USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 973 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 72 GLN : amide:sc= -0.625 K(o=-0.6,f=-2.1!) USER MOD Set 1.2: A 150 TYR OH : rot 101:sc= 0.0286 USER MOD Set 2.1: A 66 TYR OH : rot 174:sc= 0.274 USER MOD Set 2.2: A 122 LYS NZ :NH3+ -108:sc= 0.274 (180deg=-0.324) USER MOD Set 3.1: A 83 TYR OH : rot 14:sc= 0.717 USER MOD Set 3.2: A 99 ASN : amide:sc= -0.165 X(o=0.55,f=0.29) USER MOD Set 3.3: A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 96 THR OG1 : rot -109:sc= 0.428 USER MOD Set 4.2: A 114 HIS : no HD1:sc= 0.39 K(o=0.82,f=-0.55) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 155:sc= -0.104 (180deg=-0.516) USER MOD Single : A 51 THR OG1 : rot -75:sc= 0.0485 USER MOD Single : A 52 CYS SG : rot -170:sc= -0.798 USER MOD Single : A 55 SER OG : rot -98:sc= 0.957 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.031 K(o=-0.031,f=-1.1) USER MOD Single : A 60 THR OG1 : rot 170:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.115 X(o=-0.12,f=-0.0046) USER MOD Single : A 63 TYR OH : rot 180:sc= -0.0373 USER MOD Single : A 67 ASN : amide:sc= -8.18! C(o=-8.2!,f=-5.4!) USER MOD Single : A 68 CYS SG : rot -146:sc= 0.754 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.343 K(o=-0.34,f=-2.6!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.997 K(o=-1,f=-2.8!) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 79 ASN : amide:sc=-0.00822 K(o=-0.0082,f=-0.55) USER MOD Single : A 80 ASN : amide:sc= -1.77! C(o=-1.8!,f=-2.9!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -0.732 K(o=-0.73,f=-3.6!) USER MOD Single : A 89 GLN : amide:sc= -0.0318 K(o=-0.032,f=-1.5!) USER MOD Single : A 91 SER OG : rot -41:sc= 0.315 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 97 CYS SG : rot 119:sc= 0.506 USER MOD Single : A 109 GLN : amide:sc= -0.343 K(o=-0.34,f=-0.85) USER MOD Single : A 110 SER OG : rot 27:sc= 0.408 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc=-0.00551 X(o=-0.0055,f=-0.0055) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ -127:sc= 0.0337 (180deg=0) USER MOD Single : A 133 THR OG1 : rot -63:sc= 0.792 USER MOD Single : A 134 LYS NZ :NH3+ 156:sc= -0.0787 (180deg=-0.453) USER MOD Single : A 135 ASN : amide:sc= 1.05 K(o=1,f=-0.26) USER MOD Single : A 136 ASN : amide:sc= -0.0429 X(o=-0.043,f=-0.11) USER MOD Single : A 142 HIS : no HE2:sc= -7.99! C(o=-8!,f=-7.1!) USER MOD Single : A 145 SER OG : rot 4:sc= 1 USER MOD Single : A 146 HIS : no HD1:sc=-0.00111 X(o=-0.0011,f=0) USER MOD Single : A 149 LYS NZ :NH3+ -175:sc= 0.502 (180deg=0.492) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.0163 USER MOD Single : A 156 GLN : amide:sc= -0.137 K(o=-0.14,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 34 -25.060 5.828 -17.508 1.00 0.00 N ATOM 2 CA GLY A 34 -23.653 5.479 -17.557 1.00 0.00 C ATOM 3 C GLY A 34 -23.215 5.028 -18.937 1.00 0.00 C ATOM 4 O GLY A 34 -23.247 3.838 -19.248 1.00 0.00 O ATOM 0 HA2 GLY A 34 -23.057 6.340 -17.254 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -23.454 4.684 -16.838 1.00 0.00 H new ATOM 8 N SER A 35 -22.807 5.983 -19.767 1.00 0.00 N ATOM 9 CA SER A 35 -22.367 5.679 -21.124 1.00 0.00 C ATOM 10 C SER A 35 -21.822 6.927 -21.811 1.00 0.00 C ATOM 11 O SER A 35 -21.778 8.006 -21.219 1.00 0.00 O ATOM 12 CB SER A 35 -23.523 5.097 -21.940 1.00 0.00 C ATOM 13 OG SER A 35 -24.500 6.086 -22.217 1.00 0.00 O ATOM 0 H SER A 35 -22.772 6.973 -19.524 1.00 0.00 H new ATOM 0 HA SER A 35 -21.567 4.941 -21.063 1.00 0.00 H new ATOM 0 HB2 SER A 35 -23.142 4.686 -22.875 1.00 0.00 H new ATOM 0 HB3 SER A 35 -23.980 4.273 -21.392 1.00 0.00 H new ATOM 0 HG SER A 35 -25.227 5.690 -22.741 1.00 0.00 H new ATOM 19 N SER A 36 -21.407 6.772 -23.064 1.00 0.00 N ATOM 20 CA SER A 36 -20.861 7.885 -23.832 1.00 0.00 C ATOM 21 C SER A 36 -19.588 8.420 -23.182 1.00 0.00 C ATOM 22 O SER A 36 -19.474 8.465 -21.958 1.00 0.00 O ATOM 23 CB SER A 36 -21.895 9.005 -23.952 1.00 0.00 C ATOM 24 OG SER A 36 -22.702 8.833 -25.104 1.00 0.00 O ATOM 0 H SER A 36 -21.438 5.886 -23.569 1.00 0.00 H new ATOM 0 HA SER A 36 -20.614 7.520 -24.829 1.00 0.00 H new ATOM 0 HB2 SER A 36 -22.524 9.020 -23.062 1.00 0.00 H new ATOM 0 HB3 SER A 36 -21.388 9.969 -24.000 1.00 0.00 H new ATOM 0 HG SER A 36 -23.356 9.561 -25.157 1.00 0.00 H new ATOM 30 N GLY A 37 -18.633 8.826 -24.013 1.00 0.00 N ATOM 31 CA GLY A 37 -17.380 9.353 -23.503 1.00 0.00 C ATOM 32 C GLY A 37 -17.581 10.552 -22.599 1.00 0.00 C ATOM 33 O GLY A 37 -18.632 11.193 -22.631 1.00 0.00 O ATOM 0 H GLY A 37 -18.704 8.800 -25.030 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -16.857 8.571 -22.953 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -16.741 9.636 -24.340 1.00 0.00 H new ATOM 37 N SER A 38 -16.573 10.857 -21.789 1.00 0.00 N ATOM 38 CA SER A 38 -16.646 11.985 -20.867 1.00 0.00 C ATOM 39 C SER A 38 -15.335 12.147 -20.103 1.00 0.00 C ATOM 40 O SER A 38 -14.711 11.165 -19.703 1.00 0.00 O ATOM 41 CB SER A 38 -17.802 11.793 -19.884 1.00 0.00 C ATOM 42 OG SER A 38 -17.987 12.947 -19.083 1.00 0.00 O ATOM 0 H SER A 38 -15.695 10.339 -21.752 1.00 0.00 H new ATOM 0 HA SER A 38 -16.821 12.889 -21.450 1.00 0.00 H new ATOM 0 HB2 SER A 38 -18.718 11.577 -20.433 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.602 10.932 -19.246 1.00 0.00 H new ATOM 0 HG SER A 38 -18.733 12.800 -18.464 1.00 0.00 H new ATOM 48 N SER A 39 -14.925 13.396 -19.905 1.00 0.00 N ATOM 49 CA SER A 39 -13.687 13.689 -19.192 1.00 0.00 C ATOM 50 C SER A 39 -12.515 12.927 -19.803 1.00 0.00 C ATOM 51 O SER A 39 -12.331 11.738 -19.544 1.00 0.00 O ATOM 52 CB SER A 39 -13.828 13.330 -17.712 1.00 0.00 C ATOM 53 OG SER A 39 -12.591 13.463 -17.034 1.00 0.00 O ATOM 0 H SER A 39 -15.431 14.220 -20.228 1.00 0.00 H new ATOM 0 HA SER A 39 -13.490 14.757 -19.281 1.00 0.00 H new ATOM 0 HB2 SER A 39 -14.572 13.977 -17.247 1.00 0.00 H new ATOM 0 HB3 SER A 39 -14.191 12.307 -17.616 1.00 0.00 H new ATOM 0 HG SER A 39 -12.709 13.229 -16.090 1.00 0.00 H new ATOM 59 N GLY A 40 -11.724 13.621 -20.615 1.00 0.00 N ATOM 60 CA GLY A 40 -10.580 12.995 -21.251 1.00 0.00 C ATOM 61 C GLY A 40 -9.567 12.483 -20.246 1.00 0.00 C ATOM 62 O GLY A 40 -9.798 11.474 -19.580 1.00 0.00 O ATOM 0 H GLY A 40 -11.855 14.606 -20.844 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.921 12.167 -21.872 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -10.098 13.714 -21.914 1.00 0.00 H new ATOM 66 N ALA A 41 -8.440 13.179 -20.137 1.00 0.00 N ATOM 67 CA ALA A 41 -7.388 12.789 -19.206 1.00 0.00 C ATOM 68 C ALA A 41 -6.997 11.328 -19.400 1.00 0.00 C ATOM 69 O ALA A 41 -7.625 10.606 -20.173 1.00 0.00 O ATOM 70 CB ALA A 41 -7.835 13.032 -17.772 1.00 0.00 C ATOM 0 H ALA A 41 -8.232 14.016 -20.682 1.00 0.00 H new ATOM 0 HA ALA A 41 -6.511 13.403 -19.410 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -7.040 12.736 -17.088 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -8.057 14.090 -17.634 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -8.729 12.444 -17.565 1.00 0.00 H new ATOM 76 N GLU A 42 -5.955 10.901 -18.694 1.00 0.00 N ATOM 77 CA GLU A 42 -5.480 9.525 -18.791 1.00 0.00 C ATOM 78 C GLU A 42 -5.779 8.755 -17.508 1.00 0.00 C ATOM 79 O GLU A 42 -5.191 9.020 -16.459 1.00 0.00 O ATOM 80 CB GLU A 42 -3.977 9.500 -19.075 1.00 0.00 C ATOM 81 CG GLU A 42 -3.495 8.195 -19.687 1.00 0.00 C ATOM 82 CD GLU A 42 -2.190 8.352 -20.443 1.00 0.00 C ATOM 83 OE1 GLU A 42 -1.992 9.412 -21.072 1.00 0.00 O ATOM 84 OE2 GLU A 42 -1.367 7.414 -20.405 1.00 0.00 O ATOM 0 H GLU A 42 -5.424 11.487 -18.049 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.006 9.043 -19.615 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.729 10.321 -19.748 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -3.437 9.677 -18.145 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.367 7.454 -18.898 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.259 7.811 -20.364 1.00 0.00 H new ATOM 91 N LYS A 43 -6.698 7.799 -17.599 1.00 0.00 N ATOM 92 CA LYS A 43 -7.076 6.988 -16.448 1.00 0.00 C ATOM 93 C LYS A 43 -5.906 6.128 -15.981 1.00 0.00 C ATOM 94 O LYS A 43 -5.417 5.274 -16.720 1.00 0.00 O ATOM 95 CB LYS A 43 -8.271 6.098 -16.796 1.00 0.00 C ATOM 96 CG LYS A 43 -9.579 6.858 -16.924 1.00 0.00 C ATOM 97 CD LYS A 43 -10.777 5.930 -16.815 1.00 0.00 C ATOM 98 CE LYS A 43 -11.211 5.748 -15.369 1.00 0.00 C ATOM 99 NZ LYS A 43 -11.730 7.014 -14.782 1.00 0.00 N ATOM 0 H LYS A 43 -7.195 7.567 -18.459 1.00 0.00 H new ATOM 0 HA LYS A 43 -7.356 7.660 -15.637 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.067 5.581 -17.734 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.379 5.333 -16.028 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.636 7.620 -16.146 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.606 7.378 -17.882 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.606 6.334 -17.397 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -10.528 4.960 -17.246 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.982 4.980 -15.315 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -10.366 5.393 -14.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.382 6.793 -14.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -10.936 7.580 -14.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -12.235 7.554 -15.513 1.00 0.00 H new ATOM 113 N ARG A 44 -5.464 6.358 -14.749 1.00 0.00 N ATOM 114 CA ARG A 44 -4.352 5.603 -14.183 1.00 0.00 C ATOM 115 C ARG A 44 -4.836 4.284 -13.589 1.00 0.00 C ATOM 116 O ARG A 44 -5.964 4.188 -13.103 1.00 0.00 O ATOM 117 CB ARG A 44 -3.641 6.429 -13.109 1.00 0.00 C ATOM 118 CG ARG A 44 -2.160 6.114 -12.979 1.00 0.00 C ATOM 119 CD ARG A 44 -1.915 4.987 -11.988 1.00 0.00 C ATOM 120 NE ARG A 44 -0.702 4.237 -12.302 1.00 0.00 N ATOM 121 CZ ARG A 44 0.508 4.585 -11.877 1.00 0.00 C ATOM 122 NH1 ARG A 44 0.664 5.666 -11.125 1.00 0.00 N ATOM 123 NH2 ARG A 44 1.564 3.852 -12.204 1.00 0.00 N ATOM 0 H ARG A 44 -5.859 7.061 -14.124 1.00 0.00 H new ATOM 0 HA ARG A 44 -3.649 5.383 -14.986 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -3.760 7.488 -13.339 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.126 6.255 -12.149 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -1.759 5.836 -13.954 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -1.624 7.007 -12.656 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -1.836 5.399 -10.982 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -2.770 4.311 -11.989 1.00 0.00 H new ATOM 0 HE ARG A 44 -0.788 3.400 -12.879 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -0.146 6.232 -10.872 1.00 0.00 H new ATOM 0 HH12 ARG A 44 1.594 5.931 -10.800 1.00 0.00 H new ATOM 0 HH21 ARG A 44 1.448 3.020 -12.782 1.00 0.00 H new ATOM 0 HH22 ARG A 44 2.492 4.120 -11.877 1.00 0.00 H new ATOM 137 N ILE A 45 -3.978 3.271 -13.632 1.00 0.00 N ATOM 138 CA ILE A 45 -4.319 1.959 -13.097 1.00 0.00 C ATOM 139 C ILE A 45 -3.384 1.570 -11.956 1.00 0.00 C ATOM 140 O ILE A 45 -2.181 1.828 -12.011 1.00 0.00 O ATOM 141 CB ILE A 45 -4.258 0.873 -14.188 1.00 0.00 C ATOM 142 CG1 ILE A 45 -5.144 1.261 -15.373 1.00 0.00 C ATOM 143 CG2 ILE A 45 -4.682 -0.473 -13.620 1.00 0.00 C ATOM 144 CD1 ILE A 45 -6.612 1.358 -15.024 1.00 0.00 C ATOM 0 H ILE A 45 -3.042 3.333 -14.032 1.00 0.00 H new ATOM 0 HA ILE A 45 -5.339 2.028 -12.720 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.230 0.788 -14.540 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.809 2.220 -15.768 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -5.016 0.526 -16.168 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.634 -1.230 -14.403 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.014 -0.751 -12.805 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -5.703 -0.404 -13.245 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -7.179 1.637 -15.912 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.963 0.394 -14.657 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -6.753 2.114 -14.251 1.00 0.00 H new ATOM 156 N ILE A 46 -3.945 0.948 -10.925 1.00 0.00 N ATOM 157 CA ILE A 46 -3.161 0.521 -9.773 1.00 0.00 C ATOM 158 C ILE A 46 -3.226 -0.992 -9.593 1.00 0.00 C ATOM 159 O ILE A 46 -4.239 -1.621 -9.902 1.00 0.00 O ATOM 160 CB ILE A 46 -3.645 1.202 -8.479 1.00 0.00 C ATOM 161 CG1 ILE A 46 -3.704 2.719 -8.666 1.00 0.00 C ATOM 162 CG2 ILE A 46 -2.731 0.842 -7.317 1.00 0.00 C ATOM 163 CD1 ILE A 46 -2.385 3.328 -9.087 1.00 0.00 C ATOM 0 H ILE A 46 -4.939 0.729 -10.864 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.130 0.817 -9.966 1.00 0.00 H new ATOM 0 HB ILE A 46 -4.649 0.843 -8.251 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -4.460 2.955 -9.415 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.026 3.180 -7.732 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.086 1.331 -6.410 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.735 -0.238 -7.172 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.716 1.175 -7.535 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.502 4.406 -9.201 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.631 3.123 -8.328 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.071 2.895 -10.037 1.00 0.00 H new ATOM 175 N ARG A 47 -2.141 -1.570 -9.089 1.00 0.00 N ATOM 176 CA ARG A 47 -2.075 -3.009 -8.868 1.00 0.00 C ATOM 177 C ARG A 47 -1.695 -3.320 -7.423 1.00 0.00 C ATOM 178 O ARG A 47 -0.625 -2.931 -6.954 1.00 0.00 O ATOM 179 CB ARG A 47 -1.063 -3.648 -9.821 1.00 0.00 C ATOM 180 CG ARG A 47 -1.369 -3.399 -11.289 1.00 0.00 C ATOM 181 CD ARG A 47 -2.564 -4.215 -11.756 1.00 0.00 C ATOM 182 NE ARG A 47 -2.167 -5.527 -12.260 1.00 0.00 N ATOM 183 CZ ARG A 47 -3.004 -6.551 -12.382 1.00 0.00 C ATOM 184 NH1 ARG A 47 -4.278 -6.416 -12.038 1.00 0.00 N ATOM 185 NH2 ARG A 47 -2.568 -7.714 -12.849 1.00 0.00 N ATOM 0 H ARG A 47 -1.296 -1.064 -8.826 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.062 -3.427 -9.065 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.069 -3.262 -9.595 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.036 -4.723 -9.641 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.568 -2.339 -11.445 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.497 -3.652 -11.891 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.263 -4.341 -10.929 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.091 -3.670 -12.539 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.194 -5.664 -12.533 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.617 -5.524 -11.679 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -4.918 -7.204 -12.133 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.589 -7.822 -13.115 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -3.212 -8.500 -12.942 1.00 0.00 H new ATOM 199 N VAL A 48 -2.579 -4.023 -6.722 1.00 0.00 N ATOM 200 CA VAL A 48 -2.336 -4.386 -5.331 1.00 0.00 C ATOM 201 C VAL A 48 -0.948 -4.992 -5.155 1.00 0.00 C ATOM 202 O VAL A 48 -0.607 -5.986 -5.796 1.00 0.00 O ATOM 203 CB VAL A 48 -3.389 -5.388 -4.820 1.00 0.00 C ATOM 204 CG1 VAL A 48 -3.098 -5.782 -3.380 1.00 0.00 C ATOM 205 CG2 VAL A 48 -4.787 -4.802 -4.949 1.00 0.00 C ATOM 0 H VAL A 48 -3.470 -4.352 -7.095 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.405 -3.468 -4.748 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.338 -6.287 -5.434 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.852 -6.490 -3.037 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.113 -6.245 -3.321 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.120 -4.894 -2.748 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.519 -5.523 -4.584 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.854 -3.887 -4.360 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.992 -4.576 -5.995 1.00 0.00 H new ATOM 215 N ASP A 49 -0.150 -4.385 -4.283 1.00 0.00 N ATOM 216 CA ASP A 49 1.202 -4.865 -4.021 1.00 0.00 C ATOM 217 C ASP A 49 1.235 -6.389 -3.961 1.00 0.00 C ATOM 218 O ASP A 49 0.326 -7.035 -3.439 1.00 0.00 O ATOM 219 CB ASP A 49 1.728 -4.280 -2.710 1.00 0.00 C ATOM 220 CG ASP A 49 3.230 -4.071 -2.731 1.00 0.00 C ATOM 221 OD1 ASP A 49 3.728 -3.447 -3.691 1.00 0.00 O ATOM 222 OD2 ASP A 49 3.907 -4.532 -1.788 1.00 0.00 O ATOM 0 H ASP A 49 -0.416 -3.560 -3.746 1.00 0.00 H new ATOM 0 HA ASP A 49 1.843 -4.537 -4.840 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.234 -3.328 -2.516 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.468 -4.947 -1.888 1.00 0.00 H new ATOM 227 N PRO A 50 2.308 -6.980 -4.510 1.00 0.00 N ATOM 228 CA PRO A 50 2.485 -8.435 -4.532 1.00 0.00 C ATOM 229 C PRO A 50 2.757 -9.007 -3.145 1.00 0.00 C ATOM 230 O PRO A 50 2.141 -9.991 -2.736 1.00 0.00 O ATOM 231 CB PRO A 50 3.703 -8.629 -5.439 1.00 0.00 C ATOM 232 CG PRO A 50 4.460 -7.351 -5.336 1.00 0.00 C ATOM 233 CD PRO A 50 3.429 -6.272 -5.149 1.00 0.00 C ATOM 0 HA PRO A 50 1.590 -8.950 -4.881 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.308 -9.475 -5.113 1.00 0.00 H new ATOM 0 HB3 PRO A 50 3.403 -8.829 -6.467 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.155 -7.376 -4.497 1.00 0.00 H new ATOM 0 HG3 PRO A 50 5.051 -7.174 -6.235 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.803 -5.463 -4.522 1.00 0.00 H new ATOM 0 HD3 PRO A 50 3.134 -5.828 -6.100 1.00 0.00 H new ATOM 241 N THR A 51 3.684 -8.383 -2.424 1.00 0.00 N ATOM 242 CA THR A 51 4.039 -8.831 -1.083 1.00 0.00 C ATOM 243 C THR A 51 2.801 -8.969 -0.204 1.00 0.00 C ATOM 244 O THR A 51 2.784 -9.758 0.741 1.00 0.00 O ATOM 245 CB THR A 51 5.027 -7.860 -0.409 1.00 0.00 C ATOM 246 OG1 THR A 51 4.533 -6.519 -0.498 1.00 0.00 O ATOM 247 CG2 THR A 51 6.399 -7.945 -1.061 1.00 0.00 C ATOM 0 H THR A 51 4.202 -7.566 -2.747 1.00 0.00 H new ATOM 0 HA THR A 51 4.515 -9.805 -1.191 1.00 0.00 H new ATOM 0 HB THR A 51 5.122 -8.143 0.639 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.649 -6.188 -1.413 1.00 0.00 H new ATOM 0 HG21 THR A 51 7.080 -7.251 -0.568 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.785 -8.960 -0.966 1.00 0.00 H new ATOM 0 HG23 THR A 51 6.317 -7.685 -2.116 1.00 0.00 H new ATOM 255 N CYS A 52 1.766 -8.198 -0.523 1.00 0.00 N ATOM 256 CA CYS A 52 0.523 -8.235 0.239 1.00 0.00 C ATOM 257 C CYS A 52 -0.260 -9.510 -0.059 1.00 0.00 C ATOM 258 O CYS A 52 -0.349 -9.961 -1.201 1.00 0.00 O ATOM 259 CB CYS A 52 -0.333 -7.010 -0.084 1.00 0.00 C ATOM 260 SG CYS A 52 -2.087 -7.211 0.306 1.00 0.00 S ATOM 0 H CYS A 52 1.764 -7.541 -1.303 1.00 0.00 H new ATOM 0 HA CYS A 52 0.775 -8.225 1.299 1.00 0.00 H new ATOM 0 HB2 CYS A 52 0.055 -6.154 0.467 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -0.232 -6.779 -1.144 1.00 0.00 H new ATOM 0 HG CYS A 52 -2.759 -6.215 -0.190 1.00 0.00 H new ATOM 266 N PRO A 53 -0.840 -10.108 0.992 1.00 0.00 N ATOM 267 CA PRO A 53 -1.624 -11.340 0.869 1.00 0.00 C ATOM 268 C PRO A 53 -2.946 -11.116 0.143 1.00 0.00 C ATOM 269 O PRO A 53 -3.280 -11.837 -0.797 1.00 0.00 O ATOM 270 CB PRO A 53 -1.875 -11.748 2.323 1.00 0.00 C ATOM 271 CG PRO A 53 -1.793 -10.475 3.093 1.00 0.00 C ATOM 272 CD PRO A 53 -0.775 -9.626 2.383 1.00 0.00 C ATOM 0 HA PRO A 53 -1.103 -12.097 0.283 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.851 -12.219 2.439 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -1.131 -12.467 2.666 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.762 -9.976 3.127 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -1.494 -10.661 4.125 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.017 -8.566 2.453 1.00 0.00 H new ATOM 0 HD3 PRO A 53 0.221 -9.754 2.807 1.00 0.00 H new ATOM 280 N LEU A 54 -3.695 -10.111 0.584 1.00 0.00 N ATOM 281 CA LEU A 54 -4.981 -9.791 -0.025 1.00 0.00 C ATOM 282 C LEU A 54 -4.872 -9.765 -1.546 1.00 0.00 C ATOM 283 O LEU A 54 -5.808 -10.141 -2.251 1.00 0.00 O ATOM 284 CB LEU A 54 -5.487 -8.440 0.485 1.00 0.00 C ATOM 285 CG LEU A 54 -5.561 -8.281 2.004 1.00 0.00 C ATOM 286 CD1 LEU A 54 -5.710 -6.815 2.381 1.00 0.00 C ATOM 287 CD2 LEU A 54 -6.713 -9.098 2.570 1.00 0.00 C ATOM 0 H LEU A 54 -3.434 -9.504 1.361 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.692 -10.568 0.256 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.838 -7.659 0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.481 -8.268 0.073 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.631 -8.653 2.434 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.761 -6.722 3.466 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -4.853 -6.255 2.008 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.623 -6.417 1.939 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.751 -8.973 3.652 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.651 -8.756 2.132 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.564 -10.151 2.331 1.00 0.00 H new ATOM 299 N SER A 55 -3.723 -9.320 -2.044 1.00 0.00 N ATOM 300 CA SER A 55 -3.492 -9.244 -3.482 1.00 0.00 C ATOM 301 C SER A 55 -4.059 -10.471 -4.189 1.00 0.00 C ATOM 302 O SER A 55 -4.764 -10.353 -5.191 1.00 0.00 O ATOM 303 CB SER A 55 -1.995 -9.119 -3.774 1.00 0.00 C ATOM 304 OG SER A 55 -1.340 -10.365 -3.618 1.00 0.00 O ATOM 0 H SER A 55 -2.938 -9.007 -1.473 1.00 0.00 H new ATOM 0 HA SER A 55 -4.004 -8.359 -3.861 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.849 -8.752 -4.790 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.550 -8.384 -3.103 1.00 0.00 H new ATOM 0 HG SER A 55 -0.925 -10.408 -2.731 1.00 0.00 H new ATOM 310 N SER A 56 -3.745 -11.649 -3.660 1.00 0.00 N ATOM 311 CA SER A 56 -4.219 -12.899 -4.241 1.00 0.00 C ATOM 312 C SER A 56 -5.742 -12.976 -4.197 1.00 0.00 C ATOM 313 O SER A 56 -6.382 -13.387 -5.164 1.00 0.00 O ATOM 314 CB SER A 56 -3.614 -14.093 -3.499 1.00 0.00 C ATOM 315 OG SER A 56 -3.834 -15.300 -4.209 1.00 0.00 O ATOM 0 H SER A 56 -3.164 -11.764 -2.830 1.00 0.00 H new ATOM 0 HA SER A 56 -3.902 -12.930 -5.283 1.00 0.00 H new ATOM 0 HB2 SER A 56 -2.544 -13.937 -3.364 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.053 -14.167 -2.504 1.00 0.00 H new ATOM 0 HG SER A 56 -3.437 -16.047 -3.715 1.00 0.00 H new ATOM 321 N ASN A 57 -6.315 -12.578 -3.066 1.00 0.00 N ATOM 322 CA ASN A 57 -7.763 -12.602 -2.894 1.00 0.00 C ATOM 323 C ASN A 57 -8.455 -11.800 -3.992 1.00 0.00 C ATOM 324 O ASN A 57 -8.114 -10.649 -4.263 1.00 0.00 O ATOM 325 CB ASN A 57 -8.144 -12.042 -1.522 1.00 0.00 C ATOM 326 CG ASN A 57 -8.087 -13.095 -0.432 1.00 0.00 C ATOM 327 OD1 ASN A 57 -7.562 -14.189 -0.637 1.00 0.00 O ATOM 328 ND2 ASN A 57 -8.630 -12.768 0.735 1.00 0.00 N ATOM 0 H ASN A 57 -5.799 -12.235 -2.255 1.00 0.00 H new ATOM 0 HA ASN A 57 -8.094 -13.638 -2.961 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.472 -11.223 -1.267 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.150 -11.626 -1.569 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.622 -13.436 1.506 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -9.055 -11.849 0.860 1.00 0.00 H new ATOM 335 N PRO A 58 -9.452 -12.422 -4.640 1.00 0.00 N ATOM 336 CA PRO A 58 -10.213 -11.785 -5.718 1.00 0.00 C ATOM 337 C PRO A 58 -11.112 -10.663 -5.209 1.00 0.00 C ATOM 338 O PRO A 58 -11.783 -10.808 -4.188 1.00 0.00 O ATOM 339 CB PRO A 58 -11.056 -12.931 -6.283 1.00 0.00 C ATOM 340 CG PRO A 58 -11.191 -13.893 -5.153 1.00 0.00 C ATOM 341 CD PRO A 58 -9.912 -13.794 -4.369 1.00 0.00 C ATOM 0 HA PRO A 58 -9.561 -11.315 -6.454 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.030 -12.577 -6.621 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.570 -13.394 -7.142 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -12.051 -13.645 -4.530 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -11.346 -14.907 -5.521 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.079 -13.959 -3.305 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.182 -14.535 -4.696 1.00 0.00 H new ATOM 349 N GLY A 59 -11.121 -9.545 -5.928 1.00 0.00 N ATOM 350 CA GLY A 59 -11.942 -8.415 -5.533 1.00 0.00 C ATOM 351 C GLY A 59 -11.144 -7.338 -4.825 1.00 0.00 C ATOM 352 O GLY A 59 -11.454 -6.152 -4.934 1.00 0.00 O ATOM 0 H GLY A 59 -10.574 -9.401 -6.777 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.418 -7.989 -6.416 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.741 -8.762 -4.877 1.00 0.00 H new ATOM 356 N THR A 60 -10.114 -7.752 -4.093 1.00 0.00 N ATOM 357 CA THR A 60 -9.271 -6.814 -3.362 1.00 0.00 C ATOM 358 C THR A 60 -8.539 -5.875 -4.314 1.00 0.00 C ATOM 359 O THR A 60 -7.631 -6.291 -5.033 1.00 0.00 O ATOM 360 CB THR A 60 -8.237 -7.551 -2.489 1.00 0.00 C ATOM 361 OG1 THR A 60 -8.906 -8.371 -1.524 1.00 0.00 O ATOM 362 CG2 THR A 60 -7.326 -6.562 -1.778 1.00 0.00 C ATOM 0 H THR A 60 -9.844 -8.730 -3.991 1.00 0.00 H new ATOM 0 HA THR A 60 -9.930 -6.232 -2.718 1.00 0.00 H new ATOM 0 HB THR A 60 -7.628 -8.179 -3.139 1.00 0.00 H new ATOM 0 HG1 THR A 60 -8.254 -8.955 -1.083 1.00 0.00 H new ATOM 0 HG21 THR A 60 -6.605 -7.106 -1.168 1.00 0.00 H new ATOM 0 HG22 THR A 60 -6.796 -5.960 -2.516 1.00 0.00 H new ATOM 0 HG23 THR A 60 -7.923 -5.911 -1.140 1.00 0.00 H new ATOM 370 N GLN A 61 -8.939 -4.608 -4.312 1.00 0.00 N ATOM 371 CA GLN A 61 -8.319 -3.611 -5.176 1.00 0.00 C ATOM 372 C GLN A 61 -7.771 -2.446 -4.358 1.00 0.00 C ATOM 373 O GLN A 61 -8.082 -2.305 -3.175 1.00 0.00 O ATOM 374 CB GLN A 61 -9.330 -3.096 -6.203 1.00 0.00 C ATOM 375 CG GLN A 61 -10.405 -2.203 -5.604 1.00 0.00 C ATOM 376 CD GLN A 61 -11.614 -2.061 -6.506 1.00 0.00 C ATOM 377 OE1 GLN A 61 -11.989 -0.952 -6.891 1.00 0.00 O ATOM 378 NE2 GLN A 61 -12.233 -3.184 -6.850 1.00 0.00 N ATOM 0 H GLN A 61 -9.689 -4.248 -3.722 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.489 -4.086 -5.699 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -8.799 -2.542 -6.977 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -9.806 -3.947 -6.690 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -10.719 -2.613 -4.644 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -9.985 -1.217 -5.408 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -11.889 -4.081 -6.508 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -13.053 -3.149 -7.456 1.00 0.00 H new ATOM 387 N VAL A 62 -6.953 -1.615 -4.995 1.00 0.00 N ATOM 388 CA VAL A 62 -6.361 -0.462 -4.326 1.00 0.00 C ATOM 389 C VAL A 62 -7.319 0.724 -4.325 1.00 0.00 C ATOM 390 O VAL A 62 -7.528 1.367 -5.354 1.00 0.00 O ATOM 391 CB VAL A 62 -5.040 -0.041 -4.997 1.00 0.00 C ATOM 392 CG1 VAL A 62 -4.508 1.240 -4.372 1.00 0.00 C ATOM 393 CG2 VAL A 62 -4.013 -1.159 -4.900 1.00 0.00 C ATOM 0 H VAL A 62 -6.685 -1.718 -5.974 1.00 0.00 H new ATOM 0 HA VAL A 62 -6.158 -0.762 -3.298 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.234 0.152 -6.052 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.574 1.522 -4.859 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.239 2.038 -4.500 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.329 1.079 -3.309 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -3.086 -0.844 -5.379 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.820 -1.386 -3.851 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.396 -2.049 -5.400 1.00 0.00 H new ATOM 403 N TYR A 63 -7.898 1.008 -3.164 1.00 0.00 N ATOM 404 CA TYR A 63 -8.836 2.117 -3.029 1.00 0.00 C ATOM 405 C TYR A 63 -8.312 3.363 -3.736 1.00 0.00 C ATOM 406 O TYR A 63 -7.250 3.883 -3.394 1.00 0.00 O ATOM 407 CB TYR A 63 -9.086 2.423 -1.551 1.00 0.00 C ATOM 408 CG TYR A 63 -10.040 3.574 -1.325 1.00 0.00 C ATOM 409 CD1 TYR A 63 -11.398 3.439 -1.590 1.00 0.00 C ATOM 410 CD2 TYR A 63 -9.585 4.796 -0.846 1.00 0.00 C ATOM 411 CE1 TYR A 63 -12.273 4.488 -1.386 1.00 0.00 C ATOM 412 CE2 TYR A 63 -10.453 5.850 -0.637 1.00 0.00 C ATOM 413 CZ TYR A 63 -11.796 5.691 -0.908 1.00 0.00 C ATOM 414 OH TYR A 63 -12.664 6.739 -0.703 1.00 0.00 O ATOM 0 H TYR A 63 -7.735 0.486 -2.303 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.776 1.824 -3.497 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.484 1.532 -1.066 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -8.135 2.650 -1.070 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -11.775 2.498 -1.962 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.534 4.924 -0.633 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -13.325 4.367 -1.599 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -10.082 6.793 -0.264 1.00 0.00 H new ATOM 0 HH TYR A 63 -12.168 7.513 -0.363 1.00 0.00 H new ATOM 424 N GLU A 64 -9.066 3.836 -4.723 1.00 0.00 N ATOM 425 CA GLU A 64 -8.678 5.021 -5.479 1.00 0.00 C ATOM 426 C GLU A 64 -7.242 4.901 -5.980 1.00 0.00 C ATOM 427 O GLU A 64 -6.783 3.813 -6.328 1.00 0.00 O ATOM 428 CB GLU A 64 -8.825 6.275 -4.615 1.00 0.00 C ATOM 429 CG GLU A 64 -10.132 6.332 -3.842 1.00 0.00 C ATOM 430 CD GLU A 64 -10.518 7.745 -3.451 1.00 0.00 C ATOM 431 OE1 GLU A 64 -9.640 8.484 -2.958 1.00 0.00 O ATOM 432 OE2 GLU A 64 -11.697 8.112 -3.637 1.00 0.00 O ATOM 0 H GLU A 64 -9.948 3.417 -5.018 1.00 0.00 H new ATOM 0 HA GLU A 64 -9.340 5.103 -6.341 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.994 6.320 -3.911 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.751 7.156 -5.253 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.927 5.897 -4.447 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -10.045 5.721 -2.943 1.00 0.00 H new ATOM 439 N ASP A 65 -6.537 6.027 -6.014 1.00 0.00 N ATOM 440 CA ASP A 65 -5.153 6.049 -6.472 1.00 0.00 C ATOM 441 C ASP A 65 -4.199 6.295 -5.307 1.00 0.00 C ATOM 442 O ASP A 65 -3.133 6.886 -5.478 1.00 0.00 O ATOM 443 CB ASP A 65 -4.963 7.129 -7.539 1.00 0.00 C ATOM 444 CG ASP A 65 -6.222 7.370 -8.348 1.00 0.00 C ATOM 445 OD1 ASP A 65 -6.424 6.661 -9.357 1.00 0.00 O ATOM 446 OD2 ASP A 65 -7.005 8.268 -7.974 1.00 0.00 O ATOM 0 H ASP A 65 -6.902 6.936 -5.730 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.925 5.076 -6.906 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -4.659 8.060 -7.060 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -4.155 6.836 -8.209 1.00 0.00 H new ATOM 451 N TYR A 66 -4.591 5.837 -4.123 1.00 0.00 N ATOM 452 CA TYR A 66 -3.772 6.010 -2.928 1.00 0.00 C ATOM 453 C TYR A 66 -2.585 5.052 -2.938 1.00 0.00 C ATOM 454 O TYR A 66 -2.568 4.060 -2.212 1.00 0.00 O ATOM 455 CB TYR A 66 -4.614 5.784 -1.671 1.00 0.00 C ATOM 456 CG TYR A 66 -5.429 6.990 -1.263 1.00 0.00 C ATOM 457 CD1 TYR A 66 -4.813 8.144 -0.795 1.00 0.00 C ATOM 458 CD2 TYR A 66 -6.816 6.976 -1.345 1.00 0.00 C ATOM 459 CE1 TYR A 66 -5.553 9.248 -0.420 1.00 0.00 C ATOM 460 CE2 TYR A 66 -7.565 8.076 -0.974 1.00 0.00 C ATOM 461 CZ TYR A 66 -6.929 9.209 -0.512 1.00 0.00 C ATOM 462 OH TYR A 66 -7.671 10.307 -0.140 1.00 0.00 O ATOM 0 H TYR A 66 -5.470 5.344 -3.965 1.00 0.00 H new ATOM 0 HA TYR A 66 -3.391 7.031 -2.924 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -5.286 4.942 -1.840 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.956 5.506 -0.848 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -3.736 8.178 -0.723 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -7.317 6.090 -1.705 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -5.058 10.136 -0.057 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -8.642 8.049 -1.045 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.614 10.153 -0.356 1.00 0.00 H new ATOM 472 N ASN A 67 -1.592 5.360 -3.767 1.00 0.00 N ATOM 473 CA ASN A 67 -0.399 4.527 -3.872 1.00 0.00 C ATOM 474 C ASN A 67 0.836 5.379 -4.148 1.00 0.00 C ATOM 475 O ASN A 67 1.044 5.843 -5.270 1.00 0.00 O ATOM 476 CB ASN A 67 -0.574 3.488 -4.982 1.00 0.00 C ATOM 477 CG ASN A 67 -1.090 4.098 -6.270 1.00 0.00 C ATOM 478 OD1 ASN A 67 -0.313 4.467 -7.150 1.00 0.00 O ATOM 479 ND2 ASN A 67 -2.409 4.208 -6.386 1.00 0.00 N ATOM 0 H ASN A 67 -1.590 6.179 -4.375 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.259 4.013 -2.921 1.00 0.00 H new ATOM 0 HB2 ASN A 67 0.382 2.999 -5.172 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -1.266 2.715 -4.647 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -2.815 4.612 -7.230 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -3.016 3.889 -5.631 1.00 0.00 H new ATOM 486 N CYS A 68 1.651 5.580 -3.119 1.00 0.00 N ATOM 487 CA CYS A 68 2.866 6.376 -3.250 1.00 0.00 C ATOM 488 C CYS A 68 4.054 5.665 -2.612 1.00 0.00 C ATOM 489 O CYS A 68 3.946 5.112 -1.516 1.00 0.00 O ATOM 490 CB CYS A 68 2.672 7.750 -2.606 1.00 0.00 C ATOM 491 SG CYS A 68 1.846 7.701 -0.998 1.00 0.00 S ATOM 0 H CYS A 68 1.493 5.203 -2.185 1.00 0.00 H new ATOM 0 HA CYS A 68 3.072 6.506 -4.312 1.00 0.00 H new ATOM 0 HB2 CYS A 68 3.646 8.225 -2.488 1.00 0.00 H new ATOM 0 HB3 CYS A 68 2.091 8.378 -3.282 1.00 0.00 H new ATOM 0 HG CYS A 68 1.113 8.765 -0.854 1.00 0.00 H new ATOM 497 N THR A 69 5.189 5.680 -3.305 1.00 0.00 N ATOM 498 CA THR A 69 6.397 5.033 -2.807 1.00 0.00 C ATOM 499 C THR A 69 7.358 6.053 -2.206 1.00 0.00 C ATOM 500 O THR A 69 7.583 7.121 -2.777 1.00 0.00 O ATOM 501 CB THR A 69 7.120 4.259 -3.925 1.00 0.00 C ATOM 502 OG1 THR A 69 6.275 3.217 -4.426 1.00 0.00 O ATOM 503 CG2 THR A 69 8.422 3.661 -3.413 1.00 0.00 C ATOM 0 H THR A 69 5.297 6.133 -4.212 1.00 0.00 H new ATOM 0 HA THR A 69 6.085 4.332 -2.033 1.00 0.00 H new ATOM 0 HB THR A 69 7.350 4.957 -4.730 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.742 2.731 -5.138 1.00 0.00 H new ATOM 0 HG21 THR A 69 8.915 3.119 -4.220 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.075 4.459 -3.060 1.00 0.00 H new ATOM 0 HG23 THR A 69 8.210 2.976 -2.592 1.00 0.00 H new ATOM 511 N LEU A 70 7.923 5.717 -1.052 1.00 0.00 N ATOM 512 CA LEU A 70 8.862 6.603 -0.373 1.00 0.00 C ATOM 513 C LEU A 70 10.223 5.934 -0.212 1.00 0.00 C ATOM 514 O LEU A 70 10.310 4.735 0.046 1.00 0.00 O ATOM 515 CB LEU A 70 8.314 7.006 0.997 1.00 0.00 C ATOM 516 CG LEU A 70 6.859 7.477 1.026 1.00 0.00 C ATOM 517 CD1 LEU A 70 6.474 7.932 2.425 1.00 0.00 C ATOM 518 CD2 LEU A 70 6.641 8.597 0.019 1.00 0.00 C ATOM 0 H LEU A 70 7.747 4.837 -0.567 1.00 0.00 H new ATOM 0 HA LEU A 70 8.987 7.496 -0.985 1.00 0.00 H new ATOM 0 HB2 LEU A 70 8.413 6.155 1.670 1.00 0.00 H new ATOM 0 HB3 LEU A 70 8.941 7.803 1.397 1.00 0.00 H new ATOM 0 HG LEU A 70 6.219 6.639 0.750 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.436 8.264 2.427 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.591 7.103 3.122 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.119 8.756 2.730 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.600 8.920 0.053 1.00 0.00 H new ATOM 0 HD22 LEU A 70 7.290 9.438 0.264 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.876 8.237 -0.982 1.00 0.00 H new ATOM 530 N ASN A 71 11.284 6.720 -0.365 1.00 0.00 N ATOM 531 CA ASN A 71 12.642 6.204 -0.235 1.00 0.00 C ATOM 532 C ASN A 71 13.381 6.898 0.905 1.00 0.00 C ATOM 533 O ASN A 71 12.997 7.985 1.335 1.00 0.00 O ATOM 534 CB ASN A 71 13.410 6.393 -1.545 1.00 0.00 C ATOM 535 CG ASN A 71 13.289 5.192 -2.464 1.00 0.00 C ATOM 536 OD1 ASN A 71 12.886 5.319 -3.620 1.00 0.00 O ATOM 537 ND2 ASN A 71 13.639 4.018 -1.952 1.00 0.00 N ATOM 0 H ASN A 71 11.230 7.716 -0.579 1.00 0.00 H new ATOM 0 HA ASN A 71 12.579 5.140 -0.009 1.00 0.00 H new ATOM 0 HB2 ASN A 71 13.036 7.279 -2.058 1.00 0.00 H new ATOM 0 HB3 ASN A 71 14.462 6.573 -1.324 1.00 0.00 H new ATOM 0 HD21 ASN A 71 13.579 3.175 -2.522 1.00 0.00 H new ATOM 0 HD22 ASN A 71 13.968 3.960 -0.988 1.00 0.00 H new ATOM 544 N GLN A 72 14.444 6.263 1.388 1.00 0.00 N ATOM 545 CA GLN A 72 15.237 6.820 2.477 1.00 0.00 C ATOM 546 C GLN A 72 16.674 6.313 2.419 1.00 0.00 C ATOM 547 O GLN A 72 16.946 5.149 2.714 1.00 0.00 O ATOM 548 CB GLN A 72 14.611 6.462 3.826 1.00 0.00 C ATOM 549 CG GLN A 72 15.371 7.023 5.017 1.00 0.00 C ATOM 550 CD GLN A 72 14.840 6.511 6.342 1.00 0.00 C ATOM 551 OE1 GLN A 72 14.875 5.311 6.615 1.00 0.00 O ATOM 552 NE2 GLN A 72 14.345 7.420 7.173 1.00 0.00 N ATOM 0 H GLN A 72 14.776 5.363 1.042 1.00 0.00 H new ATOM 0 HA GLN A 72 15.249 7.904 2.366 1.00 0.00 H new ATOM 0 HB2 GLN A 72 13.586 6.833 3.852 1.00 0.00 H new ATOM 0 HB3 GLN A 72 14.559 5.377 3.917 1.00 0.00 H new ATOM 0 HG2 GLN A 72 16.425 6.761 4.927 1.00 0.00 H new ATOM 0 HG3 GLN A 72 15.311 8.111 5.002 1.00 0.00 H new ATOM 0 HE21 GLN A 72 14.336 8.404 6.906 1.00 0.00 H new ATOM 0 HE22 GLN A 72 13.974 7.134 8.079 1.00 0.00 H new ATOM 561 N THR A 73 17.593 7.195 2.036 1.00 0.00 N ATOM 562 CA THR A 73 19.002 6.837 1.937 1.00 0.00 C ATOM 563 C THR A 73 19.821 7.524 3.024 1.00 0.00 C ATOM 564 O THR A 73 19.481 8.618 3.473 1.00 0.00 O ATOM 565 CB THR A 73 19.581 7.210 0.560 1.00 0.00 C ATOM 566 OG1 THR A 73 19.050 8.469 0.130 1.00 0.00 O ATOM 567 CG2 THR A 73 19.259 6.139 -0.471 1.00 0.00 C ATOM 0 H THR A 73 17.386 8.163 1.789 1.00 0.00 H new ATOM 0 HA THR A 73 19.064 5.757 2.068 1.00 0.00 H new ATOM 0 HB THR A 73 20.664 7.286 0.655 1.00 0.00 H new ATOM 0 HG1 THR A 73 19.424 8.700 -0.746 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.678 6.425 -1.436 1.00 0.00 H new ATOM 0 HG22 THR A 73 19.690 5.189 -0.155 1.00 0.00 H new ATOM 0 HG23 THR A 73 18.178 6.035 -0.562 1.00 0.00 H new ATOM 575 N ASN A 74 20.903 6.876 3.442 1.00 0.00 N ATOM 576 CA ASN A 74 21.772 7.426 4.477 1.00 0.00 C ATOM 577 C ASN A 74 23.227 7.040 4.227 1.00 0.00 C ATOM 578 O ASN A 74 23.518 5.927 3.790 1.00 0.00 O ATOM 579 CB ASN A 74 21.331 6.932 5.857 1.00 0.00 C ATOM 580 CG ASN A 74 20.304 7.846 6.496 1.00 0.00 C ATOM 581 OD1 ASN A 74 19.261 8.134 5.909 1.00 0.00 O ATOM 582 ND2 ASN A 74 20.595 8.307 7.707 1.00 0.00 N ATOM 0 H ASN A 74 21.199 5.970 3.080 1.00 0.00 H new ATOM 0 HA ASN A 74 21.692 8.513 4.445 1.00 0.00 H new ATOM 0 HB2 ASN A 74 20.914 5.929 5.765 1.00 0.00 H new ATOM 0 HB3 ASN A 74 22.202 6.856 6.508 1.00 0.00 H new ATOM 0 HD21 ASN A 74 19.942 8.926 8.188 1.00 0.00 H new ATOM 0 HD22 ASN A 74 21.472 8.042 8.156 1.00 0.00 H new ATOM 589 N ILE A 75 24.135 7.968 4.509 1.00 0.00 N ATOM 590 CA ILE A 75 25.559 7.725 4.316 1.00 0.00 C ATOM 591 C ILE A 75 26.117 6.828 5.416 1.00 0.00 C ATOM 592 O ILE A 75 27.119 7.158 6.050 1.00 0.00 O ATOM 593 CB ILE A 75 26.357 9.042 4.290 1.00 0.00 C ATOM 594 CG1 ILE A 75 27.793 8.786 3.827 1.00 0.00 C ATOM 595 CG2 ILE A 75 26.346 9.696 5.664 1.00 0.00 C ATOM 596 CD1 ILE A 75 28.446 9.990 3.187 1.00 0.00 C ATOM 0 H ILE A 75 23.910 8.894 4.872 1.00 0.00 H new ATOM 0 HA ILE A 75 25.666 7.226 3.353 1.00 0.00 H new ATOM 0 HB ILE A 75 25.883 9.722 3.582 1.00 0.00 H new ATOM 0 HG12 ILE A 75 28.391 8.470 4.682 1.00 0.00 H new ATOM 0 HG13 ILE A 75 27.795 7.961 3.115 1.00 0.00 H new ATOM 0 HG21 ILE A 75 26.914 10.626 5.629 1.00 0.00 H new ATOM 0 HG22 ILE A 75 25.318 9.910 5.957 1.00 0.00 H new ATOM 0 HG23 ILE A 75 26.798 9.022 6.392 1.00 0.00 H new ATOM 0 HD11 ILE A 75 29.461 9.735 2.884 1.00 0.00 H new ATOM 0 HD12 ILE A 75 27.871 10.293 2.312 1.00 0.00 H new ATOM 0 HD13 ILE A 75 28.477 10.811 3.903 1.00 0.00 H new ATOM 608 N GLU A 76 25.463 5.692 5.634 1.00 0.00 N ATOM 609 CA GLU A 76 25.895 4.747 6.657 1.00 0.00 C ATOM 610 C GLU A 76 25.906 3.322 6.111 1.00 0.00 C ATOM 611 O GLU A 76 24.855 2.722 5.891 1.00 0.00 O ATOM 612 CB GLU A 76 24.978 4.829 7.879 1.00 0.00 C ATOM 613 CG GLU A 76 25.183 6.083 8.712 1.00 0.00 C ATOM 614 CD GLU A 76 24.431 6.040 10.027 1.00 0.00 C ATOM 615 OE1 GLU A 76 23.183 6.079 9.997 1.00 0.00 O ATOM 616 OE2 GLU A 76 25.089 5.968 11.086 1.00 0.00 O ATOM 0 H GLU A 76 24.633 5.404 5.116 1.00 0.00 H new ATOM 0 HA GLU A 76 26.910 5.012 6.955 1.00 0.00 H new ATOM 0 HB2 GLU A 76 23.940 4.789 7.547 1.00 0.00 H new ATOM 0 HB3 GLU A 76 25.145 3.954 8.507 1.00 0.00 H new ATOM 0 HG2 GLU A 76 26.247 6.213 8.910 1.00 0.00 H new ATOM 0 HG3 GLU A 76 24.857 6.952 8.140 1.00 0.00 H new ATOM 623 N ASN A 77 27.104 2.787 5.894 1.00 0.00 N ATOM 624 CA ASN A 77 27.253 1.433 5.373 1.00 0.00 C ATOM 625 C ASN A 77 26.244 1.164 4.261 1.00 0.00 C ATOM 626 O ASN A 77 25.660 0.083 4.187 1.00 0.00 O ATOM 627 CB ASN A 77 27.078 0.410 6.496 1.00 0.00 C ATOM 628 CG ASN A 77 28.352 0.198 7.290 1.00 0.00 C ATOM 629 OD1 ASN A 77 29.034 -0.815 7.132 1.00 0.00 O ATOM 630 ND2 ASN A 77 28.679 1.155 8.150 1.00 0.00 N ATOM 0 H ASN A 77 27.985 3.270 6.071 1.00 0.00 H new ATOM 0 HA ASN A 77 28.257 1.338 4.958 1.00 0.00 H new ATOM 0 HB2 ASN A 77 26.286 0.743 7.167 1.00 0.00 H new ATOM 0 HB3 ASN A 77 26.756 -0.541 6.071 1.00 0.00 H new ATOM 0 HD21 ASN A 77 29.525 1.068 8.713 1.00 0.00 H new ATOM 0 HD22 ASN A 77 28.084 1.978 8.248 1.00 0.00 H new ATOM 637 N ASN A 78 26.043 2.155 3.398 1.00 0.00 N ATOM 638 CA ASN A 78 25.104 2.025 2.290 1.00 0.00 C ATOM 639 C ASN A 78 23.779 1.437 2.766 1.00 0.00 C ATOM 640 O ASN A 78 23.308 0.433 2.234 1.00 0.00 O ATOM 641 CB ASN A 78 25.700 1.145 1.190 1.00 0.00 C ATOM 642 CG ASN A 78 25.125 1.460 -0.178 1.00 0.00 C ATOM 643 OD1 ASN A 78 23.976 1.885 -0.297 1.00 0.00 O ATOM 644 ND2 ASN A 78 25.925 1.253 -1.218 1.00 0.00 N ATOM 0 H ASN A 78 26.518 3.057 3.445 1.00 0.00 H new ATOM 0 HA ASN A 78 24.915 3.020 1.887 1.00 0.00 H new ATOM 0 HB2 ASN A 78 26.781 1.280 1.166 1.00 0.00 H new ATOM 0 HB3 ASN A 78 25.515 0.097 1.426 1.00 0.00 H new ATOM 0 HD21 ASN A 78 25.594 1.448 -2.163 1.00 0.00 H new ATOM 0 HD22 ASN A 78 26.871 0.899 -1.072 1.00 0.00 H new ATOM 651 N ASN A 79 23.184 2.070 3.771 1.00 0.00 N ATOM 652 CA ASN A 79 21.913 1.610 4.319 1.00 0.00 C ATOM 653 C ASN A 79 20.749 2.407 3.739 1.00 0.00 C ATOM 654 O ASN A 79 20.677 3.625 3.899 1.00 0.00 O ATOM 655 CB ASN A 79 21.918 1.730 5.844 1.00 0.00 C ATOM 656 CG ASN A 79 22.427 0.472 6.522 1.00 0.00 C ATOM 657 OD1 ASN A 79 23.173 -0.307 5.929 1.00 0.00 O ATOM 658 ND2 ASN A 79 22.025 0.269 7.771 1.00 0.00 N ATOM 0 H ASN A 79 23.561 2.903 4.223 1.00 0.00 H new ATOM 0 HA ASN A 79 21.786 0.563 4.044 1.00 0.00 H new ATOM 0 HB2 ASN A 79 22.541 2.575 6.137 1.00 0.00 H new ATOM 0 HB3 ASN A 79 20.907 1.943 6.192 1.00 0.00 H new ATOM 0 HD21 ASN A 79 22.335 -0.560 8.278 1.00 0.00 H new ATOM 0 HD22 ASN A 79 21.406 0.942 8.223 1.00 0.00 H new ATOM 665 N ASN A 80 19.840 1.711 3.064 1.00 0.00 N ATOM 666 CA ASN A 80 18.679 2.355 2.460 1.00 0.00 C ATOM 667 C ASN A 80 17.396 1.611 2.819 1.00 0.00 C ATOM 668 O ASN A 80 17.391 0.386 2.949 1.00 0.00 O ATOM 669 CB ASN A 80 18.838 2.415 0.939 1.00 0.00 C ATOM 670 CG ASN A 80 19.668 1.268 0.398 1.00 0.00 C ATOM 671 OD1 ASN A 80 19.479 0.114 0.785 1.00 0.00 O ATOM 672 ND2 ASN A 80 20.594 1.580 -0.501 1.00 0.00 N ATOM 0 H ASN A 80 19.885 0.702 2.922 1.00 0.00 H new ATOM 0 HA ASN A 80 18.612 3.370 2.853 1.00 0.00 H new ATOM 0 HB2 ASN A 80 17.853 2.398 0.473 1.00 0.00 H new ATOM 0 HB3 ASN A 80 19.306 3.360 0.662 1.00 0.00 H new ATOM 0 HD21 ASN A 80 21.184 0.850 -0.900 1.00 0.00 H new ATOM 0 HD22 ASN A 80 20.716 2.550 -0.792 1.00 0.00 H new ATOM 679 N LYS A 81 16.310 2.359 2.977 1.00 0.00 N ATOM 680 CA LYS A 81 15.019 1.772 3.319 1.00 0.00 C ATOM 681 C LYS A 81 13.917 2.319 2.419 1.00 0.00 C ATOM 682 O LYS A 81 14.054 3.395 1.836 1.00 0.00 O ATOM 683 CB LYS A 81 14.681 2.052 4.785 1.00 0.00 C ATOM 684 CG LYS A 81 15.693 1.479 5.763 1.00 0.00 C ATOM 685 CD LYS A 81 15.499 2.044 7.160 1.00 0.00 C ATOM 686 CE LYS A 81 16.778 1.956 7.979 1.00 0.00 C ATOM 687 NZ LYS A 81 16.915 0.635 8.653 1.00 0.00 N ATOM 0 H LYS A 81 16.297 3.374 2.874 1.00 0.00 H new ATOM 0 HA LYS A 81 15.086 0.695 3.167 1.00 0.00 H new ATOM 0 HB2 LYS A 81 14.614 3.130 4.934 1.00 0.00 H new ATOM 0 HB3 LYS A 81 13.698 1.638 5.008 1.00 0.00 H new ATOM 0 HG2 LYS A 81 15.598 0.394 5.792 1.00 0.00 H new ATOM 0 HG3 LYS A 81 16.702 1.702 5.416 1.00 0.00 H new ATOM 0 HD2 LYS A 81 15.180 3.084 7.092 1.00 0.00 H new ATOM 0 HD3 LYS A 81 14.703 1.499 7.667 1.00 0.00 H new ATOM 0 HE2 LYS A 81 17.637 2.123 7.330 1.00 0.00 H new ATOM 0 HE3 LYS A 81 16.785 2.748 8.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 17.799 0.615 9.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 16.108 0.486 9.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 16.934 -0.120 7.937 1.00 0.00 H new ATOM 701 N PHE A 82 12.823 1.573 2.310 1.00 0.00 N ATOM 702 CA PHE A 82 11.696 1.984 1.480 1.00 0.00 C ATOM 703 C PHE A 82 10.383 1.862 2.248 1.00 0.00 C ATOM 704 O PHE A 82 10.135 0.862 2.922 1.00 0.00 O ATOM 705 CB PHE A 82 11.636 1.137 0.208 1.00 0.00 C ATOM 706 CG PHE A 82 11.378 -0.320 0.469 1.00 0.00 C ATOM 707 CD1 PHE A 82 12.410 -1.163 0.847 1.00 0.00 C ATOM 708 CD2 PHE A 82 10.103 -0.845 0.335 1.00 0.00 C ATOM 709 CE1 PHE A 82 12.175 -2.504 1.088 1.00 0.00 C ATOM 710 CE2 PHE A 82 9.862 -2.185 0.575 1.00 0.00 C ATOM 711 CZ PHE A 82 10.900 -3.015 0.951 1.00 0.00 C ATOM 0 H PHE A 82 12.693 0.680 2.786 1.00 0.00 H new ATOM 0 HA PHE A 82 11.841 3.029 1.205 1.00 0.00 H new ATOM 0 HB2 PHE A 82 10.852 1.526 -0.441 1.00 0.00 H new ATOM 0 HB3 PHE A 82 12.577 1.240 -0.332 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.410 -0.768 0.955 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.288 -0.200 0.040 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.988 -3.151 1.383 1.00 0.00 H new ATOM 0 HE2 PHE A 82 8.863 -2.582 0.469 1.00 0.00 H new ATOM 0 HZ PHE A 82 10.714 -4.062 1.138 1.00 0.00 H new ATOM 721 N TYR A 83 9.545 2.888 2.141 1.00 0.00 N ATOM 722 CA TYR A 83 8.258 2.898 2.827 1.00 0.00 C ATOM 723 C TYR A 83 7.109 2.973 1.827 1.00 0.00 C ATOM 724 O TYR A 83 7.057 3.876 0.991 1.00 0.00 O ATOM 725 CB TYR A 83 8.184 4.078 3.797 1.00 0.00 C ATOM 726 CG TYR A 83 7.287 3.827 4.988 1.00 0.00 C ATOM 727 CD1 TYR A 83 5.920 3.642 4.827 1.00 0.00 C ATOM 728 CD2 TYR A 83 7.809 3.773 6.275 1.00 0.00 C ATOM 729 CE1 TYR A 83 5.097 3.413 5.913 1.00 0.00 C ATOM 730 CE2 TYR A 83 6.994 3.543 7.367 1.00 0.00 C ATOM 731 CZ TYR A 83 5.639 3.364 7.181 1.00 0.00 C ATOM 732 OH TYR A 83 4.824 3.134 8.265 1.00 0.00 O ATOM 0 H TYR A 83 9.734 3.723 1.586 1.00 0.00 H new ATOM 0 HA TYR A 83 8.166 1.968 3.389 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.188 4.310 4.152 1.00 0.00 H new ATOM 0 HB3 TYR A 83 7.825 4.956 3.261 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.493 3.678 3.836 1.00 0.00 H new ATOM 0 HD2 TYR A 83 8.869 3.913 6.424 1.00 0.00 H new ATOM 0 HE1 TYR A 83 4.036 3.273 5.770 1.00 0.00 H new ATOM 0 HE2 TYR A 83 7.416 3.504 8.361 1.00 0.00 H new ATOM 0 HH TYR A 83 3.952 2.811 7.956 1.00 0.00 H new ATOM 742 N ILE A 84 6.189 2.019 1.920 1.00 0.00 N ATOM 743 CA ILE A 84 5.039 1.978 1.025 1.00 0.00 C ATOM 744 C ILE A 84 3.732 2.088 1.804 1.00 0.00 C ATOM 745 O ILE A 84 3.539 1.406 2.811 1.00 0.00 O ATOM 746 CB ILE A 84 5.019 0.682 0.193 1.00 0.00 C ATOM 747 CG1 ILE A 84 6.297 0.567 -0.641 1.00 0.00 C ATOM 748 CG2 ILE A 84 3.790 0.646 -0.702 1.00 0.00 C ATOM 749 CD1 ILE A 84 6.480 -0.792 -1.281 1.00 0.00 C ATOM 0 H ILE A 84 6.217 1.264 2.606 1.00 0.00 H new ATOM 0 HA ILE A 84 5.132 2.831 0.353 1.00 0.00 H new ATOM 0 HB ILE A 84 4.973 -0.169 0.873 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.282 1.328 -1.421 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.157 0.779 -0.005 1.00 0.00 H new ATOM 0 HG21 ILE A 84 3.790 -0.276 -1.284 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.891 0.687 -0.087 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.807 1.501 -1.378 1.00 0.00 H new ATOM 0 HD11 ILE A 84 7.406 -0.801 -1.856 1.00 0.00 H new ATOM 0 HD12 ILE A 84 6.527 -1.556 -0.505 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.639 -0.999 -1.943 1.00 0.00 H new ATOM 761 N ILE A 85 2.838 2.949 1.330 1.00 0.00 N ATOM 762 CA ILE A 85 1.549 3.146 1.981 1.00 0.00 C ATOM 763 C ILE A 85 0.412 3.129 0.964 1.00 0.00 C ATOM 764 O ILE A 85 0.192 4.107 0.249 1.00 0.00 O ATOM 765 CB ILE A 85 1.508 4.475 2.758 1.00 0.00 C ATOM 766 CG1 ILE A 85 2.602 4.500 3.828 1.00 0.00 C ATOM 767 CG2 ILE A 85 0.138 4.678 3.389 1.00 0.00 C ATOM 768 CD1 ILE A 85 2.923 5.889 4.332 1.00 0.00 C ATOM 0 H ILE A 85 2.983 3.521 0.498 1.00 0.00 H new ATOM 0 HA ILE A 85 1.420 2.321 2.682 1.00 0.00 H new ATOM 0 HB ILE A 85 1.690 5.292 2.060 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.291 3.880 4.669 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.508 4.052 3.420 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.125 5.622 3.935 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -0.622 4.700 2.608 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -0.071 3.858 4.077 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.706 5.830 5.088 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.265 6.507 3.502 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.029 6.333 4.770 1.00 0.00 H new ATOM 780 N GLN A 86 -0.307 2.013 0.908 1.00 0.00 N ATOM 781 CA GLN A 86 -1.422 1.870 -0.021 1.00 0.00 C ATOM 782 C GLN A 86 -2.723 1.601 0.729 1.00 0.00 C ATOM 783 O GLN A 86 -2.724 0.969 1.786 1.00 0.00 O ATOM 784 CB GLN A 86 -1.147 0.737 -1.011 1.00 0.00 C ATOM 785 CG GLN A 86 0.142 0.917 -1.798 1.00 0.00 C ATOM 786 CD GLN A 86 0.491 -0.300 -2.631 1.00 0.00 C ATOM 787 OE1 GLN A 86 1.396 -1.062 -2.290 1.00 0.00 O ATOM 788 NE2 GLN A 86 -0.227 -0.489 -3.733 1.00 0.00 N ATOM 0 H GLN A 86 -0.138 1.195 1.494 1.00 0.00 H new ATOM 0 HA GLN A 86 -1.527 2.805 -0.571 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -1.102 -0.207 -0.467 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -1.982 0.664 -1.708 1.00 0.00 H new ATOM 0 HG2 GLN A 86 0.046 1.784 -2.451 1.00 0.00 H new ATOM 0 HG3 GLN A 86 0.959 1.126 -1.107 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -0.968 0.168 -3.978 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -0.037 -1.291 -4.334 1.00 0.00 H new ATOM 797 N LEU A 87 -3.830 2.085 0.175 1.00 0.00 N ATOM 798 CA LEU A 87 -5.138 1.898 0.792 1.00 0.00 C ATOM 799 C LEU A 87 -5.967 0.882 0.011 1.00 0.00 C ATOM 800 O LEU A 87 -6.325 1.113 -1.144 1.00 0.00 O ATOM 801 CB LEU A 87 -5.885 3.231 0.867 1.00 0.00 C ATOM 802 CG LEU A 87 -6.859 3.390 2.035 1.00 0.00 C ATOM 803 CD1 LEU A 87 -6.961 4.849 2.450 1.00 0.00 C ATOM 804 CD2 LEU A 87 -8.229 2.842 1.664 1.00 0.00 C ATOM 0 H LEU A 87 -3.847 2.609 -0.700 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.985 1.517 1.802 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.150 4.034 0.921 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.438 3.367 -0.062 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.478 2.819 2.882 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.659 4.943 3.282 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.979 5.209 2.757 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.319 5.442 1.609 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.910 2.963 2.507 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.617 3.386 0.803 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.143 1.784 1.416 1.00 0.00 H new ATOM 816 N LEU A 88 -6.270 -0.243 0.651 1.00 0.00 N ATOM 817 CA LEU A 88 -7.059 -1.294 0.018 1.00 0.00 C ATOM 818 C LEU A 88 -8.496 -1.278 0.528 1.00 0.00 C ATOM 819 O LEU A 88 -8.791 -0.678 1.561 1.00 0.00 O ATOM 820 CB LEU A 88 -6.427 -2.662 0.282 1.00 0.00 C ATOM 821 CG LEU A 88 -4.925 -2.770 0.017 1.00 0.00 C ATOM 822 CD1 LEU A 88 -4.386 -4.096 0.530 1.00 0.00 C ATOM 823 CD2 LEU A 88 -4.632 -2.612 -1.468 1.00 0.00 C ATOM 0 H LEU A 88 -5.981 -0.450 1.607 1.00 0.00 H new ATOM 0 HA LEU A 88 -7.072 -1.108 -1.056 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -6.612 -2.931 1.322 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -6.938 -3.401 -0.334 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.423 -1.965 0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.316 -4.155 0.332 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.561 -4.169 1.603 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.894 -4.916 0.023 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.558 -2.692 -1.637 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.146 -3.395 -2.026 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.981 -1.636 -1.806 1.00 0.00 H new ATOM 835 N GLN A 89 -9.385 -1.943 -0.202 1.00 0.00 N ATOM 836 CA GLN A 89 -10.791 -2.006 0.178 1.00 0.00 C ATOM 837 C GLN A 89 -11.407 -3.339 -0.235 1.00 0.00 C ATOM 838 O GLN A 89 -11.338 -3.732 -1.399 1.00 0.00 O ATOM 839 CB GLN A 89 -11.567 -0.853 -0.462 1.00 0.00 C ATOM 840 CG GLN A 89 -13.064 -0.911 -0.207 1.00 0.00 C ATOM 841 CD GLN A 89 -13.847 0.013 -1.118 1.00 0.00 C ATOM 842 OE1 GLN A 89 -13.379 0.388 -2.193 1.00 0.00 O ATOM 843 NE2 GLN A 89 -15.048 0.387 -0.692 1.00 0.00 N ATOM 0 H GLN A 89 -9.157 -2.446 -1.060 1.00 0.00 H new ATOM 0 HA GLN A 89 -10.852 -1.918 1.263 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -11.178 0.091 -0.081 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -11.390 -0.860 -1.537 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -13.413 -1.934 -0.346 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -13.262 -0.645 0.831 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -15.398 0.052 0.206 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -15.621 1.009 -1.263 1.00 0.00 H new ATOM 852 N ASP A 90 -12.010 -4.029 0.727 1.00 0.00 N ATOM 853 CA ASP A 90 -12.639 -5.318 0.464 1.00 0.00 C ATOM 854 C ASP A 90 -14.131 -5.149 0.192 1.00 0.00 C ATOM 855 O ASP A 90 -14.693 -4.076 0.408 1.00 0.00 O ATOM 856 CB ASP A 90 -12.427 -6.264 1.647 1.00 0.00 C ATOM 857 CG ASP A 90 -12.864 -5.652 2.963 1.00 0.00 C ATOM 858 OD1 ASP A 90 -14.020 -5.188 3.047 1.00 0.00 O ATOM 859 OD2 ASP A 90 -12.049 -5.638 3.910 1.00 0.00 O ATOM 0 H ASP A 90 -12.076 -3.717 1.696 1.00 0.00 H new ATOM 0 HA ASP A 90 -12.173 -5.748 -0.423 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -12.983 -7.186 1.476 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.373 -6.535 1.708 1.00 0.00 H new ATOM 864 N SER A 91 -14.765 -6.216 -0.283 1.00 0.00 N ATOM 865 CA SER A 91 -16.190 -6.185 -0.589 1.00 0.00 C ATOM 866 C SER A 91 -17.020 -6.159 0.691 1.00 0.00 C ATOM 867 O SER A 91 -18.248 -6.104 0.646 1.00 0.00 O ATOM 868 CB SER A 91 -16.578 -7.398 -1.437 1.00 0.00 C ATOM 869 OG SER A 91 -17.890 -7.259 -1.955 1.00 0.00 O ATOM 0 H SER A 91 -14.314 -7.113 -0.464 1.00 0.00 H new ATOM 0 HA SER A 91 -16.395 -5.275 -1.153 1.00 0.00 H new ATOM 0 HB2 SER A 91 -15.870 -7.514 -2.258 1.00 0.00 H new ATOM 0 HB3 SER A 91 -16.516 -8.303 -0.833 1.00 0.00 H new ATOM 0 HG SER A 91 -18.475 -6.878 -1.267 1.00 0.00 H new ATOM 875 N ASN A 92 -16.339 -6.199 1.831 1.00 0.00 N ATOM 876 CA ASN A 92 -17.012 -6.180 3.125 1.00 0.00 C ATOM 877 C ASN A 92 -16.984 -4.781 3.733 1.00 0.00 C ATOM 878 O ASN A 92 -16.843 -4.623 4.946 1.00 0.00 O ATOM 879 CB ASN A 92 -16.353 -7.177 4.081 1.00 0.00 C ATOM 880 CG ASN A 92 -16.923 -8.576 3.940 1.00 0.00 C ATOM 881 OD1 ASN A 92 -16.927 -9.150 2.851 1.00 0.00 O ATOM 882 ND2 ASN A 92 -17.408 -9.130 5.045 1.00 0.00 N ATOM 0 H ASN A 92 -15.321 -6.245 1.886 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.052 -6.468 2.970 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -15.280 -7.204 3.891 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.486 -6.835 5.107 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -17.805 -10.069 5.013 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -17.384 -8.617 5.926 1.00 0.00 H new ATOM 889 N ARG A 93 -17.120 -3.769 2.882 1.00 0.00 N ATOM 890 CA ARG A 93 -17.109 -2.384 3.335 1.00 0.00 C ATOM 891 C ARG A 93 -16.053 -2.173 4.416 1.00 0.00 C ATOM 892 O ARG A 93 -16.280 -1.455 5.390 1.00 0.00 O ATOM 893 CB ARG A 93 -18.487 -1.989 3.871 1.00 0.00 C ATOM 894 CG ARG A 93 -19.628 -2.334 2.928 1.00 0.00 C ATOM 895 CD ARG A 93 -20.915 -2.610 3.688 1.00 0.00 C ATOM 896 NE ARG A 93 -21.924 -3.247 2.845 1.00 0.00 N ATOM 897 CZ ARG A 93 -22.984 -3.887 3.324 1.00 0.00 C ATOM 898 NH1 ARG A 93 -23.175 -3.975 4.633 1.00 0.00 N ATOM 899 NH2 ARG A 93 -23.858 -4.441 2.493 1.00 0.00 N ATOM 0 H ARG A 93 -17.239 -3.883 1.875 1.00 0.00 H new ATOM 0 HA ARG A 93 -16.863 -1.752 2.482 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -18.653 -2.487 4.826 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -18.499 -0.916 4.065 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -19.786 -1.512 2.230 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -19.360 -3.208 2.335 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -20.700 -3.251 4.543 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -21.311 -1.674 4.082 1.00 0.00 H new ATOM 0 HE ARG A 93 -21.808 -3.197 1.833 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -22.506 -3.550 5.276 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -23.991 -4.467 4.997 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -23.716 -4.375 1.485 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -24.672 -4.932 2.862 1.00 0.00 H new ATOM 913 N PHE A 94 -14.897 -2.805 4.237 1.00 0.00 N ATOM 914 CA PHE A 94 -13.806 -2.688 5.198 1.00 0.00 C ATOM 915 C PHE A 94 -12.483 -2.414 4.487 1.00 0.00 C ATOM 916 O PHE A 94 -12.060 -3.181 3.622 1.00 0.00 O ATOM 917 CB PHE A 94 -13.694 -3.965 6.033 1.00 0.00 C ATOM 918 CG PHE A 94 -14.948 -4.298 6.790 1.00 0.00 C ATOM 919 CD1 PHE A 94 -15.716 -3.295 7.358 1.00 0.00 C ATOM 920 CD2 PHE A 94 -15.357 -5.614 6.934 1.00 0.00 C ATOM 921 CE1 PHE A 94 -16.871 -3.597 8.056 1.00 0.00 C ATOM 922 CE2 PHE A 94 -16.511 -5.922 7.630 1.00 0.00 C ATOM 923 CZ PHE A 94 -17.268 -4.913 8.193 1.00 0.00 C ATOM 0 H PHE A 94 -14.692 -3.403 3.436 1.00 0.00 H new ATOM 0 HA PHE A 94 -14.025 -1.849 5.858 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.443 -4.798 5.376 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -12.871 -3.857 6.739 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -15.409 -2.265 7.255 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -14.768 -6.407 6.498 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -17.462 -2.805 8.493 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -16.821 -6.951 7.734 1.00 0.00 H new ATOM 0 HZ PHE A 94 -18.168 -5.153 8.739 1.00 0.00 H new ATOM 933 N PHE A 95 -11.836 -1.314 4.858 1.00 0.00 N ATOM 934 CA PHE A 95 -10.563 -0.937 4.256 1.00 0.00 C ATOM 935 C PHE A 95 -9.394 -1.505 5.055 1.00 0.00 C ATOM 936 O PHE A 95 -9.541 -1.865 6.224 1.00 0.00 O ATOM 937 CB PHE A 95 -10.445 0.586 4.173 1.00 0.00 C ATOM 938 CG PHE A 95 -11.605 1.240 3.478 1.00 0.00 C ATOM 939 CD1 PHE A 95 -12.795 1.467 4.150 1.00 0.00 C ATOM 940 CD2 PHE A 95 -11.505 1.627 2.151 1.00 0.00 C ATOM 941 CE1 PHE A 95 -13.864 2.068 3.513 1.00 0.00 C ATOM 942 CE2 PHE A 95 -12.570 2.230 1.509 1.00 0.00 C ATOM 943 CZ PHE A 95 -13.752 2.449 2.190 1.00 0.00 C ATOM 0 H PHE A 95 -12.172 -0.668 5.572 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.529 -1.353 3.249 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.360 0.991 5.181 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.525 0.843 3.648 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -12.888 1.171 5.184 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.585 1.455 1.613 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.786 2.240 4.049 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -12.478 2.530 0.476 1.00 0.00 H new ATOM 0 HZ PHE A 95 -14.587 2.917 1.689 1.00 0.00 H new ATOM 953 N THR A 96 -8.231 -1.585 4.416 1.00 0.00 N ATOM 954 CA THR A 96 -7.036 -2.112 5.065 1.00 0.00 C ATOM 955 C THR A 96 -5.793 -1.339 4.638 1.00 0.00 C ATOM 956 O THR A 96 -5.476 -1.261 3.451 1.00 0.00 O ATOM 957 CB THR A 96 -6.834 -3.604 4.743 1.00 0.00 C ATOM 958 OG1 THR A 96 -8.055 -4.321 4.958 1.00 0.00 O ATOM 959 CG2 THR A 96 -5.732 -4.199 5.607 1.00 0.00 C ATOM 0 H THR A 96 -8.091 -1.291 3.449 1.00 0.00 H new ATOM 0 HA THR A 96 -7.182 -1.996 6.139 1.00 0.00 H new ATOM 0 HB THR A 96 -6.541 -3.691 3.697 1.00 0.00 H new ATOM 0 HG1 THR A 96 -7.964 -4.892 5.749 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.607 -5.254 5.362 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.798 -3.670 5.420 1.00 0.00 H new ATOM 0 HG23 THR A 96 -6.001 -4.100 6.659 1.00 0.00 H new ATOM 967 N CYS A 97 -5.093 -0.770 5.613 1.00 0.00 N ATOM 968 CA CYS A 97 -3.884 -0.002 5.338 1.00 0.00 C ATOM 969 C CYS A 97 -2.666 -0.917 5.259 1.00 0.00 C ATOM 970 O CYS A 97 -2.184 -1.414 6.277 1.00 0.00 O ATOM 971 CB CYS A 97 -3.671 1.059 6.419 1.00 0.00 C ATOM 972 SG CYS A 97 -4.717 2.522 6.234 1.00 0.00 S ATOM 0 H CYS A 97 -5.342 -0.826 6.601 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.008 0.492 4.375 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.860 0.611 7.395 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.626 1.369 6.408 1.00 0.00 H new ATOM 0 HG CYS A 97 -5.475 2.649 7.283 1.00 0.00 H new ATOM 978 N TRP A 98 -2.175 -1.135 4.045 1.00 0.00 N ATOM 979 CA TRP A 98 -1.014 -1.992 3.833 1.00 0.00 C ATOM 980 C TRP A 98 0.281 -1.201 3.983 1.00 0.00 C ATOM 981 O TRP A 98 0.578 -0.320 3.178 1.00 0.00 O ATOM 982 CB TRP A 98 -1.075 -2.635 2.446 1.00 0.00 C ATOM 983 CG TRP A 98 0.222 -3.252 2.020 1.00 0.00 C ATOM 984 CD1 TRP A 98 1.096 -2.764 1.090 1.00 0.00 C ATOM 985 CD2 TRP A 98 0.792 -4.473 2.506 1.00 0.00 C ATOM 986 NE1 TRP A 98 2.173 -3.608 0.969 1.00 0.00 N ATOM 987 CE2 TRP A 98 2.011 -4.663 1.827 1.00 0.00 C ATOM 988 CE3 TRP A 98 0.391 -5.422 3.450 1.00 0.00 C ATOM 989 CZ2 TRP A 98 2.830 -5.764 2.063 1.00 0.00 C ATOM 990 CZ3 TRP A 98 1.205 -6.514 3.683 1.00 0.00 C ATOM 991 CH2 TRP A 98 2.413 -6.678 2.993 1.00 0.00 C ATOM 0 H TRP A 98 -2.562 -0.731 3.192 1.00 0.00 H new ATOM 0 HA TRP A 98 -1.029 -2.776 4.590 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -1.852 -3.400 2.442 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -1.367 -1.880 1.716 1.00 0.00 H new ATOM 0 HD1 TRP A 98 0.960 -1.849 0.532 1.00 0.00 H new ATOM 0 HE1 TRP A 98 2.965 -3.471 0.341 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -0.538 -5.304 3.988 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 3.761 -5.892 1.531 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.905 -7.254 4.410 1.00 0.00 H new ATOM 0 HH2 TRP A 98 3.027 -7.542 3.199 1.00 0.00 H new ATOM 1002 N ASN A 99 1.049 -1.523 5.020 1.00 0.00 N ATOM 1003 CA ASN A 99 2.312 -0.841 5.275 1.00 0.00 C ATOM 1004 C ASN A 99 3.480 -1.821 5.220 1.00 0.00 C ATOM 1005 O ASN A 99 3.542 -2.773 5.999 1.00 0.00 O ATOM 1006 CB ASN A 99 2.276 -0.149 6.639 1.00 0.00 C ATOM 1007 CG ASN A 99 1.736 1.265 6.556 1.00 0.00 C ATOM 1008 OD1 ASN A 99 2.373 2.213 7.016 1.00 0.00 O ATOM 1009 ND2 ASN A 99 0.555 1.414 5.968 1.00 0.00 N ATOM 0 H ASN A 99 0.818 -2.251 5.696 1.00 0.00 H new ATOM 0 HA ASN A 99 2.454 -0.090 4.498 1.00 0.00 H new ATOM 0 HB2 ASN A 99 1.658 -0.731 7.323 1.00 0.00 H new ATOM 0 HB3 ASN A 99 3.282 -0.127 7.059 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.141 2.342 5.883 1.00 0.00 H new ATOM 0 HD22 ASN A 99 0.062 0.600 5.601 1.00 0.00 H new ATOM 1016 N ARG A 100 4.404 -1.581 4.296 1.00 0.00 N ATOM 1017 CA ARG A 100 5.569 -2.443 4.139 1.00 0.00 C ATOM 1018 C ARG A 100 6.859 -1.629 4.198 1.00 0.00 C ATOM 1019 O ARG A 100 6.978 -0.589 3.550 1.00 0.00 O ATOM 1020 CB ARG A 100 5.493 -3.203 2.814 1.00 0.00 C ATOM 1021 CG ARG A 100 6.751 -3.994 2.492 1.00 0.00 C ATOM 1022 CD ARG A 100 6.728 -4.522 1.066 1.00 0.00 C ATOM 1023 NE ARG A 100 8.071 -4.804 0.565 1.00 0.00 N ATOM 1024 CZ ARG A 100 8.347 -5.020 -0.716 1.00 0.00 C ATOM 1025 NH1 ARG A 100 7.379 -4.985 -1.621 1.00 0.00 N ATOM 1026 NH2 ARG A 100 9.594 -5.270 -1.094 1.00 0.00 N ATOM 0 H ARG A 100 4.369 -0.797 3.645 1.00 0.00 H new ATOM 0 HA ARG A 100 5.573 -3.159 4.961 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.643 -3.885 2.844 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.304 -2.494 2.008 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.626 -3.360 2.632 1.00 0.00 H new ATOM 0 HG3 ARG A 100 6.846 -4.827 3.188 1.00 0.00 H new ATOM 0 HD2 ARG A 100 6.128 -5.431 1.026 1.00 0.00 H new ATOM 0 HD3 ARG A 100 6.245 -3.792 0.417 1.00 0.00 H new ATOM 0 HE ARG A 100 8.839 -4.837 1.236 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.419 -4.792 -1.334 1.00 0.00 H new ATOM 0 HH12 ARG A 100 7.594 -5.151 -2.604 1.00 0.00 H new ATOM 0 HH21 ARG A 100 10.342 -5.296 -0.401 1.00 0.00 H new ATOM 0 HH22 ARG A 100 9.805 -5.436 -2.078 1.00 0.00 H new ATOM 1040 N TRP A 101 7.820 -2.110 4.977 1.00 0.00 N ATOM 1041 CA TRP A 101 9.101 -1.427 5.121 1.00 0.00 C ATOM 1042 C TRP A 101 10.248 -2.429 5.188 1.00 0.00 C ATOM 1043 O TRP A 101 10.026 -3.637 5.253 1.00 0.00 O ATOM 1044 CB TRP A 101 9.098 -0.552 6.376 1.00 0.00 C ATOM 1045 CG TRP A 101 9.031 -1.340 7.649 1.00 0.00 C ATOM 1046 CD1 TRP A 101 10.067 -1.968 8.280 1.00 0.00 C ATOM 1047 CD2 TRP A 101 7.866 -1.586 8.444 1.00 0.00 C ATOM 1048 NE1 TRP A 101 9.616 -2.589 9.420 1.00 0.00 N ATOM 1049 CE2 TRP A 101 8.270 -2.369 9.543 1.00 0.00 C ATOM 1050 CE3 TRP A 101 6.522 -1.220 8.336 1.00 0.00 C ATOM 1051 CZ2 TRP A 101 7.377 -2.791 10.525 1.00 0.00 C ATOM 1052 CZ3 TRP A 101 5.637 -1.639 9.311 1.00 0.00 C ATOM 1053 CH2 TRP A 101 6.067 -2.418 10.394 1.00 0.00 C ATOM 0 H TRP A 101 7.737 -2.970 5.519 1.00 0.00 H new ATOM 0 HA TRP A 101 9.247 -0.794 4.246 1.00 0.00 H new ATOM 0 HB2 TRP A 101 9.998 0.062 6.384 1.00 0.00 H new ATOM 0 HB3 TRP A 101 8.248 0.129 6.333 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.090 -1.975 7.934 1.00 0.00 H new ATOM 0 HE1 TRP A 101 10.191 -3.127 10.069 1.00 0.00 H new ATOM 0 HE3 TRP A 101 6.181 -0.620 7.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 7.707 -3.391 11.360 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 4.596 -1.361 9.237 1.00 0.00 H new ATOM 0 HH2 TRP A 101 5.351 -2.730 11.140 1.00 0.00 H new ATOM 1064 N GLY A 102 11.476 -1.919 5.170 1.00 0.00 N ATOM 1065 CA GLY A 102 12.640 -2.784 5.230 1.00 0.00 C ATOM 1066 C GLY A 102 13.871 -2.142 4.623 1.00 0.00 C ATOM 1067 O GLY A 102 14.135 -0.959 4.844 1.00 0.00 O ATOM 0 H GLY A 102 11.685 -0.922 5.115 1.00 0.00 H new ATOM 0 HA2 GLY A 102 12.844 -3.042 6.269 1.00 0.00 H new ATOM 0 HA3 GLY A 102 12.424 -3.715 4.706 1.00 0.00 H new ATOM 1071 N ARG A 103 14.628 -2.921 3.858 1.00 0.00 N ATOM 1072 CA ARG A 103 15.841 -2.422 3.221 1.00 0.00 C ATOM 1073 C ARG A 103 15.659 -2.324 1.709 1.00 0.00 C ATOM 1074 O ARG A 103 15.250 -3.286 1.059 1.00 0.00 O ATOM 1075 CB ARG A 103 17.025 -3.334 3.545 1.00 0.00 C ATOM 1076 CG ARG A 103 17.789 -2.919 4.793 1.00 0.00 C ATOM 1077 CD ARG A 103 19.152 -3.591 4.860 1.00 0.00 C ATOM 1078 NE ARG A 103 19.782 -3.420 6.166 1.00 0.00 N ATOM 1079 CZ ARG A 103 19.359 -4.023 7.272 1.00 0.00 C ATOM 1080 NH1 ARG A 103 18.310 -4.833 7.229 1.00 0.00 N ATOM 1081 NH2 ARG A 103 19.985 -3.816 8.423 1.00 0.00 N ATOM 0 H ARG A 103 14.423 -3.901 3.664 1.00 0.00 H new ATOM 0 HA ARG A 103 16.043 -1.424 3.611 1.00 0.00 H new ATOM 0 HB2 ARG A 103 16.663 -4.354 3.673 1.00 0.00 H new ATOM 0 HB3 ARG A 103 17.709 -3.343 2.696 1.00 0.00 H new ATOM 0 HG2 ARG A 103 17.915 -1.836 4.801 1.00 0.00 H new ATOM 0 HG3 ARG A 103 17.210 -3.179 5.679 1.00 0.00 H new ATOM 0 HD2 ARG A 103 19.043 -4.654 4.646 1.00 0.00 H new ATOM 0 HD3 ARG A 103 19.800 -3.176 4.088 1.00 0.00 H new ATOM 0 HE ARG A 103 20.592 -2.803 6.233 1.00 0.00 H new ATOM 0 HH11 ARG A 103 17.826 -4.994 6.346 1.00 0.00 H new ATOM 0 HH12 ARG A 103 17.987 -5.295 8.079 1.00 0.00 H new ATOM 0 HH21 ARG A 103 20.792 -3.193 8.460 1.00 0.00 H new ATOM 0 HH22 ARG A 103 19.659 -4.279 9.271 1.00 0.00 H new ATOM 1095 N VAL A 104 15.967 -1.155 1.156 1.00 0.00 N ATOM 1096 CA VAL A 104 15.838 -0.931 -0.279 1.00 0.00 C ATOM 1097 C VAL A 104 16.507 -2.049 -1.072 1.00 0.00 C ATOM 1098 O VAL A 104 17.721 -2.232 -1.003 1.00 0.00 O ATOM 1099 CB VAL A 104 16.455 0.417 -0.694 1.00 0.00 C ATOM 1100 CG1 VAL A 104 16.584 0.503 -2.207 1.00 0.00 C ATOM 1101 CG2 VAL A 104 15.624 1.572 -0.155 1.00 0.00 C ATOM 0 H VAL A 104 16.307 -0.349 1.680 1.00 0.00 H new ATOM 0 HA VAL A 104 14.771 -0.918 -0.503 1.00 0.00 H new ATOM 0 HB VAL A 104 17.454 0.487 -0.264 1.00 0.00 H new ATOM 0 HG11 VAL A 104 17.022 1.463 -2.481 1.00 0.00 H new ATOM 0 HG12 VAL A 104 17.225 -0.303 -2.564 1.00 0.00 H new ATOM 0 HG13 VAL A 104 15.598 0.411 -2.662 1.00 0.00 H new ATOM 0 HG21 VAL A 104 16.075 2.517 -0.458 1.00 0.00 H new ATOM 0 HG22 VAL A 104 14.611 1.509 -0.554 1.00 0.00 H new ATOM 0 HG23 VAL A 104 15.590 1.519 0.933 1.00 0.00 H new ATOM 1111 N GLY A 105 15.704 -2.794 -1.826 1.00 0.00 N ATOM 1112 CA GLY A 105 16.236 -3.885 -2.621 1.00 0.00 C ATOM 1113 C GLY A 105 15.682 -5.233 -2.202 1.00 0.00 C ATOM 1114 O GLY A 105 15.474 -6.112 -3.037 1.00 0.00 O ATOM 0 H GLY A 105 14.695 -2.661 -1.900 1.00 0.00 H new ATOM 0 HA2 GLY A 105 16.004 -3.711 -3.672 1.00 0.00 H new ATOM 0 HA3 GLY A 105 17.322 -3.899 -2.532 1.00 0.00 H new ATOM 1118 N GLU A 106 15.445 -5.395 -0.904 1.00 0.00 N ATOM 1119 CA GLU A 106 14.914 -6.647 -0.376 1.00 0.00 C ATOM 1120 C GLU A 106 13.428 -6.516 -0.057 1.00 0.00 C ATOM 1121 O GLU A 106 12.854 -5.430 -0.150 1.00 0.00 O ATOM 1122 CB GLU A 106 15.682 -7.062 0.881 1.00 0.00 C ATOM 1123 CG GLU A 106 15.404 -6.177 2.084 1.00 0.00 C ATOM 1124 CD GLU A 106 15.595 -6.905 3.400 1.00 0.00 C ATOM 1125 OE1 GLU A 106 15.538 -8.152 3.403 1.00 0.00 O ATOM 1126 OE2 GLU A 106 15.801 -6.226 4.428 1.00 0.00 O ATOM 0 H GLU A 106 15.612 -4.676 -0.200 1.00 0.00 H new ATOM 0 HA GLU A 106 15.038 -7.415 -1.139 1.00 0.00 H new ATOM 0 HB2 GLU A 106 15.425 -8.091 1.131 1.00 0.00 H new ATOM 0 HB3 GLU A 106 16.750 -7.044 0.666 1.00 0.00 H new ATOM 0 HG2 GLU A 106 16.064 -5.310 2.053 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.382 -5.801 2.026 1.00 0.00 H new ATOM 1133 N VAL A 107 12.809 -7.631 0.318 1.00 0.00 N ATOM 1134 CA VAL A 107 11.389 -7.642 0.652 1.00 0.00 C ATOM 1135 C VAL A 107 11.123 -6.887 1.949 1.00 0.00 C ATOM 1136 O VAL A 107 10.198 -6.080 2.032 1.00 0.00 O ATOM 1137 CB VAL A 107 10.856 -9.080 0.789 1.00 0.00 C ATOM 1138 CG1 VAL A 107 9.378 -9.070 1.145 1.00 0.00 C ATOM 1139 CG2 VAL A 107 11.100 -9.863 -0.492 1.00 0.00 C ATOM 0 H VAL A 107 13.268 -8.538 0.398 1.00 0.00 H new ATOM 0 HA VAL A 107 10.868 -7.146 -0.167 1.00 0.00 H new ATOM 0 HB VAL A 107 11.396 -9.574 1.597 1.00 0.00 H new ATOM 0 HG11 VAL A 107 9.019 -10.095 1.238 1.00 0.00 H new ATOM 0 HG12 VAL A 107 9.235 -8.549 2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.818 -8.559 0.361 1.00 0.00 H new ATOM 0 HG21 VAL A 107 10.717 -10.877 -0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.588 -9.374 -1.321 1.00 0.00 H new ATOM 0 HG23 VAL A 107 12.170 -9.900 -0.697 1.00 0.00 H new ATOM 1149 N GLY A 108 11.943 -7.154 2.962 1.00 0.00 N ATOM 1150 CA GLY A 108 11.780 -6.491 4.242 1.00 0.00 C ATOM 1151 C GLY A 108 10.608 -7.037 5.033 1.00 0.00 C ATOM 1152 O GLY A 108 10.126 -8.136 4.760 1.00 0.00 O ATOM 0 H GLY A 108 12.717 -7.817 2.918 1.00 0.00 H new ATOM 0 HA2 GLY A 108 12.693 -6.606 4.826 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.638 -5.423 4.079 1.00 0.00 H new ATOM 1156 N GLN A 109 10.150 -6.270 6.017 1.00 0.00 N ATOM 1157 CA GLN A 109 9.029 -6.685 6.851 1.00 0.00 C ATOM 1158 C GLN A 109 7.702 -6.446 6.138 1.00 0.00 C ATOM 1159 O GLN A 109 7.674 -6.030 4.980 1.00 0.00 O ATOM 1160 CB GLN A 109 9.050 -5.932 8.182 1.00 0.00 C ATOM 1161 CG GLN A 109 10.191 -6.345 9.097 1.00 0.00 C ATOM 1162 CD GLN A 109 10.114 -7.804 9.504 1.00 0.00 C ATOM 1163 OE1 GLN A 109 10.538 -8.690 8.761 1.00 0.00 O ATOM 1164 NE2 GLN A 109 9.573 -8.061 10.688 1.00 0.00 N ATOM 0 H GLN A 109 10.538 -5.358 6.256 1.00 0.00 H new ATOM 0 HA GLN A 109 9.129 -7.753 7.045 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.123 -4.863 7.984 1.00 0.00 H new ATOM 0 HB3 GLN A 109 8.104 -6.096 8.698 1.00 0.00 H new ATOM 0 HG2 GLN A 109 11.140 -6.162 8.593 1.00 0.00 H new ATOM 0 HG3 GLN A 109 10.179 -5.721 9.991 1.00 0.00 H new ATOM 0 HE21 GLN A 109 9.235 -7.296 11.271 1.00 0.00 H new ATOM 0 HE22 GLN A 109 9.496 -9.024 11.015 1.00 0.00 H new ATOM 1173 N SER A 110 6.604 -6.712 6.838 1.00 0.00 N ATOM 1174 CA SER A 110 5.273 -6.529 6.271 1.00 0.00 C ATOM 1175 C SER A 110 4.239 -6.305 7.371 1.00 0.00 C ATOM 1176 O SER A 110 4.071 -7.139 8.261 1.00 0.00 O ATOM 1177 CB SER A 110 4.883 -7.746 5.429 1.00 0.00 C ATOM 1178 OG SER A 110 4.850 -8.922 6.218 1.00 0.00 O ATOM 0 H SER A 110 6.610 -7.055 7.799 1.00 0.00 H new ATOM 0 HA SER A 110 5.295 -5.646 5.633 1.00 0.00 H new ATOM 0 HB2 SER A 110 3.905 -7.581 4.976 1.00 0.00 H new ATOM 0 HB3 SER A 110 5.595 -7.871 4.613 1.00 0.00 H new ATOM 0 HG SER A 110 4.663 -8.685 7.150 1.00 0.00 H new ATOM 1184 N LYS A 111 3.549 -5.172 7.303 1.00 0.00 N ATOM 1185 CA LYS A 111 2.530 -4.836 8.291 1.00 0.00 C ATOM 1186 C LYS A 111 1.213 -4.474 7.612 1.00 0.00 C ATOM 1187 O LYS A 111 1.200 -3.806 6.577 1.00 0.00 O ATOM 1188 CB LYS A 111 3.003 -3.672 9.165 1.00 0.00 C ATOM 1189 CG LYS A 111 1.965 -3.207 10.171 1.00 0.00 C ATOM 1190 CD LYS A 111 1.891 -4.140 11.368 1.00 0.00 C ATOM 1191 CE LYS A 111 3.027 -3.883 12.346 1.00 0.00 C ATOM 1192 NZ LYS A 111 2.973 -4.806 13.514 1.00 0.00 N ATOM 0 H LYS A 111 3.677 -4.470 6.574 1.00 0.00 H new ATOM 0 HA LYS A 111 2.366 -5.711 8.920 1.00 0.00 H new ATOM 0 HB2 LYS A 111 3.905 -3.972 9.698 1.00 0.00 H new ATOM 0 HB3 LYS A 111 3.276 -2.834 8.523 1.00 0.00 H new ATOM 0 HG2 LYS A 111 2.210 -2.200 10.508 1.00 0.00 H new ATOM 0 HG3 LYS A 111 0.989 -3.154 9.689 1.00 0.00 H new ATOM 0 HD2 LYS A 111 0.936 -4.007 11.876 1.00 0.00 H new ATOM 0 HD3 LYS A 111 1.930 -5.175 11.027 1.00 0.00 H new ATOM 0 HE2 LYS A 111 3.982 -4.002 11.833 1.00 0.00 H new ATOM 0 HE3 LYS A 111 2.979 -2.852 12.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 3.764 -4.599 14.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 2.073 -4.675 14.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 3.045 -5.789 13.183 1.00 0.00 H new ATOM 1206 N ILE A 112 0.108 -4.916 8.202 1.00 0.00 N ATOM 1207 CA ILE A 112 -1.214 -4.636 7.655 1.00 0.00 C ATOM 1208 C ILE A 112 -2.184 -4.211 8.752 1.00 0.00 C ATOM 1209 O ILE A 112 -2.167 -4.755 9.855 1.00 0.00 O ATOM 1210 CB ILE A 112 -1.791 -5.861 6.922 1.00 0.00 C ATOM 1211 CG1 ILE A 112 -3.032 -5.464 6.119 1.00 0.00 C ATOM 1212 CG2 ILE A 112 -2.126 -6.964 7.915 1.00 0.00 C ATOM 1213 CD1 ILE A 112 -3.284 -6.350 4.919 1.00 0.00 C ATOM 0 H ILE A 112 0.102 -5.469 9.059 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.094 -3.820 6.943 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.039 -6.239 6.230 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.903 -5.495 6.773 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.923 -4.433 5.783 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.533 -7.823 7.381 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.222 -7.262 8.447 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -2.863 -6.599 8.630 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.179 -6.010 4.397 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.430 -6.300 4.244 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.425 -7.379 5.250 1.00 0.00 H new ATOM 1225 N ASN A 113 -3.030 -3.234 8.441 1.00 0.00 N ATOM 1226 CA ASN A 113 -4.009 -2.736 9.400 1.00 0.00 C ATOM 1227 C ASN A 113 -5.406 -2.706 8.786 1.00 0.00 C ATOM 1228 O ASN A 113 -5.586 -2.271 7.648 1.00 0.00 O ATOM 1229 CB ASN A 113 -3.620 -1.336 9.877 1.00 0.00 C ATOM 1230 CG ASN A 113 -2.179 -1.264 10.346 1.00 0.00 C ATOM 1231 OD1 ASN A 113 -1.355 -0.571 9.750 1.00 0.00 O ATOM 1232 ND2 ASN A 113 -1.870 -1.984 11.418 1.00 0.00 N ATOM 0 H ASN A 113 -3.057 -2.772 7.532 1.00 0.00 H new ATOM 0 HA ASN A 113 -4.021 -3.413 10.254 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -3.771 -0.624 9.066 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -4.280 -1.036 10.691 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.916 -1.977 11.779 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -2.586 -2.544 11.880 1.00 0.00 H new ATOM 1239 N HIS A 114 -6.391 -3.171 9.548 1.00 0.00 N ATOM 1240 CA HIS A 114 -7.772 -3.196 9.080 1.00 0.00 C ATOM 1241 C HIS A 114 -8.603 -2.124 9.779 1.00 0.00 C ATOM 1242 O HIS A 114 -8.631 -2.049 11.007 1.00 0.00 O ATOM 1243 CB HIS A 114 -8.389 -4.574 9.321 1.00 0.00 C ATOM 1244 CG HIS A 114 -7.547 -5.705 8.816 1.00 0.00 C ATOM 1245 ND1 HIS A 114 -7.587 -6.150 7.512 1.00 0.00 N ATOM 1246 CD2 HIS A 114 -6.635 -6.480 9.449 1.00 0.00 C ATOM 1247 CE1 HIS A 114 -6.739 -7.152 7.364 1.00 0.00 C ATOM 1248 NE2 HIS A 114 -6.148 -7.372 8.525 1.00 0.00 N ATOM 0 H HIS A 114 -6.259 -3.535 10.491 1.00 0.00 H new ATOM 0 HA HIS A 114 -7.771 -2.989 8.010 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -8.556 -4.706 10.390 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -9.365 -4.615 8.838 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -6.345 -6.410 10.487 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -6.559 -7.698 6.450 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -5.444 -8.088 8.706 1.00 0.00 H new ATOM 1256 N PHE A 115 -9.278 -1.296 8.988 1.00 0.00 N ATOM 1257 CA PHE A 115 -10.107 -0.227 9.532 1.00 0.00 C ATOM 1258 C PHE A 115 -11.558 -0.385 9.086 1.00 0.00 C ATOM 1259 O PHE A 115 -11.838 -0.597 7.906 1.00 0.00 O ATOM 1260 CB PHE A 115 -9.572 1.137 9.091 1.00 0.00 C ATOM 1261 CG PHE A 115 -8.223 1.465 9.663 1.00 0.00 C ATOM 1262 CD1 PHE A 115 -8.096 1.883 10.978 1.00 0.00 C ATOM 1263 CD2 PHE A 115 -7.081 1.355 8.886 1.00 0.00 C ATOM 1264 CE1 PHE A 115 -6.855 2.186 11.506 1.00 0.00 C ATOM 1265 CE2 PHE A 115 -5.837 1.656 9.409 1.00 0.00 C ATOM 1266 CZ PHE A 115 -5.725 2.071 10.721 1.00 0.00 C ATOM 0 H PHE A 115 -9.267 -1.345 7.969 1.00 0.00 H new ATOM 0 HA PHE A 115 -10.070 -0.289 10.620 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.512 1.160 8.003 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -10.281 1.910 9.388 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -8.976 1.973 11.597 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -7.164 1.030 7.859 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.769 2.512 12.532 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -4.955 1.567 8.793 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.755 2.305 11.133 1.00 0.00 H new ATOM 1276 N THR A 116 -12.479 -0.280 10.039 1.00 0.00 N ATOM 1277 CA THR A 116 -13.900 -0.412 9.747 1.00 0.00 C ATOM 1278 C THR A 116 -14.431 0.822 9.027 1.00 0.00 C ATOM 1279 O THR A 116 -15.241 0.715 8.106 1.00 0.00 O ATOM 1280 CB THR A 116 -14.720 -0.635 11.032 1.00 0.00 C ATOM 1281 OG1 THR A 116 -14.530 0.464 11.931 1.00 0.00 O ATOM 1282 CG2 THR A 116 -14.313 -1.931 11.716 1.00 0.00 C ATOM 0 H THR A 116 -12.265 -0.104 11.021 1.00 0.00 H new ATOM 0 HA THR A 116 -14.009 -1.282 9.100 1.00 0.00 H new ATOM 0 HB THR A 116 -15.773 -0.703 10.757 1.00 0.00 H new ATOM 0 HG1 THR A 116 -15.056 0.316 12.745 1.00 0.00 H new ATOM 0 HG21 THR A 116 -14.906 -2.067 12.621 1.00 0.00 H new ATOM 0 HG22 THR A 116 -14.485 -2.769 11.040 1.00 0.00 H new ATOM 0 HG23 THR A 116 -13.256 -1.888 11.978 1.00 0.00 H new ATOM 1290 N ARG A 117 -13.969 1.994 9.452 1.00 0.00 N ATOM 1291 CA ARG A 117 -14.398 3.249 8.847 1.00 0.00 C ATOM 1292 C ARG A 117 -13.435 3.679 7.745 1.00 0.00 C ATOM 1293 O ARG A 117 -12.232 3.427 7.824 1.00 0.00 O ATOM 1294 CB ARG A 117 -14.496 4.345 9.910 1.00 0.00 C ATOM 1295 CG ARG A 117 -15.823 4.358 10.650 1.00 0.00 C ATOM 1296 CD ARG A 117 -16.032 5.668 11.395 1.00 0.00 C ATOM 1297 NE ARG A 117 -17.029 5.542 12.455 1.00 0.00 N ATOM 1298 CZ ARG A 117 -17.351 6.530 13.282 1.00 0.00 C ATOM 1299 NH1 ARG A 117 -16.758 7.710 13.173 1.00 0.00 N ATOM 1300 NH2 ARG A 117 -18.269 6.338 14.221 1.00 0.00 N ATOM 0 H ARG A 117 -13.298 2.100 10.213 1.00 0.00 H new ATOM 0 HA ARG A 117 -15.382 3.092 8.405 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -13.689 4.214 10.631 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -14.345 5.314 9.435 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -16.638 4.207 9.942 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -15.856 3.528 11.355 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -15.085 5.996 11.825 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -16.346 6.439 10.691 1.00 0.00 H new ATOM 0 HE ARG A 117 -17.504 4.646 12.566 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -16.052 7.861 12.452 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -17.007 8.467 13.810 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -18.728 5.431 14.308 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -18.516 7.097 14.856 1.00 0.00 H new ATOM 1314 N LEU A 118 -13.971 4.327 6.717 1.00 0.00 N ATOM 1315 CA LEU A 118 -13.159 4.792 5.598 1.00 0.00 C ATOM 1316 C LEU A 118 -12.256 5.945 6.022 1.00 0.00 C ATOM 1317 O LEU A 118 -11.031 5.838 5.969 1.00 0.00 O ATOM 1318 CB LEU A 118 -14.056 5.232 4.439 1.00 0.00 C ATOM 1319 CG LEU A 118 -13.365 5.991 3.306 1.00 0.00 C ATOM 1320 CD1 LEU A 118 -12.297 5.124 2.657 1.00 0.00 C ATOM 1321 CD2 LEU A 118 -14.384 6.449 2.272 1.00 0.00 C ATOM 0 H LEU A 118 -14.965 4.542 6.635 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.530 3.964 5.269 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -14.533 4.347 4.018 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -14.850 5.862 4.840 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.882 6.873 3.726 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -11.816 5.681 1.853 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.552 4.846 3.402 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -12.757 4.223 2.250 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -13.875 6.988 1.473 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -14.896 5.581 1.856 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -15.113 7.107 2.746 1.00 0.00 H new ATOM 1333 N GLU A 119 -12.869 7.046 6.445 1.00 0.00 N ATOM 1334 CA GLU A 119 -12.119 8.219 6.880 1.00 0.00 C ATOM 1335 C GLU A 119 -10.974 7.819 7.807 1.00 0.00 C ATOM 1336 O GLU A 119 -9.832 8.235 7.615 1.00 0.00 O ATOM 1337 CB GLU A 119 -13.044 9.208 7.592 1.00 0.00 C ATOM 1338 CG GLU A 119 -13.996 9.933 6.655 1.00 0.00 C ATOM 1339 CD GLU A 119 -14.523 11.226 7.245 1.00 0.00 C ATOM 1340 OE1 GLU A 119 -14.742 11.273 8.473 1.00 0.00 O ATOM 1341 OE2 GLU A 119 -14.717 12.192 6.477 1.00 0.00 O ATOM 0 H GLU A 119 -13.882 7.150 6.496 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.698 8.698 5.996 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -13.624 8.673 8.344 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -12.438 9.943 8.121 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -13.483 10.148 5.717 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.834 9.278 6.417 1.00 0.00 H new ATOM 1348 N ASP A 120 -11.290 7.011 8.813 1.00 0.00 N ATOM 1349 CA ASP A 120 -10.289 6.554 9.770 1.00 0.00 C ATOM 1350 C ASP A 120 -9.020 6.102 9.055 1.00 0.00 C ATOM 1351 O ASP A 120 -7.915 6.507 9.416 1.00 0.00 O ATOM 1352 CB ASP A 120 -10.847 5.408 10.616 1.00 0.00 C ATOM 1353 CG ASP A 120 -9.979 5.101 11.820 1.00 0.00 C ATOM 1354 OD1 ASP A 120 -8.761 5.372 11.757 1.00 0.00 O ATOM 1355 OD2 ASP A 120 -10.516 4.590 12.825 1.00 0.00 O ATOM 0 H ASP A 120 -12.231 6.659 8.987 1.00 0.00 H new ATOM 0 HA ASP A 120 -10.039 7.390 10.423 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -11.852 5.664 10.952 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -10.936 4.514 9.998 1.00 0.00 H new ATOM 1360 N ALA A 121 -9.186 5.261 8.039 1.00 0.00 N ATOM 1361 CA ALA A 121 -8.054 4.755 7.273 1.00 0.00 C ATOM 1362 C ALA A 121 -7.333 5.886 6.548 1.00 0.00 C ATOM 1363 O ALA A 121 -6.103 5.956 6.551 1.00 0.00 O ATOM 1364 CB ALA A 121 -8.517 3.700 6.280 1.00 0.00 C ATOM 0 H ALA A 121 -10.094 4.916 7.728 1.00 0.00 H new ATOM 0 HA ALA A 121 -7.351 4.298 7.970 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -7.661 3.331 5.715 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -8.980 2.873 6.818 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -9.242 4.139 5.595 1.00 0.00 H new ATOM 1370 N LYS A 122 -8.105 6.771 5.926 1.00 0.00 N ATOM 1371 CA LYS A 122 -7.540 7.900 5.196 1.00 0.00 C ATOM 1372 C LYS A 122 -6.649 8.743 6.102 1.00 0.00 C ATOM 1373 O LYS A 122 -5.526 9.091 5.737 1.00 0.00 O ATOM 1374 CB LYS A 122 -8.659 8.767 4.614 1.00 0.00 C ATOM 1375 CG LYS A 122 -9.615 8.004 3.714 1.00 0.00 C ATOM 1376 CD LYS A 122 -10.737 8.895 3.209 1.00 0.00 C ATOM 1377 CE LYS A 122 -10.383 9.537 1.877 1.00 0.00 C ATOM 1378 NZ LYS A 122 -9.736 10.866 2.057 1.00 0.00 N ATOM 0 H LYS A 122 -9.124 6.728 5.913 1.00 0.00 H new ATOM 0 HA LYS A 122 -6.931 7.507 4.382 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.223 9.215 5.432 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -8.215 9.586 4.047 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -9.067 7.592 2.867 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -10.037 7.161 4.261 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.648 8.307 3.100 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.945 9.672 3.945 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -9.713 8.879 1.323 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -11.286 9.651 1.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -10.399 11.616 1.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -9.476 10.993 3.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -8.881 10.919 1.467 1.00 0.00 H new ATOM 1392 N LYS A 123 -7.155 9.067 7.287 1.00 0.00 N ATOM 1393 CA LYS A 123 -6.404 9.866 8.248 1.00 0.00 C ATOM 1394 C LYS A 123 -5.019 9.273 8.485 1.00 0.00 C ATOM 1395 O LYS A 123 -4.035 10.002 8.612 1.00 0.00 O ATOM 1396 CB LYS A 123 -7.165 9.957 9.573 1.00 0.00 C ATOM 1397 CG LYS A 123 -8.514 10.644 9.453 1.00 0.00 C ATOM 1398 CD LYS A 123 -9.325 10.506 10.731 1.00 0.00 C ATOM 1399 CE LYS A 123 -8.765 11.378 11.843 1.00 0.00 C ATOM 1400 NZ LYS A 123 -9.287 12.772 11.772 1.00 0.00 N ATOM 0 H LYS A 123 -8.083 8.788 7.605 1.00 0.00 H new ATOM 0 HA LYS A 123 -6.285 10.868 7.835 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -7.312 8.952 9.968 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.555 10.497 10.297 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -8.367 11.700 9.226 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -9.070 10.214 8.620 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -10.361 10.783 10.537 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -9.328 9.464 11.051 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -9.021 10.943 12.809 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -7.677 11.394 11.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -8.881 13.334 12.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -9.021 13.196 10.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -10.323 12.759 11.859 1.00 0.00 H new ATOM 1414 N ASP A 124 -4.950 7.948 8.541 1.00 0.00 N ATOM 1415 CA ASP A 124 -3.684 7.257 8.760 1.00 0.00 C ATOM 1416 C ASP A 124 -2.802 7.333 7.518 1.00 0.00 C ATOM 1417 O ASP A 124 -1.590 7.529 7.615 1.00 0.00 O ATOM 1418 CB ASP A 124 -3.935 5.795 9.134 1.00 0.00 C ATOM 1419 CG ASP A 124 -2.664 5.074 9.535 1.00 0.00 C ATOM 1420 OD1 ASP A 124 -2.203 5.275 10.679 1.00 0.00 O ATOM 1421 OD2 ASP A 124 -2.129 4.308 8.707 1.00 0.00 O ATOM 0 H ASP A 124 -5.755 7.331 8.438 1.00 0.00 H new ATOM 0 HA ASP A 124 -3.166 7.751 9.582 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.649 5.751 9.956 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.390 5.280 8.288 1.00 0.00 H new ATOM 1426 N PHE A 125 -3.417 7.175 6.350 1.00 0.00 N ATOM 1427 CA PHE A 125 -2.687 7.224 5.089 1.00 0.00 C ATOM 1428 C PHE A 125 -2.057 8.598 4.878 1.00 0.00 C ATOM 1429 O PHE A 125 -0.884 8.705 4.521 1.00 0.00 O ATOM 1430 CB PHE A 125 -3.621 6.895 3.922 1.00 0.00 C ATOM 1431 CG PHE A 125 -2.922 6.836 2.594 1.00 0.00 C ATOM 1432 CD1 PHE A 125 -2.375 7.979 2.033 1.00 0.00 C ATOM 1433 CD2 PHE A 125 -2.812 5.638 1.906 1.00 0.00 C ATOM 1434 CE1 PHE A 125 -1.733 7.927 0.810 1.00 0.00 C ATOM 1435 CE2 PHE A 125 -2.170 5.581 0.684 1.00 0.00 C ATOM 1436 CZ PHE A 125 -1.629 6.727 0.135 1.00 0.00 C ATOM 0 H PHE A 125 -4.419 7.012 6.251 1.00 0.00 H new ATOM 0 HA PHE A 125 -1.891 6.481 5.130 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -4.104 5.937 4.112 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.410 7.646 3.875 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.451 8.920 2.557 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.233 4.738 2.330 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.313 8.825 0.382 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.091 4.641 0.158 1.00 0.00 H new ATOM 0 HZ PHE A 125 -1.126 6.685 -0.820 1.00 0.00 H new ATOM 1446 N GLU A 126 -2.845 9.645 5.101 1.00 0.00 N ATOM 1447 CA GLU A 126 -2.364 11.011 4.934 1.00 0.00 C ATOM 1448 C GLU A 126 -1.435 11.405 6.078 1.00 0.00 C ATOM 1449 O GLU A 126 -0.334 11.908 5.855 1.00 0.00 O ATOM 1450 CB GLU A 126 -3.543 11.985 4.862 1.00 0.00 C ATOM 1451 CG GLU A 126 -4.082 12.185 3.455 1.00 0.00 C ATOM 1452 CD GLU A 126 -4.827 13.496 3.297 1.00 0.00 C ATOM 1453 OE1 GLU A 126 -5.514 13.907 4.256 1.00 0.00 O ATOM 1454 OE2 GLU A 126 -4.724 14.111 2.215 1.00 0.00 O ATOM 0 H GLU A 126 -3.818 9.573 5.397 1.00 0.00 H new ATOM 0 HA GLU A 126 -1.803 11.060 4.001 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.346 11.618 5.501 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -3.232 12.949 5.263 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -3.255 12.153 2.745 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -4.749 11.360 3.205 1.00 0.00 H new ATOM 1461 N LYS A 127 -1.887 11.172 7.306 1.00 0.00 N ATOM 1462 CA LYS A 127 -1.097 11.501 8.487 1.00 0.00 C ATOM 1463 C LYS A 127 0.313 10.931 8.375 1.00 0.00 C ATOM 1464 O LYS A 127 1.299 11.662 8.474 1.00 0.00 O ATOM 1465 CB LYS A 127 -1.778 10.961 9.747 1.00 0.00 C ATOM 1466 CG LYS A 127 -1.031 11.285 11.029 1.00 0.00 C ATOM 1467 CD LYS A 127 -0.017 10.207 11.372 1.00 0.00 C ATOM 1468 CE LYS A 127 -0.668 9.040 12.097 1.00 0.00 C ATOM 1469 NZ LYS A 127 0.338 8.178 12.776 1.00 0.00 N ATOM 0 H LYS A 127 -2.796 10.757 7.509 1.00 0.00 H new ATOM 0 HA LYS A 127 -1.026 12.587 8.555 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -2.786 11.372 9.810 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -1.880 9.879 9.659 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -0.522 12.243 10.922 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.742 11.391 11.848 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.459 9.850 10.459 1.00 0.00 H new ATOM 0 HD3 LYS A 127 0.770 10.631 11.996 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.377 9.420 12.833 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -1.237 8.442 11.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.146 7.394 13.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.000 7.795 12.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 0.864 8.742 13.474 1.00 0.00 H new ATOM 1483 N LYS A 128 0.402 9.622 8.166 1.00 0.00 N ATOM 1484 CA LYS A 128 1.692 8.953 8.037 1.00 0.00 C ATOM 1485 C LYS A 128 2.505 9.556 6.896 1.00 0.00 C ATOM 1486 O LYS A 128 3.625 10.026 7.100 1.00 0.00 O ATOM 1487 CB LYS A 128 1.491 7.455 7.799 1.00 0.00 C ATOM 1488 CG LYS A 128 2.791 6.681 7.665 1.00 0.00 C ATOM 1489 CD LYS A 128 3.559 6.651 8.976 1.00 0.00 C ATOM 1490 CE LYS A 128 2.891 5.737 9.992 1.00 0.00 C ATOM 1491 NZ LYS A 128 3.866 5.205 10.984 1.00 0.00 N ATOM 0 H LYS A 128 -0.404 9.003 8.082 1.00 0.00 H new ATOM 0 HA LYS A 128 2.242 9.096 8.967 1.00 0.00 H new ATOM 0 HB2 LYS A 128 0.913 7.039 8.624 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.900 7.315 6.894 1.00 0.00 H new ATOM 0 HG2 LYS A 128 2.577 5.662 7.344 1.00 0.00 H new ATOM 0 HG3 LYS A 128 3.409 7.136 6.891 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.579 6.311 8.794 1.00 0.00 H new ATOM 0 HD3 LYS A 128 3.627 7.660 9.382 1.00 0.00 H new ATOM 0 HE2 LYS A 128 2.106 6.285 10.513 1.00 0.00 H new ATOM 0 HE3 LYS A 128 2.411 4.907 9.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 3.372 4.587 11.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 4.602 4.661 10.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 4.306 5.996 11.497 1.00 0.00 H new ATOM 1505 N PHE A 129 1.935 9.540 5.696 1.00 0.00 N ATOM 1506 CA PHE A 129 2.607 10.086 4.523 1.00 0.00 C ATOM 1507 C PHE A 129 3.190 11.464 4.822 1.00 0.00 C ATOM 1508 O PHE A 129 4.393 11.684 4.685 1.00 0.00 O ATOM 1509 CB PHE A 129 1.633 10.175 3.346 1.00 0.00 C ATOM 1510 CG PHE A 129 2.135 11.028 2.216 1.00 0.00 C ATOM 1511 CD1 PHE A 129 1.882 12.390 2.193 1.00 0.00 C ATOM 1512 CD2 PHE A 129 2.859 10.467 1.177 1.00 0.00 C ATOM 1513 CE1 PHE A 129 2.343 13.178 1.155 1.00 0.00 C ATOM 1514 CE2 PHE A 129 3.323 11.250 0.136 1.00 0.00 C ATOM 1515 CZ PHE A 129 3.063 12.606 0.125 1.00 0.00 C ATOM 0 H PHE A 129 1.009 9.155 5.510 1.00 0.00 H new ATOM 0 HA PHE A 129 3.425 9.415 4.259 1.00 0.00 H new ATOM 0 HB2 PHE A 129 1.435 9.171 2.972 1.00 0.00 H new ATOM 0 HB3 PHE A 129 0.684 10.577 3.700 1.00 0.00 H new ATOM 0 HD1 PHE A 129 1.318 12.841 2.996 1.00 0.00 H new ATOM 0 HD2 PHE A 129 3.063 9.407 1.180 1.00 0.00 H new ATOM 0 HE1 PHE A 129 2.140 14.239 1.150 1.00 0.00 H new ATOM 0 HE2 PHE A 129 3.888 10.801 -0.668 1.00 0.00 H new ATOM 0 HZ PHE A 129 3.422 13.219 -0.689 1.00 0.00 H new ATOM 1525 N ARG A 130 2.327 12.389 5.229 1.00 0.00 N ATOM 1526 CA ARG A 130 2.754 13.746 5.546 1.00 0.00 C ATOM 1527 C ARG A 130 3.776 13.744 6.679 1.00 0.00 C ATOM 1528 O ARG A 130 4.650 14.608 6.740 1.00 0.00 O ATOM 1529 CB ARG A 130 1.549 14.606 5.932 1.00 0.00 C ATOM 1530 CG ARG A 130 1.928 15.953 6.527 1.00 0.00 C ATOM 1531 CD ARG A 130 0.784 16.949 6.421 1.00 0.00 C ATOM 1532 NE ARG A 130 0.822 17.941 7.493 1.00 0.00 N ATOM 1533 CZ ARG A 130 1.611 19.010 7.477 1.00 0.00 C ATOM 1534 NH1 ARG A 130 2.422 19.224 6.450 1.00 0.00 N ATOM 1535 NH2 ARG A 130 1.589 19.868 8.489 1.00 0.00 N ATOM 0 H ARG A 130 1.328 12.223 5.347 1.00 0.00 H new ATOM 0 HA ARG A 130 3.223 14.169 4.658 1.00 0.00 H new ATOM 0 HB2 ARG A 130 0.932 14.769 5.049 1.00 0.00 H new ATOM 0 HB3 ARG A 130 0.939 14.059 6.651 1.00 0.00 H new ATOM 0 HG2 ARG A 130 2.205 15.825 7.573 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.804 16.347 6.011 1.00 0.00 H new ATOM 0 HD2 ARG A 130 0.832 17.455 5.457 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -0.166 16.415 6.454 1.00 0.00 H new ATOM 0 HE ARG A 130 0.210 17.806 8.297 1.00 0.00 H new ATOM 0 HH11 ARG A 130 2.441 18.567 5.670 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.027 20.045 6.440 1.00 0.00 H new ATOM 0 HH21 ARG A 130 0.966 19.707 9.280 1.00 0.00 H new ATOM 0 HH22 ARG A 130 2.195 20.688 8.475 1.00 0.00 H new ATOM 1549 N GLU A 131 3.657 12.768 7.574 1.00 0.00 N ATOM 1550 CA GLU A 131 4.570 12.656 8.706 1.00 0.00 C ATOM 1551 C GLU A 131 5.955 12.210 8.246 1.00 0.00 C ATOM 1552 O GLU A 131 6.953 12.445 8.926 1.00 0.00 O ATOM 1553 CB GLU A 131 4.020 11.668 9.737 1.00 0.00 C ATOM 1554 CG GLU A 131 3.130 12.314 10.785 1.00 0.00 C ATOM 1555 CD GLU A 131 3.170 11.586 12.114 1.00 0.00 C ATOM 1556 OE1 GLU A 131 3.400 10.358 12.111 1.00 0.00 O ATOM 1557 OE2 GLU A 131 2.972 12.242 13.158 1.00 0.00 O ATOM 0 H GLU A 131 2.939 12.045 7.537 1.00 0.00 H new ATOM 0 HA GLU A 131 4.659 13.640 9.167 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.454 10.893 9.219 1.00 0.00 H new ATOM 0 HB3 GLU A 131 4.854 11.174 10.235 1.00 0.00 H new ATOM 0 HG2 GLU A 131 3.441 13.348 10.932 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.103 12.338 10.419 1.00 0.00 H new ATOM 1564 N LYS A 132 6.006 11.563 7.086 1.00 0.00 N ATOM 1565 CA LYS A 132 7.267 11.084 6.533 1.00 0.00 C ATOM 1566 C LYS A 132 7.787 12.035 5.460 1.00 0.00 C ATOM 1567 O LYS A 132 8.988 12.090 5.193 1.00 0.00 O ATOM 1568 CB LYS A 132 7.089 9.682 5.944 1.00 0.00 C ATOM 1569 CG LYS A 132 6.658 8.644 6.965 1.00 0.00 C ATOM 1570 CD LYS A 132 7.834 8.155 7.794 1.00 0.00 C ATOM 1571 CE LYS A 132 7.489 6.887 8.559 1.00 0.00 C ATOM 1572 NZ LYS A 132 8.708 6.149 8.989 1.00 0.00 N ATOM 0 H LYS A 132 5.189 11.359 6.511 1.00 0.00 H new ATOM 0 HA LYS A 132 7.997 11.042 7.341 1.00 0.00 H new ATOM 0 HB2 LYS A 132 6.348 9.724 5.146 1.00 0.00 H new ATOM 0 HB3 LYS A 132 8.028 9.365 5.491 1.00 0.00 H new ATOM 0 HG2 LYS A 132 5.901 9.072 7.622 1.00 0.00 H new ATOM 0 HG3 LYS A 132 6.196 7.799 6.454 1.00 0.00 H new ATOM 0 HD2 LYS A 132 8.687 7.967 7.142 1.00 0.00 H new ATOM 0 HD3 LYS A 132 8.135 8.934 8.495 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.892 7.142 9.434 1.00 0.00 H new ATOM 0 HE3 LYS A 132 6.875 6.240 7.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 8.647 5.161 8.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 9.550 6.596 8.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 8.781 6.173 10.026 1.00 0.00 H new ATOM 1586 N THR A 133 6.876 12.785 4.848 1.00 0.00 N ATOM 1587 CA THR A 133 7.243 13.734 3.804 1.00 0.00 C ATOM 1588 C THR A 133 7.039 15.170 4.272 1.00 0.00 C ATOM 1589 O THR A 133 7.219 16.116 3.504 1.00 0.00 O ATOM 1590 CB THR A 133 6.422 13.503 2.521 1.00 0.00 C ATOM 1591 OG1 THR A 133 5.033 13.735 2.779 1.00 0.00 O ATOM 1592 CG2 THR A 133 6.617 12.086 2.002 1.00 0.00 C ATOM 0 H THR A 133 5.878 12.754 5.057 1.00 0.00 H new ATOM 0 HA THR A 133 8.298 13.572 3.585 1.00 0.00 H new ATOM 0 HB THR A 133 6.771 14.203 1.762 1.00 0.00 H new ATOM 0 HG1 THR A 133 4.710 13.087 3.440 1.00 0.00 H new ATOM 0 HG21 THR A 133 6.028 11.946 1.096 1.00 0.00 H new ATOM 0 HG22 THR A 133 7.671 11.922 1.778 1.00 0.00 H new ATOM 0 HG23 THR A 133 6.292 11.373 2.760 1.00 0.00 H new ATOM 1600 N LYS A 134 6.665 15.329 5.537 1.00 0.00 N ATOM 1601 CA LYS A 134 6.439 16.651 6.109 1.00 0.00 C ATOM 1602 C LYS A 134 5.685 17.545 5.131 1.00 0.00 C ATOM 1603 O LYS A 134 5.894 18.757 5.095 1.00 0.00 O ATOM 1604 CB LYS A 134 7.772 17.300 6.487 1.00 0.00 C ATOM 1605 CG LYS A 134 8.223 16.985 7.903 1.00 0.00 C ATOM 1606 CD LYS A 134 9.611 17.536 8.182 1.00 0.00 C ATOM 1607 CE LYS A 134 9.548 18.957 8.721 1.00 0.00 C ATOM 1608 NZ LYS A 134 8.925 19.010 10.073 1.00 0.00 N ATOM 0 H LYS A 134 6.512 14.558 6.186 1.00 0.00 H new ATOM 0 HA LYS A 134 5.832 16.532 7.007 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.539 16.967 5.788 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.685 18.381 6.374 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.513 17.407 8.614 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.222 15.906 8.054 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.120 16.895 8.902 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.201 17.519 7.266 1.00 0.00 H new ATOM 0 HE2 LYS A 134 10.555 19.372 8.768 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.977 19.581 8.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 9.249 19.863 10.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 7.890 19.037 9.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 9.201 18.167 10.616 1.00 0.00 H new ATOM 1622 N ASN A 135 4.806 16.939 4.339 1.00 0.00 N ATOM 1623 CA ASN A 135 4.019 17.682 3.360 1.00 0.00 C ATOM 1624 C ASN A 135 2.587 17.159 3.303 1.00 0.00 C ATOM 1625 O ASN A 135 2.280 16.101 3.849 1.00 0.00 O ATOM 1626 CB ASN A 135 4.665 17.585 1.977 1.00 0.00 C ATOM 1627 CG ASN A 135 5.654 18.706 1.720 1.00 0.00 C ATOM 1628 OD1 ASN A 135 5.333 19.693 1.058 1.00 0.00 O ATOM 1629 ND2 ASN A 135 6.865 18.558 2.245 1.00 0.00 N ATOM 0 H ASN A 135 4.621 15.936 4.356 1.00 0.00 H new ATOM 0 HA ASN A 135 3.993 18.727 3.669 1.00 0.00 H new ATOM 0 HB2 ASN A 135 5.175 16.626 1.884 1.00 0.00 H new ATOM 0 HB3 ASN A 135 3.887 17.608 1.213 1.00 0.00 H new ATOM 0 HD21 ASN A 135 7.573 19.279 2.106 1.00 0.00 H new ATOM 0 HD22 ASN A 135 7.087 17.723 2.787 1.00 0.00 H new ATOM 1636 N ASN A 136 1.715 17.910 2.638 1.00 0.00 N ATOM 1637 CA ASN A 136 0.315 17.522 2.509 1.00 0.00 C ATOM 1638 C ASN A 136 0.073 16.785 1.195 1.00 0.00 C ATOM 1639 O ASN A 136 0.566 17.193 0.144 1.00 0.00 O ATOM 1640 CB ASN A 136 -0.586 18.756 2.589 1.00 0.00 C ATOM 1641 CG ASN A 136 -0.669 19.322 3.993 1.00 0.00 C ATOM 1642 OD1 ASN A 136 0.265 19.967 4.470 1.00 0.00 O ATOM 1643 ND2 ASN A 136 -1.790 19.083 4.663 1.00 0.00 N ATOM 0 H ASN A 136 1.953 18.790 2.180 1.00 0.00 H new ATOM 0 HA ASN A 136 0.073 16.849 3.331 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -0.208 19.523 1.913 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -1.587 18.494 2.246 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -1.903 19.439 5.612 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -2.539 18.544 4.228 1.00 0.00 H new ATOM 1650 N TRP A 137 -0.689 15.700 1.264 1.00 0.00 N ATOM 1651 CA TRP A 137 -0.997 14.906 0.080 1.00 0.00 C ATOM 1652 C TRP A 137 -1.707 15.751 -0.972 1.00 0.00 C ATOM 1653 O TRP A 137 -1.485 15.582 -2.171 1.00 0.00 O ATOM 1654 CB TRP A 137 -1.864 13.705 0.457 1.00 0.00 C ATOM 1655 CG TRP A 137 -2.192 12.819 -0.707 1.00 0.00 C ATOM 1656 CD1 TRP A 137 -3.393 12.720 -1.349 1.00 0.00 C ATOM 1657 CD2 TRP A 137 -1.306 11.908 -1.366 1.00 0.00 C ATOM 1658 NE1 TRP A 137 -3.308 11.801 -2.367 1.00 0.00 N ATOM 1659 CE2 TRP A 137 -2.038 11.290 -2.399 1.00 0.00 C ATOM 1660 CE3 TRP A 137 0.034 11.555 -1.186 1.00 0.00 C ATOM 1661 CZ2 TRP A 137 -1.472 10.339 -3.246 1.00 0.00 C ATOM 1662 CZ3 TRP A 137 0.594 10.612 -2.027 1.00 0.00 C ATOM 1663 CH2 TRP A 137 -0.159 10.013 -3.047 1.00 0.00 C ATOM 0 H TRP A 137 -1.105 15.350 2.127 1.00 0.00 H new ATOM 0 HA TRP A 137 -0.058 14.548 -0.341 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -1.348 13.118 1.217 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -2.791 14.062 0.905 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -4.280 13.282 -1.094 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -4.067 11.542 -2.997 1.00 0.00 H new ATOM 0 HE3 TRP A 137 0.622 12.011 -0.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 -2.050 9.876 -4.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 1.629 10.332 -1.896 1.00 0.00 H new ATOM 0 HH2 TRP A 137 0.307 9.280 -3.688 1.00 0.00 H new ATOM 1674 N ALA A 138 -2.562 16.661 -0.516 1.00 0.00 N ATOM 1675 CA ALA A 138 -3.303 17.534 -1.418 1.00 0.00 C ATOM 1676 C ALA A 138 -2.378 18.546 -2.086 1.00 0.00 C ATOM 1677 O ALA A 138 -2.495 18.812 -3.281 1.00 0.00 O ATOM 1678 CB ALA A 138 -4.415 18.249 -0.665 1.00 0.00 C ATOM 0 H ALA A 138 -2.759 16.813 0.473 1.00 0.00 H new ATOM 0 HA ALA A 138 -3.747 16.916 -2.199 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -4.960 18.898 -1.351 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -5.098 17.513 -0.241 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -3.984 18.849 0.137 1.00 0.00 H new ATOM 1684 N GLU A 139 -1.460 19.107 -1.305 1.00 0.00 N ATOM 1685 CA GLU A 139 -0.516 20.091 -1.822 1.00 0.00 C ATOM 1686 C GLU A 139 0.766 19.416 -2.301 1.00 0.00 C ATOM 1687 O GLU A 139 1.858 19.967 -2.163 1.00 0.00 O ATOM 1688 CB GLU A 139 -0.188 21.129 -0.747 1.00 0.00 C ATOM 1689 CG GLU A 139 -1.417 21.748 -0.103 1.00 0.00 C ATOM 1690 CD GLU A 139 -1.145 23.127 0.468 1.00 0.00 C ATOM 1691 OE1 GLU A 139 -0.339 23.229 1.415 1.00 0.00 O ATOM 1692 OE2 GLU A 139 -1.740 24.104 -0.034 1.00 0.00 O ATOM 0 H GLU A 139 -1.350 18.897 -0.313 1.00 0.00 H new ATOM 0 HA GLU A 139 -0.981 20.592 -2.671 1.00 0.00 H new ATOM 0 HB2 GLU A 139 0.419 20.659 0.027 1.00 0.00 H new ATOM 0 HB3 GLU A 139 0.417 21.920 -1.190 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -2.215 21.816 -0.843 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -1.774 21.094 0.692 1.00 0.00 H new ATOM 1699 N ARG A 140 0.624 18.221 -2.863 1.00 0.00 N ATOM 1700 CA ARG A 140 1.769 17.469 -3.361 1.00 0.00 C ATOM 1701 C ARG A 140 2.495 18.246 -4.456 1.00 0.00 C ATOM 1702 O ARG A 140 3.636 17.936 -4.800 1.00 0.00 O ATOM 1703 CB ARG A 140 1.320 16.109 -3.899 1.00 0.00 C ATOM 1704 CG ARG A 140 0.482 16.201 -5.163 1.00 0.00 C ATOM 1705 CD ARG A 140 -0.074 14.843 -5.563 1.00 0.00 C ATOM 1706 NE ARG A 140 0.892 14.060 -6.328 1.00 0.00 N ATOM 1707 CZ ARG A 140 1.223 14.326 -7.586 1.00 0.00 C ATOM 1708 NH1 ARG A 140 0.668 15.351 -8.218 1.00 0.00 N ATOM 1709 NH2 ARG A 140 2.111 13.566 -8.215 1.00 0.00 N ATOM 0 H ARG A 140 -0.274 17.752 -2.985 1.00 0.00 H new ATOM 0 HA ARG A 140 2.458 17.314 -2.531 1.00 0.00 H new ATOM 0 HB2 ARG A 140 2.200 15.499 -4.101 1.00 0.00 H new ATOM 0 HB3 ARG A 140 0.745 15.595 -3.129 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -0.340 16.900 -5.006 1.00 0.00 H new ATOM 0 HG3 ARG A 140 1.089 16.600 -5.975 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -0.361 14.291 -4.668 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -0.978 14.982 -6.155 1.00 0.00 H new ATOM 0 HE ARG A 140 1.337 13.264 -5.871 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -0.015 15.937 -7.738 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.924 15.553 -9.184 1.00 0.00 H new ATOM 0 HH21 ARG A 140 2.540 12.777 -7.732 1.00 0.00 H new ATOM 0 HH22 ARG A 140 2.364 13.771 -9.181 1.00 0.00 H new ATOM 1723 N ASP A 141 1.826 19.257 -4.999 1.00 0.00 N ATOM 1724 CA ASP A 141 2.406 20.079 -6.054 1.00 0.00 C ATOM 1725 C ASP A 141 3.703 20.731 -5.584 1.00 0.00 C ATOM 1726 O ASP A 141 4.701 20.745 -6.306 1.00 0.00 O ATOM 1727 CB ASP A 141 1.413 21.154 -6.498 1.00 0.00 C ATOM 1728 CG ASP A 141 1.755 21.733 -7.857 1.00 0.00 C ATOM 1729 OD1 ASP A 141 1.635 21.001 -8.862 1.00 0.00 O ATOM 1730 OD2 ASP A 141 2.142 22.919 -7.915 1.00 0.00 O ATOM 0 H ASP A 141 0.881 19.527 -4.726 1.00 0.00 H new ATOM 0 HA ASP A 141 2.631 19.432 -6.901 1.00 0.00 H new ATOM 0 HB2 ASP A 141 0.410 20.727 -6.530 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.395 21.955 -5.759 1.00 0.00 H new ATOM 1735 N HIS A 142 3.681 21.272 -4.369 1.00 0.00 N ATOM 1736 CA HIS A 142 4.855 21.926 -3.803 1.00 0.00 C ATOM 1737 C HIS A 142 5.597 20.986 -2.857 1.00 0.00 C ATOM 1738 O HIS A 142 6.141 21.416 -1.840 1.00 0.00 O ATOM 1739 CB HIS A 142 4.446 23.198 -3.059 1.00 0.00 C ATOM 1740 CG HIS A 142 3.592 22.941 -1.856 1.00 0.00 C ATOM 1741 ND1 HIS A 142 2.858 23.925 -1.229 1.00 0.00 N ATOM 1742 CD2 HIS A 142 3.357 21.801 -1.165 1.00 0.00 C ATOM 1743 CE1 HIS A 142 2.209 23.403 -0.204 1.00 0.00 C ATOM 1744 NE2 HIS A 142 2.494 22.114 -0.144 1.00 0.00 N ATOM 0 H HIS A 142 2.864 21.270 -3.759 1.00 0.00 H new ATOM 0 HA HIS A 142 5.524 22.191 -4.622 1.00 0.00 H new ATOM 0 HB2 HIS A 142 5.344 23.732 -2.749 1.00 0.00 H new ATOM 0 HB3 HIS A 142 3.907 23.852 -3.744 1.00 0.00 H new ATOM 0 HD1 HIS A 142 2.822 24.904 -1.513 1.00 0.00 H new ATOM 0 HD2 HIS A 142 3.771 20.826 -1.377 1.00 0.00 H new ATOM 0 HE1 HIS A 142 1.557 23.938 0.470 1.00 0.00 H new ATOM 1752 N PHE A 143 5.615 19.703 -3.200 1.00 0.00 N ATOM 1753 CA PHE A 143 6.289 18.702 -2.382 1.00 0.00 C ATOM 1754 C PHE A 143 7.747 19.085 -2.145 1.00 0.00 C ATOM 1755 O PHE A 143 8.577 19.004 -3.051 1.00 0.00 O ATOM 1756 CB PHE A 143 6.213 17.328 -3.052 1.00 0.00 C ATOM 1757 CG PHE A 143 6.858 16.234 -2.251 1.00 0.00 C ATOM 1758 CD1 PHE A 143 8.227 16.026 -2.313 1.00 0.00 C ATOM 1759 CD2 PHE A 143 6.096 15.412 -1.436 1.00 0.00 C ATOM 1760 CE1 PHE A 143 8.824 15.020 -1.576 1.00 0.00 C ATOM 1761 CE2 PHE A 143 6.687 14.405 -0.697 1.00 0.00 C ATOM 1762 CZ PHE A 143 8.052 14.208 -0.768 1.00 0.00 C ATOM 0 H PHE A 143 5.170 19.332 -4.039 1.00 0.00 H new ATOM 0 HA PHE A 143 5.782 18.656 -1.418 1.00 0.00 H new ATOM 0 HB2 PHE A 143 5.167 17.074 -3.223 1.00 0.00 H new ATOM 0 HB3 PHE A 143 6.692 17.382 -4.030 1.00 0.00 H new ATOM 0 HD1 PHE A 143 8.835 16.657 -2.945 1.00 0.00 H new ATOM 0 HD2 PHE A 143 5.028 15.560 -1.378 1.00 0.00 H new ATOM 0 HE1 PHE A 143 9.892 14.869 -1.632 1.00 0.00 H new ATOM 0 HE2 PHE A 143 6.082 13.773 -0.064 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.515 13.420 -0.193 1.00 0.00 H new ATOM 1772 N VAL A 144 8.052 19.503 -0.921 1.00 0.00 N ATOM 1773 CA VAL A 144 9.409 19.899 -0.563 1.00 0.00 C ATOM 1774 C VAL A 144 10.208 18.710 -0.042 1.00 0.00 C ATOM 1775 O VAL A 144 9.833 18.083 0.949 1.00 0.00 O ATOM 1776 CB VAL A 144 9.407 21.010 0.503 1.00 0.00 C ATOM 1777 CG1 VAL A 144 10.829 21.348 0.925 1.00 0.00 C ATOM 1778 CG2 VAL A 144 8.688 22.246 -0.017 1.00 0.00 C ATOM 0 H VAL A 144 7.377 19.576 -0.160 1.00 0.00 H new ATOM 0 HA VAL A 144 9.878 20.279 -1.471 1.00 0.00 H new ATOM 0 HB VAL A 144 8.870 20.647 1.380 1.00 0.00 H new ATOM 0 HG11 VAL A 144 10.807 22.135 1.679 1.00 0.00 H new ATOM 0 HG12 VAL A 144 11.306 20.460 1.341 1.00 0.00 H new ATOM 0 HG13 VAL A 144 11.394 21.691 0.058 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.696 23.021 0.749 1.00 0.00 H new ATOM 0 HG22 VAL A 144 9.195 22.613 -0.910 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.657 21.991 -0.264 1.00 0.00 H new ATOM 1788 N SER A 145 11.313 18.405 -0.716 1.00 0.00 N ATOM 1789 CA SER A 145 12.165 17.289 -0.322 1.00 0.00 C ATOM 1790 C SER A 145 13.225 17.741 0.677 1.00 0.00 C ATOM 1791 O SER A 145 14.150 18.475 0.329 1.00 0.00 O ATOM 1792 CB SER A 145 12.836 16.674 -1.552 1.00 0.00 C ATOM 1793 OG SER A 145 13.886 17.499 -2.026 1.00 0.00 O ATOM 0 H SER A 145 11.639 18.915 -1.537 1.00 0.00 H new ATOM 0 HA SER A 145 11.538 16.536 0.156 1.00 0.00 H new ATOM 0 HB2 SER A 145 13.228 15.688 -1.301 1.00 0.00 H new ATOM 0 HB3 SER A 145 12.097 16.532 -2.340 1.00 0.00 H new ATOM 0 HG SER A 145 14.003 18.260 -1.420 1.00 0.00 H new ATOM 1799 N HIS A 146 13.083 17.297 1.922 1.00 0.00 N ATOM 1800 CA HIS A 146 14.029 17.655 2.974 1.00 0.00 C ATOM 1801 C HIS A 146 15.170 16.644 3.045 1.00 0.00 C ATOM 1802 O HIS A 146 14.999 15.458 2.763 1.00 0.00 O ATOM 1803 CB HIS A 146 13.316 17.733 4.324 1.00 0.00 C ATOM 1804 CG HIS A 146 11.987 18.421 4.261 1.00 0.00 C ATOM 1805 ND1 HIS A 146 11.832 19.777 4.459 1.00 0.00 N ATOM 1806 CD2 HIS A 146 10.748 17.933 4.019 1.00 0.00 C ATOM 1807 CE1 HIS A 146 10.554 20.093 4.343 1.00 0.00 C ATOM 1808 NE2 HIS A 146 9.876 18.992 4.076 1.00 0.00 N ATOM 0 H HIS A 146 12.323 16.689 2.227 1.00 0.00 H new ATOM 0 HA HIS A 146 14.448 18.633 2.736 1.00 0.00 H new ATOM 0 HB2 HIS A 146 13.175 16.723 4.710 1.00 0.00 H new ATOM 0 HB3 HIS A 146 13.955 18.259 5.033 1.00 0.00 H new ATOM 0 HD2 HIS A 146 10.493 16.903 3.818 1.00 0.00 H new ATOM 0 HE1 HIS A 146 10.136 21.083 4.449 1.00 0.00 H new ATOM 0 HE2 HIS A 146 8.867 18.937 3.935 1.00 0.00 H new ATOM 1816 N PRO A 147 16.362 17.123 3.430 1.00 0.00 N ATOM 1817 CA PRO A 147 17.554 16.278 3.546 1.00 0.00 C ATOM 1818 C PRO A 147 17.460 15.301 4.713 1.00 0.00 C ATOM 1819 O PRO A 147 17.485 15.704 5.876 1.00 0.00 O ATOM 1820 CB PRO A 147 18.682 17.287 3.782 1.00 0.00 C ATOM 1821 CG PRO A 147 18.011 18.469 4.391 1.00 0.00 C ATOM 1822 CD PRO A 147 16.638 18.526 3.781 1.00 0.00 C ATOM 0 HA PRO A 147 17.699 15.654 2.664 1.00 0.00 H new ATOM 0 HB2 PRO A 147 19.445 16.880 4.445 1.00 0.00 H new ATOM 0 HB3 PRO A 147 19.179 17.551 2.848 1.00 0.00 H new ATOM 0 HG2 PRO A 147 17.953 18.369 5.475 1.00 0.00 H new ATOM 0 HG3 PRO A 147 18.568 19.383 4.185 1.00 0.00 H new ATOM 0 HD2 PRO A 147 15.902 18.917 4.484 1.00 0.00 H new ATOM 0 HD3 PRO A 147 16.615 19.172 2.903 1.00 0.00 H new ATOM 1830 N GLY A 148 17.354 14.015 4.395 1.00 0.00 N ATOM 1831 CA GLY A 148 17.258 13.001 5.429 1.00 0.00 C ATOM 1832 C GLY A 148 15.878 12.377 5.504 1.00 0.00 C ATOM 1833 O GLY A 148 15.742 11.180 5.759 1.00 0.00 O ATOM 0 H GLY A 148 17.333 13.657 3.440 1.00 0.00 H new ATOM 0 HA2 GLY A 148 17.996 12.222 5.239 1.00 0.00 H new ATOM 0 HA3 GLY A 148 17.505 13.445 6.393 1.00 0.00 H new ATOM 1837 N LYS A 149 14.851 13.190 5.282 1.00 0.00 N ATOM 1838 CA LYS A 149 13.474 12.712 5.326 1.00 0.00 C ATOM 1839 C LYS A 149 13.186 11.774 4.158 1.00 0.00 C ATOM 1840 O LYS A 149 14.073 11.471 3.359 1.00 0.00 O ATOM 1841 CB LYS A 149 12.502 13.894 5.296 1.00 0.00 C ATOM 1842 CG LYS A 149 12.564 14.764 6.539 1.00 0.00 C ATOM 1843 CD LYS A 149 11.968 14.057 7.745 1.00 0.00 C ATOM 1844 CE LYS A 149 10.449 14.019 7.675 1.00 0.00 C ATOM 1845 NZ LYS A 149 9.870 13.107 8.700 1.00 0.00 N ATOM 0 H LYS A 149 14.946 14.183 5.070 1.00 0.00 H new ATOM 0 HA LYS A 149 13.337 12.159 6.255 1.00 0.00 H new ATOM 0 HB2 LYS A 149 12.717 14.508 4.422 1.00 0.00 H new ATOM 0 HB3 LYS A 149 11.487 13.516 5.178 1.00 0.00 H new ATOM 0 HG2 LYS A 149 13.601 15.029 6.747 1.00 0.00 H new ATOM 0 HG3 LYS A 149 12.027 15.695 6.360 1.00 0.00 H new ATOM 0 HD2 LYS A 149 12.356 13.040 7.800 1.00 0.00 H new ATOM 0 HD3 LYS A 149 12.279 14.567 8.657 1.00 0.00 H new ATOM 0 HE2 LYS A 149 10.053 15.025 7.818 1.00 0.00 H new ATOM 0 HE3 LYS A 149 10.139 13.693 6.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 8.841 13.043 8.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 10.292 12.161 8.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 10.073 13.479 9.650 1.00 0.00 H new ATOM 1859 N TYR A 150 11.942 11.318 4.065 1.00 0.00 N ATOM 1860 CA TYR A 150 11.538 10.413 2.995 1.00 0.00 C ATOM 1861 C TYR A 150 11.212 11.186 1.721 1.00 0.00 C ATOM 1862 O TYR A 150 10.632 12.272 1.770 1.00 0.00 O ATOM 1863 CB TYR A 150 10.326 9.587 3.428 1.00 0.00 C ATOM 1864 CG TYR A 150 10.691 8.302 4.137 1.00 0.00 C ATOM 1865 CD1 TYR A 150 10.907 7.129 3.424 1.00 0.00 C ATOM 1866 CD2 TYR A 150 10.820 8.261 5.520 1.00 0.00 C ATOM 1867 CE1 TYR A 150 11.239 5.953 4.068 1.00 0.00 C ATOM 1868 CE2 TYR A 150 11.154 7.090 6.172 1.00 0.00 C ATOM 1869 CZ TYR A 150 11.362 5.939 5.442 1.00 0.00 C ATOM 1870 OH TYR A 150 11.694 4.769 6.086 1.00 0.00 O ATOM 0 H TYR A 150 11.196 11.560 4.717 1.00 0.00 H new ATOM 0 HA TYR A 150 12.371 9.742 2.787 1.00 0.00 H new ATOM 0 HB2 TYR A 150 9.702 10.191 4.087 1.00 0.00 H new ATOM 0 HB3 TYR A 150 9.726 9.350 2.550 1.00 0.00 H new ATOM 0 HD1 TYR A 150 10.814 7.137 2.348 1.00 0.00 H new ATOM 0 HD2 TYR A 150 10.656 9.160 6.095 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.401 5.049 3.499 1.00 0.00 H new ATOM 0 HE2 TYR A 150 11.252 7.076 7.247 1.00 0.00 H new ATOM 0 HH TYR A 150 12.647 4.781 6.315 1.00 0.00 H new ATOM 1880 N THR A 151 11.588 10.619 0.579 1.00 0.00 N ATOM 1881 CA THR A 151 11.337 11.254 -0.708 1.00 0.00 C ATOM 1882 C THR A 151 10.118 10.646 -1.393 1.00 0.00 C ATOM 1883 O THR A 151 9.636 9.584 -0.996 1.00 0.00 O ATOM 1884 CB THR A 151 12.554 11.126 -1.644 1.00 0.00 C ATOM 1885 OG1 THR A 151 13.024 9.773 -1.656 1.00 0.00 O ATOM 1886 CG2 THR A 151 13.676 12.054 -1.203 1.00 0.00 C ATOM 0 H THR A 151 12.068 9.721 0.520 1.00 0.00 H new ATOM 0 HA THR A 151 11.150 12.309 -0.509 1.00 0.00 H new ATOM 0 HB THR A 151 12.242 11.410 -2.649 1.00 0.00 H new ATOM 0 HG1 THR A 151 13.796 9.700 -2.255 1.00 0.00 H new ATOM 0 HG21 THR A 151 14.524 11.946 -1.879 1.00 0.00 H new ATOM 0 HG22 THR A 151 13.324 13.086 -1.224 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.984 11.796 -0.190 1.00 0.00 H new ATOM 1894 N LEU A 152 9.624 11.324 -2.422 1.00 0.00 N ATOM 1895 CA LEU A 152 8.460 10.850 -3.163 1.00 0.00 C ATOM 1896 C LEU A 152 8.855 10.397 -4.565 1.00 0.00 C ATOM 1897 O LEU A 152 9.290 11.202 -5.389 1.00 0.00 O ATOM 1898 CB LEU A 152 7.403 11.951 -3.250 1.00 0.00 C ATOM 1899 CG LEU A 152 5.948 11.482 -3.306 1.00 0.00 C ATOM 1900 CD1 LEU A 152 5.009 12.671 -3.443 1.00 0.00 C ATOM 1901 CD2 LEU A 152 5.747 10.506 -4.455 1.00 0.00 C ATOM 0 H LEU A 152 10.011 12.204 -2.763 1.00 0.00 H new ATOM 0 HA LEU A 152 8.043 9.996 -2.629 1.00 0.00 H new ATOM 0 HB2 LEU A 152 7.519 12.607 -2.388 1.00 0.00 H new ATOM 0 HB3 LEU A 152 7.605 12.551 -4.137 1.00 0.00 H new ATOM 0 HG LEU A 152 5.715 10.967 -2.374 1.00 0.00 H new ATOM 0 HD11 LEU A 152 3.978 12.318 -3.481 1.00 0.00 H new ATOM 0 HD12 LEU A 152 5.134 13.334 -2.587 1.00 0.00 H new ATOM 0 HD13 LEU A 152 5.241 13.214 -4.359 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.706 10.183 -4.480 1.00 0.00 H new ATOM 0 HD22 LEU A 152 5.998 10.995 -5.396 1.00 0.00 H new ATOM 0 HD23 LEU A 152 6.393 9.639 -4.314 1.00 0.00 H new ATOM 1913 N ILE A 153 8.699 9.104 -4.830 1.00 0.00 N ATOM 1914 CA ILE A 153 9.035 8.545 -6.133 1.00 0.00 C ATOM 1915 C ILE A 153 7.798 7.990 -6.830 1.00 0.00 C ATOM 1916 O ILE A 153 6.732 7.876 -6.225 1.00 0.00 O ATOM 1917 CB ILE A 153 10.088 7.427 -6.012 1.00 0.00 C ATOM 1918 CG1 ILE A 153 9.912 6.673 -4.692 1.00 0.00 C ATOM 1919 CG2 ILE A 153 11.491 8.007 -6.113 1.00 0.00 C ATOM 1920 CD1 ILE A 153 10.556 7.363 -3.511 1.00 0.00 C ATOM 0 H ILE A 153 8.342 8.424 -4.159 1.00 0.00 H new ATOM 0 HA ILE A 153 9.449 9.360 -6.728 1.00 0.00 H new ATOM 0 HB ILE A 153 9.947 6.724 -6.833 1.00 0.00 H new ATOM 0 HG12 ILE A 153 8.848 6.548 -4.493 1.00 0.00 H new ATOM 0 HG13 ILE A 153 10.336 5.674 -4.794 1.00 0.00 H new ATOM 0 HG21 ILE A 153 12.224 7.205 -6.026 1.00 0.00 H new ATOM 0 HG22 ILE A 153 11.611 8.504 -7.075 1.00 0.00 H new ATOM 0 HG23 ILE A 153 11.645 8.728 -5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 153 10.391 6.772 -2.610 1.00 0.00 H new ATOM 0 HD12 ILE A 153 11.627 7.464 -3.688 1.00 0.00 H new ATOM 0 HD13 ILE A 153 10.115 8.351 -3.382 1.00 0.00 H new ATOM 1932 N GLU A 154 7.948 7.644 -8.104 1.00 0.00 N ATOM 1933 CA GLU A 154 6.842 7.098 -8.882 1.00 0.00 C ATOM 1934 C GLU A 154 7.165 5.691 -9.376 1.00 0.00 C ATOM 1935 O GLU A 154 6.495 5.162 -10.263 1.00 0.00 O ATOM 1936 CB GLU A 154 6.529 8.008 -10.072 1.00 0.00 C ATOM 1937 CG GLU A 154 7.735 8.304 -10.946 1.00 0.00 C ATOM 1938 CD GLU A 154 7.419 9.274 -12.068 1.00 0.00 C ATOM 1939 OE1 GLU A 154 6.934 10.386 -11.773 1.00 0.00 O ATOM 1940 OE2 GLU A 154 7.658 8.920 -13.242 1.00 0.00 O ATOM 0 H GLU A 154 8.824 7.732 -8.619 1.00 0.00 H new ATOM 0 HA GLU A 154 5.968 7.044 -8.233 1.00 0.00 H new ATOM 0 HB2 GLU A 154 5.755 7.541 -10.681 1.00 0.00 H new ATOM 0 HB3 GLU A 154 6.120 8.948 -9.702 1.00 0.00 H new ATOM 0 HG2 GLU A 154 8.534 8.716 -10.329 1.00 0.00 H new ATOM 0 HG3 GLU A 154 8.109 7.372 -11.371 1.00 0.00 H new ATOM 1947 N VAL A 155 8.199 5.090 -8.795 1.00 0.00 N ATOM 1948 CA VAL A 155 8.612 3.744 -9.175 1.00 0.00 C ATOM 1949 C VAL A 155 8.769 3.623 -10.686 1.00 0.00 C ATOM 1950 O VAL A 155 8.423 4.539 -11.431 1.00 0.00 O ATOM 1951 CB VAL A 155 7.601 2.688 -8.688 1.00 0.00 C ATOM 1952 CG1 VAL A 155 6.337 2.731 -9.533 1.00 0.00 C ATOM 1953 CG2 VAL A 155 8.225 1.301 -8.717 1.00 0.00 C ATOM 0 H VAL A 155 8.765 5.514 -8.060 1.00 0.00 H new ATOM 0 HA VAL A 155 9.575 3.562 -8.697 1.00 0.00 H new ATOM 0 HB VAL A 155 7.329 2.917 -7.658 1.00 0.00 H new ATOM 0 HG11 VAL A 155 5.634 1.979 -9.175 1.00 0.00 H new ATOM 0 HG12 VAL A 155 5.882 3.718 -9.457 1.00 0.00 H new ATOM 0 HG13 VAL A 155 6.588 2.527 -10.574 1.00 0.00 H new ATOM 0 HG21 VAL A 155 7.497 0.567 -8.370 1.00 0.00 H new ATOM 0 HG22 VAL A 155 8.527 1.059 -9.736 1.00 0.00 H new ATOM 0 HG23 VAL A 155 9.099 1.281 -8.066 1.00 0.00 H new ATOM 1963 N GLN A 156 9.293 2.486 -11.132 1.00 0.00 N ATOM 1964 CA GLN A 156 9.496 2.245 -12.556 1.00 0.00 C ATOM 1965 C GLN A 156 8.889 0.910 -12.974 1.00 0.00 C ATOM 1966 O GLN A 156 9.181 -0.128 -12.382 1.00 0.00 O ATOM 1967 CB GLN A 156 10.989 2.267 -12.890 1.00 0.00 C ATOM 1968 CG GLN A 156 11.695 3.536 -12.441 1.00 0.00 C ATOM 1969 CD GLN A 156 13.169 3.318 -12.167 1.00 0.00 C ATOM 1970 OE1 GLN A 156 13.617 2.187 -11.978 1.00 0.00 O ATOM 1971 NE2 GLN A 156 13.934 4.403 -12.144 1.00 0.00 N ATOM 0 H GLN A 156 9.585 1.717 -10.528 1.00 0.00 H new ATOM 0 HA GLN A 156 8.995 3.040 -13.109 1.00 0.00 H new ATOM 0 HB2 GLN A 156 11.470 1.408 -12.421 1.00 0.00 H new ATOM 0 HB3 GLN A 156 11.113 2.154 -13.967 1.00 0.00 H new ATOM 0 HG2 GLN A 156 11.581 4.301 -13.209 1.00 0.00 H new ATOM 0 HG3 GLN A 156 11.214 3.915 -11.539 1.00 0.00 H new ATOM 0 HE21 GLN A 156 13.521 5.322 -12.306 1.00 0.00 H new ATOM 0 HE22 GLN A 156 14.934 4.318 -11.964 1.00 0.00 H new ATOM 1980 N ALA A 157 8.043 0.946 -13.998 1.00 0.00 N ATOM 1981 CA ALA A 157 7.395 -0.261 -14.497 1.00 0.00 C ATOM 1982 C ALA A 157 8.411 -1.208 -15.128 1.00 0.00 C ATOM 1983 O ALA A 157 8.731 -2.255 -14.564 1.00 0.00 O ATOM 1984 CB ALA A 157 6.311 0.099 -15.502 1.00 0.00 C ATOM 0 H ALA A 157 7.790 1.798 -14.498 1.00 0.00 H new ATOM 0 HA ALA A 157 6.935 -0.773 -13.652 1.00 0.00 H new ATOM 0 HB1 ALA A 157 5.836 -0.812 -15.866 1.00 0.00 H new ATOM 0 HB2 ALA A 157 5.564 0.731 -15.021 1.00 0.00 H new ATOM 0 HB3 ALA A 157 6.755 0.636 -16.340 1.00 0.00 H new TER 1990 ALA A 157