USER MOD reduce.3.24.130724 H: found=0, std=0, add=705, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 706 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 152 HIS : no HD1:sc= -20.3! C(o=-28!,f=-35!) USER MOD Set 1.2: A 153 ASN : amide:sc= -7.2! C(o=-28!,f=-30!) USER MOD Set 2.1: A 119 THR OG1 : rot 180:sc= -0.0592 USER MOD Set 2.2: A 122 GLN : amide:sc= 0.129 K(o=0.069,f=-5.5!) USER MOD Set 3.1: A 100 GLN : amide:sc=-0.00183 X(o=-2.7,f=-3.1) USER MOD Set 3.2: A 108 GLN :FLIP amide:sc= -2.69 X(o=-3.1!,f=-2.7) USER MOD Set 4.1: A 95 ASN : amide:sc= -0.368 X(o=-2.7,f=-2.8) USER MOD Set 4.2: A 99 ASN :FLIP amide:sc= -2.32! C(o=-5.5!,f=-2.7!) USER MOD Single : A 92 SER OG : rot -26:sc= 0.455 USER MOD Single : A 101 SER OG : rot 180:sc= 0.0874 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot -27:sc= 0.384 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 180:sc= -0.962 USER MOD Single : A 127 MET CE :methyl 169:sc= -1.2 (180deg=-1.33) USER MOD Single : A 130 THR OG1 : rot 85:sc= 0.911 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= -0.0073 K(o=-0.0073,f=-1) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 ASN : amide:sc= -3.71! C(o=-3.7!,f=-12!) USER MOD Single : A 149 SER OG : rot -64:sc= 0.011! USER MOD Single : A 155 SER OG : rot 180:sc=-0.00912 USER MOD Single : A 157 HIS : no HD1:sc= -0.0619 X(o=-0.062,f=-0.28) USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ -150:sc= -0.191 (180deg=-0.819) USER MOD Single : A 164 HIS : no HD1:sc= -1.64! C(o=-1.6!,f=-2.8!) USER MOD Single : A 165 ASN : amide:sc= -2.2 K(o=-2.2,f=-6.8!) USER MOD Single : A 168 THR OG1 : rot 180:sc= 0 USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 SER OG : rot 180:sc= -0.0267 USER MOD Single : A 172 SER OG : rot 180:sc= 0.0206 USER MOD Single : A 175 MET CE :methyl 154:sc= -0.528 (180deg=-2.5!) USER MOD Single : A 177 ASN :FLIP amide:sc= -2.71! C(o=-5!,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 92 -1.572 20.865 8.968 1.00 0.00 N ATOM 2 CA SER A 92 -1.801 19.446 9.362 1.00 0.00 C ATOM 3 C SER A 92 -3.297 19.205 9.576 1.00 0.00 C ATOM 4 O SER A 92 -3.783 19.228 10.687 1.00 0.00 O ATOM 5 CB SER A 92 -1.043 19.146 10.657 1.00 0.00 C ATOM 6 OG SER A 92 -1.180 20.247 11.548 1.00 0.00 O ATOM 0 HA SER A 92 -1.441 18.789 8.570 1.00 0.00 H new ATOM 0 HB2 SER A 92 -1.433 18.239 11.119 1.00 0.00 H new ATOM 0 HB3 SER A 92 0.010 18.966 10.442 1.00 0.00 H new ATOM 0 HG SER A 92 -1.335 21.067 11.034 1.00 0.00 H new ATOM 12 N ARG A 93 -4.025 18.964 8.516 1.00 0.00 N ATOM 13 CA ARG A 93 -5.491 18.703 8.647 1.00 0.00 C ATOM 14 C ARG A 93 -5.811 17.380 7.965 1.00 0.00 C ATOM 15 O ARG A 93 -5.101 16.937 7.085 1.00 0.00 O ATOM 16 CB ARG A 93 -6.297 19.823 7.976 1.00 0.00 C ATOM 17 CG ARG A 93 -7.748 19.779 8.476 1.00 0.00 C ATOM 18 CD ARG A 93 -8.630 20.675 7.599 1.00 0.00 C ATOM 19 NE ARG A 93 -8.142 22.081 7.668 1.00 0.00 N ATOM 20 CZ ARG A 93 -8.550 22.958 6.789 1.00 0.00 C ATOM 21 NH1 ARG A 93 -9.443 22.625 5.896 1.00 0.00 N ATOM 22 NH2 ARG A 93 -8.079 24.174 6.814 1.00 0.00 N ATOM 0 H ARG A 93 -3.666 18.937 7.562 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.757 18.664 9.703 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -5.852 20.792 8.203 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -6.271 19.706 6.893 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.119 18.754 8.453 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.795 20.111 9.513 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -8.611 20.323 6.567 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.666 20.622 7.934 1.00 0.00 H new ATOM 0 HE ARG A 93 -7.490 22.359 8.401 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -9.824 21.679 5.884 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -9.760 23.311 5.211 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -7.392 24.441 7.520 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -8.397 24.858 6.128 1.00 0.00 H new ATOM 36 N ARG A 94 -6.870 16.742 8.364 1.00 0.00 N ATOM 37 CA ARG A 94 -7.224 15.446 7.737 1.00 0.00 C ATOM 38 C ARG A 94 -7.565 15.666 6.260 1.00 0.00 C ATOM 39 O ARG A 94 -7.404 14.780 5.445 1.00 0.00 O ATOM 40 CB ARG A 94 -8.417 14.828 8.473 1.00 0.00 C ATOM 41 CG ARG A 94 -8.072 14.634 9.958 1.00 0.00 C ATOM 42 CD ARG A 94 -6.730 13.909 10.102 1.00 0.00 C ATOM 43 NE ARG A 94 -6.659 13.274 11.450 1.00 0.00 N ATOM 44 CZ ARG A 94 -5.712 12.417 11.727 1.00 0.00 C ATOM 45 NH1 ARG A 94 -4.859 12.059 10.806 1.00 0.00 N ATOM 46 NH2 ARG A 94 -5.625 11.911 12.925 1.00 0.00 N ATOM 0 H ARG A 94 -7.505 17.061 9.096 1.00 0.00 H new ATOM 0 HA ARG A 94 -6.377 14.763 7.805 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -9.290 15.473 8.375 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -8.677 13.870 8.023 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -8.025 15.602 10.457 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -8.858 14.060 10.449 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -6.626 13.152 9.324 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -5.907 14.612 9.974 1.00 0.00 H new ATOM 0 HE ARG A 94 -7.353 13.510 12.159 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -4.930 12.448 9.866 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -4.121 11.390 11.026 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -6.295 12.184 13.644 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -4.887 11.242 13.144 1.00 0.00 H new ATOM 60 N ASN A 95 -8.026 16.835 5.897 1.00 0.00 N ATOM 61 CA ASN A 95 -8.354 17.067 4.461 1.00 0.00 C ATOM 62 C ASN A 95 -7.066 17.193 3.654 1.00 0.00 C ATOM 63 O ASN A 95 -6.050 17.646 4.139 1.00 0.00 O ATOM 64 CB ASN A 95 -9.168 18.347 4.271 1.00 0.00 C ATOM 65 CG ASN A 95 -10.407 18.342 5.168 1.00 0.00 C ATOM 66 OD1 ASN A 95 -10.836 17.304 5.634 1.00 0.00 O ATOM 67 ND2 ASN A 95 -11.012 19.472 5.423 1.00 0.00 N ATOM 0 H ASN A 95 -8.187 17.626 6.521 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.945 16.218 4.117 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -8.550 19.214 4.503 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -9.469 18.440 3.228 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -11.844 19.483 6.013 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -10.652 20.343 5.032 1.00 0.00 H new ATOM 74 N ALA A 96 -7.123 16.796 2.418 1.00 0.00 N ATOM 75 CA ALA A 96 -5.938 16.870 1.522 1.00 0.00 C ATOM 76 C ALA A 96 -6.232 15.976 0.323 1.00 0.00 C ATOM 77 O ALA A 96 -7.278 16.079 -0.286 1.00 0.00 O ATOM 78 CB ALA A 96 -4.681 16.376 2.254 1.00 0.00 C ATOM 0 H ALA A 96 -7.961 16.414 1.980 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.754 17.898 1.208 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.823 16.437 1.585 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.502 16.999 3.131 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.825 15.342 2.567 1.00 0.00 H new ATOM 84 N TRP A 97 -5.350 15.080 -0.014 1.00 0.00 N ATOM 85 CA TRP A 97 -5.639 14.186 -1.157 1.00 0.00 C ATOM 86 C TRP A 97 -6.935 13.439 -0.858 1.00 0.00 C ATOM 87 O TRP A 97 -7.611 12.959 -1.747 1.00 0.00 O ATOM 88 CB TRP A 97 -4.493 13.188 -1.348 1.00 0.00 C ATOM 89 CG TRP A 97 -4.450 12.208 -0.216 1.00 0.00 C ATOM 90 CD1 TRP A 97 -5.272 11.142 -0.077 1.00 0.00 C ATOM 91 CD2 TRP A 97 -3.544 12.176 0.925 1.00 0.00 C ATOM 92 NE1 TRP A 97 -4.925 10.455 1.075 1.00 0.00 N ATOM 93 CE2 TRP A 97 -3.866 11.055 1.727 1.00 0.00 C ATOM 94 CE3 TRP A 97 -2.483 13.004 1.336 1.00 0.00 C ATOM 95 CZ2 TRP A 97 -3.159 10.765 2.895 1.00 0.00 C ATOM 96 CZ3 TRP A 97 -1.772 12.715 2.512 1.00 0.00 C ATOM 97 CH2 TRP A 97 -2.109 11.597 3.289 1.00 0.00 C ATOM 0 H TRP A 97 -4.453 14.931 0.448 1.00 0.00 H new ATOM 0 HA TRP A 97 -5.741 14.769 -2.073 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -4.620 12.656 -2.291 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -3.545 13.723 -1.409 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -6.069 10.871 -0.754 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -5.394 9.610 1.401 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -2.214 13.866 0.744 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -3.422 9.903 3.490 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -0.961 13.358 2.820 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -1.557 11.380 4.191 1.00 0.00 H new ATOM 108 N GLY A 98 -7.294 13.354 0.395 1.00 0.00 N ATOM 109 CA GLY A 98 -8.552 12.647 0.756 1.00 0.00 C ATOM 110 C GLY A 98 -8.609 12.416 2.266 1.00 0.00 C ATOM 111 O GLY A 98 -7.611 12.147 2.907 1.00 0.00 O ATOM 0 H GLY A 98 -6.771 13.743 1.180 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -9.413 13.235 0.437 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -8.606 11.693 0.232 1.00 0.00 H new ATOM 115 N ASN A 99 -9.779 12.510 2.832 1.00 0.00 N ATOM 116 CA ASN A 99 -9.930 12.286 4.296 1.00 0.00 C ATOM 117 C ASN A 99 -9.689 10.811 4.602 1.00 0.00 C ATOM 118 O ASN A 99 -9.854 10.357 5.717 1.00 0.00 O ATOM 119 CB ASN A 99 -11.347 12.675 4.721 1.00 0.00 C ATOM 120 CG ASN A 99 -11.483 14.195 4.685 1.00 0.00 C ATOM 121 OD1 ASN A 99 -10.510 14.905 4.199 1.00 0.00 O flip ATOM 122 ND2 ASN A 99 -12.485 14.739 5.100 1.00 0.00 N flip ATOM 0 H ASN A 99 -10.644 12.734 2.339 1.00 0.00 H new ATOM 0 HA ASN A 99 -9.209 12.894 4.842 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -12.078 12.217 4.055 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -11.553 12.303 5.725 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -13.248 14.180 5.481 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -12.564 15.755 5.068 1.00 0.00 H new ATOM 129 N GLN A 100 -9.309 10.059 3.611 1.00 0.00 N ATOM 130 CA GLN A 100 -9.067 8.608 3.822 1.00 0.00 C ATOM 131 C GLN A 100 -7.915 8.409 4.803 1.00 0.00 C ATOM 132 O GLN A 100 -6.934 9.128 4.781 1.00 0.00 O ATOM 133 CB GLN A 100 -8.704 7.959 2.487 1.00 0.00 C ATOM 134 CG GLN A 100 -9.869 8.123 1.514 1.00 0.00 C ATOM 135 CD GLN A 100 -9.640 7.238 0.290 1.00 0.00 C ATOM 136 OE1 GLN A 100 -9.701 6.027 0.381 1.00 0.00 O ATOM 137 NE2 GLN A 100 -9.370 7.792 -0.859 1.00 0.00 N ATOM 0 H GLN A 100 -9.155 10.389 2.658 1.00 0.00 H new ATOM 0 HA GLN A 100 -9.969 8.150 4.227 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.805 8.420 2.078 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -8.482 6.902 2.632 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -10.805 7.852 2.002 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -9.959 9.166 1.210 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -9.319 8.808 -0.936 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.210 7.210 -1.681 1.00 0.00 H new ATOM 146 N SER A 101 -8.014 7.426 5.651 1.00 0.00 N ATOM 147 CA SER A 101 -6.909 7.168 6.609 1.00 0.00 C ATOM 148 C SER A 101 -5.771 6.495 5.840 1.00 0.00 C ATOM 149 O SER A 101 -5.977 5.951 4.774 1.00 0.00 O ATOM 150 CB SER A 101 -7.399 6.253 7.736 1.00 0.00 C ATOM 151 OG SER A 101 -7.425 4.911 7.273 1.00 0.00 O ATOM 0 H SER A 101 -8.810 6.792 5.721 1.00 0.00 H new ATOM 0 HA SER A 101 -6.563 8.101 7.054 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.742 6.339 8.601 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.394 6.557 8.060 1.00 0.00 H new ATOM 0 HG SER A 101 -7.737 4.323 7.992 1.00 0.00 H new ATOM 157 N TYR A 102 -4.576 6.528 6.353 1.00 0.00 N ATOM 158 CA TYR A 102 -3.442 5.890 5.622 1.00 0.00 C ATOM 159 C TYR A 102 -3.709 4.382 5.477 1.00 0.00 C ATOM 160 O TYR A 102 -3.511 3.803 4.428 1.00 0.00 O ATOM 161 CB TYR A 102 -2.141 6.100 6.414 1.00 0.00 C ATOM 162 CG TYR A 102 -1.398 7.332 5.929 1.00 0.00 C ATOM 163 CD1 TYR A 102 -0.906 7.392 4.617 1.00 0.00 C ATOM 164 CD2 TYR A 102 -1.174 8.403 6.806 1.00 0.00 C ATOM 165 CE1 TYR A 102 -0.193 8.518 4.185 1.00 0.00 C ATOM 166 CE2 TYR A 102 -0.465 9.530 6.370 1.00 0.00 C ATOM 167 CZ TYR A 102 0.026 9.586 5.061 1.00 0.00 C ATOM 168 OH TYR A 102 0.730 10.695 4.636 1.00 0.00 O ATOM 0 H TYR A 102 -4.333 6.966 7.242 1.00 0.00 H new ATOM 0 HA TYR A 102 -3.347 6.341 4.634 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -2.370 6.204 7.475 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -1.503 5.222 6.310 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -1.077 6.569 3.939 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -1.548 8.359 7.818 1.00 0.00 H new ATOM 0 HE1 TYR A 102 0.188 8.561 3.175 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.297 10.356 7.045 1.00 0.00 H new ATOM 0 HH TYR A 102 0.791 11.344 5.368 1.00 0.00 H new ATOM 178 N ALA A 103 -4.136 3.744 6.535 1.00 0.00 N ATOM 179 CA ALA A 103 -4.392 2.272 6.482 1.00 0.00 C ATOM 180 C ALA A 103 -5.393 1.910 5.371 1.00 0.00 C ATOM 181 O ALA A 103 -5.234 0.912 4.695 1.00 0.00 O ATOM 182 CB ALA A 103 -4.934 1.808 7.837 1.00 0.00 C ATOM 0 H ALA A 103 -4.320 4.180 7.438 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.452 1.768 6.258 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.123 0.735 7.805 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -4.202 2.025 8.615 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -5.863 2.334 8.056 1.00 0.00 H new ATOM 188 N GLU A 104 -6.425 2.686 5.175 1.00 0.00 N ATOM 189 CA GLU A 104 -7.413 2.338 4.105 1.00 0.00 C ATOM 190 C GLU A 104 -6.775 2.492 2.718 1.00 0.00 C ATOM 191 O GLU A 104 -7.095 1.765 1.798 1.00 0.00 O ATOM 192 CB GLU A 104 -8.652 3.232 4.222 1.00 0.00 C ATOM 193 CG GLU A 104 -9.486 2.777 5.425 1.00 0.00 C ATOM 194 CD GLU A 104 -10.731 3.655 5.556 1.00 0.00 C ATOM 195 OE1 GLU A 104 -11.363 3.908 4.545 1.00 0.00 O ATOM 196 OE2 GLU A 104 -11.034 4.055 6.670 1.00 0.00 O ATOM 0 H GLU A 104 -6.628 3.536 5.701 1.00 0.00 H new ATOM 0 HA GLU A 104 -7.716 1.299 4.233 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.354 4.274 4.343 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.245 3.174 3.309 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -9.777 1.734 5.303 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.890 2.837 6.336 1.00 0.00 H new ATOM 203 N LEU A 105 -5.879 3.428 2.554 1.00 0.00 N ATOM 204 CA LEU A 105 -5.231 3.611 1.220 1.00 0.00 C ATOM 205 C LEU A 105 -4.499 2.321 0.817 1.00 0.00 C ATOM 206 O LEU A 105 -4.565 1.889 -0.318 1.00 0.00 O ATOM 207 CB LEU A 105 -4.240 4.779 1.294 1.00 0.00 C ATOM 208 CG LEU A 105 -5.003 6.115 1.294 1.00 0.00 C ATOM 209 CD1 LEU A 105 -4.059 7.251 1.716 1.00 0.00 C ATOM 210 CD2 LEU A 105 -5.549 6.412 -0.112 1.00 0.00 C ATOM 0 H LEU A 105 -5.568 4.072 3.281 1.00 0.00 H new ATOM 0 HA LEU A 105 -5.991 3.832 0.471 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.634 4.696 2.196 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.556 4.741 0.446 1.00 0.00 H new ATOM 0 HG LEU A 105 -5.833 6.044 1.997 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -4.603 8.196 1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.677 7.054 2.718 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.226 7.311 1.015 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.087 7.360 -0.101 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.721 6.473 -0.818 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -6.226 5.614 -0.415 1.00 0.00 H new ATOM 222 N ILE A 106 -3.806 1.697 1.735 1.00 0.00 N ATOM 223 CA ILE A 106 -3.083 0.431 1.398 1.00 0.00 C ATOM 224 C ILE A 106 -4.078 -0.622 0.917 1.00 0.00 C ATOM 225 O ILE A 106 -3.875 -1.282 -0.084 1.00 0.00 O ATOM 226 CB ILE A 106 -2.388 -0.113 2.647 1.00 0.00 C ATOM 227 CG1 ILE A 106 -1.443 0.942 3.222 1.00 0.00 C ATOM 228 CG2 ILE A 106 -1.582 -1.363 2.281 1.00 0.00 C ATOM 229 CD1 ILE A 106 -1.011 0.532 4.635 1.00 0.00 C ATOM 0 H ILE A 106 -3.709 2.008 2.702 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.352 0.645 0.618 1.00 0.00 H new ATOM 0 HB ILE A 106 -3.144 -0.365 3.391 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -0.568 1.049 2.580 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.939 1.912 3.250 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -1.087 -1.750 3.171 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.252 -2.123 1.879 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -0.833 -1.106 1.532 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.337 1.286 5.043 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.890 0.447 5.274 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -0.498 -0.429 4.594 1.00 0.00 H new ATOM 241 N SER A 107 -5.141 -0.799 1.652 1.00 0.00 N ATOM 242 CA SER A 107 -6.155 -1.826 1.282 1.00 0.00 C ATOM 243 C SER A 107 -6.644 -1.595 -0.147 1.00 0.00 C ATOM 244 O SER A 107 -6.707 -2.508 -0.941 1.00 0.00 O ATOM 245 CB SER A 107 -7.333 -1.739 2.250 1.00 0.00 C ATOM 246 OG SER A 107 -7.868 -0.422 2.222 1.00 0.00 O ATOM 0 H SER A 107 -5.352 -0.272 2.499 1.00 0.00 H new ATOM 0 HA SER A 107 -5.702 -2.816 1.341 1.00 0.00 H new ATOM 0 HB2 SER A 107 -8.100 -2.462 1.973 1.00 0.00 H new ATOM 0 HB3 SER A 107 -7.008 -1.991 3.260 1.00 0.00 H new ATOM 0 HG SER A 107 -7.167 0.210 1.959 1.00 0.00 H new ATOM 252 N GLN A 108 -6.985 -0.384 -0.488 1.00 0.00 N ATOM 253 CA GLN A 108 -7.460 -0.128 -1.873 1.00 0.00 C ATOM 254 C GLN A 108 -6.376 -0.571 -2.854 1.00 0.00 C ATOM 255 O GLN A 108 -6.656 -1.130 -3.894 1.00 0.00 O ATOM 256 CB GLN A 108 -7.734 1.369 -2.056 1.00 0.00 C ATOM 257 CG GLN A 108 -8.990 1.783 -1.265 1.00 0.00 C ATOM 258 CD GLN A 108 -8.676 3.005 -0.393 1.00 0.00 C ATOM 259 OE1 GLN A 108 -9.016 2.997 0.867 1.00 0.00 O flip ATOM 260 NE2 GLN A 108 -8.114 3.975 -0.864 1.00 0.00 N flip ATOM 0 H GLN A 108 -6.956 0.430 0.125 1.00 0.00 H new ATOM 0 HA GLN A 108 -8.379 -0.684 -2.057 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -6.875 1.947 -1.716 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -7.871 1.594 -3.114 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -9.804 2.015 -1.952 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -9.326 0.956 -0.640 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -7.848 3.982 -1.849 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -7.909 4.782 -0.274 1.00 0.00 H new ATOM 269 N ALA A 109 -5.137 -0.315 -2.532 1.00 0.00 N ATOM 270 CA ALA A 109 -4.028 -0.716 -3.441 1.00 0.00 C ATOM 271 C ALA A 109 -4.058 -2.230 -3.685 1.00 0.00 C ATOM 272 O ALA A 109 -4.134 -2.681 -4.811 1.00 0.00 O ATOM 273 CB ALA A 109 -2.692 -0.324 -2.806 1.00 0.00 C ATOM 0 H ALA A 109 -4.845 0.156 -1.676 1.00 0.00 H new ATOM 0 HA ALA A 109 -4.148 -0.207 -4.397 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.876 -0.615 -3.467 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.666 0.754 -2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -2.582 -0.832 -1.848 1.00 0.00 H new ATOM 279 N ILE A 110 -3.998 -3.023 -2.647 1.00 0.00 N ATOM 280 CA ILE A 110 -4.021 -4.503 -2.849 1.00 0.00 C ATOM 281 C ILE A 110 -5.348 -4.907 -3.493 1.00 0.00 C ATOM 282 O ILE A 110 -5.385 -5.687 -4.425 1.00 0.00 O ATOM 283 CB ILE A 110 -3.850 -5.221 -1.503 1.00 0.00 C ATOM 284 CG1 ILE A 110 -2.404 -5.040 -1.018 1.00 0.00 C ATOM 285 CG2 ILE A 110 -4.155 -6.717 -1.668 1.00 0.00 C ATOM 286 CD1 ILE A 110 -2.232 -5.645 0.381 1.00 0.00 C ATOM 0 H ILE A 110 -3.935 -2.714 -1.677 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.199 -4.790 -3.505 1.00 0.00 H new ATOM 0 HB ILE A 110 -4.539 -4.797 -0.773 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -1.717 -5.519 -1.716 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -2.150 -3.980 -0.997 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -4.032 -7.221 -0.710 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -5.180 -6.843 -2.015 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.469 -7.150 -2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -1.202 -5.509 0.712 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -2.906 -5.147 1.078 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -2.465 -6.709 0.348 1.00 0.00 H new ATOM 298 N GLU A 111 -6.439 -4.375 -3.014 1.00 0.00 N ATOM 299 CA GLU A 111 -7.759 -4.724 -3.609 1.00 0.00 C ATOM 300 C GLU A 111 -7.769 -4.323 -5.083 1.00 0.00 C ATOM 301 O GLU A 111 -8.293 -5.023 -5.926 1.00 0.00 O ATOM 302 CB GLU A 111 -8.868 -3.974 -2.872 1.00 0.00 C ATOM 303 CG GLU A 111 -8.994 -4.531 -1.454 1.00 0.00 C ATOM 304 CD GLU A 111 -10.173 -3.865 -0.744 1.00 0.00 C ATOM 305 OE1 GLU A 111 -10.209 -2.644 -0.712 1.00 0.00 O ATOM 306 OE2 GLU A 111 -11.019 -4.586 -0.242 1.00 0.00 O ATOM 0 H GLU A 111 -6.473 -3.715 -2.237 1.00 0.00 H new ATOM 0 HA GLU A 111 -7.926 -5.797 -3.519 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -8.642 -2.908 -2.838 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -9.813 -4.083 -3.404 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.140 -5.611 -1.488 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.073 -4.351 -0.899 1.00 0.00 H new ATOM 313 N SER A 112 -7.188 -3.200 -5.401 1.00 0.00 N ATOM 314 CA SER A 112 -7.156 -2.757 -6.821 1.00 0.00 C ATOM 315 C SER A 112 -6.101 -3.577 -7.563 1.00 0.00 C ATOM 316 O SER A 112 -6.114 -3.688 -8.772 1.00 0.00 O ATOM 317 CB SER A 112 -6.789 -1.270 -6.878 1.00 0.00 C ATOM 318 OG SER A 112 -7.187 -0.732 -8.130 1.00 0.00 O ATOM 0 H SER A 112 -6.734 -2.571 -4.739 1.00 0.00 H new ATOM 0 HA SER A 112 -8.132 -2.903 -7.285 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.279 -0.732 -6.067 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.715 -1.144 -6.741 1.00 0.00 H new ATOM 0 HG SER A 112 -6.954 0.219 -8.166 1.00 0.00 H new ATOM 324 N ALA A 113 -5.186 -4.150 -6.831 1.00 0.00 N ATOM 325 CA ALA A 113 -4.107 -4.968 -7.454 1.00 0.00 C ATOM 326 C ALA A 113 -4.688 -6.259 -8.040 1.00 0.00 C ATOM 327 O ALA A 113 -5.702 -6.750 -7.587 1.00 0.00 O ATOM 328 CB ALA A 113 -3.085 -5.332 -6.373 1.00 0.00 C ATOM 0 H ALA A 113 -5.139 -4.085 -5.814 1.00 0.00 H new ATOM 0 HA ALA A 113 -3.637 -4.395 -8.253 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -2.288 -5.931 -6.813 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -2.663 -4.421 -5.950 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -3.576 -5.904 -5.586 1.00 0.00 H new ATOM 334 N PRO A 114 -4.032 -6.820 -9.025 1.00 0.00 N ATOM 335 CA PRO A 114 -4.473 -8.096 -9.659 1.00 0.00 C ATOM 336 C PRO A 114 -4.229 -9.302 -8.737 1.00 0.00 C ATOM 337 O PRO A 114 -3.280 -9.330 -7.976 1.00 0.00 O ATOM 338 CB PRO A 114 -3.614 -8.193 -10.926 1.00 0.00 C ATOM 339 CG PRO A 114 -2.384 -7.398 -10.628 1.00 0.00 C ATOM 340 CD PRO A 114 -2.801 -6.300 -9.647 1.00 0.00 C ATOM 0 HA PRO A 114 -5.543 -8.104 -9.868 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -3.367 -9.229 -11.156 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -4.142 -7.792 -11.791 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -1.609 -8.031 -10.195 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -1.971 -6.967 -11.540 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -2.026 -6.115 -8.903 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -2.982 -5.355 -10.160 1.00 0.00 H new ATOM 348 N GLU A 115 -5.085 -10.291 -8.792 1.00 0.00 N ATOM 349 CA GLU A 115 -4.915 -11.493 -7.917 1.00 0.00 C ATOM 350 C GLU A 115 -4.835 -11.067 -6.450 1.00 0.00 C ATOM 351 O GLU A 115 -4.616 -11.882 -5.576 1.00 0.00 O ATOM 352 CB GLU A 115 -3.628 -12.242 -8.281 1.00 0.00 C ATOM 353 CG GLU A 115 -3.687 -12.709 -9.735 1.00 0.00 C ATOM 354 CD GLU A 115 -2.437 -13.533 -10.053 1.00 0.00 C ATOM 355 OE1 GLU A 115 -1.400 -12.934 -10.289 1.00 0.00 O ATOM 356 OE2 GLU A 115 -2.538 -14.750 -10.055 1.00 0.00 O ATOM 0 H GLU A 115 -5.898 -10.319 -9.408 1.00 0.00 H new ATOM 0 HA GLU A 115 -5.774 -12.147 -8.068 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.765 -11.592 -8.134 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -3.497 -13.099 -7.620 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -4.583 -13.307 -9.901 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -3.750 -11.850 -10.403 1.00 0.00 H new ATOM 363 N LYS A 116 -5.000 -9.805 -6.166 1.00 0.00 N ATOM 364 CA LYS A 116 -4.924 -9.346 -4.748 1.00 0.00 C ATOM 365 C LYS A 116 -3.589 -9.783 -4.150 1.00 0.00 C ATOM 366 O LYS A 116 -3.541 -10.594 -3.246 1.00 0.00 O ATOM 367 CB LYS A 116 -6.063 -9.967 -3.940 1.00 0.00 C ATOM 368 CG LYS A 116 -7.399 -9.592 -4.575 1.00 0.00 C ATOM 369 CD LYS A 116 -8.536 -9.996 -3.637 1.00 0.00 C ATOM 370 CE LYS A 116 -9.874 -9.565 -4.238 1.00 0.00 C ATOM 371 NZ LYS A 116 -10.153 -8.152 -3.859 1.00 0.00 N ATOM 0 H LYS A 116 -5.184 -9.072 -6.851 1.00 0.00 H new ATOM 0 HA LYS A 116 -5.009 -8.260 -4.716 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.954 -11.051 -3.911 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -6.026 -9.615 -2.909 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.435 -8.520 -4.768 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -7.511 -10.092 -5.537 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -8.526 -11.075 -3.481 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -8.398 -9.532 -2.661 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -9.847 -9.664 -5.323 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -10.673 -10.214 -3.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -11.063 -7.856 -4.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -10.196 -8.072 -2.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -9.395 -7.539 -4.222 1.00 0.00 H new ATOM 385 N ARG A 117 -2.504 -9.263 -4.649 1.00 0.00 N ATOM 386 CA ARG A 117 -1.174 -9.665 -4.114 1.00 0.00 C ATOM 387 C ARG A 117 -0.126 -8.607 -4.474 1.00 0.00 C ATOM 388 O ARG A 117 0.099 -8.321 -5.630 1.00 0.00 O ATOM 389 CB ARG A 117 -0.766 -11.004 -4.745 1.00 0.00 C ATOM 390 CG ARG A 117 -1.597 -12.140 -4.147 1.00 0.00 C ATOM 391 CD ARG A 117 -0.940 -13.483 -4.465 1.00 0.00 C ATOM 392 NE ARG A 117 0.293 -13.639 -3.647 1.00 0.00 N ATOM 393 CZ ARG A 117 0.826 -14.816 -3.497 1.00 0.00 C ATOM 394 NH1 ARG A 117 0.257 -15.860 -4.032 1.00 0.00 N ATOM 395 NH2 ARG A 117 1.926 -14.951 -2.807 1.00 0.00 N ATOM 0 H ARG A 117 -2.480 -8.577 -5.404 1.00 0.00 H new ATOM 0 HA ARG A 117 -1.235 -9.760 -3.030 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -0.911 -10.966 -5.825 1.00 0.00 H new ATOM 0 HB3 ARG A 117 0.294 -11.188 -4.572 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -1.682 -12.012 -3.068 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -2.609 -12.115 -4.551 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -1.633 -14.298 -4.256 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -0.695 -13.538 -5.526 1.00 0.00 H new ATOM 0 HE ARG A 117 0.719 -12.825 -3.205 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -0.605 -15.753 -4.567 1.00 0.00 H new ATOM 0 HH12 ARG A 117 0.674 -16.784 -3.915 1.00 0.00 H new ATOM 0 HH21 ARG A 117 2.367 -14.134 -2.386 1.00 0.00 H new ATOM 0 HH22 ARG A 117 2.344 -15.874 -2.689 1.00 0.00 H new ATOM 409 N LEU A 118 0.525 -8.036 -3.490 1.00 0.00 N ATOM 410 CA LEU A 118 1.573 -7.005 -3.773 1.00 0.00 C ATOM 411 C LEU A 118 2.705 -7.133 -2.754 1.00 0.00 C ATOM 412 O LEU A 118 2.504 -7.553 -1.632 1.00 0.00 O ATOM 413 CB LEU A 118 0.994 -5.587 -3.637 1.00 0.00 C ATOM 414 CG LEU A 118 0.049 -5.233 -4.794 1.00 0.00 C ATOM 415 CD1 LEU A 118 -0.377 -3.766 -4.648 1.00 0.00 C ATOM 416 CD2 LEU A 118 0.762 -5.405 -6.142 1.00 0.00 C ATOM 0 H LEU A 118 0.376 -8.239 -2.502 1.00 0.00 H new ATOM 0 HA LEU A 118 1.934 -7.166 -4.789 1.00 0.00 H new ATOM 0 HB2 LEU A 118 0.456 -5.505 -2.693 1.00 0.00 H new ATOM 0 HB3 LEU A 118 1.810 -4.865 -3.603 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.817 -5.895 -4.762 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.049 -3.499 -5.464 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.889 -3.629 -3.696 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.505 -3.126 -4.681 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.077 -5.150 -6.951 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.631 -4.748 -6.181 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.085 -6.440 -6.253 1.00 0.00 H new ATOM 428 N THR A 119 3.891 -6.740 -3.132 1.00 0.00 N ATOM 429 CA THR A 119 5.042 -6.795 -2.186 1.00 0.00 C ATOM 430 C THR A 119 5.157 -5.428 -1.495 1.00 0.00 C ATOM 431 O THR A 119 4.490 -4.489 -1.873 1.00 0.00 O ATOM 432 CB THR A 119 6.323 -7.111 -2.962 1.00 0.00 C ATOM 433 OG1 THR A 119 6.462 -6.188 -4.032 1.00 0.00 O ATOM 434 CG2 THR A 119 6.245 -8.535 -3.522 1.00 0.00 C ATOM 0 H THR A 119 4.113 -6.381 -4.061 1.00 0.00 H new ATOM 0 HA THR A 119 4.891 -7.574 -1.438 1.00 0.00 H new ATOM 0 HB THR A 119 7.182 -7.032 -2.296 1.00 0.00 H new ATOM 0 HG1 THR A 119 7.282 -6.386 -4.530 1.00 0.00 H new ATOM 0 HG21 THR A 119 7.157 -8.759 -4.074 1.00 0.00 H new ATOM 0 HG22 THR A 119 6.135 -9.243 -2.701 1.00 0.00 H new ATOM 0 HG23 THR A 119 5.387 -8.617 -4.190 1.00 0.00 H new ATOM 442 N LEU A 120 5.982 -5.293 -0.491 1.00 0.00 N ATOM 443 CA LEU A 120 6.093 -3.965 0.189 1.00 0.00 C ATOM 444 C LEU A 120 6.515 -2.912 -0.840 1.00 0.00 C ATOM 445 O LEU A 120 6.001 -1.812 -0.868 1.00 0.00 O ATOM 446 CB LEU A 120 7.144 -4.036 1.304 1.00 0.00 C ATOM 447 CG LEU A 120 7.158 -2.718 2.098 1.00 0.00 C ATOM 448 CD1 LEU A 120 5.976 -2.678 3.075 1.00 0.00 C ATOM 449 CD2 LEU A 120 8.466 -2.608 2.888 1.00 0.00 C ATOM 0 H LEU A 120 6.577 -6.031 -0.115 1.00 0.00 H new ATOM 0 HA LEU A 120 5.130 -3.697 0.623 1.00 0.00 H new ATOM 0 HB2 LEU A 120 6.923 -4.870 1.971 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.129 -4.223 0.876 1.00 0.00 H new ATOM 0 HG LEU A 120 7.077 -1.885 1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.996 -1.741 3.632 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.041 -2.750 2.519 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.050 -3.514 3.770 1.00 0.00 H new ATOM 0 HD21 LEU A 120 8.474 -1.674 3.450 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.546 -3.448 3.579 1.00 0.00 H new ATOM 0 HD23 LEU A 120 9.310 -2.624 2.198 1.00 0.00 H new ATOM 461 N ALA A 121 7.451 -3.250 -1.681 1.00 0.00 N ATOM 462 CA ALA A 121 7.925 -2.290 -2.719 1.00 0.00 C ATOM 463 C ALA A 121 6.752 -1.792 -3.565 1.00 0.00 C ATOM 464 O ALA A 121 6.622 -0.616 -3.838 1.00 0.00 O ATOM 465 CB ALA A 121 8.923 -3.004 -3.634 1.00 0.00 C ATOM 0 H ALA A 121 7.913 -4.159 -1.695 1.00 0.00 H new ATOM 0 HA ALA A 121 8.394 -1.439 -2.226 1.00 0.00 H new ATOM 0 HB1 ALA A 121 9.277 -2.311 -4.398 1.00 0.00 H new ATOM 0 HB2 ALA A 121 9.769 -3.357 -3.044 1.00 0.00 H new ATOM 0 HB3 ALA A 121 8.435 -3.853 -4.113 1.00 0.00 H new ATOM 471 N GLN A 122 5.923 -2.688 -4.009 1.00 0.00 N ATOM 472 CA GLN A 122 4.781 -2.290 -4.872 1.00 0.00 C ATOM 473 C GLN A 122 3.801 -1.390 -4.117 1.00 0.00 C ATOM 474 O GLN A 122 3.166 -0.537 -4.705 1.00 0.00 O ATOM 475 CB GLN A 122 4.077 -3.553 -5.360 1.00 0.00 C ATOM 476 CG GLN A 122 5.008 -4.281 -6.331 1.00 0.00 C ATOM 477 CD GLN A 122 4.324 -5.538 -6.863 1.00 0.00 C ATOM 478 OE1 GLN A 122 3.771 -6.312 -6.105 1.00 0.00 O ATOM 479 NE2 GLN A 122 4.331 -5.773 -8.146 1.00 0.00 N ATOM 0 H GLN A 122 5.987 -3.686 -3.810 1.00 0.00 H new ATOM 0 HA GLN A 122 5.156 -1.719 -5.721 1.00 0.00 H new ATOM 0 HB2 GLN A 122 3.829 -4.198 -4.517 1.00 0.00 H new ATOM 0 HB3 GLN A 122 3.139 -3.298 -5.853 1.00 0.00 H new ATOM 0 HG2 GLN A 122 5.272 -3.622 -7.158 1.00 0.00 H new ATOM 0 HG3 GLN A 122 5.937 -4.548 -5.827 1.00 0.00 H new ATOM 0 HE21 GLN A 122 4.795 -5.123 -8.781 1.00 0.00 H new ATOM 0 HE22 GLN A 122 3.872 -6.606 -8.514 1.00 0.00 H new ATOM 488 N ILE A 123 3.671 -1.539 -2.830 1.00 0.00 N ATOM 489 CA ILE A 123 2.726 -0.647 -2.102 1.00 0.00 C ATOM 490 C ILE A 123 3.240 0.788 -2.218 1.00 0.00 C ATOM 491 O ILE A 123 2.482 1.717 -2.420 1.00 0.00 O ATOM 492 CB ILE A 123 2.639 -1.050 -0.627 1.00 0.00 C ATOM 493 CG1 ILE A 123 2.168 -2.505 -0.523 1.00 0.00 C ATOM 494 CG2 ILE A 123 1.633 -0.142 0.090 1.00 0.00 C ATOM 495 CD1 ILE A 123 2.163 -2.954 0.943 1.00 0.00 C ATOM 0 H ILE A 123 4.166 -2.224 -2.259 1.00 0.00 H new ATOM 0 HA ILE A 123 1.730 -0.731 -2.536 1.00 0.00 H new ATOM 0 HB ILE A 123 3.621 -0.948 -0.164 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.168 -2.603 -0.945 1.00 0.00 H new ATOM 0 HG13 ILE A 123 2.824 -3.150 -1.107 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.570 -0.427 1.140 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.961 0.895 0.015 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.653 -0.247 -0.374 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.827 -3.989 1.005 1.00 0.00 H new ATOM 0 HD12 ILE A 123 3.170 -2.874 1.351 1.00 0.00 H new ATOM 0 HD13 ILE A 123 1.488 -2.318 1.516 1.00 0.00 H new ATOM 507 N TYR A 124 4.529 0.972 -2.099 1.00 0.00 N ATOM 508 CA TYR A 124 5.097 2.344 -2.215 1.00 0.00 C ATOM 509 C TYR A 124 4.764 2.916 -3.599 1.00 0.00 C ATOM 510 O TYR A 124 4.293 4.027 -3.728 1.00 0.00 O ATOM 511 CB TYR A 124 6.619 2.287 -2.044 1.00 0.00 C ATOM 512 CG TYR A 124 6.982 2.067 -0.588 1.00 0.00 C ATOM 513 CD1 TYR A 124 6.610 3.003 0.387 1.00 0.00 C ATOM 514 CD2 TYR A 124 7.702 0.924 -0.215 1.00 0.00 C ATOM 515 CE1 TYR A 124 6.957 2.794 1.728 1.00 0.00 C ATOM 516 CE2 TYR A 124 8.048 0.715 1.123 1.00 0.00 C ATOM 517 CZ TYR A 124 7.677 1.648 2.094 1.00 0.00 C ATOM 518 OH TYR A 124 8.019 1.439 3.415 1.00 0.00 O ATOM 0 H TYR A 124 5.210 0.232 -1.927 1.00 0.00 H new ATOM 0 HA TYR A 124 4.668 2.980 -1.441 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.029 1.481 -2.653 1.00 0.00 H new ATOM 0 HB3 TYR A 124 7.066 3.215 -2.400 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.056 3.886 0.104 1.00 0.00 H new ATOM 0 HD2 TYR A 124 7.991 0.202 -0.964 1.00 0.00 H new ATOM 0 HE1 TYR A 124 6.670 3.515 2.479 1.00 0.00 H new ATOM 0 HE2 TYR A 124 8.602 -0.168 1.406 1.00 0.00 H new ATOM 0 HH TYR A 124 8.515 0.597 3.495 1.00 0.00 H new ATOM 528 N GLU A 125 5.025 2.162 -4.633 1.00 0.00 N ATOM 529 CA GLU A 125 4.749 2.647 -6.017 1.00 0.00 C ATOM 530 C GLU A 125 3.269 2.976 -6.197 1.00 0.00 C ATOM 531 O GLU A 125 2.918 3.940 -6.844 1.00 0.00 O ATOM 532 CB GLU A 125 5.135 1.552 -7.016 1.00 0.00 C ATOM 533 CG GLU A 125 6.655 1.389 -7.028 1.00 0.00 C ATOM 534 CD GLU A 125 7.028 0.189 -7.898 1.00 0.00 C ATOM 535 OE1 GLU A 125 6.484 0.078 -8.983 1.00 0.00 O ATOM 536 OE2 GLU A 125 7.856 -0.596 -7.465 1.00 0.00 O ATOM 0 H GLU A 125 5.421 1.223 -4.578 1.00 0.00 H new ATOM 0 HA GLU A 125 5.333 3.551 -6.190 1.00 0.00 H new ATOM 0 HB2 GLU A 125 4.659 0.610 -6.742 1.00 0.00 H new ATOM 0 HB3 GLU A 125 4.778 1.811 -8.013 1.00 0.00 H new ATOM 0 HG2 GLU A 125 7.126 2.293 -7.414 1.00 0.00 H new ATOM 0 HG3 GLU A 125 7.025 1.246 -6.013 1.00 0.00 H new ATOM 543 N TRP A 126 2.392 2.181 -5.649 1.00 0.00 N ATOM 544 CA TRP A 126 0.944 2.460 -5.824 1.00 0.00 C ATOM 545 C TRP A 126 0.602 3.820 -5.216 1.00 0.00 C ATOM 546 O TRP A 126 0.117 4.705 -5.894 1.00 0.00 O ATOM 547 CB TRP A 126 0.120 1.363 -5.152 1.00 0.00 C ATOM 548 CG TRP A 126 -1.331 1.638 -5.369 1.00 0.00 C ATOM 549 CD1 TRP A 126 -2.040 1.269 -6.459 1.00 0.00 C ATOM 550 CD2 TRP A 126 -2.256 2.342 -4.497 1.00 0.00 C ATOM 551 NE1 TRP A 126 -3.345 1.703 -6.310 1.00 0.00 N ATOM 552 CE2 TRP A 126 -3.527 2.370 -5.115 1.00 0.00 C ATOM 553 CE3 TRP A 126 -2.117 2.951 -3.244 1.00 0.00 C ATOM 554 CZ2 TRP A 126 -4.622 2.983 -4.507 1.00 0.00 C ATOM 555 CZ3 TRP A 126 -3.214 3.571 -2.627 1.00 0.00 C ATOM 556 CH2 TRP A 126 -4.464 3.588 -3.257 1.00 0.00 C ATOM 0 H TRP A 126 2.616 1.356 -5.092 1.00 0.00 H new ATOM 0 HA TRP A 126 0.708 2.478 -6.888 1.00 0.00 H new ATOM 0 HB2 TRP A 126 0.384 0.389 -5.564 1.00 0.00 H new ATOM 0 HB3 TRP A 126 0.340 1.328 -4.085 1.00 0.00 H new ATOM 0 HD1 TRP A 126 -1.651 0.725 -7.307 1.00 0.00 H new ATOM 0 HE1 TRP A 126 -4.082 1.549 -6.998 1.00 0.00 H new ATOM 0 HE3 TRP A 126 -1.157 2.943 -2.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 -5.584 2.990 -4.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 -3.093 4.038 -1.661 1.00 0.00 H new ATOM 0 HH2 TRP A 126 -5.305 4.068 -2.778 1.00 0.00 H new ATOM 567 N MET A 127 0.851 4.005 -3.947 1.00 0.00 N ATOM 568 CA MET A 127 0.532 5.325 -3.326 1.00 0.00 C ATOM 569 C MET A 127 1.240 6.436 -4.102 1.00 0.00 C ATOM 570 O MET A 127 0.676 7.479 -4.361 1.00 0.00 O ATOM 571 CB MET A 127 1.002 5.366 -1.867 1.00 0.00 C ATOM 572 CG MET A 127 0.162 4.413 -1.022 1.00 0.00 C ATOM 573 SD MET A 127 0.483 4.724 0.727 1.00 0.00 S ATOM 574 CE MET A 127 -0.585 3.426 1.386 1.00 0.00 C ATOM 0 H MET A 127 1.256 3.310 -3.320 1.00 0.00 H new ATOM 0 HA MET A 127 -0.548 5.468 -3.357 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.054 5.087 -1.807 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.918 6.381 -1.478 1.00 0.00 H new ATOM 0 HG2 MET A 127 -0.897 4.553 -1.240 1.00 0.00 H new ATOM 0 HG3 MET A 127 0.404 3.380 -1.270 1.00 0.00 H new ATOM 0 HE1 MET A 127 -0.394 3.305 2.452 1.00 0.00 H new ATOM 0 HE2 MET A 127 -1.629 3.701 1.233 1.00 0.00 H new ATOM 0 HE3 MET A 127 -0.378 2.488 0.871 1.00 0.00 H new ATOM 584 N VAL A 128 2.475 6.224 -4.467 1.00 0.00 N ATOM 585 CA VAL A 128 3.212 7.279 -5.216 1.00 0.00 C ATOM 586 C VAL A 128 2.621 7.433 -6.614 1.00 0.00 C ATOM 587 O VAL A 128 2.479 8.527 -7.120 1.00 0.00 O ATOM 588 CB VAL A 128 4.693 6.905 -5.329 1.00 0.00 C ATOM 589 CG1 VAL A 128 5.413 7.941 -6.200 1.00 0.00 C ATOM 590 CG2 VAL A 128 5.326 6.894 -3.933 1.00 0.00 C ATOM 0 H VAL A 128 3.002 5.371 -4.280 1.00 0.00 H new ATOM 0 HA VAL A 128 3.118 8.222 -4.677 1.00 0.00 H new ATOM 0 HB VAL A 128 4.784 5.917 -5.780 1.00 0.00 H new ATOM 0 HG11 VAL A 128 6.467 7.677 -6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 128 4.964 7.956 -7.193 1.00 0.00 H new ATOM 0 HG13 VAL A 128 5.320 8.927 -5.745 1.00 0.00 H new ATOM 0 HG21 VAL A 128 6.380 6.628 -4.013 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.235 7.883 -3.484 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.814 6.163 -3.307 1.00 0.00 H new ATOM 600 N ARG A 129 2.295 6.347 -7.250 1.00 0.00 N ATOM 601 CA ARG A 129 1.732 6.436 -8.621 1.00 0.00 C ATOM 602 C ARG A 129 0.315 7.011 -8.579 1.00 0.00 C ATOM 603 O ARG A 129 -0.130 7.641 -9.518 1.00 0.00 O ATOM 604 CB ARG A 129 1.703 5.045 -9.254 1.00 0.00 C ATOM 605 CG ARG A 129 1.021 5.126 -10.620 1.00 0.00 C ATOM 606 CD ARG A 129 1.074 3.762 -11.301 1.00 0.00 C ATOM 607 NE ARG A 129 0.207 3.784 -12.509 1.00 0.00 N ATOM 608 CZ ARG A 129 0.316 2.846 -13.405 1.00 0.00 C ATOM 609 NH1 ARG A 129 1.179 1.883 -13.235 1.00 0.00 N ATOM 610 NH2 ARG A 129 -0.438 2.871 -14.468 1.00 0.00 N ATOM 0 H ARG A 129 2.394 5.402 -6.880 1.00 0.00 H new ATOM 0 HA ARG A 129 2.361 7.096 -9.218 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.717 4.661 -9.363 1.00 0.00 H new ATOM 0 HB3 ARG A 129 1.167 4.350 -8.608 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -0.015 5.445 -10.502 1.00 0.00 H new ATOM 0 HG3 ARG A 129 1.516 5.873 -11.241 1.00 0.00 H new ATOM 0 HD2 ARG A 129 2.100 3.521 -11.579 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.740 2.986 -10.613 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.473 4.534 -12.635 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.767 1.866 -12.401 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.266 1.147 -13.936 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -1.113 3.625 -14.597 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.353 2.137 -15.171 1.00 0.00 H new ATOM 624 N THR A 130 -0.403 6.792 -7.514 1.00 0.00 N ATOM 625 CA THR A 130 -1.795 7.320 -7.441 1.00 0.00 C ATOM 626 C THR A 130 -1.772 8.779 -6.979 1.00 0.00 C ATOM 627 O THR A 130 -2.230 9.668 -7.670 1.00 0.00 O ATOM 628 CB THR A 130 -2.595 6.475 -6.442 1.00 0.00 C ATOM 629 OG1 THR A 130 -2.119 5.138 -6.478 1.00 0.00 O ATOM 630 CG2 THR A 130 -4.084 6.497 -6.806 1.00 0.00 C ATOM 0 H THR A 130 -0.089 6.273 -6.694 1.00 0.00 H new ATOM 0 HA THR A 130 -2.260 7.268 -8.425 1.00 0.00 H new ATOM 0 HB THR A 130 -2.470 6.887 -5.441 1.00 0.00 H new ATOM 0 HG1 THR A 130 -1.340 5.052 -5.889 1.00 0.00 H new ATOM 0 HG21 THR A 130 -4.642 5.894 -6.090 1.00 0.00 H new ATOM 0 HG22 THR A 130 -4.450 7.523 -6.779 1.00 0.00 H new ATOM 0 HG23 THR A 130 -4.220 6.089 -7.808 1.00 0.00 H new ATOM 638 N VAL A 131 -1.244 9.030 -5.815 1.00 0.00 N ATOM 639 CA VAL A 131 -1.188 10.426 -5.298 1.00 0.00 C ATOM 640 C VAL A 131 0.137 11.070 -5.745 1.00 0.00 C ATOM 641 O VAL A 131 1.198 10.556 -5.456 1.00 0.00 O ATOM 642 CB VAL A 131 -1.273 10.370 -3.771 1.00 0.00 C ATOM 643 CG1 VAL A 131 -1.231 11.783 -3.185 1.00 0.00 C ATOM 644 CG2 VAL A 131 -2.592 9.695 -3.379 1.00 0.00 C ATOM 0 H VAL A 131 -0.846 8.324 -5.195 1.00 0.00 H new ATOM 0 HA VAL A 131 -2.013 11.023 -5.686 1.00 0.00 H new ATOM 0 HB VAL A 131 -0.427 9.805 -3.380 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -1.292 11.728 -2.098 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -0.298 12.268 -3.472 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -2.073 12.361 -3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -2.668 9.647 -2.293 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -3.428 10.271 -3.776 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -2.620 8.686 -3.789 1.00 0.00 H new ATOM 654 N PRO A 132 0.085 12.168 -6.470 1.00 0.00 N ATOM 655 CA PRO A 132 1.316 12.847 -6.974 1.00 0.00 C ATOM 656 C PRO A 132 2.078 13.593 -5.877 1.00 0.00 C ATOM 657 O PRO A 132 3.226 13.951 -6.045 1.00 0.00 O ATOM 658 CB PRO A 132 0.794 13.825 -8.031 1.00 0.00 C ATOM 659 CG PRO A 132 -0.629 14.101 -7.662 1.00 0.00 C ATOM 660 CD PRO A 132 -1.140 12.881 -6.884 1.00 0.00 C ATOM 0 HA PRO A 132 2.033 12.125 -7.366 1.00 0.00 H new ATOM 0 HB2 PRO A 132 1.381 14.743 -8.038 1.00 0.00 H new ATOM 0 HB3 PRO A 132 0.863 13.395 -9.030 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -0.701 15.003 -7.054 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -1.232 14.269 -8.554 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -1.735 13.181 -6.022 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -1.775 12.251 -7.506 1.00 0.00 H new ATOM 668 N TYR A 133 1.452 13.840 -4.766 1.00 0.00 N ATOM 669 CA TYR A 133 2.147 14.574 -3.674 1.00 0.00 C ATOM 670 C TYR A 133 3.372 13.792 -3.196 1.00 0.00 C ATOM 671 O TYR A 133 4.333 14.360 -2.715 1.00 0.00 O ATOM 672 CB TYR A 133 1.190 14.781 -2.499 1.00 0.00 C ATOM 673 CG TYR A 133 1.699 15.924 -1.658 1.00 0.00 C ATOM 674 CD1 TYR A 133 2.834 15.753 -0.857 1.00 0.00 C ATOM 675 CD2 TYR A 133 1.049 17.163 -1.695 1.00 0.00 C ATOM 676 CE1 TYR A 133 3.318 16.821 -0.094 1.00 0.00 C ATOM 677 CE2 TYR A 133 1.535 18.231 -0.934 1.00 0.00 C ATOM 678 CZ TYR A 133 2.671 18.061 -0.134 1.00 0.00 C ATOM 679 OH TYR A 133 3.155 19.116 0.614 1.00 0.00 O ATOM 0 H TYR A 133 0.490 13.567 -4.564 1.00 0.00 H new ATOM 0 HA TYR A 133 2.472 15.540 -4.060 1.00 0.00 H new ATOM 0 HB2 TYR A 133 0.186 14.997 -2.863 1.00 0.00 H new ATOM 0 HB3 TYR A 133 1.123 13.872 -1.901 1.00 0.00 H new ATOM 0 HD1 TYR A 133 3.336 14.797 -0.828 1.00 0.00 H new ATOM 0 HD2 TYR A 133 0.172 17.294 -2.311 1.00 0.00 H new ATOM 0 HE1 TYR A 133 4.192 16.688 0.527 1.00 0.00 H new ATOM 0 HE2 TYR A 133 1.034 19.187 -0.964 1.00 0.00 H new ATOM 0 HH TYR A 133 2.591 19.904 0.471 1.00 0.00 H new ATOM 689 N PHE A 134 3.348 12.495 -3.298 1.00 0.00 N ATOM 690 CA PHE A 134 4.509 11.698 -2.814 1.00 0.00 C ATOM 691 C PHE A 134 5.608 11.678 -3.880 1.00 0.00 C ATOM 692 O PHE A 134 6.750 11.373 -3.598 1.00 0.00 O ATOM 693 CB PHE A 134 4.028 10.280 -2.495 1.00 0.00 C ATOM 694 CG PHE A 134 2.844 10.357 -1.547 1.00 0.00 C ATOM 695 CD1 PHE A 134 2.903 11.187 -0.417 1.00 0.00 C ATOM 696 CD2 PHE A 134 1.687 9.604 -1.799 1.00 0.00 C ATOM 697 CE1 PHE A 134 1.813 11.264 0.455 1.00 0.00 C ATOM 698 CE2 PHE A 134 0.595 9.683 -0.921 1.00 0.00 C ATOM 699 CZ PHE A 134 0.659 10.513 0.205 1.00 0.00 C ATOM 0 H PHE A 134 2.580 11.953 -3.693 1.00 0.00 H new ATOM 0 HA PHE A 134 4.926 12.146 -1.912 1.00 0.00 H new ATOM 0 HB2 PHE A 134 3.742 9.765 -3.412 1.00 0.00 H new ATOM 0 HB3 PHE A 134 4.834 9.702 -2.043 1.00 0.00 H new ATOM 0 HD1 PHE A 134 3.792 11.767 -0.221 1.00 0.00 H new ATOM 0 HD2 PHE A 134 1.637 8.964 -2.668 1.00 0.00 H new ATOM 0 HE1 PHE A 134 1.862 11.904 1.323 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -0.295 9.103 -1.114 1.00 0.00 H new ATOM 0 HZ PHE A 134 -0.182 10.574 0.880 1.00 0.00 H new ATOM 709 N LYS A 135 5.285 12.033 -5.093 1.00 0.00 N ATOM 710 CA LYS A 135 6.324 12.067 -6.165 1.00 0.00 C ATOM 711 C LYS A 135 7.404 13.085 -5.798 1.00 0.00 C ATOM 712 O LYS A 135 8.565 12.912 -6.111 1.00 0.00 O ATOM 713 CB LYS A 135 5.681 12.477 -7.486 1.00 0.00 C ATOM 714 CG LYS A 135 4.801 11.338 -7.989 1.00 0.00 C ATOM 715 CD LYS A 135 4.114 11.764 -9.282 1.00 0.00 C ATOM 716 CE LYS A 135 3.110 10.691 -9.706 1.00 0.00 C ATOM 717 NZ LYS A 135 2.452 11.107 -10.974 1.00 0.00 N ATOM 0 H LYS A 135 4.347 12.301 -5.390 1.00 0.00 H new ATOM 0 HA LYS A 135 6.770 11.077 -6.265 1.00 0.00 H new ATOM 0 HB2 LYS A 135 5.086 13.380 -7.350 1.00 0.00 H new ATOM 0 HB3 LYS A 135 6.450 12.711 -8.222 1.00 0.00 H new ATOM 0 HG2 LYS A 135 5.404 10.446 -8.161 1.00 0.00 H new ATOM 0 HG3 LYS A 135 4.056 11.079 -7.236 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.605 12.717 -9.138 1.00 0.00 H new ATOM 0 HD3 LYS A 135 4.855 11.914 -10.067 1.00 0.00 H new ATOM 0 HE2 LYS A 135 3.617 9.736 -9.842 1.00 0.00 H new ATOM 0 HE3 LYS A 135 2.363 10.547 -8.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 1.768 10.379 -11.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 1.956 12.009 -10.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 3.171 11.223 -11.716 1.00 0.00 H new ATOM 731 N ASP A 136 7.034 14.147 -5.139 1.00 0.00 N ATOM 732 CA ASP A 136 8.049 15.164 -4.759 1.00 0.00 C ATOM 733 C ASP A 136 8.971 14.546 -3.709 1.00 0.00 C ATOM 734 O ASP A 136 10.111 14.933 -3.553 1.00 0.00 O ATOM 735 CB ASP A 136 7.350 16.410 -4.193 1.00 0.00 C ATOM 736 CG ASP A 136 6.983 16.195 -2.723 1.00 0.00 C ATOM 737 OD1 ASP A 136 7.889 16.017 -1.927 1.00 0.00 O ATOM 738 OD2 ASP A 136 5.801 16.218 -2.417 1.00 0.00 O ATOM 0 H ASP A 136 6.078 14.353 -4.849 1.00 0.00 H new ATOM 0 HA ASP A 136 8.631 15.467 -5.630 1.00 0.00 H new ATOM 0 HB2 ASP A 136 8.004 17.276 -4.288 1.00 0.00 H new ATOM 0 HB3 ASP A 136 6.451 16.625 -4.771 1.00 0.00 H new ATOM 743 N LYS A 137 8.469 13.577 -2.995 1.00 0.00 N ATOM 744 CA LYS A 137 9.285 12.904 -1.946 1.00 0.00 C ATOM 745 C LYS A 137 9.957 11.655 -2.529 1.00 0.00 C ATOM 746 O LYS A 137 10.609 10.910 -1.825 1.00 0.00 O ATOM 747 CB LYS A 137 8.363 12.495 -0.794 1.00 0.00 C ATOM 748 CG LYS A 137 7.888 13.744 -0.050 1.00 0.00 C ATOM 749 CD LYS A 137 7.220 13.338 1.267 1.00 0.00 C ATOM 750 CE LYS A 137 7.068 14.568 2.165 1.00 0.00 C ATOM 751 NZ LYS A 137 5.994 14.323 3.167 1.00 0.00 N ATOM 0 H LYS A 137 7.519 13.219 -3.095 1.00 0.00 H new ATOM 0 HA LYS A 137 10.056 13.586 -1.587 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.507 11.941 -1.179 1.00 0.00 H new ATOM 0 HB3 LYS A 137 8.891 11.831 -0.110 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.732 14.404 0.148 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.185 14.302 -0.668 1.00 0.00 H new ATOM 0 HD2 LYS A 137 6.243 12.896 1.070 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.818 12.579 1.771 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.010 14.781 2.671 1.00 0.00 H new ATOM 0 HE3 LYS A 137 6.825 15.443 1.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 5.891 15.159 3.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 5.096 14.140 2.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 6.244 13.498 3.749 1.00 0.00 H new ATOM 765 N GLY A 138 9.794 11.408 -3.802 1.00 0.00 N ATOM 766 CA GLY A 138 10.413 10.193 -4.411 1.00 0.00 C ATOM 767 C GLY A 138 11.856 10.474 -4.848 1.00 0.00 C ATOM 768 O GLY A 138 12.768 9.740 -4.515 1.00 0.00 O ATOM 0 H GLY A 138 9.261 11.993 -4.445 1.00 0.00 H new ATOM 0 HA2 GLY A 138 10.400 9.374 -3.692 1.00 0.00 H new ATOM 0 HA3 GLY A 138 9.824 9.872 -5.271 1.00 0.00 H new ATOM 772 N ASP A 139 12.071 11.513 -5.608 1.00 0.00 N ATOM 773 CA ASP A 139 13.453 11.815 -6.088 1.00 0.00 C ATOM 774 C ASP A 139 14.273 12.456 -4.970 1.00 0.00 C ATOM 775 O ASP A 139 15.197 13.205 -5.219 1.00 0.00 O ATOM 776 CB ASP A 139 13.380 12.771 -7.279 1.00 0.00 C ATOM 777 CG ASP A 139 12.835 14.121 -6.816 1.00 0.00 C ATOM 778 OD1 ASP A 139 13.512 14.775 -6.041 1.00 0.00 O ATOM 779 OD2 ASP A 139 11.752 14.480 -7.248 1.00 0.00 O ATOM 0 H ASP A 139 11.351 12.166 -5.918 1.00 0.00 H new ATOM 0 HA ASP A 139 13.934 10.885 -6.391 1.00 0.00 H new ATOM 0 HB2 ASP A 139 14.369 12.898 -7.718 1.00 0.00 H new ATOM 0 HB3 ASP A 139 12.738 12.354 -8.055 1.00 0.00 H new ATOM 784 N SER A 140 13.951 12.172 -3.738 1.00 0.00 N ATOM 785 CA SER A 140 14.727 12.775 -2.620 1.00 0.00 C ATOM 786 C SER A 140 14.824 11.776 -1.460 1.00 0.00 C ATOM 787 O SER A 140 13.944 10.968 -1.243 1.00 0.00 O ATOM 788 CB SER A 140 14.033 14.057 -2.163 1.00 0.00 C ATOM 789 OG SER A 140 15.001 14.949 -1.619 1.00 0.00 O ATOM 0 H SER A 140 13.190 11.553 -3.459 1.00 0.00 H new ATOM 0 HA SER A 140 15.736 13.015 -2.956 1.00 0.00 H new ATOM 0 HB2 SER A 140 13.521 14.526 -3.003 1.00 0.00 H new ATOM 0 HB3 SER A 140 13.274 13.826 -1.416 1.00 0.00 H new ATOM 0 HG SER A 140 14.559 15.773 -1.327 1.00 0.00 H new ATOM 795 N ASN A 141 15.901 11.830 -0.724 1.00 0.00 N ATOM 796 CA ASN A 141 16.102 10.891 0.424 1.00 0.00 C ATOM 797 C ASN A 141 14.950 11.017 1.422 1.00 0.00 C ATOM 798 O ASN A 141 14.754 10.169 2.270 1.00 0.00 O ATOM 799 CB ASN A 141 17.409 11.259 1.129 1.00 0.00 C ATOM 800 CG ASN A 141 18.587 10.985 0.197 1.00 0.00 C ATOM 801 OD1 ASN A 141 18.551 10.063 -0.591 1.00 0.00 O ATOM 802 ND2 ASN A 141 19.635 11.761 0.247 1.00 0.00 N ATOM 0 H ASN A 141 16.662 12.493 -0.869 1.00 0.00 H new ATOM 0 HA ASN A 141 16.138 9.867 0.051 1.00 0.00 H new ATOM 0 HB2 ASN A 141 17.396 12.310 1.416 1.00 0.00 H new ATOM 0 HB3 ASN A 141 17.515 10.680 2.046 1.00 0.00 H new ATOM 0 HD21 ASN A 141 20.424 11.593 -0.377 1.00 0.00 H new ATOM 0 HD22 ASN A 141 19.665 12.536 0.910 1.00 0.00 H new ATOM 809 N SER A 142 14.206 12.076 1.339 1.00 0.00 N ATOM 810 CA SER A 142 13.081 12.287 2.293 1.00 0.00 C ATOM 811 C SER A 142 12.095 11.111 2.244 1.00 0.00 C ATOM 812 O SER A 142 11.224 10.992 3.084 1.00 0.00 O ATOM 813 CB SER A 142 12.353 13.571 1.909 1.00 0.00 C ATOM 814 OG SER A 142 11.458 13.296 0.842 1.00 0.00 O ATOM 0 H SER A 142 14.327 12.814 0.646 1.00 0.00 H new ATOM 0 HA SER A 142 13.480 12.359 3.305 1.00 0.00 H new ATOM 0 HB2 SER A 142 11.807 13.964 2.766 1.00 0.00 H new ATOM 0 HB3 SER A 142 13.071 14.335 1.610 1.00 0.00 H new ATOM 0 HG SER A 142 10.985 14.117 0.591 1.00 0.00 H new ATOM 820 N SER A 143 12.207 10.252 1.273 1.00 0.00 N ATOM 821 CA SER A 143 11.255 9.105 1.187 1.00 0.00 C ATOM 822 C SER A 143 11.335 8.256 2.461 1.00 0.00 C ATOM 823 O SER A 143 10.379 7.620 2.852 1.00 0.00 O ATOM 824 CB SER A 143 11.604 8.240 -0.029 1.00 0.00 C ATOM 825 OG SER A 143 12.743 7.445 0.269 1.00 0.00 O ATOM 0 H SER A 143 12.912 10.291 0.537 1.00 0.00 H new ATOM 0 HA SER A 143 10.241 9.492 1.082 1.00 0.00 H new ATOM 0 HB2 SER A 143 10.760 7.602 -0.290 1.00 0.00 H new ATOM 0 HB3 SER A 143 11.804 8.873 -0.894 1.00 0.00 H new ATOM 0 HG SER A 143 12.967 6.890 -0.507 1.00 0.00 H new ATOM 831 N ALA A 144 12.473 8.229 3.101 1.00 0.00 N ATOM 832 CA ALA A 144 12.629 7.409 4.342 1.00 0.00 C ATOM 833 C ALA A 144 11.662 7.868 5.446 1.00 0.00 C ATOM 834 O ALA A 144 11.251 7.086 6.280 1.00 0.00 O ATOM 835 CB ALA A 144 14.066 7.550 4.849 1.00 0.00 C ATOM 0 H ALA A 144 13.308 8.742 2.817 1.00 0.00 H new ATOM 0 HA ALA A 144 12.401 6.371 4.099 1.00 0.00 H new ATOM 0 HB1 ALA A 144 14.192 6.956 5.754 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.758 7.197 4.084 1.00 0.00 H new ATOM 0 HB3 ALA A 144 14.273 8.597 5.070 1.00 0.00 H new ATOM 841 N GLY A 145 11.322 9.125 5.484 1.00 0.00 N ATOM 842 CA GLY A 145 10.416 9.628 6.563 1.00 0.00 C ATOM 843 C GLY A 145 9.080 8.871 6.582 1.00 0.00 C ATOM 844 O GLY A 145 8.889 7.962 7.365 1.00 0.00 O ATOM 0 H GLY A 145 11.631 9.830 4.815 1.00 0.00 H new ATOM 0 HA2 GLY A 145 10.908 9.522 7.530 1.00 0.00 H new ATOM 0 HA3 GLY A 145 10.229 10.692 6.415 1.00 0.00 H new ATOM 848 N TRP A 146 8.141 9.259 5.758 1.00 0.00 N ATOM 849 CA TRP A 146 6.809 8.577 5.771 1.00 0.00 C ATOM 850 C TRP A 146 6.974 7.062 5.613 1.00 0.00 C ATOM 851 O TRP A 146 6.091 6.294 5.939 1.00 0.00 O ATOM 852 CB TRP A 146 5.919 9.142 4.654 1.00 0.00 C ATOM 853 CG TRP A 146 6.335 8.617 3.316 1.00 0.00 C ATOM 854 CD1 TRP A 146 7.593 8.637 2.826 1.00 0.00 C ATOM 855 CD2 TRP A 146 5.501 8.013 2.283 1.00 0.00 C ATOM 856 NE1 TRP A 146 7.588 8.079 1.558 1.00 0.00 N ATOM 857 CE2 TRP A 146 6.322 7.677 1.181 1.00 0.00 C ATOM 858 CE3 TRP A 146 4.127 7.722 2.200 1.00 0.00 C ATOM 859 CZ2 TRP A 146 5.798 7.077 0.034 1.00 0.00 C ATOM 860 CZ3 TRP A 146 3.596 7.118 1.047 1.00 0.00 C ATOM 861 CH2 TRP A 146 4.431 6.796 -0.034 1.00 0.00 C ATOM 0 H TRP A 146 8.236 10.015 5.079 1.00 0.00 H new ATOM 0 HA TRP A 146 6.330 8.766 6.732 1.00 0.00 H new ATOM 0 HB2 TRP A 146 4.879 8.877 4.845 1.00 0.00 H new ATOM 0 HB3 TRP A 146 5.976 10.230 4.655 1.00 0.00 H new ATOM 0 HD1 TRP A 146 8.461 9.025 3.339 1.00 0.00 H new ATOM 0 HE1 TRP A 146 8.418 7.978 0.974 1.00 0.00 H new ATOM 0 HE3 TRP A 146 3.476 7.964 3.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 6.445 6.832 -0.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 2.540 6.901 0.993 1.00 0.00 H new ATOM 0 HH2 TRP A 146 4.018 6.332 -0.917 1.00 0.00 H new ATOM 872 N LYS A 147 8.096 6.622 5.125 1.00 0.00 N ATOM 873 CA LYS A 147 8.305 5.157 4.958 1.00 0.00 C ATOM 874 C LYS A 147 8.003 4.438 6.279 1.00 0.00 C ATOM 875 O LYS A 147 7.332 3.424 6.303 1.00 0.00 O ATOM 876 CB LYS A 147 9.763 4.909 4.565 1.00 0.00 C ATOM 877 CG LYS A 147 9.944 3.457 4.126 1.00 0.00 C ATOM 878 CD LYS A 147 11.423 3.199 3.831 1.00 0.00 C ATOM 879 CE LYS A 147 11.571 1.878 3.074 1.00 0.00 C ATOM 880 NZ LYS A 147 13.009 1.643 2.765 1.00 0.00 N ATOM 0 H LYS A 147 8.877 7.210 4.834 1.00 0.00 H new ATOM 0 HA LYS A 147 7.640 4.775 4.184 1.00 0.00 H new ATOM 0 HB2 LYS A 147 10.050 5.581 3.756 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.418 5.127 5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 147 9.594 2.782 4.907 1.00 0.00 H new ATOM 0 HG3 LYS A 147 9.344 3.256 3.239 1.00 0.00 H new ATOM 0 HD2 LYS A 147 11.835 4.017 3.240 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.989 3.162 4.762 1.00 0.00 H new ATOM 0 HE2 LYS A 147 11.178 1.057 3.673 1.00 0.00 H new ATOM 0 HE3 LYS A 147 10.990 1.907 2.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 13.111 0.745 2.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 13.370 2.422 2.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 13.552 1.598 3.651 1.00 0.00 H new ATOM 894 N ASN A 148 8.496 4.948 7.375 1.00 0.00 N ATOM 895 CA ASN A 148 8.239 4.282 8.684 1.00 0.00 C ATOM 896 C ASN A 148 6.739 4.249 8.983 1.00 0.00 C ATOM 897 O ASN A 148 6.257 3.360 9.654 1.00 0.00 O ATOM 898 CB ASN A 148 8.977 5.028 9.803 1.00 0.00 C ATOM 899 CG ASN A 148 8.376 6.423 9.991 1.00 0.00 C ATOM 900 OD1 ASN A 148 7.753 6.957 9.096 1.00 0.00 O ATOM 901 ND2 ASN A 148 8.538 7.040 11.131 1.00 0.00 N ATOM 0 H ASN A 148 9.064 5.794 7.421 1.00 0.00 H new ATOM 0 HA ASN A 148 8.607 3.257 8.631 1.00 0.00 H new ATOM 0 HB2 ASN A 148 8.907 4.465 10.734 1.00 0.00 H new ATOM 0 HB3 ASN A 148 10.036 5.110 9.559 1.00 0.00 H new ATOM 0 HD21 ASN A 148 8.141 7.970 11.269 1.00 0.00 H new ATOM 0 HD22 ASN A 148 9.061 6.592 11.883 1.00 0.00 H new ATOM 908 N SER A 149 5.996 5.213 8.515 1.00 0.00 N ATOM 909 CA SER A 149 4.536 5.216 8.805 1.00 0.00 C ATOM 910 C SER A 149 3.865 3.952 8.250 1.00 0.00 C ATOM 911 O SER A 149 3.197 3.225 8.960 1.00 0.00 O ATOM 912 CB SER A 149 3.888 6.458 8.191 1.00 0.00 C ATOM 913 OG SER A 149 4.031 6.424 6.780 1.00 0.00 O ATOM 0 H SER A 149 6.333 5.992 7.949 1.00 0.00 H new ATOM 0 HA SER A 149 4.400 5.231 9.886 1.00 0.00 H new ATOM 0 HB2 SER A 149 2.832 6.499 8.458 1.00 0.00 H new ATOM 0 HB3 SER A 149 4.353 7.359 8.592 1.00 0.00 H new ATOM 0 HG SER A 149 4.982 6.464 6.547 1.00 0.00 H new ATOM 919 N ILE A 150 4.018 3.698 6.984 1.00 0.00 N ATOM 920 CA ILE A 150 3.364 2.496 6.382 1.00 0.00 C ATOM 921 C ILE A 150 3.859 1.208 7.045 1.00 0.00 C ATOM 922 O ILE A 150 3.080 0.342 7.390 1.00 0.00 O ATOM 923 CB ILE A 150 3.678 2.456 4.883 1.00 0.00 C ATOM 924 CG1 ILE A 150 2.959 3.628 4.208 1.00 0.00 C ATOM 925 CG2 ILE A 150 3.197 1.126 4.280 1.00 0.00 C ATOM 926 CD1 ILE A 150 3.415 3.758 2.753 1.00 0.00 C ATOM 0 H ILE A 150 4.565 4.266 6.337 1.00 0.00 H new ATOM 0 HA ILE A 150 2.288 2.567 6.541 1.00 0.00 H new ATOM 0 HB ILE A 150 4.753 2.536 4.724 1.00 0.00 H new ATOM 0 HG12 ILE A 150 1.881 3.474 4.247 1.00 0.00 H new ATOM 0 HG13 ILE A 150 3.169 4.552 4.747 1.00 0.00 H new ATOM 0 HG21 ILE A 150 3.424 1.106 3.214 1.00 0.00 H new ATOM 0 HG22 ILE A 150 3.704 0.298 4.775 1.00 0.00 H new ATOM 0 HG23 ILE A 150 2.121 1.030 4.423 1.00 0.00 H new ATOM 0 HD11 ILE A 150 2.898 4.594 2.283 1.00 0.00 H new ATOM 0 HD12 ILE A 150 4.490 3.934 2.723 1.00 0.00 H new ATOM 0 HD13 ILE A 150 3.182 2.839 2.215 1.00 0.00 H new ATOM 938 N ARG A 151 5.141 1.062 7.213 1.00 0.00 N ATOM 939 CA ARG A 151 5.673 -0.185 7.832 1.00 0.00 C ATOM 940 C ARG A 151 5.013 -0.455 9.193 1.00 0.00 C ATOM 941 O ARG A 151 4.747 -1.590 9.537 1.00 0.00 O ATOM 942 CB ARG A 151 7.186 -0.056 8.010 1.00 0.00 C ATOM 943 CG ARG A 151 7.861 -0.092 6.637 1.00 0.00 C ATOM 944 CD ARG A 151 9.374 0.023 6.809 1.00 0.00 C ATOM 945 NE ARG A 151 9.690 1.286 7.527 1.00 0.00 N ATOM 946 CZ ARG A 151 10.872 1.461 8.049 1.00 0.00 C ATOM 947 NH1 ARG A 151 11.771 0.521 7.949 1.00 0.00 N ATOM 948 NH2 ARG A 151 11.152 2.569 8.679 1.00 0.00 N ATOM 0 H ARG A 151 5.845 1.751 6.949 1.00 0.00 H new ATOM 0 HA ARG A 151 5.445 -1.022 7.173 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.425 0.876 8.522 1.00 0.00 H new ATOM 0 HB3 ARG A 151 7.561 -0.867 8.634 1.00 0.00 H new ATOM 0 HG2 ARG A 151 7.613 -1.020 6.122 1.00 0.00 H new ATOM 0 HG3 ARG A 151 7.492 0.725 6.017 1.00 0.00 H new ATOM 0 HD2 ARG A 151 9.754 -0.832 7.368 1.00 0.00 H new ATOM 0 HD3 ARG A 151 9.865 0.011 5.836 1.00 0.00 H new ATOM 0 HE ARG A 151 8.982 2.016 7.611 1.00 0.00 H new ATOM 0 HH11 ARG A 151 11.548 -0.348 7.463 1.00 0.00 H new ATOM 0 HH12 ARG A 151 12.696 0.655 8.356 1.00 0.00 H new ATOM 0 HH21 ARG A 151 10.446 3.300 8.764 1.00 0.00 H new ATOM 0 HH22 ARG A 151 12.077 2.704 9.087 1.00 0.00 H new ATOM 962 N HIS A 152 4.764 0.555 9.985 1.00 0.00 N ATOM 963 CA HIS A 152 4.148 0.295 11.325 1.00 0.00 C ATOM 964 C HIS A 152 2.728 -0.263 11.174 1.00 0.00 C ATOM 965 O HIS A 152 2.308 -1.108 11.939 1.00 0.00 O ATOM 966 CB HIS A 152 4.132 1.576 12.176 1.00 0.00 C ATOM 967 CG HIS A 152 3.079 2.545 11.701 1.00 0.00 C ATOM 968 ND1 HIS A 152 3.400 3.839 11.315 1.00 0.00 N ATOM 969 CD2 HIS A 152 1.712 2.450 11.578 1.00 0.00 C ATOM 970 CE1 HIS A 152 2.256 4.463 10.979 1.00 0.00 C ATOM 971 NE2 HIS A 152 1.202 3.661 11.120 1.00 0.00 N ATOM 0 H HIS A 152 4.956 1.533 9.770 1.00 0.00 H new ATOM 0 HA HIS A 152 4.758 -0.451 11.836 1.00 0.00 H new ATOM 0 HB2 HIS A 152 3.946 1.318 13.219 1.00 0.00 H new ATOM 0 HB3 HIS A 152 5.111 2.053 12.135 1.00 0.00 H new ATOM 0 HD2 HIS A 152 1.125 1.571 11.802 1.00 0.00 H new ATOM 0 HE1 HIS A 152 2.200 5.486 10.638 1.00 0.00 H new ATOM 0 HE2 HIS A 152 0.225 3.887 10.932 1.00 0.00 H new ATOM 980 N ASN A 153 1.976 0.193 10.210 1.00 0.00 N ATOM 981 CA ASN A 153 0.584 -0.331 10.052 1.00 0.00 C ATOM 982 C ASN A 153 0.621 -1.782 9.569 1.00 0.00 C ATOM 983 O ASN A 153 -0.157 -2.608 10.004 1.00 0.00 O ATOM 984 CB ASN A 153 -0.168 0.529 9.036 1.00 0.00 C ATOM 985 CG ASN A 153 -0.226 1.972 9.538 1.00 0.00 C ATOM 986 OD1 ASN A 153 -0.749 2.237 10.602 1.00 0.00 O ATOM 987 ND2 ASN A 153 0.297 2.924 8.814 1.00 0.00 N ATOM 0 H ASN A 153 2.259 0.899 9.530 1.00 0.00 H new ATOM 0 HA ASN A 153 0.074 -0.292 11.015 1.00 0.00 H new ATOM 0 HB2 ASN A 153 0.332 0.489 8.068 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -1.177 0.142 8.891 1.00 0.00 H new ATOM 0 HD21 ASN A 153 0.266 3.889 9.142 1.00 0.00 H new ATOM 0 HD22 ASN A 153 0.736 2.702 7.921 1.00 0.00 H new ATOM 994 N LEU A 154 1.509 -2.098 8.675 1.00 0.00 N ATOM 995 CA LEU A 154 1.585 -3.492 8.160 1.00 0.00 C ATOM 996 C LEU A 154 1.848 -4.481 9.301 1.00 0.00 C ATOM 997 O LEU A 154 1.262 -5.545 9.353 1.00 0.00 O ATOM 998 CB LEU A 154 2.718 -3.589 7.134 1.00 0.00 C ATOM 999 CG LEU A 154 2.445 -2.650 5.953 1.00 0.00 C ATOM 1000 CD1 LEU A 154 3.461 -2.926 4.844 1.00 0.00 C ATOM 1001 CD2 LEU A 154 1.030 -2.885 5.410 1.00 0.00 C ATOM 0 H LEU A 154 2.189 -1.451 8.276 1.00 0.00 H new ATOM 0 HA LEU A 154 0.632 -3.745 7.694 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.667 -3.328 7.603 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.809 -4.615 6.778 1.00 0.00 H new ATOM 0 HG LEU A 154 2.532 -1.617 6.290 1.00 0.00 H new ATOM 0 HD11 LEU A 154 3.270 -2.260 4.002 1.00 0.00 H new ATOM 0 HD12 LEU A 154 4.469 -2.753 5.222 1.00 0.00 H new ATOM 0 HD13 LEU A 154 3.369 -3.961 4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.846 -2.213 4.572 1.00 0.00 H new ATOM 0 HD22 LEU A 154 0.936 -3.918 5.075 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.301 -2.691 6.197 1.00 0.00 H new ATOM 1013 N SER A 155 2.740 -4.160 10.192 1.00 0.00 N ATOM 1014 CA SER A 155 3.055 -5.104 11.303 1.00 0.00 C ATOM 1015 C SER A 155 2.111 -4.911 12.500 1.00 0.00 C ATOM 1016 O SER A 155 1.807 -5.850 13.210 1.00 0.00 O ATOM 1017 CB SER A 155 4.499 -4.879 11.752 1.00 0.00 C ATOM 1018 OG SER A 155 4.554 -3.741 12.603 1.00 0.00 O ATOM 0 H SER A 155 3.266 -3.286 10.202 1.00 0.00 H new ATOM 0 HA SER A 155 2.921 -6.121 10.935 1.00 0.00 H new ATOM 0 HB2 SER A 155 4.870 -5.759 12.278 1.00 0.00 H new ATOM 0 HB3 SER A 155 5.143 -4.731 10.885 1.00 0.00 H new ATOM 0 HG SER A 155 5.478 -3.595 12.894 1.00 0.00 H new ATOM 1024 N LEU A 156 1.676 -3.708 12.763 1.00 0.00 N ATOM 1025 CA LEU A 156 0.793 -3.487 13.950 1.00 0.00 C ATOM 1026 C LEU A 156 -0.643 -3.977 13.692 1.00 0.00 C ATOM 1027 O LEU A 156 -1.264 -4.544 14.568 1.00 0.00 O ATOM 1028 CB LEU A 156 0.799 -1.998 14.322 1.00 0.00 C ATOM 1029 CG LEU A 156 2.199 -1.604 14.826 1.00 0.00 C ATOM 1030 CD1 LEU A 156 2.231 -0.110 15.155 1.00 0.00 C ATOM 1031 CD2 LEU A 156 2.551 -2.410 16.087 1.00 0.00 C ATOM 0 H LEU A 156 1.890 -2.875 12.215 1.00 0.00 H new ATOM 0 HA LEU A 156 1.185 -4.071 14.783 1.00 0.00 H new ATOM 0 HB2 LEU A 156 0.529 -1.394 13.456 1.00 0.00 H new ATOM 0 HB3 LEU A 156 0.054 -1.801 15.093 1.00 0.00 H new ATOM 0 HG LEU A 156 2.927 -1.821 14.045 1.00 0.00 H new ATOM 0 HD11 LEU A 156 3.224 0.163 15.511 1.00 0.00 H new ATOM 0 HD12 LEU A 156 1.996 0.465 14.259 1.00 0.00 H new ATOM 0 HD13 LEU A 156 1.495 0.108 15.929 1.00 0.00 H new ATOM 0 HD21 LEU A 156 3.543 -2.124 16.436 1.00 0.00 H new ATOM 0 HD22 LEU A 156 1.818 -2.203 16.867 1.00 0.00 H new ATOM 0 HD23 LEU A 156 2.541 -3.475 15.853 1.00 0.00 H new ATOM 1043 N HIS A 157 -1.185 -3.783 12.515 1.00 0.00 N ATOM 1044 CA HIS A 157 -2.582 -4.267 12.263 1.00 0.00 C ATOM 1045 C HIS A 157 -2.540 -5.660 11.631 1.00 0.00 C ATOM 1046 O HIS A 157 -1.770 -5.919 10.729 1.00 0.00 O ATOM 1047 CB HIS A 157 -3.312 -3.310 11.317 1.00 0.00 C ATOM 1048 CG HIS A 157 -3.469 -1.971 11.975 1.00 0.00 C ATOM 1049 ND1 HIS A 157 -3.647 -1.833 13.346 1.00 0.00 N ATOM 1050 CD2 HIS A 157 -3.478 -0.694 11.466 1.00 0.00 C ATOM 1051 CE1 HIS A 157 -3.753 -0.518 13.611 1.00 0.00 C ATOM 1052 NE2 HIS A 157 -3.656 0.216 12.501 1.00 0.00 N ATOM 0 H HIS A 157 -0.731 -3.319 11.728 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.113 -4.308 13.214 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -2.753 -3.206 10.387 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -4.290 -3.715 11.057 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -3.364 -0.438 10.423 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -3.899 -0.108 14.599 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -3.703 1.232 12.428 1.00 0.00 H new ATOM 1061 N SER A 158 -3.361 -6.561 12.104 1.00 0.00 N ATOM 1062 CA SER A 158 -3.361 -7.938 11.535 1.00 0.00 C ATOM 1063 C SER A 158 -4.165 -7.974 10.230 1.00 0.00 C ATOM 1064 O SER A 158 -4.253 -8.997 9.580 1.00 0.00 O ATOM 1065 CB SER A 158 -3.972 -8.908 12.547 1.00 0.00 C ATOM 1066 OG SER A 158 -5.273 -8.456 12.906 1.00 0.00 O ATOM 0 H SER A 158 -4.029 -6.402 12.858 1.00 0.00 H new ATOM 0 HA SER A 158 -2.334 -8.234 11.321 1.00 0.00 H new ATOM 0 HB2 SER A 158 -4.027 -9.909 12.120 1.00 0.00 H new ATOM 0 HB3 SER A 158 -3.340 -8.973 13.433 1.00 0.00 H new ATOM 0 HG SER A 158 -5.668 -9.077 13.553 1.00 0.00 H new ATOM 1072 N LYS A 159 -4.749 -6.872 9.832 1.00 0.00 N ATOM 1073 CA LYS A 159 -5.530 -6.872 8.560 1.00 0.00 C ATOM 1074 C LYS A 159 -4.666 -7.466 7.450 1.00 0.00 C ATOM 1075 O LYS A 159 -5.150 -8.136 6.557 1.00 0.00 O ATOM 1076 CB LYS A 159 -5.915 -5.437 8.169 1.00 0.00 C ATOM 1077 CG LYS A 159 -6.873 -4.844 9.209 1.00 0.00 C ATOM 1078 CD LYS A 159 -7.776 -3.792 8.549 1.00 0.00 C ATOM 1079 CE LYS A 159 -6.929 -2.791 7.752 1.00 0.00 C ATOM 1080 NZ LYS A 159 -7.698 -1.524 7.579 1.00 0.00 N ATOM 0 H LYS A 159 -4.719 -5.981 10.328 1.00 0.00 H new ATOM 0 HA LYS A 159 -6.436 -7.461 8.700 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -5.020 -4.820 8.095 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -6.386 -5.434 7.186 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -7.482 -5.635 9.648 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -6.306 -4.390 10.022 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -8.493 -4.280 7.888 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -8.352 -3.267 9.311 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -5.992 -2.593 8.273 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -6.670 -3.209 6.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -7.127 -0.843 7.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -8.580 -1.721 7.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -7.923 -1.124 8.512 1.00 0.00 H new ATOM 1094 N PHE A 160 -3.390 -7.210 7.496 1.00 0.00 N ATOM 1095 CA PHE A 160 -2.476 -7.734 6.447 1.00 0.00 C ATOM 1096 C PHE A 160 -1.845 -9.046 6.923 1.00 0.00 C ATOM 1097 O PHE A 160 -1.325 -9.133 8.018 1.00 0.00 O ATOM 1098 CB PHE A 160 -1.388 -6.691 6.189 1.00 0.00 C ATOM 1099 CG PHE A 160 -2.013 -5.315 6.206 1.00 0.00 C ATOM 1100 CD1 PHE A 160 -2.741 -4.874 5.097 1.00 0.00 C ATOM 1101 CD2 PHE A 160 -1.867 -4.483 7.325 1.00 0.00 C ATOM 1102 CE1 PHE A 160 -3.326 -3.604 5.103 1.00 0.00 C ATOM 1103 CE2 PHE A 160 -2.454 -3.214 7.330 1.00 0.00 C ATOM 1104 CZ PHE A 160 -3.183 -2.774 6.219 1.00 0.00 C ATOM 0 H PHE A 160 -2.938 -6.655 8.222 1.00 0.00 H new ATOM 0 HA PHE A 160 -3.028 -7.927 5.527 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -0.611 -6.761 6.950 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -0.910 -6.876 5.227 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -2.852 -5.515 4.235 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -1.302 -4.822 8.181 1.00 0.00 H new ATOM 0 HE1 PHE A 160 -3.888 -3.264 4.246 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -2.345 -2.573 8.192 1.00 0.00 H new ATOM 0 HZ PHE A 160 -3.635 -1.793 6.224 1.00 0.00 H new ATOM 1114 N ILE A 161 -1.894 -10.067 6.108 1.00 0.00 N ATOM 1115 CA ILE A 161 -1.306 -11.378 6.508 1.00 0.00 C ATOM 1116 C ILE A 161 0.053 -11.568 5.826 1.00 0.00 C ATOM 1117 O ILE A 161 0.281 -11.093 4.731 1.00 0.00 O ATOM 1118 CB ILE A 161 -2.283 -12.497 6.130 1.00 0.00 C ATOM 1119 CG1 ILE A 161 -2.210 -12.792 4.626 1.00 0.00 C ATOM 1120 CG2 ILE A 161 -3.705 -12.053 6.481 1.00 0.00 C ATOM 1121 CD1 ILE A 161 -3.407 -13.657 4.212 1.00 0.00 C ATOM 0 H ILE A 161 -2.317 -10.049 5.180 1.00 0.00 H new ATOM 0 HA ILE A 161 -1.144 -11.406 7.585 1.00 0.00 H new ATOM 0 HB ILE A 161 -2.017 -13.400 6.680 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -2.210 -11.859 4.062 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -1.278 -13.306 4.391 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -4.408 -12.842 6.216 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -3.770 -11.853 7.551 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -3.951 -11.147 5.927 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -3.353 -13.865 3.143 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -3.387 -14.595 4.766 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -4.333 -13.126 4.432 1.00 0.00 H new ATOM 1133 N LYS A 162 0.971 -12.231 6.485 1.00 0.00 N ATOM 1134 CA LYS A 162 2.329 -12.424 5.894 1.00 0.00 C ATOM 1135 C LYS A 162 2.363 -13.678 5.018 1.00 0.00 C ATOM 1136 O LYS A 162 1.806 -14.705 5.355 1.00 0.00 O ATOM 1137 CB LYS A 162 3.356 -12.559 7.025 1.00 0.00 C ATOM 1138 CG LYS A 162 4.729 -12.073 6.543 1.00 0.00 C ATOM 1139 CD LYS A 162 4.797 -10.543 6.618 1.00 0.00 C ATOM 1140 CE LYS A 162 6.257 -10.097 6.551 1.00 0.00 C ATOM 1141 NZ LYS A 162 6.966 -10.544 7.782 1.00 0.00 N ATOM 0 H LYS A 162 0.837 -12.647 7.407 1.00 0.00 H new ATOM 0 HA LYS A 162 2.570 -11.561 5.273 1.00 0.00 H new ATOM 0 HB2 LYS A 162 3.037 -11.976 7.889 1.00 0.00 H new ATOM 0 HB3 LYS A 162 3.421 -13.598 7.347 1.00 0.00 H new ATOM 0 HG2 LYS A 162 5.516 -12.511 7.157 1.00 0.00 H new ATOM 0 HG3 LYS A 162 4.903 -12.404 5.519 1.00 0.00 H new ATOM 0 HD2 LYS A 162 4.232 -10.102 5.797 1.00 0.00 H new ATOM 0 HD3 LYS A 162 4.340 -10.192 7.543 1.00 0.00 H new ATOM 0 HE2 LYS A 162 6.737 -10.518 5.668 1.00 0.00 H new ATOM 0 HE3 LYS A 162 6.314 -9.012 6.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 7.731 -9.875 8.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 6.295 -10.579 8.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 7.368 -11.490 7.627 1.00 0.00 H new ATOM 1155 N VAL A 163 3.018 -13.593 3.891 1.00 0.00 N ATOM 1156 CA VAL A 163 3.099 -14.763 2.969 1.00 0.00 C ATOM 1157 C VAL A 163 4.519 -15.327 2.940 1.00 0.00 C ATOM 1158 O VAL A 163 5.461 -14.641 2.596 1.00 0.00 O ATOM 1159 CB VAL A 163 2.725 -14.290 1.569 1.00 0.00 C ATOM 1160 CG1 VAL A 163 2.969 -15.411 0.545 1.00 0.00 C ATOM 1161 CG2 VAL A 163 1.249 -13.889 1.564 1.00 0.00 C ATOM 0 H VAL A 163 3.504 -12.757 3.567 1.00 0.00 H new ATOM 0 HA VAL A 163 2.421 -15.544 3.313 1.00 0.00 H new ATOM 0 HB VAL A 163 3.342 -13.435 1.295 1.00 0.00 H new ATOM 0 HG11 VAL A 163 2.698 -15.060 -0.451 1.00 0.00 H new ATOM 0 HG12 VAL A 163 4.022 -15.691 0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 163 2.360 -16.278 0.802 1.00 0.00 H new ATOM 0 HG21 VAL A 163 0.968 -13.548 0.568 1.00 0.00 H new ATOM 0 HG22 VAL A 163 0.638 -14.748 1.840 1.00 0.00 H new ATOM 0 HG23 VAL A 163 1.088 -13.084 2.281 1.00 0.00 H new ATOM 1171 N HIS A 164 4.683 -16.577 3.270 1.00 0.00 N ATOM 1172 CA HIS A 164 6.044 -17.171 3.229 1.00 0.00 C ATOM 1173 C HIS A 164 6.412 -17.427 1.764 1.00 0.00 C ATOM 1174 O HIS A 164 6.056 -18.433 1.183 1.00 0.00 O ATOM 1175 CB HIS A 164 6.067 -18.485 4.029 1.00 0.00 C ATOM 1176 CG HIS A 164 5.474 -19.598 3.208 1.00 0.00 C ATOM 1177 ND1 HIS A 164 4.165 -19.560 2.745 1.00 0.00 N ATOM 1178 CD2 HIS A 164 6.005 -20.777 2.737 1.00 0.00 C ATOM 1179 CE1 HIS A 164 3.955 -20.682 2.029 1.00 0.00 C ATOM 1180 NE2 HIS A 164 5.041 -21.454 1.995 1.00 0.00 N ATOM 0 H HIS A 164 3.938 -17.208 3.564 1.00 0.00 H new ATOM 0 HA HIS A 164 6.768 -16.490 3.677 1.00 0.00 H new ATOM 0 HB2 HIS A 164 7.091 -18.733 4.307 1.00 0.00 H new ATOM 0 HB3 HIS A 164 5.505 -18.366 4.955 1.00 0.00 H new ATOM 0 HD2 HIS A 164 7.012 -21.123 2.915 1.00 0.00 H new ATOM 0 HE1 HIS A 164 3.022 -20.926 1.543 1.00 0.00 H new ATOM 0 HE2 HIS A 164 5.144 -22.353 1.524 1.00 0.00 H new ATOM 1189 N ASN A 165 7.105 -16.512 1.155 1.00 0.00 N ATOM 1190 CA ASN A 165 7.475 -16.685 -0.275 1.00 0.00 C ATOM 1191 C ASN A 165 8.319 -17.947 -0.450 1.00 0.00 C ATOM 1192 O ASN A 165 9.183 -18.242 0.351 1.00 0.00 O ATOM 1193 CB ASN A 165 8.294 -15.478 -0.730 1.00 0.00 C ATOM 1194 CG ASN A 165 8.410 -15.476 -2.250 1.00 0.00 C ATOM 1195 OD1 ASN A 165 7.861 -16.332 -2.917 1.00 0.00 O ATOM 1196 ND2 ASN A 165 9.111 -14.543 -2.828 1.00 0.00 N ATOM 0 H ASN A 165 7.433 -15.648 1.586 1.00 0.00 H new ATOM 0 HA ASN A 165 6.566 -16.772 -0.870 1.00 0.00 H new ATOM 0 HB2 ASN A 165 7.820 -14.557 -0.391 1.00 0.00 H new ATOM 0 HB3 ASN A 165 9.286 -15.510 -0.280 1.00 0.00 H new ATOM 0 HD21 ASN A 165 9.201 -14.528 -3.844 1.00 0.00 H new ATOM 0 HD22 ASN A 165 9.570 -13.827 -2.265 1.00 0.00 H new ATOM 1203 N GLU A 166 8.090 -18.685 -1.505 1.00 0.00 N ATOM 1204 CA GLU A 166 8.905 -19.908 -1.733 1.00 0.00 C ATOM 1205 C GLU A 166 10.334 -19.469 -2.055 1.00 0.00 C ATOM 1206 O GLU A 166 11.293 -20.132 -1.716 1.00 0.00 O ATOM 1207 CB GLU A 166 8.349 -20.703 -2.922 1.00 0.00 C ATOM 1208 CG GLU A 166 6.984 -21.301 -2.571 1.00 0.00 C ATOM 1209 CD GLU A 166 6.470 -22.122 -3.760 1.00 0.00 C ATOM 1210 OE1 GLU A 166 7.223 -22.292 -4.705 1.00 0.00 O ATOM 1211 OE2 GLU A 166 5.337 -22.568 -3.702 1.00 0.00 O ATOM 0 H GLU A 166 7.379 -18.494 -2.211 1.00 0.00 H new ATOM 0 HA GLU A 166 8.879 -20.539 -0.845 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.256 -20.052 -3.791 1.00 0.00 H new ATOM 0 HB3 GLU A 166 9.043 -21.499 -3.193 1.00 0.00 H new ATOM 0 HG2 GLU A 166 7.067 -21.933 -1.687 1.00 0.00 H new ATOM 0 HG3 GLU A 166 6.277 -20.507 -2.330 1.00 0.00 H new ATOM 1218 N ALA A 167 10.470 -18.346 -2.716 1.00 0.00 N ATOM 1219 CA ALA A 167 11.819 -17.831 -3.086 1.00 0.00 C ATOM 1220 C ALA A 167 12.664 -17.592 -1.831 1.00 0.00 C ATOM 1221 O ALA A 167 13.147 -16.503 -1.595 1.00 0.00 O ATOM 1222 CB ALA A 167 11.661 -16.511 -3.843 1.00 0.00 C ATOM 0 H ALA A 167 9.692 -17.759 -3.017 1.00 0.00 H new ATOM 0 HA ALA A 167 12.319 -18.569 -3.713 1.00 0.00 H new ATOM 0 HB1 ALA A 167 12.644 -16.129 -4.117 1.00 0.00 H new ATOM 0 HB2 ALA A 167 11.072 -16.677 -4.745 1.00 0.00 H new ATOM 0 HB3 ALA A 167 11.154 -15.785 -3.207 1.00 0.00 H new ATOM 1228 N THR A 168 12.860 -18.606 -1.041 1.00 0.00 N ATOM 1229 CA THR A 168 13.694 -18.465 0.191 1.00 0.00 C ATOM 1230 C THR A 168 13.171 -17.336 1.092 1.00 0.00 C ATOM 1231 O THR A 168 13.800 -16.978 2.068 1.00 0.00 O ATOM 1232 CB THR A 168 15.142 -18.166 -0.217 1.00 0.00 C ATOM 1233 OG1 THR A 168 15.680 -19.290 -0.899 1.00 0.00 O ATOM 1234 CG2 THR A 168 15.983 -17.875 1.029 1.00 0.00 C ATOM 0 H THR A 168 12.476 -19.538 -1.194 1.00 0.00 H new ATOM 0 HA THR A 168 13.643 -19.397 0.753 1.00 0.00 H new ATOM 0 HB THR A 168 15.160 -17.295 -0.873 1.00 0.00 H new ATOM 0 HG1 THR A 168 16.605 -19.101 -1.162 1.00 0.00 H new ATOM 0 HG21 THR A 168 17.011 -17.663 0.733 1.00 0.00 H new ATOM 0 HG22 THR A 168 15.571 -17.012 1.553 1.00 0.00 H new ATOM 0 HG23 THR A 168 15.967 -18.742 1.689 1.00 0.00 H new ATOM 1242 N GLY A 169 12.034 -16.777 0.799 1.00 0.00 N ATOM 1243 CA GLY A 169 11.513 -15.691 1.679 1.00 0.00 C ATOM 1244 C GLY A 169 12.378 -14.433 1.540 1.00 0.00 C ATOM 1245 O GLY A 169 12.676 -13.768 2.514 1.00 0.00 O ATOM 0 H GLY A 169 11.447 -17.018 0.000 1.00 0.00 H new ATOM 0 HA2 GLY A 169 10.481 -15.462 1.414 1.00 0.00 H new ATOM 0 HA3 GLY A 169 11.509 -16.025 2.717 1.00 0.00 H new ATOM 1249 N LYS A 170 12.767 -14.081 0.344 1.00 0.00 N ATOM 1250 CA LYS A 170 13.592 -12.850 0.173 1.00 0.00 C ATOM 1251 C LYS A 170 12.660 -11.642 0.233 1.00 0.00 C ATOM 1252 O LYS A 170 13.017 -10.585 0.713 1.00 0.00 O ATOM 1253 CB LYS A 170 14.288 -12.861 -1.191 1.00 0.00 C ATOM 1254 CG LYS A 170 15.348 -13.965 -1.242 1.00 0.00 C ATOM 1255 CD LYS A 170 16.085 -13.886 -2.582 1.00 0.00 C ATOM 1256 CE LYS A 170 17.200 -14.934 -2.631 1.00 0.00 C ATOM 1257 NZ LYS A 170 18.278 -14.465 -3.547 1.00 0.00 N ATOM 0 H LYS A 170 12.552 -14.587 -0.515 1.00 0.00 H new ATOM 0 HA LYS A 170 14.347 -12.806 0.958 1.00 0.00 H new ATOM 0 HB2 LYS A 170 13.553 -13.018 -1.980 1.00 0.00 H new ATOM 0 HB3 LYS A 170 14.753 -11.893 -1.377 1.00 0.00 H new ATOM 0 HG2 LYS A 170 16.052 -13.850 -0.418 1.00 0.00 H new ATOM 0 HG3 LYS A 170 14.880 -14.942 -1.127 1.00 0.00 H new ATOM 0 HD2 LYS A 170 15.385 -14.050 -3.401 1.00 0.00 H new ATOM 0 HD3 LYS A 170 16.506 -12.889 -2.717 1.00 0.00 H new ATOM 0 HE2 LYS A 170 17.603 -15.100 -1.632 1.00 0.00 H new ATOM 0 HE3 LYS A 170 16.803 -15.888 -2.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 19.037 -15.175 -3.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 17.888 -14.328 -4.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 18.663 -13.564 -3.198 1.00 0.00 H new ATOM 1271 N SER A 171 11.460 -11.805 -0.249 1.00 0.00 N ATOM 1272 CA SER A 171 10.473 -10.692 -0.232 1.00 0.00 C ATOM 1273 C SER A 171 9.072 -11.284 -0.024 1.00 0.00 C ATOM 1274 O SER A 171 8.443 -11.761 -0.948 1.00 0.00 O ATOM 1275 CB SER A 171 10.539 -9.948 -1.568 1.00 0.00 C ATOM 1276 OG SER A 171 9.263 -9.407 -1.872 1.00 0.00 O ATOM 0 H SER A 171 11.118 -12.674 -0.659 1.00 0.00 H new ATOM 0 HA SER A 171 10.695 -9.994 0.575 1.00 0.00 H new ATOM 0 HB2 SER A 171 11.281 -9.151 -1.516 1.00 0.00 H new ATOM 0 HB3 SER A 171 10.856 -10.627 -2.359 1.00 0.00 H new ATOM 0 HG SER A 171 9.305 -8.930 -2.727 1.00 0.00 H new ATOM 1282 N SER A 172 8.589 -11.278 1.191 1.00 0.00 N ATOM 1283 CA SER A 172 7.242 -11.860 1.474 1.00 0.00 C ATOM 1284 C SER A 172 6.145 -11.051 0.787 1.00 0.00 C ATOM 1285 O SER A 172 6.248 -9.853 0.621 1.00 0.00 O ATOM 1286 CB SER A 172 6.988 -11.853 2.983 1.00 0.00 C ATOM 1287 OG SER A 172 8.211 -12.057 3.671 1.00 0.00 O ATOM 0 H SER A 172 9.071 -10.893 2.003 1.00 0.00 H new ATOM 0 HA SER A 172 7.224 -12.880 1.091 1.00 0.00 H new ATOM 0 HB2 SER A 172 6.544 -10.904 3.283 1.00 0.00 H new ATOM 0 HB3 SER A 172 6.276 -12.635 3.246 1.00 0.00 H new ATOM 0 HG SER A 172 8.048 -12.051 4.637 1.00 0.00 H new ATOM 1293 N TRP A 173 5.085 -11.704 0.396 1.00 0.00 N ATOM 1294 CA TRP A 173 3.970 -10.989 -0.267 1.00 0.00 C ATOM 1295 C TRP A 173 2.966 -10.504 0.776 1.00 0.00 C ATOM 1296 O TRP A 173 2.677 -11.182 1.747 1.00 0.00 O ATOM 1297 CB TRP A 173 3.267 -11.942 -1.221 1.00 0.00 C ATOM 1298 CG TRP A 173 4.246 -12.440 -2.218 1.00 0.00 C ATOM 1299 CD1 TRP A 173 5.239 -13.327 -1.982 1.00 0.00 C ATOM 1300 CD2 TRP A 173 4.339 -12.079 -3.610 1.00 0.00 C ATOM 1301 NE1 TRP A 173 5.933 -13.536 -3.161 1.00 0.00 N ATOM 1302 CE2 TRP A 173 5.410 -12.783 -4.197 1.00 0.00 C ATOM 1303 CE3 TRP A 173 3.591 -11.212 -4.405 1.00 0.00 C ATOM 1304 CZ2 TRP A 173 5.728 -12.627 -5.545 1.00 0.00 C ATOM 1305 CZ3 TRP A 173 3.900 -11.046 -5.764 1.00 0.00 C ATOM 1306 CH2 TRP A 173 4.969 -11.754 -6.334 1.00 0.00 C ATOM 0 H TRP A 173 4.947 -12.708 0.510 1.00 0.00 H new ATOM 0 HA TRP A 173 4.367 -10.132 -0.812 1.00 0.00 H new ATOM 0 HB2 TRP A 173 2.835 -12.777 -0.669 1.00 0.00 H new ATOM 0 HB3 TRP A 173 2.445 -11.433 -1.723 1.00 0.00 H new ATOM 0 HD1 TRP A 173 5.454 -13.794 -1.032 1.00 0.00 H new ATOM 0 HE1 TRP A 173 6.730 -14.166 -3.254 1.00 0.00 H new ATOM 0 HE3 TRP A 173 2.767 -10.664 -3.972 1.00 0.00 H new ATOM 0 HZ2 TRP A 173 6.552 -13.175 -5.977 1.00 0.00 H new ATOM 0 HZ3 TRP A 173 3.314 -10.372 -6.372 1.00 0.00 H new ATOM 0 HH2 TRP A 173 5.206 -11.626 -7.380 1.00 0.00 H new ATOM 1317 N TRP A 174 2.421 -9.343 0.568 1.00 0.00 N ATOM 1318 CA TRP A 174 1.416 -8.797 1.518 1.00 0.00 C ATOM 1319 C TRP A 174 0.013 -9.093 0.973 1.00 0.00 C ATOM 1320 O TRP A 174 -0.283 -8.817 -0.173 1.00 0.00 O ATOM 1321 CB TRP A 174 1.617 -7.286 1.627 1.00 0.00 C ATOM 1322 CG TRP A 174 2.795 -7.000 2.499 1.00 0.00 C ATOM 1323 CD1 TRP A 174 4.012 -6.595 2.064 1.00 0.00 C ATOM 1324 CD2 TRP A 174 2.887 -7.092 3.947 1.00 0.00 C ATOM 1325 NE1 TRP A 174 4.842 -6.425 3.157 1.00 0.00 N ATOM 1326 CE2 TRP A 174 4.193 -6.720 4.341 1.00 0.00 C ATOM 1327 CE3 TRP A 174 1.971 -7.457 4.947 1.00 0.00 C ATOM 1328 CZ2 TRP A 174 4.575 -6.711 5.683 1.00 0.00 C ATOM 1329 CZ3 TRP A 174 2.351 -7.450 6.298 1.00 0.00 C ATOM 1330 CH2 TRP A 174 3.652 -7.076 6.665 1.00 0.00 C ATOM 0 H TRP A 174 2.630 -8.741 -0.228 1.00 0.00 H new ATOM 0 HA TRP A 174 1.530 -9.254 2.501 1.00 0.00 H new ATOM 0 HB2 TRP A 174 1.772 -6.857 0.637 1.00 0.00 H new ATOM 0 HB3 TRP A 174 0.723 -6.819 2.041 1.00 0.00 H new ATOM 0 HD1 TRP A 174 4.289 -6.432 1.033 1.00 0.00 H new ATOM 0 HE1 TRP A 174 5.813 -6.120 3.097 1.00 0.00 H new ATOM 0 HE3 TRP A 174 0.967 -7.745 4.674 1.00 0.00 H new ATOM 0 HZ2 TRP A 174 5.578 -6.423 5.960 1.00 0.00 H new ATOM 0 HZ3 TRP A 174 1.639 -7.734 7.058 1.00 0.00 H new ATOM 0 HH2 TRP A 174 3.940 -7.070 7.706 1.00 0.00 H new ATOM 1341 N MET A 175 -0.849 -9.658 1.779 1.00 0.00 N ATOM 1342 CA MET A 175 -2.233 -9.977 1.299 1.00 0.00 C ATOM 1343 C MET A 175 -3.258 -9.624 2.381 1.00 0.00 C ATOM 1344 O MET A 175 -2.968 -9.656 3.560 1.00 0.00 O ATOM 1345 CB MET A 175 -2.343 -11.480 1.001 1.00 0.00 C ATOM 1346 CG MET A 175 -1.681 -11.816 -0.339 1.00 0.00 C ATOM 1347 SD MET A 175 -2.429 -13.324 -1.016 1.00 0.00 S ATOM 1348 CE MET A 175 -1.643 -14.523 0.086 1.00 0.00 C ATOM 0 H MET A 175 -0.657 -9.913 2.748 1.00 0.00 H new ATOM 0 HA MET A 175 -2.430 -9.397 0.397 1.00 0.00 H new ATOM 0 HB2 MET A 175 -1.868 -12.050 1.800 1.00 0.00 H new ATOM 0 HB3 MET A 175 -3.392 -11.776 0.978 1.00 0.00 H new ATOM 0 HG2 MET A 175 -1.807 -10.989 -1.037 1.00 0.00 H new ATOM 0 HG3 MET A 175 -0.609 -11.958 -0.203 1.00 0.00 H new ATOM 0 HE1 MET A 175 -2.271 -15.410 0.166 1.00 0.00 H new ATOM 0 HE2 MET A 175 -0.669 -14.803 -0.316 1.00 0.00 H new ATOM 0 HE3 MET A 175 -1.514 -14.080 1.073 1.00 0.00 H new ATOM 1358 N LEU A 176 -4.466 -9.307 1.988 1.00 0.00 N ATOM 1359 CA LEU A 176 -5.516 -8.982 2.995 1.00 0.00 C ATOM 1360 C LEU A 176 -6.044 -10.294 3.584 1.00 0.00 C ATOM 1361 O LEU A 176 -6.017 -11.323 2.939 1.00 0.00 O ATOM 1362 CB LEU A 176 -6.658 -8.218 2.314 1.00 0.00 C ATOM 1363 CG LEU A 176 -6.100 -6.980 1.597 1.00 0.00 C ATOM 1364 CD1 LEU A 176 -7.245 -6.218 0.921 1.00 0.00 C ATOM 1365 CD2 LEU A 176 -5.410 -6.060 2.611 1.00 0.00 C ATOM 0 H LEU A 176 -4.768 -9.260 1.015 1.00 0.00 H new ATOM 0 HA LEU A 176 -5.101 -8.360 3.788 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -7.166 -8.866 1.599 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -7.399 -7.918 3.054 1.00 0.00 H new ATOM 0 HG LEU A 176 -5.378 -7.298 0.845 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -6.847 -5.340 0.413 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -7.735 -6.867 0.195 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -7.968 -5.905 1.674 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -5.016 -5.183 2.097 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -6.131 -5.745 3.366 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -4.592 -6.597 3.092 1.00 0.00 H new ATOM 1377 N ASN A 177 -6.515 -10.279 4.802 1.00 0.00 N ATOM 1378 CA ASN A 177 -7.024 -11.546 5.409 1.00 0.00 C ATOM 1379 C ASN A 177 -8.017 -12.211 4.449 1.00 0.00 C ATOM 1380 O ASN A 177 -8.688 -11.545 3.687 1.00 0.00 O ATOM 1381 CB ASN A 177 -7.711 -11.246 6.750 1.00 0.00 C ATOM 1382 CG ASN A 177 -8.247 -9.813 6.753 1.00 0.00 C ATOM 1383 OD1 ASN A 177 -8.688 -9.293 5.642 1.00 0.00 O flip ATOM 1384 ND2 ASN A 177 -8.264 -9.161 7.778 1.00 0.00 N flip ATOM 0 H ASN A 177 -6.570 -9.454 5.399 1.00 0.00 H new ATOM 0 HA ASN A 177 -6.187 -12.222 5.586 1.00 0.00 H new ATOM 0 HB2 ASN A 177 -8.527 -11.949 6.915 1.00 0.00 H new ATOM 0 HB3 ASN A 177 -7.004 -11.381 7.569 1.00 0.00 H new ATOM 0 HD21 ASN A 177 -7.919 -9.568 8.647 1.00 0.00 H new ATOM 0 HD22 ASN A 177 -8.623 -8.206 7.769 1.00 0.00 H new ATOM 1391 N PRO A 178 -8.108 -13.519 4.481 1.00 0.00 N ATOM 1392 CA PRO A 178 -9.032 -14.280 3.594 1.00 0.00 C ATOM 1393 C PRO A 178 -10.382 -13.580 3.415 1.00 0.00 C ATOM 1394 O PRO A 178 -11.103 -13.844 2.473 1.00 0.00 O ATOM 1395 CB PRO A 178 -9.180 -15.609 4.330 1.00 0.00 C ATOM 1396 CG PRO A 178 -7.840 -15.822 4.952 1.00 0.00 C ATOM 1397 CD PRO A 178 -7.349 -14.430 5.365 1.00 0.00 C ATOM 0 HA PRO A 178 -8.653 -14.383 2.577 1.00 0.00 H new ATOM 0 HB2 PRO A 178 -9.968 -15.564 5.082 1.00 0.00 H new ATOM 0 HB3 PRO A 178 -9.437 -16.418 3.647 1.00 0.00 H new ATOM 0 HG2 PRO A 178 -7.910 -16.485 5.815 1.00 0.00 H new ATOM 0 HG3 PRO A 178 -7.151 -16.287 4.247 1.00 0.00 H new ATOM 0 HD2 PRO A 178 -7.551 -14.229 6.417 1.00 0.00 H new ATOM 0 HD3 PRO A 178 -6.274 -14.325 5.221 1.00 0.00 H new ATOM 1405 N GLU A 179 -10.722 -12.680 4.301 1.00 0.00 N ATOM 1406 CA GLU A 179 -12.014 -11.949 4.175 1.00 0.00 C ATOM 1407 C GLU A 179 -11.736 -10.445 4.076 1.00 0.00 C ATOM 1408 O GLU A 179 -10.769 -9.948 4.619 1.00 0.00 O ATOM 1409 CB GLU A 179 -12.886 -12.254 5.395 1.00 0.00 C ATOM 1410 CG GLU A 179 -12.431 -11.433 6.606 1.00 0.00 C ATOM 1411 CD GLU A 179 -13.063 -12.015 7.875 1.00 0.00 C ATOM 1412 OE1 GLU A 179 -13.229 -13.222 7.930 1.00 0.00 O ATOM 1413 OE2 GLU A 179 -13.371 -11.243 8.769 1.00 0.00 O ATOM 0 H GLU A 179 -10.157 -12.420 5.109 1.00 0.00 H new ATOM 0 HA GLU A 179 -12.541 -12.269 3.276 1.00 0.00 H new ATOM 0 HB2 GLU A 179 -13.928 -12.030 5.168 1.00 0.00 H new ATOM 0 HB3 GLU A 179 -12.833 -13.317 5.630 1.00 0.00 H new ATOM 0 HG2 GLU A 179 -11.344 -11.451 6.685 1.00 0.00 H new ATOM 0 HG3 GLU A 179 -12.724 -10.390 6.485 1.00 0.00 H new ATOM 1420 N GLY A 180 -12.570 -9.720 3.376 1.00 0.00 N ATOM 1421 CA GLY A 180 -12.352 -8.250 3.228 1.00 0.00 C ATOM 1422 C GLY A 180 -12.567 -7.847 1.766 1.00 0.00 C ATOM 1423 O GLY A 180 -11.628 -7.566 1.047 1.00 0.00 O ATOM 0 H GLY A 180 -13.395 -10.084 2.899 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -13.040 -7.703 3.872 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.342 -7.988 3.544 1.00 0.00 H new ATOM 1427 N GLY A 181 -13.797 -7.818 1.321 1.00 0.00 N ATOM 1428 CA GLY A 181 -14.081 -7.435 -0.096 1.00 0.00 C ATOM 1429 C GLY A 181 -14.735 -8.609 -0.821 1.00 0.00 C ATOM 1430 O GLY A 181 -14.543 -8.801 -2.006 1.00 0.00 O ATOM 0 H GLY A 181 -14.620 -8.044 1.880 1.00 0.00 H new ATOM 0 HA2 GLY A 181 -14.738 -6.565 -0.124 1.00 0.00 H new ATOM 0 HA3 GLY A 181 -13.156 -7.153 -0.600 1.00 0.00 H new TER 1434 GLY A 181