USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1085 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 88 SER OG : rot 178:sc= 0.544 USER MOD Set 1.2: A 89 HIS : no HE2:sc= 0.476 K(o=-4.9,f=-9.8!) USER MOD Set 1.3: A 92 LYS NZ :NH3+ -135:sc= -3.75! (180deg=-3.71!) USER MOD Set 1.4: A 142 CYS SG : rot 116:sc= -2.65! USER MOD Set 1.5: A 187 SER OG : rot 23:sc= 0.459! USER MOD Single : A 61 GLN :FLIP amide:sc=-0.00848 F(o=-1.2,f=-0.0085) USER MOD Single : A 71 THR OG1 : rot 180:sc= -0.19 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 MET CE :methyl 174:sc= 0 (180deg=-0.00356) USER MOD Single : A 80 THR OG1 : rot -170:sc= -1.5! USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -149:sc= -0.161 (180deg=-1) USER MOD Single : A 102 HIS : no HE2:sc= -0.607 K(o=-0.61,f=-2.2) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc=-0.00679 K(o=-0.0068,f=-0.84) USER MOD Single : A 115 TYR OH : rot 165:sc= -0.0222 USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=-0.0052) USER MOD Single : A 117 THR OG1 : rot 5:sc= -0.858 USER MOD Single : A 118 GLN : amide:sc= -24.5! C(o=-24!,f=-28!) USER MOD Single : A 120 TYR OH : rot 30:sc= 0.0288 USER MOD Single : A 125 GLN : amide:sc= -1.43 X(o=-1.4,f=-1.9!) USER MOD Single : A 126 ASN :FLIP amide:sc= -0.833 F(o=-1.5,f=-0.83) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot -170:sc= -3.17! USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot -154:sc= 1.28 USER MOD Single : A 143 TYR OH : rot 180:sc= -0.454 USER MOD Single : A 144 LYS NZ :NH3+ 168:sc= -2.16 (180deg=-3.2) USER MOD Single : A 152 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0917) USER MOD Single : A 157 ASN :FLIP amide:sc= -0.347 F(o=-2.1,f=-0.35) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 192 HIS : no HD1:sc= -2.65! C(o=-2.6!,f=-2.7!) USER MOD Single : A 193 HIS : no HD1:sc= -1.07 X(o=-1.1,f=-1.4) USER MOD Single : A 194 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 199 HIS : no HD1:sc= -2.61 K(o=-2.6,f=-3.8!) USER MOD Single : A 202 TYR OH : rot -105:sc= 1.04 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 ASN :FLIP amide:sc= -0.478 F(o=-4.4!,f=-0.48) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 56 4.923 16.589 -3.897 1.00 4.61 N ATOM 2 CA ALA A 56 6.131 15.735 -3.715 1.00 3.98 C ATOM 3 C ALA A 56 6.085 15.078 -2.334 1.00 3.15 C ATOM 4 O ALA A 56 6.907 15.347 -1.480 1.00 3.23 O ATOM 5 CB ALA A 56 7.387 16.600 -3.831 1.00 4.70 C ATOM 0 HA ALA A 56 6.152 14.962 -4.483 1.00 3.98 H new ATOM 0 HB1 ALA A 56 8.271 15.977 -3.698 1.00 4.70 H new ATOM 0 HB2 ALA A 56 7.417 17.068 -4.815 1.00 4.70 H new ATOM 0 HB3 ALA A 56 7.369 17.373 -3.063 1.00 4.70 H new ATOM 11 N TRP A 57 5.129 14.221 -2.108 1.00 2.75 N ATOM 12 CA TRP A 57 5.023 13.547 -0.782 1.00 2.31 C ATOM 13 C TRP A 57 6.131 12.497 -0.643 1.00 1.71 C ATOM 14 O TRP A 57 6.904 12.523 0.294 1.00 2.05 O ATOM 15 CB TRP A 57 3.652 12.872 -0.669 1.00 2.59 C ATOM 16 CG TRP A 57 3.599 12.014 0.558 1.00 2.15 C ATOM 17 CD1 TRP A 57 3.735 12.454 1.830 1.00 2.38 C ATOM 18 CD2 TRP A 57 3.401 10.576 0.644 1.00 1.56 C ATOM 19 NE1 TRP A 57 3.618 11.378 2.690 1.00 2.03 N ATOM 20 CE2 TRP A 57 3.413 10.198 2.007 1.00 1.45 C ATOM 21 CE3 TRP A 57 3.210 9.576 -0.320 1.00 1.38 C ATOM 22 CZ2 TRP A 57 3.241 8.872 2.398 1.00 1.05 C ATOM 23 CZ3 TRP A 57 3.039 8.238 0.068 1.00 1.05 C ATOM 24 CH2 TRP A 57 3.052 7.888 1.425 1.00 0.77 C ATOM 0 H TRP A 57 4.414 13.957 -2.786 1.00 2.75 H new ATOM 0 HA TRP A 57 5.133 14.285 0.012 1.00 2.31 H new ATOM 0 HB2 TRP A 57 2.868 13.628 -0.627 1.00 2.59 H new ATOM 0 HB3 TRP A 57 3.463 12.265 -1.555 1.00 2.59 H new ATOM 0 HD1 TRP A 57 3.907 13.479 2.125 1.00 2.38 H new ATOM 0 HE1 TRP A 57 3.676 11.448 3.706 1.00 2.03 H new ATOM 0 HE3 TRP A 57 3.194 9.837 -1.368 1.00 1.38 H new ATOM 0 HZ2 TRP A 57 3.254 8.607 3.445 1.00 1.05 H new ATOM 0 HZ3 TRP A 57 2.897 7.475 -0.683 1.00 1.05 H new ATOM 0 HH2 TRP A 57 2.916 6.858 1.718 1.00 0.77 H new ATOM 35 N LEU A 58 6.213 11.566 -1.559 1.00 1.60 N ATOM 36 CA LEU A 58 7.272 10.521 -1.454 1.00 1.99 C ATOM 37 C LEU A 58 8.608 11.107 -1.934 1.00 2.51 C ATOM 38 O LEU A 58 9.659 10.784 -1.417 1.00 3.09 O ATOM 39 CB LEU A 58 6.885 9.297 -2.321 1.00 2.55 C ATOM 40 CG LEU A 58 6.271 8.183 -1.454 1.00 2.63 C ATOM 41 CD1 LEU A 58 5.595 7.153 -2.363 1.00 2.73 C ATOM 42 CD2 LEU A 58 7.357 7.489 -0.609 1.00 3.22 C ATOM 0 H LEU A 58 5.597 11.485 -2.368 1.00 1.60 H new ATOM 0 HA LEU A 58 7.371 10.200 -0.417 1.00 1.99 H new ATOM 0 HB2 LEU A 58 6.173 9.600 -3.089 1.00 2.55 H new ATOM 0 HB3 LEU A 58 7.767 8.918 -2.837 1.00 2.55 H new ATOM 0 HG LEU A 58 5.538 8.625 -0.780 1.00 2.63 H new ATOM 0 HD11 LEU A 58 5.158 6.361 -1.754 1.00 2.73 H new ATOM 0 HD12 LEU A 58 4.811 7.639 -2.943 1.00 2.73 H new ATOM 0 HD13 LEU A 58 6.334 6.724 -3.040 1.00 2.73 H new ATOM 0 HD21 LEU A 58 6.902 6.705 -0.004 1.00 3.22 H new ATOM 0 HD22 LEU A 58 8.106 7.050 -1.268 1.00 3.22 H new ATOM 0 HD23 LEU A 58 7.833 8.221 0.044 1.00 3.22 H new ATOM 54 N GLU A 59 8.575 11.962 -2.919 1.00 2.68 N ATOM 55 CA GLU A 59 9.843 12.557 -3.426 1.00 3.25 C ATOM 56 C GLU A 59 10.357 13.589 -2.419 1.00 3.14 C ATOM 57 O GLU A 59 10.627 13.270 -1.277 1.00 3.52 O ATOM 58 CB GLU A 59 9.583 13.220 -4.782 1.00 3.87 C ATOM 59 CG GLU A 59 10.916 13.491 -5.488 1.00 4.68 C ATOM 60 CD GLU A 59 10.660 14.225 -6.805 1.00 5.43 C ATOM 61 OE1 GLU A 59 9.502 14.377 -7.160 1.00 5.81 O ATOM 62 OE2 GLU A 59 11.624 14.624 -7.436 1.00 5.92 O ATOM 0 H GLU A 59 7.727 12.273 -3.393 1.00 2.68 H new ATOM 0 HA GLU A 59 10.596 11.779 -3.550 1.00 3.25 H new ATOM 0 HB2 GLU A 59 8.958 12.575 -5.399 1.00 3.87 H new ATOM 0 HB3 GLU A 59 9.038 14.153 -4.643 1.00 3.87 H new ATOM 0 HG2 GLU A 59 11.564 14.089 -4.847 1.00 4.68 H new ATOM 0 HG3 GLU A 59 11.435 12.552 -5.679 1.00 4.68 H new ATOM 69 N ALA A 60 10.505 14.817 -2.827 1.00 3.25 N ATOM 70 CA ALA A 60 11.010 15.857 -1.888 1.00 3.79 C ATOM 71 C ALA A 60 9.952 16.149 -0.822 1.00 3.93 C ATOM 72 O ALA A 60 8.917 16.721 -1.101 1.00 4.34 O ATOM 73 CB ALA A 60 11.314 17.139 -2.667 1.00 4.57 C ATOM 0 H ALA A 60 10.298 15.146 -3.770 1.00 3.25 H new ATOM 0 HA ALA A 60 11.918 15.497 -1.405 1.00 3.79 H new ATOM 0 HB1 ALA A 60 11.684 17.902 -1.982 1.00 4.57 H new ATOM 0 HB2 ALA A 60 12.071 16.934 -3.424 1.00 4.57 H new ATOM 0 HB3 ALA A 60 10.404 17.495 -3.150 1.00 4.57 H new ATOM 79 N GLN A 61 10.208 15.766 0.400 1.00 4.11 N ATOM 80 CA GLN A 61 9.222 16.028 1.485 1.00 4.74 C ATOM 81 C GLN A 61 9.209 17.528 1.789 1.00 4.98 C ATOM 82 O GLN A 61 8.390 18.266 1.278 1.00 5.45 O ATOM 83 CB GLN A 61 9.623 15.245 2.741 1.00 5.31 C ATOM 84 CG GLN A 61 9.224 13.775 2.577 1.00 5.77 C ATOM 85 CD GLN A 61 9.663 12.984 3.811 1.00 6.31 C ATOM 86 OE1 GLN A 61 10.636 13.438 4.553 1.00 6.59 O flip ATOM 87 NE2 GLN A 61 9.113 11.941 4.104 1.00 6.81 N flip ATOM 0 H GLN A 61 11.057 15.283 0.693 1.00 4.11 H new ATOM 0 HA GLN A 61 8.228 15.709 1.171 1.00 4.74 H new ATOM 0 HB2 GLN A 61 10.698 15.325 2.904 1.00 5.31 H new ATOM 0 HB3 GLN A 61 9.135 15.670 3.618 1.00 5.31 H new ATOM 0 HG2 GLN A 61 8.145 13.693 2.445 1.00 5.77 H new ATOM 0 HG3 GLN A 61 9.687 13.359 1.682 1.00 5.77 H new ATOM 0 HE21 GLN A 61 8.352 11.585 3.525 1.00 6.81 H new ATOM 0 HE22 GLN A 61 9.412 11.421 4.929 1.00 6.81 H new ATOM 96 N GLU A 62 10.119 17.988 2.607 1.00 5.00 N ATOM 97 CA GLU A 62 10.165 19.445 2.928 1.00 5.58 C ATOM 98 C GLU A 62 11.019 20.156 1.876 1.00 5.55 C ATOM 99 O GLU A 62 10.837 19.965 0.689 1.00 5.67 O ATOM 100 CB GLU A 62 10.784 19.643 4.315 1.00 6.14 C ATOM 101 CG GLU A 62 9.896 18.973 5.367 1.00 6.74 C ATOM 102 CD GLU A 62 10.397 19.333 6.767 1.00 7.42 C ATOM 103 OE1 GLU A 62 11.588 19.544 6.914 1.00 7.69 O ATOM 104 OE2 GLU A 62 9.576 19.390 7.669 1.00 7.91 O ATOM 0 H GLU A 62 10.831 17.419 3.066 1.00 5.00 H new ATOM 0 HA GLU A 62 9.157 19.859 2.925 1.00 5.58 H new ATOM 0 HB2 GLU A 62 11.786 19.215 4.343 1.00 6.14 H new ATOM 0 HB3 GLU A 62 10.885 20.706 4.532 1.00 6.14 H new ATOM 0 HG2 GLU A 62 8.863 19.298 5.245 1.00 6.74 H new ATOM 0 HG3 GLU A 62 9.908 17.891 5.232 1.00 6.74 H new ATOM 111 N GLU A 63 11.951 20.973 2.292 1.00 5.72 N ATOM 112 CA GLU A 63 12.814 21.689 1.303 1.00 6.01 C ATOM 113 C GLU A 63 14.050 20.835 0.997 1.00 5.97 C ATOM 114 O GLU A 63 14.801 21.120 0.084 1.00 6.17 O ATOM 115 CB GLU A 63 13.250 23.038 1.890 1.00 6.54 C ATOM 116 CG GLU A 63 13.713 23.972 0.763 1.00 6.72 C ATOM 117 CD GLU A 63 12.494 24.545 0.035 1.00 7.22 C ATOM 118 OE1 GLU A 63 11.547 24.913 0.709 1.00 7.67 O ATOM 119 OE2 GLU A 63 12.532 24.607 -1.183 1.00 7.44 O ATOM 0 H GLU A 63 12.153 21.176 3.271 1.00 5.72 H new ATOM 0 HA GLU A 63 12.255 21.860 0.383 1.00 6.01 H new ATOM 0 HB2 GLU A 63 12.422 23.493 2.434 1.00 6.54 H new ATOM 0 HB3 GLU A 63 14.058 22.889 2.606 1.00 6.54 H new ATOM 0 HG2 GLU A 63 14.317 24.781 1.173 1.00 6.72 H new ATOM 0 HG3 GLU A 63 14.344 23.427 0.062 1.00 6.72 H new ATOM 126 N GLU A 64 14.269 19.792 1.753 1.00 6.07 N ATOM 127 CA GLU A 64 15.459 18.928 1.500 1.00 6.34 C ATOM 128 C GLU A 64 15.352 18.307 0.105 1.00 6.12 C ATOM 129 O GLU A 64 15.025 17.146 -0.046 1.00 6.31 O ATOM 130 CB GLU A 64 15.519 17.815 2.550 1.00 6.85 C ATOM 131 CG GLU A 64 16.899 17.152 2.512 1.00 7.36 C ATOM 132 CD GLU A 64 16.864 15.842 3.301 1.00 8.01 C ATOM 133 OE1 GLU A 64 16.673 15.903 4.505 1.00 8.36 O ATOM 134 OE2 GLU A 64 17.032 14.799 2.689 1.00 8.39 O ATOM 0 H GLU A 64 13.678 19.502 2.532 1.00 6.07 H new ATOM 0 HA GLU A 64 16.364 19.533 1.561 1.00 6.34 H new ATOM 0 HB2 GLU A 64 15.328 18.225 3.542 1.00 6.85 H new ATOM 0 HB3 GLU A 64 14.743 17.075 2.356 1.00 6.85 H new ATOM 0 HG2 GLU A 64 17.192 16.958 1.480 1.00 7.36 H new ATOM 0 HG3 GLU A 64 17.647 17.823 2.935 1.00 7.36 H new ATOM 141 N GLU A 65 15.627 19.072 -0.916 1.00 6.04 N ATOM 142 CA GLU A 65 15.543 18.528 -2.300 1.00 6.09 C ATOM 143 C GLU A 65 16.372 17.244 -2.388 1.00 5.38 C ATOM 144 O GLU A 65 17.484 17.174 -1.900 1.00 5.46 O ATOM 145 CB GLU A 65 16.085 19.570 -3.285 1.00 6.80 C ATOM 146 CG GLU A 65 15.812 19.126 -4.728 1.00 7.45 C ATOM 147 CD GLU A 65 16.830 18.061 -5.141 1.00 7.99 C ATOM 148 OE1 GLU A 65 18.014 18.318 -4.997 1.00 8.13 O ATOM 149 OE2 GLU A 65 16.409 17.010 -5.594 1.00 8.49 O ATOM 0 H GLU A 65 15.906 20.051 -0.851 1.00 6.04 H new ATOM 0 HA GLU A 65 14.506 18.303 -2.550 1.00 6.09 H new ATOM 0 HB2 GLU A 65 15.616 20.536 -3.099 1.00 6.80 H new ATOM 0 HB3 GLU A 65 17.156 19.702 -3.134 1.00 6.80 H new ATOM 0 HG2 GLU A 65 14.801 18.728 -4.811 1.00 7.45 H new ATOM 0 HG3 GLU A 65 15.874 19.982 -5.400 1.00 7.45 H new ATOM 156 N VAL A 66 15.837 16.222 -2.999 1.00 4.95 N ATOM 157 CA VAL A 66 16.589 14.940 -3.111 1.00 4.48 C ATOM 158 C VAL A 66 17.602 15.040 -4.254 1.00 4.72 C ATOM 159 O VAL A 66 17.597 14.249 -5.174 1.00 5.03 O ATOM 160 CB VAL A 66 15.604 13.801 -3.395 1.00 4.18 C ATOM 161 CG1 VAL A 66 16.242 12.456 -3.036 1.00 3.90 C ATOM 162 CG2 VAL A 66 14.341 14.004 -2.555 1.00 4.35 C ATOM 0 H VAL A 66 14.911 16.220 -3.426 1.00 4.95 H new ATOM 0 HA VAL A 66 17.117 14.742 -2.178 1.00 4.48 H new ATOM 0 HB VAL A 66 15.348 13.804 -4.454 1.00 4.18 H new ATOM 0 HG11 VAL A 66 15.535 11.652 -3.241 1.00 3.90 H new ATOM 0 HG12 VAL A 66 17.142 12.309 -3.633 1.00 3.90 H new ATOM 0 HG13 VAL A 66 16.504 12.448 -1.978 1.00 3.90 H new ATOM 0 HG21 VAL A 66 13.638 13.196 -2.754 1.00 4.35 H new ATOM 0 HG22 VAL A 66 14.604 14.004 -1.497 1.00 4.35 H new ATOM 0 HG23 VAL A 66 13.881 14.957 -2.814 1.00 4.35 H new ATOM 172 N GLY A 67 18.468 16.011 -4.200 1.00 4.94 N ATOM 173 CA GLY A 67 19.483 16.173 -5.279 1.00 5.45 C ATOM 174 C GLY A 67 20.451 14.989 -5.263 1.00 5.43 C ATOM 175 O GLY A 67 21.429 14.967 -5.984 1.00 5.79 O ATOM 0 H GLY A 67 18.518 16.703 -3.452 1.00 4.94 H new ATOM 0 HA2 GLY A 67 18.989 16.237 -6.249 1.00 5.45 H new ATOM 0 HA3 GLY A 67 20.031 17.104 -5.138 1.00 5.45 H new ATOM 179 N PHE A 68 20.190 14.002 -4.447 1.00 5.26 N ATOM 180 CA PHE A 68 21.100 12.821 -4.386 1.00 5.45 C ATOM 181 C PHE A 68 20.297 11.583 -3.987 1.00 4.79 C ATOM 182 O PHE A 68 20.415 11.082 -2.886 1.00 4.49 O ATOM 183 CB PHE A 68 22.194 13.082 -3.354 1.00 6.13 C ATOM 184 CG PHE A 68 22.689 14.495 -3.520 1.00 6.37 C ATOM 185 CD1 PHE A 68 23.678 14.783 -4.465 1.00 6.71 C ATOM 186 CD2 PHE A 68 22.156 15.517 -2.729 1.00 6.59 C ATOM 187 CE1 PHE A 68 24.137 16.096 -4.621 1.00 7.20 C ATOM 188 CE2 PHE A 68 22.615 16.831 -2.881 1.00 7.13 C ATOM 189 CZ PHE A 68 23.606 17.121 -3.828 1.00 7.40 C ATOM 0 H PHE A 68 19.386 13.963 -3.820 1.00 5.26 H new ATOM 0 HA PHE A 68 21.556 12.655 -5.362 1.00 5.45 H new ATOM 0 HB2 PHE A 68 21.806 12.934 -2.346 1.00 6.13 H new ATOM 0 HB3 PHE A 68 23.014 12.376 -3.486 1.00 6.13 H new ATOM 0 HD1 PHE A 68 24.088 13.992 -5.075 1.00 6.71 H new ATOM 0 HD2 PHE A 68 21.390 15.293 -2.001 1.00 6.59 H new ATOM 0 HE1 PHE A 68 24.900 16.319 -5.352 1.00 7.20 H new ATOM 0 HE2 PHE A 68 22.205 17.621 -2.269 1.00 7.13 H new ATOM 0 HZ PHE A 68 23.960 18.134 -3.946 1.00 7.40 H new ATOM 199 N PRO A 69 19.485 11.096 -4.886 1.00 4.86 N ATOM 200 CA PRO A 69 18.636 9.900 -4.652 1.00 4.45 C ATOM 201 C PRO A 69 19.385 8.596 -4.953 1.00 4.09 C ATOM 202 O PRO A 69 20.581 8.592 -5.172 1.00 4.61 O ATOM 203 CB PRO A 69 17.484 10.110 -5.637 1.00 5.21 C ATOM 204 CG PRO A 69 18.103 10.830 -6.801 1.00 5.88 C ATOM 205 CD PRO A 69 19.286 11.643 -6.240 1.00 5.67 C ATOM 0 HA PRO A 69 18.316 9.804 -3.614 1.00 4.45 H new ATOM 0 HB2 PRO A 69 17.049 9.159 -5.946 1.00 5.21 H new ATOM 0 HB3 PRO A 69 16.682 10.697 -5.189 1.00 5.21 H new ATOM 0 HG2 PRO A 69 18.444 10.123 -7.557 1.00 5.88 H new ATOM 0 HG3 PRO A 69 17.376 11.485 -7.282 1.00 5.88 H new ATOM 0 HD2 PRO A 69 20.179 11.524 -6.854 1.00 5.67 H new ATOM 0 HD3 PRO A 69 19.059 12.709 -6.211 1.00 5.67 H new ATOM 213 N VAL A 70 18.692 7.492 -4.971 1.00 3.53 N ATOM 214 CA VAL A 70 19.361 6.192 -5.263 1.00 3.48 C ATOM 215 C VAL A 70 19.493 6.027 -6.778 1.00 3.20 C ATOM 216 O VAL A 70 18.903 6.764 -7.543 1.00 3.15 O ATOM 217 CB VAL A 70 18.521 5.045 -4.693 1.00 3.52 C ATOM 218 CG1 VAL A 70 19.268 3.717 -4.868 1.00 4.19 C ATOM 219 CG2 VAL A 70 18.266 5.293 -3.202 1.00 3.47 C ATOM 0 H VAL A 70 17.689 7.433 -4.796 1.00 3.53 H new ATOM 0 HA VAL A 70 20.350 6.175 -4.804 1.00 3.48 H new ATOM 0 HB VAL A 70 17.571 4.996 -5.225 1.00 3.52 H new ATOM 0 HG11 VAL A 70 18.666 2.905 -4.461 1.00 4.19 H new ATOM 0 HG12 VAL A 70 19.449 3.538 -5.928 1.00 4.19 H new ATOM 0 HG13 VAL A 70 20.220 3.763 -4.340 1.00 4.19 H new ATOM 0 HG21 VAL A 70 17.668 4.478 -2.795 1.00 3.47 H new ATOM 0 HG22 VAL A 70 19.218 5.344 -2.674 1.00 3.47 H new ATOM 0 HG23 VAL A 70 17.730 6.234 -3.076 1.00 3.47 H new ATOM 229 N THR A 71 20.260 5.067 -7.221 1.00 3.33 N ATOM 230 CA THR A 71 20.422 4.864 -8.690 1.00 3.19 C ATOM 231 C THR A 71 19.253 4.006 -9.204 1.00 2.33 C ATOM 232 O THR A 71 18.682 3.245 -8.450 1.00 2.20 O ATOM 233 CB THR A 71 21.743 4.132 -8.956 1.00 3.92 C ATOM 234 OG1 THR A 71 21.636 2.790 -8.502 1.00 4.10 O ATOM 235 CG2 THR A 71 22.883 4.834 -8.215 1.00 4.65 C ATOM 0 H THR A 71 20.780 4.417 -6.632 1.00 3.33 H new ATOM 0 HA THR A 71 20.430 5.827 -9.201 1.00 3.19 H new ATOM 0 HB THR A 71 21.953 4.141 -10.026 1.00 3.92 H new ATOM 0 HG1 THR A 71 22.478 2.319 -8.672 1.00 4.10 H new ATOM 0 HG21 THR A 71 23.819 4.310 -8.407 1.00 4.65 H new ATOM 0 HG22 THR A 71 22.965 5.863 -8.565 1.00 4.65 H new ATOM 0 HG23 THR A 71 22.678 4.830 -7.144 1.00 4.65 H new ATOM 243 N PRO A 72 18.891 4.118 -10.470 1.00 2.04 N ATOM 244 CA PRO A 72 17.772 3.310 -11.057 1.00 1.36 C ATOM 245 C PRO A 72 17.884 1.808 -10.745 1.00 1.25 C ATOM 246 O PRO A 72 18.550 1.400 -9.819 1.00 1.81 O ATOM 247 CB PRO A 72 17.900 3.548 -12.569 1.00 1.84 C ATOM 248 CG PRO A 72 18.569 4.877 -12.701 1.00 2.59 C ATOM 249 CD PRO A 72 19.487 5.024 -11.480 1.00 2.69 C ATOM 0 HA PRO A 72 16.811 3.611 -10.641 1.00 1.36 H new ATOM 0 HB2 PRO A 72 18.488 2.762 -13.043 1.00 1.84 H new ATOM 0 HB3 PRO A 72 16.923 3.549 -13.052 1.00 1.84 H new ATOM 0 HG2 PRO A 72 19.142 4.933 -13.627 1.00 2.59 H new ATOM 0 HG3 PRO A 72 17.833 5.681 -12.733 1.00 2.59 H new ATOM 0 HD2 PRO A 72 20.512 4.739 -11.715 1.00 2.69 H new ATOM 0 HD3 PRO A 72 19.516 6.054 -11.124 1.00 2.69 H new ATOM 257 N GLN A 73 17.212 0.996 -11.523 1.00 1.10 N ATOM 258 CA GLN A 73 17.222 -0.485 -11.321 1.00 1.44 C ATOM 259 C GLN A 73 18.552 -0.976 -10.748 1.00 1.16 C ATOM 260 O GLN A 73 19.504 -1.229 -11.460 1.00 1.32 O ATOM 261 CB GLN A 73 16.982 -1.174 -12.665 1.00 2.13 C ATOM 262 CG GLN A 73 15.582 -0.833 -13.176 1.00 2.59 C ATOM 263 CD GLN A 73 15.469 -1.232 -14.649 1.00 3.31 C ATOM 264 OE1 GLN A 73 15.476 -2.402 -14.976 1.00 3.76 O ATOM 265 NE2 GLN A 73 15.364 -0.302 -15.558 1.00 3.98 N ATOM 0 H GLN A 73 16.642 1.307 -12.310 1.00 1.10 H new ATOM 0 HA GLN A 73 16.435 -0.729 -10.608 1.00 1.44 H new ATOM 0 HB2 GLN A 73 17.732 -0.853 -13.388 1.00 2.13 H new ATOM 0 HB3 GLN A 73 17.087 -2.253 -12.555 1.00 2.13 H new ATOM 0 HG2 GLN A 73 14.830 -1.357 -12.587 1.00 2.59 H new ATOM 0 HG3 GLN A 73 15.390 0.234 -13.061 1.00 2.59 H new ATOM 0 HE21 GLN A 73 15.358 0.681 -15.284 1.00 3.98 H new ATOM 0 HE22 GLN A 73 15.288 -0.557 -16.543 1.00 3.98 H new ATOM 274 N VAL A 74 18.595 -1.150 -9.459 1.00 1.04 N ATOM 275 CA VAL A 74 19.823 -1.674 -8.791 1.00 0.93 C ATOM 276 C VAL A 74 19.690 -3.210 -8.767 1.00 0.86 C ATOM 277 O VAL A 74 18.607 -3.719 -8.973 1.00 0.89 O ATOM 278 CB VAL A 74 19.899 -1.083 -7.361 1.00 1.09 C ATOM 279 CG1 VAL A 74 19.465 0.384 -7.394 1.00 1.17 C ATOM 280 CG2 VAL A 74 18.977 -1.865 -6.408 1.00 1.38 C ATOM 0 H VAL A 74 17.820 -0.949 -8.827 1.00 1.04 H new ATOM 0 HA VAL A 74 20.738 -1.394 -9.314 1.00 0.93 H new ATOM 0 HB VAL A 74 20.925 -1.159 -7.002 1.00 1.09 H new ATOM 0 HG11 VAL A 74 19.518 0.802 -6.389 1.00 1.17 H new ATOM 0 HG12 VAL A 74 20.126 0.944 -8.055 1.00 1.17 H new ATOM 0 HG13 VAL A 74 18.441 0.452 -7.762 1.00 1.17 H new ATOM 0 HG21 VAL A 74 19.042 -1.438 -5.407 1.00 1.38 H new ATOM 0 HG22 VAL A 74 17.949 -1.802 -6.764 1.00 1.38 H new ATOM 0 HG23 VAL A 74 19.287 -2.909 -6.377 1.00 1.38 H new ATOM 290 N PRO A 75 20.748 -3.956 -8.537 1.00 0.93 N ATOM 291 CA PRO A 75 20.663 -5.447 -8.520 1.00 1.00 C ATOM 292 C PRO A 75 19.370 -5.942 -7.864 1.00 0.88 C ATOM 293 O PRO A 75 19.094 -5.661 -6.715 1.00 0.84 O ATOM 294 CB PRO A 75 21.896 -5.847 -7.720 1.00 1.18 C ATOM 295 CG PRO A 75 22.910 -4.810 -8.082 1.00 1.37 C ATOM 296 CD PRO A 75 22.127 -3.499 -8.267 1.00 1.13 C ATOM 0 HA PRO A 75 20.639 -5.884 -9.518 1.00 1.00 H new ATOM 0 HB2 PRO A 75 21.694 -5.851 -6.649 1.00 1.18 H new ATOM 0 HB3 PRO A 75 22.236 -6.848 -7.984 1.00 1.18 H new ATOM 0 HG2 PRO A 75 23.661 -4.709 -7.299 1.00 1.37 H new ATOM 0 HG3 PRO A 75 23.437 -5.082 -8.996 1.00 1.37 H new ATOM 0 HD2 PRO A 75 22.175 -2.873 -7.376 1.00 1.13 H new ATOM 0 HD3 PRO A 75 22.523 -2.908 -9.093 1.00 1.13 H new ATOM 304 N LEU A 76 18.565 -6.657 -8.604 1.00 0.86 N ATOM 305 CA LEU A 76 17.271 -7.151 -8.047 1.00 0.77 C ATOM 306 C LEU A 76 17.526 -8.089 -6.866 1.00 0.77 C ATOM 307 O LEU A 76 17.781 -9.265 -7.037 1.00 0.85 O ATOM 308 CB LEU A 76 16.499 -7.912 -9.135 1.00 0.84 C ATOM 309 CG LEU A 76 16.153 -6.975 -10.304 1.00 0.87 C ATOM 310 CD1 LEU A 76 15.646 -7.810 -11.487 1.00 1.01 C ATOM 311 CD2 LEU A 76 15.062 -5.973 -9.886 1.00 0.76 C ATOM 0 H LEU A 76 18.748 -6.921 -9.572 1.00 0.86 H new ATOM 0 HA LEU A 76 16.687 -6.296 -7.707 1.00 0.77 H new ATOM 0 HB2 LEU A 76 17.097 -8.748 -9.496 1.00 0.84 H new ATOM 0 HB3 LEU A 76 15.585 -8.332 -8.715 1.00 0.84 H new ATOM 0 HG LEU A 76 17.048 -6.423 -10.591 1.00 0.87 H new ATOM 0 HD11 LEU A 76 15.399 -7.150 -12.319 1.00 1.01 H new ATOM 0 HD12 LEU A 76 16.422 -8.510 -11.797 1.00 1.01 H new ATOM 0 HD13 LEU A 76 14.756 -8.364 -11.187 1.00 1.01 H new ATOM 0 HD21 LEU A 76 14.829 -5.317 -10.725 1.00 0.76 H new ATOM 0 HD22 LEU A 76 14.164 -6.515 -9.589 1.00 0.76 H new ATOM 0 HD23 LEU A 76 15.419 -5.376 -9.047 1.00 0.76 H new ATOM 323 N ARG A 77 17.433 -7.580 -5.666 1.00 0.74 N ATOM 324 CA ARG A 77 17.642 -8.441 -4.466 1.00 0.79 C ATOM 325 C ARG A 77 16.315 -9.151 -4.143 1.00 0.71 C ATOM 326 O ARG A 77 15.255 -8.639 -4.446 1.00 0.73 O ATOM 327 CB ARG A 77 18.078 -7.559 -3.285 1.00 0.85 C ATOM 328 CG ARG A 77 18.980 -6.434 -3.799 1.00 1.19 C ATOM 329 CD ARG A 77 19.719 -5.783 -2.627 1.00 1.52 C ATOM 330 NE ARG A 77 18.728 -5.249 -1.648 1.00 2.13 N ATOM 331 CZ ARG A 77 19.118 -4.886 -0.456 1.00 2.66 C ATOM 332 NH1 ARG A 77 20.377 -4.971 -0.125 1.00 2.73 N ATOM 333 NH2 ARG A 77 18.247 -4.436 0.405 1.00 3.61 N ATOM 0 H ARG A 77 17.221 -6.603 -5.465 1.00 0.74 H new ATOM 0 HA ARG A 77 18.417 -9.185 -4.653 1.00 0.79 H new ATOM 0 HB2 ARG A 77 17.204 -7.140 -2.787 1.00 0.85 H new ATOM 0 HB3 ARG A 77 18.610 -8.158 -2.546 1.00 0.85 H new ATOM 0 HG2 ARG A 77 19.697 -6.831 -4.517 1.00 1.19 H new ATOM 0 HG3 ARG A 77 18.383 -5.688 -4.323 1.00 1.19 H new ATOM 0 HD2 ARG A 77 20.368 -6.512 -2.142 1.00 1.52 H new ATOM 0 HD3 ARG A 77 20.359 -4.978 -2.989 1.00 1.52 H new ATOM 0 HE ARG A 77 17.746 -5.167 -1.910 1.00 2.13 H new ATOM 0 HH11 ARG A 77 21.059 -5.322 -0.798 1.00 2.73 H new ATOM 0 HH12 ARG A 77 20.680 -4.687 0.807 1.00 2.73 H new ATOM 0 HH21 ARG A 77 17.263 -4.368 0.147 1.00 3.61 H new ATOM 0 HH22 ARG A 77 18.550 -4.152 1.337 1.00 3.61 H new ATOM 347 N PRO A 78 16.356 -10.314 -3.540 1.00 0.79 N ATOM 348 CA PRO A 78 15.114 -11.071 -3.193 1.00 0.76 C ATOM 349 C PRO A 78 14.348 -10.426 -2.028 1.00 0.67 C ATOM 350 O PRO A 78 14.866 -10.272 -0.939 1.00 0.69 O ATOM 351 CB PRO A 78 15.638 -12.464 -2.809 1.00 0.86 C ATOM 352 CG PRO A 78 17.029 -12.224 -2.315 1.00 1.18 C ATOM 353 CD PRO A 78 17.571 -11.041 -3.123 1.00 1.06 C ATOM 0 HA PRO A 78 14.400 -11.092 -4.016 1.00 0.76 H new ATOM 0 HB2 PRO A 78 15.018 -12.922 -2.038 1.00 0.86 H new ATOM 0 HB3 PRO A 78 15.633 -13.139 -3.665 1.00 0.86 H new ATOM 0 HG2 PRO A 78 17.030 -12.000 -1.248 1.00 1.18 H new ATOM 0 HG3 PRO A 78 17.650 -13.109 -2.456 1.00 1.18 H new ATOM 0 HD2 PRO A 78 18.227 -10.412 -2.521 1.00 1.06 H new ATOM 0 HD3 PRO A 78 18.152 -11.376 -3.982 1.00 1.06 H new ATOM 361 N MET A 79 13.115 -10.051 -2.252 1.00 0.65 N ATOM 362 CA MET A 79 12.311 -9.421 -1.164 1.00 0.61 C ATOM 363 C MET A 79 12.055 -10.454 -0.063 1.00 0.51 C ATOM 364 O MET A 79 11.463 -11.489 -0.296 1.00 0.56 O ATOM 365 CB MET A 79 10.978 -8.924 -1.739 1.00 0.66 C ATOM 366 CG MET A 79 10.180 -8.221 -0.643 1.00 0.74 C ATOM 367 SD MET A 79 8.761 -7.364 -1.382 1.00 1.25 S ATOM 368 CE MET A 79 9.349 -5.664 -1.164 1.00 0.83 C ATOM 0 H MET A 79 12.630 -10.154 -3.143 1.00 0.65 H new ATOM 0 HA MET A 79 12.855 -8.575 -0.743 1.00 0.61 H new ATOM 0 HB2 MET A 79 11.160 -8.239 -2.567 1.00 0.66 H new ATOM 0 HB3 MET A 79 10.407 -9.762 -2.138 1.00 0.66 H new ATOM 0 HG2 MET A 79 9.836 -8.947 0.094 1.00 0.74 H new ATOM 0 HG3 MET A 79 10.815 -7.508 -0.116 1.00 0.74 H new ATOM 0 HE1 MET A 79 8.661 -4.975 -1.654 1.00 0.83 H new ATOM 0 HE2 MET A 79 9.400 -5.430 -0.101 1.00 0.83 H new ATOM 0 HE3 MET A 79 10.340 -5.562 -1.606 1.00 0.83 H new ATOM 378 N THR A 80 12.517 -10.190 1.135 1.00 0.56 N ATOM 379 CA THR A 80 12.322 -11.167 2.252 1.00 0.60 C ATOM 380 C THR A 80 11.012 -10.908 2.977 1.00 0.56 C ATOM 381 O THR A 80 10.571 -9.787 3.105 1.00 0.50 O ATOM 382 CB THR A 80 13.479 -11.044 3.250 1.00 0.77 C ATOM 383 OG1 THR A 80 13.245 -9.946 4.118 1.00 0.94 O ATOM 384 CG2 THR A 80 14.789 -10.825 2.491 1.00 0.73 C ATOM 0 H THR A 80 13.021 -9.340 1.388 1.00 0.56 H new ATOM 0 HA THR A 80 12.297 -12.171 1.828 1.00 0.60 H new ATOM 0 HB THR A 80 13.548 -11.960 3.836 1.00 0.77 H new ATOM 0 HG1 THR A 80 14.050 -9.771 4.648 1.00 0.94 H new ATOM 0 HG21 THR A 80 15.611 -10.738 3.202 1.00 0.73 H new ATOM 0 HG22 THR A 80 14.971 -11.671 1.828 1.00 0.73 H new ATOM 0 HG23 THR A 80 14.720 -9.910 1.902 1.00 0.73 H new ATOM 392 N TYR A 81 10.397 -11.943 3.496 1.00 0.61 N ATOM 393 CA TYR A 81 9.137 -11.742 4.263 1.00 0.60 C ATOM 394 C TYR A 81 9.466 -10.676 5.305 1.00 0.51 C ATOM 395 O TYR A 81 8.724 -9.741 5.531 1.00 0.45 O ATOM 396 CB TYR A 81 8.726 -13.083 4.920 1.00 0.69 C ATOM 397 CG TYR A 81 8.154 -12.872 6.308 1.00 0.60 C ATOM 398 CD1 TYR A 81 6.805 -12.542 6.473 1.00 0.59 C ATOM 399 CD2 TYR A 81 8.982 -13.011 7.430 1.00 0.71 C ATOM 400 CE1 TYR A 81 6.283 -12.350 7.758 1.00 0.66 C ATOM 401 CE2 TYR A 81 8.460 -12.820 8.714 1.00 0.77 C ATOM 402 CZ TYR A 81 7.111 -12.489 8.879 1.00 0.73 C ATOM 403 OH TYR A 81 6.596 -12.303 10.145 1.00 0.90 O ATOM 0 H TYR A 81 10.713 -12.910 3.420 1.00 0.61 H new ATOM 0 HA TYR A 81 8.300 -11.424 3.641 1.00 0.60 H new ATOM 0 HB2 TYR A 81 7.988 -13.584 4.294 1.00 0.69 H new ATOM 0 HB3 TYR A 81 9.593 -13.741 4.979 1.00 0.69 H new ATOM 0 HD1 TYR A 81 6.166 -12.435 5.609 1.00 0.59 H new ATOM 0 HD2 TYR A 81 10.024 -13.266 7.303 1.00 0.71 H new ATOM 0 HE1 TYR A 81 5.241 -12.095 7.885 1.00 0.66 H new ATOM 0 HE2 TYR A 81 9.099 -12.928 9.578 1.00 0.77 H new ATOM 0 HH TYR A 81 7.304 -12.438 10.809 1.00 0.90 H new ATOM 413 N LYS A 82 10.621 -10.805 5.894 1.00 0.52 N ATOM 414 CA LYS A 82 11.078 -9.801 6.876 1.00 0.48 C ATOM 415 C LYS A 82 11.187 -8.457 6.160 1.00 0.40 C ATOM 416 O LYS A 82 11.003 -7.411 6.752 1.00 0.38 O ATOM 417 CB LYS A 82 12.452 -10.207 7.411 1.00 0.55 C ATOM 418 CG LYS A 82 12.881 -9.237 8.513 1.00 0.60 C ATOM 419 CD LYS A 82 14.085 -9.815 9.262 1.00 0.92 C ATOM 420 CE LYS A 82 15.204 -10.149 8.270 1.00 1.49 C ATOM 421 NZ LYS A 82 16.495 -10.274 9.002 1.00 2.32 N ATOM 0 H LYS A 82 11.271 -11.574 5.731 1.00 0.52 H new ATOM 0 HA LYS A 82 10.377 -9.732 7.708 1.00 0.48 H new ATOM 0 HB2 LYS A 82 12.415 -11.224 7.802 1.00 0.55 H new ATOM 0 HB3 LYS A 82 13.184 -10.202 6.603 1.00 0.55 H new ATOM 0 HG2 LYS A 82 13.138 -8.270 8.081 1.00 0.60 H new ATOM 0 HG3 LYS A 82 12.056 -9.068 9.205 1.00 0.60 H new ATOM 0 HD2 LYS A 82 14.444 -9.098 10.000 1.00 0.92 H new ATOM 0 HD3 LYS A 82 13.790 -10.712 9.806 1.00 0.92 H new ATOM 0 HE2 LYS A 82 14.977 -11.079 7.749 1.00 1.49 H new ATOM 0 HE3 LYS A 82 15.277 -9.369 7.512 1.00 1.49 H new ATOM 0 HZ1 LYS A 82 17.255 -10.501 8.329 1.00 2.32 H new ATOM 0 HZ2 LYS A 82 16.712 -9.376 9.479 1.00 2.32 H new ATOM 0 HZ3 LYS A 82 16.421 -11.033 9.709 1.00 2.32 H new ATOM 435 N ALA A 83 11.492 -8.471 4.880 1.00 0.42 N ATOM 436 CA ALA A 83 11.613 -7.173 4.149 1.00 0.41 C ATOM 437 C ALA A 83 10.255 -6.463 4.126 1.00 0.35 C ATOM 438 O ALA A 83 10.174 -5.259 4.262 1.00 0.34 O ATOM 439 CB ALA A 83 12.079 -7.416 2.711 1.00 0.52 C ATOM 0 H ALA A 83 11.659 -9.309 4.323 1.00 0.42 H new ATOM 0 HA ALA A 83 12.345 -6.550 4.663 1.00 0.41 H new ATOM 0 HB1 ALA A 83 12.163 -6.462 2.190 1.00 0.52 H new ATOM 0 HB2 ALA A 83 13.050 -7.910 2.722 1.00 0.52 H new ATOM 0 HB3 ALA A 83 11.356 -8.048 2.196 1.00 0.52 H new ATOM 445 N ALA A 84 9.191 -7.197 3.944 1.00 0.34 N ATOM 446 CA ALA A 84 7.844 -6.557 3.901 1.00 0.31 C ATOM 447 C ALA A 84 7.541 -5.891 5.245 1.00 0.28 C ATOM 448 O ALA A 84 7.149 -4.742 5.302 1.00 0.28 O ATOM 449 CB ALA A 84 6.783 -7.618 3.606 1.00 0.34 C ATOM 0 H ALA A 84 9.195 -8.210 3.823 1.00 0.34 H new ATOM 0 HA ALA A 84 7.832 -5.801 3.116 1.00 0.31 H new ATOM 0 HB1 ALA A 84 5.799 -7.150 3.575 1.00 0.34 H new ATOM 0 HB2 ALA A 84 6.993 -8.085 2.644 1.00 0.34 H new ATOM 0 HB3 ALA A 84 6.799 -8.376 4.389 1.00 0.34 H new ATOM 455 N VAL A 85 7.713 -6.599 6.327 1.00 0.29 N ATOM 456 CA VAL A 85 7.427 -5.994 7.657 1.00 0.29 C ATOM 457 C VAL A 85 8.380 -4.823 7.891 1.00 0.29 C ATOM 458 O VAL A 85 7.987 -3.777 8.365 1.00 0.30 O ATOM 459 CB VAL A 85 7.612 -7.047 8.761 1.00 0.33 C ATOM 460 CG1 VAL A 85 6.880 -6.599 10.030 1.00 0.37 C ATOM 461 CG2 VAL A 85 7.037 -8.389 8.296 1.00 0.38 C ATOM 0 H VAL A 85 8.038 -7.566 6.348 1.00 0.29 H new ATOM 0 HA VAL A 85 6.398 -5.637 7.681 1.00 0.29 H new ATOM 0 HB VAL A 85 8.676 -7.158 8.972 1.00 0.33 H new ATOM 0 HG11 VAL A 85 7.013 -7.348 10.811 1.00 0.37 H new ATOM 0 HG12 VAL A 85 7.288 -5.646 10.368 1.00 0.37 H new ATOM 0 HG13 VAL A 85 5.818 -6.484 9.816 1.00 0.37 H new ATOM 0 HG21 VAL A 85 7.170 -9.133 9.081 1.00 0.38 H new ATOM 0 HG22 VAL A 85 5.975 -8.275 8.080 1.00 0.38 H new ATOM 0 HG23 VAL A 85 7.557 -8.715 7.395 1.00 0.38 H new ATOM 471 N ASP A 86 9.627 -4.983 7.547 1.00 0.30 N ATOM 472 CA ASP A 86 10.587 -3.865 7.738 1.00 0.32 C ATOM 473 C ASP A 86 10.137 -2.697 6.862 1.00 0.30 C ATOM 474 O ASP A 86 10.136 -1.555 7.278 1.00 0.31 O ATOM 475 CB ASP A 86 11.989 -4.313 7.317 1.00 0.36 C ATOM 476 CG ASP A 86 12.493 -5.390 8.278 1.00 0.42 C ATOM 477 OD1 ASP A 86 11.677 -5.946 8.994 1.00 1.23 O ATOM 478 OD2 ASP A 86 13.686 -5.642 8.282 1.00 1.05 O ATOM 0 H ASP A 86 10.020 -5.834 7.145 1.00 0.30 H new ATOM 0 HA ASP A 86 10.614 -3.564 8.785 1.00 0.32 H new ATOM 0 HB2 ASP A 86 11.967 -4.701 6.299 1.00 0.36 H new ATOM 0 HB3 ASP A 86 12.670 -3.462 7.319 1.00 0.36 H new ATOM 483 N LEU A 87 9.745 -2.983 5.651 1.00 0.29 N ATOM 484 CA LEU A 87 9.280 -1.904 4.738 1.00 0.30 C ATOM 485 C LEU A 87 8.063 -1.210 5.350 1.00 0.29 C ATOM 486 O LEU A 87 7.972 0.002 5.365 1.00 0.30 O ATOM 487 CB LEU A 87 8.903 -2.514 3.380 1.00 0.33 C ATOM 488 CG LEU A 87 8.414 -1.425 2.408 1.00 0.42 C ATOM 489 CD1 LEU A 87 9.553 -0.442 2.094 1.00 0.52 C ATOM 490 CD2 LEU A 87 7.939 -2.087 1.109 1.00 0.44 C ATOM 0 H LEU A 87 9.727 -3.922 5.254 1.00 0.29 H new ATOM 0 HA LEU A 87 10.077 -1.174 4.596 1.00 0.30 H new ATOM 0 HB2 LEU A 87 9.766 -3.027 2.955 1.00 0.33 H new ATOM 0 HB3 LEU A 87 8.123 -3.263 3.517 1.00 0.33 H new ATOM 0 HG LEU A 87 7.592 -0.877 2.869 1.00 0.42 H new ATOM 0 HD11 LEU A 87 9.194 0.323 1.406 1.00 0.52 H new ATOM 0 HD12 LEU A 87 9.891 0.030 3.017 1.00 0.52 H new ATOM 0 HD13 LEU A 87 10.383 -0.981 1.637 1.00 0.52 H new ATOM 0 HD21 LEU A 87 7.591 -1.321 0.416 1.00 0.44 H new ATOM 0 HD22 LEU A 87 8.765 -2.637 0.658 1.00 0.44 H new ATOM 0 HD23 LEU A 87 7.123 -2.775 1.329 1.00 0.44 H new ATOM 502 N SER A 88 7.119 -1.963 5.850 1.00 0.30 N ATOM 503 CA SER A 88 5.913 -1.325 6.446 1.00 0.34 C ATOM 504 C SER A 88 6.347 -0.267 7.462 1.00 0.33 C ATOM 505 O SER A 88 5.825 0.831 7.493 1.00 0.36 O ATOM 506 CB SER A 88 5.062 -2.387 7.143 1.00 0.40 C ATOM 507 OG SER A 88 5.606 -2.656 8.428 1.00 0.44 O ATOM 0 H SER A 88 7.131 -2.983 5.871 1.00 0.30 H new ATOM 0 HA SER A 88 5.325 -0.853 5.659 1.00 0.34 H new ATOM 0 HB2 SER A 88 4.033 -2.041 7.236 1.00 0.40 H new ATOM 0 HB3 SER A 88 5.039 -3.299 6.547 1.00 0.40 H new ATOM 0 HG SER A 88 5.045 -3.314 8.889 1.00 0.44 H new ATOM 513 N HIS A 89 7.295 -0.588 8.297 1.00 0.34 N ATOM 514 CA HIS A 89 7.760 0.396 9.314 1.00 0.36 C ATOM 515 C HIS A 89 8.638 1.460 8.656 1.00 0.36 C ATOM 516 O HIS A 89 8.609 2.615 9.034 1.00 0.41 O ATOM 517 CB HIS A 89 8.559 -0.332 10.398 1.00 0.41 C ATOM 518 CG HIS A 89 7.641 -1.225 11.185 1.00 0.52 C ATOM 519 ND1 HIS A 89 7.378 -2.533 10.807 1.00 1.43 N ATOM 520 CD2 HIS A 89 6.916 -1.014 12.332 1.00 1.01 C ATOM 521 CE1 HIS A 89 6.527 -3.053 11.711 1.00 1.27 C ATOM 522 NE2 HIS A 89 6.213 -2.169 12.661 1.00 0.82 N ATOM 0 H HIS A 89 7.769 -1.491 8.319 1.00 0.34 H new ATOM 0 HA HIS A 89 6.893 0.882 9.762 1.00 0.36 H new ATOM 0 HB2 HIS A 89 9.355 -0.922 9.943 1.00 0.41 H new ATOM 0 HB3 HIS A 89 9.036 0.391 11.060 1.00 0.41 H new ATOM 0 HD1 HIS A 89 7.760 -3.014 9.992 1.00 1.43 H new ATOM 0 HD2 HIS A 89 6.895 -0.092 12.893 1.00 1.01 H new ATOM 0 HE1 HIS A 89 6.145 -4.062 11.673 1.00 1.27 H new ATOM 530 N PHE A 90 9.422 1.094 7.680 1.00 0.34 N ATOM 531 CA PHE A 90 10.291 2.105 7.021 1.00 0.37 C ATOM 532 C PHE A 90 9.407 3.234 6.486 1.00 0.40 C ATOM 533 O PHE A 90 9.572 4.385 6.833 1.00 0.47 O ATOM 534 CB PHE A 90 11.061 1.446 5.867 1.00 0.38 C ATOM 535 CG PHE A 90 12.274 2.277 5.518 1.00 0.47 C ATOM 536 CD1 PHE A 90 13.495 2.039 6.163 1.00 0.57 C ATOM 537 CD2 PHE A 90 12.181 3.284 4.549 1.00 0.59 C ATOM 538 CE1 PHE A 90 14.620 2.807 5.840 1.00 0.69 C ATOM 539 CE2 PHE A 90 13.306 4.052 4.227 1.00 0.70 C ATOM 540 CZ PHE A 90 14.525 3.814 4.873 1.00 0.72 C ATOM 0 H PHE A 90 9.498 0.145 7.313 1.00 0.34 H new ATOM 0 HA PHE A 90 11.009 2.508 7.736 1.00 0.37 H new ATOM 0 HB2 PHE A 90 11.368 0.440 6.151 1.00 0.38 H new ATOM 0 HB3 PHE A 90 10.414 1.348 4.996 1.00 0.38 H new ATOM 0 HD1 PHE A 90 13.568 1.262 6.910 1.00 0.57 H new ATOM 0 HD2 PHE A 90 11.241 3.468 4.050 1.00 0.59 H new ATOM 0 HE1 PHE A 90 15.561 2.622 6.337 1.00 0.69 H new ATOM 0 HE2 PHE A 90 13.234 4.829 3.480 1.00 0.70 H new ATOM 0 HZ PHE A 90 15.392 4.408 4.625 1.00 0.72 H new ATOM 550 N LEU A 91 8.463 2.904 5.649 1.00 0.37 N ATOM 551 CA LEU A 91 7.556 3.947 5.094 1.00 0.42 C ATOM 552 C LEU A 91 6.787 4.626 6.231 1.00 0.47 C ATOM 553 O LEU A 91 6.409 5.775 6.132 1.00 0.57 O ATOM 554 CB LEU A 91 6.553 3.297 4.139 1.00 0.41 C ATOM 555 CG LEU A 91 7.272 2.794 2.878 1.00 0.41 C ATOM 556 CD1 LEU A 91 6.370 1.792 2.154 1.00 0.42 C ATOM 557 CD2 LEU A 91 7.591 3.968 1.935 1.00 0.54 C ATOM 0 H LEU A 91 8.280 1.954 5.325 1.00 0.37 H new ATOM 0 HA LEU A 91 8.152 4.688 4.561 1.00 0.42 H new ATOM 0 HB2 LEU A 91 6.051 2.467 4.636 1.00 0.41 H new ATOM 0 HB3 LEU A 91 5.782 4.017 3.864 1.00 0.41 H new ATOM 0 HG LEU A 91 8.207 2.315 3.169 1.00 0.41 H new ATOM 0 HD11 LEU A 91 6.874 1.431 1.258 1.00 0.42 H new ATOM 0 HD12 LEU A 91 6.157 0.951 2.814 1.00 0.42 H new ATOM 0 HD13 LEU A 91 5.436 2.279 1.874 1.00 0.42 H new ATOM 0 HD21 LEU A 91 8.100 3.593 1.047 1.00 0.54 H new ATOM 0 HD22 LEU A 91 6.664 4.461 1.641 1.00 0.54 H new ATOM 0 HD23 LEU A 91 8.235 4.682 2.448 1.00 0.54 H new ATOM 569 N LYS A 92 6.538 3.925 7.308 1.00 0.45 N ATOM 570 CA LYS A 92 5.778 4.547 8.426 1.00 0.53 C ATOM 571 C LYS A 92 6.551 5.755 8.967 1.00 0.63 C ATOM 572 O LYS A 92 6.000 6.819 9.165 1.00 0.85 O ATOM 573 CB LYS A 92 5.580 3.514 9.549 1.00 0.54 C ATOM 574 CG LYS A 92 4.400 3.935 10.462 1.00 0.73 C ATOM 575 CD LYS A 92 4.681 3.562 11.932 1.00 1.20 C ATOM 576 CE LYS A 92 5.253 2.133 12.042 1.00 1.61 C ATOM 577 NZ LYS A 92 6.738 2.203 12.148 1.00 2.27 N ATOM 0 H LYS A 92 6.826 2.958 7.458 1.00 0.45 H new ATOM 0 HA LYS A 92 4.805 4.878 8.062 1.00 0.53 H new ATOM 0 HB2 LYS A 92 5.384 2.532 9.119 1.00 0.54 H new ATOM 0 HB3 LYS A 92 6.493 3.428 10.139 1.00 0.54 H new ATOM 0 HG2 LYS A 92 4.237 5.010 10.380 1.00 0.73 H new ATOM 0 HG3 LYS A 92 3.484 3.447 10.128 1.00 0.73 H new ATOM 0 HD2 LYS A 92 5.386 4.273 12.363 1.00 1.20 H new ATOM 0 HD3 LYS A 92 3.761 3.634 12.511 1.00 1.20 H new ATOM 0 HE2 LYS A 92 4.838 1.629 12.915 1.00 1.61 H new ATOM 0 HE3 LYS A 92 4.967 1.546 11.169 1.00 1.61 H new ATOM 0 HZ1 LYS A 92 7.165 1.495 11.517 1.00 2.27 H new ATOM 0 HZ2 LYS A 92 7.061 3.152 11.872 1.00 2.27 H new ATOM 0 HZ3 LYS A 92 7.025 2.011 13.129 1.00 2.27 H new ATOM 591 N GLU A 93 7.822 5.596 9.215 1.00 0.62 N ATOM 592 CA GLU A 93 8.631 6.727 9.752 1.00 0.76 C ATOM 593 C GLU A 93 8.841 7.801 8.675 1.00 0.77 C ATOM 594 O GLU A 93 8.623 8.972 8.907 1.00 1.05 O ATOM 595 CB GLU A 93 9.994 6.198 10.222 1.00 0.94 C ATOM 596 CG GLU A 93 9.851 5.528 11.593 1.00 1.22 C ATOM 597 CD GLU A 93 8.719 4.499 11.551 1.00 2.00 C ATOM 598 OE1 GLU A 93 7.571 4.908 11.622 1.00 2.54 O ATOM 599 OE2 GLU A 93 9.018 3.321 11.450 1.00 2.73 O ATOM 0 H GLU A 93 8.337 4.728 9.068 1.00 0.62 H new ATOM 0 HA GLU A 93 8.097 7.175 10.590 1.00 0.76 H new ATOM 0 HB2 GLU A 93 10.386 5.484 9.498 1.00 0.94 H new ATOM 0 HB3 GLU A 93 10.711 7.017 10.281 1.00 0.94 H new ATOM 0 HG2 GLU A 93 10.787 5.042 11.870 1.00 1.22 H new ATOM 0 HG3 GLU A 93 9.644 6.279 12.355 1.00 1.22 H new ATOM 606 N LYS A 94 9.288 7.418 7.508 1.00 0.80 N ATOM 607 CA LYS A 94 9.537 8.427 6.438 1.00 1.02 C ATOM 608 C LYS A 94 8.216 8.842 5.769 1.00 0.96 C ATOM 609 O LYS A 94 7.697 9.912 6.017 1.00 1.41 O ATOM 610 CB LYS A 94 10.507 7.830 5.392 1.00 1.39 C ATOM 611 CG LYS A 94 11.969 8.095 5.804 1.00 1.63 C ATOM 612 CD LYS A 94 12.407 9.507 5.364 1.00 2.18 C ATOM 613 CE LYS A 94 12.932 9.473 3.923 1.00 2.61 C ATOM 614 NZ LYS A 94 14.159 8.629 3.861 1.00 2.96 N ATOM 0 H LYS A 94 9.491 6.452 7.250 1.00 0.80 H new ATOM 0 HA LYS A 94 9.985 9.317 6.880 1.00 1.02 H new ATOM 0 HB2 LYS A 94 10.337 6.757 5.299 1.00 1.39 H new ATOM 0 HB3 LYS A 94 10.313 8.269 4.414 1.00 1.39 H new ATOM 0 HG2 LYS A 94 12.072 7.996 6.885 1.00 1.63 H new ATOM 0 HG3 LYS A 94 12.622 7.348 5.352 1.00 1.63 H new ATOM 0 HD2 LYS A 94 11.565 10.196 5.436 1.00 2.18 H new ATOM 0 HD3 LYS A 94 13.183 9.880 6.033 1.00 2.18 H new ATOM 0 HE2 LYS A 94 12.168 9.073 3.256 1.00 2.61 H new ATOM 0 HE3 LYS A 94 13.155 10.484 3.582 1.00 2.61 H new ATOM 0 HZ1 LYS A 94 14.790 8.987 3.116 1.00 2.96 H new ATOM 0 HZ2 LYS A 94 14.651 8.663 4.777 1.00 2.96 H new ATOM 0 HZ3 LYS A 94 13.894 7.646 3.647 1.00 2.96 H new ATOM 628 N GLY A 95 7.681 8.016 4.909 1.00 1.12 N ATOM 629 CA GLY A 95 6.408 8.373 4.206 1.00 1.51 C ATOM 630 C GLY A 95 5.210 7.778 4.951 1.00 1.10 C ATOM 631 O GLY A 95 4.751 6.697 4.636 1.00 1.71 O ATOM 0 H GLY A 95 8.070 7.106 4.661 1.00 1.12 H new ATOM 0 HA2 GLY A 95 6.308 9.457 4.147 1.00 1.51 H new ATOM 0 HA3 GLY A 95 6.432 7.999 3.182 1.00 1.51 H new ATOM 635 N GLY A 96 4.691 8.471 5.930 1.00 1.17 N ATOM 636 CA GLY A 96 3.519 7.935 6.679 1.00 0.99 C ATOM 637 C GLY A 96 2.439 7.480 5.685 1.00 0.81 C ATOM 638 O GLY A 96 1.589 8.252 5.291 1.00 0.83 O ATOM 0 H GLY A 96 5.027 9.382 6.242 1.00 1.17 H new ATOM 0 HA2 GLY A 96 3.827 7.098 7.306 1.00 0.99 H new ATOM 0 HA3 GLY A 96 3.118 8.700 7.343 1.00 0.99 H new ATOM 642 N LEU A 97 2.463 6.237 5.276 1.00 0.67 N ATOM 643 CA LEU A 97 1.433 5.751 4.312 1.00 0.55 C ATOM 644 C LEU A 97 0.140 5.456 5.080 1.00 0.46 C ATOM 645 O LEU A 97 -0.946 5.515 4.539 1.00 0.49 O ATOM 646 CB LEU A 97 1.952 4.471 3.632 1.00 0.54 C ATOM 647 CG LEU A 97 0.941 3.939 2.594 1.00 0.54 C ATOM 648 CD1 LEU A 97 1.016 4.762 1.306 1.00 0.65 C ATOM 649 CD2 LEU A 97 1.279 2.481 2.266 1.00 0.66 C ATOM 0 H LEU A 97 3.149 5.541 5.567 1.00 0.67 H new ATOM 0 HA LEU A 97 1.235 6.505 3.550 1.00 0.55 H new ATOM 0 HB2 LEU A 97 2.904 4.677 3.143 1.00 0.54 H new ATOM 0 HB3 LEU A 97 2.139 3.706 4.386 1.00 0.54 H new ATOM 0 HG LEU A 97 -0.064 4.014 3.010 1.00 0.54 H new ATOM 0 HD11 LEU A 97 0.297 4.374 0.584 1.00 0.65 H new ATOM 0 HD12 LEU A 97 0.784 5.804 1.526 1.00 0.65 H new ATOM 0 HD13 LEU A 97 2.021 4.695 0.889 1.00 0.65 H new ATOM 0 HD21 LEU A 97 0.568 2.099 1.533 1.00 0.66 H new ATOM 0 HD22 LEU A 97 2.288 2.424 1.857 1.00 0.66 H new ATOM 0 HD23 LEU A 97 1.222 1.881 3.174 1.00 0.66 H new ATOM 661 N GLU A 98 0.251 5.138 6.338 1.00 0.44 N ATOM 662 CA GLU A 98 -0.964 4.835 7.148 1.00 0.40 C ATOM 663 C GLU A 98 -2.002 5.943 6.989 1.00 0.40 C ATOM 664 O GLU A 98 -1.686 7.093 6.758 1.00 0.58 O ATOM 665 CB GLU A 98 -0.578 4.727 8.624 1.00 0.49 C ATOM 666 CG GLU A 98 -1.819 4.405 9.464 1.00 0.48 C ATOM 667 CD GLU A 98 -1.400 4.146 10.912 1.00 1.26 C ATOM 668 OE1 GLU A 98 -0.373 4.669 11.314 1.00 1.94 O ATOM 669 OE2 GLU A 98 -2.112 3.429 11.595 1.00 2.03 O ATOM 0 H GLU A 98 1.134 5.074 6.844 1.00 0.44 H new ATOM 0 HA GLU A 98 -1.389 3.894 6.799 1.00 0.40 H new ATOM 0 HB2 GLU A 98 0.174 3.949 8.757 1.00 0.49 H new ATOM 0 HB3 GLU A 98 -0.132 5.662 8.962 1.00 0.49 H new ATOM 0 HG2 GLU A 98 -2.526 5.234 9.421 1.00 0.48 H new ATOM 0 HG3 GLU A 98 -2.329 3.530 9.059 1.00 0.48 H new ATOM 676 N GLY A 99 -3.242 5.588 7.142 1.00 0.39 N ATOM 677 CA GLY A 99 -4.345 6.581 7.041 1.00 0.42 C ATOM 678 C GLY A 99 -4.271 7.374 5.730 1.00 0.42 C ATOM 679 O GLY A 99 -5.083 8.245 5.487 1.00 0.46 O ATOM 0 H GLY A 99 -3.545 4.634 7.337 1.00 0.39 H new ATOM 0 HA2 GLY A 99 -5.305 6.068 7.103 1.00 0.42 H new ATOM 0 HA3 GLY A 99 -4.296 7.268 7.886 1.00 0.42 H new ATOM 683 N LEU A 100 -3.321 7.096 4.878 1.00 0.41 N ATOM 684 CA LEU A 100 -3.247 7.865 3.596 1.00 0.43 C ATOM 685 C LEU A 100 -4.355 7.376 2.662 1.00 0.42 C ATOM 686 O LEU A 100 -4.367 6.237 2.238 1.00 0.44 O ATOM 687 CB LEU A 100 -1.881 7.663 2.926 1.00 0.45 C ATOM 688 CG LEU A 100 -1.644 8.766 1.872 1.00 0.55 C ATOM 689 CD1 LEU A 100 -1.133 10.052 2.538 1.00 1.15 C ATOM 690 CD2 LEU A 100 -0.602 8.289 0.855 1.00 1.17 C ATOM 0 H LEU A 100 -2.603 6.383 5.007 1.00 0.41 H new ATOM 0 HA LEU A 100 -3.375 8.927 3.806 1.00 0.43 H new ATOM 0 HB2 LEU A 100 -1.091 7.689 3.676 1.00 0.45 H new ATOM 0 HB3 LEU A 100 -1.840 6.682 2.454 1.00 0.45 H new ATOM 0 HG LEU A 100 -2.591 8.974 1.373 1.00 0.55 H new ATOM 0 HD11 LEU A 100 -0.972 10.816 1.778 1.00 1.15 H new ATOM 0 HD12 LEU A 100 -1.870 10.406 3.259 1.00 1.15 H new ATOM 0 HD13 LEU A 100 -0.193 9.847 3.051 1.00 1.15 H new ATOM 0 HD21 LEU A 100 -0.436 9.069 0.112 1.00 1.17 H new ATOM 0 HD22 LEU A 100 0.335 8.071 1.368 1.00 1.17 H new ATOM 0 HD23 LEU A 100 -0.963 7.387 0.360 1.00 1.17 H new ATOM 702 N ILE A 101 -5.301 8.221 2.354 1.00 0.44 N ATOM 703 CA ILE A 101 -6.418 7.792 1.469 1.00 0.45 C ATOM 704 C ILE A 101 -5.903 7.415 0.069 1.00 0.46 C ATOM 705 O ILE A 101 -5.563 8.258 -0.736 1.00 0.49 O ATOM 706 CB ILE A 101 -7.491 8.902 1.410 1.00 0.50 C ATOM 707 CG1 ILE A 101 -8.399 8.810 2.662 1.00 0.51 C ATOM 708 CG2 ILE A 101 -8.341 8.770 0.143 1.00 0.54 C ATOM 709 CD1 ILE A 101 -9.474 7.707 2.502 1.00 0.52 C ATOM 0 H ILE A 101 -5.348 9.187 2.677 1.00 0.44 H new ATOM 0 HA ILE A 101 -6.878 6.896 1.885 1.00 0.45 H new ATOM 0 HB ILE A 101 -6.991 9.870 1.389 1.00 0.50 H new ATOM 0 HG12 ILE A 101 -7.789 8.601 3.541 1.00 0.51 H new ATOM 0 HG13 ILE A 101 -8.884 9.771 2.832 1.00 0.51 H new ATOM 0 HG21 ILE A 101 -9.090 9.562 0.123 1.00 0.54 H new ATOM 0 HG22 ILE A 101 -7.701 8.854 -0.735 1.00 0.54 H new ATOM 0 HG23 ILE A 101 -8.839 7.800 0.138 1.00 0.54 H new ATOM 0 HD11 ILE A 101 -10.093 7.670 3.398 1.00 0.52 H new ATOM 0 HD12 ILE A 101 -10.099 7.931 1.638 1.00 0.52 H new ATOM 0 HD13 ILE A 101 -8.987 6.743 2.357 1.00 0.52 H new ATOM 721 N HIS A 102 -5.874 6.135 -0.217 1.00 0.47 N ATOM 722 CA HIS A 102 -5.419 5.651 -1.554 1.00 0.51 C ATOM 723 C HIS A 102 -6.433 6.080 -2.624 1.00 0.58 C ATOM 724 O HIS A 102 -7.508 5.511 -2.739 1.00 0.64 O ATOM 725 CB HIS A 102 -5.301 4.109 -1.522 1.00 0.57 C ATOM 726 CG HIS A 102 -5.400 3.530 -2.915 1.00 0.64 C ATOM 727 ND1 HIS A 102 -6.535 2.869 -3.359 1.00 1.41 N ATOM 728 CD2 HIS A 102 -4.524 3.519 -3.973 1.00 0.64 C ATOM 729 CE1 HIS A 102 -6.314 2.493 -4.631 1.00 1.36 C ATOM 730 NE2 HIS A 102 -5.104 2.864 -5.055 1.00 0.70 N ATOM 0 H HIS A 102 -6.151 5.397 0.430 1.00 0.47 H new ATOM 0 HA HIS A 102 -4.447 6.081 -1.794 1.00 0.51 H new ATOM 0 HB2 HIS A 102 -4.351 3.823 -1.072 1.00 0.57 H new ATOM 0 HB3 HIS A 102 -6.089 3.693 -0.894 1.00 0.57 H new ATOM 0 HD1 HIS A 102 -7.383 2.699 -2.819 1.00 1.41 H new ATOM 0 HD2 HIS A 102 -3.535 3.953 -3.966 1.00 0.64 H new ATOM 0 HE1 HIS A 102 -7.029 1.956 -5.236 1.00 1.36 H new ATOM 738 N SER A 103 -6.088 7.062 -3.412 1.00 0.60 N ATOM 739 CA SER A 103 -7.009 7.517 -4.491 1.00 0.69 C ATOM 740 C SER A 103 -7.064 6.448 -5.584 1.00 0.76 C ATOM 741 O SER A 103 -7.831 5.509 -5.513 1.00 0.85 O ATOM 742 CB SER A 103 -6.492 8.828 -5.086 1.00 0.74 C ATOM 743 OG SER A 103 -6.632 9.867 -4.127 1.00 1.49 O ATOM 0 H SER A 103 -5.205 7.570 -3.354 1.00 0.60 H new ATOM 0 HA SER A 103 -8.006 7.676 -4.080 1.00 0.69 H new ATOM 0 HB2 SER A 103 -5.446 8.722 -5.374 1.00 0.74 H new ATOM 0 HB3 SER A 103 -7.049 9.075 -5.990 1.00 0.74 H new ATOM 0 HG SER A 103 -6.300 10.708 -4.505 1.00 1.49 H new ATOM 749 N GLN A 104 -6.245 6.584 -6.597 1.00 0.81 N ATOM 750 CA GLN A 104 -6.231 5.580 -7.705 1.00 0.92 C ATOM 751 C GLN A 104 -4.798 5.420 -8.224 1.00 0.93 C ATOM 752 O GLN A 104 -4.234 4.346 -8.196 1.00 1.37 O ATOM 753 CB GLN A 104 -7.126 6.062 -8.852 1.00 1.06 C ATOM 754 CG GLN A 104 -8.571 6.192 -8.367 1.00 1.76 C ATOM 755 CD GLN A 104 -9.463 6.616 -9.534 1.00 2.14 C ATOM 756 OE1 GLN A 104 -9.901 5.792 -10.312 1.00 2.64 O ATOM 757 NE2 GLN A 104 -9.750 7.880 -9.693 1.00 2.70 N ATOM 0 H GLN A 104 -5.582 7.352 -6.705 1.00 0.81 H new ATOM 0 HA GLN A 104 -6.601 4.626 -7.330 1.00 0.92 H new ATOM 0 HB2 GLN A 104 -6.770 7.023 -9.223 1.00 1.06 H new ATOM 0 HB3 GLN A 104 -7.075 5.360 -9.684 1.00 1.06 H new ATOM 0 HG2 GLN A 104 -8.916 5.242 -7.958 1.00 1.76 H new ATOM 0 HG3 GLN A 104 -8.632 6.926 -7.563 1.00 1.76 H new ATOM 0 HE21 GLN A 104 -9.383 8.572 -9.040 1.00 2.70 H new ATOM 0 HE22 GLN A 104 -10.342 8.175 -10.470 1.00 2.70 H new ATOM 766 N ARG A 105 -4.211 6.484 -8.705 1.00 0.83 N ATOM 767 CA ARG A 105 -2.819 6.394 -9.233 1.00 0.87 C ATOM 768 C ARG A 105 -1.818 6.394 -8.076 1.00 0.74 C ATOM 769 O ARG A 105 -0.678 6.003 -8.232 1.00 0.70 O ATOM 770 CB ARG A 105 -2.540 7.588 -10.150 1.00 1.06 C ATOM 771 CG ARG A 105 -2.852 8.891 -9.411 1.00 1.71 C ATOM 772 CD ARG A 105 -2.522 10.078 -10.318 1.00 1.99 C ATOM 773 NE ARG A 105 -2.920 11.347 -9.647 1.00 2.86 N ATOM 774 CZ ARG A 105 -2.455 12.487 -10.084 1.00 3.60 C ATOM 775 NH1 ARG A 105 -1.643 12.510 -11.104 1.00 3.73 N ATOM 776 NH2 ARG A 105 -2.804 13.601 -9.500 1.00 4.61 N ATOM 0 H ARG A 105 -4.635 7.410 -8.755 1.00 0.83 H new ATOM 0 HA ARG A 105 -2.712 5.467 -9.797 1.00 0.87 H new ATOM 0 HB2 ARG A 105 -1.497 7.579 -10.467 1.00 1.06 H new ATOM 0 HB3 ARG A 105 -3.148 7.516 -11.052 1.00 1.06 H new ATOM 0 HG2 ARG A 105 -3.904 8.918 -9.126 1.00 1.71 H new ATOM 0 HG3 ARG A 105 -2.271 8.949 -8.491 1.00 1.71 H new ATOM 0 HD2 ARG A 105 -1.455 10.092 -10.541 1.00 1.99 H new ATOM 0 HD3 ARG A 105 -3.045 9.978 -11.269 1.00 1.99 H new ATOM 0 HE ARG A 105 -3.554 11.326 -8.848 1.00 2.86 H new ATOM 0 HH11 ARG A 105 -1.372 11.639 -11.560 1.00 3.73 H new ATOM 0 HH12 ARG A 105 -1.279 13.399 -11.446 1.00 3.73 H new ATOM 0 HH21 ARG A 105 -3.440 13.581 -8.703 1.00 4.61 H new ATOM 0 HH22 ARG A 105 -2.441 14.491 -9.841 1.00 4.61 H new ATOM 790 N ARG A 106 -2.228 6.827 -6.915 1.00 0.71 N ATOM 791 CA ARG A 106 -1.288 6.846 -5.757 1.00 0.65 C ATOM 792 C ARG A 106 -0.696 5.441 -5.580 1.00 0.54 C ATOM 793 O ARG A 106 0.370 5.272 -5.023 1.00 0.50 O ATOM 794 CB ARG A 106 -2.057 7.267 -4.480 1.00 0.70 C ATOM 795 CG ARG A 106 -1.852 8.767 -4.184 1.00 1.01 C ATOM 796 CD ARG A 106 -2.531 9.635 -5.266 1.00 1.24 C ATOM 797 NE ARG A 106 -1.647 10.793 -5.614 1.00 1.86 N ATOM 798 CZ ARG A 106 -1.081 11.520 -4.685 1.00 2.48 C ATOM 799 NH1 ARG A 106 -1.383 11.341 -3.430 1.00 2.86 N ATOM 800 NH2 ARG A 106 -0.241 12.459 -5.021 1.00 3.29 N ATOM 0 H ARG A 106 -3.169 7.167 -6.718 1.00 0.71 H new ATOM 0 HA ARG A 106 -0.483 7.559 -5.935 1.00 0.65 H new ATOM 0 HB2 ARG A 106 -3.120 7.059 -4.605 1.00 0.70 H new ATOM 0 HB3 ARG A 106 -1.714 6.675 -3.632 1.00 0.70 H new ATOM 0 HG2 ARG A 106 -2.265 9.009 -3.205 1.00 1.01 H new ATOM 0 HG3 ARG A 106 -0.786 8.993 -4.146 1.00 1.01 H new ATOM 0 HD2 ARG A 106 -2.728 9.036 -6.155 1.00 1.24 H new ATOM 0 HD3 ARG A 106 -3.494 9.996 -4.905 1.00 1.24 H new ATOM 0 HE ARG A 106 -1.483 11.019 -6.595 1.00 1.86 H new ATOM 0 HH11 ARG A 106 -2.065 10.630 -3.166 1.00 2.86 H new ATOM 0 HH12 ARG A 106 -0.937 11.912 -2.712 1.00 2.86 H new ATOM 0 HH21 ARG A 106 -0.028 12.624 -6.005 1.00 3.29 H new ATOM 0 HH22 ARG A 106 0.203 13.028 -4.300 1.00 3.29 H new ATOM 814 N GLN A 107 -1.380 4.435 -6.050 1.00 0.55 N ATOM 815 CA GLN A 107 -0.857 3.046 -5.909 1.00 0.52 C ATOM 816 C GLN A 107 0.436 2.896 -6.715 1.00 0.49 C ATOM 817 O GLN A 107 1.423 2.378 -6.232 1.00 0.44 O ATOM 818 CB GLN A 107 -1.899 2.054 -6.430 1.00 0.63 C ATOM 819 CG GLN A 107 -1.527 0.639 -5.982 1.00 1.11 C ATOM 820 CD GLN A 107 -2.515 -0.364 -6.582 1.00 1.53 C ATOM 821 OE1 GLN A 107 -2.961 -0.200 -7.701 1.00 2.13 O ATOM 822 NE2 GLN A 107 -2.878 -1.402 -5.880 1.00 2.12 N ATOM 0 H GLN A 107 -2.279 4.514 -6.526 1.00 0.55 H new ATOM 0 HA GLN A 107 -0.652 2.843 -4.858 1.00 0.52 H new ATOM 0 HB2 GLN A 107 -2.887 2.318 -6.054 1.00 0.63 H new ATOM 0 HB3 GLN A 107 -1.949 2.101 -7.518 1.00 0.63 H new ATOM 0 HG2 GLN A 107 -0.512 0.401 -6.300 1.00 1.11 H new ATOM 0 HG3 GLN A 107 -1.543 0.575 -4.894 1.00 1.11 H new ATOM 0 HE21 GLN A 107 -2.503 -1.539 -4.941 1.00 2.12 H new ATOM 0 HE22 GLN A 107 -3.536 -2.076 -6.270 1.00 2.12 H new ATOM 831 N ASP A 108 0.436 3.342 -7.941 1.00 0.56 N ATOM 832 CA ASP A 108 1.663 3.219 -8.780 1.00 0.59 C ATOM 833 C ASP A 108 2.832 3.942 -8.104 1.00 0.54 C ATOM 834 O ASP A 108 3.902 3.390 -7.944 1.00 0.54 O ATOM 835 CB ASP A 108 1.408 3.844 -10.153 1.00 0.72 C ATOM 836 CG ASP A 108 0.044 3.391 -10.676 1.00 0.81 C ATOM 837 OD1 ASP A 108 -0.594 2.599 -10.003 1.00 1.33 O ATOM 838 OD2 ASP A 108 -0.340 3.846 -11.742 1.00 1.42 O ATOM 0 H ASP A 108 -0.360 3.786 -8.399 1.00 0.56 H new ATOM 0 HA ASP A 108 1.911 2.164 -8.897 1.00 0.59 H new ATOM 0 HB2 ASP A 108 1.438 4.931 -10.080 1.00 0.72 H new ATOM 0 HB3 ASP A 108 2.193 3.549 -10.850 1.00 0.72 H new ATOM 843 N ILE A 109 2.637 5.175 -7.712 1.00 0.55 N ATOM 844 CA ILE A 109 3.739 5.939 -7.053 1.00 0.54 C ATOM 845 C ILE A 109 4.426 5.059 -6.004 1.00 0.47 C ATOM 846 O ILE A 109 5.630 4.903 -6.006 1.00 0.53 O ATOM 847 CB ILE A 109 3.162 7.184 -6.374 1.00 0.59 C ATOM 848 CG1 ILE A 109 2.246 7.933 -7.352 1.00 0.70 C ATOM 849 CG2 ILE A 109 4.303 8.105 -5.935 1.00 0.63 C ATOM 850 CD1 ILE A 109 2.970 8.165 -8.684 1.00 1.47 C ATOM 0 H ILE A 109 1.761 5.686 -7.820 1.00 0.55 H new ATOM 0 HA ILE A 109 4.469 6.238 -7.806 1.00 0.54 H new ATOM 0 HB ILE A 109 2.584 6.880 -5.501 1.00 0.59 H new ATOM 0 HG12 ILE A 109 1.335 7.359 -7.520 1.00 0.70 H new ATOM 0 HG13 ILE A 109 1.946 8.888 -6.922 1.00 0.70 H new ATOM 0 HG21 ILE A 109 3.890 8.991 -5.452 1.00 0.63 H new ATOM 0 HG22 ILE A 109 4.948 7.576 -5.233 1.00 0.63 H new ATOM 0 HG23 ILE A 109 4.884 8.405 -6.807 1.00 0.63 H new ATOM 0 HD11 ILE A 109 2.310 8.697 -9.369 1.00 1.47 H new ATOM 0 HD12 ILE A 109 3.868 8.758 -8.511 1.00 1.47 H new ATOM 0 HD13 ILE A 109 3.247 7.205 -9.119 1.00 1.47 H new ATOM 862 N LEU A 110 3.672 4.480 -5.110 1.00 0.43 N ATOM 863 CA LEU A 110 4.288 3.610 -4.069 1.00 0.39 C ATOM 864 C LEU A 110 5.236 2.615 -4.744 1.00 0.38 C ATOM 865 O LEU A 110 6.432 2.637 -4.530 1.00 0.38 O ATOM 866 CB LEU A 110 3.184 2.844 -3.328 1.00 0.42 C ATOM 867 CG LEU A 110 3.770 2.115 -2.101 1.00 0.44 C ATOM 868 CD1 LEU A 110 3.895 3.078 -0.913 1.00 0.56 C ATOM 869 CD2 LEU A 110 2.849 0.957 -1.701 1.00 0.66 C ATOM 0 H LEU A 110 2.658 4.572 -5.056 1.00 0.43 H new ATOM 0 HA LEU A 110 4.844 4.222 -3.358 1.00 0.39 H new ATOM 0 HB2 LEU A 110 2.403 3.535 -3.010 1.00 0.42 H new ATOM 0 HB3 LEU A 110 2.718 2.123 -4.000 1.00 0.42 H new ATOM 0 HG LEU A 110 4.758 1.737 -2.365 1.00 0.44 H new ATOM 0 HD11 LEU A 110 4.310 2.547 -0.056 1.00 0.56 H new ATOM 0 HD12 LEU A 110 4.554 3.904 -1.182 1.00 0.56 H new ATOM 0 HD13 LEU A 110 2.910 3.468 -0.656 1.00 0.56 H new ATOM 0 HD21 LEU A 110 3.265 0.444 -0.834 1.00 0.66 H new ATOM 0 HD22 LEU A 110 1.862 1.346 -1.453 1.00 0.66 H new ATOM 0 HD23 LEU A 110 2.764 0.256 -2.531 1.00 0.66 H new ATOM 881 N ASP A 111 4.706 1.743 -5.557 1.00 0.40 N ATOM 882 CA ASP A 111 5.568 0.743 -6.251 1.00 0.42 C ATOM 883 C ASP A 111 6.679 1.459 -7.024 1.00 0.43 C ATOM 884 O ASP A 111 7.801 0.997 -7.082 1.00 0.42 O ATOM 885 CB ASP A 111 4.714 -0.071 -7.224 1.00 0.50 C ATOM 886 CG ASP A 111 3.445 -0.544 -6.515 1.00 0.59 C ATOM 887 OD1 ASP A 111 3.399 -0.450 -5.300 1.00 1.19 O ATOM 888 OD2 ASP A 111 2.540 -0.993 -7.199 1.00 1.30 O ATOM 0 H ASP A 111 3.711 1.679 -5.772 1.00 0.40 H new ATOM 0 HA ASP A 111 6.017 0.080 -5.512 1.00 0.42 H new ATOM 0 HB2 ASP A 111 4.454 0.535 -8.092 1.00 0.50 H new ATOM 0 HB3 ASP A 111 5.279 -0.928 -7.592 1.00 0.50 H new ATOM 893 N LEU A 112 6.378 2.579 -7.624 1.00 0.48 N ATOM 894 CA LEU A 112 7.424 3.311 -8.396 1.00 0.52 C ATOM 895 C LEU A 112 8.536 3.755 -7.449 1.00 0.48 C ATOM 896 O LEU A 112 9.685 3.405 -7.623 1.00 0.47 O ATOM 897 CB LEU A 112 6.799 4.541 -9.069 1.00 0.60 C ATOM 898 CG LEU A 112 7.781 5.143 -10.099 1.00 0.70 C ATOM 899 CD1 LEU A 112 7.682 4.391 -11.435 1.00 1.45 C ATOM 900 CD2 LEU A 112 7.439 6.619 -10.335 1.00 1.26 C ATOM 0 H LEU A 112 5.457 3.018 -7.614 1.00 0.48 H new ATOM 0 HA LEU A 112 7.839 2.654 -9.160 1.00 0.52 H new ATOM 0 HB2 LEU A 112 5.869 4.261 -9.563 1.00 0.60 H new ATOM 0 HB3 LEU A 112 6.547 5.288 -8.316 1.00 0.60 H new ATOM 0 HG LEU A 112 8.794 5.051 -9.707 1.00 0.70 H new ATOM 0 HD11 LEU A 112 8.380 4.827 -12.150 1.00 1.45 H new ATOM 0 HD12 LEU A 112 7.929 3.341 -11.281 1.00 1.45 H new ATOM 0 HD13 LEU A 112 6.667 4.471 -11.823 1.00 1.45 H new ATOM 0 HD21 LEU A 112 8.133 7.042 -11.062 1.00 1.26 H new ATOM 0 HD22 LEU A 112 6.421 6.700 -10.716 1.00 1.26 H new ATOM 0 HD23 LEU A 112 7.520 7.166 -9.396 1.00 1.26 H new ATOM 912 N TRP A 113 8.207 4.515 -6.442 1.00 0.48 N ATOM 913 CA TRP A 113 9.257 4.966 -5.489 1.00 0.48 C ATOM 914 C TRP A 113 10.049 3.746 -5.018 1.00 0.43 C ATOM 915 O TRP A 113 11.262 3.758 -4.980 1.00 0.45 O ATOM 916 CB TRP A 113 8.600 5.652 -4.290 1.00 0.52 C ATOM 917 CG TRP A 113 9.651 6.089 -3.318 1.00 0.56 C ATOM 918 CD1 TRP A 113 10.408 7.204 -3.440 1.00 0.66 C ATOM 919 CD2 TRP A 113 10.068 5.443 -2.081 1.00 0.55 C ATOM 920 NE1 TRP A 113 11.264 7.283 -2.356 1.00 0.70 N ATOM 921 CE2 TRP A 113 11.092 6.221 -1.491 1.00 0.65 C ATOM 922 CE3 TRP A 113 9.663 4.271 -1.420 1.00 0.51 C ATOM 923 CZ2 TRP A 113 11.692 5.848 -0.287 1.00 0.70 C ATOM 924 CZ3 TRP A 113 10.263 3.892 -0.210 1.00 0.58 C ATOM 925 CH2 TRP A 113 11.277 4.679 0.356 1.00 0.67 C ATOM 0 H TRP A 113 7.262 4.841 -6.239 1.00 0.48 H new ATOM 0 HA TRP A 113 9.926 5.674 -5.979 1.00 0.48 H new ATOM 0 HB2 TRP A 113 8.020 6.512 -4.624 1.00 0.52 H new ATOM 0 HB3 TRP A 113 7.904 4.968 -3.804 1.00 0.52 H new ATOM 0 HD1 TRP A 113 10.353 7.916 -4.251 1.00 0.66 H new ATOM 0 HE1 TRP A 113 11.939 8.034 -2.213 1.00 0.70 H new ATOM 0 HE3 TRP A 113 8.884 3.657 -1.847 1.00 0.51 H new ATOM 0 HZ2 TRP A 113 12.471 6.459 0.144 1.00 0.70 H new ATOM 0 HZ3 TRP A 113 9.942 2.989 0.289 1.00 0.58 H new ATOM 0 HH2 TRP A 113 11.736 4.382 1.287 1.00 0.67 H new ATOM 936 N ILE A 114 9.372 2.684 -4.672 1.00 0.39 N ATOM 937 CA ILE A 114 10.092 1.462 -4.220 1.00 0.37 C ATOM 938 C ILE A 114 11.031 0.990 -5.333 1.00 0.39 C ATOM 939 O ILE A 114 12.104 0.480 -5.080 1.00 0.44 O ATOM 940 CB ILE A 114 9.086 0.346 -3.907 1.00 0.37 C ATOM 941 CG1 ILE A 114 8.137 0.775 -2.764 1.00 0.37 C ATOM 942 CG2 ILE A 114 9.843 -0.931 -3.520 1.00 0.42 C ATOM 943 CD1 ILE A 114 8.778 0.541 -1.386 1.00 1.00 C ATOM 0 H ILE A 114 8.355 2.611 -4.683 1.00 0.39 H new ATOM 0 HA ILE A 114 10.663 1.695 -3.322 1.00 0.37 H new ATOM 0 HB ILE A 114 8.483 0.152 -4.794 1.00 0.37 H new ATOM 0 HG12 ILE A 114 7.884 1.829 -2.875 1.00 0.37 H new ATOM 0 HG13 ILE A 114 7.205 0.215 -2.833 1.00 0.37 H new ATOM 0 HG21 ILE A 114 9.129 -1.724 -3.298 1.00 0.42 H new ATOM 0 HG22 ILE A 114 10.482 -1.240 -4.347 1.00 0.42 H new ATOM 0 HG23 ILE A 114 10.456 -0.738 -2.640 1.00 0.42 H new ATOM 0 HD11 ILE A 114 8.085 0.853 -0.605 1.00 1.00 H new ATOM 0 HD12 ILE A 114 9.007 -0.518 -1.266 1.00 1.00 H new ATOM 0 HD13 ILE A 114 9.697 1.122 -1.309 1.00 1.00 H new ATOM 955 N TYR A 115 10.627 1.137 -6.566 1.00 0.40 N ATOM 956 CA TYR A 115 11.488 0.681 -7.695 1.00 0.46 C ATOM 957 C TYR A 115 12.761 1.541 -7.787 1.00 0.51 C ATOM 958 O TYR A 115 13.863 1.051 -7.649 1.00 0.54 O ATOM 959 CB TYR A 115 10.689 0.779 -9.005 1.00 0.53 C ATOM 960 CG TYR A 115 11.258 -0.172 -10.040 1.00 0.59 C ATOM 961 CD1 TYR A 115 11.150 -1.560 -9.856 1.00 0.56 C ATOM 962 CD2 TYR A 115 11.888 0.333 -11.186 1.00 0.74 C ATOM 963 CE1 TYR A 115 11.669 -2.435 -10.818 1.00 0.65 C ATOM 964 CE2 TYR A 115 12.408 -0.545 -12.144 1.00 0.82 C ATOM 965 CZ TYR A 115 12.299 -1.928 -11.960 1.00 0.77 C ATOM 966 OH TYR A 115 12.809 -2.792 -12.906 1.00 0.87 O ATOM 0 H TYR A 115 9.737 1.553 -6.840 1.00 0.40 H new ATOM 0 HA TYR A 115 11.788 -0.353 -7.523 1.00 0.46 H new ATOM 0 HB2 TYR A 115 9.642 0.541 -8.819 1.00 0.53 H new ATOM 0 HB3 TYR A 115 10.721 1.801 -9.383 1.00 0.53 H new ATOM 0 HD1 TYR A 115 10.667 -1.952 -8.973 1.00 0.56 H new ATOM 0 HD2 TYR A 115 11.972 1.400 -11.330 1.00 0.74 H new ATOM 0 HE1 TYR A 115 11.583 -3.502 -10.678 1.00 0.65 H new ATOM 0 HE2 TYR A 115 12.894 -0.155 -13.026 1.00 0.82 H new ATOM 0 HH TYR A 115 12.993 -2.300 -13.733 1.00 0.87 H new ATOM 976 N HIS A 116 12.619 2.816 -8.040 1.00 0.58 N ATOM 977 CA HIS A 116 13.821 3.700 -8.166 1.00 0.67 C ATOM 978 C HIS A 116 14.635 3.701 -6.864 1.00 0.67 C ATOM 979 O HIS A 116 15.666 4.342 -6.780 1.00 0.81 O ATOM 980 CB HIS A 116 13.361 5.131 -8.481 1.00 0.79 C ATOM 981 CG HIS A 116 13.021 5.252 -9.944 1.00 1.20 C ATOM 982 ND1 HIS A 116 13.712 6.103 -10.794 1.00 1.99 N ATOM 983 CD2 HIS A 116 12.068 4.641 -10.720 1.00 2.05 C ATOM 984 CE1 HIS A 116 13.170 5.980 -12.019 1.00 2.71 C ATOM 985 NE2 HIS A 116 12.164 5.101 -12.031 1.00 2.74 N ATOM 0 H HIS A 116 11.722 3.286 -8.165 1.00 0.58 H new ATOM 0 HA HIS A 116 14.453 3.322 -8.969 1.00 0.67 H new ATOM 0 HB2 HIS A 116 12.491 5.384 -7.875 1.00 0.79 H new ATOM 0 HB3 HIS A 116 14.147 5.840 -8.222 1.00 0.79 H new ATOM 0 HD2 HIS A 116 11.352 3.914 -10.367 1.00 2.05 H new ATOM 0 HE1 HIS A 116 13.507 6.526 -12.888 1.00 2.71 H new ATOM 0 HE2 HIS A 116 11.590 4.826 -12.828 1.00 2.74 H new ATOM 993 N THR A 117 14.193 3.003 -5.847 1.00 0.63 N ATOM 994 CA THR A 117 14.959 2.987 -4.554 1.00 0.68 C ATOM 995 C THR A 117 15.810 1.715 -4.461 1.00 0.66 C ATOM 996 O THR A 117 16.903 1.653 -4.987 1.00 0.73 O ATOM 997 CB THR A 117 13.980 3.037 -3.378 1.00 0.80 C ATOM 998 OG1 THR A 117 12.967 2.064 -3.570 1.00 0.85 O ATOM 999 CG2 THR A 117 13.347 4.433 -3.280 1.00 0.91 C ATOM 0 H THR A 117 13.339 2.445 -5.852 1.00 0.63 H new ATOM 0 HA THR A 117 15.616 3.856 -4.519 1.00 0.68 H new ATOM 0 HB THR A 117 14.517 2.828 -2.453 1.00 0.80 H new ATOM 0 HG1 THR A 117 13.168 1.536 -4.371 1.00 0.85 H new ATOM 0 HG21 THR A 117 12.652 4.459 -2.441 1.00 0.91 H new ATOM 0 HG22 THR A 117 14.129 5.177 -3.127 1.00 0.91 H new ATOM 0 HG23 THR A 117 12.810 4.655 -4.202 1.00 0.91 H new ATOM 1007 N GLN A 118 15.327 0.702 -3.786 1.00 0.73 N ATOM 1008 CA GLN A 118 16.126 -0.555 -3.655 1.00 0.83 C ATOM 1009 C GLN A 118 15.956 -1.412 -4.910 1.00 0.72 C ATOM 1010 O GLN A 118 16.647 -2.392 -5.100 1.00 0.91 O ATOM 1011 CB GLN A 118 15.649 -1.338 -2.423 1.00 1.06 C ATOM 1012 CG GLN A 118 16.551 -2.570 -2.179 1.00 1.48 C ATOM 1013 CD GLN A 118 16.013 -3.798 -2.929 1.00 2.12 C ATOM 1014 OE1 GLN A 118 16.470 -4.901 -2.708 1.00 2.89 O ATOM 1015 NE2 GLN A 118 15.059 -3.658 -3.808 1.00 2.13 N ATOM 0 H GLN A 118 14.419 0.691 -3.322 1.00 0.73 H new ATOM 0 HA GLN A 118 17.180 -0.302 -3.538 1.00 0.83 H new ATOM 0 HB2 GLN A 118 15.663 -0.691 -1.546 1.00 1.06 H new ATOM 0 HB3 GLN A 118 14.617 -1.659 -2.566 1.00 1.06 H new ATOM 0 HG2 GLN A 118 17.567 -2.353 -2.509 1.00 1.48 H new ATOM 0 HG3 GLN A 118 16.601 -2.784 -1.111 1.00 1.48 H new ATOM 0 HE21 GLN A 118 14.672 -2.734 -3.997 1.00 2.13 H new ATOM 0 HE22 GLN A 118 14.701 -4.473 -4.306 1.00 2.13 H new ATOM 1024 N GLY A 119 15.054 -1.044 -5.776 1.00 0.86 N ATOM 1025 CA GLY A 119 14.856 -1.828 -7.029 1.00 0.85 C ATOM 1026 C GLY A 119 14.151 -3.157 -6.743 1.00 0.65 C ATOM 1027 O GLY A 119 14.384 -4.141 -7.416 1.00 0.67 O ATOM 0 H GLY A 119 14.444 -0.233 -5.671 1.00 0.86 H new ATOM 0 HA2 GLY A 119 14.267 -1.245 -7.737 1.00 0.85 H new ATOM 0 HA3 GLY A 119 15.821 -2.019 -7.499 1.00 0.85 H new ATOM 1031 N TYR A 120 13.273 -3.200 -5.776 1.00 0.54 N ATOM 1032 CA TYR A 120 12.555 -4.478 -5.508 1.00 0.44 C ATOM 1033 C TYR A 120 11.547 -4.685 -6.637 1.00 0.49 C ATOM 1034 O TYR A 120 10.836 -3.775 -7.016 1.00 0.70 O ATOM 1035 CB TYR A 120 11.808 -4.402 -4.166 1.00 0.48 C ATOM 1036 CG TYR A 120 12.746 -4.723 -3.021 1.00 0.52 C ATOM 1037 CD1 TYR A 120 13.320 -5.997 -2.923 1.00 0.58 C ATOM 1038 CD2 TYR A 120 13.039 -3.750 -2.055 1.00 0.60 C ATOM 1039 CE1 TYR A 120 14.185 -6.297 -1.863 1.00 0.71 C ATOM 1040 CE2 TYR A 120 13.902 -4.051 -0.996 1.00 0.71 C ATOM 1041 CZ TYR A 120 14.476 -5.325 -0.900 1.00 0.75 C ATOM 1042 OH TYR A 120 15.327 -5.623 0.145 1.00 0.91 O ATOM 0 H TYR A 120 13.025 -2.418 -5.169 1.00 0.54 H new ATOM 0 HA TYR A 120 13.265 -5.303 -5.459 1.00 0.44 H new ATOM 0 HB2 TYR A 120 11.388 -3.405 -4.032 1.00 0.48 H new ATOM 0 HB3 TYR A 120 10.973 -5.102 -4.167 1.00 0.48 H new ATOM 0 HD1 TYR A 120 13.095 -6.749 -3.665 1.00 0.58 H new ATOM 0 HD2 TYR A 120 12.598 -2.767 -2.129 1.00 0.60 H new ATOM 0 HE1 TYR A 120 14.628 -7.279 -1.789 1.00 0.71 H new ATOM 0 HE2 TYR A 120 14.126 -3.301 -0.252 1.00 0.71 H new ATOM 0 HH TYR A 120 15.980 -6.293 -0.146 1.00 0.91 H new ATOM 1052 N PHE A 121 11.480 -5.860 -7.189 1.00 0.48 N ATOM 1053 CA PHE A 121 10.518 -6.090 -8.299 1.00 0.57 C ATOM 1054 C PHE A 121 9.088 -6.137 -7.723 1.00 0.55 C ATOM 1055 O PHE A 121 8.858 -6.777 -6.718 1.00 0.59 O ATOM 1056 CB PHE A 121 10.843 -7.422 -8.989 1.00 0.68 C ATOM 1057 CG PHE A 121 10.219 -7.447 -10.367 1.00 1.42 C ATOM 1058 CD1 PHE A 121 8.910 -7.911 -10.537 1.00 2.33 C ATOM 1059 CD2 PHE A 121 10.953 -7.001 -11.474 1.00 2.32 C ATOM 1060 CE1 PHE A 121 8.334 -7.930 -11.814 1.00 3.43 C ATOM 1061 CE2 PHE A 121 10.377 -7.019 -12.749 1.00 3.44 C ATOM 1062 CZ PHE A 121 9.067 -7.484 -12.919 1.00 3.85 C ATOM 0 H PHE A 121 12.045 -6.667 -6.923 1.00 0.48 H new ATOM 0 HA PHE A 121 10.592 -5.282 -9.027 1.00 0.57 H new ATOM 0 HB2 PHE A 121 11.923 -7.549 -9.066 1.00 0.68 H new ATOM 0 HB3 PHE A 121 10.466 -8.253 -8.393 1.00 0.68 H new ATOM 0 HD1 PHE A 121 8.344 -8.254 -9.684 1.00 2.33 H new ATOM 0 HD2 PHE A 121 11.964 -6.643 -11.343 1.00 2.32 H new ATOM 0 HE1 PHE A 121 7.324 -8.289 -11.945 1.00 3.43 H new ATOM 0 HE2 PHE A 121 10.943 -6.674 -13.602 1.00 3.44 H new ATOM 0 HZ PHE A 121 8.623 -7.498 -13.903 1.00 3.85 H new ATOM 1072 N PRO A 122 8.132 -5.468 -8.335 1.00 0.64 N ATOM 1073 CA PRO A 122 6.726 -5.460 -7.833 1.00 0.67 C ATOM 1074 C PRO A 122 5.960 -6.740 -8.192 1.00 0.73 C ATOM 1075 O PRO A 122 5.448 -6.889 -9.283 1.00 1.19 O ATOM 1076 CB PRO A 122 6.114 -4.247 -8.538 1.00 0.80 C ATOM 1077 CG PRO A 122 6.830 -4.188 -9.848 1.00 1.05 C ATOM 1078 CD PRO A 122 8.264 -4.648 -9.560 1.00 0.87 C ATOM 0 HA PRO A 122 6.681 -5.410 -6.745 1.00 0.67 H new ATOM 0 HB2 PRO A 122 5.039 -4.366 -8.676 1.00 0.80 H new ATOM 0 HB3 PRO A 122 6.262 -3.334 -7.961 1.00 0.80 H new ATOM 0 HG2 PRO A 122 6.352 -4.834 -10.584 1.00 1.05 H new ATOM 0 HG3 PRO A 122 6.818 -3.177 -10.255 1.00 1.05 H new ATOM 0 HD2 PRO A 122 8.672 -5.228 -10.388 1.00 0.87 H new ATOM 0 HD3 PRO A 122 8.932 -3.801 -9.404 1.00 0.87 H new ATOM 1086 N ASP A 123 5.869 -7.650 -7.268 1.00 0.56 N ATOM 1087 CA ASP A 123 5.128 -8.916 -7.520 1.00 0.64 C ATOM 1088 C ASP A 123 4.664 -9.471 -6.176 1.00 0.58 C ATOM 1089 O ASP A 123 4.338 -10.633 -6.045 1.00 0.65 O ATOM 1090 CB ASP A 123 6.048 -9.929 -8.205 1.00 0.74 C ATOM 1091 CG ASP A 123 7.245 -10.222 -7.301 1.00 0.77 C ATOM 1092 OD1 ASP A 123 7.560 -9.381 -6.475 1.00 1.38 O ATOM 1093 OD2 ASP A 123 7.829 -11.283 -7.450 1.00 1.27 O ATOM 0 H ASP A 123 6.280 -7.571 -6.338 1.00 0.56 H new ATOM 0 HA ASP A 123 4.272 -8.728 -8.168 1.00 0.64 H new ATOM 0 HB2 ASP A 123 5.502 -10.849 -8.414 1.00 0.74 H new ATOM 0 HB3 ASP A 123 6.389 -9.537 -9.163 1.00 0.74 H new ATOM 1098 N TRP A 124 4.644 -8.629 -5.171 1.00 0.53 N ATOM 1099 CA TRP A 124 4.219 -9.060 -3.805 1.00 0.52 C ATOM 1100 C TRP A 124 2.927 -8.348 -3.433 1.00 0.51 C ATOM 1101 O TRP A 124 2.189 -8.771 -2.564 1.00 0.55 O ATOM 1102 CB TRP A 124 5.308 -8.667 -2.811 1.00 0.49 C ATOM 1103 CG TRP A 124 5.628 -7.219 -3.001 1.00 0.43 C ATOM 1104 CD1 TRP A 124 6.564 -6.728 -3.850 1.00 0.44 C ATOM 1105 CD2 TRP A 124 5.016 -6.064 -2.358 1.00 0.42 C ATOM 1106 NE1 TRP A 124 6.566 -5.348 -3.762 1.00 0.42 N ATOM 1107 CE2 TRP A 124 5.631 -4.891 -2.855 1.00 0.41 C ATOM 1108 CE3 TRP A 124 3.998 -5.924 -1.397 1.00 0.51 C ATOM 1109 CZ2 TRP A 124 5.248 -3.623 -2.415 1.00 0.46 C ATOM 1110 CZ3 TRP A 124 3.611 -4.649 -0.953 1.00 0.58 C ATOM 1111 CH2 TRP A 124 4.236 -3.501 -1.460 1.00 0.55 C ATOM 0 H TRP A 124 4.909 -7.647 -5.242 1.00 0.53 H new ATOM 0 HA TRP A 124 4.061 -10.138 -3.786 1.00 0.52 H new ATOM 0 HB2 TRP A 124 4.972 -8.849 -1.790 1.00 0.49 H new ATOM 0 HB3 TRP A 124 6.199 -9.275 -2.967 1.00 0.49 H new ATOM 0 HD1 TRP A 124 7.203 -7.318 -4.490 1.00 0.44 H new ATOM 0 HE1 TRP A 124 7.183 -4.741 -4.302 1.00 0.42 H new ATOM 0 HE3 TRP A 124 3.511 -6.802 -0.998 1.00 0.51 H new ATOM 0 HZ2 TRP A 124 5.731 -2.742 -2.810 1.00 0.46 H new ATOM 0 HZ3 TRP A 124 2.827 -4.552 -0.216 1.00 0.58 H new ATOM 0 HH2 TRP A 124 3.935 -2.524 -1.113 1.00 0.55 H new ATOM 1122 N GLN A 125 2.662 -7.269 -4.089 1.00 0.53 N ATOM 1123 CA GLN A 125 1.423 -6.496 -3.799 1.00 0.60 C ATOM 1124 C GLN A 125 0.220 -7.229 -4.396 1.00 0.66 C ATOM 1125 O GLN A 125 0.015 -7.240 -5.594 1.00 0.84 O ATOM 1126 CB GLN A 125 1.535 -5.084 -4.398 1.00 0.69 C ATOM 1127 CG GLN A 125 2.249 -5.143 -5.751 1.00 1.56 C ATOM 1128 CD GLN A 125 2.164 -3.776 -6.431 1.00 2.18 C ATOM 1129 OE1 GLN A 125 1.531 -2.870 -5.925 1.00 2.78 O ATOM 1130 NE2 GLN A 125 2.781 -3.586 -7.565 1.00 2.82 N ATOM 0 H GLN A 125 3.252 -6.878 -4.824 1.00 0.53 H new ATOM 0 HA GLN A 125 1.292 -6.407 -2.721 1.00 0.60 H new ATOM 0 HB2 GLN A 125 0.542 -4.652 -4.521 1.00 0.69 H new ATOM 0 HB3 GLN A 125 2.083 -4.434 -3.716 1.00 0.69 H new ATOM 0 HG2 GLN A 125 3.292 -5.428 -5.612 1.00 1.56 H new ATOM 0 HG3 GLN A 125 1.792 -5.905 -6.383 1.00 1.56 H new ATOM 0 HE21 GLN A 125 3.312 -4.346 -7.990 1.00 2.82 H new ATOM 0 HE22 GLN A 125 2.732 -2.678 -8.026 1.00 2.82 H new ATOM 1139 N ASN A 126 -0.576 -7.847 -3.565 1.00 0.64 N ATOM 1140 CA ASN A 126 -1.769 -8.586 -4.069 1.00 0.72 C ATOM 1141 C ASN A 126 -2.877 -8.540 -3.015 1.00 0.69 C ATOM 1142 O ASN A 126 -2.643 -8.208 -1.869 1.00 1.22 O ATOM 1143 CB ASN A 126 -1.385 -10.041 -4.349 1.00 0.84 C ATOM 1144 CG ASN A 126 -0.441 -10.095 -5.553 1.00 0.89 C ATOM 1145 OD1 ASN A 126 0.848 -10.016 -5.361 1.00 1.53 O flip ATOM 1146 ND2 ASN A 126 -0.880 -10.210 -6.680 1.00 0.88 N flip ATOM 0 H ASN A 126 -0.450 -7.872 -2.553 1.00 0.64 H new ATOM 0 HA ASN A 126 -2.125 -8.123 -4.989 1.00 0.72 H new ATOM 0 HB2 ASN A 126 -0.902 -10.476 -3.474 1.00 0.84 H new ATOM 0 HB3 ASN A 126 -2.279 -10.633 -4.547 1.00 0.84 H new ATOM 0 HD21 ASN A 126 -1.887 -10.272 -6.831 1.00 0.88 H new ATOM 0 HD22 ASN A 126 -0.242 -10.245 -7.475 1.00 0.88 H new ATOM 1153 N TYR A 127 -4.082 -8.866 -3.395 1.00 0.69 N ATOM 1154 CA TYR A 127 -5.218 -8.835 -2.425 1.00 0.61 C ATOM 1155 C TYR A 127 -6.371 -9.666 -2.991 1.00 0.63 C ATOM 1156 O TYR A 127 -6.326 -10.120 -4.117 1.00 0.75 O ATOM 1157 CB TYR A 127 -5.718 -7.391 -2.226 1.00 0.65 C ATOM 1158 CG TYR A 127 -4.562 -6.438 -2.009 1.00 0.79 C ATOM 1159 CD1 TYR A 127 -3.878 -5.902 -3.108 1.00 0.93 C ATOM 1160 CD2 TYR A 127 -4.185 -6.080 -0.709 1.00 0.98 C ATOM 1161 CE1 TYR A 127 -2.814 -5.015 -2.907 1.00 1.14 C ATOM 1162 CE2 TYR A 127 -3.120 -5.193 -0.508 1.00 1.19 C ATOM 1163 CZ TYR A 127 -2.435 -4.661 -1.607 1.00 1.23 C ATOM 1164 OH TYR A 127 -1.387 -3.785 -1.409 1.00 1.48 O ATOM 0 H TYR A 127 -4.332 -9.154 -4.341 1.00 0.69 H new ATOM 0 HA TYR A 127 -4.877 -9.235 -1.470 1.00 0.61 H new ATOM 0 HB2 TYR A 127 -6.292 -7.078 -3.098 1.00 0.65 H new ATOM 0 HB3 TYR A 127 -6.392 -7.351 -1.370 1.00 0.65 H new ATOM 0 HD1 TYR A 127 -4.172 -6.173 -4.111 1.00 0.93 H new ATOM 0 HD2 TYR A 127 -4.715 -6.488 0.139 1.00 0.98 H new ATOM 0 HE1 TYR A 127 -2.286 -4.604 -3.755 1.00 1.14 H new ATOM 0 HE2 TYR A 127 -2.827 -4.919 0.495 1.00 1.19 H new ATOM 0 HH TYR A 127 -1.255 -3.645 -0.448 1.00 1.48 H new ATOM 1174 N THR A 128 -7.407 -9.864 -2.224 1.00 0.62 N ATOM 1175 CA THR A 128 -8.559 -10.661 -2.730 1.00 0.68 C ATOM 1176 C THR A 128 -9.207 -9.916 -3.912 1.00 0.75 C ATOM 1177 O THR A 128 -9.272 -8.702 -3.907 1.00 0.97 O ATOM 1178 CB THR A 128 -9.591 -10.826 -1.609 1.00 0.86 C ATOM 1179 OG1 THR A 128 -9.909 -9.551 -1.071 1.00 1.22 O ATOM 1180 CG2 THR A 128 -9.016 -11.717 -0.508 1.00 0.90 C ATOM 0 H THR A 128 -7.506 -9.510 -1.273 1.00 0.62 H new ATOM 0 HA THR A 128 -8.214 -11.642 -3.057 1.00 0.68 H new ATOM 0 HB THR A 128 -10.493 -11.288 -2.011 1.00 0.86 H new ATOM 0 HG1 THR A 128 -10.443 -9.663 -0.257 1.00 1.22 H new ATOM 0 HG21 THR A 128 -9.752 -11.833 0.288 1.00 0.90 H new ATOM 0 HG22 THR A 128 -8.772 -12.695 -0.922 1.00 0.90 H new ATOM 0 HG23 THR A 128 -8.113 -11.259 -0.104 1.00 0.90 H new ATOM 1188 N PRO A 129 -9.693 -10.615 -4.916 1.00 0.88 N ATOM 1189 CA PRO A 129 -10.348 -9.968 -6.093 1.00 1.15 C ATOM 1190 C PRO A 129 -11.807 -9.588 -5.803 1.00 1.51 C ATOM 1191 O PRO A 129 -12.683 -10.429 -5.793 1.00 2.29 O ATOM 1192 CB PRO A 129 -10.282 -11.060 -7.162 1.00 1.51 C ATOM 1193 CG PRO A 129 -10.403 -12.332 -6.390 1.00 1.27 C ATOM 1194 CD PRO A 129 -9.674 -12.088 -5.062 1.00 1.09 C ATOM 0 HA PRO A 129 -9.862 -9.036 -6.381 1.00 1.15 H new ATOM 0 HB2 PRO A 129 -11.088 -10.956 -7.888 1.00 1.51 H new ATOM 0 HB3 PRO A 129 -9.345 -11.018 -7.717 1.00 1.51 H new ATOM 0 HG2 PRO A 129 -11.449 -12.588 -6.220 1.00 1.27 H new ATOM 0 HG3 PRO A 129 -9.955 -13.164 -6.934 1.00 1.27 H new ATOM 0 HD2 PRO A 129 -10.181 -12.579 -4.231 1.00 1.09 H new ATOM 0 HD3 PRO A 129 -8.655 -12.475 -5.088 1.00 1.09 H new ATOM 1202 N GLY A 130 -12.078 -8.330 -5.573 1.00 1.64 N ATOM 1203 CA GLY A 130 -13.483 -7.917 -5.292 1.00 2.18 C ATOM 1204 C GLY A 130 -13.499 -6.544 -4.613 1.00 1.76 C ATOM 1205 O GLY A 130 -12.493 -6.081 -4.112 1.00 1.92 O ATOM 0 H GLY A 130 -11.392 -7.576 -5.568 1.00 1.64 H new ATOM 0 HA2 GLY A 130 -14.052 -7.879 -6.221 1.00 2.18 H new ATOM 0 HA3 GLY A 130 -13.966 -8.654 -4.651 1.00 2.18 H new ATOM 1209 N PRO A 131 -14.640 -5.899 -4.597 1.00 1.94 N ATOM 1210 CA PRO A 131 -14.804 -4.552 -3.968 1.00 2.04 C ATOM 1211 C PRO A 131 -14.823 -4.623 -2.434 1.00 1.43 C ATOM 1212 O PRO A 131 -14.525 -5.644 -1.846 1.00 1.44 O ATOM 1213 CB PRO A 131 -16.163 -4.079 -4.504 1.00 2.91 C ATOM 1214 CG PRO A 131 -16.934 -5.339 -4.730 1.00 3.25 C ATOM 1215 CD PRO A 131 -15.907 -6.381 -5.181 1.00 2.75 C ATOM 0 HA PRO A 131 -13.978 -3.882 -4.208 1.00 2.04 H new ATOM 0 HB2 PRO A 131 -16.667 -3.428 -3.790 1.00 2.91 H new ATOM 0 HB3 PRO A 131 -16.050 -3.512 -5.428 1.00 2.91 H new ATOM 0 HG2 PRO A 131 -17.439 -5.657 -3.818 1.00 3.25 H new ATOM 0 HG3 PRO A 131 -17.704 -5.196 -5.488 1.00 3.25 H new ATOM 0 HD2 PRO A 131 -16.162 -7.377 -4.819 1.00 2.75 H new ATOM 0 HD3 PRO A 131 -15.849 -6.442 -6.268 1.00 2.75 H new ATOM 1223 N GLY A 132 -15.178 -3.545 -1.788 1.00 1.58 N ATOM 1224 CA GLY A 132 -15.226 -3.543 -0.297 1.00 1.44 C ATOM 1225 C GLY A 132 -13.814 -3.703 0.269 1.00 1.21 C ATOM 1226 O GLY A 132 -12.832 -3.570 -0.436 1.00 1.21 O ATOM 0 H GLY A 132 -15.438 -2.663 -2.230 1.00 1.58 H new ATOM 0 HA2 GLY A 132 -15.667 -2.612 0.060 1.00 1.44 H new ATOM 0 HA3 GLY A 132 -15.863 -4.354 0.056 1.00 1.44 H new ATOM 1230 N ILE A 133 -13.704 -3.990 1.540 1.00 1.11 N ATOM 1231 CA ILE A 133 -12.362 -4.161 2.162 1.00 0.94 C ATOM 1232 C ILE A 133 -11.490 -5.042 1.269 1.00 0.92 C ATOM 1233 O ILE A 133 -11.972 -5.656 0.342 1.00 1.52 O ATOM 1234 CB ILE A 133 -12.538 -4.830 3.523 1.00 0.99 C ATOM 1235 CG1 ILE A 133 -13.330 -3.894 4.442 1.00 1.14 C ATOM 1236 CG2 ILE A 133 -11.170 -5.132 4.144 1.00 0.98 C ATOM 1237 CD1 ILE A 133 -13.888 -4.700 5.608 1.00 1.56 C ATOM 0 H ILE A 133 -14.492 -4.114 2.176 1.00 1.11 H new ATOM 0 HA ILE A 133 -11.881 -3.190 2.282 1.00 0.94 H new ATOM 0 HB ILE A 133 -13.079 -5.768 3.398 1.00 0.99 H new ATOM 0 HG12 ILE A 133 -12.687 -3.095 4.810 1.00 1.14 H new ATOM 0 HG13 ILE A 133 -14.141 -3.421 3.889 1.00 1.14 H new ATOM 0 HG21 ILE A 133 -11.308 -5.609 5.114 1.00 0.98 H new ATOM 0 HG22 ILE A 133 -10.612 -5.800 3.488 1.00 0.98 H new ATOM 0 HG23 ILE A 133 -10.615 -4.202 4.272 1.00 0.98 H new ATOM 0 HD11 ILE A 133 -14.453 -4.042 6.268 1.00 1.56 H new ATOM 0 HD12 ILE A 133 -14.544 -5.483 5.228 1.00 1.56 H new ATOM 0 HD13 ILE A 133 -13.067 -5.152 6.164 1.00 1.56 H new ATOM 1249 N ARG A 134 -10.215 -5.117 1.553 1.00 0.51 N ATOM 1250 CA ARG A 134 -9.303 -5.961 0.719 1.00 0.49 C ATOM 1251 C ARG A 134 -8.085 -6.366 1.560 1.00 0.40 C ATOM 1252 O ARG A 134 -7.217 -5.559 1.845 1.00 0.38 O ATOM 1253 CB ARG A 134 -8.803 -5.150 -0.501 1.00 0.58 C ATOM 1254 CG ARG A 134 -9.834 -5.145 -1.647 1.00 1.06 C ATOM 1255 CD ARG A 134 -10.126 -6.580 -2.138 1.00 1.37 C ATOM 1256 NE ARG A 134 -11.359 -7.087 -1.473 1.00 1.86 N ATOM 1257 CZ ARG A 134 -11.964 -8.147 -1.935 1.00 2.52 C ATOM 1258 NH1 ARG A 134 -11.480 -8.778 -2.968 1.00 2.83 N ATOM 1259 NH2 ARG A 134 -13.054 -8.578 -1.359 1.00 3.36 N ATOM 0 H ARG A 134 -9.764 -4.630 2.327 1.00 0.51 H new ATOM 0 HA ARG A 134 -9.846 -6.843 0.379 1.00 0.49 H new ATOM 0 HB2 ARG A 134 -8.595 -4.125 -0.195 1.00 0.58 H new ATOM 0 HB3 ARG A 134 -7.864 -5.573 -0.859 1.00 0.58 H new ATOM 0 HG2 ARG A 134 -10.758 -4.679 -1.307 1.00 1.06 H new ATOM 0 HG3 ARG A 134 -9.459 -4.543 -2.475 1.00 1.06 H new ATOM 0 HD2 ARG A 134 -10.254 -6.587 -3.220 1.00 1.37 H new ATOM 0 HD3 ARG A 134 -9.283 -7.233 -1.912 1.00 1.37 H new ATOM 0 HE ARG A 134 -11.731 -6.605 -0.655 1.00 1.86 H new ATOM 0 HH11 ARG A 134 -10.627 -8.443 -3.416 1.00 2.83 H new ATOM 0 HH12 ARG A 134 -11.954 -9.606 -3.328 1.00 2.83 H new ATOM 0 HH21 ARG A 134 -13.431 -8.086 -0.549 1.00 3.36 H new ATOM 0 HH22 ARG A 134 -13.528 -9.406 -1.719 1.00 3.36 H new ATOM 1273 N TYR A 135 -8.012 -7.614 1.949 1.00 0.41 N ATOM 1274 CA TYR A 135 -6.848 -8.087 2.757 1.00 0.39 C ATOM 1275 C TYR A 135 -5.719 -8.516 1.805 1.00 0.36 C ATOM 1276 O TYR A 135 -5.980 -8.965 0.704 1.00 0.39 O ATOM 1277 CB TYR A 135 -7.274 -9.289 3.608 1.00 0.46 C ATOM 1278 CG TYR A 135 -8.255 -8.838 4.666 1.00 0.50 C ATOM 1279 CD1 TYR A 135 -9.576 -8.541 4.313 1.00 0.72 C ATOM 1280 CD2 TYR A 135 -7.845 -8.722 6.000 1.00 0.66 C ATOM 1281 CE1 TYR A 135 -10.487 -8.127 5.292 1.00 0.91 C ATOM 1282 CE2 TYR A 135 -8.755 -8.308 6.979 1.00 0.85 C ATOM 1283 CZ TYR A 135 -10.077 -8.011 6.626 1.00 0.92 C ATOM 1284 OH TYR A 135 -10.974 -7.602 7.591 1.00 1.17 O ATOM 0 H TYR A 135 -8.711 -8.327 1.741 1.00 0.41 H new ATOM 0 HA TYR A 135 -6.501 -7.284 3.408 1.00 0.39 H new ATOM 0 HB2 TYR A 135 -7.730 -10.052 2.976 1.00 0.46 H new ATOM 0 HB3 TYR A 135 -6.401 -9.743 4.077 1.00 0.46 H new ATOM 0 HD1 TYR A 135 -9.893 -8.631 3.285 1.00 0.72 H new ATOM 0 HD2 TYR A 135 -6.826 -8.952 6.273 1.00 0.66 H new ATOM 0 HE1 TYR A 135 -11.506 -7.897 5.018 1.00 0.91 H new ATOM 0 HE2 TYR A 135 -8.438 -8.218 8.007 1.00 0.85 H new ATOM 0 HH TYR A 135 -10.527 -7.576 8.463 1.00 1.17 H new ATOM 1294 N PRO A 136 -4.474 -8.389 2.211 1.00 0.37 N ATOM 1295 CA PRO A 136 -3.311 -8.784 1.357 1.00 0.38 C ATOM 1296 C PRO A 136 -3.105 -10.303 1.324 1.00 0.37 C ATOM 1297 O PRO A 136 -2.965 -10.943 2.346 1.00 0.38 O ATOM 1298 CB PRO A 136 -2.128 -8.091 2.042 1.00 0.42 C ATOM 1299 CG PRO A 136 -2.506 -8.051 3.486 1.00 0.51 C ATOM 1300 CD PRO A 136 -4.027 -7.858 3.515 1.00 0.44 C ATOM 0 HA PRO A 136 -3.446 -8.497 0.314 1.00 0.38 H new ATOM 0 HB2 PRO A 136 -1.201 -8.644 1.889 1.00 0.42 H new ATOM 0 HB3 PRO A 136 -1.971 -7.088 1.645 1.00 0.42 H new ATOM 0 HG2 PRO A 136 -2.219 -8.974 3.991 1.00 0.51 H new ATOM 0 HG3 PRO A 136 -1.998 -7.235 4.001 1.00 0.51 H new ATOM 0 HD2 PRO A 136 -4.483 -8.398 4.345 1.00 0.44 H new ATOM 0 HD3 PRO A 136 -4.295 -6.808 3.633 1.00 0.44 H new ATOM 1308 N LEU A 137 -3.081 -10.881 0.154 1.00 0.40 N ATOM 1309 CA LEU A 137 -2.877 -12.355 0.055 1.00 0.43 C ATOM 1310 C LEU A 137 -1.494 -12.708 0.614 1.00 0.41 C ATOM 1311 O LEU A 137 -1.351 -13.604 1.423 1.00 0.38 O ATOM 1312 CB LEU A 137 -2.967 -12.784 -1.417 1.00 0.51 C ATOM 1313 CG LEU A 137 -4.444 -12.865 -1.861 1.00 0.59 C ATOM 1314 CD1 LEU A 137 -4.536 -12.683 -3.381 1.00 0.64 C ATOM 1315 CD2 LEU A 137 -5.038 -14.233 -1.485 1.00 0.92 C ATOM 0 H LEU A 137 -3.194 -10.397 -0.737 1.00 0.40 H new ATOM 0 HA LEU A 137 -3.645 -12.875 0.628 1.00 0.43 H new ATOM 0 HB2 LEU A 137 -2.430 -12.072 -2.044 1.00 0.51 H new ATOM 0 HB3 LEU A 137 -2.486 -13.753 -1.551 1.00 0.51 H new ATOM 0 HG LEU A 137 -5.004 -12.077 -1.357 1.00 0.59 H new ATOM 0 HD11 LEU A 137 -5.579 -12.741 -3.692 1.00 0.64 H new ATOM 0 HD12 LEU A 137 -4.128 -11.710 -3.656 1.00 0.64 H new ATOM 0 HD13 LEU A 137 -3.966 -13.469 -3.877 1.00 0.64 H new ATOM 0 HD21 LEU A 137 -6.080 -14.277 -1.803 1.00 0.92 H new ATOM 0 HD22 LEU A 137 -4.473 -15.023 -1.980 1.00 0.92 H new ATOM 0 HD23 LEU A 137 -4.983 -14.369 -0.405 1.00 0.92 H new ATOM 1327 N THR A 138 -0.475 -12.012 0.185 1.00 0.50 N ATOM 1328 CA THR A 138 0.897 -12.308 0.689 1.00 0.55 C ATOM 1329 C THR A 138 0.982 -11.966 2.178 1.00 0.47 C ATOM 1330 O THR A 138 0.266 -11.121 2.678 1.00 0.50 O ATOM 1331 CB THR A 138 1.927 -11.476 -0.098 1.00 0.73 C ATOM 1332 OG1 THR A 138 1.355 -10.222 -0.441 1.00 0.98 O ATOM 1333 CG2 THR A 138 2.330 -12.218 -1.374 1.00 1.04 C ATOM 0 H THR A 138 -0.534 -11.252 -0.492 1.00 0.50 H new ATOM 0 HA THR A 138 1.113 -13.368 0.552 1.00 0.55 H new ATOM 0 HB THR A 138 2.811 -11.320 0.520 1.00 0.73 H new ATOM 0 HG1 THR A 138 1.790 -9.874 -1.247 1.00 0.98 H new ATOM 0 HG21 THR A 138 3.059 -11.624 -1.926 1.00 1.04 H new ATOM 0 HG22 THR A 138 2.770 -13.180 -1.112 1.00 1.04 H new ATOM 0 HG23 THR A 138 1.449 -12.379 -1.995 1.00 1.04 H new ATOM 1341 N PHE A 139 1.861 -12.623 2.887 1.00 0.51 N ATOM 1342 CA PHE A 139 2.017 -12.359 4.351 1.00 0.49 C ATOM 1343 C PHE A 139 3.210 -11.426 4.578 1.00 0.65 C ATOM 1344 O PHE A 139 4.055 -11.262 3.722 1.00 1.43 O ATOM 1345 CB PHE A 139 2.254 -13.689 5.075 1.00 0.52 C ATOM 1346 CG PHE A 139 2.156 -13.493 6.575 1.00 0.50 C ATOM 1347 CD1 PHE A 139 0.943 -13.097 7.154 1.00 0.67 C ATOM 1348 CD2 PHE A 139 3.276 -13.715 7.389 1.00 0.59 C ATOM 1349 CE1 PHE A 139 0.851 -12.921 8.541 1.00 0.77 C ATOM 1350 CE2 PHE A 139 3.183 -13.540 8.775 1.00 0.62 C ATOM 1351 CZ PHE A 139 1.971 -13.144 9.351 1.00 0.66 C ATOM 0 H PHE A 139 2.484 -13.338 2.512 1.00 0.51 H new ATOM 0 HA PHE A 139 1.115 -11.886 4.740 1.00 0.49 H new ATOM 0 HB2 PHE A 139 1.520 -14.425 4.748 1.00 0.52 H new ATOM 0 HB3 PHE A 139 3.237 -14.083 4.816 1.00 0.52 H new ATOM 0 HD1 PHE A 139 0.078 -12.927 6.530 1.00 0.67 H new ATOM 0 HD2 PHE A 139 4.212 -14.022 6.946 1.00 0.59 H new ATOM 0 HE1 PHE A 139 -0.084 -12.613 8.985 1.00 0.77 H new ATOM 0 HE2 PHE A 139 4.047 -13.711 9.400 1.00 0.62 H new ATOM 0 HZ PHE A 139 1.899 -13.010 10.420 1.00 0.66 H new ATOM 1361 N GLY A 140 3.283 -10.810 5.728 1.00 0.46 N ATOM 1362 CA GLY A 140 4.418 -9.882 6.023 1.00 0.43 C ATOM 1363 C GLY A 140 3.981 -8.444 5.753 1.00 0.35 C ATOM 1364 O GLY A 140 4.308 -7.536 6.491 1.00 0.32 O ATOM 0 H GLY A 140 2.602 -10.909 6.481 1.00 0.46 H new ATOM 0 HA2 GLY A 140 4.730 -9.990 7.062 1.00 0.43 H new ATOM 0 HA3 GLY A 140 5.279 -10.134 5.404 1.00 0.43 H new ATOM 1368 N TRP A 141 3.239 -8.232 4.703 1.00 0.34 N ATOM 1369 CA TRP A 141 2.772 -6.851 4.386 1.00 0.29 C ATOM 1370 C TRP A 141 1.621 -6.501 5.325 1.00 0.32 C ATOM 1371 O TRP A 141 0.483 -6.867 5.105 1.00 0.40 O ATOM 1372 CB TRP A 141 2.332 -6.800 2.916 1.00 0.33 C ATOM 1373 CG TRP A 141 2.086 -5.391 2.442 1.00 0.31 C ATOM 1374 CD1 TRP A 141 0.963 -5.005 1.793 1.00 0.35 C ATOM 1375 CD2 TRP A 141 2.940 -4.194 2.518 1.00 0.28 C ATOM 1376 NE1 TRP A 141 1.062 -3.667 1.470 1.00 0.33 N ATOM 1377 CE2 TRP A 141 2.254 -3.120 1.892 1.00 0.30 C ATOM 1378 CE3 TRP A 141 4.218 -3.923 3.060 1.00 0.28 C ATOM 1379 CZ2 TRP A 141 2.806 -1.843 1.803 1.00 0.32 C ATOM 1380 CZ3 TRP A 141 4.773 -2.634 2.970 1.00 0.31 C ATOM 1381 CH2 TRP A 141 4.069 -1.599 2.342 1.00 0.33 C ATOM 0 H TRP A 141 2.935 -8.954 4.050 1.00 0.34 H new ATOM 0 HA TRP A 141 3.571 -6.123 4.528 1.00 0.29 H new ATOM 0 HB2 TRP A 141 3.098 -7.262 2.293 1.00 0.33 H new ATOM 0 HB3 TRP A 141 1.422 -7.387 2.791 1.00 0.33 H new ATOM 0 HD1 TRP A 141 0.122 -5.643 1.564 1.00 0.35 H new ATOM 0 HE1 TRP A 141 0.338 -3.145 0.977 1.00 0.33 H new ATOM 0 HE3 TRP A 141 4.772 -4.712 3.547 1.00 0.28 H new ATOM 0 HZ2 TRP A 141 2.259 -1.047 1.319 1.00 0.32 H new ATOM 0 HZ3 TRP A 141 5.750 -2.441 3.388 1.00 0.31 H new ATOM 0 HH2 TRP A 141 4.504 -0.613 2.275 1.00 0.33 H new ATOM 1392 N CYS A 142 1.929 -5.819 6.394 1.00 0.31 N ATOM 1393 CA CYS A 142 0.891 -5.460 7.393 1.00 0.40 C ATOM 1394 C CYS A 142 0.054 -4.272 6.901 1.00 0.39 C ATOM 1395 O CYS A 142 -0.254 -3.368 7.653 1.00 0.48 O ATOM 1396 CB CYS A 142 1.604 -5.103 8.702 1.00 0.47 C ATOM 1397 SG CYS A 142 3.223 -4.380 8.333 1.00 1.45 S ATOM 0 H CYS A 142 2.869 -5.492 6.618 1.00 0.31 H new ATOM 0 HA CYS A 142 0.213 -6.299 7.546 1.00 0.40 H new ATOM 0 HB2 CYS A 142 1.002 -4.398 9.276 1.00 0.47 H new ATOM 0 HB3 CYS A 142 1.724 -5.995 9.318 1.00 0.47 H new ATOM 0 HG CYS A 142 3.250 -3.145 8.739 1.00 1.45 H new ATOM 1403 N TYR A 143 -0.318 -4.266 5.651 1.00 0.38 N ATOM 1404 CA TYR A 143 -1.141 -3.136 5.108 1.00 0.40 C ATOM 1405 C TYR A 143 -2.416 -3.696 4.471 1.00 0.43 C ATOM 1406 O TYR A 143 -2.368 -4.498 3.560 1.00 0.65 O ATOM 1407 CB TYR A 143 -0.306 -2.379 4.054 1.00 0.55 C ATOM 1408 CG TYR A 143 0.264 -1.107 4.649 1.00 1.43 C ATOM 1409 CD1 TYR A 143 -0.604 -0.120 5.124 1.00 2.16 C ATOM 1410 CD2 TYR A 143 1.651 -0.917 4.726 1.00 2.17 C ATOM 1411 CE1 TYR A 143 -0.092 1.056 5.676 1.00 3.14 C ATOM 1412 CE2 TYR A 143 2.164 0.262 5.280 1.00 3.14 C ATOM 1413 CZ TYR A 143 1.291 1.249 5.755 1.00 3.52 C ATOM 1414 OH TYR A 143 1.794 2.410 6.305 1.00 4.57 O ATOM 0 H TYR A 143 -0.089 -4.995 4.976 1.00 0.38 H new ATOM 0 HA TYR A 143 -1.421 -2.452 5.909 1.00 0.40 H new ATOM 0 HB2 TYR A 143 0.503 -3.015 3.696 1.00 0.55 H new ATOM 0 HB3 TYR A 143 -0.928 -2.138 3.192 1.00 0.55 H new ATOM 0 HD1 TYR A 143 -1.672 -0.267 5.064 1.00 2.16 H new ATOM 0 HD2 TYR A 143 2.323 -1.679 4.359 1.00 2.17 H new ATOM 0 HE1 TYR A 143 -0.765 1.817 6.042 1.00 3.14 H new ATOM 0 HE2 TYR A 143 3.232 0.410 5.341 1.00 3.14 H new ATOM 0 HH TYR A 143 2.773 2.384 6.284 1.00 4.57 H new ATOM 1424 N LYS A 144 -3.554 -3.257 4.943 1.00 0.39 N ATOM 1425 CA LYS A 144 -4.857 -3.729 4.375 1.00 0.51 C ATOM 1426 C LYS A 144 -5.722 -2.508 4.059 1.00 0.43 C ATOM 1427 O LYS A 144 -5.861 -1.610 4.864 1.00 0.45 O ATOM 1428 CB LYS A 144 -5.561 -4.638 5.392 1.00 0.70 C ATOM 1429 CG LYS A 144 -6.051 -3.823 6.596 1.00 1.21 C ATOM 1430 CD LYS A 144 -6.583 -4.766 7.689 1.00 1.24 C ATOM 1431 CE LYS A 144 -5.447 -5.605 8.304 1.00 1.57 C ATOM 1432 NZ LYS A 144 -4.190 -4.806 8.371 1.00 2.32 N ATOM 0 H LYS A 144 -3.639 -2.585 5.705 1.00 0.39 H new ATOM 0 HA LYS A 144 -4.688 -4.299 3.462 1.00 0.51 H new ATOM 0 HB2 LYS A 144 -6.405 -5.139 4.917 1.00 0.70 H new ATOM 0 HB3 LYS A 144 -4.876 -5.417 5.728 1.00 0.70 H new ATOM 0 HG2 LYS A 144 -5.236 -3.218 6.992 1.00 1.21 H new ATOM 0 HG3 LYS A 144 -6.837 -3.135 6.284 1.00 1.21 H new ATOM 0 HD2 LYS A 144 -7.071 -4.183 8.470 1.00 1.24 H new ATOM 0 HD3 LYS A 144 -7.339 -5.428 7.266 1.00 1.24 H new ATOM 0 HE2 LYS A 144 -5.730 -5.935 9.304 1.00 1.57 H new ATOM 0 HE3 LYS A 144 -5.284 -6.502 7.707 1.00 1.57 H new ATOM 0 HZ1 LYS A 144 -3.495 -5.302 8.965 1.00 2.32 H new ATOM 0 HZ2 LYS A 144 -3.804 -4.685 7.413 1.00 2.32 H new ATOM 0 HZ3 LYS A 144 -4.393 -3.873 8.782 1.00 2.32 H new ATOM 1446 N LEU A 145 -6.293 -2.454 2.885 1.00 0.40 N ATOM 1447 CA LEU A 145 -7.135 -1.277 2.529 1.00 0.37 C ATOM 1448 C LEU A 145 -8.508 -1.407 3.196 1.00 0.38 C ATOM 1449 O LEU A 145 -8.955 -2.494 3.514 1.00 0.41 O ATOM 1450 CB LEU A 145 -7.288 -1.195 1.004 1.00 0.42 C ATOM 1451 CG LEU A 145 -5.931 -0.831 0.354 1.00 0.50 C ATOM 1452 CD1 LEU A 145 -5.886 -1.352 -1.086 1.00 0.63 C ATOM 1453 CD2 LEU A 145 -5.743 0.695 0.334 1.00 0.52 C ATOM 0 H LEU A 145 -6.213 -3.169 2.162 1.00 0.40 H new ATOM 0 HA LEU A 145 -6.656 -0.364 2.884 1.00 0.37 H new ATOM 0 HB2 LEU A 145 -7.643 -2.149 0.614 1.00 0.42 H new ATOM 0 HB3 LEU A 145 -8.037 -0.446 0.745 1.00 0.42 H new ATOM 0 HG LEU A 145 -5.134 -1.289 0.940 1.00 0.50 H new ATOM 0 HD11 LEU A 145 -4.928 -1.092 -1.537 1.00 0.63 H new ATOM 0 HD12 LEU A 145 -6.005 -2.436 -1.085 1.00 0.63 H new ATOM 0 HD13 LEU A 145 -6.693 -0.899 -1.662 1.00 0.63 H new ATOM 0 HD21 LEU A 145 -4.785 0.938 -0.126 1.00 0.52 H new ATOM 0 HD22 LEU A 145 -6.548 1.153 -0.241 1.00 0.52 H new ATOM 0 HD23 LEU A 145 -5.763 1.077 1.354 1.00 0.52 H new ATOM 1465 N VAL A 146 -9.174 -0.303 3.414 1.00 0.43 N ATOM 1466 CA VAL A 146 -10.511 -0.345 4.078 1.00 0.50 C ATOM 1467 C VAL A 146 -11.271 0.958 3.753 1.00 0.59 C ATOM 1468 O VAL A 146 -10.750 2.036 3.965 1.00 0.63 O ATOM 1469 CB VAL A 146 -10.297 -0.419 5.606 1.00 0.56 C ATOM 1470 CG1 VAL A 146 -11.613 -0.145 6.349 1.00 0.68 C ATOM 1471 CG2 VAL A 146 -9.775 -1.805 6.004 1.00 0.56 C ATOM 0 H VAL A 146 -8.848 0.630 3.160 1.00 0.43 H new ATOM 0 HA VAL A 146 -11.078 -1.208 3.728 1.00 0.50 H new ATOM 0 HB VAL A 146 -9.564 0.339 5.881 1.00 0.56 H new ATOM 0 HG11 VAL A 146 -11.442 -0.201 7.424 1.00 0.68 H new ATOM 0 HG12 VAL A 146 -11.976 0.850 6.091 1.00 0.68 H new ATOM 0 HG13 VAL A 146 -12.356 -0.889 6.060 1.00 0.68 H new ATOM 0 HG21 VAL A 146 -9.629 -1.843 7.083 1.00 0.56 H new ATOM 0 HG22 VAL A 146 -10.499 -2.565 5.709 1.00 0.56 H new ATOM 0 HG23 VAL A 146 -8.826 -1.994 5.503 1.00 0.56 H new ATOM 1481 N PRO A 147 -12.496 0.884 3.269 1.00 0.68 N ATOM 1482 CA PRO A 147 -13.293 2.107 2.964 1.00 0.81 C ATOM 1483 C PRO A 147 -13.872 2.721 4.245 1.00 0.91 C ATOM 1484 O PRO A 147 -14.344 2.018 5.117 1.00 1.12 O ATOM 1485 CB PRO A 147 -14.407 1.590 2.047 1.00 0.87 C ATOM 1486 CG PRO A 147 -14.623 0.175 2.479 1.00 0.97 C ATOM 1487 CD PRO A 147 -13.257 -0.345 2.951 1.00 0.75 C ATOM 0 HA PRO A 147 -12.699 2.897 2.504 1.00 0.81 H new ATOM 0 HB2 PRO A 147 -15.316 2.181 2.156 1.00 0.87 H new ATOM 0 HB3 PRO A 147 -14.115 1.644 0.998 1.00 0.87 H new ATOM 0 HG2 PRO A 147 -15.358 0.122 3.282 1.00 0.97 H new ATOM 0 HG3 PRO A 147 -15.006 -0.429 1.656 1.00 0.97 H new ATOM 0 HD2 PRO A 147 -13.356 -0.990 3.824 1.00 0.75 H new ATOM 0 HD3 PRO A 147 -12.763 -0.931 2.176 1.00 0.75 H new ATOM 1495 N VAL A 148 -13.835 4.018 4.374 1.00 1.17 N ATOM 1496 CA VAL A 148 -14.375 4.655 5.604 1.00 1.29 C ATOM 1497 C VAL A 148 -15.886 4.807 5.468 1.00 1.32 C ATOM 1498 O VAL A 148 -16.586 3.895 5.075 1.00 1.88 O ATOM 1499 CB VAL A 148 -13.713 6.031 5.792 1.00 1.89 C ATOM 1500 CG1 VAL A 148 -13.813 6.465 7.260 1.00 2.07 C ATOM 1501 CG2 VAL A 148 -12.238 5.939 5.396 1.00 2.31 C ATOM 0 H VAL A 148 -13.454 4.662 3.681 1.00 1.17 H new ATOM 0 HA VAL A 148 -14.159 4.035 6.474 1.00 1.29 H new ATOM 0 HB VAL A 148 -14.223 6.762 5.165 1.00 1.89 H new ATOM 0 HG11 VAL A 148 -13.342 7.440 7.384 1.00 2.07 H new ATOM 0 HG12 VAL A 148 -14.862 6.529 7.550 1.00 2.07 H new ATOM 0 HG13 VAL A 148 -13.306 5.734 7.891 1.00 2.07 H new ATOM 0 HG21 VAL A 148 -11.765 6.912 5.528 1.00 2.31 H new ATOM 0 HG22 VAL A 148 -11.737 5.204 6.026 1.00 2.31 H new ATOM 0 HG23 VAL A 148 -12.160 5.636 4.352 1.00 2.31 H new ATOM 1511 N GLU A 149 -16.386 5.951 5.797 1.00 1.71 N ATOM 1512 CA GLU A 149 -17.855 6.189 5.705 1.00 2.15 C ATOM 1513 C GLU A 149 -18.267 6.277 4.228 1.00 2.52 C ATOM 1514 O GLU A 149 -17.482 6.674 3.390 1.00 2.96 O ATOM 1515 CB GLU A 149 -18.196 7.506 6.413 1.00 3.00 C ATOM 1516 CG GLU A 149 -18.180 7.298 7.932 1.00 3.61 C ATOM 1517 CD GLU A 149 -19.469 6.600 8.373 1.00 4.55 C ATOM 1518 OE1 GLU A 149 -19.540 5.390 8.241 1.00 5.02 O ATOM 1519 OE2 GLU A 149 -20.364 7.290 8.834 1.00 5.12 O ATOM 0 H GLU A 149 -15.841 6.746 6.131 1.00 1.71 H new ATOM 0 HA GLU A 149 -18.392 5.368 6.181 1.00 2.15 H new ATOM 0 HB2 GLU A 149 -17.477 8.276 6.135 1.00 3.00 H new ATOM 0 HB3 GLU A 149 -19.178 7.857 6.095 1.00 3.00 H new ATOM 0 HG2 GLU A 149 -17.315 6.699 8.217 1.00 3.61 H new ATOM 0 HG3 GLU A 149 -18.084 8.258 8.439 1.00 3.61 H new ATOM 1526 N PRO A 150 -19.490 5.921 3.903 1.00 3.13 N ATOM 1527 CA PRO A 150 -19.991 5.981 2.497 1.00 4.08 C ATOM 1528 C PRO A 150 -20.260 7.425 2.054 1.00 4.33 C ATOM 1529 O PRO A 150 -19.765 8.364 2.645 1.00 4.84 O ATOM 1530 CB PRO A 150 -21.292 5.169 2.547 1.00 4.93 C ATOM 1531 CG PRO A 150 -21.784 5.335 3.948 1.00 4.81 C ATOM 1532 CD PRO A 150 -20.532 5.425 4.826 1.00 3.63 C ATOM 0 HA PRO A 150 -19.270 5.591 1.779 1.00 4.08 H new ATOM 0 HB2 PRO A 150 -22.019 5.540 1.825 1.00 4.93 H new ATOM 0 HB3 PRO A 150 -21.114 4.120 2.311 1.00 4.93 H new ATOM 0 HG2 PRO A 150 -22.393 6.234 4.044 1.00 4.81 H new ATOM 0 HG3 PRO A 150 -22.409 4.493 4.245 1.00 4.81 H new ATOM 0 HD2 PRO A 150 -20.680 6.105 5.665 1.00 3.63 H new ATOM 0 HD3 PRO A 150 -20.266 4.454 5.245 1.00 3.63 H new ATOM 1540 N GLU A 151 -21.045 7.614 1.029 1.00 4.44 N ATOM 1541 CA GLU A 151 -21.337 9.001 0.574 1.00 5.08 C ATOM 1542 C GLU A 151 -21.972 9.774 1.729 1.00 5.48 C ATOM 1543 O GLU A 151 -23.010 9.405 2.239 1.00 5.61 O ATOM 1544 CB GLU A 151 -22.302 8.970 -0.611 1.00 5.57 C ATOM 1545 CG GLU A 151 -22.386 10.365 -1.234 1.00 5.87 C ATOM 1546 CD GLU A 151 -23.522 10.401 -2.258 1.00 6.47 C ATOM 1547 OE1 GLU A 151 -23.377 9.776 -3.295 1.00 6.74 O ATOM 1548 OE2 GLU A 151 -24.516 11.056 -1.988 1.00 6.96 O ATOM 0 H GLU A 151 -21.494 6.873 0.491 1.00 4.44 H new ATOM 0 HA GLU A 151 -20.412 9.486 0.263 1.00 5.08 H new ATOM 0 HB2 GLU A 151 -21.961 8.248 -1.353 1.00 5.57 H new ATOM 0 HB3 GLU A 151 -23.289 8.647 -0.282 1.00 5.57 H new ATOM 0 HG2 GLU A 151 -22.558 11.111 -0.458 1.00 5.87 H new ATOM 0 HG3 GLU A 151 -21.441 10.617 -1.715 1.00 5.87 H new ATOM 1555 N LYS A 152 -21.354 10.843 2.151 1.00 6.06 N ATOM 1556 CA LYS A 152 -21.918 11.636 3.278 1.00 6.80 C ATOM 1557 C LYS A 152 -22.966 12.611 2.741 1.00 7.18 C ATOM 1558 O LYS A 152 -23.941 12.220 2.132 1.00 7.59 O ATOM 1559 CB LYS A 152 -20.790 12.414 3.973 1.00 7.59 C ATOM 1560 CG LYS A 152 -19.962 13.217 2.936 1.00 7.87 C ATOM 1561 CD LYS A 152 -18.667 12.467 2.583 1.00 8.73 C ATOM 1562 CE LYS A 152 -17.980 13.158 1.402 1.00 9.22 C ATOM 1563 NZ LYS A 152 -17.452 14.478 1.843 1.00 9.63 N ATOM 0 H LYS A 152 -20.481 11.201 1.763 1.00 6.06 H new ATOM 0 HA LYS A 152 -22.387 10.965 3.998 1.00 6.80 H new ATOM 0 HB2 LYS A 152 -21.212 13.093 4.714 1.00 7.59 H new ATOM 0 HB3 LYS A 152 -20.140 11.722 4.508 1.00 7.59 H new ATOM 0 HG2 LYS A 152 -20.554 13.377 2.035 1.00 7.87 H new ATOM 0 HG3 LYS A 152 -19.721 14.201 3.338 1.00 7.87 H new ATOM 0 HD2 LYS A 152 -18.000 12.447 3.445 1.00 8.73 H new ATOM 0 HD3 LYS A 152 -18.892 11.431 2.331 1.00 8.73 H new ATOM 0 HE2 LYS A 152 -17.168 12.536 1.025 1.00 9.22 H new ATOM 0 HE3 LYS A 152 -18.687 13.291 0.583 1.00 9.22 H new ATOM 0 HZ1 LYS A 152 -16.870 14.890 1.086 1.00 9.63 H new ATOM 0 HZ2 LYS A 152 -18.245 15.116 2.055 1.00 9.63 H new ATOM 0 HZ3 LYS A 152 -16.871 14.352 2.697 1.00 9.63 H new ATOM 1577 N LEU A 153 -22.772 13.878 2.967 1.00 7.34 N ATOM 1578 CA LEU A 153 -23.754 14.889 2.476 1.00 7.98 C ATOM 1579 C LEU A 153 -23.448 15.234 1.015 1.00 8.11 C ATOM 1580 O LEU A 153 -22.641 14.594 0.369 1.00 8.31 O ATOM 1581 CB LEU A 153 -23.654 16.154 3.341 1.00 8.45 C ATOM 1582 CG LEU A 153 -24.426 15.953 4.651 1.00 8.93 C ATOM 1583 CD1 LEU A 153 -23.984 14.650 5.321 1.00 9.23 C ATOM 1584 CD2 LEU A 153 -24.143 17.126 5.592 1.00 9.46 C ATOM 0 H LEU A 153 -21.973 14.261 3.472 1.00 7.34 H new ATOM 0 HA LEU A 153 -24.763 14.483 2.543 1.00 7.98 H new ATOM 0 HB2 LEU A 153 -22.609 16.377 3.555 1.00 8.45 H new ATOM 0 HB3 LEU A 153 -24.057 17.009 2.798 1.00 8.45 H new ATOM 0 HG LEU A 153 -25.493 15.903 4.434 1.00 8.93 H new ATOM 0 HD11 LEU A 153 -24.536 14.513 6.251 1.00 9.23 H new ATOM 0 HD12 LEU A 153 -24.184 13.812 4.654 1.00 9.23 H new ATOM 0 HD13 LEU A 153 -22.916 14.696 5.536 1.00 9.23 H new ATOM 0 HD21 LEU A 153 -24.691 16.985 6.524 1.00 9.46 H new ATOM 0 HD22 LEU A 153 -23.075 17.174 5.803 1.00 9.46 H new ATOM 0 HD23 LEU A 153 -24.462 18.056 5.121 1.00 9.46 H new ATOM 1596 N GLU A 154 -24.087 16.245 0.494 1.00 8.27 N ATOM 1597 CA GLU A 154 -23.841 16.640 -0.921 1.00 8.64 C ATOM 1598 C GLU A 154 -24.387 18.051 -1.147 1.00 8.97 C ATOM 1599 O GLU A 154 -25.580 18.279 -1.104 1.00 9.31 O ATOM 1600 CB GLU A 154 -24.553 15.659 -1.857 1.00 9.08 C ATOM 1601 CG GLU A 154 -24.022 15.832 -3.282 1.00 9.38 C ATOM 1602 CD GLU A 154 -24.950 15.115 -4.265 1.00 9.91 C ATOM 1603 OE1 GLU A 154 -25.670 14.230 -3.832 1.00 10.25 O ATOM 1604 OE2 GLU A 154 -24.926 15.463 -5.433 1.00 10.18 O ATOM 0 H GLU A 154 -24.771 16.816 0.990 1.00 8.27 H new ATOM 0 HA GLU A 154 -22.771 16.622 -1.128 1.00 8.64 H new ATOM 0 HB2 GLU A 154 -24.391 14.635 -1.519 1.00 9.08 H new ATOM 0 HB3 GLU A 154 -25.628 15.835 -1.835 1.00 9.08 H new ATOM 0 HG2 GLU A 154 -23.959 16.891 -3.532 1.00 9.38 H new ATOM 0 HG3 GLU A 154 -23.013 15.427 -3.357 1.00 9.38 H new ATOM 1611 N GLU A 155 -23.525 19.001 -1.381 1.00 9.09 N ATOM 1612 CA GLU A 155 -23.999 20.397 -1.602 1.00 9.60 C ATOM 1613 C GLU A 155 -22.868 21.236 -2.200 1.00 9.70 C ATOM 1614 O GLU A 155 -23.084 22.058 -3.069 1.00 10.09 O ATOM 1615 CB GLU A 155 -24.429 21.003 -0.263 1.00 10.07 C ATOM 1616 CG GLU A 155 -25.189 22.308 -0.510 1.00 10.61 C ATOM 1617 CD GLU A 155 -26.569 21.995 -1.090 1.00 11.03 C ATOM 1618 OE1 GLU A 155 -27.216 21.097 -0.577 1.00 11.33 O ATOM 1619 OE2 GLU A 155 -26.956 22.659 -2.039 1.00 11.24 O ATOM 0 H GLU A 155 -22.514 18.872 -1.429 1.00 9.09 H new ATOM 0 HA GLU A 155 -24.844 20.389 -2.290 1.00 9.60 H new ATOM 0 HB2 GLU A 155 -25.061 20.300 0.280 1.00 10.07 H new ATOM 0 HB3 GLU A 155 -23.555 21.192 0.360 1.00 10.07 H new ATOM 0 HG2 GLU A 155 -25.292 22.863 0.423 1.00 10.61 H new ATOM 0 HG3 GLU A 155 -24.629 22.942 -1.198 1.00 10.61 H new ATOM 1626 N ALA A 156 -21.663 21.038 -1.740 1.00 9.56 N ATOM 1627 CA ALA A 156 -20.518 21.827 -2.279 1.00 9.82 C ATOM 1628 C ALA A 156 -20.197 21.362 -3.702 1.00 9.59 C ATOM 1629 O ALA A 156 -21.037 20.824 -4.395 1.00 9.64 O ATOM 1630 CB ALA A 156 -19.292 21.621 -1.387 1.00 9.95 C ATOM 0 H ALA A 156 -21.421 20.364 -1.014 1.00 9.56 H new ATOM 0 HA ALA A 156 -20.784 22.884 -2.295 1.00 9.82 H new ATOM 0 HB1 ALA A 156 -18.455 22.197 -1.780 1.00 9.95 H new ATOM 0 HB2 ALA A 156 -19.518 21.955 -0.374 1.00 9.95 H new ATOM 0 HB3 ALA A 156 -19.028 20.564 -1.370 1.00 9.95 H new ATOM 1636 N ASN A 157 -18.985 21.568 -4.140 1.00 9.56 N ATOM 1637 CA ASN A 157 -18.604 21.141 -5.516 1.00 9.52 C ATOM 1638 C ASN A 157 -17.088 21.266 -5.685 1.00 9.04 C ATOM 1639 O ASN A 157 -16.604 22.059 -6.469 1.00 9.05 O ATOM 1640 CB ASN A 157 -19.308 22.034 -6.541 1.00 10.08 C ATOM 1641 CG ASN A 157 -18.974 21.554 -7.954 1.00 10.54 C ATOM 1642 OD1 ASN A 157 -18.463 20.363 -8.122 1.00 10.93 O flip ATOM 1643 ND2 ASN A 157 -19.179 22.267 -8.915 1.00 10.75 N flip ATOM 0 H ASN A 157 -18.241 22.014 -3.603 1.00 9.56 H new ATOM 0 HA ASN A 157 -18.904 20.105 -5.672 1.00 9.52 H new ATOM 0 HB2 ASN A 157 -20.386 22.007 -6.382 1.00 10.08 H new ATOM 0 HB3 ASN A 157 -18.993 23.070 -6.414 1.00 10.08 H new ATOM 0 HD21 ASN A 157 -19.578 23.197 -8.784 1.00 10.75 H new ATOM 0 HD22 ASN A 157 -18.952 21.936 -9.853 1.00 10.75 H new ATOM 1650 N LYS A 158 -16.335 20.492 -4.952 1.00 8.83 N ATOM 1651 CA LYS A 158 -14.851 20.567 -5.066 1.00 8.52 C ATOM 1652 C LYS A 158 -14.414 20.047 -6.438 1.00 8.03 C ATOM 1653 O LYS A 158 -15.227 19.687 -7.265 1.00 8.18 O ATOM 1654 CB LYS A 158 -14.209 19.703 -3.977 1.00 8.88 C ATOM 1655 CG LYS A 158 -14.580 20.248 -2.598 1.00 9.31 C ATOM 1656 CD LYS A 158 -14.183 19.228 -1.529 1.00 9.87 C ATOM 1657 CE LYS A 158 -14.294 19.864 -0.142 1.00 10.59 C ATOM 1658 NZ LYS A 158 -14.013 18.835 0.900 1.00 10.96 N ATOM 0 H LYS A 158 -16.684 19.810 -4.278 1.00 8.83 H new ATOM 0 HA LYS A 158 -14.535 21.603 -4.948 1.00 8.52 H new ATOM 0 HB2 LYS A 158 -14.546 18.671 -4.073 1.00 8.88 H new ATOM 0 HB3 LYS A 158 -13.126 19.697 -4.096 1.00 8.88 H new ATOM 0 HG2 LYS A 158 -14.072 21.196 -2.420 1.00 9.31 H new ATOM 0 HG3 LYS A 158 -15.651 20.446 -2.548 1.00 9.31 H new ATOM 0 HD2 LYS A 158 -14.829 18.352 -1.591 1.00 9.87 H new ATOM 0 HD3 LYS A 158 -13.163 18.885 -1.701 1.00 9.87 H new ATOM 0 HE2 LYS A 158 -13.589 20.691 -0.052 1.00 10.59 H new ATOM 0 HE3 LYS A 158 -15.292 20.279 0.001 1.00 10.59 H new ATOM 0 HZ1 LYS A 158 -14.088 19.267 1.843 1.00 10.96 H new ATOM 0 HZ2 LYS A 158 -14.702 18.060 0.818 1.00 10.96 H new ATOM 0 HZ3 LYS A 158 -13.052 18.459 0.767 1.00 10.96 H new ATOM 1672 N ASP A 174 -13.130 19.999 -6.679 1.00 7.70 N ATOM 1673 CA ASP A 174 -12.627 19.495 -7.991 1.00 7.46 C ATOM 1674 C ASP A 174 -12.340 17.996 -7.875 1.00 6.93 C ATOM 1675 O ASP A 174 -11.371 17.495 -8.409 1.00 7.21 O ATOM 1676 CB ASP A 174 -11.338 20.233 -8.357 1.00 7.83 C ATOM 1677 CG ASP A 174 -10.348 20.145 -7.194 1.00 8.11 C ATOM 1678 OD1 ASP A 174 -10.777 20.315 -6.064 1.00 8.32 O ATOM 1679 OD2 ASP A 174 -9.180 19.908 -7.453 1.00 8.38 O ATOM 0 H ASP A 174 -12.406 20.288 -6.021 1.00 7.70 H new ATOM 0 HA ASP A 174 -13.376 19.667 -8.764 1.00 7.46 H new ATOM 0 HB2 ASP A 174 -10.900 19.797 -9.255 1.00 7.83 H new ATOM 0 HB3 ASP A 174 -11.556 21.277 -8.584 1.00 7.83 H new ATOM 1684 N ASP A 175 -13.178 17.276 -7.175 1.00 6.43 N ATOM 1685 CA ASP A 175 -12.961 15.807 -7.015 1.00 6.11 C ATOM 1686 C ASP A 175 -14.314 15.127 -6.747 1.00 5.51 C ATOM 1687 O ASP A 175 -15.229 15.746 -6.241 1.00 5.46 O ATOM 1688 CB ASP A 175 -12.008 15.567 -5.834 1.00 6.61 C ATOM 1689 CG ASP A 175 -12.263 16.617 -4.749 1.00 7.27 C ATOM 1690 OD1 ASP A 175 -11.768 17.722 -4.895 1.00 7.70 O ATOM 1691 OD2 ASP A 175 -12.948 16.297 -3.792 1.00 7.57 O ATOM 0 H ASP A 175 -14.006 17.643 -6.706 1.00 6.43 H new ATOM 0 HA ASP A 175 -12.522 15.389 -7.921 1.00 6.11 H new ATOM 0 HB2 ASP A 175 -12.159 14.566 -5.429 1.00 6.61 H new ATOM 0 HB3 ASP A 175 -10.973 15.622 -6.171 1.00 6.61 H new ATOM 1696 N PRO A 176 -14.447 13.864 -7.085 1.00 5.43 N ATOM 1697 CA PRO A 176 -15.720 13.107 -6.873 1.00 5.29 C ATOM 1698 C PRO A 176 -15.946 12.749 -5.398 1.00 4.96 C ATOM 1699 O PRO A 176 -15.039 12.334 -4.704 1.00 4.91 O ATOM 1700 CB PRO A 176 -15.520 11.840 -7.716 1.00 5.76 C ATOM 1701 CG PRO A 176 -14.043 11.619 -7.712 1.00 6.11 C ATOM 1702 CD PRO A 176 -13.410 13.013 -7.704 1.00 5.94 C ATOM 0 HA PRO A 176 -16.597 13.688 -7.157 1.00 5.29 H new ATOM 0 HB2 PRO A 176 -16.050 10.990 -7.287 1.00 5.76 H new ATOM 0 HB3 PRO A 176 -15.899 11.973 -8.729 1.00 5.76 H new ATOM 0 HG2 PRO A 176 -13.736 11.046 -6.837 1.00 6.11 H new ATOM 0 HG3 PRO A 176 -13.730 11.053 -8.590 1.00 6.11 H new ATOM 0 HD2 PRO A 176 -12.484 13.029 -7.130 1.00 5.94 H new ATOM 0 HD3 PRO A 176 -13.166 13.348 -8.712 1.00 5.94 H new ATOM 1710 N GLU A 177 -17.152 12.900 -4.919 1.00 5.10 N ATOM 1711 CA GLU A 177 -17.438 12.561 -3.496 1.00 5.19 C ATOM 1712 C GLU A 177 -17.622 11.048 -3.366 1.00 4.50 C ATOM 1713 O GLU A 177 -18.411 10.575 -2.574 1.00 4.75 O ATOM 1714 CB GLU A 177 -18.720 13.269 -3.045 1.00 6.10 C ATOM 1715 CG GLU A 177 -18.473 14.776 -2.950 1.00 6.79 C ATOM 1716 CD GLU A 177 -18.353 15.365 -4.356 1.00 7.52 C ATOM 1717 OE1 GLU A 177 -19.189 15.044 -5.185 1.00 7.81 O ATOM 1718 OE2 GLU A 177 -17.427 16.127 -4.581 1.00 8.01 O ATOM 0 H GLU A 177 -17.951 13.243 -5.452 1.00 5.10 H new ATOM 0 HA GLU A 177 -16.607 12.887 -2.871 1.00 5.19 H new ATOM 0 HB2 GLU A 177 -19.526 13.067 -3.751 1.00 6.10 H new ATOM 0 HB3 GLU A 177 -19.039 12.882 -2.077 1.00 6.10 H new ATOM 0 HG2 GLU A 177 -19.291 15.256 -2.412 1.00 6.79 H new ATOM 0 HG3 GLU A 177 -17.562 14.971 -2.384 1.00 6.79 H new ATOM 1725 N ARG A 178 -16.900 10.288 -4.141 1.00 3.95 N ATOM 1726 CA ARG A 178 -17.033 8.806 -4.067 1.00 3.61 C ATOM 1727 C ARG A 178 -16.265 8.290 -2.847 1.00 3.28 C ATOM 1728 O ARG A 178 -15.389 8.953 -2.328 1.00 3.07 O ATOM 1729 CB ARG A 178 -16.459 8.185 -5.347 1.00 3.75 C ATOM 1730 CG ARG A 178 -16.998 6.763 -5.526 1.00 4.06 C ATOM 1731 CD ARG A 178 -16.308 6.105 -6.722 1.00 4.58 C ATOM 1732 NE ARG A 178 -16.952 4.796 -7.019 1.00 5.19 N ATOM 1733 CZ ARG A 178 -16.748 4.216 -8.170 1.00 5.87 C ATOM 1734 NH1 ARG A 178 -15.996 4.795 -9.068 1.00 6.06 N ATOM 1735 NH2 ARG A 178 -17.296 3.060 -8.427 1.00 6.66 N ATOM 0 H ARG A 178 -16.223 10.629 -4.823 1.00 3.95 H new ATOM 0 HA ARG A 178 -18.083 8.531 -3.972 1.00 3.61 H new ATOM 0 HB2 ARG A 178 -16.727 8.796 -6.209 1.00 3.75 H new ATOM 0 HB3 ARG A 178 -15.370 8.166 -5.296 1.00 3.75 H new ATOM 0 HG2 ARG A 178 -16.821 6.179 -4.623 1.00 4.06 H new ATOM 0 HG3 ARG A 178 -18.076 6.788 -5.683 1.00 4.06 H new ATOM 0 HD2 ARG A 178 -16.370 6.757 -7.593 1.00 4.58 H new ATOM 0 HD3 ARG A 178 -15.249 5.959 -6.508 1.00 4.58 H new ATOM 0 HE ARG A 178 -17.552 4.353 -6.323 1.00 5.19 H new ATOM 0 HH11 ARG A 178 -15.569 5.700 -8.869 1.00 6.06 H new ATOM 0 HH12 ARG A 178 -15.836 4.342 -9.968 1.00 6.06 H new ATOM 0 HH21 ARG A 178 -17.885 2.608 -7.728 1.00 6.66 H new ATOM 0 HH22 ARG A 178 -17.135 2.608 -9.327 1.00 6.66 H new ATOM 1749 N GLU A 179 -16.584 7.113 -2.382 1.00 3.66 N ATOM 1750 CA GLU A 179 -15.870 6.567 -1.194 1.00 3.59 C ATOM 1751 C GLU A 179 -14.469 6.104 -1.612 1.00 2.48 C ATOM 1752 O GLU A 179 -14.311 5.157 -2.357 1.00 2.75 O ATOM 1753 CB GLU A 179 -16.663 5.382 -0.613 1.00 4.67 C ATOM 1754 CG GLU A 179 -17.335 4.588 -1.747 1.00 5.63 C ATOM 1755 CD GLU A 179 -18.681 5.228 -2.108 1.00 6.37 C ATOM 1756 OE1 GLU A 179 -19.485 5.416 -1.210 1.00 6.87 O ATOM 1757 OE2 GLU A 179 -18.884 5.515 -3.276 1.00 6.71 O ATOM 0 H GLU A 179 -17.306 6.508 -2.772 1.00 3.66 H new ATOM 0 HA GLU A 179 -15.781 7.342 -0.433 1.00 3.59 H new ATOM 0 HB2 GLU A 179 -15.996 4.730 -0.048 1.00 4.67 H new ATOM 0 HB3 GLU A 179 -17.418 5.746 0.083 1.00 4.67 H new ATOM 0 HG2 GLU A 179 -16.686 4.568 -2.622 1.00 5.63 H new ATOM 0 HG3 GLU A 179 -17.486 3.554 -1.438 1.00 5.63 H new ATOM 1764 N VAL A 180 -13.452 6.770 -1.132 1.00 1.65 N ATOM 1765 CA VAL A 180 -12.056 6.380 -1.488 1.00 0.77 C ATOM 1766 C VAL A 180 -11.560 5.337 -0.481 1.00 0.63 C ATOM 1767 O VAL A 180 -12.213 5.073 0.510 1.00 0.64 O ATOM 1768 CB VAL A 180 -11.170 7.629 -1.442 1.00 1.22 C ATOM 1769 CG1 VAL A 180 -9.904 7.401 -2.268 1.00 2.08 C ATOM 1770 CG2 VAL A 180 -11.940 8.808 -2.030 1.00 1.28 C ATOM 0 H VAL A 180 -13.529 7.571 -0.506 1.00 1.65 H new ATOM 0 HA VAL A 180 -12.020 5.952 -2.490 1.00 0.77 H new ATOM 0 HB VAL A 180 -10.894 7.837 -0.408 1.00 1.22 H new ATOM 0 HG11 VAL A 180 -9.279 8.293 -2.230 1.00 2.08 H new ATOM 0 HG12 VAL A 180 -9.352 6.554 -1.861 1.00 2.08 H new ATOM 0 HG13 VAL A 180 -10.177 7.193 -3.302 1.00 2.08 H new ATOM 0 HG21 VAL A 180 -11.316 9.701 -2.001 1.00 1.28 H new ATOM 0 HG22 VAL A 180 -12.210 8.588 -3.063 1.00 1.28 H new ATOM 0 HG23 VAL A 180 -12.845 8.979 -1.447 1.00 1.28 H new ATOM 1780 N LEU A 181 -10.422 4.727 -0.731 1.00 0.58 N ATOM 1781 CA LEU A 181 -9.898 3.678 0.213 1.00 0.52 C ATOM 1782 C LEU A 181 -8.589 4.145 0.856 1.00 0.47 C ATOM 1783 O LEU A 181 -7.790 4.802 0.231 1.00 0.51 O ATOM 1784 CB LEU A 181 -9.634 2.387 -0.570 1.00 0.60 C ATOM 1785 CG LEU A 181 -10.825 2.078 -1.485 1.00 0.74 C ATOM 1786 CD1 LEU A 181 -10.529 0.816 -2.296 1.00 0.95 C ATOM 1787 CD2 LEU A 181 -12.081 1.856 -0.636 1.00 0.87 C ATOM 0 H LEU A 181 -9.834 4.908 -1.544 1.00 0.58 H new ATOM 0 HA LEU A 181 -10.637 3.504 0.995 1.00 0.52 H new ATOM 0 HB2 LEU A 181 -8.726 2.491 -1.164 1.00 0.60 H new ATOM 0 HB3 LEU A 181 -9.471 1.560 0.121 1.00 0.60 H new ATOM 0 HG LEU A 181 -10.989 2.917 -2.162 1.00 0.74 H new ATOM 0 HD11 LEU A 181 -11.375 0.595 -2.947 1.00 0.95 H new ATOM 0 HD12 LEU A 181 -9.637 0.974 -2.902 1.00 0.95 H new ATOM 0 HD13 LEU A 181 -10.364 -0.022 -1.618 1.00 0.95 H new ATOM 0 HD21 LEU A 181 -12.927 1.637 -1.288 1.00 0.87 H new ATOM 0 HD22 LEU A 181 -11.918 1.018 0.042 1.00 0.87 H new ATOM 0 HD23 LEU A 181 -12.293 2.755 -0.057 1.00 0.87 H new ATOM 1799 N GLU A 182 -8.373 3.808 2.111 1.00 0.45 N ATOM 1800 CA GLU A 182 -7.113 4.223 2.819 1.00 0.45 C ATOM 1801 C GLU A 182 -6.308 3.004 3.276 1.00 0.42 C ATOM 1802 O GLU A 182 -6.848 1.981 3.648 1.00 0.43 O ATOM 1803 CB GLU A 182 -7.479 5.058 4.050 1.00 0.49 C ATOM 1804 CG GLU A 182 -8.524 4.311 4.882 1.00 0.56 C ATOM 1805 CD GLU A 182 -8.726 5.032 6.215 1.00 0.90 C ATOM 1806 OE1 GLU A 182 -8.321 6.178 6.313 1.00 1.49 O ATOM 1807 OE2 GLU A 182 -9.281 4.425 7.116 1.00 1.62 O ATOM 0 H GLU A 182 -9.020 3.260 2.678 1.00 0.45 H new ATOM 0 HA GLU A 182 -6.506 4.804 2.124 1.00 0.45 H new ATOM 0 HB2 GLU A 182 -6.590 5.249 4.650 1.00 0.49 H new ATOM 0 HB3 GLU A 182 -7.870 6.028 3.742 1.00 0.49 H new ATOM 0 HG2 GLU A 182 -9.467 4.259 4.338 1.00 0.56 H new ATOM 0 HG3 GLU A 182 -8.199 3.285 5.057 1.00 0.56 H new ATOM 1814 N TRP A 183 -5.003 3.131 3.264 1.00 0.40 N ATOM 1815 CA TRP A 183 -4.120 2.015 3.712 1.00 0.38 C ATOM 1816 C TRP A 183 -4.170 1.942 5.241 1.00 0.37 C ATOM 1817 O TRP A 183 -3.709 2.838 5.920 1.00 0.43 O ATOM 1818 CB TRP A 183 -2.670 2.306 3.284 1.00 0.41 C ATOM 1819 CG TRP A 183 -2.424 1.869 1.874 1.00 0.42 C ATOM 1820 CD1 TRP A 183 -2.342 0.584 1.459 1.00 0.52 C ATOM 1821 CD2 TRP A 183 -2.196 2.695 0.697 1.00 0.38 C ATOM 1822 NE1 TRP A 183 -2.077 0.570 0.101 1.00 0.53 N ATOM 1823 CE2 TRP A 183 -1.980 1.848 -0.414 1.00 0.44 C ATOM 1824 CE3 TRP A 183 -2.159 4.084 0.490 1.00 0.38 C ATOM 1825 CZ2 TRP A 183 -1.732 2.362 -1.688 1.00 0.44 C ATOM 1826 CZ3 TRP A 183 -1.908 4.606 -0.790 1.00 0.41 C ATOM 1827 CH2 TRP A 183 -1.695 3.746 -1.877 1.00 0.41 C ATOM 0 H TRP A 183 -4.510 3.970 2.959 1.00 0.40 H new ATOM 0 HA TRP A 183 -4.455 1.077 3.269 1.00 0.38 H new ATOM 0 HB2 TRP A 183 -2.468 3.373 3.377 1.00 0.41 H new ATOM 0 HB3 TRP A 183 -1.980 1.791 3.953 1.00 0.41 H new ATOM 0 HD1 TRP A 183 -2.463 -0.288 2.085 1.00 0.52 H new ATOM 0 HE1 TRP A 183 -1.967 -0.280 -0.452 1.00 0.53 H new ATOM 0 HE3 TRP A 183 -2.325 4.755 1.320 1.00 0.38 H new ATOM 0 HZ2 TRP A 183 -1.570 1.695 -2.522 1.00 0.44 H new ATOM 0 HZ3 TRP A 183 -1.879 5.675 -0.938 1.00 0.41 H new ATOM 0 HH2 TRP A 183 -1.503 4.153 -2.859 1.00 0.41 H new ATOM 1838 N ARG A 184 -4.711 0.890 5.795 1.00 0.35 N ATOM 1839 CA ARG A 184 -4.766 0.783 7.284 1.00 0.35 C ATOM 1840 C ARG A 184 -3.537 0.013 7.772 1.00 0.31 C ATOM 1841 O ARG A 184 -3.465 -1.197 7.676 1.00 0.31 O ATOM 1842 CB ARG A 184 -6.049 0.050 7.705 1.00 0.40 C ATOM 1843 CG ARG A 184 -6.404 0.422 9.155 1.00 0.98 C ATOM 1844 CD ARG A 184 -7.554 -0.469 9.683 1.00 1.51 C ATOM 1845 NE ARG A 184 -8.604 0.380 10.336 1.00 1.57 N ATOM 1846 CZ ARG A 184 -8.288 1.317 11.192 1.00 2.13 C ATOM 1847 NH1 ARG A 184 -7.048 1.477 11.566 1.00 2.82 N ATOM 1848 NH2 ARG A 184 -9.221 2.080 11.694 1.00 2.61 N ATOM 0 H ARG A 184 -5.115 0.104 5.286 1.00 0.35 H new ATOM 0 HA ARG A 184 -4.771 1.779 7.727 1.00 0.35 H new ATOM 0 HB2 ARG A 184 -6.869 0.319 7.039 1.00 0.40 H new ATOM 0 HB3 ARG A 184 -5.909 -1.028 7.619 1.00 0.40 H new ATOM 0 HG2 ARG A 184 -5.526 0.306 9.791 1.00 0.98 H new ATOM 0 HG3 ARG A 184 -6.697 1.471 9.205 1.00 0.98 H new ATOM 0 HD2 ARG A 184 -7.992 -1.036 8.861 1.00 1.51 H new ATOM 0 HD3 ARG A 184 -7.164 -1.194 10.398 1.00 1.51 H new ATOM 0 HE ARG A 184 -9.586 0.223 10.108 1.00 1.57 H new ATOM 0 HH11 ARG A 184 -6.320 0.870 11.190 1.00 2.82 H new ATOM 0 HH12 ARG A 184 -6.807 2.209 12.234 1.00 2.82 H new ATOM 0 HH21 ARG A 184 -10.194 1.945 11.418 1.00 2.61 H new ATOM 0 HH22 ARG A 184 -8.977 2.811 12.362 1.00 2.61 H new ATOM 1862 N PHE A 185 -2.571 0.716 8.287 1.00 0.31 N ATOM 1863 CA PHE A 185 -1.329 0.051 8.781 1.00 0.31 C ATOM 1864 C PHE A 185 -1.658 -0.821 9.999 1.00 0.31 C ATOM 1865 O PHE A 185 -2.410 -0.429 10.868 1.00 0.37 O ATOM 1866 CB PHE A 185 -0.327 1.146 9.165 1.00 0.40 C ATOM 1867 CG PHE A 185 0.883 0.566 9.869 1.00 0.44 C ATOM 1868 CD1 PHE A 185 0.799 0.179 11.215 1.00 0.65 C ATOM 1869 CD2 PHE A 185 2.098 0.442 9.183 1.00 0.62 C ATOM 1870 CE1 PHE A 185 1.927 -0.337 11.866 1.00 0.75 C ATOM 1871 CE2 PHE A 185 3.224 -0.070 9.836 1.00 0.74 C ATOM 1872 CZ PHE A 185 3.138 -0.460 11.177 1.00 0.71 C ATOM 0 H PHE A 185 -2.585 1.731 8.389 1.00 0.31 H new ATOM 0 HA PHE A 185 -0.904 -0.589 8.008 1.00 0.31 H new ATOM 0 HB2 PHE A 185 -0.008 1.679 8.270 1.00 0.40 H new ATOM 0 HB3 PHE A 185 -0.813 1.875 9.814 1.00 0.40 H new ATOM 0 HD1 PHE A 185 -0.135 0.279 11.749 1.00 0.65 H new ATOM 0 HD2 PHE A 185 2.165 0.742 8.148 1.00 0.62 H new ATOM 0 HE1 PHE A 185 1.862 -0.640 12.901 1.00 0.75 H new ATOM 0 HE2 PHE A 185 4.160 -0.164 9.305 1.00 0.74 H new ATOM 0 HZ PHE A 185 4.007 -0.856 11.680 1.00 0.71 H new ATOM 1882 N ASP A 186 -1.109 -2.007 10.063 1.00 0.28 N ATOM 1883 CA ASP A 186 -1.397 -2.910 11.212 1.00 0.32 C ATOM 1884 C ASP A 186 -0.237 -3.899 11.397 1.00 0.30 C ATOM 1885 O ASP A 186 -0.371 -5.079 11.140 1.00 0.32 O ATOM 1886 CB ASP A 186 -2.680 -3.674 10.896 1.00 0.37 C ATOM 1887 CG ASP A 186 -3.288 -4.235 12.184 1.00 0.47 C ATOM 1888 OD1 ASP A 186 -3.585 -3.447 13.067 1.00 1.16 O ATOM 1889 OD2 ASP A 186 -3.447 -5.442 12.265 1.00 1.23 O ATOM 0 H ASP A 186 -0.471 -2.388 9.364 1.00 0.28 H new ATOM 0 HA ASP A 186 -1.513 -2.334 12.130 1.00 0.32 H new ATOM 0 HB2 ASP A 186 -3.394 -3.013 10.405 1.00 0.37 H new ATOM 0 HB3 ASP A 186 -2.467 -4.486 10.201 1.00 0.37 H new ATOM 1894 N SER A 187 0.906 -3.425 11.827 1.00 0.33 N ATOM 1895 CA SER A 187 2.083 -4.333 12.018 1.00 0.34 C ATOM 1896 C SER A 187 1.665 -5.577 12.813 1.00 0.35 C ATOM 1897 O SER A 187 2.426 -6.514 12.952 1.00 0.37 O ATOM 1898 CB SER A 187 3.179 -3.583 12.786 1.00 0.40 C ATOM 1899 OG SER A 187 3.885 -4.496 13.619 1.00 1.32 O ATOM 0 H SER A 187 1.077 -2.446 12.055 1.00 0.33 H new ATOM 0 HA SER A 187 2.459 -4.644 11.043 1.00 0.34 H new ATOM 0 HB2 SER A 187 3.866 -3.106 12.087 1.00 0.40 H new ATOM 0 HB3 SER A 187 2.737 -2.790 13.390 1.00 0.40 H new ATOM 0 HG SER A 187 3.786 -5.405 13.266 1.00 1.32 H new ATOM 1905 N ARG A 188 0.470 -5.597 13.339 1.00 0.40 N ATOM 1906 CA ARG A 188 0.025 -6.784 14.124 1.00 0.46 C ATOM 1907 C ARG A 188 -0.008 -8.011 13.209 1.00 0.42 C ATOM 1908 O ARG A 188 0.322 -9.107 13.614 1.00 0.43 O ATOM 1909 CB ARG A 188 -1.377 -6.529 14.686 1.00 0.58 C ATOM 1910 CG ARG A 188 -1.429 -5.146 15.336 1.00 1.40 C ATOM 1911 CD ARG A 188 -2.825 -4.907 15.916 1.00 1.75 C ATOM 1912 NE ARG A 188 -2.822 -3.652 16.719 1.00 2.37 N ATOM 1913 CZ ARG A 188 -3.948 -3.093 17.068 1.00 2.99 C ATOM 1914 NH1 ARG A 188 -5.082 -3.631 16.711 1.00 3.19 N ATOM 1915 NH2 ARG A 188 -3.940 -1.997 17.772 1.00 3.87 N ATOM 0 H ARG A 188 -0.215 -4.846 13.260 1.00 0.40 H new ATOM 0 HA ARG A 188 0.718 -6.959 14.947 1.00 0.46 H new ATOM 0 HB2 ARG A 188 -2.116 -6.594 13.888 1.00 0.58 H new ATOM 0 HB3 ARG A 188 -1.630 -7.295 15.419 1.00 0.58 H new ATOM 0 HG2 ARG A 188 -0.679 -5.074 16.124 1.00 1.40 H new ATOM 0 HG3 ARG A 188 -1.193 -4.377 14.600 1.00 1.40 H new ATOM 0 HD2 ARG A 188 -3.557 -4.835 15.112 1.00 1.75 H new ATOM 0 HD3 ARG A 188 -3.120 -5.750 16.541 1.00 1.75 H new ATOM 0 HE ARG A 188 -1.937 -3.228 16.997 1.00 2.37 H new ATOM 0 HH11 ARG A 188 -5.088 -4.489 16.159 1.00 3.19 H new ATOM 0 HH12 ARG A 188 -5.962 -3.194 16.984 1.00 3.19 H new ATOM 0 HH21 ARG A 188 -3.054 -1.576 18.050 1.00 3.87 H new ATOM 0 HH22 ARG A 188 -4.820 -1.560 18.045 1.00 3.87 H new ATOM 1929 N LEU A 189 -0.397 -7.831 11.975 1.00 0.43 N ATOM 1930 CA LEU A 189 -0.444 -8.982 11.029 1.00 0.46 C ATOM 1931 C LEU A 189 0.974 -9.540 10.858 1.00 0.41 C ATOM 1932 O LEU A 189 1.199 -10.475 10.116 1.00 0.46 O ATOM 1933 CB LEU A 189 -1.007 -8.503 9.665 1.00 0.57 C ATOM 1934 CG LEU A 189 -2.444 -9.020 9.458 1.00 1.05 C ATOM 1935 CD1 LEU A 189 -3.148 -8.175 8.394 1.00 1.46 C ATOM 1936 CD2 LEU A 189 -2.406 -10.481 8.993 1.00 1.78 C ATOM 0 H LEU A 189 -0.685 -6.935 11.581 1.00 0.43 H new ATOM 0 HA LEU A 189 -1.093 -9.766 11.418 1.00 0.46 H new ATOM 0 HB2 LEU A 189 -0.997 -7.414 9.624 1.00 0.57 H new ATOM 0 HB3 LEU A 189 -0.367 -8.858 8.857 1.00 0.57 H new ATOM 0 HG LEU A 189 -2.986 -8.949 10.401 1.00 1.05 H new ATOM 0 HD11 LEU A 189 -4.164 -8.543 8.250 1.00 1.46 H new ATOM 0 HD12 LEU A 189 -3.182 -7.135 8.719 1.00 1.46 H new ATOM 0 HD13 LEU A 189 -2.601 -8.244 7.454 1.00 1.46 H new ATOM 0 HD21 LEU A 189 -3.424 -10.843 8.848 1.00 1.78 H new ATOM 0 HD22 LEU A 189 -1.859 -10.549 8.053 1.00 1.78 H new ATOM 0 HD23 LEU A 189 -1.908 -11.090 9.748 1.00 1.78 H new ATOM 1948 N ALA A 190 1.932 -8.977 11.543 1.00 0.37 N ATOM 1949 CA ALA A 190 3.322 -9.487 11.417 1.00 0.42 C ATOM 1950 C ALA A 190 3.420 -10.812 12.165 1.00 0.44 C ATOM 1951 O ALA A 190 4.428 -11.489 12.124 1.00 0.53 O ATOM 1952 CB ALA A 190 4.297 -8.478 12.028 1.00 0.47 C ATOM 0 H ALA A 190 1.811 -8.190 12.181 1.00 0.37 H new ATOM 0 HA ALA A 190 3.574 -9.631 10.366 1.00 0.42 H new ATOM 0 HB1 ALA A 190 5.316 -8.854 11.935 1.00 0.47 H new ATOM 0 HB2 ALA A 190 4.212 -7.526 11.503 1.00 0.47 H new ATOM 0 HB3 ALA A 190 4.059 -8.334 13.082 1.00 0.47 H new ATOM 1958 N PHE A 191 2.367 -11.192 12.845 1.00 0.42 N ATOM 1959 CA PHE A 191 2.377 -12.485 13.598 1.00 0.51 C ATOM 1960 C PHE A 191 1.017 -13.176 13.451 1.00 0.56 C ATOM 1961 O PHE A 191 0.935 -14.379 13.301 1.00 0.96 O ATOM 1962 CB PHE A 191 2.676 -12.216 15.080 1.00 0.58 C ATOM 1963 CG PHE A 191 1.476 -11.588 15.752 1.00 1.14 C ATOM 1964 CD1 PHE A 191 0.440 -12.400 16.231 1.00 1.98 C ATOM 1965 CD2 PHE A 191 1.399 -10.197 15.898 1.00 1.81 C ATOM 1966 CE1 PHE A 191 -0.671 -11.823 16.856 1.00 2.87 C ATOM 1967 CE2 PHE A 191 0.287 -9.621 16.523 1.00 2.75 C ATOM 1968 CZ PHE A 191 -0.748 -10.433 17.002 1.00 3.15 C ATOM 0 H PHE A 191 1.498 -10.661 12.911 1.00 0.42 H new ATOM 0 HA PHE A 191 3.151 -13.136 13.193 1.00 0.51 H new ATOM 0 HB2 PHE A 191 2.935 -13.149 15.581 1.00 0.58 H new ATOM 0 HB3 PHE A 191 3.539 -11.556 15.170 1.00 0.58 H new ATOM 0 HD1 PHE A 191 0.499 -13.472 16.118 1.00 1.98 H new ATOM 0 HD2 PHE A 191 2.197 -9.570 15.529 1.00 1.81 H new ATOM 0 HE1 PHE A 191 -1.469 -12.450 17.226 1.00 2.87 H new ATOM 0 HE2 PHE A 191 0.227 -8.549 16.636 1.00 2.75 H new ATOM 0 HZ PHE A 191 -1.605 -9.987 17.484 1.00 3.15 H new ATOM 1978 N HIS A 192 -0.051 -12.425 13.495 1.00 0.64 N ATOM 1979 CA HIS A 192 -1.399 -13.045 13.358 1.00 0.72 C ATOM 1980 C HIS A 192 -1.619 -13.450 11.899 1.00 0.67 C ATOM 1981 O HIS A 192 -0.695 -13.477 11.112 1.00 1.26 O ATOM 1982 CB HIS A 192 -2.469 -12.038 13.789 1.00 1.01 C ATOM 1983 CG HIS A 192 -3.791 -12.736 13.987 1.00 1.62 C ATOM 1984 ND1 HIS A 192 -4.993 -12.145 13.623 1.00 2.46 N ATOM 1985 CD2 HIS A 192 -4.123 -13.962 14.515 1.00 2.48 C ATOM 1986 CE1 HIS A 192 -5.979 -13.005 13.934 1.00 3.29 C ATOM 1987 NE2 HIS A 192 -5.505 -14.128 14.480 1.00 3.35 N ATOM 0 H HIS A 192 -0.048 -11.413 13.619 1.00 0.64 H new ATOM 0 HA HIS A 192 -1.467 -13.929 13.992 1.00 0.72 H new ATOM 0 HB2 HIS A 192 -2.166 -11.548 14.714 1.00 1.01 H new ATOM 0 HB3 HIS A 192 -2.570 -11.258 13.034 1.00 1.01 H new ATOM 0 HD2 HIS A 192 -3.419 -14.686 14.898 1.00 2.48 H new ATOM 0 HE1 HIS A 192 -7.028 -12.811 13.763 1.00 3.29 H new ATOM 0 HE2 HIS A 192 -6.040 -14.934 14.802 1.00 3.35 H new ATOM 1995 N HIS A 193 -2.829 -13.771 11.529 1.00 0.77 N ATOM 1996 CA HIS A 193 -3.080 -14.180 10.117 1.00 0.85 C ATOM 1997 C HIS A 193 -4.583 -14.116 9.816 1.00 0.74 C ATOM 1998 O HIS A 193 -5.198 -15.102 9.466 1.00 0.78 O ATOM 1999 CB HIS A 193 -2.564 -15.616 9.918 1.00 1.28 C ATOM 2000 CG HIS A 193 -2.240 -15.862 8.467 1.00 2.09 C ATOM 2001 ND1 HIS A 193 -2.643 -14.999 7.460 1.00 2.84 N ATOM 2002 CD2 HIS A 193 -1.548 -16.869 7.842 1.00 2.99 C ATOM 2003 CE1 HIS A 193 -2.192 -15.498 6.294 1.00 3.75 C ATOM 2004 NE2 HIS A 193 -1.518 -16.638 6.471 1.00 3.87 N ATOM 0 H HIS A 193 -3.648 -13.768 12.137 1.00 0.77 H new ATOM 0 HA HIS A 193 -2.559 -13.505 9.438 1.00 0.85 H new ATOM 0 HB2 HIS A 193 -1.675 -15.778 10.528 1.00 1.28 H new ATOM 0 HB3 HIS A 193 -3.316 -16.329 10.255 1.00 1.28 H new ATOM 0 HD2 HIS A 193 -1.095 -17.714 8.340 1.00 2.99 H new ATOM 0 HE1 HIS A 193 -2.355 -15.034 5.333 1.00 3.75 H new ATOM 0 HE2 HIS A 193 -1.077 -17.215 5.755 1.00 3.87 H new ATOM 2012 N MET A 194 -5.178 -12.960 9.946 1.00 0.73 N ATOM 2013 CA MET A 194 -6.637 -12.837 9.664 1.00 0.79 C ATOM 2014 C MET A 194 -6.944 -13.422 8.284 1.00 0.75 C ATOM 2015 O MET A 194 -7.912 -14.133 8.100 1.00 0.90 O ATOM 2016 CB MET A 194 -7.040 -11.360 9.681 1.00 0.91 C ATOM 2017 CG MET A 194 -6.866 -10.788 11.090 1.00 1.47 C ATOM 2018 SD MET A 194 -7.631 -9.149 11.169 1.00 2.35 S ATOM 2019 CE MET A 194 -7.740 -9.035 12.972 1.00 2.94 C ATOM 0 H MET A 194 -4.717 -12.097 10.235 1.00 0.73 H new ATOM 0 HA MET A 194 -7.196 -13.380 10.426 1.00 0.79 H new ATOM 0 HB2 MET A 194 -6.429 -10.799 8.974 1.00 0.91 H new ATOM 0 HB3 MET A 194 -8.077 -11.253 9.361 1.00 0.91 H new ATOM 0 HG2 MET A 194 -7.324 -11.452 11.823 1.00 1.47 H new ATOM 0 HG3 MET A 194 -5.807 -10.720 11.339 1.00 1.47 H new ATOM 0 HE1 MET A 194 -8.192 -8.083 13.250 1.00 2.94 H new ATOM 0 HE2 MET A 194 -8.353 -9.852 13.352 1.00 2.94 H new ATOM 0 HE3 MET A 194 -6.741 -9.102 13.402 1.00 2.94 H new ATOM 2029 N ALA A 195 -6.127 -13.123 7.309 1.00 0.66 N ATOM 2030 CA ALA A 195 -6.372 -13.652 5.937 1.00 0.76 C ATOM 2031 C ALA A 195 -6.614 -15.163 6.002 1.00 0.90 C ATOM 2032 O ALA A 195 -7.501 -15.685 5.355 1.00 1.11 O ATOM 2033 CB ALA A 195 -5.150 -13.371 5.059 1.00 0.82 C ATOM 0 H ALA A 195 -5.300 -12.534 7.405 1.00 0.66 H new ATOM 0 HA ALA A 195 -7.249 -13.164 5.513 1.00 0.76 H new ATOM 0 HB1 ALA A 195 -5.327 -13.757 4.055 1.00 0.82 H new ATOM 0 HB2 ALA A 195 -4.977 -12.296 5.009 1.00 0.82 H new ATOM 0 HB3 ALA A 195 -4.275 -13.860 5.487 1.00 0.82 H new ATOM 2039 N ARG A 196 -5.837 -15.872 6.779 1.00 0.89 N ATOM 2040 CA ARG A 196 -6.032 -17.347 6.880 1.00 1.09 C ATOM 2041 C ARG A 196 -7.322 -17.630 7.647 1.00 1.21 C ATOM 2042 O ARG A 196 -7.974 -18.635 7.439 1.00 1.44 O ATOM 2043 CB ARG A 196 -4.846 -17.969 7.621 1.00 1.11 C ATOM 2044 CG ARG A 196 -4.960 -19.500 7.592 1.00 1.34 C ATOM 2045 CD ARG A 196 -3.770 -20.136 8.341 1.00 1.43 C ATOM 2046 NE ARG A 196 -3.280 -21.335 7.591 1.00 1.90 N ATOM 2047 CZ ARG A 196 -4.106 -22.257 7.172 1.00 2.46 C ATOM 2048 NH1 ARG A 196 -5.362 -22.226 7.520 1.00 2.75 N ATOM 2049 NH2 ARG A 196 -3.661 -23.241 6.438 1.00 3.31 N ATOM 0 H ARG A 196 -5.078 -15.494 7.346 1.00 0.89 H new ATOM 0 HA ARG A 196 -6.098 -17.779 5.881 1.00 1.09 H new ATOM 0 HB2 ARG A 196 -3.911 -17.656 7.157 1.00 1.11 H new ATOM 0 HB3 ARG A 196 -4.824 -17.616 8.652 1.00 1.11 H new ATOM 0 HG2 ARG A 196 -5.898 -19.811 8.053 1.00 1.34 H new ATOM 0 HG3 ARG A 196 -4.980 -19.851 6.560 1.00 1.34 H new ATOM 0 HD2 ARG A 196 -2.965 -19.409 8.448 1.00 1.43 H new ATOM 0 HD3 ARG A 196 -4.074 -20.425 9.347 1.00 1.43 H new ATOM 0 HE ARG A 196 -2.282 -21.434 7.403 1.00 1.90 H new ATOM 0 HH11 ARG A 196 -5.706 -21.479 8.123 1.00 2.75 H new ATOM 0 HH12 ARG A 196 -6.001 -22.949 7.189 1.00 2.75 H new ATOM 0 HH21 ARG A 196 -2.672 -23.288 6.194 1.00 3.31 H new ATOM 0 HH22 ARG A 196 -4.303 -23.963 6.109 1.00 3.31 H new ATOM 2063 N GLU A 197 -7.708 -16.741 8.520 1.00 1.18 N ATOM 2064 CA GLU A 197 -8.967 -16.952 9.284 1.00 1.45 C ATOM 2065 C GLU A 197 -10.139 -16.833 8.312 1.00 1.53 C ATOM 2066 O GLU A 197 -11.124 -17.537 8.414 1.00 1.76 O ATOM 2067 CB GLU A 197 -9.088 -15.884 10.378 1.00 1.53 C ATOM 2068 CG GLU A 197 -10.231 -16.237 11.336 1.00 1.99 C ATOM 2069 CD GLU A 197 -11.575 -15.973 10.654 1.00 2.56 C ATOM 2070 OE1 GLU A 197 -11.644 -15.048 9.862 1.00 3.04 O ATOM 2071 OE2 GLU A 197 -12.513 -16.698 10.938 1.00 3.13 O ATOM 0 H GLU A 197 -7.206 -15.880 8.736 1.00 1.18 H new ATOM 0 HA GLU A 197 -8.967 -17.936 9.753 1.00 1.45 H new ATOM 0 HB2 GLU A 197 -8.151 -15.810 10.930 1.00 1.53 H new ATOM 0 HB3 GLU A 197 -9.270 -14.909 9.926 1.00 1.53 H new ATOM 0 HG2 GLU A 197 -10.161 -17.284 11.631 1.00 1.99 H new ATOM 0 HG3 GLU A 197 -10.152 -15.644 12.247 1.00 1.99 H new ATOM 2078 N LEU A 198 -10.029 -15.947 7.359 1.00 1.41 N ATOM 2079 CA LEU A 198 -11.123 -15.781 6.363 1.00 1.56 C ATOM 2080 C LEU A 198 -11.017 -16.902 5.321 1.00 1.70 C ATOM 2081 O LEU A 198 -11.892 -17.736 5.205 1.00 1.95 O ATOM 2082 CB LEU A 198 -10.991 -14.410 5.667 1.00 1.47 C ATOM 2083 CG LEU A 198 -11.636 -13.299 6.517 1.00 1.53 C ATOM 2084 CD1 LEU A 198 -10.706 -12.913 7.669 1.00 1.82 C ATOM 2085 CD2 LEU A 198 -11.877 -12.065 5.639 1.00 1.83 C ATOM 0 H LEU A 198 -9.227 -15.331 7.228 1.00 1.41 H new ATOM 0 HA LEU A 198 -12.090 -15.831 6.864 1.00 1.56 H new ATOM 0 HB2 LEU A 198 -9.938 -14.182 5.501 1.00 1.47 H new ATOM 0 HB3 LEU A 198 -11.468 -14.447 4.687 1.00 1.47 H new ATOM 0 HG LEU A 198 -12.581 -13.664 6.921 1.00 1.53 H new ATOM 0 HD11 LEU A 198 -11.171 -12.127 8.264 1.00 1.82 H new ATOM 0 HD12 LEU A 198 -10.524 -13.785 8.298 1.00 1.82 H new ATOM 0 HD13 LEU A 198 -9.759 -12.552 7.267 1.00 1.82 H new ATOM 0 HD21 LEU A 198 -12.334 -11.276 6.237 1.00 1.83 H new ATOM 0 HD22 LEU A 198 -10.927 -11.712 5.238 1.00 1.83 H new ATOM 0 HD23 LEU A 198 -12.542 -12.328 4.817 1.00 1.83 H new ATOM 2097 N HIS A 199 -9.955 -16.921 4.554 1.00 1.61 N ATOM 2098 CA HIS A 199 -9.800 -17.983 3.511 1.00 1.79 C ATOM 2099 C HIS A 199 -8.301 -18.277 3.287 1.00 1.68 C ATOM 2100 O HIS A 199 -7.470 -17.432 3.545 1.00 1.85 O ATOM 2101 CB HIS A 199 -10.432 -17.474 2.213 1.00 2.06 C ATOM 2102 CG HIS A 199 -11.886 -17.180 2.458 1.00 2.04 C ATOM 2103 ND1 HIS A 199 -12.787 -18.167 2.827 1.00 2.62 N ATOM 2104 CD2 HIS A 199 -12.609 -16.014 2.403 1.00 2.05 C ATOM 2105 CE1 HIS A 199 -13.989 -17.583 2.979 1.00 2.96 C ATOM 2106 NE2 HIS A 199 -13.937 -16.271 2.732 1.00 2.51 N ATOM 0 H HIS A 199 -9.190 -16.249 4.604 1.00 1.61 H new ATOM 0 HA HIS A 199 -10.291 -18.902 3.831 1.00 1.79 H new ATOM 0 HB2 HIS A 199 -9.919 -16.575 1.872 1.00 2.06 H new ATOM 0 HB3 HIS A 199 -10.326 -18.220 1.425 1.00 2.06 H new ATOM 0 HD2 HIS A 199 -12.208 -15.045 2.144 1.00 2.05 H new ATOM 0 HE1 HIS A 199 -14.887 -18.110 3.266 1.00 2.96 H new ATOM 0 HE2 HIS A 199 -14.705 -15.601 2.775 1.00 2.51 H new ATOM 2114 N PRO A 200 -7.954 -19.465 2.812 1.00 1.59 N ATOM 2115 CA PRO A 200 -6.524 -19.853 2.541 1.00 1.65 C ATOM 2116 C PRO A 200 -5.681 -18.791 1.802 1.00 1.89 C ATOM 2117 O PRO A 200 -5.554 -17.669 2.242 1.00 2.44 O ATOM 2118 CB PRO A 200 -6.657 -21.121 1.687 1.00 1.85 C ATOM 2119 CG PRO A 200 -7.932 -21.749 2.137 1.00 1.95 C ATOM 2120 CD PRO A 200 -8.872 -20.593 2.504 1.00 1.72 C ATOM 0 HA PRO A 200 -5.986 -19.984 3.480 1.00 1.65 H new ATOM 0 HB2 PRO A 200 -6.687 -20.881 0.624 1.00 1.85 H new ATOM 0 HB3 PRO A 200 -5.811 -21.791 1.838 1.00 1.85 H new ATOM 0 HG2 PRO A 200 -8.362 -22.365 1.348 1.00 1.95 H new ATOM 0 HG3 PRO A 200 -7.764 -22.401 2.994 1.00 1.95 H new ATOM 0 HD2 PRO A 200 -9.543 -20.348 1.681 1.00 1.72 H new ATOM 0 HD3 PRO A 200 -9.497 -20.844 3.361 1.00 1.72 H new ATOM 2128 N GLU A 201 -5.053 -19.169 0.706 1.00 1.95 N ATOM 2129 CA GLU A 201 -4.190 -18.212 -0.065 1.00 2.41 C ATOM 2130 C GLU A 201 -4.710 -18.070 -1.506 1.00 2.20 C ATOM 2131 O GLU A 201 -5.446 -17.159 -1.829 1.00 2.62 O ATOM 2132 CB GLU A 201 -2.750 -18.734 -0.088 1.00 2.93 C ATOM 2133 CG GLU A 201 -1.849 -17.709 -0.780 1.00 3.65 C ATOM 2134 CD GLU A 201 -0.381 -18.059 -0.520 1.00 4.31 C ATOM 2135 OE1 GLU A 201 -0.139 -19.044 0.157 1.00 4.64 O ATOM 2136 OE2 GLU A 201 0.474 -17.337 -1.005 1.00 4.86 O ATOM 0 H GLU A 201 -5.104 -20.108 0.311 1.00 1.95 H new ATOM 0 HA GLU A 201 -4.220 -17.235 0.418 1.00 2.41 H new ATOM 0 HB2 GLU A 201 -2.401 -18.914 0.929 1.00 2.93 H new ATOM 0 HB3 GLU A 201 -2.705 -19.688 -0.614 1.00 2.93 H new ATOM 0 HG2 GLU A 201 -2.047 -17.700 -1.852 1.00 3.65 H new ATOM 0 HG3 GLU A 201 -2.066 -16.708 -0.407 1.00 3.65 H new ATOM 2143 N TYR A 202 -4.319 -18.976 -2.371 1.00 1.91 N ATOM 2144 CA TYR A 202 -4.758 -18.928 -3.796 1.00 2.02 C ATOM 2145 C TYR A 202 -6.096 -19.644 -3.930 1.00 2.17 C ATOM 2146 O TYR A 202 -6.247 -20.579 -4.692 1.00 2.63 O ATOM 2147 CB TYR A 202 -3.722 -19.621 -4.690 1.00 2.25 C ATOM 2148 CG TYR A 202 -2.331 -19.326 -4.189 1.00 2.62 C ATOM 2149 CD1 TYR A 202 -1.758 -20.137 -3.203 1.00 2.97 C ATOM 2150 CD2 TYR A 202 -1.609 -18.250 -4.719 1.00 3.00 C ATOM 2151 CE1 TYR A 202 -0.462 -19.872 -2.746 1.00 3.63 C ATOM 2152 CE2 TYR A 202 -0.314 -17.983 -4.260 1.00 3.60 C ATOM 2153 CZ TYR A 202 0.260 -18.796 -3.274 1.00 3.90 C ATOM 2154 OH TYR A 202 1.538 -18.536 -2.823 1.00 4.66 O ATOM 0 H TYR A 202 -3.705 -19.758 -2.143 1.00 1.91 H new ATOM 0 HA TYR A 202 -4.858 -17.888 -4.106 1.00 2.02 H new ATOM 0 HB2 TYR A 202 -3.895 -20.697 -4.695 1.00 2.25 H new ATOM 0 HB3 TYR A 202 -3.828 -19.276 -5.719 1.00 2.25 H new ATOM 0 HD1 TYR A 202 -2.316 -20.967 -2.795 1.00 2.97 H new ATOM 0 HD2 TYR A 202 -2.051 -17.626 -5.482 1.00 3.00 H new ATOM 0 HE1 TYR A 202 -0.019 -20.498 -1.986 1.00 3.63 H new ATOM 0 HE2 TYR A 202 0.242 -17.151 -4.666 1.00 3.60 H new ATOM 0 HH TYR A 202 1.523 -17.757 -2.228 1.00 4.66 H new ATOM 2164 N PHE A 203 -7.052 -19.222 -3.179 1.00 2.24 N ATOM 2165 CA PHE A 203 -8.390 -19.881 -3.225 1.00 2.91 C ATOM 2166 C PHE A 203 -9.177 -19.376 -4.445 1.00 3.51 C ATOM 2167 O PHE A 203 -10.260 -18.839 -4.326 1.00 4.00 O ATOM 2168 CB PHE A 203 -9.146 -19.546 -1.924 1.00 3.09 C ATOM 2169 CG PHE A 203 -8.689 -18.195 -1.401 1.00 2.66 C ATOM 2170 CD1 PHE A 203 -8.787 -17.050 -2.209 1.00 2.55 C ATOM 2171 CD2 PHE A 203 -8.155 -18.087 -0.112 1.00 2.71 C ATOM 2172 CE1 PHE A 203 -8.358 -15.811 -1.725 1.00 2.24 C ATOM 2173 CE2 PHE A 203 -7.731 -16.847 0.368 1.00 2.44 C ATOM 2174 CZ PHE A 203 -7.832 -15.708 -0.436 1.00 2.05 C ATOM 0 H PHE A 203 -6.976 -18.443 -2.525 1.00 2.24 H new ATOM 0 HA PHE A 203 -8.274 -20.961 -3.314 1.00 2.91 H new ATOM 0 HB2 PHE A 203 -10.220 -19.531 -2.109 1.00 3.09 H new ATOM 0 HB3 PHE A 203 -8.963 -20.318 -1.176 1.00 3.09 H new ATOM 0 HD1 PHE A 203 -9.195 -17.127 -3.206 1.00 2.55 H new ATOM 0 HD2 PHE A 203 -8.071 -18.964 0.512 1.00 2.71 H new ATOM 0 HE1 PHE A 203 -8.433 -14.933 -2.349 1.00 2.24 H new ATOM 0 HE2 PHE A 203 -7.323 -16.767 1.365 1.00 2.44 H new ATOM 0 HZ PHE A 203 -7.504 -14.750 -0.061 1.00 2.05 H new ATOM 2184 N LYS A 204 -8.643 -19.559 -5.624 1.00 3.84 N ATOM 2185 CA LYS A 204 -9.362 -19.099 -6.849 1.00 4.59 C ATOM 2186 C LYS A 204 -10.823 -19.555 -6.779 1.00 5.09 C ATOM 2187 O LYS A 204 -11.735 -18.791 -7.031 1.00 5.47 O ATOM 2188 CB LYS A 204 -8.691 -19.701 -8.094 1.00 5.01 C ATOM 2189 CG LYS A 204 -7.405 -18.923 -8.435 1.00 5.49 C ATOM 2190 CD LYS A 204 -7.736 -17.715 -9.325 1.00 6.17 C ATOM 2191 CE LYS A 204 -6.456 -16.927 -9.616 1.00 6.89 C ATOM 2192 NZ LYS A 204 -6.814 -15.564 -10.102 1.00 7.32 N ATOM 0 H LYS A 204 -7.742 -20.006 -5.792 1.00 3.84 H new ATOM 0 HA LYS A 204 -9.323 -18.011 -6.910 1.00 4.59 H new ATOM 0 HB2 LYS A 204 -8.454 -20.750 -7.917 1.00 5.01 H new ATOM 0 HB3 LYS A 204 -9.379 -19.668 -8.939 1.00 5.01 H new ATOM 0 HG2 LYS A 204 -6.921 -18.587 -7.518 1.00 5.49 H new ATOM 0 HG3 LYS A 204 -6.700 -19.578 -8.946 1.00 5.49 H new ATOM 0 HD2 LYS A 204 -8.189 -18.051 -10.258 1.00 6.17 H new ATOM 0 HD3 LYS A 204 -8.465 -17.074 -8.829 1.00 6.17 H new ATOM 0 HE2 LYS A 204 -5.847 -16.856 -8.715 1.00 6.89 H new ATOM 0 HE3 LYS A 204 -5.858 -17.447 -10.365 1.00 6.89 H new ATOM 0 HZ1 LYS A 204 -5.946 -15.027 -10.300 1.00 7.32 H new ATOM 0 HZ2 LYS A 204 -7.379 -15.643 -10.972 1.00 7.32 H new ATOM 0 HZ3 LYS A 204 -7.368 -15.070 -9.373 1.00 7.32 H new ATOM 2206 N ASN A 205 -11.052 -20.790 -6.430 1.00 5.49 N ATOM 2207 CA ASN A 205 -12.453 -21.285 -6.335 1.00 6.31 C ATOM 2208 C ASN A 205 -13.168 -20.544 -5.204 1.00 6.66 C ATOM 2209 O ASN A 205 -12.589 -20.265 -4.171 1.00 6.90 O ATOM 2210 CB ASN A 205 -12.445 -22.787 -6.042 1.00 6.97 C ATOM 2211 CG ASN A 205 -13.877 -23.329 -6.080 1.00 7.47 C ATOM 2212 OD1 ASN A 205 -14.826 -22.605 -6.610 1.00 7.58 O flip ATOM 2213 ND2 ASN A 205 -14.137 -24.423 -5.621 1.00 8.08 N flip ATOM 0 H ASN A 205 -10.331 -21.477 -6.207 1.00 5.49 H new ATOM 0 HA ASN A 205 -12.973 -21.106 -7.276 1.00 6.31 H new ATOM 0 HB2 ASN A 205 -11.830 -23.307 -6.776 1.00 6.97 H new ATOM 0 HB3 ASN A 205 -12.001 -22.974 -5.064 1.00 6.97 H new ATOM 0 HD21 ASN A 205 -13.398 -24.991 -5.206 1.00 8.08 H new ATOM 0 HD22 ASN A 205 -15.094 -24.774 -5.650 1.00 8.08 H new ATOM 2220 N ALA A 206 -14.418 -20.219 -5.385 1.00 7.01 N ATOM 2221 CA ALA A 206 -15.161 -19.492 -4.315 1.00 7.67 C ATOM 2222 C ALA A 206 -16.664 -19.711 -4.497 1.00 7.99 C ATOM 2223 O ALA A 206 -17.407 -19.345 -3.601 1.00 8.32 O ATOM 2224 CB ALA A 206 -14.847 -17.998 -4.406 1.00 8.33 C ATOM 2225 OXT ALA A 206 -17.045 -20.241 -5.526 1.00 8.16 O ATOM 0 H ALA A 206 -14.957 -20.425 -6.226 1.00 7.01 H new ATOM 0 HA ALA A 206 -14.857 -19.870 -3.339 1.00 7.67 H new ATOM 0 HB1 ALA A 206 -15.389 -17.464 -3.625 1.00 8.33 H new ATOM 0 HB2 ALA A 206 -13.776 -17.843 -4.276 1.00 8.33 H new ATOM 0 HB3 ALA A 206 -15.152 -17.621 -5.382 1.00 8.33 H new TER 2231 ALA A 206