USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 874 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 86 GLN : amide:sc= -0.248 X(o=-0.41,f=0.08) USER MOD Set 1.2: A 94 GLN : amide:sc= -0.166 X(o=-0.41,f=0) USER MOD Set 2.1: A 38 ASN : amide:sc= -1.69 K(o=-2.4,f=-3.3) USER MOD Set 2.2: A 39 SER OG : rot 172:sc= -0.702 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= -1.73! C(o=-1.7!,f=-2.5!) USER MOD Single : A 5 SER OG : rot -92:sc= 1.19 USER MOD Single : A 6 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0214) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 71:sc= 0.938 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -3.73! C(o=-3.7!,f=-8.1!) USER MOD Single : A 16 GLN : amide:sc= -1.59 X(o=-1.6,f=-1.9) USER MOD Single : A 19 ASN : amide:sc= -0.433 K(o=-0.43,f=-1.9) USER MOD Single : A 22 SER OG : rot -177:sc= -0.896 USER MOD Single : A 31 THR OG1 : rot 98:sc= 1.28 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= -4.83! C(o=-4.8!,f=-5.1!) USER MOD Single : A 48 SER OG : rot 180:sc= -0.0802 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot -104:sc= 1.26 USER MOD Single : A 55 ASN : amide:sc= -0.492 X(o=-0.49,f=-0.83) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -8.92! C(o=-8.9!,f=-13!) USER MOD Single : A 74 GLN : amide:sc= -1.97 K(o=-2,f=-8.6!) USER MOD Single : A 79 HIS : no HD1:sc= -0.901 X(o=-0.9,f=-0.72) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -0.229 X(o=-0.23,f=-0.23) USER MOD Single : A 90 GLN : amide:sc= -1.32 X(o=-1.3,f=-1.8) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc= -0.698 X(o=-0.7,f=-0.39) USER MOD Single : A 97 GLN : amide:sc= -0.175 X(o=-0.17,f=-0.17) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 3.410 1.586 -1.996 1.00 0.00 N ATOM 2 CA GLY A -1 3.745 0.335 -1.340 1.00 0.00 C ATOM 3 C GLY A -1 2.929 -0.830 -1.861 1.00 0.00 C ATOM 4 O GLY A -1 2.230 -1.498 -1.099 1.00 0.00 O ATOM 0 H1 GLY A -1 3.995 2.351 -1.604 1.00 0.00 H new ATOM 0 H2 GLY A -1 3.589 1.501 -3.017 1.00 0.00 H new ATOM 0 H3 GLY A -1 2.405 1.803 -1.837 1.00 0.00 H new ATOM 0 HA2 GLY A -1 4.805 0.125 -1.484 1.00 0.00 H new ATOM 0 HA3 GLY A -1 3.583 0.437 -0.267 1.00 0.00 H new ATOM 8 N SER A 0 3.015 -1.075 -3.165 1.00 0.00 N ATOM 9 CA SER A 0 2.273 -2.164 -3.789 1.00 0.00 C ATOM 10 C SER A 0 3.210 -3.303 -4.183 1.00 0.00 C ATOM 11 O SER A 0 3.476 -3.521 -5.365 1.00 0.00 O ATOM 12 CB SER A 0 1.521 -1.658 -5.021 1.00 0.00 C ATOM 13 OG SER A 0 1.070 -0.328 -4.832 1.00 0.00 O ATOM 0 H SER A 0 3.591 -0.534 -3.810 1.00 0.00 H new ATOM 0 HA SER A 0 1.553 -2.542 -3.064 1.00 0.00 H new ATOM 0 HB2 SER A 0 2.173 -1.704 -5.893 1.00 0.00 H new ATOM 0 HB3 SER A 0 0.670 -2.308 -5.224 1.00 0.00 H new ATOM 0 HG SER A 0 0.594 -0.027 -5.634 1.00 0.00 H new ATOM 19 N ALA A 1 3.706 -4.025 -3.184 1.00 0.00 N ATOM 20 CA ALA A 1 4.610 -5.143 -3.426 1.00 0.00 C ATOM 21 C ALA A 1 3.848 -6.461 -3.495 1.00 0.00 C ATOM 22 O ALA A 1 3.700 -7.048 -4.567 1.00 0.00 O ATOM 23 CB ALA A 1 5.676 -5.203 -2.341 1.00 0.00 C ATOM 0 H ALA A 1 3.497 -3.856 -2.200 1.00 0.00 H new ATOM 0 HA ALA A 1 5.095 -4.984 -4.389 1.00 0.00 H new ATOM 0 HB1 ALA A 1 6.344 -6.042 -2.534 1.00 0.00 H new ATOM 0 HB2 ALA A 1 6.249 -4.275 -2.342 1.00 0.00 H new ATOM 0 HB3 ALA A 1 5.199 -5.334 -1.370 1.00 0.00 H new ATOM 29 N ARG A 2 3.367 -6.922 -2.345 1.00 0.00 N ATOM 30 CA ARG A 2 2.621 -8.173 -2.275 1.00 0.00 C ATOM 31 C ARG A 2 1.522 -8.210 -3.332 1.00 0.00 C ATOM 32 O ARG A 2 1.428 -9.160 -4.110 1.00 0.00 O ATOM 33 CB ARG A 2 2.011 -8.351 -0.883 1.00 0.00 C ATOM 34 CG ARG A 2 2.631 -9.489 -0.088 1.00 0.00 C ATOM 35 CD ARG A 2 2.490 -10.818 -0.814 1.00 0.00 C ATOM 36 NE ARG A 2 2.325 -11.933 0.113 1.00 0.00 N ATOM 37 CZ ARG A 2 1.832 -13.115 -0.239 1.00 0.00 C ATOM 38 NH1 ARG A 2 1.458 -13.334 -1.492 1.00 0.00 N ATOM 39 NH2 ARG A 2 1.713 -14.081 0.663 1.00 0.00 N ATOM 0 H ARG A 2 3.481 -6.448 -1.449 1.00 0.00 H new ATOM 0 HA ARG A 2 3.314 -8.992 -2.468 1.00 0.00 H new ATOM 0 HB2 ARG A 2 2.127 -7.423 -0.323 1.00 0.00 H new ATOM 0 HB3 ARG A 2 0.941 -8.531 -0.985 1.00 0.00 H new ATOM 0 HG2 ARG A 2 3.686 -9.279 0.087 1.00 0.00 H new ATOM 0 HG3 ARG A 2 2.152 -9.554 0.889 1.00 0.00 H new ATOM 0 HD2 ARG A 2 1.632 -10.775 -1.485 1.00 0.00 H new ATOM 0 HD3 ARG A 2 3.371 -10.988 -1.433 1.00 0.00 H new ATOM 0 HE ARG A 2 2.604 -11.797 1.085 1.00 0.00 H new ATOM 0 HH11 ARG A 2 1.549 -12.594 -2.188 1.00 0.00 H new ATOM 0 HH12 ARG A 2 1.080 -14.243 -1.760 1.00 0.00 H new ATOM 0 HH21 ARG A 2 2.000 -13.916 1.628 1.00 0.00 H new ATOM 0 HH22 ARG A 2 1.334 -14.988 0.392 1.00 0.00 H new ATOM 53 N GLN A 3 0.693 -7.172 -3.354 1.00 0.00 N ATOM 54 CA GLN A 3 -0.401 -7.087 -4.315 1.00 0.00 C ATOM 55 C GLN A 3 0.118 -7.220 -5.743 1.00 0.00 C ATOM 56 O GLN A 3 -0.591 -7.696 -6.631 1.00 0.00 O ATOM 57 CB GLN A 3 -1.149 -5.763 -4.153 1.00 0.00 C ATOM 58 CG GLN A 3 -0.233 -4.570 -3.933 1.00 0.00 C ATOM 59 CD GLN A 3 -0.311 -4.026 -2.520 1.00 0.00 C ATOM 60 OE1 GLN A 3 0.554 -4.300 -1.688 1.00 0.00 O ATOM 61 NE2 GLN A 3 -1.352 -3.250 -2.241 1.00 0.00 N ATOM 0 H GLN A 3 0.758 -6.378 -2.717 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.088 -7.910 -4.119 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -1.755 -5.586 -5.042 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -1.835 -5.844 -3.310 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.795 -4.861 -4.150 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.496 -3.780 -4.637 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -2.046 -3.049 -2.961 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -1.458 -2.855 -1.306 1.00 0.00 H new ATOM 70 N LEU A 4 1.359 -6.798 -5.958 1.00 0.00 N ATOM 71 CA LEU A 4 1.974 -6.869 -7.279 1.00 0.00 C ATOM 72 C LEU A 4 2.757 -8.167 -7.445 1.00 0.00 C ATOM 73 O LEU A 4 3.202 -8.499 -8.544 1.00 0.00 O ATOM 74 CB LEU A 4 2.898 -5.671 -7.498 1.00 0.00 C ATOM 75 CG LEU A 4 2.232 -4.394 -8.012 1.00 0.00 C ATOM 76 CD1 LEU A 4 1.785 -4.568 -9.455 1.00 0.00 C ATOM 77 CD2 LEU A 4 1.051 -4.016 -7.128 1.00 0.00 C ATOM 0 H LEU A 4 1.960 -6.403 -5.234 1.00 0.00 H new ATOM 0 HA LEU A 4 1.179 -6.847 -8.025 1.00 0.00 H new ATOM 0 HB2 LEU A 4 3.394 -5.443 -6.555 1.00 0.00 H new ATOM 0 HB3 LEU A 4 3.675 -5.961 -8.205 1.00 0.00 H new ATOM 0 HG LEU A 4 2.963 -3.586 -7.975 1.00 0.00 H new ATOM 0 HD11 LEU A 4 1.313 -3.649 -9.803 1.00 0.00 H new ATOM 0 HD12 LEU A 4 2.650 -4.791 -10.079 1.00 0.00 H new ATOM 0 HD13 LEU A 4 1.071 -5.389 -9.518 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.589 -3.105 -7.508 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.319 -4.824 -7.133 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.399 -3.848 -6.109 1.00 0.00 H new ATOM 89 N SER A 5 2.920 -8.899 -6.348 1.00 0.00 N ATOM 90 CA SER A 5 3.651 -10.161 -6.372 1.00 0.00 C ATOM 91 C SER A 5 2.926 -11.193 -7.230 1.00 0.00 C ATOM 92 O SER A 5 3.490 -12.226 -7.590 1.00 0.00 O ATOM 93 CB SER A 5 3.830 -10.698 -4.950 1.00 0.00 C ATOM 94 OG SER A 5 2.660 -11.360 -4.504 1.00 0.00 O ATOM 0 H SER A 5 2.556 -8.640 -5.431 1.00 0.00 H new ATOM 0 HA SER A 5 4.632 -9.976 -6.809 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.674 -11.387 -4.922 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.066 -9.876 -4.274 1.00 0.00 H new ATOM 0 HG SER A 5 2.081 -10.722 -4.036 1.00 0.00 H new ATOM 100 N LYS A 6 1.670 -10.905 -7.554 1.00 0.00 N ATOM 101 CA LYS A 6 0.865 -11.806 -8.371 1.00 0.00 C ATOM 102 C LYS A 6 1.647 -12.279 -9.591 1.00 0.00 C ATOM 103 O LYS A 6 1.489 -13.415 -10.041 1.00 0.00 O ATOM 104 CB LYS A 6 -0.423 -11.109 -8.816 1.00 0.00 C ATOM 105 CG LYS A 6 -1.447 -12.054 -9.422 1.00 0.00 C ATOM 106 CD LYS A 6 -2.394 -11.323 -10.359 1.00 0.00 C ATOM 107 CE LYS A 6 -3.530 -10.659 -9.596 1.00 0.00 C ATOM 108 NZ LYS A 6 -4.563 -11.643 -9.170 1.00 0.00 N ATOM 0 H LYS A 6 1.187 -10.055 -7.263 1.00 0.00 H new ATOM 0 HA LYS A 6 0.610 -12.676 -7.766 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.869 -10.605 -7.958 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -0.176 -10.338 -9.546 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.934 -12.847 -9.967 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.018 -12.532 -8.626 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -1.842 -10.569 -10.921 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -2.803 -12.025 -11.085 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.130 -10.150 -8.719 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -3.992 -9.897 -10.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -5.367 -11.140 -8.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -4.891 -12.182 -9.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.154 -12.296 -8.471 1.00 0.00 H new ATOM 122 N LEU A 7 2.493 -11.403 -10.123 1.00 0.00 N ATOM 123 CA LEU A 7 3.302 -11.733 -11.291 1.00 0.00 C ATOM 124 C LEU A 7 4.674 -12.254 -10.874 1.00 0.00 C ATOM 125 O LEU A 7 5.305 -13.022 -11.600 1.00 0.00 O ATOM 126 CB LEU A 7 3.461 -10.504 -12.188 1.00 0.00 C ATOM 127 CG LEU A 7 3.812 -10.782 -13.650 1.00 0.00 C ATOM 128 CD1 LEU A 7 3.037 -9.853 -14.571 1.00 0.00 C ATOM 129 CD2 LEU A 7 5.310 -10.633 -13.877 1.00 0.00 C ATOM 0 H LEU A 7 2.636 -10.459 -9.764 1.00 0.00 H new ATOM 0 HA LEU A 7 2.790 -12.518 -11.847 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.531 -9.936 -12.160 1.00 0.00 H new ATOM 0 HB3 LEU A 7 4.237 -9.867 -11.764 1.00 0.00 H new ATOM 0 HG LEU A 7 3.530 -11.809 -13.882 1.00 0.00 H new ATOM 0 HD11 LEU A 7 3.300 -10.066 -15.607 1.00 0.00 H new ATOM 0 HD12 LEU A 7 1.968 -10.009 -14.429 1.00 0.00 H new ATOM 0 HD13 LEU A 7 3.287 -8.818 -14.338 1.00 0.00 H new ATOM 0 HD21 LEU A 7 5.541 -10.835 -14.923 1.00 0.00 H new ATOM 0 HD22 LEU A 7 5.617 -9.617 -13.627 1.00 0.00 H new ATOM 0 HD23 LEU A 7 5.846 -11.340 -13.244 1.00 0.00 H new ATOM 141 N LYS A 8 5.129 -11.831 -9.699 1.00 0.00 N ATOM 142 CA LYS A 8 6.424 -12.257 -9.183 1.00 0.00 C ATOM 143 C LYS A 8 6.606 -13.763 -9.343 1.00 0.00 C ATOM 144 O LYS A 8 7.585 -14.221 -9.931 1.00 0.00 O ATOM 145 CB LYS A 8 6.560 -11.870 -7.708 1.00 0.00 C ATOM 146 CG LYS A 8 7.903 -12.241 -7.103 1.00 0.00 C ATOM 147 CD LYS A 8 7.764 -12.659 -5.649 1.00 0.00 C ATOM 148 CE LYS A 8 7.976 -14.155 -5.477 1.00 0.00 C ATOM 149 NZ LYS A 8 7.786 -14.583 -4.063 1.00 0.00 N ATOM 0 H LYS A 8 4.620 -11.194 -9.087 1.00 0.00 H new ATOM 0 HA LYS A 8 7.200 -11.752 -9.759 1.00 0.00 H new ATOM 0 HB2 LYS A 8 6.410 -10.795 -7.608 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.768 -12.356 -7.139 1.00 0.00 H new ATOM 0 HG2 LYS A 8 8.348 -13.055 -7.675 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.582 -11.392 -7.175 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.488 -12.116 -5.042 1.00 0.00 H new ATOM 0 HD3 LYS A 8 6.774 -12.386 -5.284 1.00 0.00 H new ATOM 0 HE2 LYS A 8 7.279 -14.697 -6.117 1.00 0.00 H new ATOM 0 HE3 LYS A 8 8.981 -14.419 -5.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.939 -15.609 -3.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 8.468 -14.085 -3.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 6.818 -14.354 -3.758 1.00 0.00 H new ATOM 163 N ARG A 9 5.655 -14.528 -8.816 1.00 0.00 N ATOM 164 CA ARG A 9 5.710 -15.983 -8.902 1.00 0.00 C ATOM 165 C ARG A 9 5.880 -16.436 -10.349 1.00 0.00 C ATOM 166 O ARG A 9 6.808 -17.178 -10.673 1.00 0.00 O ATOM 167 CB ARG A 9 4.442 -16.598 -8.309 1.00 0.00 C ATOM 168 CG ARG A 9 4.140 -16.127 -6.895 1.00 0.00 C ATOM 169 CD ARG A 9 4.758 -17.050 -5.857 1.00 0.00 C ATOM 170 NE ARG A 9 4.117 -18.362 -5.838 1.00 0.00 N ATOM 171 CZ ARG A 9 4.344 -19.278 -4.904 1.00 0.00 C ATOM 172 NH1 ARG A 9 5.192 -19.026 -3.916 1.00 0.00 N ATOM 173 NH2 ARG A 9 3.722 -20.449 -4.955 1.00 0.00 N ATOM 0 H ARG A 9 4.838 -14.165 -8.325 1.00 0.00 H new ATOM 0 HA ARG A 9 6.573 -16.324 -8.329 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.596 -16.356 -8.952 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.541 -17.683 -8.308 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.522 -15.116 -6.758 1.00 0.00 H new ATOM 0 HG3 ARG A 9 3.061 -16.083 -6.748 1.00 0.00 H new ATOM 0 HD2 ARG A 9 5.821 -17.169 -6.066 1.00 0.00 H new ATOM 0 HD3 ARG A 9 4.676 -16.593 -4.871 1.00 0.00 H new ATOM 0 HE ARG A 9 3.458 -18.587 -6.584 1.00 0.00 H new ATOM 0 HH11 ARG A 9 5.672 -18.127 -3.872 1.00 0.00 H new ATOM 0 HH12 ARG A 9 5.365 -19.731 -3.200 1.00 0.00 H new ATOM 0 HH21 ARG A 9 3.068 -20.647 -5.713 1.00 0.00 H new ATOM 0 HH22 ARG A 9 3.898 -21.151 -4.237 1.00 0.00 H new ATOM 187 N PHE A 10 4.978 -15.986 -11.214 1.00 0.00 N ATOM 188 CA PHE A 10 5.026 -16.347 -12.626 1.00 0.00 C ATOM 189 C PHE A 10 6.415 -16.091 -13.205 1.00 0.00 C ATOM 190 O PHE A 10 6.998 -16.959 -13.856 1.00 0.00 O ATOM 191 CB PHE A 10 3.979 -15.556 -13.413 1.00 0.00 C ATOM 192 CG PHE A 10 4.216 -15.559 -14.896 1.00 0.00 C ATOM 193 CD1 PHE A 10 4.512 -16.738 -15.561 1.00 0.00 C ATOM 194 CD2 PHE A 10 4.142 -14.383 -15.625 1.00 0.00 C ATOM 195 CE1 PHE A 10 4.730 -16.744 -16.926 1.00 0.00 C ATOM 196 CE2 PHE A 10 4.358 -14.383 -16.990 1.00 0.00 C ATOM 197 CZ PHE A 10 4.653 -15.565 -17.642 1.00 0.00 C ATOM 0 H PHE A 10 4.205 -15.370 -10.962 1.00 0.00 H new ATOM 0 HA PHE A 10 4.806 -17.411 -12.711 1.00 0.00 H new ATOM 0 HB2 PHE A 10 2.992 -15.972 -13.210 1.00 0.00 H new ATOM 0 HB3 PHE A 10 3.970 -14.526 -13.057 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.573 -17.663 -15.007 1.00 0.00 H new ATOM 0 HD2 PHE A 10 3.913 -13.456 -15.121 1.00 0.00 H new ATOM 0 HE1 PHE A 10 4.960 -17.670 -17.432 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.296 -13.460 -17.547 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.823 -15.567 -18.709 1.00 0.00 H new ATOM 207 N LEU A 11 6.938 -14.894 -12.965 1.00 0.00 N ATOM 208 CA LEU A 11 8.258 -14.522 -13.462 1.00 0.00 C ATOM 209 C LEU A 11 9.331 -15.455 -12.909 1.00 0.00 C ATOM 210 O LEU A 11 10.161 -15.976 -13.655 1.00 0.00 O ATOM 211 CB LEU A 11 8.578 -13.075 -13.083 1.00 0.00 C ATOM 212 CG LEU A 11 9.469 -12.307 -14.060 1.00 0.00 C ATOM 213 CD1 LEU A 11 10.867 -12.906 -14.092 1.00 0.00 C ATOM 214 CD2 LEU A 11 8.855 -12.304 -15.452 1.00 0.00 C ATOM 0 H LEU A 11 6.468 -14.164 -12.429 1.00 0.00 H new ATOM 0 HA LEU A 11 8.249 -14.613 -14.548 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.639 -12.532 -12.975 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.060 -13.075 -12.105 1.00 0.00 H new ATOM 0 HG LEU A 11 9.547 -11.275 -13.717 1.00 0.00 H new ATOM 0 HD11 LEU A 11 11.487 -12.346 -14.793 1.00 0.00 H new ATOM 0 HD12 LEU A 11 11.308 -12.854 -13.096 1.00 0.00 H new ATOM 0 HD13 LEU A 11 10.810 -13.947 -14.410 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.503 -11.753 -16.134 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.746 -13.330 -15.804 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.876 -11.827 -15.417 1.00 0.00 H new ATOM 226 N THR A 12 9.307 -15.663 -11.596 1.00 0.00 N ATOM 227 CA THR A 12 10.277 -16.533 -10.943 1.00 0.00 C ATOM 228 C THR A 12 10.354 -17.888 -11.637 1.00 0.00 C ATOM 229 O THR A 12 11.416 -18.297 -12.109 1.00 0.00 O ATOM 230 CB THR A 12 9.927 -16.749 -9.458 1.00 0.00 C ATOM 231 OG1 THR A 12 9.839 -15.487 -8.788 1.00 0.00 O ATOM 232 CG2 THR A 12 10.973 -17.619 -8.777 1.00 0.00 C ATOM 0 H THR A 12 8.626 -15.241 -10.964 1.00 0.00 H new ATOM 0 HA THR A 12 11.245 -16.036 -11.012 1.00 0.00 H new ATOM 0 HB THR A 12 8.964 -17.257 -9.404 1.00 0.00 H new ATOM 0 HG1 THR A 12 9.037 -15.011 -9.090 1.00 0.00 H new ATOM 0 HG21 THR A 12 10.705 -17.758 -7.730 1.00 0.00 H new ATOM 0 HG22 THR A 12 11.017 -18.589 -9.272 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.947 -17.134 -8.841 1.00 0.00 H new ATOM 240 N THR A 13 9.222 -18.583 -11.697 1.00 0.00 N ATOM 241 CA THR A 13 9.162 -19.893 -12.333 1.00 0.00 C ATOM 242 C THR A 13 9.420 -19.789 -13.832 1.00 0.00 C ATOM 243 O THR A 13 9.955 -20.713 -14.446 1.00 0.00 O ATOM 244 CB THR A 13 7.796 -20.567 -12.104 1.00 0.00 C ATOM 245 OG1 THR A 13 7.761 -21.839 -12.760 1.00 0.00 O ATOM 246 CG2 THR A 13 6.667 -19.691 -12.624 1.00 0.00 C ATOM 0 H THR A 13 8.334 -18.260 -11.313 1.00 0.00 H new ATOM 0 HA THR A 13 9.941 -20.503 -11.875 1.00 0.00 H new ATOM 0 HB THR A 13 7.660 -20.708 -11.032 1.00 0.00 H new ATOM 0 HG1 THR A 13 6.890 -22.261 -12.608 1.00 0.00 H new ATOM 0 HG21 THR A 13 5.712 -20.188 -12.451 1.00 0.00 H new ATOM 0 HG22 THR A 13 6.678 -18.735 -12.101 1.00 0.00 H new ATOM 0 HG23 THR A 13 6.800 -19.522 -13.693 1.00 0.00 H new ATOM 254 N LEU A 14 9.037 -18.659 -14.416 1.00 0.00 N ATOM 255 CA LEU A 14 9.228 -18.433 -15.844 1.00 0.00 C ATOM 256 C LEU A 14 10.710 -18.439 -16.204 1.00 0.00 C ATOM 257 O LEU A 14 11.122 -19.086 -17.166 1.00 0.00 O ATOM 258 CB LEU A 14 8.596 -17.103 -16.259 1.00 0.00 C ATOM 259 CG LEU A 14 9.100 -16.501 -17.571 1.00 0.00 C ATOM 260 CD1 LEU A 14 7.983 -15.749 -18.278 1.00 0.00 C ATOM 261 CD2 LEU A 14 10.285 -15.581 -17.314 1.00 0.00 C ATOM 0 H LEU A 14 8.592 -17.885 -13.922 1.00 0.00 H new ATOM 0 HA LEU A 14 8.739 -19.245 -16.383 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.518 -17.245 -16.338 1.00 0.00 H new ATOM 0 HB3 LEU A 14 8.765 -16.379 -15.462 1.00 0.00 H new ATOM 0 HG LEU A 14 9.429 -17.314 -18.219 1.00 0.00 H new ATOM 0 HD11 LEU A 14 8.361 -15.328 -19.210 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.164 -16.434 -18.496 1.00 0.00 H new ATOM 0 HD13 LEU A 14 7.623 -14.945 -17.636 1.00 0.00 H new ATOM 0 HD21 LEU A 14 10.631 -15.161 -18.258 1.00 0.00 H new ATOM 0 HD22 LEU A 14 9.981 -14.774 -16.648 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.093 -16.148 -16.852 1.00 0.00 H new ATOM 273 N GLN A 15 11.506 -17.715 -15.423 1.00 0.00 N ATOM 274 CA GLN A 15 12.943 -17.639 -15.658 1.00 0.00 C ATOM 275 C GLN A 15 13.655 -18.857 -15.079 1.00 0.00 C ATOM 276 O GLN A 15 14.724 -19.243 -15.550 1.00 0.00 O ATOM 277 CB GLN A 15 13.514 -16.359 -15.045 1.00 0.00 C ATOM 278 CG GLN A 15 13.262 -16.236 -13.551 1.00 0.00 C ATOM 279 CD GLN A 15 14.422 -15.597 -12.814 1.00 0.00 C ATOM 280 OE1 GLN A 15 15.504 -16.176 -12.714 1.00 0.00 O ATOM 281 NE2 GLN A 15 14.202 -14.395 -12.292 1.00 0.00 N ATOM 0 H GLN A 15 11.180 -17.173 -14.623 1.00 0.00 H new ATOM 0 HA GLN A 15 13.109 -17.623 -16.735 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.588 -16.326 -15.228 1.00 0.00 H new ATOM 0 HB3 GLN A 15 13.078 -15.498 -15.551 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.362 -15.644 -13.386 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.074 -17.226 -13.136 1.00 0.00 H new ATOM 0 HE21 GLN A 15 13.290 -13.952 -12.399 1.00 0.00 H new ATOM 0 HE22 GLN A 15 14.946 -13.916 -11.784 1.00 0.00 H new ATOM 290 N GLN A 16 13.054 -19.456 -14.056 1.00 0.00 N ATOM 291 CA GLN A 16 13.633 -20.630 -13.412 1.00 0.00 C ATOM 292 C GLN A 16 13.474 -21.866 -14.291 1.00 0.00 C ATOM 293 O GLN A 16 14.375 -22.701 -14.374 1.00 0.00 O ATOM 294 CB GLN A 16 12.975 -20.868 -12.052 1.00 0.00 C ATOM 295 CG GLN A 16 12.963 -22.328 -11.629 1.00 0.00 C ATOM 296 CD GLN A 16 14.352 -22.935 -11.588 1.00 0.00 C ATOM 297 OE1 GLN A 16 14.581 -24.025 -12.111 1.00 0.00 O ATOM 298 NE2 GLN A 16 15.288 -22.229 -10.963 1.00 0.00 N ATOM 0 H GLN A 16 12.168 -19.149 -13.656 1.00 0.00 H new ATOM 0 HA GLN A 16 14.697 -20.446 -13.265 1.00 0.00 H new ATOM 0 HB2 GLN A 16 13.500 -20.284 -11.296 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.950 -20.499 -12.084 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.504 -22.413 -10.644 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.342 -22.898 -12.320 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.053 -21.329 -10.543 1.00 0.00 H new ATOM 0 HE22 GLN A 16 16.241 -22.587 -10.903 1.00 0.00 H new ATOM 307 N PHE A 17 12.322 -21.977 -14.945 1.00 0.00 N ATOM 308 CA PHE A 17 12.044 -23.113 -15.816 1.00 0.00 C ATOM 309 C PHE A 17 12.372 -22.777 -17.268 1.00 0.00 C ATOM 310 O PHE A 17 12.350 -23.647 -18.138 1.00 0.00 O ATOM 311 CB PHE A 17 10.576 -23.528 -15.696 1.00 0.00 C ATOM 312 CG PHE A 17 10.348 -24.995 -15.919 1.00 0.00 C ATOM 313 CD1 PHE A 17 10.926 -25.935 -15.081 1.00 0.00 C ATOM 314 CD2 PHE A 17 9.556 -25.435 -16.968 1.00 0.00 C ATOM 315 CE1 PHE A 17 10.718 -27.287 -15.284 1.00 0.00 C ATOM 316 CE2 PHE A 17 9.344 -26.785 -17.175 1.00 0.00 C ATOM 317 CZ PHE A 17 9.927 -27.712 -16.333 1.00 0.00 C ATOM 0 H PHE A 17 11.566 -21.294 -14.888 1.00 0.00 H new ATOM 0 HA PHE A 17 12.676 -23.944 -15.501 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.210 -23.258 -14.705 1.00 0.00 H new ATOM 0 HB3 PHE A 17 9.987 -22.963 -16.418 1.00 0.00 H new ATOM 0 HD1 PHE A 17 11.546 -25.608 -14.260 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.099 -24.715 -17.631 1.00 0.00 H new ATOM 0 HE1 PHE A 17 11.174 -28.009 -14.623 1.00 0.00 H new ATOM 0 HE2 PHE A 17 8.723 -27.115 -17.995 1.00 0.00 H new ATOM 0 HZ PHE A 17 9.764 -28.767 -16.495 1.00 0.00 H new ATOM 327 N GLY A 18 12.677 -21.508 -17.522 1.00 0.00 N ATOM 328 CA GLY A 18 13.004 -21.078 -18.869 1.00 0.00 C ATOM 329 C GLY A 18 14.165 -21.855 -19.459 1.00 0.00 C ATOM 330 O GLY A 18 14.285 -21.974 -20.677 1.00 0.00 O ATOM 0 H GLY A 18 12.703 -20.770 -16.819 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.129 -21.197 -19.508 1.00 0.00 H new ATOM 0 HA3 GLY A 18 13.249 -20.016 -18.859 1.00 0.00 H new ATOM 334 N ASN A 19 15.023 -22.383 -18.592 1.00 0.00 N ATOM 335 CA ASN A 19 16.182 -23.150 -19.034 1.00 0.00 C ATOM 336 C ASN A 19 15.787 -24.582 -19.380 1.00 0.00 C ATOM 337 O ASN A 19 16.601 -25.358 -19.880 1.00 0.00 O ATOM 338 CB ASN A 19 17.261 -23.154 -17.949 1.00 0.00 C ATOM 339 CG ASN A 19 18.605 -22.681 -18.469 1.00 0.00 C ATOM 340 OD1 ASN A 19 18.677 -21.790 -19.315 1.00 0.00 O ATOM 341 ND2 ASN A 19 19.678 -23.276 -17.962 1.00 0.00 N ATOM 0 H ASN A 19 14.938 -22.294 -17.580 1.00 0.00 H new ATOM 0 HA ASN A 19 16.580 -22.675 -19.931 1.00 0.00 H new ATOM 0 HB2 ASN A 19 16.947 -22.513 -17.126 1.00 0.00 H new ATOM 0 HB3 ASN A 19 17.364 -24.162 -17.547 1.00 0.00 H new ATOM 0 HD21 ASN A 19 20.609 -22.999 -18.272 1.00 0.00 H new ATOM 0 HD22 ASN A 19 19.571 -24.010 -17.262 1.00 0.00 H new ATOM 348 N ASP A 20 14.532 -24.925 -19.110 1.00 0.00 N ATOM 349 CA ASP A 20 14.027 -26.263 -19.394 1.00 0.00 C ATOM 350 C ASP A 20 13.458 -26.341 -20.807 1.00 0.00 C ATOM 351 O ASP A 20 13.786 -27.250 -21.570 1.00 0.00 O ATOM 352 CB ASP A 20 12.954 -26.653 -18.376 1.00 0.00 C ATOM 353 CG ASP A 20 12.719 -28.150 -18.327 1.00 0.00 C ATOM 354 OD1 ASP A 20 11.911 -28.651 -19.136 1.00 0.00 O ATOM 355 OD2 ASP A 20 13.345 -28.821 -17.480 1.00 0.00 O ATOM 0 H ASP A 20 13.846 -24.295 -18.695 1.00 0.00 H new ATOM 0 HA ASP A 20 14.860 -26.962 -19.318 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.251 -26.302 -17.388 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.020 -26.150 -18.626 1.00 0.00 H new ATOM 360 N ILE A 21 12.603 -25.383 -21.148 1.00 0.00 N ATOM 361 CA ILE A 21 11.988 -25.344 -22.469 1.00 0.00 C ATOM 362 C ILE A 21 13.036 -25.486 -23.568 1.00 0.00 C ATOM 363 O ILE A 21 12.817 -26.176 -24.563 1.00 0.00 O ATOM 364 CB ILE A 21 11.205 -24.036 -22.687 1.00 0.00 C ATOM 365 CG1 ILE A 21 10.779 -23.908 -24.152 1.00 0.00 C ATOM 366 CG2 ILE A 21 12.047 -22.839 -22.269 1.00 0.00 C ATOM 367 CD1 ILE A 21 9.987 -22.653 -24.444 1.00 0.00 C ATOM 0 H ILE A 21 12.320 -24.624 -20.528 1.00 0.00 H new ATOM 0 HA ILE A 21 11.296 -26.185 -22.520 1.00 0.00 H new ATOM 0 HB ILE A 21 10.308 -24.060 -22.068 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.668 -23.922 -24.783 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.181 -24.777 -24.425 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.480 -21.922 -22.429 1.00 0.00 H new ATOM 0 HG22 ILE A 21 12.305 -22.927 -21.214 1.00 0.00 H new ATOM 0 HG23 ILE A 21 12.959 -22.810 -22.865 1.00 0.00 H new ATOM 0 HD11 ILE A 21 9.719 -22.629 -25.500 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.080 -22.646 -23.840 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.590 -21.778 -24.203 1.00 0.00 H new ATOM 379 N SER A 22 14.176 -24.828 -23.379 1.00 0.00 N ATOM 380 CA SER A 22 15.258 -24.879 -24.355 1.00 0.00 C ATOM 381 C SER A 22 16.451 -24.052 -23.886 1.00 0.00 C ATOM 382 O SER A 22 16.331 -23.164 -23.041 1.00 0.00 O ATOM 383 CB SER A 22 14.773 -24.370 -25.713 1.00 0.00 C ATOM 384 OG SER A 22 15.127 -23.011 -25.905 1.00 0.00 O ATOM 0 H SER A 22 14.374 -24.254 -22.559 1.00 0.00 H new ATOM 0 HA SER A 22 15.574 -25.917 -24.456 1.00 0.00 H new ATOM 0 HB2 SER A 22 15.206 -24.977 -26.508 1.00 0.00 H new ATOM 0 HB3 SER A 22 13.691 -24.480 -25.781 1.00 0.00 H new ATOM 0 HG SER A 22 14.766 -22.696 -26.760 1.00 0.00 H new ATOM 390 N PRO A 23 17.633 -24.350 -24.446 1.00 0.00 N ATOM 391 CA PRO A 23 18.872 -23.646 -24.102 1.00 0.00 C ATOM 392 C PRO A 23 18.882 -22.208 -24.610 1.00 0.00 C ATOM 393 O PRO A 23 19.138 -21.274 -23.851 1.00 0.00 O ATOM 394 CB PRO A 23 19.955 -24.469 -24.805 1.00 0.00 C ATOM 395 CG PRO A 23 19.251 -25.130 -25.939 1.00 0.00 C ATOM 396 CD PRO A 23 17.851 -25.396 -25.460 1.00 0.00 C ATOM 0 HA PRO A 23 19.010 -23.567 -23.024 1.00 0.00 H new ATOM 0 HB2 PRO A 23 20.767 -23.834 -25.159 1.00 0.00 H new ATOM 0 HB3 PRO A 23 20.395 -25.203 -24.130 1.00 0.00 H new ATOM 0 HG2 PRO A 23 19.246 -24.490 -26.821 1.00 0.00 H new ATOM 0 HG3 PRO A 23 19.750 -26.057 -26.220 1.00 0.00 H new ATOM 0 HD2 PRO A 23 17.128 -25.325 -26.273 1.00 0.00 H new ATOM 0 HD3 PRO A 23 17.755 -26.395 -25.034 1.00 0.00 H new ATOM 404 N GLU A 24 18.601 -22.038 -25.899 1.00 0.00 N ATOM 405 CA GLU A 24 18.579 -20.713 -26.507 1.00 0.00 C ATOM 406 C GLU A 24 17.641 -19.780 -25.745 1.00 0.00 C ATOM 407 O GLU A 24 18.088 -18.914 -24.992 1.00 0.00 O ATOM 408 CB GLU A 24 18.143 -20.807 -27.971 1.00 0.00 C ATOM 409 CG GLU A 24 17.152 -21.927 -28.241 1.00 0.00 C ATOM 410 CD GLU A 24 17.782 -23.101 -28.965 1.00 0.00 C ATOM 411 OE1 GLU A 24 18.630 -22.864 -29.851 1.00 0.00 O ATOM 412 OE2 GLU A 24 17.427 -24.255 -28.647 1.00 0.00 O ATOM 0 H GLU A 24 18.386 -22.801 -26.541 1.00 0.00 H new ATOM 0 HA GLU A 24 19.588 -20.303 -26.461 1.00 0.00 H new ATOM 0 HB2 GLU A 24 17.697 -19.859 -28.270 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.024 -20.955 -28.595 1.00 0.00 H new ATOM 0 HG2 GLU A 24 16.732 -22.271 -27.296 1.00 0.00 H new ATOM 0 HG3 GLU A 24 16.325 -21.540 -28.836 1.00 0.00 H new ATOM 419 N ILE A 25 16.341 -19.964 -25.946 1.00 0.00 N ATOM 420 CA ILE A 25 15.341 -19.141 -25.278 1.00 0.00 C ATOM 421 C ILE A 25 15.580 -19.098 -23.772 1.00 0.00 C ATOM 422 O ILE A 25 15.327 -18.086 -23.121 1.00 0.00 O ATOM 423 CB ILE A 25 13.915 -19.658 -25.545 1.00 0.00 C ATOM 424 CG1 ILE A 25 13.018 -18.517 -26.029 1.00 0.00 C ATOM 425 CG2 ILE A 25 13.340 -20.297 -24.290 1.00 0.00 C ATOM 426 CD1 ILE A 25 13.067 -17.292 -25.142 1.00 0.00 C ATOM 0 H ILE A 25 15.955 -20.676 -26.566 1.00 0.00 H new ATOM 0 HA ILE A 25 15.437 -18.136 -25.688 1.00 0.00 H new ATOM 0 HB ILE A 25 13.959 -20.416 -26.327 1.00 0.00 H new ATOM 0 HG12 ILE A 25 13.315 -18.236 -27.040 1.00 0.00 H new ATOM 0 HG13 ILE A 25 11.989 -18.873 -26.086 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.332 -20.658 -24.494 1.00 0.00 H new ATOM 0 HG22 ILE A 25 13.970 -21.133 -23.986 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.306 -19.559 -23.489 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.407 -16.524 -25.546 1.00 0.00 H new ATOM 0 HD12 ILE A 25 12.742 -17.558 -24.136 1.00 0.00 H new ATOM 0 HD13 ILE A 25 14.087 -16.911 -25.104 1.00 0.00 H new ATOM 438 N GLY A 26 16.073 -20.206 -23.225 1.00 0.00 N ATOM 439 CA GLY A 26 16.340 -20.274 -21.801 1.00 0.00 C ATOM 440 C GLY A 26 17.385 -19.269 -21.358 1.00 0.00 C ATOM 441 O GLY A 26 17.103 -18.387 -20.548 1.00 0.00 O ATOM 0 H GLY A 26 16.292 -21.057 -23.743 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.415 -20.097 -21.252 1.00 0.00 H new ATOM 0 HA3 GLY A 26 16.675 -21.279 -21.545 1.00 0.00 H new ATOM 445 N GLU A 27 18.596 -19.404 -21.890 1.00 0.00 N ATOM 446 CA GLU A 27 19.687 -18.501 -21.542 1.00 0.00 C ATOM 447 C GLU A 27 19.258 -17.045 -21.694 1.00 0.00 C ATOM 448 O GLU A 27 19.629 -16.190 -20.889 1.00 0.00 O ATOM 449 CB GLU A 27 20.908 -18.779 -22.422 1.00 0.00 C ATOM 450 CG GLU A 27 20.916 -17.988 -23.720 1.00 0.00 C ATOM 451 CD GLU A 27 21.950 -18.496 -24.705 1.00 0.00 C ATOM 452 OE1 GLU A 27 22.021 -19.725 -24.912 1.00 0.00 O ATOM 453 OE2 GLU A 27 22.689 -17.662 -25.270 1.00 0.00 O ATOM 0 H GLU A 27 18.846 -20.129 -22.563 1.00 0.00 H new ATOM 0 HA GLU A 27 19.951 -18.676 -20.499 1.00 0.00 H new ATOM 0 HB2 GLU A 27 21.812 -18.546 -21.859 1.00 0.00 H new ATOM 0 HB3 GLU A 27 20.943 -19.843 -22.655 1.00 0.00 H new ATOM 0 HG2 GLU A 27 19.928 -18.038 -24.178 1.00 0.00 H new ATOM 0 HG3 GLU A 27 21.113 -16.939 -23.501 1.00 0.00 H new ATOM 460 N ARG A 28 18.474 -16.770 -22.732 1.00 0.00 N ATOM 461 CA ARG A 28 17.995 -15.418 -22.991 1.00 0.00 C ATOM 462 C ARG A 28 17.048 -14.956 -21.887 1.00 0.00 C ATOM 463 O ARG A 28 17.304 -13.960 -21.211 1.00 0.00 O ATOM 464 CB ARG A 28 17.287 -15.355 -24.345 1.00 0.00 C ATOM 465 CG ARG A 28 17.627 -14.114 -25.153 1.00 0.00 C ATOM 466 CD ARG A 28 18.547 -14.442 -26.319 1.00 0.00 C ATOM 467 NE ARG A 28 17.963 -15.439 -27.213 1.00 0.00 N ATOM 468 CZ ARG A 28 18.350 -15.613 -28.471 1.00 0.00 C ATOM 469 NH1 ARG A 28 19.315 -14.861 -28.982 1.00 0.00 N ATOM 470 NH2 ARG A 28 17.771 -16.541 -29.222 1.00 0.00 N ATOM 0 H ARG A 28 18.157 -17.466 -23.407 1.00 0.00 H new ATOM 0 HA ARG A 28 18.857 -14.751 -23.009 1.00 0.00 H new ATOM 0 HB2 ARG A 28 17.551 -16.239 -24.925 1.00 0.00 H new ATOM 0 HB3 ARG A 28 16.210 -15.389 -24.184 1.00 0.00 H new ATOM 0 HG2 ARG A 28 16.710 -13.661 -25.529 1.00 0.00 H new ATOM 0 HG3 ARG A 28 18.105 -13.378 -24.507 1.00 0.00 H new ATOM 0 HD2 ARG A 28 18.760 -13.532 -26.880 1.00 0.00 H new ATOM 0 HD3 ARG A 28 19.499 -14.811 -25.937 1.00 0.00 H new ATOM 0 HE ARG A 28 17.218 -16.034 -26.851 1.00 0.00 H new ATOM 0 HH11 ARG A 28 19.762 -14.146 -28.408 1.00 0.00 H new ATOM 0 HH12 ARG A 28 19.610 -14.997 -29.949 1.00 0.00 H new ATOM 0 HH21 ARG A 28 17.028 -17.121 -28.833 1.00 0.00 H new ATOM 0 HH22 ARG A 28 18.069 -16.674 -30.188 1.00 0.00 H new ATOM 484 N VAL A 29 15.951 -15.687 -21.711 1.00 0.00 N ATOM 485 CA VAL A 29 14.966 -15.353 -20.691 1.00 0.00 C ATOM 486 C VAL A 29 15.639 -15.022 -19.363 1.00 0.00 C ATOM 487 O VAL A 29 15.456 -13.935 -18.816 1.00 0.00 O ATOM 488 CB VAL A 29 13.968 -16.506 -20.475 1.00 0.00 C ATOM 489 CG1 VAL A 29 13.066 -16.216 -19.285 1.00 0.00 C ATOM 490 CG2 VAL A 29 13.146 -16.742 -21.733 1.00 0.00 C ATOM 0 H VAL A 29 15.723 -16.514 -22.262 1.00 0.00 H new ATOM 0 HA VAL A 29 14.425 -14.477 -21.049 1.00 0.00 H new ATOM 0 HB VAL A 29 14.530 -17.415 -20.261 1.00 0.00 H new ATOM 0 HG11 VAL A 29 12.368 -17.042 -19.148 1.00 0.00 H new ATOM 0 HG12 VAL A 29 13.674 -16.102 -18.387 1.00 0.00 H new ATOM 0 HG13 VAL A 29 12.509 -15.296 -19.466 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.446 -17.560 -21.562 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.592 -15.837 -21.981 1.00 0.00 H new ATOM 0 HG23 VAL A 29 13.810 -16.999 -22.559 1.00 0.00 H new ATOM 500 N ARG A 30 16.419 -15.968 -18.851 1.00 0.00 N ATOM 501 CA ARG A 30 17.120 -15.778 -17.586 1.00 0.00 C ATOM 502 C ARG A 30 18.068 -14.585 -17.665 1.00 0.00 C ATOM 503 O ARG A 30 18.127 -13.763 -16.749 1.00 0.00 O ATOM 504 CB ARG A 30 17.901 -17.041 -17.217 1.00 0.00 C ATOM 505 CG ARG A 30 18.960 -17.423 -18.239 1.00 0.00 C ATOM 506 CD ARG A 30 19.395 -18.871 -18.075 1.00 0.00 C ATOM 507 NE ARG A 30 19.584 -19.230 -16.672 1.00 0.00 N ATOM 508 CZ ARG A 30 20.656 -18.891 -15.964 1.00 0.00 C ATOM 509 NH1 ARG A 30 21.630 -18.187 -16.525 1.00 0.00 N ATOM 510 NH2 ARG A 30 20.755 -19.255 -14.692 1.00 0.00 N ATOM 0 H ARG A 30 16.582 -16.873 -19.292 1.00 0.00 H new ATOM 0 HA ARG A 30 16.377 -15.580 -16.813 1.00 0.00 H new ATOM 0 HB2 ARG A 30 18.379 -16.892 -16.249 1.00 0.00 H new ATOM 0 HB3 ARG A 30 17.202 -17.870 -17.103 1.00 0.00 H new ATOM 0 HG2 ARG A 30 18.568 -17.271 -19.245 1.00 0.00 H new ATOM 0 HG3 ARG A 30 19.824 -16.768 -18.131 1.00 0.00 H new ATOM 0 HD2 ARG A 30 18.646 -19.527 -18.519 1.00 0.00 H new ATOM 0 HD3 ARG A 30 20.325 -19.034 -18.619 1.00 0.00 H new ATOM 0 HE ARG A 30 18.853 -19.771 -16.210 1.00 0.00 H new ATOM 0 HH11 ARG A 30 21.557 -17.904 -17.502 1.00 0.00 H new ATOM 0 HH12 ARG A 30 22.452 -17.928 -15.979 1.00 0.00 H new ATOM 0 HH21 ARG A 30 20.008 -19.796 -14.257 1.00 0.00 H new ATOM 0 HH22 ARG A 30 21.578 -18.994 -14.150 1.00 0.00 H new ATOM 524 N THR A 31 18.811 -14.497 -18.764 1.00 0.00 N ATOM 525 CA THR A 31 19.757 -13.406 -18.961 1.00 0.00 C ATOM 526 C THR A 31 19.076 -12.052 -18.805 1.00 0.00 C ATOM 527 O THR A 31 19.450 -11.253 -17.945 1.00 0.00 O ATOM 528 CB THR A 31 20.416 -13.479 -20.352 1.00 0.00 C ATOM 529 OG1 THR A 31 21.431 -14.490 -20.361 1.00 0.00 O ATOM 530 CG2 THR A 31 21.026 -12.138 -20.732 1.00 0.00 C ATOM 0 H THR A 31 18.776 -15.168 -19.531 1.00 0.00 H new ATOM 0 HA THR A 31 20.526 -13.513 -18.196 1.00 0.00 H new ATOM 0 HB THR A 31 19.647 -13.731 -21.082 1.00 0.00 H new ATOM 0 HG1 THR A 31 21.070 -15.313 -20.753 1.00 0.00 H new ATOM 0 HG21 THR A 31 21.485 -12.213 -21.718 1.00 0.00 H new ATOM 0 HG22 THR A 31 20.246 -11.376 -20.752 1.00 0.00 H new ATOM 0 HG23 THR A 31 21.784 -11.862 -19.999 1.00 0.00 H new ATOM 538 N LEU A 32 18.074 -11.799 -19.639 1.00 0.00 N ATOM 539 CA LEU A 32 17.339 -10.540 -19.593 1.00 0.00 C ATOM 540 C LEU A 32 16.701 -10.331 -18.223 1.00 0.00 C ATOM 541 O LEU A 32 16.920 -9.308 -17.574 1.00 0.00 O ATOM 542 CB LEU A 32 16.261 -10.515 -20.679 1.00 0.00 C ATOM 543 CG LEU A 32 16.673 -11.065 -22.045 1.00 0.00 C ATOM 544 CD1 LEU A 32 15.653 -10.678 -23.105 1.00 0.00 C ATOM 545 CD2 LEU A 32 18.058 -10.564 -22.427 1.00 0.00 C ATOM 0 H LEU A 32 17.752 -12.449 -20.356 1.00 0.00 H new ATOM 0 HA LEU A 32 18.045 -9.729 -19.772 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.402 -11.085 -20.324 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.928 -9.485 -20.809 1.00 0.00 H new ATOM 0 HG LEU A 32 16.707 -12.153 -21.982 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.962 -11.078 -24.071 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.678 -11.087 -22.838 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.586 -9.592 -23.166 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.334 -10.966 -23.402 1.00 0.00 H new ATOM 0 HD22 LEU A 32 18.051 -9.475 -22.472 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.782 -10.892 -21.681 1.00 0.00 H new ATOM 557 N VAL A 33 15.913 -11.309 -17.788 1.00 0.00 N ATOM 558 CA VAL A 33 15.246 -11.235 -16.494 1.00 0.00 C ATOM 559 C VAL A 33 16.235 -10.892 -15.385 1.00 0.00 C ATOM 560 O VAL A 33 16.221 -9.785 -14.845 1.00 0.00 O ATOM 561 CB VAL A 33 14.542 -12.560 -16.148 1.00 0.00 C ATOM 562 CG1 VAL A 33 14.040 -12.540 -14.712 1.00 0.00 C ATOM 563 CG2 VAL A 33 13.400 -12.826 -17.117 1.00 0.00 C ATOM 0 H VAL A 33 15.721 -12.162 -18.313 1.00 0.00 H new ATOM 0 HA VAL A 33 14.499 -10.445 -16.568 1.00 0.00 H new ATOM 0 HB VAL A 33 15.265 -13.370 -16.243 1.00 0.00 H new ATOM 0 HG11 VAL A 33 13.545 -13.485 -14.486 1.00 0.00 H new ATOM 0 HG12 VAL A 33 14.882 -12.400 -14.034 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.332 -11.721 -14.585 1.00 0.00 H new ATOM 0 HG21 VAL A 33 12.914 -13.766 -16.857 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.675 -12.014 -17.057 1.00 0.00 H new ATOM 0 HG23 VAL A 33 13.791 -12.888 -18.132 1.00 0.00 H new ATOM 573 N LEU A 34 17.093 -11.849 -15.049 1.00 0.00 N ATOM 574 CA LEU A 34 18.091 -11.650 -14.004 1.00 0.00 C ATOM 575 C LEU A 34 18.874 -10.361 -14.237 1.00 0.00 C ATOM 576 O LEU A 34 19.256 -9.675 -13.291 1.00 0.00 O ATOM 577 CB LEU A 34 19.050 -12.840 -13.953 1.00 0.00 C ATOM 578 CG LEU A 34 18.401 -14.221 -13.853 1.00 0.00 C ATOM 579 CD1 LEU A 34 19.425 -15.313 -14.121 1.00 0.00 C ATOM 580 CD2 LEU A 34 17.762 -14.412 -12.485 1.00 0.00 C ATOM 0 H LEU A 34 17.118 -12.771 -15.485 1.00 0.00 H new ATOM 0 HA LEU A 34 17.570 -11.570 -13.050 1.00 0.00 H new ATOM 0 HB2 LEU A 34 19.673 -12.817 -14.847 1.00 0.00 H new ATOM 0 HB3 LEU A 34 19.714 -12.710 -13.098 1.00 0.00 H new ATOM 0 HG LEU A 34 17.620 -14.290 -14.610 1.00 0.00 H new ATOM 0 HD11 LEU A 34 18.945 -16.289 -14.045 1.00 0.00 H new ATOM 0 HD12 LEU A 34 19.837 -15.188 -15.122 1.00 0.00 H new ATOM 0 HD13 LEU A 34 20.228 -15.246 -13.387 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.305 -15.400 -12.432 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.525 -14.323 -11.711 1.00 0.00 H new ATOM 0 HD23 LEU A 34 16.998 -13.650 -12.331 1.00 0.00 H new ATOM 592 N GLY A 35 19.108 -10.038 -15.506 1.00 0.00 N ATOM 593 CA GLY A 35 19.842 -8.832 -15.841 1.00 0.00 C ATOM 594 C GLY A 35 19.158 -7.578 -15.333 1.00 0.00 C ATOM 595 O GLY A 35 19.662 -6.909 -14.429 1.00 0.00 O ATOM 0 H GLY A 35 18.802 -10.590 -16.307 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.845 -8.892 -15.419 1.00 0.00 H new ATOM 0 HA3 GLY A 35 19.955 -8.768 -16.923 1.00 0.00 H new ATOM 599 N LEU A 36 18.009 -7.255 -15.916 1.00 0.00 N ATOM 600 CA LEU A 36 17.255 -6.071 -15.519 1.00 0.00 C ATOM 601 C LEU A 36 17.022 -6.055 -14.011 1.00 0.00 C ATOM 602 O LEU A 36 16.823 -4.996 -13.415 1.00 0.00 O ATOM 603 CB LEU A 36 15.915 -6.025 -16.254 1.00 0.00 C ATOM 604 CG LEU A 36 15.005 -7.240 -16.069 1.00 0.00 C ATOM 605 CD1 LEU A 36 14.351 -7.212 -14.697 1.00 0.00 C ATOM 606 CD2 LEU A 36 13.950 -7.287 -17.164 1.00 0.00 C ATOM 0 H LEU A 36 17.579 -7.797 -16.666 1.00 0.00 H new ATOM 0 HA LEU A 36 17.839 -5.191 -15.788 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.374 -5.138 -15.926 1.00 0.00 H new ATOM 0 HB3 LEU A 36 16.112 -5.903 -17.319 1.00 0.00 H new ATOM 0 HG LEU A 36 15.614 -8.141 -16.140 1.00 0.00 H new ATOM 0 HD11 LEU A 36 13.707 -8.084 -14.583 1.00 0.00 H new ATOM 0 HD12 LEU A 36 15.122 -7.227 -13.926 1.00 0.00 H new ATOM 0 HD13 LEU A 36 13.755 -6.305 -14.597 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.311 -8.158 -17.017 1.00 0.00 H new ATOM 0 HD22 LEU A 36 13.344 -6.382 -17.125 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.438 -7.355 -18.136 1.00 0.00 H new ATOM 618 N VAL A 37 17.049 -7.235 -13.400 1.00 0.00 N ATOM 619 CA VAL A 37 16.844 -7.356 -11.962 1.00 0.00 C ATOM 620 C VAL A 37 18.027 -6.784 -11.188 1.00 0.00 C ATOM 621 O VAL A 37 17.869 -5.866 -10.384 1.00 0.00 O ATOM 622 CB VAL A 37 16.635 -8.825 -11.547 1.00 0.00 C ATOM 623 CG1 VAL A 37 16.939 -9.010 -10.068 1.00 0.00 C ATOM 624 CG2 VAL A 37 15.217 -9.272 -11.868 1.00 0.00 C ATOM 0 H VAL A 37 17.211 -8.121 -13.879 1.00 0.00 H new ATOM 0 HA VAL A 37 15.946 -6.786 -11.721 1.00 0.00 H new ATOM 0 HB VAL A 37 17.325 -9.447 -12.116 1.00 0.00 H new ATOM 0 HG11 VAL A 37 16.786 -10.054 -9.793 1.00 0.00 H new ATOM 0 HG12 VAL A 37 17.974 -8.731 -9.872 1.00 0.00 H new ATOM 0 HG13 VAL A 37 16.275 -8.378 -9.478 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.087 -10.312 -11.568 1.00 0.00 H new ATOM 0 HG22 VAL A 37 14.507 -8.647 -11.327 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.040 -9.178 -12.939 1.00 0.00 H new ATOM 634 N ASN A 38 19.211 -7.333 -11.437 1.00 0.00 N ATOM 635 CA ASN A 38 20.422 -6.877 -10.763 1.00 0.00 C ATOM 636 C ASN A 38 21.357 -6.173 -11.742 1.00 0.00 C ATOM 637 O ASN A 38 21.851 -5.080 -11.467 1.00 0.00 O ATOM 638 CB ASN A 38 21.143 -8.059 -10.112 1.00 0.00 C ATOM 639 CG ASN A 38 21.144 -9.293 -10.992 1.00 0.00 C ATOM 640 OD1 ASN A 38 20.229 -10.114 -10.930 1.00 0.00 O ATOM 641 ND2 ASN A 38 22.174 -9.429 -11.819 1.00 0.00 N ATOM 0 H ASN A 38 19.358 -8.094 -12.100 1.00 0.00 H new ATOM 0 HA ASN A 38 20.132 -6.166 -9.990 1.00 0.00 H new ATOM 0 HB2 ASN A 38 22.171 -7.775 -9.889 1.00 0.00 H new ATOM 0 HB3 ASN A 38 20.664 -8.294 -9.162 1.00 0.00 H new ATOM 0 HD21 ASN A 38 22.229 -10.239 -12.436 1.00 0.00 H new ATOM 0 HD22 ASN A 38 22.910 -8.723 -11.837 1.00 0.00 H new ATOM 648 N SER A 39 21.593 -6.807 -12.886 1.00 0.00 N ATOM 649 CA SER A 39 22.472 -6.243 -13.905 1.00 0.00 C ATOM 650 C SER A 39 21.850 -4.998 -14.529 1.00 0.00 C ATOM 651 O SER A 39 20.662 -4.725 -14.350 1.00 0.00 O ATOM 652 CB SER A 39 22.760 -7.282 -14.991 1.00 0.00 C ATOM 653 OG SER A 39 22.876 -8.581 -14.436 1.00 0.00 O ATOM 0 H SER A 39 21.188 -7.711 -13.131 1.00 0.00 H new ATOM 0 HA SER A 39 23.409 -5.959 -13.426 1.00 0.00 H new ATOM 0 HB2 SER A 39 21.960 -7.270 -15.732 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.681 -7.022 -15.512 1.00 0.00 H new ATOM 0 HG SER A 39 22.931 -9.241 -15.158 1.00 0.00 H new ATOM 659 N THR A 40 22.662 -4.243 -15.263 1.00 0.00 N ATOM 660 CA THR A 40 22.194 -3.026 -15.913 1.00 0.00 C ATOM 661 C THR A 40 21.439 -3.344 -17.198 1.00 0.00 C ATOM 662 O THR A 40 22.030 -3.418 -18.276 1.00 0.00 O ATOM 663 CB THR A 40 23.364 -2.078 -16.240 1.00 0.00 C ATOM 664 OG1 THR A 40 23.982 -1.627 -15.030 1.00 0.00 O ATOM 665 CG2 THR A 40 22.882 -0.882 -17.046 1.00 0.00 C ATOM 0 H THR A 40 23.647 -4.454 -15.422 1.00 0.00 H new ATOM 0 HA THR A 40 21.521 -2.533 -15.212 1.00 0.00 H new ATOM 0 HB THR A 40 24.092 -2.628 -16.836 1.00 0.00 H new ATOM 0 HG1 THR A 40 24.726 -1.026 -15.247 1.00 0.00 H new ATOM 0 HG21 THR A 40 23.725 -0.227 -17.265 1.00 0.00 H new ATOM 0 HG22 THR A 40 22.439 -1.227 -17.980 1.00 0.00 H new ATOM 0 HG23 THR A 40 22.136 -0.333 -16.472 1.00 0.00 H new ATOM 673 N LEU A 41 20.129 -3.531 -17.078 1.00 0.00 N ATOM 674 CA LEU A 41 19.291 -3.841 -18.231 1.00 0.00 C ATOM 675 C LEU A 41 17.962 -3.097 -18.154 1.00 0.00 C ATOM 676 O LEU A 41 17.207 -3.249 -17.193 1.00 0.00 O ATOM 677 CB LEU A 41 19.042 -5.347 -18.315 1.00 0.00 C ATOM 678 CG LEU A 41 19.861 -6.107 -19.360 1.00 0.00 C ATOM 679 CD1 LEU A 41 19.494 -7.583 -19.356 1.00 0.00 C ATOM 680 CD2 LEU A 41 19.650 -5.506 -20.742 1.00 0.00 C ATOM 0 H LEU A 41 19.624 -3.473 -16.194 1.00 0.00 H new ATOM 0 HA LEU A 41 19.816 -3.516 -19.129 1.00 0.00 H new ATOM 0 HB2 LEU A 41 19.244 -5.783 -17.337 1.00 0.00 H new ATOM 0 HB3 LEU A 41 17.984 -5.509 -18.524 1.00 0.00 H new ATOM 0 HG LEU A 41 20.916 -6.016 -19.103 1.00 0.00 H new ATOM 0 HD11 LEU A 41 20.087 -8.107 -20.106 1.00 0.00 H new ATOM 0 HD12 LEU A 41 19.697 -8.006 -18.372 1.00 0.00 H new ATOM 0 HD13 LEU A 41 18.435 -7.695 -19.587 1.00 0.00 H new ATOM 0 HD21 LEU A 41 20.240 -6.059 -21.473 1.00 0.00 H new ATOM 0 HD22 LEU A 41 18.595 -5.566 -21.007 1.00 0.00 H new ATOM 0 HD23 LEU A 41 19.964 -4.462 -20.737 1.00 0.00 H new ATOM 692 N THR A 42 17.679 -2.293 -19.175 1.00 0.00 N ATOM 693 CA THR A 42 16.441 -1.526 -19.224 1.00 0.00 C ATOM 694 C THR A 42 15.312 -2.344 -19.840 1.00 0.00 C ATOM 695 O THR A 42 15.540 -3.160 -20.734 1.00 0.00 O ATOM 696 CB THR A 42 16.616 -0.226 -20.030 1.00 0.00 C ATOM 697 OG1 THR A 42 15.390 0.513 -20.042 1.00 0.00 O ATOM 698 CG2 THR A 42 17.046 -0.528 -21.457 1.00 0.00 C ATOM 0 H THR A 42 18.291 -2.157 -19.979 1.00 0.00 H new ATOM 0 HA THR A 42 16.185 -1.274 -18.195 1.00 0.00 H new ATOM 0 HB THR A 42 17.393 0.370 -19.551 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.511 1.339 -20.555 1.00 0.00 H new ATOM 0 HG21 THR A 42 17.163 0.406 -22.007 1.00 0.00 H new ATOM 0 HG22 THR A 42 17.995 -1.064 -21.445 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.288 -1.143 -21.943 1.00 0.00 H new ATOM 706 N ILE A 43 14.094 -2.121 -19.358 1.00 0.00 N ATOM 707 CA ILE A 43 12.929 -2.837 -19.864 1.00 0.00 C ATOM 708 C ILE A 43 12.888 -2.811 -21.388 1.00 0.00 C ATOM 709 O ILE A 43 12.499 -3.790 -22.024 1.00 0.00 O ATOM 710 CB ILE A 43 11.620 -2.240 -19.315 1.00 0.00 C ATOM 711 CG1 ILE A 43 11.687 -2.120 -17.792 1.00 0.00 C ATOM 712 CG2 ILE A 43 10.432 -3.094 -19.733 1.00 0.00 C ATOM 713 CD1 ILE A 43 10.669 -2.978 -17.073 1.00 0.00 C ATOM 0 H ILE A 43 13.888 -1.450 -18.618 1.00 0.00 H new ATOM 0 HA ILE A 43 13.019 -3.868 -19.523 1.00 0.00 H new ATOM 0 HB ILE A 43 11.490 -1.242 -19.733 1.00 0.00 H new ATOM 0 HG12 ILE A 43 12.686 -2.399 -17.457 1.00 0.00 H new ATOM 0 HG13 ILE A 43 11.536 -1.078 -17.511 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.514 -2.659 -19.337 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.376 -3.132 -20.821 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.554 -4.104 -19.341 1.00 0.00 H new ATOM 0 HD11 ILE A 43 10.774 -2.843 -15.997 1.00 0.00 H new ATOM 0 HD12 ILE A 43 9.665 -2.685 -17.379 1.00 0.00 H new ATOM 0 HD13 ILE A 43 10.833 -4.026 -17.325 1.00 0.00 H new ATOM 725 N GLU A 44 13.293 -1.685 -21.967 1.00 0.00 N ATOM 726 CA GLU A 44 13.302 -1.534 -23.417 1.00 0.00 C ATOM 727 C GLU A 44 14.254 -2.537 -24.063 1.00 0.00 C ATOM 728 O GLU A 44 13.955 -3.102 -25.115 1.00 0.00 O ATOM 729 CB GLU A 44 13.709 -0.109 -23.800 1.00 0.00 C ATOM 730 CG GLU A 44 13.221 0.314 -25.176 1.00 0.00 C ATOM 731 CD GLU A 44 13.855 1.608 -25.647 1.00 0.00 C ATOM 732 OE1 GLU A 44 13.577 2.662 -25.039 1.00 0.00 O ATOM 733 OE2 GLU A 44 14.631 1.566 -26.625 1.00 0.00 O ATOM 0 H GLU A 44 13.619 -0.865 -21.455 1.00 0.00 H new ATOM 0 HA GLU A 44 12.294 -1.728 -23.783 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.317 0.584 -23.056 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.796 -0.030 -23.769 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.440 -0.476 -25.894 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.138 0.432 -25.153 1.00 0.00 H new ATOM 740 N GLU A 45 15.400 -2.752 -23.425 1.00 0.00 N ATOM 741 CA GLU A 45 16.395 -3.687 -23.938 1.00 0.00 C ATOM 742 C GLU A 45 16.007 -5.127 -23.616 1.00 0.00 C ATOM 743 O GLU A 45 16.083 -6.008 -24.472 1.00 0.00 O ATOM 744 CB GLU A 45 17.772 -3.374 -23.348 1.00 0.00 C ATOM 745 CG GLU A 45 18.841 -4.383 -23.731 1.00 0.00 C ATOM 746 CD GLU A 45 19.558 -4.014 -25.016 1.00 0.00 C ATOM 747 OE1 GLU A 45 18.959 -3.301 -25.847 1.00 0.00 O ATOM 748 OE2 GLU A 45 20.720 -4.439 -25.189 1.00 0.00 O ATOM 0 H GLU A 45 15.662 -2.292 -22.553 1.00 0.00 H new ATOM 0 HA GLU A 45 16.437 -3.575 -25.021 1.00 0.00 H new ATOM 0 HB2 GLU A 45 18.084 -2.384 -23.680 1.00 0.00 H new ATOM 0 HB3 GLU A 45 17.693 -3.336 -22.262 1.00 0.00 H new ATOM 0 HG2 GLU A 45 19.568 -4.461 -22.923 1.00 0.00 H new ATOM 0 HG3 GLU A 45 18.384 -5.366 -23.844 1.00 0.00 H new ATOM 755 N PHE A 46 15.590 -5.358 -22.376 1.00 0.00 N ATOM 756 CA PHE A 46 15.191 -6.691 -21.939 1.00 0.00 C ATOM 757 C PHE A 46 14.083 -7.246 -22.830 1.00 0.00 C ATOM 758 O PHE A 46 13.865 -8.456 -22.887 1.00 0.00 O ATOM 759 CB PHE A 46 14.720 -6.654 -20.483 1.00 0.00 C ATOM 760 CG PHE A 46 13.383 -7.304 -20.269 1.00 0.00 C ATOM 761 CD1 PHE A 46 13.293 -8.659 -19.997 1.00 0.00 C ATOM 762 CD2 PHE A 46 12.217 -6.559 -20.340 1.00 0.00 C ATOM 763 CE1 PHE A 46 12.064 -9.260 -19.799 1.00 0.00 C ATOM 764 CE2 PHE A 46 10.985 -7.155 -20.143 1.00 0.00 C ATOM 765 CZ PHE A 46 10.909 -8.507 -19.873 1.00 0.00 C ATOM 0 H PHE A 46 15.519 -4.639 -21.656 1.00 0.00 H new ATOM 0 HA PHE A 46 16.058 -7.347 -22.016 1.00 0.00 H new ATOM 0 HB2 PHE A 46 15.461 -7.151 -19.857 1.00 0.00 H new ATOM 0 HB3 PHE A 46 14.668 -5.617 -20.153 1.00 0.00 H new ATOM 0 HD1 PHE A 46 14.193 -9.253 -19.939 1.00 0.00 H new ATOM 0 HD2 PHE A 46 12.271 -5.501 -20.552 1.00 0.00 H new ATOM 0 HE1 PHE A 46 12.007 -10.317 -19.587 1.00 0.00 H new ATOM 0 HE2 PHE A 46 10.083 -6.564 -20.200 1.00 0.00 H new ATOM 0 HZ PHE A 46 9.948 -8.975 -19.720 1.00 0.00 H new ATOM 775 N HIS A 47 13.386 -6.352 -23.523 1.00 0.00 N ATOM 776 CA HIS A 47 12.300 -6.751 -24.411 1.00 0.00 C ATOM 777 C HIS A 47 12.830 -7.080 -25.803 1.00 0.00 C ATOM 778 O HIS A 47 12.266 -7.913 -26.513 1.00 0.00 O ATOM 779 CB HIS A 47 11.252 -5.642 -24.501 1.00 0.00 C ATOM 780 CG HIS A 47 10.433 -5.691 -25.755 1.00 0.00 C ATOM 781 ND1 HIS A 47 9.727 -6.808 -26.149 1.00 0.00 N ATOM 782 CD2 HIS A 47 10.210 -4.752 -26.704 1.00 0.00 C ATOM 783 CE1 HIS A 47 9.106 -6.555 -27.287 1.00 0.00 C ATOM 784 NE2 HIS A 47 9.382 -5.313 -27.645 1.00 0.00 N ATOM 0 H HIS A 47 13.554 -5.347 -23.487 1.00 0.00 H new ATOM 0 HA HIS A 47 11.836 -7.646 -23.997 1.00 0.00 H new ATOM 0 HB2 HIS A 47 10.587 -5.711 -23.640 1.00 0.00 H new ATOM 0 HB3 HIS A 47 11.752 -4.675 -24.441 1.00 0.00 H new ATOM 0 HD2 HIS A 47 10.609 -3.748 -26.718 1.00 0.00 H new ATOM 0 HE1 HIS A 47 8.479 -7.245 -27.832 1.00 0.00 H new ATOM 0 HE2 HIS A 47 9.036 -4.847 -28.484 1.00 0.00 H new ATOM 792 N SER A 48 13.918 -6.421 -26.188 1.00 0.00 N ATOM 793 CA SER A 48 14.522 -6.640 -27.497 1.00 0.00 C ATOM 794 C SER A 48 14.901 -8.106 -27.682 1.00 0.00 C ATOM 795 O SER A 48 14.296 -8.820 -28.482 1.00 0.00 O ATOM 796 CB SER A 48 15.760 -5.756 -27.666 1.00 0.00 C ATOM 797 OG SER A 48 16.730 -6.388 -28.483 1.00 0.00 O ATOM 0 H SER A 48 14.400 -5.731 -25.612 1.00 0.00 H new ATOM 0 HA SER A 48 13.788 -6.374 -28.257 1.00 0.00 H new ATOM 0 HB2 SER A 48 15.472 -4.803 -28.109 1.00 0.00 H new ATOM 0 HB3 SER A 48 16.190 -5.537 -26.689 1.00 0.00 H new ATOM 0 HG SER A 48 17.510 -5.802 -28.577 1.00 0.00 H new ATOM 803 N LYS A 49 15.907 -8.549 -26.936 1.00 0.00 N ATOM 804 CA LYS A 49 16.368 -9.930 -27.015 1.00 0.00 C ATOM 805 C LYS A 49 15.204 -10.902 -26.855 1.00 0.00 C ATOM 806 O LYS A 49 15.062 -11.850 -27.628 1.00 0.00 O ATOM 807 CB LYS A 49 17.423 -10.200 -25.939 1.00 0.00 C ATOM 808 CG LYS A 49 18.834 -10.323 -26.489 1.00 0.00 C ATOM 809 CD LYS A 49 19.871 -9.909 -25.459 1.00 0.00 C ATOM 810 CE LYS A 49 19.789 -8.422 -25.151 1.00 0.00 C ATOM 811 NZ LYS A 49 21.134 -7.830 -24.911 1.00 0.00 N ATOM 0 H LYS A 49 16.419 -7.971 -26.269 1.00 0.00 H new ATOM 0 HA LYS A 49 16.813 -10.082 -27.998 1.00 0.00 H new ATOM 0 HB2 LYS A 49 17.397 -9.394 -25.206 1.00 0.00 H new ATOM 0 HB3 LYS A 49 17.166 -11.119 -25.412 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.017 -11.352 -26.798 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.934 -9.701 -27.378 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.723 -10.480 -24.542 1.00 0.00 H new ATOM 0 HD3 LYS A 49 20.868 -10.151 -25.828 1.00 0.00 H new ATOM 0 HE2 LYS A 49 19.308 -7.905 -25.981 1.00 0.00 H new ATOM 0 HE3 LYS A 49 19.162 -8.267 -24.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 21.035 -6.816 -24.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.583 -8.306 -24.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 21.724 -7.955 -25.758 1.00 0.00 H new ATOM 825 N LEU A 50 14.372 -10.661 -25.847 1.00 0.00 N ATOM 826 CA LEU A 50 13.218 -11.514 -25.587 1.00 0.00 C ATOM 827 C LEU A 50 12.331 -11.623 -26.823 1.00 0.00 C ATOM 828 O LEU A 50 11.618 -12.611 -27.001 1.00 0.00 O ATOM 829 CB LEU A 50 12.408 -10.966 -24.410 1.00 0.00 C ATOM 830 CG LEU A 50 11.776 -12.008 -23.487 1.00 0.00 C ATOM 831 CD1 LEU A 50 11.604 -11.444 -22.085 1.00 0.00 C ATOM 832 CD2 LEU A 50 10.439 -12.473 -24.045 1.00 0.00 C ATOM 0 H LEU A 50 14.475 -9.882 -25.197 1.00 0.00 H new ATOM 0 HA LEU A 50 13.583 -12.510 -25.336 1.00 0.00 H new ATOM 0 HB2 LEU A 50 13.059 -10.328 -23.813 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.615 -10.331 -24.805 1.00 0.00 H new ATOM 0 HG LEU A 50 12.443 -12.869 -23.431 1.00 0.00 H new ATOM 0 HD11 LEU A 50 11.153 -12.199 -21.442 1.00 0.00 H new ATOM 0 HD12 LEU A 50 12.578 -11.161 -21.685 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.958 -10.567 -22.122 1.00 0.00 H new ATOM 0 HD21 LEU A 50 10.003 -13.214 -23.375 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.765 -11.621 -24.131 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.590 -12.917 -25.029 1.00 0.00 H new ATOM 844 N GLN A 51 12.381 -10.603 -27.673 1.00 0.00 N ATOM 845 CA GLN A 51 11.583 -10.585 -28.893 1.00 0.00 C ATOM 846 C GLN A 51 12.183 -11.507 -29.949 1.00 0.00 C ATOM 847 O GLN A 51 11.492 -12.359 -30.508 1.00 0.00 O ATOM 848 CB GLN A 51 11.481 -9.161 -29.440 1.00 0.00 C ATOM 849 CG GLN A 51 10.411 -8.994 -30.507 1.00 0.00 C ATOM 850 CD GLN A 51 10.706 -7.849 -31.456 1.00 0.00 C ATOM 851 OE1 GLN A 51 11.001 -6.733 -31.028 1.00 0.00 O ATOM 852 NE2 GLN A 51 10.628 -8.121 -32.753 1.00 0.00 N ATOM 0 H GLN A 51 12.966 -9.778 -27.539 1.00 0.00 H new ATOM 0 HA GLN A 51 10.583 -10.945 -28.649 1.00 0.00 H new ATOM 0 HB2 GLN A 51 11.271 -8.479 -28.616 1.00 0.00 H new ATOM 0 HB3 GLN A 51 12.446 -8.871 -29.856 1.00 0.00 H new ATOM 0 HG2 GLN A 51 10.324 -9.919 -31.076 1.00 0.00 H new ATOM 0 HG3 GLN A 51 9.448 -8.823 -30.026 1.00 0.00 H new ATOM 0 HE21 GLN A 51 10.380 -9.061 -33.063 1.00 0.00 H new ATOM 0 HE22 GLN A 51 10.816 -7.390 -33.440 1.00 0.00 H new ATOM 861 N GLU A 52 13.473 -11.330 -30.219 1.00 0.00 N ATOM 862 CA GLU A 52 14.165 -12.146 -31.209 1.00 0.00 C ATOM 863 C GLU A 52 14.520 -13.515 -30.635 1.00 0.00 C ATOM 864 O GLU A 52 15.053 -14.374 -31.336 1.00 0.00 O ATOM 865 CB GLU A 52 15.433 -11.438 -31.690 1.00 0.00 C ATOM 866 CG GLU A 52 16.447 -11.190 -30.586 1.00 0.00 C ATOM 867 CD GLU A 52 17.860 -11.035 -31.116 1.00 0.00 C ATOM 868 OE1 GLU A 52 18.189 -11.691 -32.127 1.00 0.00 O ATOM 869 OE2 GLU A 52 18.635 -10.259 -30.520 1.00 0.00 O ATOM 0 H GLU A 52 14.059 -10.629 -29.766 1.00 0.00 H new ATOM 0 HA GLU A 52 13.494 -12.290 -32.056 1.00 0.00 H new ATOM 0 HB2 GLU A 52 15.899 -12.037 -32.472 1.00 0.00 H new ATOM 0 HB3 GLU A 52 15.158 -10.484 -32.140 1.00 0.00 H new ATOM 0 HG2 GLU A 52 16.168 -10.291 -30.037 1.00 0.00 H new ATOM 0 HG3 GLU A 52 16.417 -12.018 -29.878 1.00 0.00 H new ATOM 876 N ALA A 53 14.221 -13.708 -29.355 1.00 0.00 N ATOM 877 CA ALA A 53 14.506 -14.972 -28.686 1.00 0.00 C ATOM 878 C ALA A 53 13.274 -15.870 -28.661 1.00 0.00 C ATOM 879 O ALA A 53 13.356 -17.063 -28.957 1.00 0.00 O ATOM 880 CB ALA A 53 15.007 -14.719 -27.272 1.00 0.00 C ATOM 0 H ALA A 53 13.782 -13.006 -28.760 1.00 0.00 H new ATOM 0 HA ALA A 53 15.285 -15.485 -29.249 1.00 0.00 H new ATOM 0 HB1 ALA A 53 15.216 -15.671 -26.784 1.00 0.00 H new ATOM 0 HB2 ALA A 53 15.919 -14.123 -27.310 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.246 -14.181 -26.707 1.00 0.00 H new ATOM 886 N THR A 54 12.132 -15.290 -28.304 1.00 0.00 N ATOM 887 CA THR A 54 10.883 -16.039 -28.237 1.00 0.00 C ATOM 888 C THR A 54 10.476 -16.552 -29.614 1.00 0.00 C ATOM 889 O THR A 54 9.583 -17.390 -29.735 1.00 0.00 O ATOM 890 CB THR A 54 9.742 -15.177 -27.665 1.00 0.00 C ATOM 891 OG1 THR A 54 9.727 -13.896 -28.304 1.00 0.00 O ATOM 892 CG2 THR A 54 9.900 -14.999 -26.162 1.00 0.00 C ATOM 0 H THR A 54 12.046 -14.304 -28.057 1.00 0.00 H new ATOM 0 HA THR A 54 11.057 -16.886 -27.573 1.00 0.00 H new ATOM 0 HB THR A 54 8.799 -15.688 -27.857 1.00 0.00 H new ATOM 0 HG1 THR A 54 10.105 -13.224 -27.699 1.00 0.00 H new ATOM 0 HG21 THR A 54 9.083 -14.387 -25.780 1.00 0.00 H new ATOM 0 HG22 THR A 54 9.880 -15.974 -25.676 1.00 0.00 H new ATOM 0 HG23 THR A 54 10.850 -14.508 -25.952 1.00 0.00 H new ATOM 900 N ASN A 55 11.137 -16.044 -30.649 1.00 0.00 N ATOM 901 CA ASN A 55 10.843 -16.452 -32.018 1.00 0.00 C ATOM 902 C ASN A 55 9.458 -15.974 -32.442 1.00 0.00 C ATOM 903 O ASN A 55 8.911 -16.434 -33.445 1.00 0.00 O ATOM 904 CB ASN A 55 10.932 -17.974 -32.149 1.00 0.00 C ATOM 905 CG ASN A 55 12.045 -18.563 -31.304 1.00 0.00 C ATOM 906 OD1 ASN A 55 11.793 -19.194 -30.278 1.00 0.00 O ATOM 907 ND2 ASN A 55 13.285 -18.357 -31.732 1.00 0.00 N ATOM 0 H ASN A 55 11.879 -15.349 -30.566 1.00 0.00 H new ATOM 0 HA ASN A 55 11.583 -15.994 -32.674 1.00 0.00 H new ATOM 0 HB2 ASN A 55 9.981 -18.418 -31.853 1.00 0.00 H new ATOM 0 HB3 ASN A 55 11.095 -18.237 -33.194 1.00 0.00 H new ATOM 0 HD21 ASN A 55 14.075 -18.728 -31.204 1.00 0.00 H new ATOM 0 HD22 ASN A 55 13.448 -17.828 -32.589 1.00 0.00 H new ATOM 914 N PHE A 56 8.895 -15.048 -31.672 1.00 0.00 N ATOM 915 CA PHE A 56 7.574 -14.508 -31.968 1.00 0.00 C ATOM 916 C PHE A 56 7.619 -12.986 -32.071 1.00 0.00 C ATOM 917 O PHE A 56 8.545 -12.333 -31.590 1.00 0.00 O ATOM 918 CB PHE A 56 6.575 -14.928 -30.887 1.00 0.00 C ATOM 919 CG PHE A 56 5.923 -16.254 -31.156 1.00 0.00 C ATOM 920 CD1 PHE A 56 5.289 -16.497 -32.364 1.00 0.00 C ATOM 921 CD2 PHE A 56 5.945 -17.258 -30.201 1.00 0.00 C ATOM 922 CE1 PHE A 56 4.688 -17.716 -32.613 1.00 0.00 C ATOM 923 CE2 PHE A 56 5.347 -18.479 -30.445 1.00 0.00 C ATOM 924 CZ PHE A 56 4.718 -18.709 -31.653 1.00 0.00 C ATOM 0 H PHE A 56 9.334 -14.656 -30.839 1.00 0.00 H new ATOM 0 HA PHE A 56 7.251 -14.910 -32.928 1.00 0.00 H new ATOM 0 HB2 PHE A 56 7.089 -14.973 -29.927 1.00 0.00 H new ATOM 0 HB3 PHE A 56 5.803 -14.163 -30.800 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.264 -15.725 -33.119 1.00 0.00 H new ATOM 0 HD2 PHE A 56 6.436 -17.084 -29.255 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.195 -17.892 -33.558 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.371 -19.253 -29.692 1.00 0.00 H new ATOM 0 HZ PHE A 56 4.251 -19.663 -31.847 1.00 0.00 H new ATOM 934 N PRO A 57 6.595 -12.407 -32.714 1.00 0.00 N ATOM 935 CA PRO A 57 6.493 -10.956 -32.896 1.00 0.00 C ATOM 936 C PRO A 57 6.213 -10.225 -31.588 1.00 0.00 C ATOM 937 O PRO A 57 5.721 -10.819 -30.626 1.00 0.00 O ATOM 938 CB PRO A 57 5.314 -10.800 -33.859 1.00 0.00 C ATOM 939 CG PRO A 57 4.488 -12.022 -33.647 1.00 0.00 C ATOM 940 CD PRO A 57 5.456 -13.123 -33.313 1.00 0.00 C ATOM 0 HA PRO A 57 7.423 -10.526 -33.267 1.00 0.00 H new ATOM 0 HB2 PRO A 57 4.745 -9.895 -33.645 1.00 0.00 H new ATOM 0 HB3 PRO A 57 5.654 -10.726 -34.892 1.00 0.00 H new ATOM 0 HG2 PRO A 57 3.772 -11.874 -32.839 1.00 0.00 H new ATOM 0 HG3 PRO A 57 3.914 -12.265 -34.541 1.00 0.00 H new ATOM 0 HD2 PRO A 57 5.023 -13.842 -32.617 1.00 0.00 H new ATOM 0 HD3 PRO A 57 5.754 -13.679 -34.202 1.00 0.00 H new ATOM 948 N LEU A 58 6.526 -8.935 -31.557 1.00 0.00 N ATOM 949 CA LEU A 58 6.307 -8.123 -30.365 1.00 0.00 C ATOM 950 C LEU A 58 4.904 -8.341 -29.808 1.00 0.00 C ATOM 951 O LEU A 58 3.914 -7.930 -30.414 1.00 0.00 O ATOM 952 CB LEU A 58 6.515 -6.642 -30.687 1.00 0.00 C ATOM 953 CG LEU A 58 5.759 -5.649 -29.803 1.00 0.00 C ATOM 954 CD1 LEU A 58 6.189 -5.793 -28.352 1.00 0.00 C ATOM 955 CD2 LEU A 58 5.982 -4.225 -30.289 1.00 0.00 C ATOM 0 H LEU A 58 6.932 -8.428 -32.343 1.00 0.00 H new ATOM 0 HA LEU A 58 7.030 -8.429 -29.609 1.00 0.00 H new ATOM 0 HB2 LEU A 58 7.580 -6.422 -30.617 1.00 0.00 H new ATOM 0 HB3 LEU A 58 6.222 -6.472 -31.723 1.00 0.00 H new ATOM 0 HG LEU A 58 4.694 -5.871 -29.869 1.00 0.00 H new ATOM 0 HD11 LEU A 58 5.641 -5.079 -27.738 1.00 0.00 H new ATOM 0 HD12 LEU A 58 5.977 -6.805 -28.008 1.00 0.00 H new ATOM 0 HD13 LEU A 58 7.258 -5.598 -28.268 1.00 0.00 H new ATOM 0 HD21 LEU A 58 5.437 -3.532 -29.648 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.046 -3.991 -30.254 1.00 0.00 H new ATOM 0 HD23 LEU A 58 5.623 -4.130 -31.314 1.00 0.00 H new ATOM 967 N ARG A 59 4.827 -8.988 -28.649 1.00 0.00 N ATOM 968 CA ARG A 59 3.545 -9.259 -28.010 1.00 0.00 C ATOM 969 C ARG A 59 3.033 -8.025 -27.272 1.00 0.00 C ATOM 970 O ARG A 59 3.799 -7.144 -26.880 1.00 0.00 O ATOM 971 CB ARG A 59 3.675 -10.432 -27.036 1.00 0.00 C ATOM 972 CG ARG A 59 4.865 -10.314 -26.097 1.00 0.00 C ATOM 973 CD ARG A 59 4.455 -10.532 -24.649 1.00 0.00 C ATOM 974 NE ARG A 59 5.407 -11.377 -23.932 1.00 0.00 N ATOM 975 CZ ARG A 59 5.140 -11.963 -22.770 1.00 0.00 C ATOM 976 NH1 ARG A 59 3.956 -11.797 -22.197 1.00 0.00 N ATOM 977 NH2 ARG A 59 6.058 -12.717 -22.180 1.00 0.00 N ATOM 0 H ARG A 59 5.637 -9.334 -28.134 1.00 0.00 H new ATOM 0 HA ARG A 59 2.827 -9.519 -28.788 1.00 0.00 H new ATOM 0 HB2 ARG A 59 2.762 -10.505 -26.445 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.762 -11.358 -27.605 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.624 -11.045 -26.376 1.00 0.00 H new ATOM 0 HG3 ARG A 59 5.318 -9.328 -26.204 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.375 -9.568 -24.146 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.467 -10.991 -24.617 1.00 0.00 H new ATOM 0 HE ARG A 59 6.327 -11.525 -24.346 1.00 0.00 H new ATOM 0 HH11 ARG A 59 3.248 -11.218 -22.648 1.00 0.00 H new ATOM 0 HH12 ARG A 59 3.753 -12.248 -21.305 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.970 -12.847 -22.618 1.00 0.00 H new ATOM 0 HH22 ARG A 59 5.852 -13.167 -21.288 1.00 0.00 H new ATOM 991 N PRO A 60 1.708 -7.959 -27.078 1.00 0.00 N ATOM 992 CA PRO A 60 1.064 -6.838 -26.386 1.00 0.00 C ATOM 993 C PRO A 60 1.382 -6.817 -24.895 1.00 0.00 C ATOM 994 O PRO A 60 1.641 -7.858 -24.291 1.00 0.00 O ATOM 995 CB PRO A 60 -0.428 -7.092 -26.611 1.00 0.00 C ATOM 996 CG PRO A 60 -0.534 -8.563 -26.825 1.00 0.00 C ATOM 997 CD PRO A 60 0.735 -8.973 -27.518 1.00 0.00 C ATOM 0 HA PRO A 60 1.408 -5.875 -26.763 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.018 -6.774 -25.751 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -0.798 -6.539 -27.474 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -0.648 -9.088 -25.877 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -1.406 -8.807 -27.431 1.00 0.00 H new ATOM 0 HD2 PRO A 60 1.044 -9.978 -27.229 1.00 0.00 H new ATOM 0 HD3 PRO A 60 0.618 -8.974 -28.602 1.00 0.00 H new ATOM 1005 N PHE A 61 1.360 -5.626 -24.307 1.00 0.00 N ATOM 1006 CA PHE A 61 1.647 -5.470 -22.885 1.00 0.00 C ATOM 1007 C PHE A 61 2.877 -6.280 -22.486 1.00 0.00 C ATOM 1008 O PHE A 61 2.880 -6.962 -21.461 1.00 0.00 O ATOM 1009 CB PHE A 61 0.442 -5.907 -22.050 1.00 0.00 C ATOM 1010 CG PHE A 61 -0.875 -5.466 -22.621 1.00 0.00 C ATOM 1011 CD1 PHE A 61 -1.234 -4.128 -22.618 1.00 0.00 C ATOM 1012 CD2 PHE A 61 -1.755 -6.390 -23.161 1.00 0.00 C ATOM 1013 CE1 PHE A 61 -2.445 -3.719 -23.144 1.00 0.00 C ATOM 1014 CE2 PHE A 61 -2.967 -5.987 -23.689 1.00 0.00 C ATOM 1015 CZ PHE A 61 -3.314 -4.650 -23.679 1.00 0.00 C ATOM 0 H PHE A 61 1.147 -4.755 -24.792 1.00 0.00 H new ATOM 0 HA PHE A 61 1.850 -4.416 -22.694 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.445 -6.993 -21.963 1.00 0.00 H new ATOM 0 HB3 PHE A 61 0.544 -5.506 -21.042 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.559 -3.396 -22.200 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -1.491 -7.437 -23.169 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.712 -2.672 -23.137 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.643 -6.717 -24.109 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.262 -4.333 -24.088 1.00 0.00 H new ATOM 1025 N VAL A 62 3.921 -6.201 -23.305 1.00 0.00 N ATOM 1026 CA VAL A 62 5.158 -6.925 -23.038 1.00 0.00 C ATOM 1027 C VAL A 62 6.157 -6.051 -22.288 1.00 0.00 C ATOM 1028 O VAL A 62 6.889 -6.531 -21.422 1.00 0.00 O ATOM 1029 CB VAL A 62 5.808 -7.424 -24.343 1.00 0.00 C ATOM 1030 CG1 VAL A 62 6.463 -6.271 -25.088 1.00 0.00 C ATOM 1031 CG2 VAL A 62 6.820 -8.521 -24.047 1.00 0.00 C ATOM 0 H VAL A 62 3.935 -5.643 -24.159 1.00 0.00 H new ATOM 0 HA VAL A 62 4.895 -7.783 -22.419 1.00 0.00 H new ATOM 0 HB VAL A 62 5.029 -7.841 -24.981 1.00 0.00 H new ATOM 0 HG11 VAL A 62 6.917 -6.642 -26.007 1.00 0.00 H new ATOM 0 HG12 VAL A 62 5.710 -5.521 -25.332 1.00 0.00 H new ATOM 0 HG13 VAL A 62 7.232 -5.822 -24.460 1.00 0.00 H new ATOM 0 HG21 VAL A 62 7.270 -8.862 -24.979 1.00 0.00 H new ATOM 0 HG22 VAL A 62 7.598 -8.131 -23.390 1.00 0.00 H new ATOM 0 HG23 VAL A 62 6.318 -9.357 -23.559 1.00 0.00 H new ATOM 1041 N ILE A 63 6.180 -4.766 -22.625 1.00 0.00 N ATOM 1042 CA ILE A 63 7.087 -3.824 -21.982 1.00 0.00 C ATOM 1043 C ILE A 63 6.586 -3.438 -20.594 1.00 0.00 C ATOM 1044 O ILE A 63 7.284 -3.587 -19.591 1.00 0.00 O ATOM 1045 CB ILE A 63 7.264 -2.547 -22.824 1.00 0.00 C ATOM 1046 CG1 ILE A 63 8.323 -2.767 -23.906 1.00 0.00 C ATOM 1047 CG2 ILE A 63 7.644 -1.373 -21.934 1.00 0.00 C ATOM 1048 CD1 ILE A 63 9.695 -3.086 -23.353 1.00 0.00 C ATOM 0 H ILE A 63 5.581 -4.353 -23.340 1.00 0.00 H new ATOM 0 HA ILE A 63 8.050 -4.326 -21.892 1.00 0.00 H new ATOM 0 HB ILE A 63 6.316 -2.316 -23.311 1.00 0.00 H new ATOM 0 HG12 ILE A 63 8.003 -3.582 -24.555 1.00 0.00 H new ATOM 0 HG13 ILE A 63 8.389 -1.873 -24.526 1.00 0.00 H new ATOM 0 HG21 ILE A 63 7.765 -0.478 -22.544 1.00 0.00 H new ATOM 0 HG22 ILE A 63 6.858 -1.206 -21.197 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.581 -1.593 -21.422 1.00 0.00 H new ATOM 0 HD11 ILE A 63 10.395 -3.230 -24.176 1.00 0.00 H new ATOM 0 HD12 ILE A 63 10.036 -2.261 -22.727 1.00 0.00 H new ATOM 0 HD13 ILE A 63 9.644 -3.997 -22.757 1.00 0.00 H new ATOM 1060 N PRO A 64 5.345 -2.932 -20.533 1.00 0.00 N ATOM 1061 CA PRO A 64 4.721 -2.517 -19.273 1.00 0.00 C ATOM 1062 C PRO A 64 4.388 -3.702 -18.373 1.00 0.00 C ATOM 1063 O PRO A 64 3.995 -3.527 -17.219 1.00 0.00 O ATOM 1064 CB PRO A 64 3.440 -1.813 -19.727 1.00 0.00 C ATOM 1065 CG PRO A 64 3.129 -2.412 -21.055 1.00 0.00 C ATOM 1066 CD PRO A 64 4.456 -2.727 -21.688 1.00 0.00 C ATOM 0 HA PRO A 64 5.382 -1.887 -18.679 1.00 0.00 H new ATOM 0 HB2 PRO A 64 2.627 -1.975 -19.019 1.00 0.00 H new ATOM 0 HB3 PRO A 64 3.586 -0.736 -19.803 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.525 -3.313 -20.945 1.00 0.00 H new ATOM 0 HG3 PRO A 64 2.557 -1.719 -21.672 1.00 0.00 H new ATOM 0 HD2 PRO A 64 4.401 -3.617 -22.315 1.00 0.00 H new ATOM 0 HD3 PRO A 64 4.803 -1.911 -22.322 1.00 0.00 H new ATOM 1074 N PHE A 65 4.547 -4.908 -18.907 1.00 0.00 N ATOM 1075 CA PHE A 65 4.262 -6.123 -18.152 1.00 0.00 C ATOM 1076 C PHE A 65 5.213 -6.261 -16.967 1.00 0.00 C ATOM 1077 O PHE A 65 4.787 -6.527 -15.842 1.00 0.00 O ATOM 1078 CB PHE A 65 4.376 -7.350 -19.058 1.00 0.00 C ATOM 1079 CG PHE A 65 5.040 -8.524 -18.396 1.00 0.00 C ATOM 1080 CD1 PHE A 65 4.303 -9.412 -17.629 1.00 0.00 C ATOM 1081 CD2 PHE A 65 6.401 -8.740 -18.542 1.00 0.00 C ATOM 1082 CE1 PHE A 65 4.911 -10.493 -17.019 1.00 0.00 C ATOM 1083 CE2 PHE A 65 7.014 -9.819 -17.935 1.00 0.00 C ATOM 1084 CZ PHE A 65 6.268 -10.696 -17.171 1.00 0.00 C ATOM 0 H PHE A 65 4.872 -5.071 -19.860 1.00 0.00 H new ATOM 0 HA PHE A 65 3.243 -6.055 -17.772 1.00 0.00 H new ATOM 0 HB2 PHE A 65 3.379 -7.644 -19.386 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.939 -7.081 -19.952 1.00 0.00 H new ATOM 0 HD1 PHE A 65 3.241 -9.258 -17.506 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.989 -8.057 -19.137 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.325 -11.178 -16.424 1.00 0.00 H new ATOM 0 HE2 PHE A 65 8.075 -9.977 -18.057 1.00 0.00 H new ATOM 0 HZ PHE A 65 6.746 -11.539 -16.694 1.00 0.00 H new ATOM 1094 N LEU A 66 6.503 -6.081 -17.227 1.00 0.00 N ATOM 1095 CA LEU A 66 7.517 -6.186 -16.183 1.00 0.00 C ATOM 1096 C LEU A 66 7.805 -4.822 -15.565 1.00 0.00 C ATOM 1097 O LEU A 66 8.434 -4.726 -14.510 1.00 0.00 O ATOM 1098 CB LEU A 66 8.804 -6.784 -16.753 1.00 0.00 C ATOM 1099 CG LEU A 66 9.496 -7.838 -15.887 1.00 0.00 C ATOM 1100 CD1 LEU A 66 10.504 -8.625 -16.708 1.00 0.00 C ATOM 1101 CD2 LEU A 66 10.173 -7.185 -14.691 1.00 0.00 C ATOM 0 H LEU A 66 6.872 -5.862 -18.152 1.00 0.00 H new ATOM 0 HA LEU A 66 7.134 -6.843 -15.403 1.00 0.00 H new ATOM 0 HB2 LEU A 66 8.576 -7.231 -17.721 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.509 -5.972 -16.935 1.00 0.00 H new ATOM 0 HG LEU A 66 8.740 -8.530 -15.518 1.00 0.00 H new ATOM 0 HD11 LEU A 66 10.986 -9.370 -16.075 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.993 -9.124 -17.531 1.00 0.00 H new ATOM 0 HD13 LEU A 66 11.257 -7.946 -17.108 1.00 0.00 H new ATOM 0 HD21 LEU A 66 10.660 -7.950 -14.086 1.00 0.00 H new ATOM 0 HD22 LEU A 66 10.918 -6.470 -15.040 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.427 -6.667 -14.089 1.00 0.00 H new ATOM 1113 N LYS A 67 7.341 -3.768 -16.227 1.00 0.00 N ATOM 1114 CA LYS A 67 7.546 -2.408 -15.742 1.00 0.00 C ATOM 1115 C LYS A 67 7.030 -2.256 -14.315 1.00 0.00 C ATOM 1116 O LYS A 67 7.566 -1.473 -13.531 1.00 0.00 O ATOM 1117 CB LYS A 67 6.842 -1.406 -16.660 1.00 0.00 C ATOM 1118 CG LYS A 67 7.640 -1.055 -17.904 1.00 0.00 C ATOM 1119 CD LYS A 67 8.741 -0.054 -17.596 1.00 0.00 C ATOM 1120 CE LYS A 67 8.180 1.344 -17.387 1.00 0.00 C ATOM 1121 NZ LYS A 67 9.252 2.333 -17.084 1.00 0.00 N ATOM 0 H LYS A 67 6.820 -3.829 -17.102 1.00 0.00 H new ATOM 0 HA LYS A 67 8.617 -2.205 -15.746 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.878 -1.817 -16.961 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.639 -0.493 -16.100 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.077 -1.961 -18.324 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.973 -0.642 -18.661 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.280 -0.368 -16.702 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.461 -0.040 -18.414 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.640 1.656 -18.281 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.459 1.328 -16.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.829 3.273 -16.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.751 2.049 -16.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.926 2.368 -17.875 1.00 0.00 H new ATOM 1135 N ALA A 68 5.986 -3.009 -13.985 1.00 0.00 N ATOM 1136 CA ALA A 68 5.400 -2.960 -12.651 1.00 0.00 C ATOM 1137 C ALA A 68 5.817 -4.171 -11.823 1.00 0.00 C ATOM 1138 O ALA A 68 5.299 -4.395 -10.730 1.00 0.00 O ATOM 1139 CB ALA A 68 3.884 -2.877 -12.743 1.00 0.00 C ATOM 0 H ALA A 68 5.529 -3.660 -14.623 1.00 0.00 H new ATOM 0 HA ALA A 68 5.772 -2.066 -12.151 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.460 -2.841 -11.739 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.601 -1.977 -13.289 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.503 -3.754 -13.267 1.00 0.00 H new ATOM 1145 N ASN A 69 6.755 -4.949 -12.353 1.00 0.00 N ATOM 1146 CA ASN A 69 7.240 -6.139 -11.663 1.00 0.00 C ATOM 1147 C ASN A 69 8.751 -6.075 -11.464 1.00 0.00 C ATOM 1148 O ASN A 69 9.338 -6.932 -10.802 1.00 0.00 O ATOM 1149 CB ASN A 69 6.871 -7.397 -12.451 1.00 0.00 C ATOM 1150 CG ASN A 69 5.371 -7.606 -12.539 1.00 0.00 C ATOM 1151 OD1 ASN A 69 4.826 -7.819 -13.622 1.00 0.00 O ATOM 1152 ND2 ASN A 69 4.698 -7.545 -11.397 1.00 0.00 N ATOM 0 H ASN A 69 7.194 -4.777 -13.257 1.00 0.00 H new ATOM 0 HA ASN A 69 6.764 -6.179 -10.683 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.285 -7.327 -13.457 1.00 0.00 H new ATOM 0 HB3 ASN A 69 7.329 -8.266 -11.978 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.687 -7.677 -11.393 1.00 0.00 H new ATOM 0 HD22 ASN A 69 5.192 -7.366 -10.523 1.00 0.00 H new ATOM 1159 N LEU A 70 9.375 -5.053 -12.040 1.00 0.00 N ATOM 1160 CA LEU A 70 10.818 -4.876 -11.926 1.00 0.00 C ATOM 1161 C LEU A 70 11.247 -4.827 -10.463 1.00 0.00 C ATOM 1162 O LEU A 70 12.126 -5.568 -10.023 1.00 0.00 O ATOM 1163 CB LEU A 70 11.252 -3.594 -12.640 1.00 0.00 C ATOM 1164 CG LEU A 70 12.562 -3.674 -13.425 1.00 0.00 C ATOM 1165 CD1 LEU A 70 13.718 -4.020 -12.501 1.00 0.00 C ATOM 1166 CD2 LEU A 70 12.449 -4.696 -14.547 1.00 0.00 C ATOM 0 H LEU A 70 8.904 -4.335 -12.590 1.00 0.00 H new ATOM 0 HA LEU A 70 11.303 -5.730 -12.399 1.00 0.00 H new ATOM 0 HB2 LEU A 70 10.458 -3.297 -13.326 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.344 -2.802 -11.897 1.00 0.00 H new ATOM 0 HG LEU A 70 12.758 -2.698 -13.868 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.642 -4.072 -13.078 1.00 0.00 H new ATOM 0 HD12 LEU A 70 13.813 -3.252 -11.733 1.00 0.00 H new ATOM 0 HD13 LEU A 70 13.530 -4.984 -12.028 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.390 -4.740 -15.095 1.00 0.00 H new ATOM 0 HD22 LEU A 70 12.229 -5.677 -14.125 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.647 -4.404 -15.225 1.00 0.00 H new ATOM 1178 N PRO A 71 10.611 -3.935 -9.690 1.00 0.00 N ATOM 1179 CA PRO A 71 10.908 -3.770 -8.264 1.00 0.00 C ATOM 1180 C PRO A 71 10.448 -4.964 -7.434 1.00 0.00 C ATOM 1181 O PRO A 71 10.770 -5.070 -6.250 1.00 0.00 O ATOM 1182 CB PRO A 71 10.117 -2.516 -7.880 1.00 0.00 C ATOM 1183 CG PRO A 71 9.003 -2.453 -8.866 1.00 0.00 C ATOM 1184 CD PRO A 71 9.552 -3.019 -10.147 1.00 0.00 C ATOM 0 HA PRO A 71 11.979 -3.690 -8.077 1.00 0.00 H new ATOM 0 HB2 PRO A 71 9.739 -2.584 -6.860 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.741 -1.624 -7.930 1.00 0.00 H new ATOM 0 HG2 PRO A 71 8.144 -3.029 -8.522 1.00 0.00 H new ATOM 0 HG3 PRO A 71 8.664 -1.427 -9.006 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.785 -3.544 -10.716 1.00 0.00 H new ATOM 0 HD3 PRO A 71 9.949 -2.237 -10.794 1.00 0.00 H new ATOM 1192 N LEU A 72 9.696 -5.860 -8.062 1.00 0.00 N ATOM 1193 CA LEU A 72 9.192 -7.048 -7.381 1.00 0.00 C ATOM 1194 C LEU A 72 10.126 -8.235 -7.594 1.00 0.00 C ATOM 1195 O LEU A 72 10.526 -8.903 -6.640 1.00 0.00 O ATOM 1196 CB LEU A 72 7.789 -7.392 -7.884 1.00 0.00 C ATOM 1197 CG LEU A 72 6.626 -6.845 -7.055 1.00 0.00 C ATOM 1198 CD1 LEU A 72 6.865 -7.090 -5.574 1.00 0.00 C ATOM 1199 CD2 LEU A 72 6.429 -5.361 -7.328 1.00 0.00 C ATOM 0 H LEU A 72 9.421 -5.787 -9.042 1.00 0.00 H new ATOM 0 HA LEU A 72 9.146 -6.832 -6.314 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.689 -7.020 -8.904 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.697 -8.477 -7.930 1.00 0.00 H new ATOM 0 HG LEU A 72 5.717 -7.371 -7.347 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.027 -6.694 -5.000 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.956 -8.161 -5.392 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.784 -6.591 -5.266 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.597 -4.988 -6.730 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.337 -4.819 -7.065 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.211 -5.211 -8.385 1.00 0.00 H new ATOM 1211 N LEU A 73 10.473 -8.490 -8.851 1.00 0.00 N ATOM 1212 CA LEU A 73 11.363 -9.595 -9.190 1.00 0.00 C ATOM 1213 C LEU A 73 12.715 -9.436 -8.503 1.00 0.00 C ATOM 1214 O LEU A 73 13.372 -10.422 -8.171 1.00 0.00 O ATOM 1215 CB LEU A 73 11.554 -9.675 -10.706 1.00 0.00 C ATOM 1216 CG LEU A 73 10.767 -10.771 -11.425 1.00 0.00 C ATOM 1217 CD1 LEU A 73 11.141 -12.141 -10.882 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.271 -10.530 -11.288 1.00 0.00 C ATOM 0 H LEU A 73 10.152 -7.947 -9.652 1.00 0.00 H new ATOM 0 HA LEU A 73 10.905 -10.519 -8.838 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.277 -8.714 -11.138 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.614 -9.823 -10.911 1.00 0.00 H new ATOM 0 HG LEU A 73 11.024 -10.741 -12.484 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.571 -12.908 -11.406 1.00 0.00 H new ATOM 0 HD12 LEU A 73 12.206 -12.314 -11.034 1.00 0.00 H new ATOM 0 HD13 LEU A 73 10.914 -12.184 -9.817 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.726 -11.320 -11.806 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.997 -10.532 -10.233 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.016 -9.565 -11.727 1.00 0.00 H new ATOM 1230 N GLN A 74 13.121 -8.189 -8.290 1.00 0.00 N ATOM 1231 CA GLN A 74 14.395 -7.901 -7.640 1.00 0.00 C ATOM 1232 C GLN A 74 14.335 -8.236 -6.153 1.00 0.00 C ATOM 1233 O GLN A 74 15.345 -8.175 -5.452 1.00 0.00 O ATOM 1234 CB GLN A 74 14.767 -6.430 -7.829 1.00 0.00 C ATOM 1235 CG GLN A 74 13.699 -5.464 -7.341 1.00 0.00 C ATOM 1236 CD GLN A 74 13.933 -5.008 -5.914 1.00 0.00 C ATOM 1237 OE1 GLN A 74 13.764 -5.778 -4.968 1.00 0.00 O ATOM 1238 NE2 GLN A 74 14.323 -3.749 -5.752 1.00 0.00 N ATOM 0 H GLN A 74 12.587 -7.362 -8.558 1.00 0.00 H new ATOM 0 HA GLN A 74 15.160 -8.524 -8.104 1.00 0.00 H new ATOM 0 HB2 GLN A 74 15.697 -6.228 -7.298 1.00 0.00 H new ATOM 0 HB3 GLN A 74 14.957 -6.245 -8.886 1.00 0.00 H new ATOM 0 HG2 GLN A 74 13.674 -4.594 -7.997 1.00 0.00 H new ATOM 0 HG3 GLN A 74 12.722 -5.943 -7.410 1.00 0.00 H new ATOM 0 HE21 GLN A 74 14.451 -3.146 -6.565 1.00 0.00 H new ATOM 0 HE22 GLN A 74 14.495 -3.385 -4.815 1.00 0.00 H new ATOM 1247 N ARG A 75 13.144 -8.590 -5.679 1.00 0.00 N ATOM 1248 CA ARG A 75 12.953 -8.933 -4.275 1.00 0.00 C ATOM 1249 C ARG A 75 13.156 -10.428 -4.048 1.00 0.00 C ATOM 1250 O ARG A 75 13.967 -10.834 -3.217 1.00 0.00 O ATOM 1251 CB ARG A 75 11.553 -8.522 -3.814 1.00 0.00 C ATOM 1252 CG ARG A 75 11.137 -7.139 -4.289 1.00 0.00 C ATOM 1253 CD ARG A 75 9.739 -6.782 -3.809 1.00 0.00 C ATOM 1254 NE ARG A 75 9.730 -6.371 -2.408 1.00 0.00 N ATOM 1255 CZ ARG A 75 10.143 -5.180 -1.989 1.00 0.00 C ATOM 1256 NH1 ARG A 75 10.596 -4.287 -2.859 1.00 0.00 N ATOM 1257 NH2 ARG A 75 10.104 -4.879 -0.697 1.00 0.00 N ATOM 0 H ARG A 75 12.298 -8.647 -6.246 1.00 0.00 H new ATOM 0 HA ARG A 75 13.695 -8.390 -3.690 1.00 0.00 H new ATOM 0 HB2 ARG A 75 10.831 -9.254 -4.176 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.516 -8.549 -2.725 1.00 0.00 H new ATOM 0 HG2 ARG A 75 11.848 -6.398 -3.924 1.00 0.00 H new ATOM 0 HG3 ARG A 75 11.169 -7.102 -5.378 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.339 -5.977 -4.425 1.00 0.00 H new ATOM 0 HD3 ARG A 75 9.081 -7.641 -3.939 1.00 0.00 H new ATOM 0 HE ARG A 75 9.388 -7.035 -1.713 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.628 -4.514 -3.853 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.912 -3.373 -2.534 1.00 0.00 H new ATOM 0 HH21 ARG A 75 9.757 -5.563 -0.024 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.421 -3.964 -0.377 1.00 0.00 H new ATOM 1271 N GLU A 76 12.412 -11.241 -4.792 1.00 0.00 N ATOM 1272 CA GLU A 76 12.511 -12.690 -4.670 1.00 0.00 C ATOM 1273 C GLU A 76 13.931 -13.166 -4.962 1.00 0.00 C ATOM 1274 O GLU A 76 14.325 -14.263 -4.564 1.00 0.00 O ATOM 1275 CB GLU A 76 11.526 -13.373 -5.622 1.00 0.00 C ATOM 1276 CG GLU A 76 11.984 -13.375 -7.071 1.00 0.00 C ATOM 1277 CD GLU A 76 12.893 -14.545 -7.394 1.00 0.00 C ATOM 1278 OE1 GLU A 76 12.734 -15.612 -6.766 1.00 0.00 O ATOM 1279 OE2 GLU A 76 13.765 -14.393 -8.275 1.00 0.00 O ATOM 0 H GLU A 76 11.735 -10.921 -5.485 1.00 0.00 H new ATOM 0 HA GLU A 76 12.260 -12.960 -3.644 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.373 -14.402 -5.296 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.561 -12.871 -5.555 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.112 -13.407 -7.724 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.508 -12.443 -7.284 1.00 0.00 H new ATOM 1286 N LEU A 77 14.695 -12.334 -5.661 1.00 0.00 N ATOM 1287 CA LEU A 77 16.072 -12.668 -6.008 1.00 0.00 C ATOM 1288 C LEU A 77 16.874 -13.034 -4.763 1.00 0.00 C ATOM 1289 O LEU A 77 17.826 -13.812 -4.832 1.00 0.00 O ATOM 1290 CB LEU A 77 16.736 -11.494 -6.729 1.00 0.00 C ATOM 1291 CG LEU A 77 17.804 -11.858 -7.762 1.00 0.00 C ATOM 1292 CD1 LEU A 77 17.156 -12.304 -9.064 1.00 0.00 C ATOM 1293 CD2 LEU A 77 18.735 -10.679 -8.004 1.00 0.00 C ATOM 0 H LEU A 77 14.384 -11.423 -5.999 1.00 0.00 H new ATOM 0 HA LEU A 77 16.054 -13.532 -6.673 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.960 -10.914 -7.228 1.00 0.00 H new ATOM 0 HB3 LEU A 77 17.189 -10.844 -5.981 1.00 0.00 H new ATOM 0 HG LEU A 77 18.394 -12.687 -7.371 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.931 -12.559 -9.787 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.531 -13.177 -8.879 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.542 -11.496 -9.460 1.00 0.00 H new ATOM 0 HD21 LEU A 77 19.488 -10.956 -8.741 1.00 0.00 H new ATOM 0 HD22 LEU A 77 18.159 -9.831 -8.374 1.00 0.00 H new ATOM 0 HD23 LEU A 77 19.225 -10.405 -7.070 1.00 0.00 H new ATOM 1305 N LEU A 78 16.481 -12.471 -3.626 1.00 0.00 N ATOM 1306 CA LEU A 78 17.161 -12.740 -2.364 1.00 0.00 C ATOM 1307 C LEU A 78 17.055 -14.215 -1.991 1.00 0.00 C ATOM 1308 O LEU A 78 17.808 -14.711 -1.153 1.00 0.00 O ATOM 1309 CB LEU A 78 16.570 -11.876 -1.249 1.00 0.00 C ATOM 1310 CG LEU A 78 17.112 -10.450 -1.145 1.00 0.00 C ATOM 1311 CD1 LEU A 78 16.173 -9.581 -0.323 1.00 0.00 C ATOM 1312 CD2 LEU A 78 18.508 -10.452 -0.539 1.00 0.00 C ATOM 0 H LEU A 78 15.695 -11.825 -3.552 1.00 0.00 H new ATOM 0 HA LEU A 78 18.215 -12.491 -2.488 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.491 -11.823 -1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 78 16.742 -12.379 -0.297 1.00 0.00 H new ATOM 0 HG LEU A 78 17.175 -10.032 -2.150 1.00 0.00 H new ATOM 0 HD11 LEU A 78 16.575 -8.570 -0.260 1.00 0.00 H new ATOM 0 HD12 LEU A 78 15.193 -9.553 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 78 16.077 -9.997 0.680 1.00 0.00 H new ATOM 0 HD21 LEU A 78 18.877 -9.429 -0.473 1.00 0.00 H new ATOM 0 HD22 LEU A 78 18.471 -10.890 0.459 1.00 0.00 H new ATOM 0 HD23 LEU A 78 19.177 -11.039 -1.168 1.00 0.00 H new ATOM 1324 N HIS A 79 16.114 -14.913 -2.621 1.00 0.00 N ATOM 1325 CA HIS A 79 15.911 -16.333 -2.357 1.00 0.00 C ATOM 1326 C HIS A 79 16.882 -17.181 -3.172 1.00 0.00 C ATOM 1327 O HIS A 79 17.211 -18.304 -2.791 1.00 0.00 O ATOM 1328 CB HIS A 79 14.471 -16.732 -2.682 1.00 0.00 C ATOM 1329 CG HIS A 79 14.236 -18.210 -2.642 1.00 0.00 C ATOM 1330 ND1 HIS A 79 13.615 -18.846 -1.587 1.00 0.00 N ATOM 1331 CD2 HIS A 79 14.541 -19.180 -3.536 1.00 0.00 C ATOM 1332 CE1 HIS A 79 13.550 -20.142 -1.834 1.00 0.00 C ATOM 1333 NE2 HIS A 79 14.104 -20.371 -3.010 1.00 0.00 N ATOM 0 H HIS A 79 15.481 -14.518 -3.317 1.00 0.00 H new ATOM 0 HA HIS A 79 16.100 -16.512 -1.299 1.00 0.00 H new ATOM 0 HB2 HIS A 79 13.799 -16.246 -1.974 1.00 0.00 H new ATOM 0 HB3 HIS A 79 14.214 -16.358 -3.673 1.00 0.00 H new ATOM 0 HD2 HIS A 79 15.036 -19.043 -4.486 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.117 -20.888 -1.184 1.00 0.00 H new ATOM 0 HE2 HIS A 79 14.193 -21.284 -3.456 1.00 0.00 H new ATOM 1341 N ALA A 80 17.337 -16.636 -4.296 1.00 0.00 N ATOM 1342 CA ALA A 80 18.272 -17.343 -5.163 1.00 0.00 C ATOM 1343 C ALA A 80 19.655 -17.428 -4.527 1.00 0.00 C ATOM 1344 O ALA A 80 20.498 -18.216 -4.954 1.00 0.00 O ATOM 1345 CB ALA A 80 18.354 -16.658 -6.520 1.00 0.00 C ATOM 0 H ALA A 80 17.073 -15.708 -4.627 1.00 0.00 H new ATOM 0 HA ALA A 80 17.903 -18.359 -5.302 1.00 0.00 H new ATOM 0 HB1 ALA A 80 19.056 -17.196 -7.157 1.00 0.00 H new ATOM 0 HB2 ALA A 80 17.369 -16.655 -6.986 1.00 0.00 H new ATOM 0 HB3 ALA A 80 18.696 -15.631 -6.389 1.00 0.00 H new ATOM 1351 N ALA A 81 19.882 -16.610 -3.504 1.00 0.00 N ATOM 1352 CA ALA A 81 21.162 -16.594 -2.808 1.00 0.00 C ATOM 1353 C ALA A 81 21.159 -17.563 -1.630 1.00 0.00 C ATOM 1354 O ALA A 81 22.038 -18.417 -1.514 1.00 0.00 O ATOM 1355 CB ALA A 81 21.489 -15.186 -2.335 1.00 0.00 C ATOM 0 H ALA A 81 19.195 -15.950 -3.139 1.00 0.00 H new ATOM 0 HA ALA A 81 21.932 -16.917 -3.509 1.00 0.00 H new ATOM 0 HB1 ALA A 81 22.448 -15.190 -1.817 1.00 0.00 H new ATOM 0 HB2 ALA A 81 21.543 -14.517 -3.194 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.710 -14.841 -1.655 1.00 0.00 H new ATOM 1361 N ARG A 82 20.166 -17.424 -0.759 1.00 0.00 N ATOM 1362 CA ARG A 82 20.050 -18.285 0.412 1.00 0.00 C ATOM 1363 C ARG A 82 20.058 -19.756 0.007 1.00 0.00 C ATOM 1364 O ARG A 82 20.419 -20.628 0.799 1.00 0.00 O ATOM 1365 CB ARG A 82 18.768 -17.965 1.183 1.00 0.00 C ATOM 1366 CG ARG A 82 17.525 -17.929 0.309 1.00 0.00 C ATOM 1367 CD ARG A 82 16.841 -19.286 0.257 1.00 0.00 C ATOM 1368 NE ARG A 82 16.195 -19.622 1.523 1.00 0.00 N ATOM 1369 CZ ARG A 82 15.109 -19.010 1.980 1.00 0.00 C ATOM 1370 NH1 ARG A 82 14.549 -18.035 1.277 1.00 0.00 N ATOM 1371 NH2 ARG A 82 14.579 -19.373 3.141 1.00 0.00 N ATOM 0 H ARG A 82 19.430 -16.723 -0.842 1.00 0.00 H new ATOM 0 HA ARG A 82 20.909 -18.097 1.056 1.00 0.00 H new ATOM 0 HB2 ARG A 82 18.630 -18.710 1.966 1.00 0.00 H new ATOM 0 HB3 ARG A 82 18.882 -17.000 1.677 1.00 0.00 H new ATOM 0 HG2 ARG A 82 16.829 -17.184 0.695 1.00 0.00 H new ATOM 0 HG3 ARG A 82 17.797 -17.619 -0.700 1.00 0.00 H new ATOM 0 HD2 ARG A 82 16.098 -19.287 -0.541 1.00 0.00 H new ATOM 0 HD3 ARG A 82 17.575 -20.053 0.010 1.00 0.00 H new ATOM 0 HE ARG A 82 16.601 -20.368 2.088 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.953 -17.754 0.383 1.00 0.00 H new ATOM 0 HH12 ARG A 82 13.715 -17.566 1.630 1.00 0.00 H new ATOM 0 HH21 ARG A 82 15.006 -20.123 3.684 1.00 0.00 H new ATOM 0 HH22 ARG A 82 13.745 -18.902 3.490 1.00 0.00 H new ATOM 1385 N LEU A 83 19.658 -20.026 -1.231 1.00 0.00 N ATOM 1386 CA LEU A 83 19.618 -21.392 -1.742 1.00 0.00 C ATOM 1387 C LEU A 83 20.871 -21.706 -2.554 1.00 0.00 C ATOM 1388 O LEU A 83 21.181 -22.869 -2.809 1.00 0.00 O ATOM 1389 CB LEU A 83 18.372 -21.599 -2.604 1.00 0.00 C ATOM 1390 CG LEU A 83 18.031 -23.048 -2.954 1.00 0.00 C ATOM 1391 CD1 LEU A 83 17.339 -23.731 -1.784 1.00 0.00 C ATOM 1392 CD2 LEU A 83 17.157 -23.104 -4.199 1.00 0.00 C ATOM 0 H LEU A 83 19.357 -19.317 -1.900 1.00 0.00 H new ATOM 0 HA LEU A 83 19.579 -22.071 -0.891 1.00 0.00 H new ATOM 0 HB2 LEU A 83 17.519 -21.161 -2.085 1.00 0.00 H new ATOM 0 HB3 LEU A 83 18.500 -21.043 -3.532 1.00 0.00 H new ATOM 0 HG LEU A 83 18.959 -23.580 -3.161 1.00 0.00 H new ATOM 0 HD11 LEU A 83 17.104 -24.761 -2.051 1.00 0.00 H new ATOM 0 HD12 LEU A 83 17.998 -23.723 -0.916 1.00 0.00 H new ATOM 0 HD13 LEU A 83 16.418 -23.199 -1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 83 16.924 -24.143 -4.434 1.00 0.00 H new ATOM 0 HD22 LEU A 83 16.232 -22.556 -4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 83 17.688 -22.653 -5.037 1.00 0.00 H new ATOM 1404 N ALA A 84 21.587 -20.661 -2.955 1.00 0.00 N ATOM 1405 CA ALA A 84 22.807 -20.826 -3.735 1.00 0.00 C ATOM 1406 C ALA A 84 24.044 -20.711 -2.849 1.00 0.00 C ATOM 1407 O ALA A 84 25.174 -20.822 -3.325 1.00 0.00 O ATOM 1408 CB ALA A 84 22.861 -19.797 -4.855 1.00 0.00 C ATOM 0 H ALA A 84 21.343 -19.691 -2.753 1.00 0.00 H new ATOM 0 HA ALA A 84 22.797 -21.824 -4.173 1.00 0.00 H new ATOM 0 HB1 ALA A 84 23.778 -19.932 -5.429 1.00 0.00 H new ATOM 0 HB2 ALA A 84 22.000 -19.927 -5.510 1.00 0.00 H new ATOM 0 HB3 ALA A 84 22.844 -18.794 -4.429 1.00 0.00 H new ATOM 1414 N LYS A 85 23.822 -20.489 -1.558 1.00 0.00 N ATOM 1415 CA LYS A 85 24.918 -20.360 -0.605 1.00 0.00 C ATOM 1416 C LYS A 85 25.815 -19.180 -0.963 1.00 0.00 C ATOM 1417 O LYS A 85 27.001 -19.169 -0.633 1.00 0.00 O ATOM 1418 CB LYS A 85 25.742 -21.649 -0.567 1.00 0.00 C ATOM 1419 CG LYS A 85 24.928 -22.901 -0.844 1.00 0.00 C ATOM 1420 CD LYS A 85 23.756 -23.028 0.115 1.00 0.00 C ATOM 1421 CE LYS A 85 22.770 -24.088 -0.348 1.00 0.00 C ATOM 1422 NZ LYS A 85 22.355 -24.985 0.766 1.00 0.00 N ATOM 0 H LYS A 85 22.893 -20.395 -1.148 1.00 0.00 H new ATOM 0 HA LYS A 85 24.490 -20.181 0.381 1.00 0.00 H new ATOM 0 HB2 LYS A 85 26.545 -21.578 -1.301 1.00 0.00 H new ATOM 0 HB3 LYS A 85 26.212 -21.741 0.412 1.00 0.00 H new ATOM 0 HG2 LYS A 85 24.559 -22.877 -1.869 1.00 0.00 H new ATOM 0 HG3 LYS A 85 25.568 -23.779 -0.756 1.00 0.00 H new ATOM 0 HD2 LYS A 85 24.124 -23.281 1.109 1.00 0.00 H new ATOM 0 HD3 LYS A 85 23.247 -22.068 0.198 1.00 0.00 H new ATOM 0 HE2 LYS A 85 21.890 -23.605 -0.772 1.00 0.00 H new ATOM 0 HE3 LYS A 85 23.222 -24.681 -1.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 21.683 -25.694 0.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 23.191 -25.466 1.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 21.901 -24.423 1.514 1.00 0.00 H new ATOM 1436 N GLN A 86 25.241 -18.190 -1.639 1.00 0.00 N ATOM 1437 CA GLN A 86 25.991 -17.005 -2.041 1.00 0.00 C ATOM 1438 C GLN A 86 25.192 -15.736 -1.762 1.00 0.00 C ATOM 1439 O GLN A 86 24.092 -15.791 -1.215 1.00 0.00 O ATOM 1440 CB GLN A 86 26.348 -17.082 -3.526 1.00 0.00 C ATOM 1441 CG GLN A 86 26.711 -18.482 -3.993 1.00 0.00 C ATOM 1442 CD GLN A 86 27.840 -18.485 -5.006 1.00 0.00 C ATOM 1443 OE1 GLN A 86 28.946 -18.942 -4.718 1.00 0.00 O ATOM 1444 NE2 GLN A 86 27.565 -17.974 -6.200 1.00 0.00 N ATOM 0 H GLN A 86 24.260 -18.184 -1.920 1.00 0.00 H new ATOM 0 HA GLN A 86 26.910 -16.970 -1.456 1.00 0.00 H new ATOM 0 HB2 GLN A 86 25.504 -16.720 -4.113 1.00 0.00 H new ATOM 0 HB3 GLN A 86 27.185 -16.413 -3.725 1.00 0.00 H new ATOM 0 HG2 GLN A 86 26.999 -19.085 -3.132 1.00 0.00 H new ATOM 0 HG3 GLN A 86 25.832 -18.954 -4.433 1.00 0.00 H new ATOM 0 HE21 GLN A 86 26.634 -17.606 -6.395 1.00 0.00 H new ATOM 0 HE22 GLN A 86 28.285 -17.949 -6.922 1.00 0.00 H new ATOM 1453 N ASN A 87 25.755 -14.594 -2.143 1.00 0.00 N ATOM 1454 CA ASN A 87 25.096 -13.310 -1.933 1.00 0.00 C ATOM 1455 C ASN A 87 23.994 -13.089 -2.965 1.00 0.00 C ATOM 1456 O ASN A 87 24.041 -13.610 -4.080 1.00 0.00 O ATOM 1457 CB ASN A 87 26.115 -12.171 -2.007 1.00 0.00 C ATOM 1458 CG ASN A 87 26.433 -11.590 -0.643 1.00 0.00 C ATOM 1459 OD1 ASN A 87 26.779 -12.317 0.289 1.00 0.00 O ATOM 1460 ND2 ASN A 87 26.316 -10.273 -0.519 1.00 0.00 N ATOM 0 H ASN A 87 26.665 -14.531 -2.599 1.00 0.00 H new ATOM 0 HA ASN A 87 24.644 -13.320 -0.941 1.00 0.00 H new ATOM 0 HB2 ASN A 87 27.033 -12.538 -2.466 1.00 0.00 H new ATOM 0 HB3 ASN A 87 25.729 -11.383 -2.653 1.00 0.00 H new ATOM 0 HD21 ASN A 87 26.516 -9.825 0.375 1.00 0.00 H new ATOM 0 HD22 ASN A 87 26.026 -9.709 -1.318 1.00 0.00 H new ATOM 1467 N PRO A 88 22.979 -12.298 -2.587 1.00 0.00 N ATOM 1468 CA PRO A 88 21.847 -11.989 -3.466 1.00 0.00 C ATOM 1469 C PRO A 88 22.245 -11.088 -4.629 1.00 0.00 C ATOM 1470 O PRO A 88 21.672 -11.170 -5.715 1.00 0.00 O ATOM 1471 CB PRO A 88 20.867 -11.265 -2.539 1.00 0.00 C ATOM 1472 CG PRO A 88 21.720 -10.682 -1.467 1.00 0.00 C ATOM 1473 CD PRO A 88 22.859 -11.644 -1.273 1.00 0.00 C ATOM 0 HA PRO A 88 21.434 -12.885 -3.930 1.00 0.00 H new ATOM 0 HB2 PRO A 88 20.317 -10.490 -3.072 1.00 0.00 H new ATOM 0 HB3 PRO A 88 20.129 -11.954 -2.127 1.00 0.00 H new ATOM 0 HG2 PRO A 88 22.087 -9.696 -1.753 1.00 0.00 H new ATOM 0 HG3 PRO A 88 21.154 -10.556 -0.544 1.00 0.00 H new ATOM 0 HD2 PRO A 88 23.778 -11.128 -0.995 1.00 0.00 H new ATOM 0 HD3 PRO A 88 22.647 -12.365 -0.483 1.00 0.00 H new ATOM 1481 N ALA A 89 23.231 -10.227 -4.395 1.00 0.00 N ATOM 1482 CA ALA A 89 23.707 -9.312 -5.424 1.00 0.00 C ATOM 1483 C ALA A 89 24.889 -9.907 -6.183 1.00 0.00 C ATOM 1484 O ALA A 89 25.181 -9.502 -7.308 1.00 0.00 O ATOM 1485 CB ALA A 89 24.092 -7.977 -4.806 1.00 0.00 C ATOM 0 H ALA A 89 23.715 -10.145 -3.501 1.00 0.00 H new ATOM 0 HA ALA A 89 22.897 -9.150 -6.135 1.00 0.00 H new ATOM 0 HB1 ALA A 89 24.446 -7.303 -5.586 1.00 0.00 H new ATOM 0 HB2 ALA A 89 23.223 -7.539 -4.315 1.00 0.00 H new ATOM 0 HB3 ALA A 89 24.884 -8.130 -4.073 1.00 0.00 H new ATOM 1491 N GLN A 90 25.564 -10.867 -5.560 1.00 0.00 N ATOM 1492 CA GLN A 90 26.715 -11.515 -6.177 1.00 0.00 C ATOM 1493 C GLN A 90 26.312 -12.834 -6.829 1.00 0.00 C ATOM 1494 O GLN A 90 27.088 -13.431 -7.576 1.00 0.00 O ATOM 1495 CB GLN A 90 27.808 -11.761 -5.136 1.00 0.00 C ATOM 1496 CG GLN A 90 28.176 -10.521 -4.337 1.00 0.00 C ATOM 1497 CD GLN A 90 29.568 -10.603 -3.741 1.00 0.00 C ATOM 1498 OE1 GLN A 90 30.537 -10.121 -4.328 1.00 0.00 O ATOM 1499 NE2 GLN A 90 29.674 -11.216 -2.568 1.00 0.00 N ATOM 0 H GLN A 90 25.334 -11.213 -4.629 1.00 0.00 H new ATOM 0 HA GLN A 90 27.102 -10.851 -6.950 1.00 0.00 H new ATOM 0 HB2 GLN A 90 27.476 -12.540 -4.450 1.00 0.00 H new ATOM 0 HB3 GLN A 90 28.699 -12.137 -5.639 1.00 0.00 H new ATOM 0 HG2 GLN A 90 28.112 -9.645 -4.983 1.00 0.00 H new ATOM 0 HG3 GLN A 90 27.450 -10.380 -3.536 1.00 0.00 H new ATOM 0 HE21 GLN A 90 28.844 -11.601 -2.117 1.00 0.00 H new ATOM 0 HE22 GLN A 90 30.585 -11.302 -2.118 1.00 0.00 H new ATOM 1508 N TYR A 91 25.095 -13.282 -6.542 1.00 0.00 N ATOM 1509 CA TYR A 91 24.590 -14.532 -7.099 1.00 0.00 C ATOM 1510 C TYR A 91 24.790 -14.575 -8.611 1.00 0.00 C ATOM 1511 O TYR A 91 25.473 -15.457 -9.133 1.00 0.00 O ATOM 1512 CB TYR A 91 23.107 -14.701 -6.764 1.00 0.00 C ATOM 1513 CG TYR A 91 22.455 -15.866 -7.475 1.00 0.00 C ATOM 1514 CD1 TYR A 91 22.735 -17.175 -7.105 1.00 0.00 C ATOM 1515 CD2 TYR A 91 21.558 -15.656 -8.515 1.00 0.00 C ATOM 1516 CE1 TYR A 91 22.142 -18.242 -7.752 1.00 0.00 C ATOM 1517 CE2 TYR A 91 20.959 -16.717 -9.167 1.00 0.00 C ATOM 1518 CZ TYR A 91 21.255 -18.008 -8.782 1.00 0.00 C ATOM 1519 OH TYR A 91 20.661 -19.068 -9.428 1.00 0.00 O ATOM 0 H TYR A 91 24.440 -12.799 -5.927 1.00 0.00 H new ATOM 0 HA TYR A 91 25.152 -15.353 -6.653 1.00 0.00 H new ATOM 0 HB2 TYR A 91 22.999 -14.836 -5.688 1.00 0.00 H new ATOM 0 HB3 TYR A 91 22.577 -13.785 -7.024 1.00 0.00 H new ATOM 0 HD1 TYR A 91 23.428 -17.362 -6.298 1.00 0.00 H new ATOM 0 HD2 TYR A 91 21.325 -14.646 -8.819 1.00 0.00 H new ATOM 0 HE1 TYR A 91 22.372 -19.254 -7.453 1.00 0.00 H new ATOM 0 HE2 TYR A 91 20.263 -16.536 -9.973 1.00 0.00 H new ATOM 0 HH TYR A 91 20.063 -18.731 -10.127 1.00 0.00 H new ATOM 1529 N LEU A 92 24.190 -13.617 -9.308 1.00 0.00 N ATOM 1530 CA LEU A 92 24.302 -13.543 -10.760 1.00 0.00 C ATOM 1531 C LEU A 92 25.487 -12.676 -11.172 1.00 0.00 C ATOM 1532 O LEU A 92 26.208 -13.000 -12.115 1.00 0.00 O ATOM 1533 CB LEU A 92 23.012 -12.983 -11.363 1.00 0.00 C ATOM 1534 CG LEU A 92 22.683 -13.438 -12.785 1.00 0.00 C ATOM 1535 CD1 LEU A 92 23.776 -13.006 -13.750 1.00 0.00 C ATOM 1536 CD2 LEU A 92 22.494 -14.948 -12.831 1.00 0.00 C ATOM 0 H LEU A 92 23.621 -12.880 -8.891 1.00 0.00 H new ATOM 0 HA LEU A 92 24.465 -14.552 -11.139 1.00 0.00 H new ATOM 0 HB2 LEU A 92 22.181 -13.259 -10.713 1.00 0.00 H new ATOM 0 HB3 LEU A 92 23.074 -11.895 -11.356 1.00 0.00 H new ATOM 0 HG LEU A 92 21.750 -12.965 -13.091 1.00 0.00 H new ATOM 0 HD11 LEU A 92 23.525 -13.339 -14.757 1.00 0.00 H new ATOM 0 HD12 LEU A 92 23.863 -11.920 -13.738 1.00 0.00 H new ATOM 0 HD13 LEU A 92 24.725 -13.450 -13.448 1.00 0.00 H new ATOM 0 HD21 LEU A 92 22.260 -15.255 -13.851 1.00 0.00 H new ATOM 0 HD22 LEU A 92 23.411 -15.440 -12.505 1.00 0.00 H new ATOM 0 HD23 LEU A 92 21.675 -15.233 -12.170 1.00 0.00 H new ATOM 1548 N ALA A 93 25.684 -11.573 -10.457 1.00 0.00 N ATOM 1549 CA ALA A 93 26.784 -10.661 -10.745 1.00 0.00 C ATOM 1550 C ALA A 93 28.112 -11.408 -10.813 1.00 0.00 C ATOM 1551 O ALA A 93 28.871 -11.256 -11.770 1.00 0.00 O ATOM 1552 CB ALA A 93 26.847 -9.562 -9.695 1.00 0.00 C ATOM 0 H ALA A 93 25.096 -11.289 -9.674 1.00 0.00 H new ATOM 0 HA ALA A 93 26.602 -10.207 -11.719 1.00 0.00 H new ATOM 0 HB1 ALA A 93 27.673 -8.888 -9.923 1.00 0.00 H new ATOM 0 HB2 ALA A 93 25.911 -9.003 -9.697 1.00 0.00 H new ATOM 0 HB3 ALA A 93 27.002 -10.007 -8.712 1.00 0.00 H new ATOM 1558 N GLN A 94 28.386 -12.214 -9.792 1.00 0.00 N ATOM 1559 CA GLN A 94 29.623 -12.982 -9.737 1.00 0.00 C ATOM 1560 C GLN A 94 30.837 -12.059 -9.722 1.00 0.00 C ATOM 1561 O GLN A 94 31.923 -12.437 -10.165 1.00 0.00 O ATOM 1562 CB GLN A 94 29.709 -13.938 -10.928 1.00 0.00 C ATOM 1563 CG GLN A 94 28.513 -14.869 -11.048 1.00 0.00 C ATOM 1564 CD GLN A 94 28.653 -16.112 -10.191 1.00 0.00 C ATOM 1565 OE1 GLN A 94 28.946 -17.197 -10.694 1.00 0.00 O ATOM 1566 NE2 GLN A 94 28.445 -15.960 -8.889 1.00 0.00 N ATOM 0 H GLN A 94 27.768 -12.352 -8.992 1.00 0.00 H new ATOM 0 HA GLN A 94 29.619 -13.562 -8.814 1.00 0.00 H new ATOM 0 HB2 GLN A 94 29.799 -13.356 -11.845 1.00 0.00 H new ATOM 0 HB3 GLN A 94 30.616 -14.535 -10.839 1.00 0.00 H new ATOM 0 HG2 GLN A 94 27.609 -14.333 -10.759 1.00 0.00 H new ATOM 0 HG3 GLN A 94 28.389 -15.163 -12.090 1.00 0.00 H new ATOM 0 HE21 GLN A 94 28.204 -15.042 -8.515 1.00 0.00 H new ATOM 0 HE22 GLN A 94 28.526 -16.761 -8.263 1.00 0.00 H new ATOM 1575 N HIS A 95 30.647 -10.847 -9.211 1.00 0.00 N ATOM 1576 CA HIS A 95 31.727 -9.870 -9.138 1.00 0.00 C ATOM 1577 C HIS A 95 31.574 -8.982 -7.907 1.00 0.00 C ATOM 1578 O HIS A 95 30.466 -8.769 -7.418 1.00 0.00 O ATOM 1579 CB HIS A 95 31.751 -9.010 -10.402 1.00 0.00 C ATOM 1580 CG HIS A 95 33.093 -8.413 -10.695 1.00 0.00 C ATOM 1581 ND1 HIS A 95 34.276 -9.096 -10.514 1.00 0.00 N ATOM 1582 CD2 HIS A 95 33.434 -7.189 -11.162 1.00 0.00 C ATOM 1583 CE1 HIS A 95 35.288 -8.318 -10.854 1.00 0.00 C ATOM 1584 NE2 HIS A 95 34.804 -7.155 -11.252 1.00 0.00 N ATOM 0 H HIS A 95 29.755 -10.518 -8.841 1.00 0.00 H new ATOM 0 HA HIS A 95 32.669 -10.412 -9.058 1.00 0.00 H new ATOM 0 HB2 HIS A 95 31.440 -9.618 -11.251 1.00 0.00 H new ATOM 0 HB3 HIS A 95 31.020 -8.208 -10.300 1.00 0.00 H new ATOM 0 HD2 HIS A 95 32.755 -6.388 -11.416 1.00 0.00 H new ATOM 0 HE1 HIS A 95 36.333 -8.587 -10.813 1.00 0.00 H new ATOM 0 HE2 HIS A 95 35.358 -6.361 -11.574 1.00 0.00 H new ATOM 1592 N GLU A 96 32.696 -8.467 -7.411 1.00 0.00 N ATOM 1593 CA GLU A 96 32.685 -7.604 -6.236 1.00 0.00 C ATOM 1594 C GLU A 96 32.326 -6.170 -6.618 1.00 0.00 C ATOM 1595 O GLU A 96 31.501 -5.532 -5.964 1.00 0.00 O ATOM 1596 CB GLU A 96 34.049 -7.632 -5.543 1.00 0.00 C ATOM 1597 CG GLU A 96 34.143 -6.699 -4.347 1.00 0.00 C ATOM 1598 CD GLU A 96 35.443 -6.859 -3.584 1.00 0.00 C ATOM 1599 OE1 GLU A 96 35.808 -8.010 -3.266 1.00 0.00 O ATOM 1600 OE2 GLU A 96 36.097 -5.832 -3.305 1.00 0.00 O ATOM 0 H GLU A 96 33.622 -8.633 -7.805 1.00 0.00 H new ATOM 0 HA GLU A 96 31.928 -7.979 -5.548 1.00 0.00 H new ATOM 0 HB2 GLU A 96 34.260 -8.650 -5.216 1.00 0.00 H new ATOM 0 HB3 GLU A 96 34.820 -7.362 -6.265 1.00 0.00 H new ATOM 0 HG2 GLU A 96 34.050 -5.668 -4.687 1.00 0.00 H new ATOM 0 HG3 GLU A 96 33.306 -6.890 -3.675 1.00 0.00 H new ATOM 1607 N GLN A 97 32.952 -5.672 -7.679 1.00 0.00 N ATOM 1608 CA GLN A 97 32.700 -4.314 -8.146 1.00 0.00 C ATOM 1609 C GLN A 97 31.235 -4.134 -8.531 1.00 0.00 C ATOM 1610 O GLN A 97 30.700 -3.026 -8.479 1.00 0.00 O ATOM 1611 CB GLN A 97 33.597 -3.989 -9.342 1.00 0.00 C ATOM 1612 CG GLN A 97 34.942 -3.399 -8.951 1.00 0.00 C ATOM 1613 CD GLN A 97 34.815 -2.027 -8.318 1.00 0.00 C ATOM 1614 OE1 GLN A 97 35.130 -1.841 -7.142 1.00 0.00 O ATOM 1615 NE2 GLN A 97 34.353 -1.056 -9.097 1.00 0.00 N ATOM 0 H GLN A 97 33.637 -6.188 -8.231 1.00 0.00 H new ATOM 0 HA GLN A 97 32.930 -3.628 -7.331 1.00 0.00 H new ATOM 0 HB2 GLN A 97 33.763 -4.899 -9.919 1.00 0.00 H new ATOM 0 HB3 GLN A 97 33.078 -3.287 -9.995 1.00 0.00 H new ATOM 0 HG2 GLN A 97 35.441 -4.072 -8.254 1.00 0.00 H new ATOM 0 HG3 GLN A 97 35.575 -3.330 -9.836 1.00 0.00 H new ATOM 0 HE21 GLN A 97 34.104 -1.254 -10.066 1.00 0.00 H new ATOM 0 HE22 GLN A 97 34.247 -0.112 -8.726 1.00 0.00 H new ATOM 1624 N LEU A 98 30.591 -5.230 -8.917 1.00 0.00 N ATOM 1625 CA LEU A 98 29.187 -5.194 -9.311 1.00 0.00 C ATOM 1626 C LEU A 98 28.293 -5.717 -8.191 1.00 0.00 C ATOM 1627 O LEU A 98 27.307 -6.410 -8.442 1.00 0.00 O ATOM 1628 CB LEU A 98 28.971 -6.021 -10.580 1.00 0.00 C ATOM 1629 CG LEU A 98 27.737 -5.666 -11.410 1.00 0.00 C ATOM 1630 CD1 LEU A 98 27.943 -4.343 -12.133 1.00 0.00 C ATOM 1631 CD2 LEU A 98 27.426 -6.776 -12.404 1.00 0.00 C ATOM 0 H LEU A 98 31.019 -6.155 -8.966 1.00 0.00 H new ATOM 0 HA LEU A 98 28.918 -4.157 -9.511 1.00 0.00 H new ATOM 0 HB2 LEU A 98 29.852 -5.916 -11.213 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.905 -7.072 -10.298 1.00 0.00 H new ATOM 0 HG LEU A 98 26.887 -5.560 -10.736 1.00 0.00 H new ATOM 0 HD11 LEU A 98 27.055 -4.106 -12.719 1.00 0.00 H new ATOM 0 HD12 LEU A 98 28.117 -3.553 -11.403 1.00 0.00 H new ATOM 0 HD13 LEU A 98 28.805 -4.421 -12.796 1.00 0.00 H new ATOM 0 HD21 LEU A 98 26.545 -6.507 -12.986 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.275 -6.913 -13.073 1.00 0.00 H new ATOM 0 HD23 LEU A 98 27.235 -7.704 -11.865 1.00 0.00 H new ATOM 1643 N LEU A 99 28.644 -5.379 -6.955 1.00 0.00 N ATOM 1644 CA LEU A 99 27.872 -5.813 -5.795 1.00 0.00 C ATOM 1645 C LEU A 99 26.817 -4.776 -5.424 1.00 0.00 C ATOM 1646 O LEU A 99 25.626 -5.081 -5.362 1.00 0.00 O ATOM 1647 CB LEU A 99 28.800 -6.062 -4.605 1.00 0.00 C ATOM 1648 CG LEU A 99 28.203 -6.858 -3.444 1.00 0.00 C ATOM 1649 CD1 LEU A 99 29.306 -7.475 -2.597 1.00 0.00 C ATOM 1650 CD2 LEU A 99 27.308 -5.970 -2.593 1.00 0.00 C ATOM 0 H LEU A 99 29.457 -4.806 -6.730 1.00 0.00 H new ATOM 0 HA LEU A 99 27.365 -6.743 -6.054 1.00 0.00 H new ATOM 0 HB2 LEU A 99 29.685 -6.589 -4.963 1.00 0.00 H new ATOM 0 HB3 LEU A 99 29.136 -5.098 -4.224 1.00 0.00 H new ATOM 0 HG LEU A 99 27.595 -7.664 -3.856 1.00 0.00 H new ATOM 0 HD11 LEU A 99 28.862 -8.038 -1.776 1.00 0.00 H new ATOM 0 HD12 LEU A 99 29.906 -8.145 -3.213 1.00 0.00 H new ATOM 0 HD13 LEU A 99 29.941 -6.685 -2.195 1.00 0.00 H new ATOM 0 HD21 LEU A 99 26.892 -6.553 -1.772 1.00 0.00 H new ATOM 0 HD22 LEU A 99 27.893 -5.143 -2.191 1.00 0.00 H new ATOM 0 HD23 LEU A 99 26.497 -5.577 -3.206 1.00 0.00 H new ATOM 1662 N LEU A 100 27.263 -3.548 -5.180 1.00 0.00 N ATOM 1663 CA LEU A 100 26.357 -2.464 -4.817 1.00 0.00 C ATOM 1664 C LEU A 100 25.824 -1.760 -6.061 1.00 0.00 C ATOM 1665 O LEU A 100 26.279 -0.672 -6.414 1.00 0.00 O ATOM 1666 CB LEU A 100 27.071 -1.457 -3.914 1.00 0.00 C ATOM 1667 CG LEU A 100 27.317 -1.904 -2.473 1.00 0.00 C ATOM 1668 CD1 LEU A 100 28.324 -0.989 -1.794 1.00 0.00 C ATOM 1669 CD2 LEU A 100 26.010 -1.934 -1.693 1.00 0.00 C ATOM 0 H LEU A 100 28.246 -3.279 -5.227 1.00 0.00 H new ATOM 0 HA LEU A 100 25.514 -2.894 -4.276 1.00 0.00 H new ATOM 0 HB2 LEU A 100 28.032 -1.212 -4.366 1.00 0.00 H new ATOM 0 HB3 LEU A 100 26.485 -0.538 -3.893 1.00 0.00 H new ATOM 0 HG LEU A 100 27.729 -2.913 -2.492 1.00 0.00 H new ATOM 0 HD11 LEU A 100 28.486 -1.323 -0.769 1.00 0.00 H new ATOM 0 HD12 LEU A 100 29.268 -1.019 -2.339 1.00 0.00 H new ATOM 0 HD13 LEU A 100 27.941 0.032 -1.787 1.00 0.00 H new ATOM 0 HD21 LEU A 100 26.204 -2.254 -0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 100 25.569 -0.937 -1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 100 25.320 -2.632 -2.167 1.00 0.00 H new ATOM 1681 N ASP A 101 24.856 -2.387 -6.721 1.00 0.00 N ATOM 1682 CA ASP A 101 24.259 -1.820 -7.924 1.00 0.00 C ATOM 1683 C ASP A 101 23.010 -1.013 -7.582 1.00 0.00 C ATOM 1684 O ASP A 101 21.966 -1.168 -8.214 1.00 0.00 O ATOM 1685 CB ASP A 101 23.908 -2.929 -8.917 1.00 0.00 C ATOM 1686 CG ASP A 101 23.651 -2.396 -10.313 1.00 0.00 C ATOM 1687 OD1 ASP A 101 24.633 -2.086 -11.020 1.00 0.00 O ATOM 1688 OD2 ASP A 101 22.469 -2.290 -10.698 1.00 0.00 O ATOM 0 H ASP A 101 24.468 -3.288 -6.443 1.00 0.00 H new ATOM 0 HA ASP A 101 24.989 -1.151 -8.381 1.00 0.00 H new ATOM 0 HB2 ASP A 101 24.722 -3.653 -8.952 1.00 0.00 H new ATOM 0 HB3 ASP A 101 23.024 -3.461 -8.566 1.00 0.00 H new ATOM 1693 N ALA A 102 23.125 -0.152 -6.576 1.00 0.00 N ATOM 1694 CA ALA A 102 22.006 0.679 -6.150 1.00 0.00 C ATOM 1695 C ALA A 102 21.475 1.519 -7.307 1.00 0.00 C ATOM 1696 O ALA A 102 22.230 1.924 -8.191 1.00 0.00 O ATOM 1697 CB ALA A 102 22.423 1.575 -4.993 1.00 0.00 C ATOM 0 H ALA A 102 23.982 -0.012 -6.041 1.00 0.00 H new ATOM 0 HA ALA A 102 21.204 0.021 -5.814 1.00 0.00 H new ATOM 0 HB1 ALA A 102 21.577 2.190 -4.686 1.00 0.00 H new ATOM 0 HB2 ALA A 102 22.748 0.959 -4.154 1.00 0.00 H new ATOM 0 HB3 ALA A 102 23.244 2.219 -5.309 1.00 0.00 H new ATOM 1703 N SER A 103 20.171 1.778 -7.295 1.00 0.00 N ATOM 1704 CA SER A 103 19.538 2.566 -8.346 1.00 0.00 C ATOM 1705 C SER A 103 18.815 3.774 -7.758 1.00 0.00 C ATOM 1706 O SER A 103 18.443 3.777 -6.586 1.00 0.00 O ATOM 1707 CB SER A 103 18.554 1.703 -9.138 1.00 0.00 C ATOM 1708 OG SER A 103 19.232 0.694 -9.866 1.00 0.00 O ATOM 0 H SER A 103 19.532 1.453 -6.569 1.00 0.00 H new ATOM 0 HA SER A 103 20.318 2.923 -9.018 1.00 0.00 H new ATOM 0 HB2 SER A 103 17.837 1.245 -8.457 1.00 0.00 H new ATOM 0 HB3 SER A 103 17.985 2.331 -9.824 1.00 0.00 H new ATOM 0 HG SER A 103 18.581 0.155 -10.362 1.00 0.00 H new TER 1714 SER A 103