USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 807 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 88 TYR OH : rot -92:sc= 0.171 USER MOD Set 1.2: A 92 GLN : amide:sc= -1.29 X(o=-1.1,f=-1.2) USER MOD Set 2.1: A 18 SER OG : rot 180:sc= 0.00509 USER MOD Set 2.2: A 79 TYR OH : rot -142:sc= 0.00494 USER MOD Set 3.1: A 45 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.113 USER MOD Single : A 5 SER OG : rot 60:sc= 0.196 USER MOD Single : A 6 SER OG : rot 76:sc= 0.751 USER MOD Single : A 9 GLN : amide:sc= -0.862 K(o=-0.86,f=-3.8!) USER MOD Single : A 11 SER OG : rot 31:sc= 0.823 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.176 USER MOD Single : A 15 SER OG : rot 94:sc= 0.0298 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HD1:sc= -0.0054 X(o=-0.0054,f=-0.014) USER MOD Single : A 27 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0112) USER MOD Single : A 28 ASN : amide:sc= -2.46! K(o=-2.5!,f=-3.7) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot -31:sc= 1.19 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 148:sc= -0.2 (180deg=-1.04) USER MOD Single : A 46 HIS : no HD1:sc= -3.78! C(o=-3.8!,f=-7.4!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= 1.05 K(o=1,f=-0.045) USER MOD Single : A 53 ASN : amide:sc= -3.23 K(o=-3.2,f=-7.8!) USER MOD Single : A 61 LYS NZ :NH3+ -154:sc= -0.375 (180deg=-1.38) USER MOD Single : A 64 ASN : amide:sc= -5.96! C(o=-6!,f=-7.3!) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 HIS : no HE2:sc= -3.47 X(o=-3.5,f=-3.2) USER MOD Single : A 71 THR OG1 : rot -38:sc= -0.905 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.024) USER MOD Single : A 77 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 81 LYS NZ :NH3+ 149:sc= -0.346 (180deg=-1.75!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc=-0.00882 USER MOD Single : A 97 ASN : amide:sc= -0.0778 X(o=-0.078,f=0) USER MOD Single : A 99 ASN : amide:sc= -0.0267 K(o=-0.027,f=-1.6!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot -138:sc= 1.37 USER MOD Single : A 104 SER OG : rot 97:sc= 1.17 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -57:sc= 0.153 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.516 -31.404 -3.083 1.00 0.00 N ATOM 2 CA GLY A 1 -9.934 -31.248 -3.346 1.00 0.00 C ATOM 3 C GLY A 1 -10.215 -30.205 -4.409 1.00 0.00 C ATOM 4 O GLY A 1 -10.438 -30.538 -5.573 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.377 -32.128 -2.349 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.031 -31.697 -3.955 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.122 -30.499 -2.756 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.349 -32.205 -3.662 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.443 -30.968 -2.424 1.00 0.00 H new ATOM 8 N SER A 2 -10.206 -28.937 -4.009 1.00 0.00 N ATOM 9 CA SER A 2 -10.467 -27.841 -4.935 1.00 0.00 C ATOM 10 C SER A 2 -9.530 -27.911 -6.137 1.00 0.00 C ATOM 11 O SER A 2 -8.309 -27.931 -5.986 1.00 0.00 O ATOM 12 CB SER A 2 -10.304 -26.496 -4.225 1.00 0.00 C ATOM 13 OG SER A 2 -11.185 -26.392 -3.120 1.00 0.00 O ATOM 0 H SER A 2 -10.021 -28.644 -3.050 1.00 0.00 H new ATOM 0 HA SER A 2 -11.493 -27.934 -5.290 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.275 -26.383 -3.885 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.499 -25.685 -4.927 1.00 0.00 H new ATOM 0 HG SER A 2 -11.060 -25.524 -2.682 1.00 0.00 H new ATOM 19 N SER A 3 -10.113 -27.949 -7.331 1.00 0.00 N ATOM 20 CA SER A 3 -9.332 -28.020 -8.561 1.00 0.00 C ATOM 21 C SER A 3 -10.136 -27.495 -9.746 1.00 0.00 C ATOM 22 O SER A 3 -11.361 -27.401 -9.688 1.00 0.00 O ATOM 23 CB SER A 3 -8.892 -29.461 -8.827 1.00 0.00 C ATOM 24 OG SER A 3 -8.204 -29.565 -10.062 1.00 0.00 O ATOM 0 H SER A 3 -11.123 -27.932 -7.473 1.00 0.00 H new ATOM 0 HA SER A 3 -8.448 -27.394 -8.438 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.247 -29.803 -8.018 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.764 -30.115 -8.837 1.00 0.00 H new ATOM 0 HG SER A 3 -7.932 -30.495 -10.208 1.00 0.00 H new ATOM 30 N GLY A 4 -9.435 -27.153 -10.823 1.00 0.00 N ATOM 31 CA GLY A 4 -10.098 -26.640 -12.008 1.00 0.00 C ATOM 32 C GLY A 4 -9.135 -26.398 -13.153 1.00 0.00 C ATOM 33 O GLY A 4 -8.533 -27.335 -13.676 1.00 0.00 O ATOM 0 H GLY A 4 -8.420 -27.222 -10.896 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.865 -27.346 -12.326 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.606 -25.708 -11.761 1.00 0.00 H new ATOM 37 N SER A 5 -8.989 -25.136 -13.544 1.00 0.00 N ATOM 38 CA SER A 5 -8.096 -24.773 -14.638 1.00 0.00 C ATOM 39 C SER A 5 -8.093 -25.852 -15.717 1.00 0.00 C ATOM 40 O SER A 5 -7.040 -26.220 -16.239 1.00 0.00 O ATOM 41 CB SER A 5 -6.675 -24.555 -14.114 1.00 0.00 C ATOM 42 OG SER A 5 -6.073 -25.784 -13.748 1.00 0.00 O ATOM 0 H SER A 5 -9.478 -24.348 -13.119 1.00 0.00 H new ATOM 0 HA SER A 5 -8.459 -23.844 -15.078 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.073 -24.065 -14.879 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.700 -23.888 -13.252 1.00 0.00 H new ATOM 0 HG SER A 5 -6.032 -26.374 -14.530 1.00 0.00 H new ATOM 48 N SER A 6 -9.278 -26.355 -16.046 1.00 0.00 N ATOM 49 CA SER A 6 -9.413 -27.394 -17.060 1.00 0.00 C ATOM 50 C SER A 6 -10.744 -27.268 -17.794 1.00 0.00 C ATOM 51 O SER A 6 -11.740 -26.823 -17.224 1.00 0.00 O ATOM 52 CB SER A 6 -9.300 -28.779 -16.419 1.00 0.00 C ATOM 53 OG SER A 6 -7.999 -28.996 -15.900 1.00 0.00 O ATOM 0 H SER A 6 -10.159 -26.060 -15.625 1.00 0.00 H new ATOM 0 HA SER A 6 -8.607 -27.269 -17.783 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.035 -28.874 -15.619 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.533 -29.545 -17.158 1.00 0.00 H new ATOM 0 HG SER A 6 -7.894 -28.498 -15.062 1.00 0.00 H new ATOM 59 N GLY A 7 -10.754 -27.664 -19.063 1.00 0.00 N ATOM 60 CA GLY A 7 -11.967 -27.588 -19.855 1.00 0.00 C ATOM 61 C GLY A 7 -11.884 -26.535 -20.942 1.00 0.00 C ATOM 62 O GLY A 7 -10.919 -25.774 -21.007 1.00 0.00 O ATOM 0 H GLY A 7 -9.943 -28.036 -19.557 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.163 -28.560 -20.309 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.811 -27.366 -19.202 1.00 0.00 H new ATOM 66 N ARG A 8 -12.899 -26.491 -21.800 1.00 0.00 N ATOM 67 CA ARG A 8 -12.935 -25.526 -22.892 1.00 0.00 C ATOM 68 C ARG A 8 -13.684 -24.263 -22.476 1.00 0.00 C ATOM 69 O ARG A 8 -14.631 -23.845 -23.142 1.00 0.00 O ATOM 70 CB ARG A 8 -13.598 -26.143 -24.125 1.00 0.00 C ATOM 71 CG ARG A 8 -15.019 -26.621 -23.877 1.00 0.00 C ATOM 72 CD ARG A 8 -15.777 -26.817 -25.181 1.00 0.00 C ATOM 73 NE ARG A 8 -17.213 -26.612 -25.015 1.00 0.00 N ATOM 74 CZ ARG A 8 -18.044 -27.551 -24.576 1.00 0.00 C ATOM 75 NH1 ARG A 8 -17.583 -28.753 -24.260 1.00 0.00 N ATOM 76 NH2 ARG A 8 -19.339 -27.287 -24.452 1.00 0.00 N ATOM 0 H ARG A 8 -13.707 -27.112 -21.759 1.00 0.00 H new ATOM 0 HA ARG A 8 -11.908 -25.255 -23.138 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -13.606 -25.407 -24.929 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -12.996 -26.984 -24.469 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -14.997 -27.560 -23.323 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -15.544 -25.896 -23.255 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -15.396 -26.123 -25.930 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -15.596 -27.824 -25.558 1.00 0.00 H new ATOM 0 HE ARG A 8 -17.599 -25.698 -25.249 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -16.588 -28.959 -24.354 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -18.223 -29.472 -23.923 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -19.697 -26.363 -24.694 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -19.977 -28.008 -24.115 1.00 0.00 H new ATOM 90 N GLN A 9 -13.253 -23.662 -21.372 1.00 0.00 N ATOM 91 CA GLN A 9 -13.885 -22.448 -20.868 1.00 0.00 C ATOM 92 C GLN A 9 -12.879 -21.304 -20.789 1.00 0.00 C ATOM 93 O GLN A 9 -11.676 -21.510 -20.949 1.00 0.00 O ATOM 94 CB GLN A 9 -14.496 -22.701 -19.489 1.00 0.00 C ATOM 95 CG GLN A 9 -15.914 -23.246 -19.543 1.00 0.00 C ATOM 96 CD GLN A 9 -16.908 -22.236 -20.083 1.00 0.00 C ATOM 97 OE1 GLN A 9 -17.062 -21.145 -19.533 1.00 0.00 O ATOM 98 NE2 GLN A 9 -17.588 -22.595 -21.165 1.00 0.00 N ATOM 0 H GLN A 9 -12.470 -23.995 -20.810 1.00 0.00 H new ATOM 0 HA GLN A 9 -14.676 -22.165 -21.562 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -13.866 -23.404 -18.945 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -14.495 -21.769 -18.924 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -15.932 -24.138 -20.169 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -16.220 -23.552 -18.542 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -17.428 -23.509 -21.588 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -18.270 -21.957 -21.574 1.00 0.00 H new ATOM 107 N ARG A 10 -13.381 -20.098 -20.542 1.00 0.00 N ATOM 108 CA ARG A 10 -12.526 -18.921 -20.443 1.00 0.00 C ATOM 109 C ARG A 10 -11.341 -19.185 -19.519 1.00 0.00 C ATOM 110 O ARG A 10 -11.267 -20.230 -18.872 1.00 0.00 O ATOM 111 CB ARG A 10 -13.329 -17.723 -19.931 1.00 0.00 C ATOM 112 CG ARG A 10 -14.535 -17.386 -20.793 1.00 0.00 C ATOM 113 CD ARG A 10 -15.514 -16.488 -20.053 1.00 0.00 C ATOM 114 NE ARG A 10 -16.420 -17.251 -19.200 1.00 0.00 N ATOM 115 CZ ARG A 10 -17.322 -18.108 -19.667 1.00 0.00 C ATOM 116 NH1 ARG A 10 -17.436 -18.310 -20.972 1.00 0.00 N ATOM 117 NH2 ARG A 10 -18.111 -18.766 -18.827 1.00 0.00 N ATOM 0 H ARG A 10 -14.375 -19.911 -20.407 1.00 0.00 H new ATOM 0 HA ARG A 10 -12.144 -18.696 -21.439 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -13.665 -17.929 -18.915 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -12.675 -16.853 -19.880 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -14.204 -16.891 -21.706 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -15.038 -18.305 -21.093 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -14.961 -15.772 -19.445 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -16.094 -15.912 -20.774 1.00 0.00 H new ATOM 0 HE ARG A 10 -16.357 -17.119 -18.190 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -16.830 -17.807 -21.621 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -18.129 -18.968 -21.328 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -18.025 -18.614 -17.822 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -18.803 -19.424 -19.186 1.00 0.00 H new ATOM 131 N SER A 11 -10.417 -18.232 -19.463 1.00 0.00 N ATOM 132 CA SER A 11 -9.233 -18.363 -18.621 1.00 0.00 C ATOM 133 C SER A 11 -9.263 -17.350 -17.480 1.00 0.00 C ATOM 134 O SER A 11 -9.238 -16.140 -17.708 1.00 0.00 O ATOM 135 CB SER A 11 -7.965 -18.171 -19.455 1.00 0.00 C ATOM 136 OG SER A 11 -7.846 -16.832 -19.903 1.00 0.00 O ATOM 0 H SER A 11 -10.465 -17.360 -19.991 1.00 0.00 H new ATOM 0 HA SER A 11 -9.230 -19.366 -18.194 1.00 0.00 H new ATOM 0 HB2 SER A 11 -7.091 -18.438 -18.860 1.00 0.00 H new ATOM 0 HB3 SER A 11 -7.985 -18.844 -20.312 1.00 0.00 H new ATOM 0 HG SER A 11 -8.252 -16.230 -19.245 1.00 0.00 H new ATOM 142 N LEU A 12 -9.316 -17.854 -16.252 1.00 0.00 N ATOM 143 CA LEU A 12 -9.349 -16.995 -15.074 1.00 0.00 C ATOM 144 C LEU A 12 -8.193 -16.000 -15.092 1.00 0.00 C ATOM 145 O LEU A 12 -7.256 -16.136 -15.880 1.00 0.00 O ATOM 146 CB LEU A 12 -9.289 -17.840 -13.800 1.00 0.00 C ATOM 147 CG LEU A 12 -10.348 -18.936 -13.671 1.00 0.00 C ATOM 148 CD1 LEU A 12 -9.834 -20.076 -12.806 1.00 0.00 C ATOM 149 CD2 LEU A 12 -11.637 -18.367 -13.096 1.00 0.00 C ATOM 0 H LEU A 12 -9.337 -18.853 -16.046 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.285 -16.437 -15.089 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -8.305 -18.305 -13.742 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -9.378 -17.174 -12.942 1.00 0.00 H new ATOM 0 HG LEU A 12 -10.560 -19.329 -14.665 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.601 -20.846 -12.726 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.939 -20.501 -13.259 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.593 -19.699 -11.812 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -12.379 -19.161 -13.011 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.441 -17.947 -12.110 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -12.015 -17.585 -13.755 1.00 0.00 H new ATOM 161 N SER A 13 -8.264 -15.001 -14.219 1.00 0.00 N ATOM 162 CA SER A 13 -7.224 -13.983 -14.136 1.00 0.00 C ATOM 163 C SER A 13 -6.667 -13.889 -12.718 1.00 0.00 C ATOM 164 O SER A 13 -7.144 -14.563 -11.805 1.00 0.00 O ATOM 165 CB SER A 13 -7.776 -12.623 -14.569 1.00 0.00 C ATOM 166 OG SER A 13 -8.835 -12.210 -13.723 1.00 0.00 O ATOM 0 H SER A 13 -9.031 -14.875 -13.559 1.00 0.00 H new ATOM 0 HA SER A 13 -6.415 -14.270 -14.808 1.00 0.00 H new ATOM 0 HB2 SER A 13 -6.979 -11.880 -14.548 1.00 0.00 H new ATOM 0 HB3 SER A 13 -8.130 -12.682 -15.598 1.00 0.00 H new ATOM 0 HG SER A 13 -9.169 -11.338 -14.019 1.00 0.00 H new ATOM 172 N THR A 14 -5.652 -13.049 -12.542 1.00 0.00 N ATOM 173 CA THR A 14 -5.028 -12.867 -11.238 1.00 0.00 C ATOM 174 C THR A 14 -4.446 -11.465 -11.098 1.00 0.00 C ATOM 175 O THR A 14 -3.754 -10.977 -11.992 1.00 0.00 O ATOM 176 CB THR A 14 -3.910 -13.900 -11.001 1.00 0.00 C ATOM 177 OG1 THR A 14 -2.908 -13.349 -10.139 1.00 0.00 O ATOM 178 CG2 THR A 14 -3.277 -14.324 -12.317 1.00 0.00 C ATOM 0 H THR A 14 -5.245 -12.484 -13.287 1.00 0.00 H new ATOM 0 HA THR A 14 -5.809 -13.010 -10.491 1.00 0.00 H new ATOM 0 HB THR A 14 -4.351 -14.778 -10.529 1.00 0.00 H new ATOM 0 HG1 THR A 14 -2.202 -14.013 -9.992 1.00 0.00 H new ATOM 0 HG21 THR A 14 -2.490 -15.054 -12.124 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.036 -14.770 -12.959 1.00 0.00 H new ATOM 0 HG23 THR A 14 -2.850 -13.452 -12.813 1.00 0.00 H new ATOM 186 N SER A 15 -4.730 -10.821 -9.970 1.00 0.00 N ATOM 187 CA SER A 15 -4.236 -9.473 -9.714 1.00 0.00 C ATOM 188 C SER A 15 -2.746 -9.371 -10.026 1.00 0.00 C ATOM 189 O SER A 15 -2.257 -8.322 -10.443 1.00 0.00 O ATOM 190 CB SER A 15 -4.492 -9.081 -8.258 1.00 0.00 C ATOM 191 OG SER A 15 -3.517 -9.647 -7.399 1.00 0.00 O ATOM 0 H SER A 15 -5.300 -11.211 -9.219 1.00 0.00 H new ATOM 0 HA SER A 15 -4.774 -8.786 -10.368 1.00 0.00 H new ATOM 0 HB2 SER A 15 -4.479 -7.995 -8.163 1.00 0.00 H new ATOM 0 HB3 SER A 15 -5.485 -9.416 -7.957 1.00 0.00 H new ATOM 0 HG SER A 15 -2.793 -9.002 -7.256 1.00 0.00 H new ATOM 197 N GLY A 16 -2.029 -10.472 -9.820 1.00 0.00 N ATOM 198 CA GLY A 16 -0.601 -10.487 -10.084 1.00 0.00 C ATOM 199 C GLY A 16 0.211 -9.982 -8.908 1.00 0.00 C ATOM 200 O GLY A 16 0.648 -10.765 -8.065 1.00 0.00 O ATOM 0 H GLY A 16 -2.411 -11.353 -9.475 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.290 -11.503 -10.327 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.390 -9.872 -10.959 1.00 0.00 H new ATOM 204 N GLU A 17 0.414 -8.669 -8.851 1.00 0.00 N ATOM 205 CA GLU A 17 1.182 -8.062 -7.770 1.00 0.00 C ATOM 206 C GLU A 17 0.273 -7.679 -6.606 1.00 0.00 C ATOM 207 O GLU A 17 -0.952 -7.717 -6.722 1.00 0.00 O ATOM 208 CB GLU A 17 1.928 -6.826 -8.277 1.00 0.00 C ATOM 209 CG GLU A 17 1.089 -5.560 -8.265 1.00 0.00 C ATOM 210 CD GLU A 17 -0.173 -5.689 -9.096 1.00 0.00 C ATOM 211 OE1 GLU A 17 -0.102 -6.278 -10.194 1.00 0.00 O ATOM 212 OE2 GLU A 17 -1.231 -5.200 -8.648 1.00 0.00 O ATOM 0 H GLU A 17 0.058 -8.006 -9.540 1.00 0.00 H new ATOM 0 HA GLU A 17 1.907 -8.795 -7.417 1.00 0.00 H new ATOM 0 HB2 GLU A 17 2.815 -6.670 -7.662 1.00 0.00 H new ATOM 0 HB3 GLU A 17 2.274 -7.013 -9.294 1.00 0.00 H new ATOM 0 HG2 GLU A 17 0.820 -5.317 -7.237 1.00 0.00 H new ATOM 0 HG3 GLU A 17 1.685 -4.730 -8.643 1.00 0.00 H new ATOM 219 N SER A 18 0.882 -7.310 -5.484 1.00 0.00 N ATOM 220 CA SER A 18 0.129 -6.924 -4.296 1.00 0.00 C ATOM 221 C SER A 18 0.679 -5.631 -3.701 1.00 0.00 C ATOM 222 O SER A 18 1.568 -4.999 -4.273 1.00 0.00 O ATOM 223 CB SER A 18 0.176 -8.040 -3.251 1.00 0.00 C ATOM 224 OG SER A 18 -0.909 -8.937 -3.414 1.00 0.00 O ATOM 0 H SER A 18 1.895 -7.270 -5.372 1.00 0.00 H new ATOM 0 HA SER A 18 -0.907 -6.756 -4.591 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.117 -8.583 -3.337 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.147 -7.608 -2.251 1.00 0.00 H new ATOM 0 HG SER A 18 -0.856 -9.642 -2.735 1.00 0.00 H new ATOM 230 N LEU A 19 0.143 -5.243 -2.549 1.00 0.00 N ATOM 231 CA LEU A 19 0.578 -4.025 -1.874 1.00 0.00 C ATOM 232 C LEU A 19 2.085 -3.834 -2.015 1.00 0.00 C ATOM 233 O LEU A 19 2.549 -2.783 -2.458 1.00 0.00 O ATOM 234 CB LEU A 19 0.195 -4.073 -0.394 1.00 0.00 C ATOM 235 CG LEU A 19 -1.296 -4.229 -0.092 1.00 0.00 C ATOM 236 CD1 LEU A 19 -1.503 -4.748 1.322 1.00 0.00 C ATOM 237 CD2 LEU A 19 -2.021 -2.905 -0.287 1.00 0.00 C ATOM 0 H LEU A 19 -0.594 -5.754 -2.063 1.00 0.00 H new ATOM 0 HA LEU A 19 0.077 -3.179 -2.345 1.00 0.00 H new ATOM 0 HB2 LEU A 19 0.728 -4.901 0.072 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.548 -3.158 0.082 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.714 -4.956 -0.789 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.570 -4.853 1.519 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.018 -5.718 1.428 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.070 -4.046 2.034 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.081 -3.035 -0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.600 -2.157 0.385 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.902 -2.573 -1.318 1.00 0.00 H new ATOM 249 N TYR A 20 2.844 -4.857 -1.636 1.00 0.00 N ATOM 250 CA TYR A 20 4.298 -4.801 -1.720 1.00 0.00 C ATOM 251 C TYR A 20 4.744 -3.956 -2.909 1.00 0.00 C ATOM 252 O TYR A 20 5.637 -3.117 -2.790 1.00 0.00 O ATOM 253 CB TYR A 20 4.877 -6.212 -1.837 1.00 0.00 C ATOM 254 CG TYR A 20 4.073 -7.260 -1.100 1.00 0.00 C ATOM 255 CD1 TYR A 20 2.965 -7.855 -1.690 1.00 0.00 C ATOM 256 CD2 TYR A 20 4.421 -7.653 0.187 1.00 0.00 C ATOM 257 CE1 TYR A 20 2.227 -8.812 -1.020 1.00 0.00 C ATOM 258 CE2 TYR A 20 3.690 -8.610 0.863 1.00 0.00 C ATOM 259 CZ TYR A 20 2.594 -9.186 0.256 1.00 0.00 C ATOM 260 OH TYR A 20 1.862 -10.139 0.927 1.00 0.00 O ATOM 0 H TYR A 20 2.476 -5.734 -1.268 1.00 0.00 H new ATOM 0 HA TYR A 20 4.671 -4.336 -0.808 1.00 0.00 H new ATOM 0 HB2 TYR A 20 4.935 -6.485 -2.891 1.00 0.00 H new ATOM 0 HB3 TYR A 20 5.896 -6.210 -1.451 1.00 0.00 H new ATOM 0 HD1 TYR A 20 2.676 -7.565 -2.689 1.00 0.00 H new ATOM 0 HD2 TYR A 20 5.277 -7.202 0.666 1.00 0.00 H new ATOM 0 HE1 TYR A 20 1.368 -9.265 -1.493 1.00 0.00 H new ATOM 0 HE2 TYR A 20 3.975 -8.906 1.862 1.00 0.00 H new ATOM 0 HH TYR A 20 2.253 -10.288 1.813 1.00 0.00 H new ATOM 270 N HIS A 21 4.115 -4.185 -4.058 1.00 0.00 N ATOM 271 CA HIS A 21 4.444 -3.444 -5.270 1.00 0.00 C ATOM 272 C HIS A 21 4.273 -1.944 -5.054 1.00 0.00 C ATOM 273 O HIS A 21 5.161 -1.154 -5.378 1.00 0.00 O ATOM 274 CB HIS A 21 3.564 -3.908 -6.432 1.00 0.00 C ATOM 275 CG HIS A 21 4.221 -3.776 -7.771 1.00 0.00 C ATOM 276 ND1 HIS A 21 3.820 -2.859 -8.719 1.00 0.00 N ATOM 277 CD2 HIS A 21 5.259 -4.451 -8.318 1.00 0.00 C ATOM 278 CE1 HIS A 21 4.581 -2.977 -9.793 1.00 0.00 C ATOM 279 NE2 HIS A 21 5.463 -3.936 -9.575 1.00 0.00 N ATOM 0 H HIS A 21 3.375 -4.877 -4.175 1.00 0.00 H new ATOM 0 HA HIS A 21 5.488 -3.641 -5.514 1.00 0.00 H new ATOM 0 HB2 HIS A 21 3.287 -4.950 -6.274 1.00 0.00 H new ATOM 0 HB3 HIS A 21 2.640 -3.329 -6.431 1.00 0.00 H new ATOM 0 HD2 HIS A 21 5.822 -5.247 -7.853 1.00 0.00 H new ATOM 0 HE1 HIS A 21 4.496 -2.389 -10.695 1.00 0.00 H new ATOM 0 HE2 HIS A 21 6.179 -4.244 -10.233 1.00 0.00 H new ATOM 287 N VAL A 22 3.126 -1.557 -4.506 1.00 0.00 N ATOM 288 CA VAL A 22 2.838 -0.151 -4.247 1.00 0.00 C ATOM 289 C VAL A 22 4.047 0.555 -3.644 1.00 0.00 C ATOM 290 O VAL A 22 4.261 1.747 -3.872 1.00 0.00 O ATOM 291 CB VAL A 22 1.637 0.010 -3.296 1.00 0.00 C ATOM 292 CG1 VAL A 22 2.109 0.124 -1.854 1.00 0.00 C ATOM 293 CG2 VAL A 22 0.804 1.220 -3.691 1.00 0.00 C ATOM 0 H VAL A 22 2.381 -2.197 -4.233 1.00 0.00 H new ATOM 0 HA VAL A 22 2.596 0.305 -5.207 1.00 0.00 H new ATOM 0 HB VAL A 22 1.009 -0.877 -3.378 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.247 0.237 -1.197 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.659 -0.776 -1.579 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.760 0.993 -1.752 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -0.040 1.319 -3.009 1.00 0.00 H new ATOM 0 HG22 VAL A 22 1.420 2.118 -3.639 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.435 1.091 -4.709 1.00 0.00 H new ATOM 303 N LEU A 23 4.836 -0.187 -2.875 1.00 0.00 N ATOM 304 CA LEU A 23 6.026 0.368 -2.239 1.00 0.00 C ATOM 305 C LEU A 23 7.263 0.133 -3.100 1.00 0.00 C ATOM 306 O LEU A 23 7.938 1.078 -3.506 1.00 0.00 O ATOM 307 CB LEU A 23 6.227 -0.255 -0.857 1.00 0.00 C ATOM 308 CG LEU A 23 4.953 -0.615 -0.091 1.00 0.00 C ATOM 309 CD1 LEU A 23 5.288 -1.432 1.147 1.00 0.00 C ATOM 310 CD2 LEU A 23 4.186 0.643 0.289 1.00 0.00 C ATOM 0 H LEU A 23 4.673 -1.174 -2.677 1.00 0.00 H new ATOM 0 HA LEU A 23 5.881 1.443 -2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.826 -1.159 -0.972 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.809 0.438 -0.249 1.00 0.00 H new ATOM 0 HG LEU A 23 4.320 -1.220 -0.740 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.370 -1.679 1.679 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.794 -2.351 0.851 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.941 -0.853 1.800 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.283 0.368 0.833 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.812 1.274 0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.913 1.190 -0.614 1.00 0.00 H new ATOM 322 N GLY A 24 7.553 -1.135 -3.377 1.00 0.00 N ATOM 323 CA GLY A 24 8.707 -1.471 -4.190 1.00 0.00 C ATOM 324 C GLY A 24 9.382 -2.751 -3.738 1.00 0.00 C ATOM 325 O GLY A 24 10.606 -2.875 -3.807 1.00 0.00 O ATOM 0 H GLY A 24 7.009 -1.935 -3.053 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.397 -1.575 -5.230 1.00 0.00 H new ATOM 0 HA3 GLY A 24 9.425 -0.652 -4.152 1.00 0.00 H new ATOM 329 N LEU A 25 8.584 -3.706 -3.272 1.00 0.00 N ATOM 330 CA LEU A 25 9.111 -4.983 -2.805 1.00 0.00 C ATOM 331 C LEU A 25 8.286 -6.145 -3.349 1.00 0.00 C ATOM 332 O LEU A 25 7.335 -5.943 -4.104 1.00 0.00 O ATOM 333 CB LEU A 25 9.124 -5.024 -1.276 1.00 0.00 C ATOM 334 CG LEU A 25 10.045 -4.018 -0.585 1.00 0.00 C ATOM 335 CD1 LEU A 25 9.627 -3.817 0.863 1.00 0.00 C ATOM 336 CD2 LEU A 25 11.493 -4.480 -0.664 1.00 0.00 C ATOM 0 H LEU A 25 7.570 -3.620 -3.208 1.00 0.00 H new ATOM 0 HA LEU A 25 10.132 -5.083 -3.174 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.107 -4.860 -0.920 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.414 -6.027 -0.962 1.00 0.00 H new ATOM 0 HG LEU A 25 9.960 -3.062 -1.102 1.00 0.00 H new ATOM 0 HD11 LEU A 25 10.294 -3.098 1.338 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.604 -3.441 0.898 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.682 -4.768 1.393 1.00 0.00 H new ATOM 0 HD21 LEU A 25 12.135 -3.752 -0.167 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.594 -5.448 -0.172 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.789 -4.571 -1.709 1.00 0.00 H new ATOM 348 N ASP A 26 8.655 -7.360 -2.959 1.00 0.00 N ATOM 349 CA ASP A 26 7.947 -8.554 -3.405 1.00 0.00 C ATOM 350 C ASP A 26 7.419 -9.349 -2.214 1.00 0.00 C ATOM 351 O ASP A 26 7.729 -9.043 -1.063 1.00 0.00 O ATOM 352 CB ASP A 26 8.869 -9.433 -4.252 1.00 0.00 C ATOM 353 CG ASP A 26 9.802 -8.619 -5.127 1.00 0.00 C ATOM 354 OD1 ASP A 26 10.610 -7.846 -4.572 1.00 0.00 O ATOM 355 OD2 ASP A 26 9.723 -8.755 -6.366 1.00 0.00 O ATOM 0 H ASP A 26 9.440 -7.544 -2.335 1.00 0.00 H new ATOM 0 HA ASP A 26 7.099 -8.238 -4.013 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.458 -10.074 -3.596 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.265 -10.088 -4.880 1.00 0.00 H new ATOM 360 N LYS A 27 6.617 -10.369 -2.500 1.00 0.00 N ATOM 361 CA LYS A 27 6.044 -11.208 -1.454 1.00 0.00 C ATOM 362 C LYS A 27 7.129 -11.715 -0.509 1.00 0.00 C ATOM 363 O LYS A 27 6.921 -11.800 0.701 1.00 0.00 O ATOM 364 CB LYS A 27 5.298 -12.393 -2.073 1.00 0.00 C ATOM 365 CG LYS A 27 4.187 -11.982 -3.024 1.00 0.00 C ATOM 366 CD LYS A 27 2.865 -11.809 -2.295 1.00 0.00 C ATOM 367 CE LYS A 27 1.802 -11.211 -3.203 1.00 0.00 C ATOM 368 NZ LYS A 27 1.441 -12.132 -4.316 1.00 0.00 N ATOM 0 H LYS A 27 6.349 -10.635 -3.448 1.00 0.00 H new ATOM 0 HA LYS A 27 5.341 -10.603 -0.882 1.00 0.00 H new ATOM 0 HB2 LYS A 27 6.010 -13.020 -2.609 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.875 -13.002 -1.275 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.456 -11.048 -3.518 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.077 -12.735 -3.804 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.525 -12.775 -1.922 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.008 -11.165 -1.427 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.911 -10.982 -2.618 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.164 -10.269 -3.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.678 -11.710 -4.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.273 -12.290 -4.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.119 -13.040 -3.925 1.00 0.00 H new ATOM 382 N ASN A 28 8.287 -12.050 -1.069 1.00 0.00 N ATOM 383 CA ASN A 28 9.404 -12.548 -0.275 1.00 0.00 C ATOM 384 C ASN A 28 9.783 -11.551 0.816 1.00 0.00 C ATOM 385 O ASN A 28 10.327 -11.928 1.854 1.00 0.00 O ATOM 386 CB ASN A 28 10.613 -12.821 -1.172 1.00 0.00 C ATOM 387 CG ASN A 28 10.993 -11.618 -2.013 1.00 0.00 C ATOM 388 OD1 ASN A 28 11.360 -10.568 -1.484 1.00 0.00 O ATOM 389 ND2 ASN A 28 10.907 -11.765 -3.330 1.00 0.00 N ATOM 0 H ASN A 28 8.476 -11.986 -2.069 1.00 0.00 H new ATOM 0 HA ASN A 28 9.093 -13.479 0.199 1.00 0.00 H new ATOM 0 HB2 ASN A 28 11.462 -13.111 -0.554 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.393 -13.664 -1.827 1.00 0.00 H new ATOM 0 HD21 ASN A 28 11.150 -10.990 -3.947 1.00 0.00 H new ATOM 0 HD22 ASN A 28 10.598 -12.653 -3.725 1.00 0.00 H new ATOM 396 N ALA A 29 9.490 -10.277 0.575 1.00 0.00 N ATOM 397 CA ALA A 29 9.796 -9.227 1.537 1.00 0.00 C ATOM 398 C ALA A 29 9.045 -9.445 2.846 1.00 0.00 C ATOM 399 O ALA A 29 8.035 -10.148 2.885 1.00 0.00 O ATOM 400 CB ALA A 29 9.460 -7.862 0.954 1.00 0.00 C ATOM 0 H ALA A 29 9.041 -9.948 -0.279 1.00 0.00 H new ATOM 0 HA ALA A 29 10.864 -9.265 1.751 1.00 0.00 H new ATOM 0 HB1 ALA A 29 9.694 -7.087 1.684 1.00 0.00 H new ATOM 0 HB2 ALA A 29 10.047 -7.698 0.050 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.398 -7.822 0.710 1.00 0.00 H new ATOM 406 N THR A 30 9.545 -8.839 3.918 1.00 0.00 N ATOM 407 CA THR A 30 8.923 -8.968 5.230 1.00 0.00 C ATOM 408 C THR A 30 8.614 -7.601 5.829 1.00 0.00 C ATOM 409 O THR A 30 9.181 -6.590 5.417 1.00 0.00 O ATOM 410 CB THR A 30 9.822 -9.753 6.204 1.00 0.00 C ATOM 411 OG1 THR A 30 11.076 -9.080 6.362 1.00 0.00 O ATOM 412 CG2 THR A 30 10.060 -11.168 5.700 1.00 0.00 C ATOM 0 H THR A 30 10.380 -8.253 3.903 1.00 0.00 H new ATOM 0 HA THR A 30 7.992 -9.516 5.086 1.00 0.00 H new ATOM 0 HB THR A 30 9.315 -9.809 7.168 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.642 -9.584 6.984 1.00 0.00 H new ATOM 0 HG21 THR A 30 10.697 -11.703 6.404 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.106 -11.687 5.608 1.00 0.00 H new ATOM 0 HG23 THR A 30 10.548 -11.130 4.726 1.00 0.00 H new ATOM 420 N SER A 31 7.713 -7.578 6.806 1.00 0.00 N ATOM 421 CA SER A 31 7.327 -6.334 7.461 1.00 0.00 C ATOM 422 C SER A 31 8.549 -5.464 7.738 1.00 0.00 C ATOM 423 O SER A 31 8.507 -4.245 7.575 1.00 0.00 O ATOM 424 CB SER A 31 6.590 -6.629 8.769 1.00 0.00 C ATOM 425 OG SER A 31 7.288 -7.588 9.543 1.00 0.00 O ATOM 0 H SER A 31 7.237 -8.407 7.161 1.00 0.00 H new ATOM 0 HA SER A 31 6.660 -5.791 6.791 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.476 -5.708 9.341 1.00 0.00 H new ATOM 0 HB3 SER A 31 5.587 -6.994 8.550 1.00 0.00 H new ATOM 0 HG SER A 31 6.797 -7.758 10.374 1.00 0.00 H new ATOM 431 N ASP A 32 9.637 -6.100 8.158 1.00 0.00 N ATOM 432 CA ASP A 32 10.873 -5.386 8.457 1.00 0.00 C ATOM 433 C ASP A 32 11.325 -4.557 7.259 1.00 0.00 C ATOM 434 O ASP A 32 11.457 -3.336 7.350 1.00 0.00 O ATOM 435 CB ASP A 32 11.973 -6.372 8.855 1.00 0.00 C ATOM 436 CG ASP A 32 12.003 -6.634 10.348 1.00 0.00 C ATOM 437 OD1 ASP A 32 11.671 -5.709 11.119 1.00 0.00 O ATOM 438 OD2 ASP A 32 12.359 -7.763 10.746 1.00 0.00 O ATOM 0 H ASP A 32 9.688 -7.109 8.299 1.00 0.00 H new ATOM 0 HA ASP A 32 10.681 -4.711 9.291 1.00 0.00 H new ATOM 0 HB2 ASP A 32 11.822 -7.313 8.327 1.00 0.00 H new ATOM 0 HB3 ASP A 32 12.940 -5.981 8.538 1.00 0.00 H new ATOM 443 N ASP A 33 11.562 -5.228 6.137 1.00 0.00 N ATOM 444 CA ASP A 33 12.000 -4.554 4.921 1.00 0.00 C ATOM 445 C ASP A 33 11.006 -3.471 4.512 1.00 0.00 C ATOM 446 O ASP A 33 11.393 -2.344 4.202 1.00 0.00 O ATOM 447 CB ASP A 33 12.169 -5.564 3.785 1.00 0.00 C ATOM 448 CG ASP A 33 13.241 -5.149 2.796 1.00 0.00 C ATOM 449 OD1 ASP A 33 14.057 -4.269 3.140 1.00 0.00 O ATOM 450 OD2 ASP A 33 13.263 -5.705 1.678 1.00 0.00 O ATOM 0 H ASP A 33 11.458 -6.238 6.045 1.00 0.00 H new ATOM 0 HA ASP A 33 12.962 -4.082 5.123 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.422 -6.538 4.203 1.00 0.00 H new ATOM 0 HB3 ASP A 33 11.220 -5.679 3.261 1.00 0.00 H new ATOM 455 N ILE A 34 9.724 -3.821 4.512 1.00 0.00 N ATOM 456 CA ILE A 34 8.675 -2.880 4.141 1.00 0.00 C ATOM 457 C ILE A 34 8.811 -1.573 4.916 1.00 0.00 C ATOM 458 O ILE A 34 8.773 -0.488 4.335 1.00 0.00 O ATOM 459 CB ILE A 34 7.275 -3.469 4.393 1.00 0.00 C ATOM 460 CG1 ILE A 34 7.106 -4.784 3.627 1.00 0.00 C ATOM 461 CG2 ILE A 34 6.200 -2.472 3.987 1.00 0.00 C ATOM 462 CD1 ILE A 34 5.997 -5.659 4.168 1.00 0.00 C ATOM 0 H ILE A 34 9.387 -4.750 4.765 1.00 0.00 H new ATOM 0 HA ILE A 34 8.790 -2.683 3.075 1.00 0.00 H new ATOM 0 HB ILE A 34 7.169 -3.674 5.458 1.00 0.00 H new ATOM 0 HG12 ILE A 34 6.904 -4.562 2.579 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.044 -5.338 3.660 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.216 -2.903 4.171 1.00 0.00 H new ATOM 0 HG22 ILE A 34 6.311 -1.559 4.571 1.00 0.00 H new ATOM 0 HG23 ILE A 34 6.302 -2.239 2.927 1.00 0.00 H new ATOM 0 HD11 ILE A 34 5.934 -6.573 3.578 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.207 -5.912 5.207 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.049 -5.123 4.109 1.00 0.00 H new ATOM 474 N LYS A 35 8.971 -1.684 6.230 1.00 0.00 N ATOM 475 CA LYS A 35 9.116 -0.513 7.085 1.00 0.00 C ATOM 476 C LYS A 35 10.076 0.498 6.466 1.00 0.00 C ATOM 477 O LYS A 35 9.896 1.708 6.606 1.00 0.00 O ATOM 478 CB LYS A 35 9.618 -0.926 8.471 1.00 0.00 C ATOM 479 CG LYS A 35 8.504 -1.301 9.434 1.00 0.00 C ATOM 480 CD LYS A 35 9.010 -1.389 10.864 1.00 0.00 C ATOM 481 CE LYS A 35 8.091 -2.238 11.729 1.00 0.00 C ATOM 482 NZ LYS A 35 8.254 -1.932 13.177 1.00 0.00 N ATOM 0 H LYS A 35 9.004 -2.575 6.726 1.00 0.00 H new ATOM 0 HA LYS A 35 8.137 -0.044 7.185 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.296 -1.773 8.365 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.196 -0.106 8.898 1.00 0.00 H new ATOM 0 HG2 LYS A 35 7.706 -0.561 9.374 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.074 -2.258 9.140 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.013 -1.815 10.870 1.00 0.00 H new ATOM 0 HD3 LYS A 35 9.086 -0.387 11.286 1.00 0.00 H new ATOM 0 HE2 LYS A 35 7.055 -2.066 11.436 1.00 0.00 H new ATOM 0 HE3 LYS A 35 8.301 -3.293 11.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.611 -2.531 13.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 9.236 -2.120 13.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 8.029 -0.931 13.348 1.00 0.00 H new ATOM 496 N LYS A 36 11.097 -0.006 5.780 1.00 0.00 N ATOM 497 CA LYS A 36 12.084 0.852 5.136 1.00 0.00 C ATOM 498 C LYS A 36 11.509 1.495 3.879 1.00 0.00 C ATOM 499 O LYS A 36 11.383 2.717 3.797 1.00 0.00 O ATOM 500 CB LYS A 36 13.337 0.046 4.783 1.00 0.00 C ATOM 501 CG LYS A 36 14.158 -0.364 5.993 1.00 0.00 C ATOM 502 CD LYS A 36 13.761 -1.741 6.496 1.00 0.00 C ATOM 503 CE LYS A 36 13.926 -1.853 8.004 1.00 0.00 C ATOM 504 NZ LYS A 36 15.331 -2.164 8.387 1.00 0.00 N ATOM 0 H LYS A 36 11.262 -1.005 5.656 1.00 0.00 H new ATOM 0 HA LYS A 36 12.353 1.643 5.836 1.00 0.00 H new ATOM 0 HB2 LYS A 36 13.041 -0.849 4.235 1.00 0.00 H new ATOM 0 HB3 LYS A 36 13.962 0.637 4.114 1.00 0.00 H new ATOM 0 HG2 LYS A 36 15.217 -0.362 5.733 1.00 0.00 H new ATOM 0 HG3 LYS A 36 14.024 0.368 6.790 1.00 0.00 H new ATOM 0 HD2 LYS A 36 12.724 -1.943 6.226 1.00 0.00 H new ATOM 0 HD3 LYS A 36 14.371 -2.499 6.005 1.00 0.00 H new ATOM 0 HE2 LYS A 36 13.620 -0.918 8.473 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.265 -2.632 8.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 15.402 -2.232 9.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 15.615 -3.069 7.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 15.959 -1.408 8.046 1.00 0.00 H new ATOM 518 N SER A 37 11.161 0.665 2.901 1.00 0.00 N ATOM 519 CA SER A 37 10.601 1.153 1.646 1.00 0.00 C ATOM 520 C SER A 37 9.628 2.302 1.896 1.00 0.00 C ATOM 521 O SER A 37 9.594 3.276 1.145 1.00 0.00 O ATOM 522 CB SER A 37 9.890 0.020 0.905 1.00 0.00 C ATOM 523 OG SER A 37 8.754 -0.427 1.624 1.00 0.00 O ATOM 0 H SER A 37 11.257 -0.349 2.954 1.00 0.00 H new ATOM 0 HA SER A 37 11.421 1.521 1.030 1.00 0.00 H new ATOM 0 HB2 SER A 37 9.586 0.363 -0.084 1.00 0.00 H new ATOM 0 HB3 SER A 37 10.580 -0.811 0.756 1.00 0.00 H new ATOM 0 HG SER A 37 8.914 -0.324 2.585 1.00 0.00 H new ATOM 529 N TYR A 38 8.838 2.178 2.957 1.00 0.00 N ATOM 530 CA TYR A 38 7.862 3.204 3.306 1.00 0.00 C ATOM 531 C TYR A 38 8.554 4.515 3.665 1.00 0.00 C ATOM 532 O TYR A 38 8.141 5.588 3.226 1.00 0.00 O ATOM 533 CB TYR A 38 6.994 2.735 4.475 1.00 0.00 C ATOM 534 CG TYR A 38 6.362 3.867 5.252 1.00 0.00 C ATOM 535 CD1 TYR A 38 5.427 4.707 4.658 1.00 0.00 C ATOM 536 CD2 TYR A 38 6.699 4.099 6.580 1.00 0.00 C ATOM 537 CE1 TYR A 38 4.847 5.743 5.363 1.00 0.00 C ATOM 538 CE2 TYR A 38 6.123 5.132 7.293 1.00 0.00 C ATOM 539 CZ TYR A 38 5.198 5.951 6.681 1.00 0.00 C ATOM 540 OH TYR A 38 4.623 6.982 7.388 1.00 0.00 O ATOM 0 H TYR A 38 8.854 1.378 3.590 1.00 0.00 H new ATOM 0 HA TYR A 38 7.227 3.376 2.437 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.208 2.083 4.094 1.00 0.00 H new ATOM 0 HB3 TYR A 38 7.604 2.137 5.152 1.00 0.00 H new ATOM 0 HD1 TYR A 38 5.149 4.546 3.627 1.00 0.00 H new ATOM 0 HD2 TYR A 38 7.424 3.460 7.063 1.00 0.00 H new ATOM 0 HE1 TYR A 38 4.123 6.387 4.886 1.00 0.00 H new ATOM 0 HE2 TYR A 38 6.396 5.297 8.325 1.00 0.00 H new ATOM 0 HH TYR A 38 4.978 6.990 8.301 1.00 0.00 H new ATOM 550 N ARG A 39 9.609 4.419 4.467 1.00 0.00 N ATOM 551 CA ARG A 39 10.359 5.597 4.886 1.00 0.00 C ATOM 552 C ARG A 39 10.697 6.481 3.690 1.00 0.00 C ATOM 553 O ARG A 39 10.212 7.607 3.579 1.00 0.00 O ATOM 554 CB ARG A 39 11.644 5.180 5.605 1.00 0.00 C ATOM 555 CG ARG A 39 11.408 4.613 6.995 1.00 0.00 C ATOM 556 CD ARG A 39 12.710 4.478 7.770 1.00 0.00 C ATOM 557 NE ARG A 39 13.053 5.706 8.481 1.00 0.00 N ATOM 558 CZ ARG A 39 12.343 6.192 9.494 1.00 0.00 C ATOM 559 NH1 ARG A 39 11.258 5.557 9.912 1.00 0.00 N ATOM 560 NH2 ARG A 39 12.720 7.316 10.090 1.00 0.00 N ATOM 0 H ARG A 39 9.964 3.538 4.840 1.00 0.00 H new ATOM 0 HA ARG A 39 9.735 6.169 5.573 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.163 4.435 5.001 1.00 0.00 H new ATOM 0 HB3 ARG A 39 12.304 6.044 5.682 1.00 0.00 H new ATOM 0 HG2 ARG A 39 10.723 5.261 7.542 1.00 0.00 H new ATOM 0 HG3 ARG A 39 10.928 3.638 6.915 1.00 0.00 H new ATOM 0 HD2 ARG A 39 12.624 3.658 8.483 1.00 0.00 H new ATOM 0 HD3 ARG A 39 13.516 4.220 7.083 1.00 0.00 H new ATOM 0 HE ARG A 39 13.883 6.219 8.184 1.00 0.00 H new ATOM 0 HH11 ARG A 39 10.966 4.693 9.456 1.00 0.00 H new ATOM 0 HH12 ARG A 39 10.715 5.932 10.690 1.00 0.00 H new ATOM 0 HH21 ARG A 39 13.555 7.807 9.771 1.00 0.00 H new ATOM 0 HH22 ARG A 39 12.175 7.689 10.867 1.00 0.00 H new ATOM 574 N LYS A 40 11.533 5.964 2.795 1.00 0.00 N ATOM 575 CA LYS A 40 11.936 6.705 1.606 1.00 0.00 C ATOM 576 C LYS A 40 10.717 7.202 0.836 1.00 0.00 C ATOM 577 O LYS A 40 10.635 8.376 0.473 1.00 0.00 O ATOM 578 CB LYS A 40 12.801 5.825 0.701 1.00 0.00 C ATOM 579 CG LYS A 40 12.051 4.650 0.097 1.00 0.00 C ATOM 580 CD LYS A 40 12.965 3.779 -0.748 1.00 0.00 C ATOM 581 CE LYS A 40 12.175 2.756 -1.550 1.00 0.00 C ATOM 582 NZ LYS A 40 12.949 2.250 -2.717 1.00 0.00 N ATOM 0 H LYS A 40 11.945 5.034 2.871 1.00 0.00 H new ATOM 0 HA LYS A 40 12.518 7.569 1.926 1.00 0.00 H new ATOM 0 HB2 LYS A 40 13.209 6.437 -0.103 1.00 0.00 H new ATOM 0 HB3 LYS A 40 13.647 5.448 1.276 1.00 0.00 H new ATOM 0 HG2 LYS A 40 11.610 4.051 0.894 1.00 0.00 H new ATOM 0 HG3 LYS A 40 11.229 5.019 -0.517 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.543 4.407 -1.426 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.678 3.265 -0.103 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.902 1.921 -0.905 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.246 3.206 -1.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.377 1.555 -3.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.188 3.043 -3.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 13.824 1.797 -2.383 1.00 0.00 H new ATOM 596 N LEU A 41 9.771 6.302 0.590 1.00 0.00 N ATOM 597 CA LEU A 41 8.555 6.649 -0.137 1.00 0.00 C ATOM 598 C LEU A 41 7.699 7.622 0.668 1.00 0.00 C ATOM 599 O LEU A 41 6.727 8.178 0.158 1.00 0.00 O ATOM 600 CB LEU A 41 7.750 5.388 -0.456 1.00 0.00 C ATOM 601 CG LEU A 41 8.467 4.330 -1.295 1.00 0.00 C ATOM 602 CD1 LEU A 41 7.692 3.021 -1.278 1.00 0.00 C ATOM 603 CD2 LEU A 41 8.658 4.820 -2.723 1.00 0.00 C ATOM 0 H LEU A 41 9.823 5.326 0.883 1.00 0.00 H new ATOM 0 HA LEU A 41 8.844 7.133 -1.070 1.00 0.00 H new ATOM 0 HB2 LEU A 41 7.442 4.930 0.484 1.00 0.00 H new ATOM 0 HB3 LEU A 41 6.841 5.684 -0.980 1.00 0.00 H new ATOM 0 HG LEU A 41 9.450 4.153 -0.859 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.217 2.280 -1.880 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.607 2.662 -0.252 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.696 3.183 -1.689 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.170 4.054 -3.305 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.686 5.026 -3.170 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.256 5.732 -2.718 1.00 0.00 H new ATOM 615 N ALA A 42 8.069 7.824 1.929 1.00 0.00 N ATOM 616 CA ALA A 42 7.338 8.733 2.803 1.00 0.00 C ATOM 617 C ALA A 42 7.914 10.143 2.734 1.00 0.00 C ATOM 618 O ALA A 42 7.212 11.125 2.980 1.00 0.00 O ATOM 619 CB ALA A 42 7.361 8.221 4.235 1.00 0.00 C ATOM 0 H ALA A 42 8.870 7.370 2.368 1.00 0.00 H new ATOM 0 HA ALA A 42 6.304 8.774 2.460 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.811 8.910 4.877 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.896 7.236 4.277 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.393 8.150 4.579 1.00 0.00 H new ATOM 625 N LEU A 43 9.197 10.238 2.400 1.00 0.00 N ATOM 626 CA LEU A 43 9.868 11.529 2.300 1.00 0.00 C ATOM 627 C LEU A 43 9.615 12.170 0.939 1.00 0.00 C ATOM 628 O LEU A 43 9.653 13.393 0.800 1.00 0.00 O ATOM 629 CB LEU A 43 11.372 11.362 2.526 1.00 0.00 C ATOM 630 CG LEU A 43 11.827 11.291 3.984 1.00 0.00 C ATOM 631 CD1 LEU A 43 12.085 12.686 4.532 1.00 0.00 C ATOM 632 CD2 LEU A 43 10.791 10.567 4.832 1.00 0.00 C ATOM 0 H LEU A 43 9.793 9.436 2.194 1.00 0.00 H new ATOM 0 HA LEU A 43 9.461 12.184 3.071 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.697 10.453 2.020 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.886 12.195 2.046 1.00 0.00 H new ATOM 0 HG LEU A 43 12.760 10.728 4.026 1.00 0.00 H new ATOM 0 HD11 LEU A 43 12.408 12.615 5.571 1.00 0.00 H new ATOM 0 HD12 LEU A 43 12.863 13.170 3.942 1.00 0.00 H new ATOM 0 HD13 LEU A 43 11.169 13.274 4.476 1.00 0.00 H new ATOM 0 HD21 LEU A 43 11.132 10.526 5.867 1.00 0.00 H new ATOM 0 HD22 LEU A 43 9.843 11.102 4.783 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.656 9.554 4.454 1.00 0.00 H new ATOM 644 N LYS A 44 9.354 11.337 -0.062 1.00 0.00 N ATOM 645 CA LYS A 44 9.091 11.821 -1.412 1.00 0.00 C ATOM 646 C LYS A 44 7.633 12.244 -1.564 1.00 0.00 C ATOM 647 O LYS A 44 7.331 13.240 -2.221 1.00 0.00 O ATOM 648 CB LYS A 44 9.428 10.738 -2.440 1.00 0.00 C ATOM 649 CG LYS A 44 8.957 9.351 -2.038 1.00 0.00 C ATOM 650 CD LYS A 44 8.625 8.502 -3.253 1.00 0.00 C ATOM 651 CE LYS A 44 9.857 8.243 -4.107 1.00 0.00 C ATOM 652 NZ LYS A 44 11.013 7.787 -3.288 1.00 0.00 N ATOM 0 H LYS A 44 9.319 10.322 0.036 1.00 0.00 H new ATOM 0 HA LYS A 44 9.724 12.690 -1.588 1.00 0.00 H new ATOM 0 HB2 LYS A 44 8.977 11.003 -3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.507 10.716 -2.592 1.00 0.00 H new ATOM 0 HG2 LYS A 44 9.731 8.859 -1.450 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.077 9.435 -1.400 1.00 0.00 H new ATOM 0 HD2 LYS A 44 8.200 7.552 -2.929 1.00 0.00 H new ATOM 0 HD3 LYS A 44 7.865 9.004 -3.852 1.00 0.00 H new ATOM 0 HE2 LYS A 44 9.625 7.489 -4.860 1.00 0.00 H new ATOM 0 HE3 LYS A 44 10.127 9.154 -4.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 11.600 7.137 -3.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.582 8.609 -3.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 10.665 7.296 -2.440 1.00 0.00 H new ATOM 666 N TYR A 45 6.734 11.482 -0.951 1.00 0.00 N ATOM 667 CA TYR A 45 5.308 11.778 -1.019 1.00 0.00 C ATOM 668 C TYR A 45 4.854 12.557 0.212 1.00 0.00 C ATOM 669 O TYR A 45 3.710 12.435 0.651 1.00 0.00 O ATOM 670 CB TYR A 45 4.503 10.483 -1.142 1.00 0.00 C ATOM 671 CG TYR A 45 4.613 9.829 -2.501 1.00 0.00 C ATOM 672 CD1 TYR A 45 3.765 10.193 -3.540 1.00 0.00 C ATOM 673 CD2 TYR A 45 5.565 8.848 -2.747 1.00 0.00 C ATOM 674 CE1 TYR A 45 3.861 9.598 -4.783 1.00 0.00 C ATOM 675 CE2 TYR A 45 5.670 8.248 -3.987 1.00 0.00 C ATOM 676 CZ TYR A 45 4.815 8.626 -5.001 1.00 0.00 C ATOM 677 OH TYR A 45 4.915 8.031 -6.238 1.00 0.00 O ATOM 0 H TYR A 45 6.967 10.655 -0.402 1.00 0.00 H new ATOM 0 HA TYR A 45 5.132 12.393 -1.901 1.00 0.00 H new ATOM 0 HB2 TYR A 45 4.843 9.780 -0.381 1.00 0.00 H new ATOM 0 HB3 TYR A 45 3.454 10.696 -0.934 1.00 0.00 H new ATOM 0 HD1 TYR A 45 3.018 10.955 -3.373 1.00 0.00 H new ATOM 0 HD2 TYR A 45 6.235 8.549 -1.955 1.00 0.00 H new ATOM 0 HE1 TYR A 45 3.193 9.892 -5.579 1.00 0.00 H new ATOM 0 HE2 TYR A 45 6.417 7.488 -4.161 1.00 0.00 H new ATOM 0 HH TYR A 45 5.637 7.369 -6.225 1.00 0.00 H new ATOM 687 N HIS A 46 5.759 13.359 0.764 1.00 0.00 N ATOM 688 CA HIS A 46 5.453 14.160 1.944 1.00 0.00 C ATOM 689 C HIS A 46 4.564 15.345 1.580 1.00 0.00 C ATOM 690 O HIS A 46 4.730 15.980 0.538 1.00 0.00 O ATOM 691 CB HIS A 46 6.743 14.657 2.598 1.00 0.00 C ATOM 692 CG HIS A 46 6.633 14.833 4.081 1.00 0.00 C ATOM 693 ND1 HIS A 46 6.528 16.068 4.686 1.00 0.00 N ATOM 694 CD2 HIS A 46 6.609 13.922 5.082 1.00 0.00 C ATOM 695 CE1 HIS A 46 6.447 15.909 5.995 1.00 0.00 C ATOM 696 NE2 HIS A 46 6.494 14.616 6.261 1.00 0.00 N ATOM 0 H HIS A 46 6.710 13.471 0.413 1.00 0.00 H new ATOM 0 HA HIS A 46 4.916 13.529 2.652 1.00 0.00 H new ATOM 0 HB2 HIS A 46 7.545 13.951 2.383 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.026 15.608 2.147 1.00 0.00 H new ATOM 0 HD2 HIS A 46 6.669 12.849 4.973 1.00 0.00 H new ATOM 0 HE1 HIS A 46 6.358 16.701 6.724 1.00 0.00 H new ATOM 0 HE2 HIS A 46 6.452 14.200 7.192 1.00 0.00 H new ATOM 704 N PRO A 47 3.597 15.651 2.457 1.00 0.00 N ATOM 705 CA PRO A 47 2.662 16.761 2.249 1.00 0.00 C ATOM 706 C PRO A 47 3.341 18.121 2.373 1.00 0.00 C ATOM 707 O PRO A 47 2.868 19.115 1.821 1.00 0.00 O ATOM 708 CB PRO A 47 1.633 16.573 3.367 1.00 0.00 C ATOM 709 CG PRO A 47 2.363 15.830 4.432 1.00 0.00 C ATOM 710 CD PRO A 47 3.341 14.938 3.719 1.00 0.00 C ATOM 0 HA PRO A 47 2.231 16.749 1.248 1.00 0.00 H new ATOM 0 HB2 PRO A 47 1.267 17.532 3.733 1.00 0.00 H new ATOM 0 HB3 PRO A 47 0.766 16.013 3.017 1.00 0.00 H new ATOM 0 HG2 PRO A 47 2.879 16.517 5.103 1.00 0.00 H new ATOM 0 HG3 PRO A 47 1.674 15.245 5.042 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.256 14.802 4.296 1.00 0.00 H new ATOM 0 HD3 PRO A 47 2.925 13.946 3.543 1.00 0.00 H new ATOM 718 N ASP A 48 4.451 18.159 3.101 1.00 0.00 N ATOM 719 CA ASP A 48 5.196 19.397 3.297 1.00 0.00 C ATOM 720 C ASP A 48 6.115 19.671 2.111 1.00 0.00 C ATOM 721 O ASP A 48 6.331 20.823 1.731 1.00 0.00 O ATOM 722 CB ASP A 48 6.015 19.327 4.587 1.00 0.00 C ATOM 723 CG ASP A 48 5.157 19.491 5.826 1.00 0.00 C ATOM 724 OD1 ASP A 48 4.242 20.339 5.806 1.00 0.00 O ATOM 725 OD2 ASP A 48 5.402 18.771 6.817 1.00 0.00 O ATOM 0 H ASP A 48 4.855 17.346 3.566 1.00 0.00 H new ATOM 0 HA ASP A 48 4.479 20.214 3.376 1.00 0.00 H new ATOM 0 HB2 ASP A 48 6.535 18.370 4.633 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.779 20.104 4.572 1.00 0.00 H new ATOM 730 N LYS A 49 6.656 18.606 1.529 1.00 0.00 N ATOM 731 CA LYS A 49 7.553 18.730 0.386 1.00 0.00 C ATOM 732 C LYS A 49 6.805 19.250 -0.837 1.00 0.00 C ATOM 733 O LYS A 49 7.296 20.123 -1.552 1.00 0.00 O ATOM 734 CB LYS A 49 8.196 17.379 0.068 1.00 0.00 C ATOM 735 CG LYS A 49 9.005 16.804 1.218 1.00 0.00 C ATOM 736 CD LYS A 49 10.432 17.325 1.211 1.00 0.00 C ATOM 737 CE LYS A 49 11.239 16.725 0.070 1.00 0.00 C ATOM 738 NZ LYS A 49 12.672 17.127 0.133 1.00 0.00 N ATOM 0 H LYS A 49 6.489 17.646 1.831 1.00 0.00 H new ATOM 0 HA LYS A 49 8.334 19.445 0.644 1.00 0.00 H new ATOM 0 HB2 LYS A 49 7.415 16.670 -0.206 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.844 17.490 -0.801 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.528 17.060 2.164 1.00 0.00 H new ATOM 0 HG3 LYS A 49 9.014 15.716 1.150 1.00 0.00 H new ATOM 0 HD2 LYS A 49 10.423 18.411 1.120 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.911 17.088 2.161 1.00 0.00 H new ATOM 0 HE2 LYS A 49 11.165 15.638 0.105 1.00 0.00 H new ATOM 0 HE3 LYS A 49 10.814 17.043 -0.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 13.188 16.698 -0.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 12.745 18.163 0.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.085 16.801 1.030 1.00 0.00 H new ATOM 752 N ASN A 50 5.614 18.709 -1.072 1.00 0.00 N ATOM 753 CA ASN A 50 4.798 19.119 -2.209 1.00 0.00 C ATOM 754 C ASN A 50 3.864 20.262 -1.824 1.00 0.00 C ATOM 755 O ASN A 50 3.048 20.149 -0.908 1.00 0.00 O ATOM 756 CB ASN A 50 3.984 17.935 -2.733 1.00 0.00 C ATOM 757 CG ASN A 50 4.861 16.777 -3.167 1.00 0.00 C ATOM 758 OD1 ASN A 50 5.177 16.631 -4.348 1.00 0.00 O ATOM 759 ND2 ASN A 50 5.260 15.946 -2.211 1.00 0.00 N ATOM 0 H ASN A 50 5.192 17.985 -0.490 1.00 0.00 H new ATOM 0 HA ASN A 50 5.466 19.468 -2.996 1.00 0.00 H new ATOM 0 HB2 ASN A 50 3.299 17.597 -1.956 1.00 0.00 H new ATOM 0 HB3 ASN A 50 3.375 18.261 -3.576 1.00 0.00 H new ATOM 0 HD21 ASN A 50 5.852 15.149 -2.443 1.00 0.00 H new ATOM 0 HD22 ASN A 50 4.974 16.105 -1.245 1.00 0.00 H new ATOM 766 N PRO A 51 3.984 21.391 -2.538 1.00 0.00 N ATOM 767 CA PRO A 51 3.158 22.576 -2.291 1.00 0.00 C ATOM 768 C PRO A 51 1.702 22.362 -2.690 1.00 0.00 C ATOM 769 O PRO A 51 1.369 22.353 -3.875 1.00 0.00 O ATOM 770 CB PRO A 51 3.802 23.648 -3.173 1.00 0.00 C ATOM 771 CG PRO A 51 4.476 22.888 -4.263 1.00 0.00 C ATOM 772 CD PRO A 51 4.935 21.596 -3.644 1.00 0.00 C ATOM 0 HA PRO A 51 3.127 22.837 -1.233 1.00 0.00 H new ATOM 0 HB2 PRO A 51 3.055 24.334 -3.572 1.00 0.00 H new ATOM 0 HB3 PRO A 51 4.516 24.248 -2.609 1.00 0.00 H new ATOM 0 HG2 PRO A 51 3.791 22.703 -5.091 1.00 0.00 H new ATOM 0 HG3 PRO A 51 5.319 23.449 -4.666 1.00 0.00 H new ATOM 0 HD2 PRO A 51 4.903 20.774 -4.359 1.00 0.00 H new ATOM 0 HD3 PRO A 51 5.961 21.665 -3.284 1.00 0.00 H new ATOM 780 N ASP A 52 0.839 22.191 -1.695 1.00 0.00 N ATOM 781 CA ASP A 52 -0.582 21.978 -1.943 1.00 0.00 C ATOM 782 C ASP A 52 -0.796 21.156 -3.210 1.00 0.00 C ATOM 783 O ASP A 52 -1.527 21.565 -4.111 1.00 0.00 O ATOM 784 CB ASP A 52 -1.307 23.320 -2.062 1.00 0.00 C ATOM 785 CG ASP A 52 -1.067 24.216 -0.863 1.00 0.00 C ATOM 786 OD1 ASP A 52 -1.734 24.011 0.173 1.00 0.00 O ATOM 787 OD2 ASP A 52 -0.214 25.123 -0.961 1.00 0.00 O ATOM 0 H ASP A 52 1.099 22.196 -0.709 1.00 0.00 H new ATOM 0 HA ASP A 52 -0.994 21.424 -1.099 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -0.974 23.830 -2.966 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -2.377 23.143 -2.171 1.00 0.00 H new ATOM 792 N ASN A 53 -0.151 19.996 -3.272 1.00 0.00 N ATOM 793 CA ASN A 53 -0.269 19.116 -4.429 1.00 0.00 C ATOM 794 C ASN A 53 -1.156 17.916 -4.113 1.00 0.00 C ATOM 795 O ASN A 53 -0.878 17.129 -3.207 1.00 0.00 O ATOM 796 CB ASN A 53 1.114 18.639 -4.876 1.00 0.00 C ATOM 797 CG ASN A 53 1.174 18.353 -6.364 1.00 0.00 C ATOM 798 OD1 ASN A 53 0.329 18.815 -7.131 1.00 0.00 O ATOM 799 ND2 ASN A 53 2.177 17.588 -6.780 1.00 0.00 N ATOM 0 H ASN A 53 0.459 19.643 -2.535 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.730 19.682 -5.238 1.00 0.00 H new ATOM 0 HB2 ASN A 53 1.856 19.397 -4.624 1.00 0.00 H new ATOM 0 HB3 ASN A 53 1.380 17.737 -4.324 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.269 17.362 -7.770 1.00 0.00 H new ATOM 0 HD22 ASN A 53 2.855 17.226 -6.109 1.00 0.00 H new ATOM 806 N PRO A 54 -2.249 17.771 -4.876 1.00 0.00 N ATOM 807 CA PRO A 54 -3.199 16.668 -4.697 1.00 0.00 C ATOM 808 C PRO A 54 -2.611 15.324 -5.111 1.00 0.00 C ATOM 809 O PRO A 54 -2.774 14.324 -4.412 1.00 0.00 O ATOM 810 CB PRO A 54 -4.362 17.049 -5.616 1.00 0.00 C ATOM 811 CG PRO A 54 -3.751 17.921 -6.658 1.00 0.00 C ATOM 812 CD PRO A 54 -2.642 18.671 -5.973 1.00 0.00 C ATOM 0 HA PRO A 54 -3.486 16.543 -3.653 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.822 16.166 -6.059 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -5.144 17.575 -5.068 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -3.366 17.327 -7.487 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.488 18.608 -7.073 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -1.811 18.866 -6.650 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -2.981 19.637 -5.599 1.00 0.00 H new ATOM 820 N GLU A 55 -1.927 15.308 -6.250 1.00 0.00 N ATOM 821 CA GLU A 55 -1.315 14.085 -6.756 1.00 0.00 C ATOM 822 C GLU A 55 -0.424 13.443 -5.697 1.00 0.00 C ATOM 823 O GLU A 55 -0.411 12.223 -5.537 1.00 0.00 O ATOM 824 CB GLU A 55 -0.497 14.380 -8.015 1.00 0.00 C ATOM 825 CG GLU A 55 0.672 15.320 -7.775 1.00 0.00 C ATOM 826 CD GLU A 55 1.562 15.468 -8.994 1.00 0.00 C ATOM 827 OE1 GLU A 55 1.914 14.435 -9.601 1.00 0.00 O ATOM 828 OE2 GLU A 55 1.907 16.617 -9.341 1.00 0.00 O ATOM 0 H GLU A 55 -1.783 16.128 -6.840 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.114 13.387 -7.006 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -0.120 13.441 -8.421 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.152 14.814 -8.770 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.292 16.300 -7.486 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.266 14.949 -6.939 1.00 0.00 H new ATOM 835 N ALA A 56 0.320 14.275 -4.975 1.00 0.00 N ATOM 836 CA ALA A 56 1.213 13.790 -3.930 1.00 0.00 C ATOM 837 C ALA A 56 0.434 13.081 -2.828 1.00 0.00 C ATOM 838 O ALA A 56 0.669 11.907 -2.545 1.00 0.00 O ATOM 839 CB ALA A 56 2.021 14.942 -3.350 1.00 0.00 C ATOM 0 H ALA A 56 0.322 15.288 -5.095 1.00 0.00 H new ATOM 0 HA ALA A 56 1.897 13.069 -4.377 1.00 0.00 H new ATOM 0 HB1 ALA A 56 2.684 14.566 -2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 56 2.614 15.404 -4.139 1.00 0.00 H new ATOM 0 HB3 ALA A 56 1.344 15.683 -2.924 1.00 0.00 H new ATOM 845 N ALA A 57 -0.494 13.803 -2.207 1.00 0.00 N ATOM 846 CA ALA A 57 -1.309 13.241 -1.136 1.00 0.00 C ATOM 847 C ALA A 57 -2.055 11.998 -1.608 1.00 0.00 C ATOM 848 O ALA A 57 -2.068 10.974 -0.926 1.00 0.00 O ATOM 849 CB ALA A 57 -2.289 14.283 -0.618 1.00 0.00 C ATOM 0 H ALA A 57 -0.700 14.777 -2.427 1.00 0.00 H new ATOM 0 HA ALA A 57 -0.645 12.946 -0.323 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.891 13.851 0.181 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -1.738 15.141 -0.233 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.941 14.605 -1.430 1.00 0.00 H new ATOM 855 N ASP A 58 -2.676 12.096 -2.779 1.00 0.00 N ATOM 856 CA ASP A 58 -3.425 10.979 -3.342 1.00 0.00 C ATOM 857 C ASP A 58 -2.594 9.700 -3.318 1.00 0.00 C ATOM 858 O ASP A 58 -3.122 8.607 -3.111 1.00 0.00 O ATOM 859 CB ASP A 58 -3.854 11.296 -4.775 1.00 0.00 C ATOM 860 CG ASP A 58 -5.026 10.448 -5.230 1.00 0.00 C ATOM 861 OD1 ASP A 58 -4.847 9.222 -5.383 1.00 0.00 O ATOM 862 OD2 ASP A 58 -6.122 11.011 -5.434 1.00 0.00 O ATOM 0 H ASP A 58 -2.675 12.937 -3.356 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.314 10.825 -2.730 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.123 12.350 -4.846 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -3.011 11.136 -5.447 1.00 0.00 H new ATOM 867 N LYS A 59 -1.291 9.843 -3.531 1.00 0.00 N ATOM 868 CA LYS A 59 -0.385 8.701 -3.534 1.00 0.00 C ATOM 869 C LYS A 59 0.080 8.371 -2.119 1.00 0.00 C ATOM 870 O LYS A 59 0.179 7.203 -1.744 1.00 0.00 O ATOM 871 CB LYS A 59 0.826 8.986 -4.426 1.00 0.00 C ATOM 872 CG LYS A 59 0.628 8.564 -5.872 1.00 0.00 C ATOM 873 CD LYS A 59 0.934 7.088 -6.069 1.00 0.00 C ATOM 874 CE LYS A 59 0.880 6.699 -7.538 1.00 0.00 C ATOM 875 NZ LYS A 59 2.128 7.074 -8.258 1.00 0.00 N ATOM 0 H LYS A 59 -0.838 10.740 -3.704 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.926 7.842 -3.930 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.047 10.053 -4.394 1.00 0.00 H new ATOM 0 HB3 LYS A 59 1.695 8.468 -4.021 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -0.400 8.767 -6.174 1.00 0.00 H new ATOM 0 HG3 LYS A 59 1.273 9.160 -6.518 1.00 0.00 H new ATOM 0 HD2 LYS A 59 1.922 6.864 -5.668 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.218 6.489 -5.506 1.00 0.00 H new ATOM 0 HE2 LYS A 59 0.721 5.624 -7.623 1.00 0.00 H new ATOM 0 HE3 LYS A 59 0.027 7.186 -8.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.051 6.792 -9.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 2.267 8.103 -8.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 2.939 6.589 -7.823 1.00 0.00 H new ATOM 889 N PHE A 60 0.361 9.408 -1.337 1.00 0.00 N ATOM 890 CA PHE A 60 0.815 9.229 0.038 1.00 0.00 C ATOM 891 C PHE A 60 -0.153 8.344 0.818 1.00 0.00 C ATOM 892 O PHE A 60 0.262 7.440 1.545 1.00 0.00 O ATOM 893 CB PHE A 60 0.956 10.585 0.732 1.00 0.00 C ATOM 894 CG PHE A 60 1.642 10.507 2.066 1.00 0.00 C ATOM 895 CD1 PHE A 60 2.826 9.802 2.210 1.00 0.00 C ATOM 896 CD2 PHE A 60 1.103 11.139 3.175 1.00 0.00 C ATOM 897 CE1 PHE A 60 3.459 9.728 3.437 1.00 0.00 C ATOM 898 CE2 PHE A 60 1.732 11.069 4.404 1.00 0.00 C ATOM 899 CZ PHE A 60 2.912 10.363 4.534 1.00 0.00 C ATOM 0 H PHE A 60 0.282 10.381 -1.632 1.00 0.00 H new ATOM 0 HA PHE A 60 1.789 8.739 0.012 1.00 0.00 H new ATOM 0 HB2 PHE A 60 1.515 11.260 0.084 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -0.034 11.020 0.866 1.00 0.00 H new ATOM 0 HD1 PHE A 60 3.259 9.305 1.355 1.00 0.00 H new ATOM 0 HD2 PHE A 60 0.181 11.693 3.078 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.381 9.174 3.537 1.00 0.00 H new ATOM 0 HE2 PHE A 60 1.301 11.566 5.261 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.406 10.308 5.493 1.00 0.00 H new ATOM 909 N LYS A 61 -1.445 8.610 0.663 1.00 0.00 N ATOM 910 CA LYS A 61 -2.474 7.839 1.351 1.00 0.00 C ATOM 911 C LYS A 61 -2.377 6.360 0.992 1.00 0.00 C ATOM 912 O LYS A 61 -2.754 5.494 1.781 1.00 0.00 O ATOM 913 CB LYS A 61 -3.863 8.371 0.995 1.00 0.00 C ATOM 914 CG LYS A 61 -4.489 7.683 -0.206 1.00 0.00 C ATOM 915 CD LYS A 61 -5.925 8.131 -0.420 1.00 0.00 C ATOM 916 CE LYS A 61 -6.385 7.865 -1.845 1.00 0.00 C ATOM 917 NZ LYS A 61 -6.099 9.017 -2.744 1.00 0.00 N ATOM 0 H LYS A 61 -1.805 9.355 0.066 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.315 7.945 2.424 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -4.521 8.250 1.856 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -3.793 9.440 0.795 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.902 7.901 -1.098 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.461 6.603 -0.063 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -6.578 7.608 0.278 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -6.012 9.195 -0.201 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -5.887 6.974 -2.227 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -7.455 7.658 -1.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -6.772 9.014 -3.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -6.195 9.905 -2.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -5.130 8.938 -3.112 1.00 0.00 H new ATOM 931 N GLU A 62 -1.867 6.078 -0.203 1.00 0.00 N ATOM 932 CA GLU A 62 -1.720 4.703 -0.666 1.00 0.00 C ATOM 933 C GLU A 62 -0.487 4.049 -0.048 1.00 0.00 C ATOM 934 O GLU A 62 -0.500 2.863 0.282 1.00 0.00 O ATOM 935 CB GLU A 62 -1.622 4.662 -2.192 1.00 0.00 C ATOM 936 CG GLU A 62 -2.941 4.350 -2.879 1.00 0.00 C ATOM 937 CD GLU A 62 -4.011 5.383 -2.583 1.00 0.00 C ATOM 938 OE1 GLU A 62 -4.052 6.412 -3.290 1.00 0.00 O ATOM 939 OE2 GLU A 62 -4.806 5.163 -1.646 1.00 0.00 O ATOM 0 H GLU A 62 -1.549 6.783 -0.868 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.602 4.145 -0.351 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.254 5.624 -2.550 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -0.886 3.912 -2.480 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.782 4.296 -3.956 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.290 3.368 -2.559 1.00 0.00 H new ATOM 946 N ILE A 63 0.575 4.832 0.105 1.00 0.00 N ATOM 947 CA ILE A 63 1.816 4.331 0.684 1.00 0.00 C ATOM 948 C ILE A 63 1.619 3.927 2.141 1.00 0.00 C ATOM 949 O ILE A 63 1.905 2.794 2.526 1.00 0.00 O ATOM 950 CB ILE A 63 2.940 5.380 0.601 1.00 0.00 C ATOM 951 CG1 ILE A 63 3.051 5.929 -0.823 1.00 0.00 C ATOM 952 CG2 ILE A 63 4.263 4.775 1.045 1.00 0.00 C ATOM 953 CD1 ILE A 63 4.234 6.849 -1.026 1.00 0.00 C ATOM 0 H ILE A 63 0.602 5.816 -0.164 1.00 0.00 H new ATOM 0 HA ILE A 63 2.104 3.455 0.103 1.00 0.00 H new ATOM 0 HB ILE A 63 2.697 6.205 1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 63 3.126 5.095 -1.520 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.136 6.468 -1.068 1.00 0.00 H new ATOM 0 HG21 ILE A 63 5.048 5.529 0.981 1.00 0.00 H new ATOM 0 HG22 ILE A 63 4.177 4.428 2.075 1.00 0.00 H new ATOM 0 HG23 ILE A 63 4.514 3.934 0.398 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.249 7.200 -2.058 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.150 7.703 -0.354 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.156 6.308 -0.813 1.00 0.00 H new ATOM 965 N ASN A 64 1.127 4.862 2.947 1.00 0.00 N ATOM 966 CA ASN A 64 0.890 4.604 4.363 1.00 0.00 C ATOM 967 C ASN A 64 -0.060 3.424 4.549 1.00 0.00 C ATOM 968 O ASN A 64 0.223 2.501 5.311 1.00 0.00 O ATOM 969 CB ASN A 64 0.315 5.848 5.041 1.00 0.00 C ATOM 970 CG ASN A 64 -1.201 5.875 5.010 1.00 0.00 C ATOM 971 OD1 ASN A 64 -1.860 5.023 5.608 1.00 0.00 O ATOM 972 ND2 ASN A 64 -1.762 6.855 4.312 1.00 0.00 N ATOM 0 H ASN A 64 0.885 5.805 2.644 1.00 0.00 H new ATOM 0 HA ASN A 64 1.845 4.356 4.826 1.00 0.00 H new ATOM 0 HB2 ASN A 64 0.655 5.884 6.076 1.00 0.00 H new ATOM 0 HB3 ASN A 64 0.702 6.739 4.547 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.778 6.924 4.255 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.177 7.539 3.832 1.00 0.00 H new ATOM 979 N ASN A 65 -1.187 3.463 3.846 1.00 0.00 N ATOM 980 CA ASN A 65 -2.179 2.398 3.933 1.00 0.00 C ATOM 981 C ASN A 65 -1.526 1.030 3.759 1.00 0.00 C ATOM 982 O ASN A 65 -1.598 0.179 4.645 1.00 0.00 O ATOM 983 CB ASN A 65 -3.265 2.595 2.874 1.00 0.00 C ATOM 984 CG ASN A 65 -4.403 1.603 3.020 1.00 0.00 C ATOM 985 OD1 ASN A 65 -5.194 1.683 3.960 1.00 0.00 O ATOM 986 ND2 ASN A 65 -4.490 0.662 2.087 1.00 0.00 N ATOM 0 H ASN A 65 -1.436 4.220 3.210 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.634 2.441 4.923 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.659 3.609 2.946 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.824 2.494 1.882 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.235 -0.033 2.132 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -3.812 0.634 1.326 1.00 0.00 H new ATOM 993 N ALA A 66 -0.888 0.827 2.611 1.00 0.00 N ATOM 994 CA ALA A 66 -0.220 -0.435 2.321 1.00 0.00 C ATOM 995 C ALA A 66 0.801 -0.776 3.401 1.00 0.00 C ATOM 996 O ALA A 66 0.626 -1.734 4.155 1.00 0.00 O ATOM 997 CB ALA A 66 0.452 -0.376 0.957 1.00 0.00 C ATOM 0 H ALA A 66 -0.820 1.521 1.867 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.974 -1.222 2.308 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.947 -1.326 0.754 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.298 -0.187 0.190 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.190 0.427 0.949 1.00 0.00 H new ATOM 1003 N HIS A 67 1.869 0.013 3.471 1.00 0.00 N ATOM 1004 CA HIS A 67 2.919 -0.206 4.460 1.00 0.00 C ATOM 1005 C HIS A 67 2.322 -0.603 5.807 1.00 0.00 C ATOM 1006 O HIS A 67 2.905 -1.396 6.545 1.00 0.00 O ATOM 1007 CB HIS A 67 3.771 1.054 4.617 1.00 0.00 C ATOM 1008 CG HIS A 67 4.493 1.129 5.927 1.00 0.00 C ATOM 1009 ND1 HIS A 67 4.183 2.050 6.905 1.00 0.00 N ATOM 1010 CD2 HIS A 67 5.514 0.389 6.419 1.00 0.00 C ATOM 1011 CE1 HIS A 67 4.984 1.874 7.941 1.00 0.00 C ATOM 1012 NE2 HIS A 67 5.801 0.872 7.672 1.00 0.00 N ATOM 0 H HIS A 67 2.030 0.810 2.855 1.00 0.00 H new ATOM 0 HA HIS A 67 3.551 -1.021 4.109 1.00 0.00 H new ATOM 0 HB2 HIS A 67 4.500 1.093 3.807 1.00 0.00 H new ATOM 0 HB3 HIS A 67 3.131 1.930 4.513 1.00 0.00 H new ATOM 0 HD1 HIS A 67 3.450 2.756 6.839 1.00 0.00 H new ATOM 0 HD2 HIS A 67 6.011 -0.429 5.919 1.00 0.00 H new ATOM 0 HE1 HIS A 67 4.972 2.452 8.853 1.00 0.00 H new ATOM 1020 N ALA A 68 1.157 -0.045 6.120 1.00 0.00 N ATOM 1021 CA ALA A 68 0.482 -0.341 7.377 1.00 0.00 C ATOM 1022 C ALA A 68 -0.046 -1.772 7.393 1.00 0.00 C ATOM 1023 O ALA A 68 0.307 -2.564 8.267 1.00 0.00 O ATOM 1024 CB ALA A 68 -0.653 0.645 7.612 1.00 0.00 C ATOM 0 H ALA A 68 0.661 0.614 5.520 1.00 0.00 H new ATOM 0 HA ALA A 68 1.209 -0.240 8.183 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.148 0.412 8.555 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -0.252 1.658 7.653 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.373 0.573 6.796 1.00 0.00 H new ATOM 1030 N ILE A 69 -0.893 -2.095 6.421 1.00 0.00 N ATOM 1031 CA ILE A 69 -1.468 -3.431 6.324 1.00 0.00 C ATOM 1032 C ILE A 69 -0.379 -4.495 6.249 1.00 0.00 C ATOM 1033 O ILE A 69 -0.520 -5.585 6.807 1.00 0.00 O ATOM 1034 CB ILE A 69 -2.383 -3.562 5.092 1.00 0.00 C ATOM 1035 CG1 ILE A 69 -3.512 -2.531 5.156 1.00 0.00 C ATOM 1036 CG2 ILE A 69 -2.950 -4.971 5.000 1.00 0.00 C ATOM 1037 CD1 ILE A 69 -4.325 -2.446 3.883 1.00 0.00 C ATOM 0 H ILE A 69 -1.196 -1.451 5.691 1.00 0.00 H new ATOM 0 HA ILE A 69 -2.061 -3.585 7.226 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.791 -3.370 4.197 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -4.175 -2.781 5.985 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -3.086 -1.551 5.372 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -3.594 -5.047 4.124 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.133 -5.687 4.913 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.529 -5.189 5.897 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.107 -1.696 4.000 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -3.675 -2.166 3.054 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -4.780 -3.415 3.676 1.00 0.00 H new ATOM 1049 N LEU A 70 0.709 -4.172 5.559 1.00 0.00 N ATOM 1050 CA LEU A 70 1.826 -5.100 5.413 1.00 0.00 C ATOM 1051 C LEU A 70 2.670 -5.141 6.683 1.00 0.00 C ATOM 1052 O LEU A 70 2.724 -6.159 7.373 1.00 0.00 O ATOM 1053 CB LEU A 70 2.696 -4.697 4.221 1.00 0.00 C ATOM 1054 CG LEU A 70 2.053 -4.839 2.841 1.00 0.00 C ATOM 1055 CD1 LEU A 70 2.893 -4.138 1.785 1.00 0.00 C ATOM 1056 CD2 LEU A 70 1.867 -6.308 2.488 1.00 0.00 C ATOM 0 H LEU A 70 0.842 -3.275 5.092 1.00 0.00 H new ATOM 0 HA LEU A 70 1.419 -6.096 5.238 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.999 -3.658 4.353 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.604 -5.299 4.240 1.00 0.00 H new ATOM 0 HG LEU A 70 1.072 -4.365 2.869 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.419 -4.250 0.810 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.975 -3.079 2.029 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.888 -4.582 1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.408 -6.390 1.503 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.837 -6.806 2.479 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.223 -6.781 3.229 1.00 0.00 H new ATOM 1068 N THR A 71 3.327 -4.026 6.987 1.00 0.00 N ATOM 1069 CA THR A 71 4.167 -3.933 8.174 1.00 0.00 C ATOM 1070 C THR A 71 3.440 -4.463 9.405 1.00 0.00 C ATOM 1071 O THR A 71 4.068 -4.867 10.383 1.00 0.00 O ATOM 1072 CB THR A 71 4.609 -2.482 8.438 1.00 0.00 C ATOM 1073 OG1 THR A 71 5.813 -2.470 9.213 1.00 0.00 O ATOM 1074 CG2 THR A 71 3.522 -1.709 9.169 1.00 0.00 C ATOM 0 H THR A 71 3.293 -3.174 6.427 1.00 0.00 H new ATOM 0 HA THR A 71 5.049 -4.544 7.985 1.00 0.00 H new ATOM 0 HB THR A 71 4.791 -2.001 7.477 1.00 0.00 H new ATOM 0 HG1 THR A 71 5.778 -3.185 9.882 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.858 -0.687 9.344 1.00 0.00 H new ATOM 0 HG22 THR A 71 2.616 -1.695 8.563 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.313 -2.191 10.124 1.00 0.00 H new ATOM 1082 N ASP A 72 2.112 -4.458 9.350 1.00 0.00 N ATOM 1083 CA ASP A 72 1.299 -4.940 10.460 1.00 0.00 C ATOM 1084 C ASP A 72 1.197 -6.462 10.438 1.00 0.00 C ATOM 1085 O ASP A 72 1.641 -7.110 9.492 1.00 0.00 O ATOM 1086 CB ASP A 72 -0.099 -4.321 10.403 1.00 0.00 C ATOM 1087 CG ASP A 72 -0.927 -4.648 11.630 1.00 0.00 C ATOM 1088 OD1 ASP A 72 -0.461 -4.363 12.752 1.00 0.00 O ATOM 1089 OD2 ASP A 72 -2.041 -5.189 11.467 1.00 0.00 O ATOM 0 H ASP A 72 1.576 -4.125 8.548 1.00 0.00 H new ATOM 0 HA ASP A 72 1.783 -4.640 11.390 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.010 -3.239 10.306 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.616 -4.680 9.513 1.00 0.00 H new ATOM 1094 N ALA A 73 0.609 -7.025 11.489 1.00 0.00 N ATOM 1095 CA ALA A 73 0.448 -8.470 11.590 1.00 0.00 C ATOM 1096 C ALA A 73 -1.022 -8.866 11.500 1.00 0.00 C ATOM 1097 O ALA A 73 -1.406 -9.685 10.664 1.00 0.00 O ATOM 1098 CB ALA A 73 1.055 -8.980 12.889 1.00 0.00 C ATOM 0 H ALA A 73 0.237 -6.502 12.282 1.00 0.00 H new ATOM 0 HA ALA A 73 0.973 -8.928 10.752 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.927 -10.061 12.951 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.118 -8.738 12.914 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.556 -8.507 13.734 1.00 0.00 H new ATOM 1104 N THR A 74 -1.842 -8.280 12.367 1.00 0.00 N ATOM 1105 CA THR A 74 -3.270 -8.573 12.386 1.00 0.00 C ATOM 1106 C THR A 74 -3.886 -8.398 11.003 1.00 0.00 C ATOM 1107 O THR A 74 -4.703 -9.210 10.568 1.00 0.00 O ATOM 1108 CB THR A 74 -4.015 -7.669 13.387 1.00 0.00 C ATOM 1109 OG1 THR A 74 -3.388 -7.739 14.672 1.00 0.00 O ATOM 1110 CG2 THR A 74 -5.474 -8.082 13.506 1.00 0.00 C ATOM 0 H THR A 74 -1.542 -7.600 13.065 1.00 0.00 H new ATOM 0 HA THR A 74 -3.376 -9.612 12.698 1.00 0.00 H new ATOM 0 HB THR A 74 -3.972 -6.644 13.018 1.00 0.00 H new ATOM 0 HG1 THR A 74 -3.867 -7.160 15.302 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.980 -7.430 14.218 1.00 0.00 H new ATOM 0 HG22 THR A 74 -5.956 -7.999 12.532 1.00 0.00 H new ATOM 0 HG23 THR A 74 -5.533 -9.113 13.853 1.00 0.00 H new ATOM 1118 N LYS A 75 -3.489 -7.333 10.315 1.00 0.00 N ATOM 1119 CA LYS A 75 -4.001 -7.051 8.979 1.00 0.00 C ATOM 1120 C LYS A 75 -3.235 -7.844 7.924 1.00 0.00 C ATOM 1121 O LYS A 75 -3.831 -8.554 7.115 1.00 0.00 O ATOM 1122 CB LYS A 75 -3.902 -5.554 8.678 1.00 0.00 C ATOM 1123 CG LYS A 75 -4.826 -4.700 9.529 1.00 0.00 C ATOM 1124 CD LYS A 75 -4.996 -3.308 8.943 1.00 0.00 C ATOM 1125 CE LYS A 75 -6.156 -3.255 7.960 1.00 0.00 C ATOM 1126 NZ LYS A 75 -6.402 -1.872 7.467 1.00 0.00 N ATOM 0 H LYS A 75 -2.814 -6.651 10.661 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.048 -7.354 8.947 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.874 -5.228 8.834 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.133 -5.387 7.626 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -5.800 -5.184 9.608 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.425 -4.624 10.540 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.166 -2.592 9.747 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.077 -3.009 8.439 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.946 -3.910 7.114 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -7.057 -3.635 8.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -7.131 -1.892 6.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.726 -1.275 8.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -5.521 -1.481 7.076 1.00 0.00 H new ATOM 1140 N ARG A 76 -1.912 -7.718 7.941 1.00 0.00 N ATOM 1141 CA ARG A 76 -1.066 -8.423 6.987 1.00 0.00 C ATOM 1142 C ARG A 76 -1.487 -9.884 6.862 1.00 0.00 C ATOM 1143 O ARG A 76 -1.621 -10.410 5.758 1.00 0.00 O ATOM 1144 CB ARG A 76 0.401 -8.339 7.414 1.00 0.00 C ATOM 1145 CG ARG A 76 1.360 -8.993 6.432 1.00 0.00 C ATOM 1146 CD ARG A 76 2.709 -9.273 7.074 1.00 0.00 C ATOM 1147 NE ARG A 76 3.506 -10.210 6.287 1.00 0.00 N ATOM 1148 CZ ARG A 76 4.627 -10.771 6.726 1.00 0.00 C ATOM 1149 NH1 ARG A 76 5.081 -10.492 7.940 1.00 0.00 N ATOM 1150 NH2 ARG A 76 5.296 -11.614 5.950 1.00 0.00 N ATOM 0 H ARG A 76 -1.403 -7.134 8.605 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.183 -7.945 6.014 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.676 -7.291 7.534 1.00 0.00 H new ATOM 0 HB3 ARG A 76 0.514 -8.812 8.389 1.00 0.00 H new ATOM 0 HG2 ARG A 76 0.929 -9.925 6.067 1.00 0.00 H new ATOM 0 HG3 ARG A 76 1.495 -8.344 5.567 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.257 -8.338 7.188 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.557 -9.678 8.075 1.00 0.00 H new ATOM 0 HE ARG A 76 3.184 -10.447 5.349 1.00 0.00 H new ATOM 0 HH11 ARG A 76 4.569 -9.845 8.540 1.00 0.00 H new ATOM 0 HH12 ARG A 76 5.942 -10.924 8.274 1.00 0.00 H new ATOM 0 HH21 ARG A 76 4.949 -11.832 5.016 1.00 0.00 H new ATOM 0 HH22 ARG A 76 6.157 -12.044 6.288 1.00 0.00 H new ATOM 1164 N ASN A 77 -1.695 -10.534 8.002 1.00 0.00 N ATOM 1165 CA ASN A 77 -2.100 -11.935 8.021 1.00 0.00 C ATOM 1166 C ASN A 77 -3.384 -12.141 7.222 1.00 0.00 C ATOM 1167 O ASN A 77 -3.492 -13.081 6.434 1.00 0.00 O ATOM 1168 CB ASN A 77 -2.301 -12.411 9.461 1.00 0.00 C ATOM 1169 CG ASN A 77 -2.433 -13.918 9.559 1.00 0.00 C ATOM 1170 OD1 ASN A 77 -1.769 -14.659 8.834 1.00 0.00 O ATOM 1171 ND2 ASN A 77 -3.293 -14.379 10.460 1.00 0.00 N ATOM 0 H ASN A 77 -1.590 -10.113 8.925 1.00 0.00 H new ATOM 0 HA ASN A 77 -1.307 -12.522 7.559 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -1.459 -12.083 10.070 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -3.195 -11.943 9.874 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -3.424 -15.384 10.572 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -3.822 -13.728 11.040 1.00 0.00 H new ATOM 1178 N ILE A 78 -4.352 -11.255 7.431 1.00 0.00 N ATOM 1179 CA ILE A 78 -5.627 -11.339 6.730 1.00 0.00 C ATOM 1180 C ILE A 78 -5.436 -11.198 5.223 1.00 0.00 C ATOM 1181 O ILE A 78 -5.764 -12.105 4.458 1.00 0.00 O ATOM 1182 CB ILE A 78 -6.608 -10.255 7.214 1.00 0.00 C ATOM 1183 CG1 ILE A 78 -7.145 -10.607 8.603 1.00 0.00 C ATOM 1184 CG2 ILE A 78 -7.752 -10.095 6.224 1.00 0.00 C ATOM 1185 CD1 ILE A 78 -7.734 -9.425 9.341 1.00 0.00 C ATOM 0 H ILE A 78 -4.278 -10.471 8.080 1.00 0.00 H new ATOM 0 HA ILE A 78 -6.045 -12.321 6.951 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.075 -9.307 7.280 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -7.907 -11.380 8.504 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.337 -11.031 9.199 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -8.437 -9.325 6.580 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -7.354 -9.805 5.252 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -8.286 -11.040 6.130 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -8.095 -9.749 10.317 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -6.969 -8.660 9.472 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -8.564 -9.014 8.766 1.00 0.00 H new ATOM 1197 N TYR A 79 -4.901 -10.057 4.804 1.00 0.00 N ATOM 1198 CA TYR A 79 -4.666 -9.797 3.389 1.00 0.00 C ATOM 1199 C TYR A 79 -3.893 -10.945 2.745 1.00 0.00 C ATOM 1200 O TYR A 79 -4.044 -11.218 1.554 1.00 0.00 O ATOM 1201 CB TYR A 79 -3.897 -8.487 3.210 1.00 0.00 C ATOM 1202 CG TYR A 79 -3.735 -8.072 1.765 1.00 0.00 C ATOM 1203 CD1 TYR A 79 -4.837 -7.719 0.996 1.00 0.00 C ATOM 1204 CD2 TYR A 79 -2.480 -8.034 1.169 1.00 0.00 C ATOM 1205 CE1 TYR A 79 -4.693 -7.340 -0.325 1.00 0.00 C ATOM 1206 CE2 TYR A 79 -2.328 -7.655 -0.150 1.00 0.00 C ATOM 1207 CZ TYR A 79 -3.437 -7.309 -0.893 1.00 0.00 C ATOM 1208 OH TYR A 79 -3.289 -6.933 -2.208 1.00 0.00 O ATOM 0 H TYR A 79 -4.622 -9.297 5.424 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.634 -9.713 2.896 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.415 -7.695 3.751 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -2.911 -8.590 3.662 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.822 -7.741 1.438 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.609 -8.305 1.747 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -5.560 -7.069 -0.910 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -1.345 -7.630 -0.598 1.00 0.00 H new ATOM 0 HH TYR A 79 -2.598 -7.485 -2.630 1.00 0.00 H new ATOM 1218 N ASP A 80 -3.067 -11.613 3.542 1.00 0.00 N ATOM 1219 CA ASP A 80 -2.271 -12.733 3.052 1.00 0.00 C ATOM 1220 C ASP A 80 -3.159 -13.930 2.730 1.00 0.00 C ATOM 1221 O ASP A 80 -3.170 -14.424 1.602 1.00 0.00 O ATOM 1222 CB ASP A 80 -1.216 -13.128 4.087 1.00 0.00 C ATOM 1223 CG ASP A 80 0.079 -12.360 3.915 1.00 0.00 C ATOM 1224 OD1 ASP A 80 0.282 -11.773 2.831 1.00 0.00 O ATOM 1225 OD2 ASP A 80 0.890 -12.345 4.864 1.00 0.00 O ATOM 0 H ASP A 80 -2.931 -11.399 4.530 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.770 -12.418 2.136 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -1.609 -12.952 5.088 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.015 -14.196 4.007 1.00 0.00 H new ATOM 1230 N LYS A 81 -3.903 -14.395 3.729 1.00 0.00 N ATOM 1231 CA LYS A 81 -4.795 -15.535 3.553 1.00 0.00 C ATOM 1232 C LYS A 81 -6.036 -15.137 2.761 1.00 0.00 C ATOM 1233 O LYS A 81 -6.332 -15.721 1.719 1.00 0.00 O ATOM 1234 CB LYS A 81 -5.205 -16.102 4.914 1.00 0.00 C ATOM 1235 CG LYS A 81 -5.830 -15.072 5.839 1.00 0.00 C ATOM 1236 CD LYS A 81 -5.564 -15.399 7.299 1.00 0.00 C ATOM 1237 CE LYS A 81 -6.589 -16.381 7.846 1.00 0.00 C ATOM 1238 NZ LYS A 81 -6.470 -17.720 7.206 1.00 0.00 N ATOM 0 H LYS A 81 -3.905 -13.999 4.669 1.00 0.00 H new ATOM 0 HA LYS A 81 -4.259 -16.302 2.993 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.913 -16.917 4.760 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -4.328 -16.529 5.400 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -5.431 -14.084 5.608 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.905 -15.030 5.665 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -4.564 -15.820 7.402 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -5.586 -14.482 7.888 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -6.458 -16.480 8.923 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -7.592 -15.988 7.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.752 -18.456 7.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -7.090 -17.762 6.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.485 -17.879 6.914 1.00 0.00 H new ATOM 1252 N TYR A 82 -6.758 -14.141 3.262 1.00 0.00 N ATOM 1253 CA TYR A 82 -7.968 -13.666 2.602 1.00 0.00 C ATOM 1254 C TYR A 82 -7.626 -12.738 1.440 1.00 0.00 C ATOM 1255 O TYR A 82 -7.759 -13.109 0.274 1.00 0.00 O ATOM 1256 CB TYR A 82 -8.868 -12.939 3.602 1.00 0.00 C ATOM 1257 CG TYR A 82 -9.244 -13.779 4.801 1.00 0.00 C ATOM 1258 CD1 TYR A 82 -9.050 -15.156 4.797 1.00 0.00 C ATOM 1259 CD2 TYR A 82 -9.792 -13.198 5.938 1.00 0.00 C ATOM 1260 CE1 TYR A 82 -9.392 -15.928 5.891 1.00 0.00 C ATOM 1261 CE2 TYR A 82 -10.135 -13.963 7.036 1.00 0.00 C ATOM 1262 CZ TYR A 82 -9.934 -15.327 7.008 1.00 0.00 C ATOM 1263 OH TYR A 82 -10.276 -16.092 8.099 1.00 0.00 O ATOM 0 H TYR A 82 -6.526 -13.647 4.124 1.00 0.00 H new ATOM 0 HA TYR A 82 -8.500 -14.532 2.208 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -8.361 -12.037 3.945 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -9.778 -12.619 3.094 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -8.625 -15.630 3.925 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -9.953 -12.130 5.964 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -9.236 -16.996 5.871 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -10.559 -13.495 7.912 1.00 0.00 H new ATOM 0 HH TYR A 82 -10.643 -15.515 8.801 1.00 0.00 H new ATOM 1273 N GLY A 83 -7.184 -11.528 1.768 1.00 0.00 N ATOM 1274 CA GLY A 83 -6.829 -10.564 0.742 1.00 0.00 C ATOM 1275 C GLY A 83 -7.835 -9.436 0.634 1.00 0.00 C ATOM 1276 O GLY A 83 -8.328 -8.935 1.645 1.00 0.00 O ATOM 0 H GLY A 83 -7.065 -11.198 2.726 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.845 -10.150 0.962 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -6.753 -11.072 -0.219 1.00 0.00 H new ATOM 1280 N SER A 84 -8.139 -9.032 -0.596 1.00 0.00 N ATOM 1281 CA SER A 84 -9.089 -7.951 -0.832 1.00 0.00 C ATOM 1282 C SER A 84 -10.418 -8.233 -0.137 1.00 0.00 C ATOM 1283 O SER A 84 -10.939 -7.392 0.597 1.00 0.00 O ATOM 1284 CB SER A 84 -9.315 -7.762 -2.333 1.00 0.00 C ATOM 1285 OG SER A 84 -9.672 -8.985 -2.953 1.00 0.00 O ATOM 0 H SER A 84 -7.741 -9.437 -1.444 1.00 0.00 H new ATOM 0 HA SER A 84 -8.670 -7.035 -0.416 1.00 0.00 H new ATOM 0 HB2 SER A 84 -10.102 -7.025 -2.496 1.00 0.00 H new ATOM 0 HB3 SER A 84 -8.409 -7.368 -2.794 1.00 0.00 H new ATOM 0 HG SER A 84 -9.813 -8.837 -3.912 1.00 0.00 H new ATOM 1291 N LEU A 85 -10.961 -9.422 -0.374 1.00 0.00 N ATOM 1292 CA LEU A 85 -12.229 -9.817 0.228 1.00 0.00 C ATOM 1293 C LEU A 85 -12.146 -9.774 1.751 1.00 0.00 C ATOM 1294 O LEU A 85 -13.035 -9.246 2.417 1.00 0.00 O ATOM 1295 CB LEU A 85 -12.620 -11.222 -0.233 1.00 0.00 C ATOM 1296 CG LEU A 85 -14.104 -11.575 -0.127 1.00 0.00 C ATOM 1297 CD1 LEU A 85 -14.911 -10.805 -1.161 1.00 0.00 C ATOM 1298 CD2 LEU A 85 -14.309 -13.073 -0.297 1.00 0.00 C ATOM 0 H LEU A 85 -10.543 -10.129 -0.979 1.00 0.00 H new ATOM 0 HA LEU A 85 -12.992 -9.110 -0.096 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -12.312 -11.340 -1.272 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -12.052 -11.946 0.352 1.00 0.00 H new ATOM 0 HG LEU A 85 -14.456 -11.290 0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -15.965 -11.069 -1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -14.790 -9.735 -0.994 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -14.558 -11.059 -2.161 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -15.371 -13.306 -0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.941 -13.382 -1.275 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.762 -13.606 0.481 1.00 0.00 H new ATOM 1310 N GLY A 86 -11.069 -10.332 2.295 1.00 0.00 N ATOM 1311 CA GLY A 86 -10.888 -10.345 3.735 1.00 0.00 C ATOM 1312 C GLY A 86 -10.994 -8.962 4.346 1.00 0.00 C ATOM 1313 O GLY A 86 -11.785 -8.739 5.263 1.00 0.00 O ATOM 0 H GLY A 86 -10.319 -10.775 1.765 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.637 -10.996 4.186 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -9.912 -10.769 3.971 1.00 0.00 H new ATOM 1317 N LEU A 87 -10.195 -8.030 3.838 1.00 0.00 N ATOM 1318 CA LEU A 87 -10.201 -6.660 4.340 1.00 0.00 C ATOM 1319 C LEU A 87 -11.575 -6.021 4.161 1.00 0.00 C ATOM 1320 O LEU A 87 -12.158 -5.504 5.114 1.00 0.00 O ATOM 1321 CB LEU A 87 -9.141 -5.827 3.618 1.00 0.00 C ATOM 1322 CG LEU A 87 -7.686 -6.218 3.881 1.00 0.00 C ATOM 1323 CD1 LEU A 87 -6.754 -5.478 2.934 1.00 0.00 C ATOM 1324 CD2 LEU A 87 -7.312 -5.937 5.329 1.00 0.00 C ATOM 0 H LEU A 87 -9.535 -8.198 3.079 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.969 -6.688 5.405 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.325 -5.891 2.546 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.273 -4.783 3.902 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.579 -7.288 3.700 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.723 -5.769 3.136 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.007 -5.730 1.904 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.863 -4.404 3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.273 -6.221 5.498 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.436 -4.874 5.537 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.958 -6.514 5.990 1.00 0.00 H new ATOM 1336 N TYR A 88 -12.086 -6.062 2.936 1.00 0.00 N ATOM 1337 CA TYR A 88 -13.391 -5.487 2.632 1.00 0.00 C ATOM 1338 C TYR A 88 -14.376 -5.741 3.769 1.00 0.00 C ATOM 1339 O TYR A 88 -14.893 -4.805 4.379 1.00 0.00 O ATOM 1340 CB TYR A 88 -13.938 -6.071 1.329 1.00 0.00 C ATOM 1341 CG TYR A 88 -15.445 -6.018 1.228 1.00 0.00 C ATOM 1342 CD1 TYR A 88 -16.122 -4.806 1.264 1.00 0.00 C ATOM 1343 CD2 TYR A 88 -16.193 -7.182 1.094 1.00 0.00 C ATOM 1344 CE1 TYR A 88 -17.500 -4.753 1.173 1.00 0.00 C ATOM 1345 CE2 TYR A 88 -17.571 -7.139 1.001 1.00 0.00 C ATOM 1346 CZ TYR A 88 -18.219 -5.922 1.041 1.00 0.00 C ATOM 1347 OH TYR A 88 -19.592 -5.874 0.948 1.00 0.00 O ATOM 0 H TYR A 88 -11.616 -6.488 2.137 1.00 0.00 H new ATOM 0 HA TYR A 88 -13.267 -4.410 2.516 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -13.507 -5.528 0.488 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -13.612 -7.107 1.240 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -15.562 -3.888 1.365 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -15.688 -8.136 1.062 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -18.010 -3.802 1.205 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -18.137 -8.053 0.898 1.00 0.00 H new ATOM 0 HH TYR A 88 -19.984 -5.955 1.843 1.00 0.00 H new ATOM 1357 N VAL A 89 -14.630 -7.015 4.050 1.00 0.00 N ATOM 1358 CA VAL A 89 -15.551 -7.395 5.114 1.00 0.00 C ATOM 1359 C VAL A 89 -15.067 -6.887 6.467 1.00 0.00 C ATOM 1360 O VAL A 89 -15.836 -6.315 7.239 1.00 0.00 O ATOM 1361 CB VAL A 89 -15.728 -8.923 5.185 1.00 0.00 C ATOM 1362 CG1 VAL A 89 -16.602 -9.306 6.370 1.00 0.00 C ATOM 1363 CG2 VAL A 89 -16.316 -9.452 3.885 1.00 0.00 C ATOM 0 H VAL A 89 -14.210 -7.802 3.555 1.00 0.00 H new ATOM 0 HA VAL A 89 -16.512 -6.936 4.879 1.00 0.00 H new ATOM 0 HB VAL A 89 -14.748 -9.378 5.326 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -16.715 -10.390 6.403 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -16.135 -8.961 7.293 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -17.582 -8.842 6.264 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -16.434 -10.533 3.953 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -17.288 -8.991 3.711 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -15.647 -9.211 3.059 1.00 0.00 H new ATOM 1373 N ALA A 90 -13.785 -7.100 6.749 1.00 0.00 N ATOM 1374 CA ALA A 90 -13.197 -6.661 8.008 1.00 0.00 C ATOM 1375 C ALA A 90 -13.546 -5.206 8.300 1.00 0.00 C ATOM 1376 O ALA A 90 -13.895 -4.856 9.427 1.00 0.00 O ATOM 1377 CB ALA A 90 -11.687 -6.848 7.978 1.00 0.00 C ATOM 0 H ALA A 90 -13.135 -7.574 6.122 1.00 0.00 H new ATOM 0 HA ALA A 90 -13.613 -7.274 8.808 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.260 -6.516 8.925 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -11.454 -7.902 7.824 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -11.264 -6.260 7.163 1.00 0.00 H new ATOM 1383 N GLU A 91 -13.448 -4.362 7.277 1.00 0.00 N ATOM 1384 CA GLU A 91 -13.753 -2.944 7.426 1.00 0.00 C ATOM 1385 C GLU A 91 -15.243 -2.731 7.677 1.00 0.00 C ATOM 1386 O GLU A 91 -15.633 -1.854 8.448 1.00 0.00 O ATOM 1387 CB GLU A 91 -13.319 -2.173 6.178 1.00 0.00 C ATOM 1388 CG GLU A 91 -12.999 -0.712 6.445 1.00 0.00 C ATOM 1389 CD GLU A 91 -12.432 -0.006 5.229 1.00 0.00 C ATOM 1390 OE1 GLU A 91 -13.065 -0.077 4.154 1.00 0.00 O ATOM 1391 OE2 GLU A 91 -11.356 0.616 5.351 1.00 0.00 O ATOM 0 H GLU A 91 -13.160 -4.636 6.337 1.00 0.00 H new ATOM 0 HA GLU A 91 -13.200 -2.568 8.287 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -12.441 -2.656 5.750 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -14.111 -2.232 5.431 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -13.905 -0.199 6.768 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -12.284 -0.645 7.265 1.00 0.00 H new ATOM 1398 N GLN A 92 -16.069 -3.538 7.020 1.00 0.00 N ATOM 1399 CA GLN A 92 -17.516 -3.437 7.171 1.00 0.00 C ATOM 1400 C GLN A 92 -17.936 -3.735 8.607 1.00 0.00 C ATOM 1401 O GLN A 92 -18.682 -2.970 9.218 1.00 0.00 O ATOM 1402 CB GLN A 92 -18.218 -4.400 6.212 1.00 0.00 C ATOM 1403 CG GLN A 92 -18.024 -4.047 4.746 1.00 0.00 C ATOM 1404 CD GLN A 92 -19.160 -4.539 3.871 1.00 0.00 C ATOM 1405 OE1 GLN A 92 -19.535 -5.711 3.921 1.00 0.00 O ATOM 1406 NE2 GLN A 92 -19.716 -3.644 3.063 1.00 0.00 N ATOM 0 H GLN A 92 -15.762 -4.269 6.378 1.00 0.00 H new ATOM 0 HA GLN A 92 -17.811 -2.416 6.930 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -17.846 -5.409 6.387 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -19.285 -4.410 6.437 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -17.936 -2.965 4.646 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -17.087 -4.478 4.394 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -19.374 -2.683 3.054 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -20.485 -3.917 2.452 1.00 0.00 H new ATOM 1415 N PHE A 93 -17.451 -4.852 9.140 1.00 0.00 N ATOM 1416 CA PHE A 93 -17.777 -5.252 10.504 1.00 0.00 C ATOM 1417 C PHE A 93 -16.534 -5.233 11.388 1.00 0.00 C ATOM 1418 O PHE A 93 -16.395 -4.380 12.264 1.00 0.00 O ATOM 1419 CB PHE A 93 -18.402 -6.649 10.513 1.00 0.00 C ATOM 1420 CG PHE A 93 -19.372 -6.879 9.389 1.00 0.00 C ATOM 1421 CD1 PHE A 93 -18.918 -7.121 8.103 1.00 0.00 C ATOM 1422 CD2 PHE A 93 -20.738 -6.852 9.620 1.00 0.00 C ATOM 1423 CE1 PHE A 93 -19.807 -7.333 7.067 1.00 0.00 C ATOM 1424 CE2 PHE A 93 -21.632 -7.065 8.588 1.00 0.00 C ATOM 1425 CZ PHE A 93 -21.167 -7.304 7.310 1.00 0.00 C ATOM 0 H PHE A 93 -16.831 -5.496 8.648 1.00 0.00 H new ATOM 0 HA PHE A 93 -18.496 -4.537 10.904 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -17.608 -7.394 10.455 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -18.915 -6.803 11.462 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -17.856 -7.144 7.908 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -21.108 -6.663 10.617 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -19.440 -7.521 6.069 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -22.694 -7.045 8.781 1.00 0.00 H new ATOM 0 HZ PHE A 93 -21.865 -7.468 6.502 1.00 0.00 H new ATOM 1435 N GLY A 94 -15.632 -6.181 11.152 1.00 0.00 N ATOM 1436 CA GLY A 94 -14.412 -6.256 11.935 1.00 0.00 C ATOM 1437 C GLY A 94 -13.636 -7.533 11.678 1.00 0.00 C ATOM 1438 O GLY A 94 -14.225 -8.599 11.502 1.00 0.00 O ATOM 0 H GLY A 94 -15.724 -6.898 10.433 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.781 -5.398 11.702 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.659 -6.192 12.995 1.00 0.00 H new ATOM 1442 N GLU A 95 -12.312 -7.424 11.654 1.00 0.00 N ATOM 1443 CA GLU A 95 -11.455 -8.579 11.414 1.00 0.00 C ATOM 1444 C GLU A 95 -11.977 -9.807 12.154 1.00 0.00 C ATOM 1445 O GLU A 95 -11.902 -10.926 11.649 1.00 0.00 O ATOM 1446 CB GLU A 95 -10.020 -8.278 11.852 1.00 0.00 C ATOM 1447 CG GLU A 95 -9.364 -7.160 11.060 1.00 0.00 C ATOM 1448 CD GLU A 95 -8.128 -6.608 11.744 1.00 0.00 C ATOM 1449 OE1 GLU A 95 -8.200 -6.320 12.957 1.00 0.00 O ATOM 1450 OE2 GLU A 95 -7.088 -6.465 11.066 1.00 0.00 O ATOM 0 H GLU A 95 -11.809 -6.548 11.798 1.00 0.00 H new ATOM 0 HA GLU A 95 -11.464 -8.789 10.345 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.020 -8.012 12.909 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.421 -9.183 11.751 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.093 -7.531 10.072 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -10.083 -6.354 10.912 1.00 0.00 H new ATOM 1457 N GLU A 96 -12.506 -9.587 13.354 1.00 0.00 N ATOM 1458 CA GLU A 96 -13.039 -10.676 14.164 1.00 0.00 C ATOM 1459 C GLU A 96 -14.291 -11.269 13.523 1.00 0.00 C ATOM 1460 O GLU A 96 -14.475 -12.485 13.504 1.00 0.00 O ATOM 1461 CB GLU A 96 -13.361 -10.181 15.575 1.00 0.00 C ATOM 1462 CG GLU A 96 -12.169 -9.571 16.293 1.00 0.00 C ATOM 1463 CD GLU A 96 -11.367 -10.598 17.068 1.00 0.00 C ATOM 1464 OE1 GLU A 96 -11.041 -11.656 16.491 1.00 0.00 O ATOM 1465 OE2 GLU A 96 -11.065 -10.342 18.253 1.00 0.00 O ATOM 0 H GLU A 96 -12.577 -8.666 13.786 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.279 -11.455 14.225 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -14.158 -9.440 15.518 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -13.742 -11.014 16.165 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -11.521 -9.084 15.564 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.518 -8.797 16.976 1.00 0.00 H new ATOM 1472 N ASN A 97 -15.148 -10.399 12.998 1.00 0.00 N ATOM 1473 CA ASN A 97 -16.384 -10.835 12.357 1.00 0.00 C ATOM 1474 C ASN A 97 -16.087 -11.634 11.092 1.00 0.00 C ATOM 1475 O ASN A 97 -16.827 -12.551 10.736 1.00 0.00 O ATOM 1476 CB ASN A 97 -17.260 -9.627 12.018 1.00 0.00 C ATOM 1477 CG ASN A 97 -17.984 -9.079 13.232 1.00 0.00 C ATOM 1478 OD1 ASN A 97 -19.196 -9.244 13.373 1.00 0.00 O ATOM 1479 ND2 ASN A 97 -17.242 -8.421 14.116 1.00 0.00 N ATOM 0 H ASN A 97 -15.010 -9.388 13.004 1.00 0.00 H new ATOM 0 HA ASN A 97 -16.919 -11.479 13.055 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -16.640 -8.843 11.583 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -17.990 -9.912 11.261 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -17.674 -8.028 14.953 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -16.241 -8.308 13.958 1.00 0.00 H new ATOM 1486 N VAL A 98 -14.998 -11.280 10.416 1.00 0.00 N ATOM 1487 CA VAL A 98 -14.602 -11.965 9.192 1.00 0.00 C ATOM 1488 C VAL A 98 -14.291 -13.433 9.459 1.00 0.00 C ATOM 1489 O VAL A 98 -14.431 -14.278 8.576 1.00 0.00 O ATOM 1490 CB VAL A 98 -13.370 -11.299 8.550 1.00 0.00 C ATOM 1491 CG1 VAL A 98 -13.107 -11.881 7.169 1.00 0.00 C ATOM 1492 CG2 VAL A 98 -13.558 -9.791 8.475 1.00 0.00 C ATOM 0 H VAL A 98 -14.375 -10.523 10.696 1.00 0.00 H new ATOM 0 HA VAL A 98 -15.444 -11.895 8.504 1.00 0.00 H new ATOM 0 HB VAL A 98 -12.501 -11.503 9.176 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -12.233 -11.398 6.731 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -12.925 -12.952 7.254 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -13.974 -11.710 6.531 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -12.678 -9.337 8.019 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -14.437 -9.563 7.873 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -13.693 -9.391 9.480 1.00 0.00 H new ATOM 1502 N ASN A 99 -13.869 -13.729 10.684 1.00 0.00 N ATOM 1503 CA ASN A 99 -13.538 -15.097 11.068 1.00 0.00 C ATOM 1504 C ASN A 99 -14.758 -16.005 10.951 1.00 0.00 C ATOM 1505 O ASN A 99 -14.696 -17.071 10.337 1.00 0.00 O ATOM 1506 CB ASN A 99 -13.000 -15.130 12.500 1.00 0.00 C ATOM 1507 CG ASN A 99 -12.248 -16.411 12.806 1.00 0.00 C ATOM 1508 OD1 ASN A 99 -11.995 -17.223 11.915 1.00 0.00 O ATOM 1509 ND2 ASN A 99 -11.886 -16.598 14.070 1.00 0.00 N ATOM 0 H ASN A 99 -13.748 -13.041 11.427 1.00 0.00 H new ATOM 0 HA ASN A 99 -12.768 -15.463 10.388 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -12.339 -14.278 12.657 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -13.829 -15.023 13.199 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -11.377 -17.441 14.335 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -12.117 -15.898 14.775 1.00 0.00 H new ATOM 1516 N THR A 100 -15.868 -15.576 11.543 1.00 0.00 N ATOM 1517 CA THR A 100 -17.103 -16.350 11.505 1.00 0.00 C ATOM 1518 C THR A 100 -17.716 -16.340 10.109 1.00 0.00 C ATOM 1519 O THR A 100 -18.485 -17.232 9.753 1.00 0.00 O ATOM 1520 CB THR A 100 -18.136 -15.808 12.511 1.00 0.00 C ATOM 1521 OG1 THR A 100 -19.214 -16.740 12.655 1.00 0.00 O ATOM 1522 CG2 THR A 100 -18.680 -14.462 12.057 1.00 0.00 C ATOM 0 H THR A 100 -15.937 -14.696 12.055 1.00 0.00 H new ATOM 0 HA THR A 100 -16.843 -17.373 11.777 1.00 0.00 H new ATOM 0 HB THR A 100 -17.639 -15.675 13.472 1.00 0.00 H new ATOM 0 HG1 THR A 100 -19.866 -16.389 13.297 1.00 0.00 H new ATOM 0 HG21 THR A 100 -19.407 -14.100 12.783 1.00 0.00 H new ATOM 0 HG22 THR A 100 -17.861 -13.747 11.976 1.00 0.00 H new ATOM 0 HG23 THR A 100 -19.162 -14.573 11.086 1.00 0.00 H new ATOM 1530 N TYR A 101 -17.369 -15.327 9.323 1.00 0.00 N ATOM 1531 CA TYR A 101 -17.887 -15.201 7.966 1.00 0.00 C ATOM 1532 C TYR A 101 -17.230 -16.215 7.036 1.00 0.00 C ATOM 1533 O TYR A 101 -17.857 -16.718 6.103 1.00 0.00 O ATOM 1534 CB TYR A 101 -17.655 -13.783 7.439 1.00 0.00 C ATOM 1535 CG TYR A 101 -18.786 -12.829 7.751 1.00 0.00 C ATOM 1536 CD1 TYR A 101 -20.101 -13.154 7.442 1.00 0.00 C ATOM 1537 CD2 TYR A 101 -18.539 -11.602 8.353 1.00 0.00 C ATOM 1538 CE1 TYR A 101 -21.137 -12.285 7.724 1.00 0.00 C ATOM 1539 CE2 TYR A 101 -19.569 -10.727 8.641 1.00 0.00 C ATOM 1540 CZ TYR A 101 -20.866 -11.073 8.324 1.00 0.00 C ATOM 1541 OH TYR A 101 -21.894 -10.204 8.607 1.00 0.00 O ATOM 0 H TYR A 101 -16.731 -14.581 9.602 1.00 0.00 H new ATOM 0 HA TYR A 101 -18.958 -15.401 7.993 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -16.732 -13.392 7.867 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -17.513 -13.824 6.359 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -20.317 -14.103 6.973 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -17.524 -11.327 8.600 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -22.153 -12.553 7.476 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -19.360 -9.778 9.112 1.00 0.00 H new ATOM 0 HH TYR A 101 -21.620 -9.290 8.385 1.00 0.00 H new ATOM 1551 N PHE A 102 -15.961 -16.512 7.296 1.00 0.00 N ATOM 1552 CA PHE A 102 -15.216 -17.466 6.483 1.00 0.00 C ATOM 1553 C PHE A 102 -15.538 -18.900 6.895 1.00 0.00 C ATOM 1554 O PHE A 102 -15.778 -19.762 6.050 1.00 0.00 O ATOM 1555 CB PHE A 102 -13.713 -17.213 6.610 1.00 0.00 C ATOM 1556 CG PHE A 102 -13.188 -16.213 5.619 1.00 0.00 C ATOM 1557 CD1 PHE A 102 -13.658 -14.910 5.615 1.00 0.00 C ATOM 1558 CD2 PHE A 102 -12.226 -16.577 4.691 1.00 0.00 C ATOM 1559 CE1 PHE A 102 -13.177 -13.987 4.705 1.00 0.00 C ATOM 1560 CE2 PHE A 102 -11.741 -15.659 3.779 1.00 0.00 C ATOM 1561 CZ PHE A 102 -12.218 -14.363 3.785 1.00 0.00 C ATOM 0 H PHE A 102 -15.427 -16.105 8.064 1.00 0.00 H new ATOM 0 HA PHE A 102 -15.514 -17.329 5.443 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -13.496 -16.862 7.619 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -13.182 -18.156 6.479 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -14.409 -14.612 6.331 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -11.851 -17.590 4.680 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -13.551 -12.974 4.714 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -10.989 -15.955 3.062 1.00 0.00 H new ATOM 0 HZ PHE A 102 -11.842 -13.645 3.072 1.00 0.00 H new ATOM 1571 N VAL A 103 -15.542 -19.147 8.201 1.00 0.00 N ATOM 1572 CA VAL A 103 -15.834 -20.475 8.727 1.00 0.00 C ATOM 1573 C VAL A 103 -17.256 -20.903 8.381 1.00 0.00 C ATOM 1574 O VAL A 103 -17.506 -22.066 8.064 1.00 0.00 O ATOM 1575 CB VAL A 103 -15.653 -20.526 10.256 1.00 0.00 C ATOM 1576 CG1 VAL A 103 -14.240 -20.115 10.641 1.00 0.00 C ATOM 1577 CG2 VAL A 103 -16.681 -19.639 10.943 1.00 0.00 C ATOM 0 H VAL A 103 -15.346 -18.445 8.914 1.00 0.00 H new ATOM 0 HA VAL A 103 -15.127 -21.162 8.261 1.00 0.00 H new ATOM 0 HB VAL A 103 -15.810 -21.552 10.589 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -14.131 -20.157 11.725 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -13.524 -20.794 10.178 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -14.050 -19.098 10.297 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -16.539 -19.687 12.023 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -16.557 -18.610 10.606 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -17.684 -19.984 10.693 1.00 0.00 H new ATOM 1587 N SER A 104 -18.185 -19.954 8.442 1.00 0.00 N ATOM 1588 CA SER A 104 -19.583 -20.233 8.137 1.00 0.00 C ATOM 1589 C SER A 104 -19.701 -21.229 6.988 1.00 0.00 C ATOM 1590 O SER A 104 -19.526 -20.874 5.823 1.00 0.00 O ATOM 1591 CB SER A 104 -20.318 -18.938 7.782 1.00 0.00 C ATOM 1592 OG SER A 104 -20.709 -18.237 8.950 1.00 0.00 O ATOM 0 H SER A 104 -17.995 -18.986 8.700 1.00 0.00 H new ATOM 0 HA SER A 104 -20.041 -20.672 9.023 1.00 0.00 H new ATOM 0 HB2 SER A 104 -19.673 -18.305 7.173 1.00 0.00 H new ATOM 0 HB3 SER A 104 -21.198 -19.168 7.181 1.00 0.00 H new ATOM 0 HG SER A 104 -20.048 -17.542 9.151 1.00 0.00 H new ATOM 1598 N GLY A 105 -19.999 -22.480 7.326 1.00 0.00 N ATOM 1599 CA GLY A 105 -20.135 -23.510 6.312 1.00 0.00 C ATOM 1600 C GLY A 105 -19.257 -24.714 6.588 1.00 0.00 C ATOM 1601 O GLY A 105 -18.733 -24.889 7.689 1.00 0.00 O ATOM 0 H GLY A 105 -20.149 -22.799 8.283 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -21.176 -23.828 6.259 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -19.879 -23.093 5.338 1.00 0.00 H new ATOM 1605 N PRO A 106 -19.087 -25.573 5.571 1.00 0.00 N ATOM 1606 CA PRO A 106 -18.267 -26.783 5.686 1.00 0.00 C ATOM 1607 C PRO A 106 -16.780 -26.467 5.797 1.00 0.00 C ATOM 1608 O PRO A 106 -15.992 -27.296 6.251 1.00 0.00 O ATOM 1609 CB PRO A 106 -18.559 -27.533 4.384 1.00 0.00 C ATOM 1610 CG PRO A 106 -18.969 -26.474 3.420 1.00 0.00 C ATOM 1611 CD PRO A 106 -19.681 -25.428 4.232 1.00 0.00 C ATOM 0 HA PRO A 106 -18.504 -27.353 6.585 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -17.679 -28.070 4.031 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -19.349 -28.271 4.521 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -18.102 -26.051 2.913 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -19.623 -26.881 2.648 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -19.522 -24.428 3.828 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -20.758 -25.597 4.250 1.00 0.00 H new ATOM 1619 N SER A 107 -16.402 -25.263 5.379 1.00 0.00 N ATOM 1620 CA SER A 107 -15.008 -24.839 5.429 1.00 0.00 C ATOM 1621 C SER A 107 -14.325 -25.366 6.687 1.00 0.00 C ATOM 1622 O SER A 107 -14.516 -24.834 7.780 1.00 0.00 O ATOM 1623 CB SER A 107 -14.915 -23.312 5.386 1.00 0.00 C ATOM 1624 OG SER A 107 -13.575 -22.888 5.207 1.00 0.00 O ATOM 0 H SER A 107 -17.042 -24.564 5.002 1.00 0.00 H new ATOM 0 HA SER A 107 -14.497 -25.252 4.559 1.00 0.00 H new ATOM 0 HB2 SER A 107 -15.532 -22.930 4.573 1.00 0.00 H new ATOM 0 HB3 SER A 107 -15.312 -22.894 6.311 1.00 0.00 H new ATOM 0 HG SER A 107 -13.542 -21.909 5.181 1.00 0.00 H new ATOM 1630 N SER A 108 -13.526 -26.416 6.523 1.00 0.00 N ATOM 1631 CA SER A 108 -12.816 -27.019 7.645 1.00 0.00 C ATOM 1632 C SER A 108 -13.741 -27.186 8.847 1.00 0.00 C ATOM 1633 O SER A 108 -13.404 -26.796 9.964 1.00 0.00 O ATOM 1634 CB SER A 108 -11.609 -26.162 8.032 1.00 0.00 C ATOM 1635 OG SER A 108 -10.755 -26.857 8.925 1.00 0.00 O ATOM 0 H SER A 108 -13.354 -26.866 5.624 1.00 0.00 H new ATOM 0 HA SER A 108 -12.469 -28.005 7.336 1.00 0.00 H new ATOM 0 HB2 SER A 108 -11.054 -25.884 7.136 1.00 0.00 H new ATOM 0 HB3 SER A 108 -11.950 -25.237 8.496 1.00 0.00 H new ATOM 0 HG SER A 108 -11.263 -27.132 9.717 1.00 0.00 H new ATOM 1641 N GLY A 109 -14.912 -27.770 8.607 1.00 0.00 N ATOM 1642 CA GLY A 109 -15.869 -27.980 9.678 1.00 0.00 C ATOM 1643 C GLY A 109 -15.778 -29.371 10.273 1.00 0.00 C ATOM 1644 O GLY A 109 -15.969 -30.366 9.573 1.00 0.00 O ATOM 0 H GLY A 109 -15.214 -28.101 7.691 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -15.700 -27.241 10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -16.877 -27.816 9.297 1.00 0.00 H new TER 1648 GLY A 109