USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=33 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 180:sc= 0 USER MOD Set 1.2: A 92 GLN : amide:sc= -12.2! C(o=-12!,f=-13!) USER MOD Single : A 1 GLY N :NH3+ -112:sc= 0.0482 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.192 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -1.97 X(o=-2,f=-2.3) USER MOD Single : A 11 SER OG : rot 29:sc= 0.0373! USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 29:sc= 0.0425 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0.0706 USER MOD Single : A 21 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 152:sc= 0.966 (180deg=-0.114) USER MOD Single : A 28 ASN :FLIP amide:sc=-0.00188 F(o=-0.87,f=-0.0019) 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 180:sc= -0.106 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+ -150:sc= 0 (180deg=-0.594) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -2.16! C(o=-2.2!,f=-7.3!) USER MOD Single : A 49 LYS NZ :NH3+ 138:sc= -1.68! (180deg=-3.67!) USER MOD Single : A 50 ASN : amide:sc= 0.73 K(o=0.73,f=-0.26) USER MOD Single : A 53 ASN : amide:sc= -18.4! C(o=-18!,f=-32!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.636) USER MOD Single : A 64 ASN : amide:sc= -5.69! C(o=-5.7!,f=-7.2!) USER MOD Single : A 65 ASN : amide:sc= -0.0073 X(o=-0.0073,f=0) USER MOD Single : A 67 HIS : no HE2:sc= -3.31! K(o=-3.3!,f=-3.9) USER MOD Single : A 71 THR OG1 : rot -56:sc= 0.795 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.5!) USER MOD Single : A 79 TYR OH : rot 100:sc= -0.944 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc=-0.000498 X(o=-0.0005,f=0) USER MOD Single : A 99 ASN : amide:sc= 0.00154 X(o=0.0015,f=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -54:sc= 0.179 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.444 -4.076 -26.778 1.00 0.00 N ATOM 2 CA GLY A 1 15.649 -5.184 -27.275 1.00 0.00 C ATOM 3 C GLY A 1 15.971 -6.489 -26.575 1.00 0.00 C ATOM 4 O GLY A 1 17.072 -6.666 -26.053 1.00 0.00 O ATOM 0 H1 GLY A 1 15.829 -3.408 -26.271 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.173 -4.435 -26.130 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.900 -3.590 -27.577 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.591 -4.956 -27.143 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.819 -5.298 -28.346 1.00 0.00 H new ATOM 8 N SER A 2 15.007 -7.404 -26.560 1.00 0.00 N ATOM 9 CA SER A 2 15.191 -8.698 -25.913 1.00 0.00 C ATOM 10 C SER A 2 14.253 -9.742 -26.510 1.00 0.00 C ATOM 11 O SER A 2 13.400 -9.425 -27.338 1.00 0.00 O ATOM 12 CB SER A 2 14.947 -8.578 -24.407 1.00 0.00 C ATOM 13 OG SER A 2 15.824 -7.631 -23.823 1.00 0.00 O ATOM 0 H SER A 2 14.091 -7.273 -26.988 1.00 0.00 H new ATOM 0 HA SER A 2 16.219 -9.019 -26.083 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.914 -8.282 -24.225 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.088 -9.550 -23.934 1.00 0.00 H new ATOM 0 HG SER A 2 15.647 -7.571 -22.861 1.00 0.00 H new ATOM 19 N SER A 3 14.418 -10.990 -26.083 1.00 0.00 N ATOM 20 CA SER A 3 13.590 -12.083 -26.577 1.00 0.00 C ATOM 21 C SER A 3 13.260 -13.065 -25.456 1.00 0.00 C ATOM 22 O SER A 3 14.048 -13.255 -24.531 1.00 0.00 O ATOM 23 CB SER A 3 14.300 -12.814 -27.718 1.00 0.00 C ATOM 24 OG SER A 3 13.560 -13.948 -28.136 1.00 0.00 O ATOM 0 H SER A 3 15.118 -11.269 -25.396 1.00 0.00 H new ATOM 0 HA SER A 3 12.658 -11.659 -26.951 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.437 -12.135 -28.560 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.293 -13.124 -27.393 1.00 0.00 H new ATOM 0 HG SER A 3 14.034 -14.397 -28.867 1.00 0.00 H new ATOM 30 N GLY A 4 12.089 -13.687 -25.548 1.00 0.00 N ATOM 31 CA GLY A 4 11.674 -14.641 -24.537 1.00 0.00 C ATOM 32 C GLY A 4 10.192 -14.556 -24.232 1.00 0.00 C ATOM 33 O GLY A 4 9.797 -14.105 -23.157 1.00 0.00 O ATOM 0 H GLY A 4 11.420 -13.547 -26.305 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.915 -15.649 -24.873 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.240 -14.466 -23.622 1.00 0.00 H new ATOM 37 N SER A 5 9.368 -14.989 -25.181 1.00 0.00 N ATOM 38 CA SER A 5 7.920 -14.955 -25.011 1.00 0.00 C ATOM 39 C SER A 5 7.358 -16.364 -24.851 1.00 0.00 C ATOM 40 O SER A 5 6.327 -16.703 -25.431 1.00 0.00 O ATOM 41 CB SER A 5 7.261 -14.264 -26.206 1.00 0.00 C ATOM 42 OG SER A 5 7.557 -12.878 -26.221 1.00 0.00 O ATOM 0 H SER A 5 9.679 -15.368 -26.076 1.00 0.00 H new ATOM 0 HA SER A 5 7.699 -14.390 -24.106 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.607 -14.723 -27.132 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.181 -14.408 -26.163 1.00 0.00 H new ATOM 0 HG SER A 5 7.126 -12.460 -26.995 1.00 0.00 H new ATOM 48 N SER A 6 8.045 -17.182 -24.059 1.00 0.00 N ATOM 49 CA SER A 6 7.618 -18.556 -23.824 1.00 0.00 C ATOM 50 C SER A 6 7.220 -18.759 -22.365 1.00 0.00 C ATOM 51 O SER A 6 7.927 -18.335 -21.452 1.00 0.00 O ATOM 52 CB SER A 6 8.735 -19.531 -24.201 1.00 0.00 C ATOM 53 OG SER A 6 9.827 -19.427 -23.303 1.00 0.00 O ATOM 0 H SER A 6 8.900 -16.916 -23.570 1.00 0.00 H new ATOM 0 HA SER A 6 6.748 -18.752 -24.450 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.350 -20.551 -24.194 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.074 -19.326 -25.216 1.00 0.00 H new ATOM 0 HG SER A 6 10.527 -20.061 -23.564 1.00 0.00 H new ATOM 59 N GLY A 7 6.081 -19.413 -22.154 1.00 0.00 N ATOM 60 CA GLY A 7 5.608 -19.662 -20.805 1.00 0.00 C ATOM 61 C GLY A 7 4.711 -18.554 -20.292 1.00 0.00 C ATOM 62 O GLY A 7 3.656 -18.817 -19.714 1.00 0.00 O ATOM 0 H GLY A 7 5.478 -19.774 -22.893 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.063 -20.606 -20.783 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.463 -19.771 -20.138 1.00 0.00 H new ATOM 66 N ARG A 8 5.131 -17.310 -20.501 1.00 0.00 N ATOM 67 CA ARG A 8 4.359 -16.157 -20.052 1.00 0.00 C ATOM 68 C ARG A 8 2.890 -16.302 -20.441 1.00 0.00 C ATOM 69 O ARG A 8 2.555 -17.026 -21.377 1.00 0.00 O ATOM 70 CB ARG A 8 4.931 -14.870 -20.649 1.00 0.00 C ATOM 71 CG ARG A 8 4.761 -14.769 -22.156 1.00 0.00 C ATOM 72 CD ARG A 8 3.448 -14.097 -22.525 1.00 0.00 C ATOM 73 NE ARG A 8 3.384 -13.763 -23.945 1.00 0.00 N ATOM 74 CZ ARG A 8 3.257 -14.670 -24.908 1.00 0.00 C ATOM 75 NH1 ARG A 8 3.180 -15.958 -24.604 1.00 0.00 N ATOM 76 NH2 ARG A 8 3.206 -14.288 -26.178 1.00 0.00 N ATOM 0 H ARG A 8 6.001 -17.075 -20.978 1.00 0.00 H new ATOM 0 HA ARG A 8 4.426 -16.107 -18.965 1.00 0.00 H new ATOM 0 HB2 ARG A 8 4.446 -14.015 -20.179 1.00 0.00 H new ATOM 0 HB3 ARG A 8 5.992 -14.807 -20.407 1.00 0.00 H new ATOM 0 HG2 ARG A 8 5.592 -14.204 -22.580 1.00 0.00 H new ATOM 0 HG3 ARG A 8 4.797 -15.766 -22.595 1.00 0.00 H new ATOM 0 HD2 ARG A 8 2.619 -14.757 -22.270 1.00 0.00 H new ATOM 0 HD3 ARG A 8 3.326 -13.190 -21.933 1.00 0.00 H new ATOM 0 HE ARG A 8 3.440 -12.780 -24.212 1.00 0.00 H new ATOM 0 HH11 ARG A 8 3.218 -16.255 -23.629 1.00 0.00 H new ATOM 0 HH12 ARG A 8 3.083 -16.652 -25.345 1.00 0.00 H new ATOM 0 HH21 ARG A 8 3.264 -13.298 -26.415 1.00 0.00 H new ATOM 0 HH22 ARG A 8 3.109 -14.985 -26.917 1.00 0.00 H new ATOM 90 N GLN A 9 2.021 -15.608 -19.714 1.00 0.00 N ATOM 91 CA GLN A 9 0.588 -15.661 -19.982 1.00 0.00 C ATOM 92 C GLN A 9 0.012 -14.257 -20.139 1.00 0.00 C ATOM 93 O GLN A 9 0.362 -13.345 -19.391 1.00 0.00 O ATOM 94 CB GLN A 9 -0.136 -16.399 -18.855 1.00 0.00 C ATOM 95 CG GLN A 9 -0.062 -15.686 -17.514 1.00 0.00 C ATOM 96 CD GLN A 9 1.345 -15.646 -16.951 1.00 0.00 C ATOM 97 OE1 GLN A 9 2.063 -16.646 -16.972 1.00 0.00 O ATOM 98 NE2 GLN A 9 1.747 -14.487 -16.444 1.00 0.00 N ATOM 0 H GLN A 9 2.283 -15.003 -18.936 1.00 0.00 H new ATOM 0 HA GLN A 9 0.438 -16.202 -20.916 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -1.183 -16.529 -19.131 1.00 0.00 H new ATOM 0 HB3 GLN A 9 0.292 -17.396 -18.751 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -0.433 -14.667 -17.628 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -0.719 -16.187 -16.804 1.00 0.00 H new ATOM 0 HE21 GLN A 9 1.119 -13.684 -16.447 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.684 -14.400 -16.051 1.00 0.00 H new ATOM 107 N ARG A 10 -0.873 -14.093 -21.117 1.00 0.00 N ATOM 108 CA ARG A 10 -1.496 -12.800 -21.373 1.00 0.00 C ATOM 109 C ARG A 10 -2.852 -12.703 -20.679 1.00 0.00 C ATOM 110 O ARG A 10 -3.816 -12.191 -21.247 1.00 0.00 O ATOM 111 CB ARG A 10 -1.665 -12.580 -22.878 1.00 0.00 C ATOM 112 CG ARG A 10 -0.363 -12.272 -23.598 1.00 0.00 C ATOM 113 CD ARG A 10 -0.047 -10.784 -23.565 1.00 0.00 C ATOM 114 NE ARG A 10 1.160 -10.464 -24.323 1.00 0.00 N ATOM 115 CZ ARG A 10 1.169 -10.253 -25.634 1.00 0.00 C ATOM 116 NH1 ARG A 10 0.042 -10.328 -26.329 1.00 0.00 N ATOM 117 NH2 ARG A 10 2.307 -9.966 -26.253 1.00 0.00 N ATOM 0 H ARG A 10 -1.174 -14.839 -21.744 1.00 0.00 H new ATOM 0 HA ARG A 10 -0.844 -12.025 -20.970 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.112 -13.471 -23.319 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -2.363 -11.759 -23.041 1.00 0.00 H new ATOM 0 HG2 ARG A 10 0.451 -12.828 -23.134 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -0.430 -12.608 -24.633 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -0.890 -10.225 -23.972 1.00 0.00 H new ATOM 0 HD3 ARG A 10 0.078 -10.463 -22.531 1.00 0.00 H new ATOM 0 HE ARG A 10 2.044 -10.399 -23.818 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -0.835 -10.548 -25.857 1.00 0.00 H new ATOM 0 HH12 ARG A 10 0.052 -10.165 -27.336 1.00 0.00 H new ATOM 0 HH21 ARG A 10 3.176 -9.907 -25.722 1.00 0.00 H new ATOM 0 HH22 ARG A 10 2.313 -9.804 -27.260 1.00 0.00 H new ATOM 131 N SER A 11 -2.917 -13.198 -19.447 1.00 0.00 N ATOM 132 CA SER A 11 -4.154 -13.171 -18.677 1.00 0.00 C ATOM 133 C SER A 11 -3.899 -13.564 -17.225 1.00 0.00 C ATOM 134 O SER A 11 -3.298 -14.603 -16.947 1.00 0.00 O ATOM 135 CB SER A 11 -5.187 -14.114 -19.298 1.00 0.00 C ATOM 136 OG SER A 11 -4.888 -15.466 -19.000 1.00 0.00 O ATOM 0 H SER A 11 -2.127 -13.623 -18.961 1.00 0.00 H new ATOM 0 HA SER A 11 -4.543 -12.153 -18.697 1.00 0.00 H new ATOM 0 HB2 SER A 11 -6.181 -13.867 -18.924 1.00 0.00 H new ATOM 0 HB3 SER A 11 -5.209 -13.973 -20.379 1.00 0.00 H new ATOM 0 HG SER A 11 -4.410 -15.515 -18.146 1.00 0.00 H new ATOM 142 N LEU A 12 -4.361 -12.727 -16.302 1.00 0.00 N ATOM 143 CA LEU A 12 -4.184 -12.986 -14.877 1.00 0.00 C ATOM 144 C LEU A 12 -5.052 -12.050 -14.042 1.00 0.00 C ATOM 145 O LEU A 12 -5.361 -10.935 -14.461 1.00 0.00 O ATOM 146 CB LEU A 12 -2.714 -12.819 -14.488 1.00 0.00 C ATOM 147 CG LEU A 12 -2.154 -11.399 -14.570 1.00 0.00 C ATOM 148 CD1 LEU A 12 -0.930 -11.255 -13.680 1.00 0.00 C ATOM 149 CD2 LEU A 12 -1.814 -11.043 -16.010 1.00 0.00 C ATOM 0 H LEU A 12 -4.861 -11.864 -16.515 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.492 -14.012 -14.678 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.586 -13.180 -13.467 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -2.114 -13.462 -15.131 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.918 -10.707 -14.216 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.546 -10.238 -13.752 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.204 -11.467 -12.647 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.161 -11.957 -14.003 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.417 -10.029 -16.050 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.068 -11.740 -16.391 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.714 -11.105 -16.622 1.00 0.00 H new ATOM 161 N SER A 13 -5.441 -12.512 -12.858 1.00 0.00 N ATOM 162 CA SER A 13 -6.275 -11.717 -11.964 1.00 0.00 C ATOM 163 C SER A 13 -5.534 -11.401 -10.668 1.00 0.00 C ATOM 164 O SER A 13 -5.457 -12.233 -9.764 1.00 0.00 O ATOM 165 CB SER A 13 -7.577 -12.458 -11.653 1.00 0.00 C ATOM 166 OG SER A 13 -8.396 -11.704 -10.776 1.00 0.00 O ATOM 0 H SER A 13 -5.192 -13.432 -12.496 1.00 0.00 H new ATOM 0 HA SER A 13 -6.511 -10.778 -12.466 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.116 -12.656 -12.579 1.00 0.00 H new ATOM 0 HB3 SER A 13 -7.350 -13.425 -11.203 1.00 0.00 H new ATOM 0 HG SER A 13 -9.222 -12.198 -10.594 1.00 0.00 H new ATOM 172 N THR A 14 -4.990 -10.191 -10.585 1.00 0.00 N ATOM 173 CA THR A 14 -4.254 -9.763 -9.402 1.00 0.00 C ATOM 174 C THR A 14 -3.378 -10.888 -8.863 1.00 0.00 C ATOM 175 O THR A 14 -3.381 -11.170 -7.665 1.00 0.00 O ATOM 176 CB THR A 14 -5.207 -9.292 -8.288 1.00 0.00 C ATOM 177 OG1 THR A 14 -6.363 -8.672 -8.862 1.00 0.00 O ATOM 178 CG2 THR A 14 -4.509 -8.311 -7.357 1.00 0.00 C ATOM 0 H THR A 14 -5.045 -9.490 -11.324 1.00 0.00 H new ATOM 0 HA THR A 14 -3.623 -8.929 -9.707 1.00 0.00 H new ATOM 0 HB THR A 14 -5.512 -10.164 -7.709 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.965 -8.377 -8.147 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.202 -7.992 -6.578 1.00 0.00 H new ATOM 0 HG22 THR A 14 -3.646 -8.795 -6.899 1.00 0.00 H new ATOM 0 HG23 THR A 14 -4.178 -7.442 -7.926 1.00 0.00 H new ATOM 186 N SER A 15 -2.628 -11.528 -9.755 1.00 0.00 N ATOM 187 CA SER A 15 -1.749 -12.625 -9.369 1.00 0.00 C ATOM 188 C SER A 15 -0.312 -12.139 -9.209 1.00 0.00 C ATOM 189 O SER A 15 0.496 -12.239 -10.132 1.00 0.00 O ATOM 190 CB SER A 15 -1.808 -13.744 -10.410 1.00 0.00 C ATOM 191 OG SER A 15 -3.093 -14.340 -10.447 1.00 0.00 O ATOM 0 H SER A 15 -2.612 -11.305 -10.750 1.00 0.00 H new ATOM 0 HA SER A 15 -2.092 -13.013 -8.410 1.00 0.00 H new ATOM 0 HB2 SER A 15 -1.561 -13.343 -11.393 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.059 -14.501 -10.177 1.00 0.00 H new ATOM 0 HG SER A 15 -3.768 -13.679 -10.186 1.00 0.00 H new ATOM 197 N GLY A 16 0.000 -11.611 -8.029 1.00 0.00 N ATOM 198 CA GLY A 16 1.339 -11.116 -7.768 1.00 0.00 C ATOM 199 C GLY A 16 1.403 -10.241 -6.532 1.00 0.00 C ATOM 200 O GLY A 16 0.741 -10.519 -5.533 1.00 0.00 O ATOM 0 H GLY A 16 -0.651 -11.517 -7.249 1.00 0.00 H new ATOM 0 HA2 GLY A 16 2.018 -11.960 -7.647 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.687 -10.547 -8.630 1.00 0.00 H new ATOM 204 N GLU A 17 2.205 -9.183 -6.599 1.00 0.00 N ATOM 205 CA GLU A 17 2.354 -8.266 -5.475 1.00 0.00 C ATOM 206 C GLU A 17 1.207 -7.261 -5.436 1.00 0.00 C ATOM 207 O GLU A 17 1.086 -6.407 -6.313 1.00 0.00 O ATOM 208 CB GLU A 17 3.691 -7.528 -5.565 1.00 0.00 C ATOM 209 CG GLU A 17 4.831 -8.244 -4.860 1.00 0.00 C ATOM 210 CD GLU A 17 5.553 -9.224 -5.764 1.00 0.00 C ATOM 211 OE1 GLU A 17 5.483 -9.054 -6.999 1.00 0.00 O ATOM 212 OE2 GLU A 17 6.187 -10.161 -5.236 1.00 0.00 O ATOM 0 H GLU A 17 2.761 -8.940 -7.419 1.00 0.00 H new ATOM 0 HA GLU A 17 2.331 -8.852 -4.556 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.952 -7.393 -6.615 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.577 -6.533 -5.135 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.543 -7.507 -4.488 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.440 -8.776 -3.993 1.00 0.00 H new ATOM 219 N SER A 18 0.367 -7.371 -4.412 1.00 0.00 N ATOM 220 CA SER A 18 -0.774 -6.475 -4.259 1.00 0.00 C ATOM 221 C SER A 18 -0.372 -5.206 -3.514 1.00 0.00 C ATOM 222 O SER A 18 -0.297 -4.125 -4.100 1.00 0.00 O ATOM 223 CB SER A 18 -1.908 -7.181 -3.513 1.00 0.00 C ATOM 224 OG SER A 18 -2.737 -7.901 -4.409 1.00 0.00 O ATOM 0 H SER A 18 0.455 -8.072 -3.676 1.00 0.00 H new ATOM 0 HA SER A 18 -1.122 -6.197 -5.254 1.00 0.00 H new ATOM 0 HB2 SER A 18 -1.491 -7.862 -2.771 1.00 0.00 H new ATOM 0 HB3 SER A 18 -2.504 -6.446 -2.972 1.00 0.00 H new ATOM 0 HG SER A 18 -3.453 -8.345 -3.908 1.00 0.00 H new ATOM 230 N LEU A 19 -0.114 -5.345 -2.218 1.00 0.00 N ATOM 231 CA LEU A 19 0.280 -4.210 -1.391 1.00 0.00 C ATOM 232 C LEU A 19 1.793 -4.019 -1.414 1.00 0.00 C ATOM 233 O LEU A 19 2.299 -2.946 -1.084 1.00 0.00 O ATOM 234 CB LEU A 19 -0.198 -4.412 0.048 1.00 0.00 C ATOM 235 CG LEU A 19 -1.691 -4.198 0.296 1.00 0.00 C ATOM 236 CD1 LEU A 19 -2.118 -4.864 1.595 1.00 0.00 C ATOM 237 CD2 LEU A 19 -2.019 -2.712 0.324 1.00 0.00 C ATOM 0 H LEU A 19 -0.171 -6.232 -1.718 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.187 -3.314 -1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 19 0.059 -5.425 0.356 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.358 -3.732 0.693 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.245 -4.657 -0.523 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.184 -4.701 1.754 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.919 -5.934 1.538 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.557 -4.435 2.425 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.086 -2.578 0.502 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.455 -2.230 1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.751 -2.262 -0.632 1.00 0.00 H new ATOM 249 N TYR A 20 2.510 -5.065 -1.809 1.00 0.00 N ATOM 250 CA TYR A 20 3.966 -5.013 -1.875 1.00 0.00 C ATOM 251 C TYR A 20 4.427 -4.161 -3.054 1.00 0.00 C ATOM 252 O TYR A 20 5.371 -3.379 -2.938 1.00 0.00 O ATOM 253 CB TYR A 20 4.543 -6.425 -1.995 1.00 0.00 C ATOM 254 CG TYR A 20 3.941 -7.410 -1.019 1.00 0.00 C ATOM 255 CD1 TYR A 20 4.329 -7.422 0.315 1.00 0.00 C ATOM 256 CD2 TYR A 20 2.983 -8.329 -1.431 1.00 0.00 C ATOM 257 CE1 TYR A 20 3.782 -8.321 1.210 1.00 0.00 C ATOM 258 CE2 TYR A 20 2.430 -9.230 -0.543 1.00 0.00 C ATOM 259 CZ TYR A 20 2.833 -9.223 0.776 1.00 0.00 C ATOM 260 OH TYR A 20 2.285 -10.119 1.665 1.00 0.00 O ATOM 0 H TYR A 20 2.107 -5.959 -2.088 1.00 0.00 H new ATOM 0 HA TYR A 20 4.330 -4.556 -0.955 1.00 0.00 H new ATOM 0 HB2 TYR A 20 4.383 -6.789 -3.010 1.00 0.00 H new ATOM 0 HB3 TYR A 20 5.621 -6.383 -1.837 1.00 0.00 H new ATOM 0 HD1 TYR A 20 5.071 -6.716 0.658 1.00 0.00 H new ATOM 0 HD2 TYR A 20 2.666 -8.338 -2.463 1.00 0.00 H new ATOM 0 HE1 TYR A 20 4.096 -8.318 2.243 1.00 0.00 H new ATOM 0 HE2 TYR A 20 1.686 -9.937 -0.879 1.00 0.00 H new ATOM 0 HH TYR A 20 1.632 -10.683 1.200 1.00 0.00 H new ATOM 270 N HIS A 21 3.753 -4.318 -4.189 1.00 0.00 N ATOM 271 CA HIS A 21 4.092 -3.563 -5.390 1.00 0.00 C ATOM 272 C HIS A 21 3.823 -2.075 -5.190 1.00 0.00 C ATOM 273 O HIS A 21 4.352 -1.234 -5.917 1.00 0.00 O ATOM 274 CB HIS A 21 3.293 -4.081 -6.586 1.00 0.00 C ATOM 275 CG HIS A 21 3.999 -3.912 -7.896 1.00 0.00 C ATOM 276 ND1 HIS A 21 3.600 -3.004 -8.854 1.00 0.00 N ATOM 277 CD2 HIS A 21 5.085 -4.541 -8.404 1.00 0.00 C ATOM 278 CE1 HIS A 21 4.409 -3.083 -9.896 1.00 0.00 C ATOM 279 NE2 HIS A 21 5.319 -4.008 -9.648 1.00 0.00 N ATOM 0 H HIS A 21 2.969 -4.961 -4.302 1.00 0.00 H new ATOM 0 HA HIS A 21 5.155 -3.699 -5.587 1.00 0.00 H new ATOM 0 HB2 HIS A 21 3.073 -5.138 -6.435 1.00 0.00 H new ATOM 0 HB3 HIS A 21 2.337 -3.559 -6.628 1.00 0.00 H new ATOM 0 HD2 HIS A 21 5.660 -5.317 -7.921 1.00 0.00 H new ATOM 0 HE1 HIS A 21 4.338 -2.492 -10.797 1.00 0.00 H new ATOM 0 HE2 HIS A 21 6.073 -4.282 -10.278 1.00 0.00 H new ATOM 287 N VAL A 22 2.996 -1.756 -4.199 1.00 0.00 N ATOM 288 CA VAL A 22 2.657 -0.369 -3.903 1.00 0.00 C ATOM 289 C VAL A 22 3.868 0.393 -3.376 1.00 0.00 C ATOM 290 O VAL A 22 4.036 1.581 -3.652 1.00 0.00 O ATOM 291 CB VAL A 22 1.518 -0.278 -2.870 1.00 0.00 C ATOM 292 CG1 VAL A 22 1.456 1.116 -2.264 1.00 0.00 C ATOM 293 CG2 VAL A 22 0.188 -0.650 -3.509 1.00 0.00 C ATOM 0 H VAL A 22 2.549 -2.439 -3.588 1.00 0.00 H new ATOM 0 HA VAL A 22 2.327 0.082 -4.839 1.00 0.00 H new ATOM 0 HB VAL A 22 1.721 -0.988 -2.068 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.645 1.161 -1.537 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.401 1.340 -1.769 1.00 0.00 H new ATOM 0 HG13 VAL A 22 1.277 1.848 -3.052 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -0.605 -0.580 -2.765 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -0.024 0.033 -4.331 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.240 -1.670 -3.889 1.00 0.00 H new ATOM 303 N LEU A 23 4.710 -0.299 -2.617 1.00 0.00 N ATOM 304 CA LEU A 23 5.908 0.312 -2.051 1.00 0.00 C ATOM 305 C LEU A 23 7.135 -0.007 -2.900 1.00 0.00 C ATOM 306 O LEU A 23 8.019 0.831 -3.069 1.00 0.00 O ATOM 307 CB LEU A 23 6.125 -0.176 -0.617 1.00 0.00 C ATOM 308 CG LEU A 23 4.868 -0.308 0.244 1.00 0.00 C ATOM 309 CD1 LEU A 23 5.110 -1.271 1.397 1.00 0.00 C ATOM 310 CD2 LEU A 23 4.434 1.054 0.766 1.00 0.00 C ATOM 0 H LEU A 23 4.586 -1.283 -2.379 1.00 0.00 H new ATOM 0 HA LEU A 23 5.765 1.393 -2.043 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.618 -1.147 -0.656 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.811 0.511 -0.121 1.00 0.00 H new ATOM 0 HG LEU A 23 4.066 -0.710 -0.376 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.205 -1.353 1.999 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.373 -2.252 1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.926 -0.899 2.017 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.538 0.941 1.377 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.233 1.484 1.370 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.219 1.714 -0.074 1.00 0.00 H new ATOM 322 N GLY A 24 7.179 -1.224 -3.433 1.00 0.00 N ATOM 323 CA GLY A 24 8.301 -1.631 -4.259 1.00 0.00 C ATOM 324 C GLY A 24 9.047 -2.817 -3.681 1.00 0.00 C ATOM 325 O GLY A 24 10.278 -2.859 -3.708 1.00 0.00 O ATOM 0 H GLY A 24 6.458 -1.935 -3.308 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.941 -1.883 -5.256 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.989 -0.793 -4.371 1.00 0.00 H new ATOM 329 N LEU A 25 8.302 -3.783 -3.155 1.00 0.00 N ATOM 330 CA LEU A 25 8.901 -4.975 -2.565 1.00 0.00 C ATOM 331 C LEU A 25 8.207 -6.238 -3.067 1.00 0.00 C ATOM 332 O LEU A 25 7.214 -6.166 -3.791 1.00 0.00 O ATOM 333 CB LEU A 25 8.822 -4.909 -1.039 1.00 0.00 C ATOM 334 CG LEU A 25 9.648 -3.809 -0.372 1.00 0.00 C ATOM 335 CD1 LEU A 25 9.293 -3.694 1.103 1.00 0.00 C ATOM 336 CD2 LEU A 25 11.136 -4.080 -0.544 1.00 0.00 C ATOM 0 H LEU A 25 7.283 -3.764 -3.125 1.00 0.00 H new ATOM 0 HA LEU A 25 9.948 -5.012 -2.867 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.778 -4.775 -0.755 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.141 -5.870 -0.637 1.00 0.00 H new ATOM 0 HG LEU A 25 9.413 -2.861 -0.856 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.891 -2.906 1.561 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.235 -3.452 1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.498 -4.641 1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 25 11.708 -3.287 -0.063 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.387 -5.037 -0.087 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.380 -4.110 -1.606 1.00 0.00 H new ATOM 348 N ASP A 26 8.736 -7.392 -2.676 1.00 0.00 N ATOM 349 CA ASP A 26 8.166 -8.671 -3.083 1.00 0.00 C ATOM 350 C ASP A 26 7.301 -9.259 -1.972 1.00 0.00 C ATOM 351 O ASP A 26 7.105 -8.637 -0.928 1.00 0.00 O ATOM 352 CB ASP A 26 9.277 -9.654 -3.455 1.00 0.00 C ATOM 353 CG ASP A 26 9.974 -9.278 -4.748 1.00 0.00 C ATOM 354 OD1 ASP A 26 9.270 -8.987 -5.738 1.00 0.00 O ATOM 355 OD2 ASP A 26 11.222 -9.274 -4.770 1.00 0.00 O ATOM 0 H ASP A 26 9.559 -7.468 -2.078 1.00 0.00 H new ATOM 0 HA ASP A 26 7.537 -8.498 -3.956 1.00 0.00 H new ATOM 0 HB2 ASP A 26 10.009 -9.692 -2.649 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.856 -10.655 -3.550 1.00 0.00 H new ATOM 360 N LYS A 27 6.784 -10.460 -2.205 1.00 0.00 N ATOM 361 CA LYS A 27 5.939 -11.133 -1.226 1.00 0.00 C ATOM 362 C LYS A 27 6.769 -11.644 -0.052 1.00 0.00 C ATOM 363 O LYS A 27 6.290 -11.700 1.080 1.00 0.00 O ATOM 364 CB LYS A 27 5.192 -12.297 -1.880 1.00 0.00 C ATOM 365 CG LYS A 27 4.089 -11.856 -2.827 1.00 0.00 C ATOM 366 CD LYS A 27 3.132 -12.995 -3.138 1.00 0.00 C ATOM 367 CE LYS A 27 2.010 -12.545 -4.060 1.00 0.00 C ATOM 368 NZ LYS A 27 0.866 -11.967 -3.301 1.00 0.00 N ATOM 0 H LYS A 27 6.936 -10.988 -3.064 1.00 0.00 H new ATOM 0 HA LYS A 27 5.215 -10.410 -0.850 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.905 -12.913 -2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.761 -12.925 -1.100 1.00 0.00 H new ATOM 0 HG2 LYS A 27 3.537 -11.027 -2.384 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.529 -11.487 -3.753 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.680 -13.815 -3.603 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.709 -13.380 -2.210 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.392 -11.803 -4.762 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.663 -13.393 -4.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.369 -11.274 -3.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.208 -12.727 -3.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.220 -11.497 -2.444 1.00 0.00 H new ATOM 382 N ASN A 28 8.015 -12.014 -0.330 1.00 0.00 N ATOM 383 CA ASN A 28 8.911 -12.519 0.704 1.00 0.00 C ATOM 384 C ASN A 28 9.633 -11.372 1.405 1.00 0.00 C ATOM 385 O ASN A 28 10.648 -11.579 2.069 1.00 0.00 O ATOM 386 CB ASN A 28 9.931 -13.484 0.097 1.00 0.00 C ATOM 387 CG ASN A 28 10.816 -12.814 -0.937 1.00 0.00 C ATOM 388 OD1 ASN A 28 10.323 -12.722 -2.166 1.00 0.00 O flip ATOM 389 ND2 ASN A 28 11.930 -12.386 -0.633 1.00 0.00 N flip ATOM 0 H ASN A 28 8.427 -11.974 -1.262 1.00 0.00 H new ATOM 0 HA ASN A 28 8.311 -13.052 1.442 1.00 0.00 H new ATOM 0 HB2 ASN A 28 10.553 -13.897 0.891 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.406 -14.320 -0.365 1.00 0.00 H new ATOM 0 HD21 ASN A 28 12.268 -12.479 0.325 1.00 0.00 H new ATOM 0 HD22 ASN A 28 12.515 -11.939 -1.339 1.00 0.00 H new ATOM 396 N ALA A 29 9.102 -10.164 1.252 1.00 0.00 N ATOM 397 CA ALA A 29 9.694 -8.985 1.872 1.00 0.00 C ATOM 398 C ALA A 29 9.523 -9.017 3.387 1.00 0.00 C ATOM 399 O ALA A 29 8.456 -9.365 3.895 1.00 0.00 O ATOM 400 CB ALA A 29 9.077 -7.719 1.296 1.00 0.00 C ATOM 0 H ALA A 29 8.263 -9.976 0.704 1.00 0.00 H new ATOM 0 HA ALA A 29 10.762 -8.988 1.653 1.00 0.00 H new ATOM 0 HB1 ALA A 29 9.529 -6.847 1.768 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.256 -7.683 0.221 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.004 -7.719 1.485 1.00 0.00 H new ATOM 406 N THR A 30 10.581 -8.653 4.106 1.00 0.00 N ATOM 407 CA THR A 30 10.548 -8.642 5.563 1.00 0.00 C ATOM 408 C THR A 30 9.964 -7.337 6.090 1.00 0.00 C ATOM 409 O THR A 30 10.109 -6.285 5.468 1.00 0.00 O ATOM 410 CB THR A 30 11.955 -8.839 6.158 1.00 0.00 C ATOM 411 OG1 THR A 30 12.859 -7.875 5.606 1.00 0.00 O ATOM 412 CG2 THR A 30 12.470 -10.243 5.878 1.00 0.00 C ATOM 0 H THR A 30 11.471 -8.362 3.702 1.00 0.00 H new ATOM 0 HA THR A 30 9.912 -9.472 5.871 1.00 0.00 H new ATOM 0 HB THR A 30 11.892 -8.701 7.237 1.00 0.00 H new ATOM 0 HG1 THR A 30 13.751 -8.006 5.990 1.00 0.00 H new ATOM 0 HG21 THR A 30 13.465 -10.358 6.308 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.795 -10.974 6.324 1.00 0.00 H new ATOM 0 HG23 THR A 30 12.519 -10.405 4.801 1.00 0.00 H new ATOM 420 N SER A 31 9.303 -7.412 7.241 1.00 0.00 N ATOM 421 CA SER A 31 8.693 -6.236 7.850 1.00 0.00 C ATOM 422 C SER A 31 9.693 -5.086 7.931 1.00 0.00 C ATOM 423 O SER A 31 9.341 -3.927 7.712 1.00 0.00 O ATOM 424 CB SER A 31 8.172 -6.572 9.248 1.00 0.00 C ATOM 425 OG SER A 31 7.037 -7.417 9.180 1.00 0.00 O ATOM 0 H SER A 31 9.176 -8.275 7.770 1.00 0.00 H new ATOM 0 HA SER A 31 7.857 -5.925 7.223 1.00 0.00 H new ATOM 0 HB2 SER A 31 8.958 -7.059 9.825 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.914 -5.653 9.774 1.00 0.00 H new ATOM 0 HG SER A 31 6.724 -7.618 10.087 1.00 0.00 H new ATOM 431 N ASP A 32 10.940 -5.416 8.246 1.00 0.00 N ATOM 432 CA ASP A 32 11.993 -4.413 8.354 1.00 0.00 C ATOM 433 C ASP A 32 12.240 -3.736 7.010 1.00 0.00 C ATOM 434 O ASP A 32 12.542 -2.544 6.949 1.00 0.00 O ATOM 435 CB ASP A 32 13.286 -5.052 8.863 1.00 0.00 C ATOM 436 CG ASP A 32 13.310 -5.188 10.373 1.00 0.00 C ATOM 437 OD1 ASP A 32 13.395 -4.149 11.060 1.00 0.00 O ATOM 438 OD2 ASP A 32 13.245 -6.333 10.867 1.00 0.00 O ATOM 0 H ASP A 32 11.247 -6.371 8.431 1.00 0.00 H new ATOM 0 HA ASP A 32 11.666 -3.656 9.067 1.00 0.00 H new ATOM 0 HB2 ASP A 32 13.404 -6.037 8.411 1.00 0.00 H new ATOM 0 HB3 ASP A 32 14.136 -4.450 8.542 1.00 0.00 H new ATOM 443 N ASP A 33 12.110 -4.505 5.934 1.00 0.00 N ATOM 444 CA ASP A 33 12.319 -3.980 4.589 1.00 0.00 C ATOM 445 C ASP A 33 11.128 -3.136 4.144 1.00 0.00 C ATOM 446 O ASP A 33 11.256 -2.277 3.272 1.00 0.00 O ATOM 447 CB ASP A 33 12.546 -5.125 3.601 1.00 0.00 C ATOM 448 CG ASP A 33 14.002 -5.541 3.522 1.00 0.00 C ATOM 449 OD1 ASP A 33 14.878 -4.669 3.701 1.00 0.00 O ATOM 450 OD2 ASP A 33 14.264 -6.737 3.281 1.00 0.00 O ATOM 0 H ASP A 33 11.861 -5.494 5.967 1.00 0.00 H new ATOM 0 HA ASP A 33 13.205 -3.345 4.607 1.00 0.00 H new ATOM 0 HB2 ASP A 33 11.942 -5.982 3.898 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.204 -4.821 2.612 1.00 0.00 H new ATOM 455 N ILE A 34 9.972 -3.388 4.749 1.00 0.00 N ATOM 456 CA ILE A 34 8.759 -2.651 4.415 1.00 0.00 C ATOM 457 C ILE A 34 8.742 -1.285 5.091 1.00 0.00 C ATOM 458 O ILE A 34 8.092 -0.353 4.616 1.00 0.00 O ATOM 459 CB ILE A 34 7.496 -3.431 4.826 1.00 0.00 C ATOM 460 CG1 ILE A 34 7.360 -4.704 3.987 1.00 0.00 C ATOM 461 CG2 ILE A 34 6.261 -2.556 4.674 1.00 0.00 C ATOM 462 CD1 ILE A 34 6.453 -5.742 4.609 1.00 0.00 C ATOM 0 H ILE A 34 9.850 -4.096 5.473 1.00 0.00 H new ATOM 0 HA ILE A 34 8.758 -2.518 3.333 1.00 0.00 H new ATOM 0 HB ILE A 34 7.588 -3.717 5.874 1.00 0.00 H new ATOM 0 HG12 ILE A 34 6.976 -4.441 3.002 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.348 -5.139 3.838 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.376 -3.121 4.968 1.00 0.00 H new ATOM 0 HG22 ILE A 34 6.358 -1.676 5.310 1.00 0.00 H new ATOM 0 HG23 ILE A 34 6.163 -2.243 3.635 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.403 -6.617 3.961 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.848 -6.034 5.582 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.454 -5.325 4.733 1.00 0.00 H new ATOM 474 N LYS A 35 9.463 -1.171 6.201 1.00 0.00 N ATOM 475 CA LYS A 35 9.534 0.083 6.943 1.00 0.00 C ATOM 476 C LYS A 35 10.521 1.045 6.290 1.00 0.00 C ATOM 477 O LYS A 35 10.193 2.201 6.024 1.00 0.00 O ATOM 478 CB LYS A 35 9.946 -0.181 8.393 1.00 0.00 C ATOM 479 CG LYS A 35 8.774 -0.473 9.314 1.00 0.00 C ATOM 480 CD LYS A 35 9.233 -1.102 10.619 1.00 0.00 C ATOM 481 CE LYS A 35 8.067 -1.704 11.388 1.00 0.00 C ATOM 482 NZ LYS A 35 8.500 -2.275 12.693 1.00 0.00 N ATOM 0 H LYS A 35 10.007 -1.932 6.607 1.00 0.00 H new ATOM 0 HA LYS A 35 8.545 0.541 6.931 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.636 -1.024 8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.488 0.686 8.772 1.00 0.00 H new ATOM 0 HG2 LYS A 35 8.236 0.452 9.524 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.074 -1.142 8.813 1.00 0.00 H new ATOM 0 HD2 LYS A 35 9.971 -1.876 10.411 1.00 0.00 H new ATOM 0 HD3 LYS A 35 9.726 -0.349 11.234 1.00 0.00 H new ATOM 0 HE2 LYS A 35 7.311 -0.938 11.560 1.00 0.00 H new ATOM 0 HE3 LYS A 35 7.600 -2.484 10.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.677 -2.675 13.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 9.203 -3.024 12.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 8.923 -1.525 13.277 1.00 0.00 H new ATOM 496 N LYS A 36 11.732 0.560 6.034 1.00 0.00 N ATOM 497 CA LYS A 36 12.767 1.376 5.410 1.00 0.00 C ATOM 498 C LYS A 36 12.269 1.978 4.099 1.00 0.00 C ATOM 499 O LYS A 36 12.437 3.171 3.850 1.00 0.00 O ATOM 500 CB LYS A 36 14.021 0.537 5.154 1.00 0.00 C ATOM 501 CG LYS A 36 13.797 -0.612 4.186 1.00 0.00 C ATOM 502 CD LYS A 36 15.055 -1.445 4.009 1.00 0.00 C ATOM 503 CE LYS A 36 16.028 -0.787 3.043 1.00 0.00 C ATOM 504 NZ LYS A 36 16.975 -1.772 2.451 1.00 0.00 N ATOM 0 H LYS A 36 12.020 -0.394 6.249 1.00 0.00 H new ATOM 0 HA LYS A 36 13.014 2.189 6.092 1.00 0.00 H new ATOM 0 HB2 LYS A 36 14.807 1.183 4.762 1.00 0.00 H new ATOM 0 HB3 LYS A 36 14.380 0.137 6.102 1.00 0.00 H new ATOM 0 HG2 LYS A 36 12.989 -1.245 4.552 1.00 0.00 H new ATOM 0 HG3 LYS A 36 13.481 -0.219 3.220 1.00 0.00 H new ATOM 0 HD2 LYS A 36 15.539 -1.585 4.976 1.00 0.00 H new ATOM 0 HD3 LYS A 36 14.788 -2.435 3.640 1.00 0.00 H new ATOM 0 HE2 LYS A 36 15.471 -0.295 2.246 1.00 0.00 H new ATOM 0 HE3 LYS A 36 16.589 -0.012 3.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 17.621 -1.284 1.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 17.525 -2.224 3.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 16.441 -2.498 1.931 1.00 0.00 H new ATOM 518 N SER A 37 11.654 1.144 3.266 1.00 0.00 N ATOM 519 CA SER A 37 11.134 1.594 1.980 1.00 0.00 C ATOM 520 C SER A 37 10.045 2.645 2.173 1.00 0.00 C ATOM 521 O SER A 37 9.995 3.643 1.452 1.00 0.00 O ATOM 522 CB SER A 37 10.579 0.409 1.188 1.00 0.00 C ATOM 523 OG SER A 37 9.270 0.077 1.615 1.00 0.00 O ATOM 0 H SER A 37 11.504 0.154 3.459 1.00 0.00 H new ATOM 0 HA SER A 37 11.955 2.044 1.421 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.567 0.652 0.125 1.00 0.00 H new ATOM 0 HB3 SER A 37 11.234 -0.453 1.311 1.00 0.00 H new ATOM 0 HG SER A 37 8.938 -0.682 1.092 1.00 0.00 H new ATOM 529 N TYR A 38 9.175 2.415 3.150 1.00 0.00 N ATOM 530 CA TYR A 38 8.085 3.340 3.436 1.00 0.00 C ATOM 531 C TYR A 38 8.617 4.748 3.685 1.00 0.00 C ATOM 532 O TYR A 38 7.984 5.737 3.313 1.00 0.00 O ATOM 533 CB TYR A 38 7.289 2.862 4.652 1.00 0.00 C ATOM 534 CG TYR A 38 6.476 3.953 5.311 1.00 0.00 C ATOM 535 CD1 TYR A 38 5.393 4.530 4.659 1.00 0.00 C ATOM 536 CD2 TYR A 38 6.792 4.409 6.585 1.00 0.00 C ATOM 537 CE1 TYR A 38 4.648 5.528 5.257 1.00 0.00 C ATOM 538 CE2 TYR A 38 6.052 5.405 7.191 1.00 0.00 C ATOM 539 CZ TYR A 38 4.981 5.961 6.523 1.00 0.00 C ATOM 540 OH TYR A 38 4.242 6.955 7.123 1.00 0.00 O ATOM 0 H TYR A 38 9.203 1.596 3.757 1.00 0.00 H new ATOM 0 HA TYR A 38 7.428 3.367 2.567 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.621 2.058 4.345 1.00 0.00 H new ATOM 0 HB3 TYR A 38 7.978 2.441 5.384 1.00 0.00 H new ATOM 0 HD1 TYR A 38 5.129 4.192 3.668 1.00 0.00 H new ATOM 0 HD2 TYR A 38 7.631 3.977 7.110 1.00 0.00 H new ATOM 0 HE1 TYR A 38 3.810 5.966 4.736 1.00 0.00 H new ATOM 0 HE2 TYR A 38 6.310 5.747 8.182 1.00 0.00 H new ATOM 0 HH TYR A 38 4.607 7.142 8.013 1.00 0.00 H new ATOM 550 N ARG A 39 9.784 4.830 4.315 1.00 0.00 N ATOM 551 CA ARG A 39 10.402 6.116 4.614 1.00 0.00 C ATOM 552 C ARG A 39 10.716 6.880 3.330 1.00 0.00 C ATOM 553 O ARG A 39 10.087 7.895 3.029 1.00 0.00 O ATOM 554 CB ARG A 39 11.683 5.914 5.426 1.00 0.00 C ATOM 555 CG ARG A 39 11.469 5.146 6.719 1.00 0.00 C ATOM 556 CD ARG A 39 12.750 5.060 7.534 1.00 0.00 C ATOM 557 NE ARG A 39 12.521 4.474 8.853 1.00 0.00 N ATOM 558 CZ ARG A 39 13.354 4.623 9.877 1.00 0.00 C ATOM 559 NH1 ARG A 39 14.463 5.335 9.736 1.00 0.00 N ATOM 560 NH2 ARG A 39 13.077 4.059 11.046 1.00 0.00 N ATOM 0 H ARG A 39 10.321 4.021 4.628 1.00 0.00 H new ATOM 0 HA ARG A 39 9.696 6.702 5.202 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.411 5.382 4.814 1.00 0.00 H new ATOM 0 HB3 ARG A 39 12.113 6.888 5.659 1.00 0.00 H new ATOM 0 HG2 ARG A 39 10.693 5.634 7.309 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.113 4.141 6.492 1.00 0.00 H new ATOM 0 HD2 ARG A 39 13.484 4.462 6.994 1.00 0.00 H new ATOM 0 HD3 ARG A 39 13.174 6.057 7.649 1.00 0.00 H new ATOM 0 HE ARG A 39 11.676 3.921 8.995 1.00 0.00 H new ATOM 0 HH11 ARG A 39 14.679 5.770 8.839 1.00 0.00 H new ATOM 0 HH12 ARG A 39 15.101 5.447 10.524 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.224 3.511 11.158 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.717 4.174 11.832 1.00 0.00 H new ATOM 574 N LYS A 40 11.693 6.386 2.578 1.00 0.00 N ATOM 575 CA LYS A 40 12.091 7.020 1.327 1.00 0.00 C ATOM 576 C LYS A 40 10.870 7.482 0.538 1.00 0.00 C ATOM 577 O LYS A 40 10.830 8.608 0.039 1.00 0.00 O ATOM 578 CB LYS A 40 12.920 6.051 0.481 1.00 0.00 C ATOM 579 CG LYS A 40 12.258 4.699 0.281 1.00 0.00 C ATOM 580 CD LYS A 40 13.103 3.788 -0.594 1.00 0.00 C ATOM 581 CE LYS A 40 12.250 2.746 -1.302 1.00 0.00 C ATOM 582 NZ LYS A 40 13.007 2.046 -2.376 1.00 0.00 N ATOM 0 H LYS A 40 12.224 5.548 2.813 1.00 0.00 H new ATOM 0 HA LYS A 40 12.698 7.893 1.569 1.00 0.00 H new ATOM 0 HB2 LYS A 40 13.108 6.502 -0.493 1.00 0.00 H new ATOM 0 HB3 LYS A 40 13.890 5.905 0.957 1.00 0.00 H new ATOM 0 HG2 LYS A 40 12.095 4.226 1.249 1.00 0.00 H new ATOM 0 HG3 LYS A 40 11.278 4.837 -0.176 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.638 4.385 -1.333 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.855 3.289 0.018 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.891 2.016 -0.576 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.371 3.227 -1.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.391 1.344 -2.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.328 2.739 -3.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 13.832 1.565 -1.963 1.00 0.00 H new ATOM 596 N LEU A 41 9.875 6.608 0.431 1.00 0.00 N ATOM 597 CA LEU A 41 8.651 6.927 -0.296 1.00 0.00 C ATOM 598 C LEU A 41 7.931 8.110 0.344 1.00 0.00 C ATOM 599 O LEU A 41 7.452 9.007 -0.349 1.00 0.00 O ATOM 600 CB LEU A 41 7.725 5.711 -0.333 1.00 0.00 C ATOM 601 CG LEU A 41 8.251 4.489 -1.086 1.00 0.00 C ATOM 602 CD1 LEU A 41 7.358 3.283 -0.839 1.00 0.00 C ATOM 603 CD2 LEU A 41 8.353 4.783 -2.575 1.00 0.00 C ATOM 0 H LEU A 41 9.892 5.673 0.838 1.00 0.00 H new ATOM 0 HA LEU A 41 8.923 7.199 -1.316 1.00 0.00 H new ATOM 0 HB2 LEU A 41 7.507 5.414 0.693 1.00 0.00 H new ATOM 0 HB3 LEU A 41 6.780 6.013 -0.785 1.00 0.00 H new ATOM 0 HG LEU A 41 9.249 4.259 -0.712 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.749 2.423 -1.383 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.337 3.058 0.227 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.347 3.502 -1.184 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.729 3.902 -3.095 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.368 5.040 -2.963 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.035 5.618 -2.735 1.00 0.00 H new ATOM 615 N ALA A 42 7.860 8.105 1.671 1.00 0.00 N ATOM 616 CA ALA A 42 7.202 9.179 2.405 1.00 0.00 C ATOM 617 C ALA A 42 8.027 10.461 2.359 1.00 0.00 C ATOM 618 O ALA A 42 7.487 11.563 2.461 1.00 0.00 O ATOM 619 CB ALA A 42 6.955 8.760 3.846 1.00 0.00 C ATOM 0 H ALA A 42 8.250 7.369 2.260 1.00 0.00 H new ATOM 0 HA ALA A 42 6.243 9.377 1.927 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.463 9.572 4.382 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.318 7.875 3.864 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.906 8.532 4.327 1.00 0.00 H new ATOM 625 N LEU A 43 9.338 10.310 2.206 1.00 0.00 N ATOM 626 CA LEU A 43 10.239 11.456 2.148 1.00 0.00 C ATOM 627 C LEU A 43 10.122 12.172 0.806 1.00 0.00 C ATOM 628 O LEU A 43 10.486 13.341 0.680 1.00 0.00 O ATOM 629 CB LEU A 43 11.683 11.006 2.375 1.00 0.00 C ATOM 630 CG LEU A 43 12.037 10.579 3.800 1.00 0.00 C ATOM 631 CD1 LEU A 43 13.526 10.754 4.055 1.00 0.00 C ATOM 632 CD2 LEU A 43 11.224 11.373 4.812 1.00 0.00 C ATOM 0 H LEU A 43 9.801 9.405 2.120 1.00 0.00 H new ATOM 0 HA LEU A 43 9.954 12.152 2.937 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.892 10.172 1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 43 12.346 11.821 2.086 1.00 0.00 H new ATOM 0 HG LEU A 43 11.791 9.523 3.914 1.00 0.00 H new ATOM 0 HD11 LEU A 43 13.759 10.445 5.074 1.00 0.00 H new ATOM 0 HD12 LEU A 43 14.090 10.141 3.352 1.00 0.00 H new ATOM 0 HD13 LEU A 43 13.797 11.801 3.922 1.00 0.00 H new ATOM 0 HD21 LEU A 43 11.489 11.056 5.821 1.00 0.00 H new ATOM 0 HD22 LEU A 43 11.438 12.436 4.698 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.162 11.197 4.644 1.00 0.00 H new ATOM 644 N LYS A 44 9.610 11.463 -0.195 1.00 0.00 N ATOM 645 CA LYS A 44 9.441 12.031 -1.527 1.00 0.00 C ATOM 646 C LYS A 44 7.999 12.477 -1.750 1.00 0.00 C ATOM 647 O LYS A 44 7.735 13.385 -2.537 1.00 0.00 O ATOM 648 CB LYS A 44 9.841 11.009 -2.594 1.00 0.00 C ATOM 649 CG LYS A 44 8.837 9.881 -2.761 1.00 0.00 C ATOM 650 CD LYS A 44 8.952 9.232 -4.130 1.00 0.00 C ATOM 651 CE LYS A 44 10.069 8.199 -4.165 1.00 0.00 C ATOM 652 NZ LYS A 44 11.393 8.824 -4.436 1.00 0.00 N ATOM 0 H LYS A 44 9.305 10.494 -0.108 1.00 0.00 H new ATOM 0 HA LYS A 44 10.089 12.904 -1.607 1.00 0.00 H new ATOM 0 HB2 LYS A 44 9.962 11.521 -3.549 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.811 10.585 -2.334 1.00 0.00 H new ATOM 0 HG2 LYS A 44 8.999 9.131 -1.987 1.00 0.00 H new ATOM 0 HG3 LYS A 44 7.827 10.268 -2.624 1.00 0.00 H new ATOM 0 HD2 LYS A 44 8.006 8.756 -4.389 1.00 0.00 H new ATOM 0 HD3 LYS A 44 9.140 9.998 -4.882 1.00 0.00 H new ATOM 0 HE2 LYS A 44 10.105 7.670 -3.212 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.853 7.457 -4.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 12.000 8.146 -4.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.263 9.674 -5.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 11.842 9.089 -3.536 1.00 0.00 H new ATOM 666 N TYR A 45 7.071 11.833 -1.051 1.00 0.00 N ATOM 667 CA TYR A 45 5.656 12.163 -1.173 1.00 0.00 C ATOM 668 C TYR A 45 5.176 12.959 0.036 1.00 0.00 C ATOM 669 O TYR A 45 4.002 13.320 0.130 1.00 0.00 O ATOM 670 CB TYR A 45 4.825 10.887 -1.321 1.00 0.00 C ATOM 671 CG TYR A 45 4.965 10.226 -2.673 1.00 0.00 C ATOM 672 CD1 TYR A 45 4.498 10.849 -3.825 1.00 0.00 C ATOM 673 CD2 TYR A 45 5.564 8.979 -2.800 1.00 0.00 C ATOM 674 CE1 TYR A 45 4.623 10.248 -5.062 1.00 0.00 C ATOM 675 CE2 TYR A 45 5.695 8.372 -4.034 1.00 0.00 C ATOM 676 CZ TYR A 45 5.223 9.009 -5.162 1.00 0.00 C ATOM 677 OH TYR A 45 5.351 8.408 -6.393 1.00 0.00 O ATOM 0 H TYR A 45 7.273 11.079 -0.394 1.00 0.00 H new ATOM 0 HA TYR A 45 5.527 12.778 -2.064 1.00 0.00 H new ATOM 0 HB2 TYR A 45 5.122 10.179 -0.547 1.00 0.00 H new ATOM 0 HB3 TYR A 45 3.775 11.125 -1.150 1.00 0.00 H new ATOM 0 HD1 TYR A 45 4.030 11.819 -3.751 1.00 0.00 H new ATOM 0 HD2 TYR A 45 5.934 8.476 -1.919 1.00 0.00 H new ATOM 0 HE1 TYR A 45 4.253 10.745 -5.947 1.00 0.00 H new ATOM 0 HE2 TYR A 45 6.165 7.403 -4.115 1.00 0.00 H new ATOM 0 HH TYR A 45 5.796 7.541 -6.289 1.00 0.00 H new ATOM 687 N HIS A 46 6.092 13.231 0.959 1.00 0.00 N ATOM 688 CA HIS A 46 5.764 13.987 2.163 1.00 0.00 C ATOM 689 C HIS A 46 4.761 15.094 1.853 1.00 0.00 C ATOM 690 O HIS A 46 4.832 15.757 0.819 1.00 0.00 O ATOM 691 CB HIS A 46 7.031 14.586 2.775 1.00 0.00 C ATOM 692 CG HIS A 46 6.957 14.749 4.262 1.00 0.00 C ATOM 693 ND1 HIS A 46 6.432 15.869 4.872 1.00 0.00 N ATOM 694 CD2 HIS A 46 7.345 13.925 5.264 1.00 0.00 C ATOM 695 CE1 HIS A 46 6.502 15.728 6.183 1.00 0.00 C ATOM 696 NE2 HIS A 46 7.052 14.556 6.447 1.00 0.00 N ATOM 0 H HIS A 46 7.067 12.939 0.897 1.00 0.00 H new ATOM 0 HA HIS A 46 5.312 13.303 2.881 1.00 0.00 H new ATOM 0 HB2 HIS A 46 7.880 13.948 2.529 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.220 15.558 2.320 1.00 0.00 H new ATOM 0 HD2 HIS A 46 7.800 12.952 5.153 1.00 0.00 H new ATOM 0 HE1 HIS A 46 6.167 16.448 6.915 1.00 0.00 H new ATOM 0 HE2 HIS A 46 7.230 14.181 7.379 1.00 0.00 H new ATOM 704 N PRO A 47 3.803 15.299 2.770 1.00 0.00 N ATOM 705 CA PRO A 47 2.768 16.325 2.616 1.00 0.00 C ATOM 706 C PRO A 47 3.328 17.737 2.742 1.00 0.00 C ATOM 707 O PRO A 47 2.771 18.688 2.192 1.00 0.00 O ATOM 708 CB PRO A 47 1.801 16.028 3.765 1.00 0.00 C ATOM 709 CG PRO A 47 2.632 15.336 4.790 1.00 0.00 C ATOM 710 CD PRO A 47 3.658 14.545 4.026 1.00 0.00 C ATOM 0 HA PRO A 47 2.304 16.291 1.630 1.00 0.00 H new ATOM 0 HB2 PRO A 47 1.365 16.944 4.162 1.00 0.00 H new ATOM 0 HB3 PRO A 47 0.975 15.399 3.434 1.00 0.00 H new ATOM 0 HG2 PRO A 47 3.110 16.055 5.455 1.00 0.00 H new ATOM 0 HG3 PRO A 47 2.020 14.683 5.413 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.602 14.481 4.568 1.00 0.00 H new ATOM 0 HD3 PRO A 47 3.325 13.523 3.845 1.00 0.00 H new ATOM 718 N ASP A 48 4.432 17.868 3.470 1.00 0.00 N ATOM 719 CA ASP A 48 5.068 19.165 3.667 1.00 0.00 C ATOM 720 C ASP A 48 6.058 19.461 2.544 1.00 0.00 C ATOM 721 O ASP A 48 6.252 20.615 2.161 1.00 0.00 O ATOM 722 CB ASP A 48 5.783 19.206 5.018 1.00 0.00 C ATOM 723 CG ASP A 48 6.093 20.621 5.467 1.00 0.00 C ATOM 724 OD1 ASP A 48 5.194 21.483 5.374 1.00 0.00 O ATOM 725 OD2 ASP A 48 7.234 20.866 5.911 1.00 0.00 O ATOM 0 H ASP A 48 4.905 17.092 3.933 1.00 0.00 H new ATOM 0 HA ASP A 48 4.291 19.929 3.653 1.00 0.00 H new ATOM 0 HB2 ASP A 48 5.162 18.717 5.769 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.711 18.637 4.952 1.00 0.00 H new ATOM 730 N LYS A 49 6.683 18.412 2.022 1.00 0.00 N ATOM 731 CA LYS A 49 7.653 18.557 0.943 1.00 0.00 C ATOM 732 C LYS A 49 6.957 18.884 -0.374 1.00 0.00 C ATOM 733 O LYS A 49 7.474 19.650 -1.187 1.00 0.00 O ATOM 734 CB LYS A 49 8.476 17.276 0.793 1.00 0.00 C ATOM 735 CG LYS A 49 9.256 16.904 2.042 1.00 0.00 C ATOM 736 CD LYS A 49 10.662 17.478 2.014 1.00 0.00 C ATOM 737 CE LYS A 49 10.661 18.969 2.312 1.00 0.00 C ATOM 738 NZ LYS A 49 10.564 19.784 1.069 1.00 0.00 N ATOM 0 H LYS A 49 6.535 17.451 2.329 1.00 0.00 H new ATOM 0 HA LYS A 49 8.319 19.382 1.196 1.00 0.00 H new ATOM 0 HB2 LYS A 49 7.809 16.454 0.533 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.172 17.396 -0.037 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.730 17.271 2.923 1.00 0.00 H new ATOM 0 HG3 LYS A 49 9.307 15.819 2.130 1.00 0.00 H new ATOM 0 HD2 LYS A 49 11.282 16.960 2.746 1.00 0.00 H new ATOM 0 HD3 LYS A 49 11.109 17.302 1.036 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.824 19.207 2.969 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.572 19.233 2.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 9.906 20.574 1.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 11.503 20.158 0.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.215 19.189 0.290 1.00 0.00 H new ATOM 752 N ASN A 50 5.781 18.300 -0.578 1.00 0.00 N ATOM 753 CA ASN A 50 5.014 18.531 -1.796 1.00 0.00 C ATOM 754 C ASN A 50 3.930 19.580 -1.567 1.00 0.00 C ATOM 755 O ASN A 50 3.280 19.618 -0.522 1.00 0.00 O ATOM 756 CB ASN A 50 4.380 17.225 -2.280 1.00 0.00 C ATOM 757 CG ASN A 50 5.415 16.160 -2.588 1.00 0.00 C ATOM 758 OD1 ASN A 50 5.626 15.799 -3.746 1.00 0.00 O ATOM 759 ND2 ASN A 50 6.067 15.651 -1.549 1.00 0.00 N ATOM 0 H ASN A 50 5.338 17.663 0.085 1.00 0.00 H new ATOM 0 HA ASN A 50 5.697 18.901 -2.560 1.00 0.00 H new ATOM 0 HB2 ASN A 50 3.695 16.853 -1.518 1.00 0.00 H new ATOM 0 HB3 ASN A 50 3.787 17.421 -3.173 1.00 0.00 H new ATOM 0 HD21 ASN A 50 6.775 14.931 -1.694 1.00 0.00 H new ATOM 0 HD22 ASN A 50 5.860 15.980 -0.606 1.00 0.00 H new ATOM 766 N PRO A 51 3.729 20.452 -2.566 1.00 0.00 N ATOM 767 CA PRO A 51 2.724 21.516 -2.497 1.00 0.00 C ATOM 768 C PRO A 51 1.300 20.974 -2.553 1.00 0.00 C ATOM 769 O PRO A 51 1.060 19.801 -2.266 1.00 0.00 O ATOM 770 CB PRO A 51 3.021 22.366 -3.736 1.00 0.00 C ATOM 771 CG PRO A 51 3.684 21.429 -4.687 1.00 0.00 C ATOM 772 CD PRO A 51 4.467 20.465 -3.840 1.00 0.00 C ATOM 0 HA PRO A 51 2.781 22.069 -1.559 1.00 0.00 H new ATOM 0 HB2 PRO A 51 2.107 22.780 -4.161 1.00 0.00 H new ATOM 0 HB3 PRO A 51 3.669 23.208 -3.493 1.00 0.00 H new ATOM 0 HG2 PRO A 51 2.947 20.905 -5.296 1.00 0.00 H new ATOM 0 HG3 PRO A 51 4.339 21.967 -5.372 1.00 0.00 H new ATOM 0 HD2 PRO A 51 4.506 19.474 -4.292 1.00 0.00 H new ATOM 0 HD3 PRO A 51 5.497 20.795 -3.704 1.00 0.00 H new ATOM 780 N ASP A 52 0.358 21.834 -2.926 1.00 0.00 N ATOM 781 CA ASP A 52 -1.043 21.440 -3.021 1.00 0.00 C ATOM 782 C ASP A 52 -1.279 20.564 -4.247 1.00 0.00 C ATOM 783 O ASP A 52 -2.252 20.750 -4.977 1.00 0.00 O ATOM 784 CB ASP A 52 -1.939 22.678 -3.082 1.00 0.00 C ATOM 785 CG ASP A 52 -1.756 23.585 -1.882 1.00 0.00 C ATOM 786 OD1 ASP A 52 -0.698 24.241 -1.789 1.00 0.00 O ATOM 787 OD2 ASP A 52 -2.672 23.640 -1.035 1.00 0.00 O ATOM 0 H ASP A 52 0.539 22.808 -3.167 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.294 20.863 -2.131 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -1.721 23.236 -3.992 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -2.982 22.366 -3.142 1.00 0.00 H new ATOM 792 N ASN A 53 -0.381 19.610 -4.468 1.00 0.00 N ATOM 793 CA ASN A 53 -0.491 18.706 -5.608 1.00 0.00 C ATOM 794 C ASN A 53 -1.320 17.477 -5.249 1.00 0.00 C ATOM 795 O ASN A 53 -1.108 16.832 -4.221 1.00 0.00 O ATOM 796 CB ASN A 53 0.900 18.277 -6.080 1.00 0.00 C ATOM 797 CG ASN A 53 0.920 16.851 -6.599 1.00 0.00 C ATOM 798 OD1 ASN A 53 -0.072 16.362 -7.140 1.00 0.00 O ATOM 799 ND2 ASN A 53 2.053 16.178 -6.435 1.00 0.00 N ATOM 0 H ASN A 53 0.431 19.442 -3.873 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.994 19.238 -6.416 1.00 0.00 H new ATOM 0 HB2 ASN A 53 1.238 18.952 -6.866 1.00 0.00 H new ATOM 0 HB3 ASN A 53 1.606 18.370 -5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.126 15.215 -6.763 1.00 0.00 H new ATOM 0 HD22 ASN A 53 2.850 16.624 -5.981 1.00 0.00 H new ATOM 806 N PRO A 54 -2.288 17.142 -6.116 1.00 0.00 N ATOM 807 CA PRO A 54 -3.168 15.987 -5.913 1.00 0.00 C ATOM 808 C PRO A 54 -2.431 14.662 -6.072 1.00 0.00 C ATOM 809 O PRO A 54 -2.474 13.808 -5.188 1.00 0.00 O ATOM 810 CB PRO A 54 -4.223 16.148 -7.010 1.00 0.00 C ATOM 811 CG PRO A 54 -3.545 16.941 -8.074 1.00 0.00 C ATOM 812 CD PRO A 54 -2.596 17.865 -7.361 1.00 0.00 C ATOM 0 HA PRO A 54 -3.582 15.962 -4.905 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.553 15.180 -7.387 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -5.108 16.663 -6.636 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -3.010 16.290 -8.765 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.269 17.504 -8.663 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -1.698 18.052 -7.950 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -3.053 18.834 -7.161 1.00 0.00 H new ATOM 820 N GLU A 55 -1.756 14.498 -7.206 1.00 0.00 N ATOM 821 CA GLU A 55 -1.010 13.275 -7.480 1.00 0.00 C ATOM 822 C GLU A 55 -0.115 12.908 -6.300 1.00 0.00 C ATOM 823 O GLU A 55 0.055 11.732 -5.979 1.00 0.00 O ATOM 824 CB GLU A 55 -0.164 13.440 -8.744 1.00 0.00 C ATOM 825 CG GLU A 55 1.212 14.027 -8.483 1.00 0.00 C ATOM 826 CD GLU A 55 2.194 13.732 -9.601 1.00 0.00 C ATOM 827 OE1 GLU A 55 2.582 12.555 -9.755 1.00 0.00 O ATOM 828 OE2 GLU A 55 2.573 14.679 -10.322 1.00 0.00 O ATOM 0 H GLU A 55 -1.711 15.196 -7.949 1.00 0.00 H new ATOM 0 HA GLU A 55 -1.727 12.469 -7.634 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -0.050 12.468 -9.224 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -0.696 14.082 -9.446 1.00 0.00 H new ATOM 0 HG2 GLU A 55 1.125 15.106 -8.357 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.602 13.627 -7.547 1.00 0.00 H new ATOM 835 N ALA A 56 0.454 13.923 -5.659 1.00 0.00 N ATOM 836 CA ALA A 56 1.331 13.707 -4.514 1.00 0.00 C ATOM 837 C ALA A 56 0.583 13.032 -3.369 1.00 0.00 C ATOM 838 O ALA A 56 1.062 12.056 -2.793 1.00 0.00 O ATOM 839 CB ALA A 56 1.927 15.028 -4.050 1.00 0.00 C ATOM 0 H ALA A 56 0.324 14.902 -5.912 1.00 0.00 H new ATOM 0 HA ALA A 56 2.139 13.045 -4.826 1.00 0.00 H new ATOM 0 HB1 ALA A 56 2.580 14.852 -3.195 1.00 0.00 H new ATOM 0 HB2 ALA A 56 2.504 15.472 -4.861 1.00 0.00 H new ATOM 0 HB3 ALA A 56 1.125 15.707 -3.761 1.00 0.00 H new ATOM 845 N ALA A 57 -0.593 13.559 -3.045 1.00 0.00 N ATOM 846 CA ALA A 57 -1.408 13.005 -1.970 1.00 0.00 C ATOM 847 C ALA A 57 -1.956 11.633 -2.347 1.00 0.00 C ATOM 848 O ALA A 57 -1.879 10.687 -1.563 1.00 0.00 O ATOM 849 CB ALA A 57 -2.546 13.955 -1.628 1.00 0.00 C ATOM 0 H ALA A 57 -1.003 14.368 -3.511 1.00 0.00 H new ATOM 0 HA ALA A 57 -0.774 12.884 -1.092 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -3.146 13.529 -0.824 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.136 14.913 -1.307 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -3.172 14.105 -2.508 1.00 0.00 H new ATOM 855 N ASP A 58 -2.508 11.532 -3.551 1.00 0.00 N ATOM 856 CA ASP A 58 -3.069 10.275 -4.032 1.00 0.00 C ATOM 857 C ASP A 58 -2.117 9.115 -3.757 1.00 0.00 C ATOM 858 O ASP A 58 -2.549 8.002 -3.455 1.00 0.00 O ATOM 859 CB ASP A 58 -3.365 10.364 -5.530 1.00 0.00 C ATOM 860 CG ASP A 58 -4.457 9.406 -5.962 1.00 0.00 C ATOM 861 OD1 ASP A 58 -4.365 8.208 -5.621 1.00 0.00 O ATOM 862 OD2 ASP A 58 -5.404 9.853 -6.642 1.00 0.00 O ATOM 0 H ASP A 58 -2.579 12.306 -4.212 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.000 10.092 -3.496 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -3.660 11.383 -5.779 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.455 10.150 -6.091 1.00 0.00 H new ATOM 867 N LYS A 59 -0.820 9.382 -3.863 1.00 0.00 N ATOM 868 CA LYS A 59 0.194 8.362 -3.626 1.00 0.00 C ATOM 869 C LYS A 59 0.457 8.193 -2.133 1.00 0.00 C ATOM 870 O LYS A 59 0.209 7.129 -1.566 1.00 0.00 O ATOM 871 CB LYS A 59 1.494 8.729 -4.346 1.00 0.00 C ATOM 872 CG LYS A 59 1.575 8.195 -5.765 1.00 0.00 C ATOM 873 CD LYS A 59 1.870 6.705 -5.785 1.00 0.00 C ATOM 874 CE LYS A 59 2.260 6.232 -7.177 1.00 0.00 C ATOM 875 NZ LYS A 59 2.751 4.826 -7.168 1.00 0.00 N ATOM 0 H LYS A 59 -0.446 10.298 -4.112 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.178 7.416 -4.021 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.593 9.814 -4.369 1.00 0.00 H new ATOM 0 HB3 LYS A 59 2.338 8.344 -3.773 1.00 0.00 H new ATOM 0 HG2 LYS A 59 0.634 8.387 -6.281 1.00 0.00 H new ATOM 0 HG3 LYS A 59 2.353 8.728 -6.311 1.00 0.00 H new ATOM 0 HD2 LYS A 59 2.676 6.483 -5.085 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.993 6.155 -5.445 1.00 0.00 H new ATOM 0 HE2 LYS A 59 1.400 6.312 -7.842 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.035 6.885 -7.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 3.007 4.541 -8.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 3.587 4.754 -6.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 2.003 4.199 -6.809 1.00 0.00 H new ATOM 889 N PHE A 60 0.960 9.249 -1.502 1.00 0.00 N ATOM 890 CA PHE A 60 1.256 9.218 -0.075 1.00 0.00 C ATOM 891 C PHE A 60 0.189 8.434 0.684 1.00 0.00 C ATOM 892 O PHE A 60 0.503 7.564 1.498 1.00 0.00 O ATOM 893 CB PHE A 60 1.350 10.641 0.480 1.00 0.00 C ATOM 894 CG PHE A 60 1.711 10.694 1.937 1.00 0.00 C ATOM 895 CD1 PHE A 60 2.863 10.079 2.401 1.00 0.00 C ATOM 896 CD2 PHE A 60 0.899 11.358 2.841 1.00 0.00 C ATOM 897 CE1 PHE A 60 3.197 10.126 3.741 1.00 0.00 C ATOM 898 CE2 PHE A 60 1.229 11.408 4.183 1.00 0.00 C ATOM 899 CZ PHE A 60 2.380 10.792 4.633 1.00 0.00 C ATOM 0 H PHE A 60 1.171 10.137 -1.957 1.00 0.00 H new ATOM 0 HA PHE A 60 2.215 8.719 0.061 1.00 0.00 H new ATOM 0 HB2 PHE A 60 2.094 11.197 -0.091 1.00 0.00 H new ATOM 0 HB3 PHE A 60 0.394 11.144 0.332 1.00 0.00 H new ATOM 0 HD1 PHE A 60 3.506 9.557 1.708 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -0.002 11.842 2.494 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.097 9.642 4.091 1.00 0.00 H new ATOM 0 HE2 PHE A 60 0.587 11.928 4.878 1.00 0.00 H new ATOM 0 HZ PHE A 60 2.641 10.831 5.680 1.00 0.00 H new ATOM 909 N LYS A 61 -1.073 8.748 0.413 1.00 0.00 N ATOM 910 CA LYS A 61 -2.187 8.074 1.069 1.00 0.00 C ATOM 911 C LYS A 61 -2.126 6.568 0.835 1.00 0.00 C ATOM 912 O LYS A 61 -2.426 5.779 1.730 1.00 0.00 O ATOM 913 CB LYS A 61 -3.518 8.628 0.555 1.00 0.00 C ATOM 914 CG LYS A 61 -4.044 7.905 -0.673 1.00 0.00 C ATOM 915 CD LYS A 61 -5.015 8.772 -1.457 1.00 0.00 C ATOM 916 CE LYS A 61 -6.428 8.667 -0.902 1.00 0.00 C ATOM 917 NZ LYS A 61 -6.633 9.567 0.267 1.00 0.00 N ATOM 0 H LYS A 61 -1.350 9.466 -0.257 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.112 8.260 2.140 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -4.260 8.563 1.350 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -3.395 9.685 0.319 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.210 7.620 -1.314 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.541 6.984 -0.369 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -4.686 9.811 -1.424 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -5.011 8.470 -2.504 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -7.145 8.918 -1.684 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.627 7.637 -0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -7.635 9.839 0.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -6.359 9.071 1.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -6.049 10.420 0.155 1.00 0.00 H new ATOM 931 N GLU A 62 -1.736 6.177 -0.374 1.00 0.00 N ATOM 932 CA GLU A 62 -1.635 4.765 -0.725 1.00 0.00 C ATOM 933 C GLU A 62 -0.447 4.114 -0.023 1.00 0.00 C ATOM 934 O GLU A 62 -0.535 2.978 0.445 1.00 0.00 O ATOM 935 CB GLU A 62 -1.500 4.601 -2.240 1.00 0.00 C ATOM 936 CG GLU A 62 -2.832 4.459 -2.958 1.00 0.00 C ATOM 937 CD GLU A 62 -3.912 5.342 -2.364 1.00 0.00 C ATOM 938 OE1 GLU A 62 -4.421 5.005 -1.274 1.00 0.00 O ATOM 939 OE2 GLU A 62 -4.248 6.369 -2.989 1.00 0.00 O ATOM 0 H GLU A 62 -1.485 6.818 -1.127 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.547 4.268 -0.394 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.969 5.463 -2.644 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -0.889 3.723 -2.449 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.701 4.709 -4.011 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.154 3.419 -2.915 1.00 0.00 H new ATOM 946 N ILE A 63 0.663 4.841 0.044 1.00 0.00 N ATOM 947 CA ILE A 63 1.869 4.334 0.688 1.00 0.00 C ATOM 948 C ILE A 63 1.605 3.979 2.147 1.00 0.00 C ATOM 949 O ILE A 63 1.860 2.855 2.579 1.00 0.00 O ATOM 950 CB ILE A 63 3.016 5.360 0.621 1.00 0.00 C ATOM 951 CG1 ILE A 63 3.095 5.979 -0.776 1.00 0.00 C ATOM 952 CG2 ILE A 63 4.337 4.702 0.991 1.00 0.00 C ATOM 953 CD1 ILE A 63 4.349 6.793 -1.006 1.00 0.00 C ATOM 0 H ILE A 63 0.753 5.782 -0.339 1.00 0.00 H new ATOM 0 HA ILE A 63 2.163 3.436 0.145 1.00 0.00 H new ATOM 0 HB ILE A 63 2.815 6.155 1.339 1.00 0.00 H new ATOM 0 HG12 ILE A 63 3.046 5.184 -1.520 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.224 6.616 -0.932 1.00 0.00 H new ATOM 0 HG21 ILE A 63 5.138 5.439 0.939 1.00 0.00 H new ATOM 0 HG22 ILE A 63 4.274 4.305 2.004 1.00 0.00 H new ATOM 0 HG23 ILE A 63 4.546 3.890 0.295 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.337 7.201 -2.017 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.390 7.610 -0.285 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.224 6.155 -0.882 1.00 0.00 H new ATOM 965 N ASN A 64 1.090 4.944 2.902 1.00 0.00 N ATOM 966 CA ASN A 64 0.790 4.732 4.314 1.00 0.00 C ATOM 967 C ASN A 64 -0.212 3.595 4.492 1.00 0.00 C ATOM 968 O ASN A 64 0.007 2.681 5.285 1.00 0.00 O ATOM 969 CB ASN A 64 0.238 6.015 4.937 1.00 0.00 C ATOM 970 CG ASN A 64 -1.273 6.103 4.838 1.00 0.00 C ATOM 971 OD1 ASN A 64 -1.992 5.295 5.427 1.00 0.00 O ATOM 972 ND2 ASN A 64 -1.761 7.087 4.092 1.00 0.00 N ATOM 0 H ASN A 64 0.872 5.880 2.560 1.00 0.00 H new ATOM 0 HA ASN A 64 1.716 4.459 4.820 1.00 0.00 H new ATOM 0 HB2 ASN A 64 0.534 6.063 5.985 1.00 0.00 H new ATOM 0 HB3 ASN A 64 0.683 6.877 4.440 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.770 7.197 3.989 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.127 7.733 3.622 1.00 0.00 H new ATOM 979 N ASN A 65 -1.311 3.660 3.747 1.00 0.00 N ATOM 980 CA ASN A 65 -2.347 2.636 3.823 1.00 0.00 C ATOM 981 C ASN A 65 -1.757 1.248 3.592 1.00 0.00 C ATOM 982 O ASN A 65 -2.275 0.251 4.095 1.00 0.00 O ATOM 983 CB ASN A 65 -3.444 2.914 2.793 1.00 0.00 C ATOM 984 CG ASN A 65 -4.678 2.062 3.019 1.00 0.00 C ATOM 985 OD1 ASN A 65 -5.514 2.374 3.868 1.00 0.00 O ATOM 986 ND2 ASN A 65 -4.797 0.980 2.259 1.00 0.00 N ATOM 0 H ASN A 65 -1.507 4.410 3.084 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.780 2.666 4.823 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.720 3.968 2.836 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.055 2.727 1.792 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.606 0.368 2.366 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.079 0.761 1.568 1.00 0.00 H new ATOM 993 N ALA A 66 -0.671 1.192 2.828 1.00 0.00 N ATOM 994 CA ALA A 66 -0.009 -0.073 2.533 1.00 0.00 C ATOM 995 C ALA A 66 0.896 -0.501 3.683 1.00 0.00 C ATOM 996 O ALA A 66 0.674 -1.538 4.309 1.00 0.00 O ATOM 997 CB ALA A 66 0.790 0.038 1.243 1.00 0.00 C ATOM 0 H ALA A 66 -0.231 2.008 2.402 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.777 -0.836 2.407 1.00 0.00 H new ATOM 0 HB1 ALA A 66 1.279 -0.914 1.035 1.00 0.00 H new ATOM 0 HB2 ALA A 66 0.120 0.289 0.421 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.544 0.818 1.348 1.00 0.00 H new ATOM 1003 N HIS A 67 1.918 0.304 3.956 1.00 0.00 N ATOM 1004 CA HIS A 67 2.858 0.008 5.032 1.00 0.00 C ATOM 1005 C HIS A 67 2.118 -0.386 6.307 1.00 0.00 C ATOM 1006 O HIS A 67 2.559 -1.266 7.045 1.00 0.00 O ATOM 1007 CB HIS A 67 3.754 1.217 5.302 1.00 0.00 C ATOM 1008 CG HIS A 67 4.361 1.219 6.671 1.00 0.00 C ATOM 1009 ND1 HIS A 67 3.740 1.778 7.768 1.00 0.00 N ATOM 1010 CD2 HIS A 67 5.539 0.725 7.118 1.00 0.00 C ATOM 1011 CE1 HIS A 67 4.511 1.629 8.831 1.00 0.00 C ATOM 1012 NE2 HIS A 67 5.608 0.992 8.464 1.00 0.00 N ATOM 0 H HIS A 67 2.116 1.166 3.448 1.00 0.00 H new ATOM 0 HA HIS A 67 3.478 -0.832 4.718 1.00 0.00 H new ATOM 0 HB2 HIS A 67 4.552 1.240 4.560 1.00 0.00 H new ATOM 0 HB3 HIS A 67 3.170 2.128 5.171 1.00 0.00 H new ATOM 0 HD1 HIS A 67 2.828 2.235 7.760 1.00 0.00 H new ATOM 0 HD2 HIS A 67 6.286 0.216 6.527 1.00 0.00 H new ATOM 0 HE1 HIS A 67 4.283 1.970 9.830 1.00 0.00 H new ATOM 1020 N ALA A 68 0.991 0.272 6.558 1.00 0.00 N ATOM 1021 CA ALA A 68 0.190 -0.011 7.743 1.00 0.00 C ATOM 1022 C ALA A 68 -0.389 -1.420 7.691 1.00 0.00 C ATOM 1023 O ALA A 68 -0.029 -2.279 8.496 1.00 0.00 O ATOM 1024 CB ALA A 68 -0.926 1.015 7.882 1.00 0.00 C ATOM 0 H ALA A 68 0.612 1.004 5.957 1.00 0.00 H new ATOM 0 HA ALA A 68 0.841 0.054 8.615 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.517 0.792 8.771 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -0.495 2.012 7.974 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.567 0.977 7.001 1.00 0.00 H new ATOM 1030 N ILE A 69 -1.287 -1.651 6.739 1.00 0.00 N ATOM 1031 CA ILE A 69 -1.915 -2.958 6.582 1.00 0.00 C ATOM 1032 C ILE A 69 -0.883 -4.077 6.668 1.00 0.00 C ATOM 1033 O ILE A 69 -1.202 -5.203 7.054 1.00 0.00 O ATOM 1034 CB ILE A 69 -2.662 -3.066 5.240 1.00 0.00 C ATOM 1035 CG1 ILE A 69 -3.837 -2.086 5.205 1.00 0.00 C ATOM 1036 CG2 ILE A 69 -3.147 -4.491 5.017 1.00 0.00 C ATOM 1037 CD1 ILE A 69 -4.379 -1.843 3.814 1.00 0.00 C ATOM 0 H ILE A 69 -1.596 -0.951 6.065 1.00 0.00 H new ATOM 0 HA ILE A 69 -2.631 -3.064 7.397 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.973 -2.807 4.436 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -4.638 -2.469 5.837 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -3.520 -1.135 5.634 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -3.673 -4.551 4.064 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.293 -5.168 5.003 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.823 -4.776 5.823 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.209 -1.139 3.865 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -3.591 -1.430 3.184 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -4.727 -2.785 3.390 1.00 0.00 H new ATOM 1049 N LEU A 70 0.356 -3.761 6.309 1.00 0.00 N ATOM 1050 CA LEU A 70 1.437 -4.740 6.347 1.00 0.00 C ATOM 1051 C LEU A 70 2.022 -4.851 7.752 1.00 0.00 C ATOM 1052 O LEU A 70 2.101 -5.941 8.319 1.00 0.00 O ATOM 1053 CB LEU A 70 2.536 -4.355 5.355 1.00 0.00 C ATOM 1054 CG LEU A 70 2.155 -4.418 3.875 1.00 0.00 C ATOM 1055 CD1 LEU A 70 3.252 -3.808 3.016 1.00 0.00 C ATOM 1056 CD2 LEU A 70 1.883 -5.855 3.455 1.00 0.00 C ATOM 0 H LEU A 70 0.637 -2.835 5.988 1.00 0.00 H new ATOM 0 HA LEU A 70 1.025 -5.709 6.066 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.864 -3.341 5.582 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.391 -5.011 5.518 1.00 0.00 H new ATOM 0 HG LEU A 70 1.243 -3.839 3.729 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.964 -3.861 1.966 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.399 -2.766 3.299 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.180 -4.359 3.166 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.613 -5.881 2.399 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.778 -6.457 3.616 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.063 -6.259 4.049 1.00 0.00 H new ATOM 1068 N THR A 71 2.428 -3.715 8.310 1.00 0.00 N ATOM 1069 CA THR A 71 3.004 -3.684 9.648 1.00 0.00 C ATOM 1070 C THR A 71 2.276 -4.644 10.582 1.00 0.00 C ATOM 1071 O THR A 71 2.885 -5.547 11.157 1.00 0.00 O ATOM 1072 CB THR A 71 2.955 -2.266 10.248 1.00 0.00 C ATOM 1073 OG1 THR A 71 1.601 -1.803 10.301 1.00 0.00 O ATOM 1074 CG2 THR A 71 3.795 -1.301 9.426 1.00 0.00 C ATOM 0 H THR A 71 2.368 -2.804 7.855 1.00 0.00 H new ATOM 0 HA THR A 71 4.045 -3.994 9.552 1.00 0.00 H new ATOM 0 HB THR A 71 3.364 -2.308 11.258 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.204 -1.849 9.406 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.745 -0.306 9.869 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.831 -1.640 9.413 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.412 -1.263 8.406 1.00 0.00 H new ATOM 1082 N ASP A 72 0.971 -4.444 10.728 1.00 0.00 N ATOM 1083 CA ASP A 72 0.160 -5.294 11.592 1.00 0.00 C ATOM 1084 C ASP A 72 0.045 -6.702 11.016 1.00 0.00 C ATOM 1085 O ASP A 72 -0.627 -6.919 10.008 1.00 0.00 O ATOM 1086 CB ASP A 72 -1.234 -4.690 11.775 1.00 0.00 C ATOM 1087 CG ASP A 72 -1.859 -5.067 13.103 1.00 0.00 C ATOM 1088 OD1 ASP A 72 -2.012 -6.279 13.364 1.00 0.00 O ATOM 1089 OD2 ASP A 72 -2.194 -4.151 13.882 1.00 0.00 O ATOM 0 H ASP A 72 0.452 -3.701 10.260 1.00 0.00 H new ATOM 0 HA ASP A 72 0.651 -5.356 12.563 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.169 -3.604 11.703 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -1.881 -5.025 10.964 1.00 0.00 H new ATOM 1094 N ALA A 73 0.707 -7.656 11.663 1.00 0.00 N ATOM 1095 CA ALA A 73 0.679 -9.043 11.216 1.00 0.00 C ATOM 1096 C ALA A 73 -0.718 -9.443 10.753 1.00 0.00 C ATOM 1097 O ALA A 73 -0.914 -9.834 9.602 1.00 0.00 O ATOM 1098 CB ALA A 73 1.152 -9.966 12.330 1.00 0.00 C ATOM 0 H ALA A 73 1.269 -7.493 12.498 1.00 0.00 H new ATOM 0 HA ALA A 73 1.356 -9.139 10.367 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.126 -10.999 11.982 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.172 -9.703 12.612 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.497 -9.858 13.195 1.00 0.00 H new ATOM 1104 N THR A 74 -1.688 -9.342 11.657 1.00 0.00 N ATOM 1105 CA THR A 74 -3.066 -9.694 11.341 1.00 0.00 C ATOM 1106 C THR A 74 -3.489 -9.111 9.998 1.00 0.00 C ATOM 1107 O THR A 74 -3.809 -9.846 9.063 1.00 0.00 O ATOM 1108 CB THR A 74 -4.036 -9.199 12.431 1.00 0.00 C ATOM 1109 OG1 THR A 74 -3.663 -9.743 13.702 1.00 0.00 O ATOM 1110 CG2 THR A 74 -5.467 -9.598 12.103 1.00 0.00 C ATOM 0 H THR A 74 -1.544 -9.019 12.614 1.00 0.00 H new ATOM 0 HA THR A 74 -3.111 -10.782 11.291 1.00 0.00 H new ATOM 0 HB THR A 74 -3.979 -8.111 12.471 1.00 0.00 H new ATOM 0 HG1 THR A 74 -4.283 -9.422 14.390 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.134 -9.238 12.886 1.00 0.00 H new ATOM 0 HG22 THR A 74 -5.758 -9.159 11.149 1.00 0.00 H new ATOM 0 HG23 THR A 74 -5.536 -10.684 12.038 1.00 0.00 H new ATOM 1118 N LYS A 75 -3.488 -7.785 9.907 1.00 0.00 N ATOM 1119 CA LYS A 75 -3.870 -7.102 8.677 1.00 0.00 C ATOM 1120 C LYS A 75 -3.300 -7.819 7.457 1.00 0.00 C ATOM 1121 O LYS A 75 -4.039 -8.205 6.551 1.00 0.00 O ATOM 1122 CB LYS A 75 -3.383 -5.651 8.703 1.00 0.00 C ATOM 1123 CG LYS A 75 -4.207 -4.749 9.605 1.00 0.00 C ATOM 1124 CD LYS A 75 -5.366 -4.117 8.853 1.00 0.00 C ATOM 1125 CE LYS A 75 -6.423 -5.149 8.488 1.00 0.00 C ATOM 1126 NZ LYS A 75 -7.754 -4.523 8.260 1.00 0.00 N ATOM 0 H LYS A 75 -3.227 -7.162 10.671 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.958 -7.113 8.607 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.345 -5.631 9.034 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.402 -5.252 7.689 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.590 -5.326 10.447 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.570 -3.967 10.018 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.815 -3.335 9.465 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.995 -3.638 7.947 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.114 -5.683 7.589 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -6.501 -5.887 9.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -8.446 -5.259 8.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -8.061 -4.035 9.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -7.686 -3.837 7.481 1.00 0.00 H new ATOM 1140 N ARG A 76 -1.983 -7.994 7.441 1.00 0.00 N ATOM 1141 CA ARG A 76 -1.315 -8.665 6.332 1.00 0.00 C ATOM 1142 C ARG A 76 -1.825 -10.094 6.174 1.00 0.00 C ATOM 1143 O ARG A 76 -2.012 -10.577 5.059 1.00 0.00 O ATOM 1144 CB ARG A 76 0.199 -8.674 6.552 1.00 0.00 C ATOM 1145 CG ARG A 76 0.942 -9.634 5.636 1.00 0.00 C ATOM 1146 CD ARG A 76 2.395 -9.223 5.459 1.00 0.00 C ATOM 1147 NE ARG A 76 3.140 -10.183 4.649 1.00 0.00 N ATOM 1148 CZ ARG A 76 3.620 -11.328 5.122 1.00 0.00 C ATOM 1149 NH1 ARG A 76 3.433 -11.654 6.393 1.00 0.00 N ATOM 1150 NH2 ARG A 76 4.288 -12.149 4.322 1.00 0.00 N ATOM 0 H ARG A 76 -1.357 -7.681 8.183 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.540 -8.115 5.418 1.00 0.00 H new ATOM 0 HB2 ARG A 76 0.586 -7.666 6.399 1.00 0.00 H new ATOM 0 HB3 ARG A 76 0.405 -8.941 7.588 1.00 0.00 H new ATOM 0 HG2 ARG A 76 0.896 -10.642 6.049 1.00 0.00 H new ATOM 0 HG3 ARG A 76 0.450 -9.665 4.664 1.00 0.00 H new ATOM 0 HD2 ARG A 76 2.439 -8.241 4.989 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.867 -9.130 6.437 1.00 0.00 H new ATOM 0 HE ARG A 76 3.301 -9.962 3.666 1.00 0.00 H new ATOM 0 HH11 ARG A 76 2.920 -11.025 7.011 1.00 0.00 H new ATOM 0 HH12 ARG A 76 3.803 -12.534 6.754 1.00 0.00 H new ATOM 0 HH21 ARG A 76 4.433 -11.901 3.343 1.00 0.00 H new ATOM 0 HH22 ARG A 76 4.656 -13.028 4.686 1.00 0.00 H new ATOM 1164 N ASN A 77 -2.049 -10.765 7.300 1.00 0.00 N ATOM 1165 CA ASN A 77 -2.537 -12.139 7.287 1.00 0.00 C ATOM 1166 C ASN A 77 -3.870 -12.236 6.551 1.00 0.00 C ATOM 1167 O ASN A 77 -4.027 -13.044 5.635 1.00 0.00 O ATOM 1168 CB ASN A 77 -2.692 -12.661 8.716 1.00 0.00 C ATOM 1169 CG ASN A 77 -2.822 -14.171 8.770 1.00 0.00 C ATOM 1170 OD1 ASN A 77 -2.437 -14.872 7.833 1.00 0.00 O ATOM 1171 ND2 ASN A 77 -3.367 -14.679 9.869 1.00 0.00 N ATOM 0 H ASN A 77 -1.900 -10.379 8.232 1.00 0.00 H new ATOM 0 HA ASN A 77 -1.806 -12.753 6.761 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -1.831 -12.352 9.308 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -3.572 -12.207 9.172 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -3.481 -15.688 9.962 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -3.672 -14.060 10.620 1.00 0.00 H new ATOM 1178 N ILE A 78 -4.825 -11.407 6.957 1.00 0.00 N ATOM 1179 CA ILE A 78 -6.143 -11.398 6.335 1.00 0.00 C ATOM 1180 C ILE A 78 -6.046 -11.087 4.845 1.00 0.00 C ATOM 1181 O ILE A 78 -6.807 -11.622 4.038 1.00 0.00 O ATOM 1182 CB ILE A 78 -7.074 -10.369 7.003 1.00 0.00 C ATOM 1183 CG1 ILE A 78 -7.388 -10.790 8.440 1.00 0.00 C ATOM 1184 CG2 ILE A 78 -8.356 -10.213 6.198 1.00 0.00 C ATOM 1185 CD1 ILE A 78 -8.052 -9.703 9.256 1.00 0.00 C ATOM 0 H ILE A 78 -4.711 -10.733 7.714 1.00 0.00 H new ATOM 0 HA ILE A 78 -6.562 -12.395 6.469 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.566 -9.405 7.030 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.037 -11.666 8.420 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.463 -11.090 8.933 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -9.004 -9.482 6.683 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -8.114 -9.872 5.191 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -8.870 -11.173 6.142 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -8.245 -10.071 10.264 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -7.396 -8.834 9.307 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -8.994 -9.419 8.786 1.00 0.00 H new ATOM 1197 N TYR A 79 -5.105 -10.222 4.487 1.00 0.00 N ATOM 1198 CA TYR A 79 -4.908 -9.839 3.094 1.00 0.00 C ATOM 1199 C TYR A 79 -4.347 -11.004 2.283 1.00 0.00 C ATOM 1200 O TYR A 79 -4.928 -11.410 1.276 1.00 0.00 O ATOM 1201 CB TYR A 79 -3.965 -8.638 3.001 1.00 0.00 C ATOM 1202 CG TYR A 79 -4.072 -7.884 1.695 1.00 0.00 C ATOM 1203 CD1 TYR A 79 -5.267 -7.287 1.311 1.00 0.00 C ATOM 1204 CD2 TYR A 79 -2.979 -7.769 0.845 1.00 0.00 C ATOM 1205 CE1 TYR A 79 -5.369 -6.597 0.119 1.00 0.00 C ATOM 1206 CE2 TYR A 79 -3.073 -7.080 -0.349 1.00 0.00 C ATOM 1207 CZ TYR A 79 -4.270 -6.496 -0.708 1.00 0.00 C ATOM 1208 OH TYR A 79 -4.367 -5.810 -1.897 1.00 0.00 O ATOM 0 H TYR A 79 -4.466 -9.772 5.142 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.878 -9.564 2.679 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -4.178 -7.955 3.824 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -2.939 -8.982 3.129 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -6.130 -7.364 1.956 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -2.040 -8.226 1.122 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -6.305 -6.139 -0.164 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -2.214 -6.999 -0.998 1.00 0.00 H new ATOM 0 HH TYR A 79 -3.990 -4.912 -1.788 1.00 0.00 H new ATOM 1218 N ASP A 80 -3.215 -11.536 2.730 1.00 0.00 N ATOM 1219 CA ASP A 80 -2.576 -12.655 2.049 1.00 0.00 C ATOM 1220 C ASP A 80 -3.551 -13.815 1.875 1.00 0.00 C ATOM 1221 O ASP A 80 -3.571 -14.474 0.835 1.00 0.00 O ATOM 1222 CB ASP A 80 -1.345 -13.120 2.830 1.00 0.00 C ATOM 1223 CG ASP A 80 -0.600 -14.237 2.126 1.00 0.00 C ATOM 1224 OD1 ASP A 80 -0.054 -13.987 1.031 1.00 0.00 O ATOM 1225 OD2 ASP A 80 -0.564 -15.361 2.668 1.00 0.00 O ATOM 0 H ASP A 80 -2.721 -11.210 3.561 1.00 0.00 H new ATOM 0 HA ASP A 80 -2.264 -12.316 1.061 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.672 -12.275 2.978 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.653 -13.460 3.819 1.00 0.00 H new ATOM 1230 N LYS A 81 -4.359 -14.061 2.901 1.00 0.00 N ATOM 1231 CA LYS A 81 -5.338 -15.141 2.863 1.00 0.00 C ATOM 1232 C LYS A 81 -6.501 -14.789 1.942 1.00 0.00 C ATOM 1233 O LYS A 81 -6.780 -15.503 0.978 1.00 0.00 O ATOM 1234 CB LYS A 81 -5.860 -15.433 4.272 1.00 0.00 C ATOM 1235 CG LYS A 81 -4.860 -16.164 5.152 1.00 0.00 C ATOM 1236 CD LYS A 81 -5.551 -16.900 6.287 1.00 0.00 C ATOM 1237 CE LYS A 81 -5.957 -15.949 7.403 1.00 0.00 C ATOM 1238 NZ LYS A 81 -6.537 -16.675 8.566 1.00 0.00 N ATOM 0 H LYS A 81 -4.355 -13.526 3.770 1.00 0.00 H new ATOM 0 HA LYS A 81 -4.845 -16.031 2.472 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -6.134 -14.493 4.751 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -6.769 -16.029 4.197 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -4.293 -16.873 4.549 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -4.145 -15.451 5.562 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -6.434 -17.413 5.905 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -4.885 -17.666 6.684 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.087 -15.378 7.728 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.685 -15.232 7.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.801 -15.992 9.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -7.382 -17.200 8.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.834 -17.341 8.945 1.00 0.00 H new ATOM 1252 N TYR A 82 -7.175 -13.685 2.243 1.00 0.00 N ATOM 1253 CA TYR A 82 -8.309 -13.239 1.441 1.00 0.00 C ATOM 1254 C TYR A 82 -7.890 -12.143 0.467 1.00 0.00 C ATOM 1255 O TYR A 82 -7.890 -12.342 -0.747 1.00 0.00 O ATOM 1256 CB TYR A 82 -9.432 -12.731 2.347 1.00 0.00 C ATOM 1257 CG TYR A 82 -9.791 -13.687 3.462 1.00 0.00 C ATOM 1258 CD1 TYR A 82 -9.855 -15.056 3.235 1.00 0.00 C ATOM 1259 CD2 TYR A 82 -10.066 -13.221 4.741 1.00 0.00 C ATOM 1260 CE1 TYR A 82 -10.183 -15.933 4.251 1.00 0.00 C ATOM 1261 CE2 TYR A 82 -10.393 -14.091 5.763 1.00 0.00 C ATOM 1262 CZ TYR A 82 -10.450 -15.446 5.513 1.00 0.00 C ATOM 1263 OH TYR A 82 -10.777 -16.316 6.528 1.00 0.00 O ATOM 0 H TYR A 82 -6.956 -13.082 3.036 1.00 0.00 H new ATOM 0 HA TYR A 82 -8.672 -14.091 0.866 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -9.134 -11.776 2.780 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -10.319 -12.543 1.742 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -9.645 -15.441 2.248 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -10.023 -12.160 4.940 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -10.230 -16.995 4.058 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -10.603 -13.712 6.752 1.00 0.00 H new ATOM 0 HH TYR A 82 -10.934 -15.812 7.353 1.00 0.00 H new ATOM 1273 N GLY A 83 -7.531 -10.983 1.010 1.00 0.00 N ATOM 1274 CA GLY A 83 -7.114 -9.871 0.176 1.00 0.00 C ATOM 1275 C GLY A 83 -7.918 -8.614 0.441 1.00 0.00 C ATOM 1276 O GLY A 83 -8.330 -8.360 1.573 1.00 0.00 O ATOM 0 H GLY A 83 -7.522 -10.794 2.012 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -6.058 -9.666 0.350 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.216 -10.149 -0.873 1.00 0.00 H new ATOM 1280 N SER A 84 -8.140 -7.824 -0.605 1.00 0.00 N ATOM 1281 CA SER A 84 -8.896 -6.583 -0.478 1.00 0.00 C ATOM 1282 C SER A 84 -10.257 -6.838 0.162 1.00 0.00 C ATOM 1283 O SER A 84 -10.754 -6.021 0.939 1.00 0.00 O ATOM 1284 CB SER A 84 -9.079 -5.931 -1.850 1.00 0.00 C ATOM 1285 OG SER A 84 -9.718 -4.671 -1.734 1.00 0.00 O ATOM 0 H SER A 84 -7.807 -8.021 -1.549 1.00 0.00 H new ATOM 0 HA SER A 84 -8.333 -5.908 0.166 1.00 0.00 H new ATOM 0 HB2 SER A 84 -8.108 -5.807 -2.330 1.00 0.00 H new ATOM 0 HB3 SER A 84 -9.670 -6.585 -2.491 1.00 0.00 H new ATOM 0 HG SER A 84 -9.822 -4.274 -2.624 1.00 0.00 H new ATOM 1291 N LEU A 85 -10.855 -7.977 -0.169 1.00 0.00 N ATOM 1292 CA LEU A 85 -12.159 -8.342 0.373 1.00 0.00 C ATOM 1293 C LEU A 85 -12.086 -8.538 1.884 1.00 0.00 C ATOM 1294 O LEU A 85 -12.830 -7.911 2.638 1.00 0.00 O ATOM 1295 CB LEU A 85 -12.671 -9.621 -0.294 1.00 0.00 C ATOM 1296 CG LEU A 85 -14.180 -9.858 -0.222 1.00 0.00 C ATOM 1297 CD1 LEU A 85 -14.913 -8.926 -1.174 1.00 0.00 C ATOM 1298 CD2 LEU A 85 -14.507 -11.310 -0.536 1.00 0.00 C ATOM 0 H LEU A 85 -10.458 -8.664 -0.810 1.00 0.00 H new ATOM 0 HA LEU A 85 -12.852 -7.527 0.164 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -12.376 -9.603 -1.343 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -12.167 -10.472 0.164 1.00 0.00 H new ATOM 0 HG LEU A 85 -14.514 -9.643 0.793 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -15.985 -9.109 -1.109 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -14.705 -7.891 -0.902 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -14.575 -9.109 -2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -15.585 -11.460 -0.480 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -14.158 -11.553 -1.540 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -14.012 -11.959 0.187 1.00 0.00 H new ATOM 1310 N GLY A 86 -11.182 -9.410 2.319 1.00 0.00 N ATOM 1311 CA GLY A 86 -11.026 -9.670 3.739 1.00 0.00 C ATOM 1312 C GLY A 86 -11.053 -8.402 4.567 1.00 0.00 C ATOM 1313 O GLY A 86 -11.837 -8.282 5.510 1.00 0.00 O ATOM 0 H GLY A 86 -10.555 -9.941 1.714 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.822 -10.335 4.073 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -10.084 -10.191 3.908 1.00 0.00 H new ATOM 1317 N LEU A 87 -10.193 -7.451 4.218 1.00 0.00 N ATOM 1318 CA LEU A 87 -10.119 -6.184 4.938 1.00 0.00 C ATOM 1319 C LEU A 87 -11.496 -5.537 5.043 1.00 0.00 C ATOM 1320 O LEU A 87 -11.903 -5.091 6.116 1.00 0.00 O ATOM 1321 CB LEU A 87 -9.147 -5.233 4.237 1.00 0.00 C ATOM 1322 CG LEU A 87 -7.814 -5.839 3.799 1.00 0.00 C ATOM 1323 CD1 LEU A 87 -6.937 -4.782 3.145 1.00 0.00 C ATOM 1324 CD2 LEU A 87 -7.099 -6.470 4.985 1.00 0.00 C ATOM 0 H LEU A 87 -9.537 -7.533 3.441 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.756 -6.387 5.946 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.643 -4.822 3.358 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.941 -4.398 4.906 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.015 -6.620 3.065 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.992 -5.231 2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.446 -4.377 2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.744 -3.979 3.856 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.152 -6.896 4.654 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -6.910 -5.709 5.742 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.723 -7.257 5.409 1.00 0.00 H new ATOM 1336 N TYR A 88 -12.209 -5.490 3.923 1.00 0.00 N ATOM 1337 CA TYR A 88 -13.540 -4.897 3.889 1.00 0.00 C ATOM 1338 C TYR A 88 -14.466 -5.578 4.891 1.00 0.00 C ATOM 1339 O TYR A 88 -15.151 -4.916 5.672 1.00 0.00 O ATOM 1340 CB TYR A 88 -14.131 -4.999 2.481 1.00 0.00 C ATOM 1341 CG TYR A 88 -15.642 -5.055 2.461 1.00 0.00 C ATOM 1342 CD1 TYR A 88 -16.399 -4.178 3.228 1.00 0.00 C ATOM 1343 CD2 TYR A 88 -16.312 -5.984 1.674 1.00 0.00 C ATOM 1344 CE1 TYR A 88 -17.780 -4.226 3.213 1.00 0.00 C ATOM 1345 CE2 TYR A 88 -17.692 -6.038 1.652 1.00 0.00 C ATOM 1346 CZ TYR A 88 -18.421 -5.157 2.423 1.00 0.00 C ATOM 1347 OH TYR A 88 -19.796 -5.207 2.405 1.00 0.00 O ATOM 0 H TYR A 88 -11.887 -5.856 3.027 1.00 0.00 H new ATOM 0 HA TYR A 88 -13.448 -3.846 4.163 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -13.800 -4.142 1.894 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -13.736 -5.891 1.994 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -15.900 -3.447 3.846 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -15.744 -6.675 1.069 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -18.354 -3.538 3.816 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -18.197 -6.766 1.035 1.00 0.00 H new ATOM 0 HH TYR A 88 -20.090 -5.918 1.798 1.00 0.00 H new ATOM 1357 N VAL A 89 -14.482 -6.907 4.865 1.00 0.00 N ATOM 1358 CA VAL A 89 -15.322 -7.680 5.772 1.00 0.00 C ATOM 1359 C VAL A 89 -14.952 -7.412 7.226 1.00 0.00 C ATOM 1360 O VAL A 89 -15.803 -7.465 8.114 1.00 0.00 O ATOM 1361 CB VAL A 89 -15.205 -9.191 5.494 1.00 0.00 C ATOM 1362 CG1 VAL A 89 -16.068 -9.981 6.466 1.00 0.00 C ATOM 1363 CG2 VAL A 89 -15.589 -9.499 4.055 1.00 0.00 C ATOM 0 H VAL A 89 -13.922 -7.471 4.225 1.00 0.00 H new ATOM 0 HA VAL A 89 -16.351 -7.364 5.598 1.00 0.00 H new ATOM 0 HB VAL A 89 -14.167 -9.491 5.641 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -15.973 -11.046 6.254 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -15.741 -9.783 7.487 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -17.110 -9.681 6.354 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -15.501 -10.571 3.876 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -16.618 -9.185 3.878 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -14.924 -8.962 3.378 1.00 0.00 H new ATOM 1373 N ALA A 90 -13.676 -7.123 7.463 1.00 0.00 N ATOM 1374 CA ALA A 90 -13.194 -6.843 8.810 1.00 0.00 C ATOM 1375 C ALA A 90 -13.493 -5.403 9.212 1.00 0.00 C ATOM 1376 O ALA A 90 -13.368 -5.038 10.380 1.00 0.00 O ATOM 1377 CB ALA A 90 -11.701 -7.120 8.904 1.00 0.00 C ATOM 0 H ALA A 90 -12.958 -7.077 6.740 1.00 0.00 H new ATOM 0 HA ALA A 90 -13.719 -7.502 9.501 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.354 -6.907 9.915 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -11.510 -8.167 8.668 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -11.168 -6.485 8.196 1.00 0.00 H new ATOM 1383 N GLU A 91 -13.888 -4.591 8.237 1.00 0.00 N ATOM 1384 CA GLU A 91 -14.203 -3.190 8.491 1.00 0.00 C ATOM 1385 C GLU A 91 -15.705 -2.997 8.685 1.00 0.00 C ATOM 1386 O GLU A 91 -16.136 -2.108 9.419 1.00 0.00 O ATOM 1387 CB GLU A 91 -13.710 -2.316 7.336 1.00 0.00 C ATOM 1388 CG GLU A 91 -13.531 -0.855 7.713 1.00 0.00 C ATOM 1389 CD GLU A 91 -13.171 0.014 6.523 1.00 0.00 C ATOM 1390 OE1 GLU A 91 -13.911 -0.021 5.518 1.00 0.00 O ATOM 1391 OE2 GLU A 91 -12.150 0.729 6.597 1.00 0.00 O ATOM 0 H GLU A 91 -13.998 -4.879 7.265 1.00 0.00 H new ATOM 0 HA GLU A 91 -13.694 -2.890 9.407 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -12.760 -2.708 6.974 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -14.418 -2.386 6.511 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.452 -0.484 8.164 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -12.750 -0.772 8.469 1.00 0.00 H new ATOM 1398 N GLN A 92 -16.494 -3.835 8.021 1.00 0.00 N ATOM 1399 CA GLN A 92 -17.946 -3.755 8.119 1.00 0.00 C ATOM 1400 C GLN A 92 -18.464 -4.632 9.254 1.00 0.00 C ATOM 1401 O GLN A 92 -19.571 -4.429 9.753 1.00 0.00 O ATOM 1402 CB GLN A 92 -18.592 -4.178 6.797 1.00 0.00 C ATOM 1403 CG GLN A 92 -18.298 -5.618 6.411 1.00 0.00 C ATOM 1404 CD GLN A 92 -19.352 -6.201 5.489 1.00 0.00 C ATOM 1405 OE1 GLN A 92 -20.535 -5.879 5.598 1.00 0.00 O ATOM 1406 NE2 GLN A 92 -18.926 -7.065 4.575 1.00 0.00 N ATOM 0 H GLN A 92 -16.152 -4.577 7.410 1.00 0.00 H new ATOM 0 HA GLN A 92 -18.214 -2.720 8.332 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -19.671 -4.043 6.870 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -18.241 -3.519 6.003 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -17.325 -5.668 5.922 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -18.233 -6.226 7.313 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -17.936 -7.303 4.521 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -19.589 -7.491 3.927 1.00 0.00 H new ATOM 1415 N PHE A 93 -17.657 -5.607 9.658 1.00 0.00 N ATOM 1416 CA PHE A 93 -18.034 -6.515 10.734 1.00 0.00 C ATOM 1417 C PHE A 93 -16.949 -6.570 11.806 1.00 0.00 C ATOM 1418 O PHE A 93 -17.190 -6.240 12.966 1.00 0.00 O ATOM 1419 CB PHE A 93 -18.290 -7.918 10.180 1.00 0.00 C ATOM 1420 CG PHE A 93 -19.284 -7.946 9.055 1.00 0.00 C ATOM 1421 CD1 PHE A 93 -20.536 -7.373 9.205 1.00 0.00 C ATOM 1422 CD2 PHE A 93 -18.966 -8.545 7.846 1.00 0.00 C ATOM 1423 CE1 PHE A 93 -21.454 -7.398 8.171 1.00 0.00 C ATOM 1424 CE2 PHE A 93 -19.879 -8.573 6.809 1.00 0.00 C ATOM 1425 CZ PHE A 93 -21.124 -7.997 6.971 1.00 0.00 C ATOM 0 H PHE A 93 -16.737 -5.788 9.256 1.00 0.00 H new ATOM 0 HA PHE A 93 -18.950 -6.138 11.188 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -17.347 -8.340 9.832 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -18.648 -8.559 10.986 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -20.798 -6.901 10.140 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -17.993 -8.995 7.713 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -22.428 -6.950 8.302 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -19.619 -9.045 5.873 1.00 0.00 H new ATOM 0 HZ PHE A 93 -21.838 -8.015 6.161 1.00 0.00 H new ATOM 1435 N GLY A 94 -15.752 -6.989 11.407 1.00 0.00 N ATOM 1436 CA GLY A 94 -14.647 -7.080 12.344 1.00 0.00 C ATOM 1437 C GLY A 94 -13.813 -8.329 12.137 1.00 0.00 C ATOM 1438 O GLY A 94 -14.349 -9.401 11.859 1.00 0.00 O ATOM 0 H GLY A 94 -15.528 -7.267 10.452 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -14.012 -6.201 12.238 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.036 -7.071 13.362 1.00 0.00 H new ATOM 1442 N GLU A 95 -12.498 -8.189 12.272 1.00 0.00 N ATOM 1443 CA GLU A 95 -11.589 -9.316 12.096 1.00 0.00 C ATOM 1444 C GLU A 95 -12.169 -10.585 12.714 1.00 0.00 C ATOM 1445 O GLU A 95 -12.040 -11.674 12.156 1.00 0.00 O ATOM 1446 CB GLU A 95 -10.229 -9.005 12.724 1.00 0.00 C ATOM 1447 CG GLU A 95 -9.574 -7.752 12.169 1.00 0.00 C ATOM 1448 CD GLU A 95 -8.661 -7.076 13.173 1.00 0.00 C ATOM 1449 OE1 GLU A 95 -9.167 -6.621 14.221 1.00 0.00 O ATOM 1450 OE2 GLU A 95 -7.442 -7.003 12.913 1.00 0.00 O ATOM 0 H GLU A 95 -12.039 -7.308 12.502 1.00 0.00 H new ATOM 0 HA GLU A 95 -11.458 -9.481 11.027 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.353 -8.893 13.801 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.563 -9.853 12.566 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.000 -8.010 11.279 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -10.347 -7.050 11.857 1.00 0.00 H new ATOM 1457 N GLU A 96 -12.808 -10.434 13.870 1.00 0.00 N ATOM 1458 CA GLU A 96 -13.406 -11.568 14.565 1.00 0.00 C ATOM 1459 C GLU A 96 -14.609 -12.106 13.794 1.00 0.00 C ATOM 1460 O GLU A 96 -14.831 -13.314 13.735 1.00 0.00 O ATOM 1461 CB GLU A 96 -13.832 -11.163 15.978 1.00 0.00 C ATOM 1462 CG GLU A 96 -14.542 -12.269 16.740 1.00 0.00 C ATOM 1463 CD GLU A 96 -14.759 -11.923 18.201 1.00 0.00 C ATOM 1464 OE1 GLU A 96 -13.756 -11.782 18.932 1.00 0.00 O ATOM 1465 OE2 GLU A 96 -15.931 -11.794 18.613 1.00 0.00 O ATOM 0 H GLU A 96 -12.925 -9.539 14.344 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.656 -12.356 14.632 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -12.950 -10.854 16.540 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -14.490 -10.296 15.916 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -15.505 -12.468 16.271 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -13.958 -13.186 16.670 1.00 0.00 H new ATOM 1472 N ASN A 97 -15.381 -11.198 13.205 1.00 0.00 N ATOM 1473 CA ASN A 97 -16.561 -11.580 12.439 1.00 0.00 C ATOM 1474 C ASN A 97 -16.167 -12.132 11.072 1.00 0.00 C ATOM 1475 O ASN A 97 -16.961 -12.799 10.408 1.00 0.00 O ATOM 1476 CB ASN A 97 -17.494 -10.379 12.267 1.00 0.00 C ATOM 1477 CG ASN A 97 -18.346 -10.129 13.496 1.00 0.00 C ATOM 1478 OD1 ASN A 97 -18.163 -9.135 14.200 1.00 0.00 O ATOM 1479 ND2 ASN A 97 -19.283 -11.032 13.760 1.00 0.00 N ATOM 0 H ASN A 97 -15.210 -10.193 13.244 1.00 0.00 H new ATOM 0 HA ASN A 97 -17.084 -12.362 12.990 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -16.901 -9.490 12.052 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -18.142 -10.546 11.407 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -19.887 -10.917 14.574 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -19.399 -11.840 13.149 1.00 0.00 H new ATOM 1486 N VAL A 98 -14.936 -11.849 10.658 1.00 0.00 N ATOM 1487 CA VAL A 98 -14.436 -12.318 9.372 1.00 0.00 C ATOM 1488 C VAL A 98 -14.275 -13.834 9.364 1.00 0.00 C ATOM 1489 O VAL A 98 -14.204 -14.455 8.305 1.00 0.00 O ATOM 1490 CB VAL A 98 -13.083 -11.668 9.025 1.00 0.00 C ATOM 1491 CG1 VAL A 98 -12.493 -12.298 7.772 1.00 0.00 C ATOM 1492 CG2 VAL A 98 -13.244 -10.165 8.851 1.00 0.00 C ATOM 0 H VAL A 98 -14.267 -11.297 11.195 1.00 0.00 H new ATOM 0 HA VAL A 98 -15.173 -12.030 8.622 1.00 0.00 H new ATOM 0 HB VAL A 98 -12.393 -11.844 9.850 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -11.538 -11.826 7.543 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -12.340 -13.364 7.938 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -13.178 -12.156 6.936 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -12.279 -9.722 8.606 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -13.950 -9.966 8.045 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -13.619 -9.730 9.777 1.00 0.00 H new ATOM 1502 N ASN A 99 -14.220 -14.424 10.554 1.00 0.00 N ATOM 1503 CA ASN A 99 -14.068 -15.868 10.685 1.00 0.00 C ATOM 1504 C ASN A 99 -15.401 -16.577 10.470 1.00 0.00 C ATOM 1505 O ASN A 99 -15.552 -17.373 9.542 1.00 0.00 O ATOM 1506 CB ASN A 99 -13.507 -16.220 12.064 1.00 0.00 C ATOM 1507 CG ASN A 99 -12.025 -15.920 12.180 1.00 0.00 C ATOM 1508 OD1 ASN A 99 -11.185 -16.801 11.993 1.00 0.00 O ATOM 1509 ND2 ASN A 99 -11.697 -14.671 12.489 1.00 0.00 N ATOM 0 H ASN A 99 -14.278 -13.924 11.441 1.00 0.00 H new ATOM 0 HA ASN A 99 -13.370 -16.205 9.919 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -14.049 -15.661 12.827 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -13.677 -17.278 12.263 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -10.715 -14.409 12.580 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -12.427 -13.973 12.635 1.00 0.00 H new ATOM 1516 N THR A 100 -16.368 -16.283 11.333 1.00 0.00 N ATOM 1517 CA THR A 100 -17.689 -16.892 11.239 1.00 0.00 C ATOM 1518 C THR A 100 -18.329 -16.609 9.884 1.00 0.00 C ATOM 1519 O THR A 100 -19.197 -17.355 9.430 1.00 0.00 O ATOM 1520 CB THR A 100 -18.623 -16.382 12.352 1.00 0.00 C ATOM 1521 OG1 THR A 100 -19.946 -16.895 12.155 1.00 0.00 O ATOM 1522 CG2 THR A 100 -18.662 -14.861 12.372 1.00 0.00 C ATOM 0 H THR A 100 -16.261 -15.626 12.106 1.00 0.00 H new ATOM 0 HA THR A 100 -17.551 -17.967 11.355 1.00 0.00 H new ATOM 0 HB THR A 100 -18.236 -16.732 13.309 1.00 0.00 H new ATOM 0 HG1 THR A 100 -20.533 -16.567 12.868 1.00 0.00 H new ATOM 0 HG21 THR A 100 -19.328 -14.525 13.166 1.00 0.00 H new ATOM 0 HG22 THR A 100 -17.659 -14.474 12.551 1.00 0.00 H new ATOM 0 HG23 THR A 100 -19.027 -14.494 11.413 1.00 0.00 H new ATOM 1530 N TYR A 101 -17.895 -15.529 9.244 1.00 0.00 N ATOM 1531 CA TYR A 101 -18.428 -15.147 7.942 1.00 0.00 C ATOM 1532 C TYR A 101 -17.859 -16.035 6.839 1.00 0.00 C ATOM 1533 O TYR A 101 -18.597 -16.560 6.005 1.00 0.00 O ATOM 1534 CB TYR A 101 -18.109 -13.681 7.647 1.00 0.00 C ATOM 1535 CG TYR A 101 -18.896 -13.110 6.489 1.00 0.00 C ATOM 1536 CD1 TYR A 101 -20.153 -12.551 6.686 1.00 0.00 C ATOM 1537 CD2 TYR A 101 -18.383 -13.130 5.198 1.00 0.00 C ATOM 1538 CE1 TYR A 101 -20.876 -12.030 5.631 1.00 0.00 C ATOM 1539 CE2 TYR A 101 -19.099 -12.610 4.137 1.00 0.00 C ATOM 1540 CZ TYR A 101 -20.345 -12.061 4.359 1.00 0.00 C ATOM 1541 OH TYR A 101 -21.062 -11.541 3.305 1.00 0.00 O ATOM 0 H TYR A 101 -17.176 -14.903 9.606 1.00 0.00 H new ATOM 0 HA TYR A 101 -19.510 -15.278 7.968 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -18.310 -13.088 8.539 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -17.044 -13.586 7.434 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -20.572 -12.524 7.681 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -17.408 -13.559 5.021 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -21.852 -11.601 5.801 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -18.686 -12.633 3.140 1.00 0.00 H new ATOM 0 HH TYR A 101 -20.546 -11.640 2.478 1.00 0.00 H new ATOM 1551 N PHE A 102 -16.540 -16.199 6.842 1.00 0.00 N ATOM 1552 CA PHE A 102 -15.870 -17.022 5.842 1.00 0.00 C ATOM 1553 C PHE A 102 -16.093 -18.506 6.122 1.00 0.00 C ATOM 1554 O PHE A 102 -15.752 -19.361 5.305 1.00 0.00 O ATOM 1555 CB PHE A 102 -14.371 -16.716 5.820 1.00 0.00 C ATOM 1556 CG PHE A 102 -14.017 -15.514 4.991 1.00 0.00 C ATOM 1557 CD1 PHE A 102 -14.619 -14.289 5.231 1.00 0.00 C ATOM 1558 CD2 PHE A 102 -13.084 -15.610 3.971 1.00 0.00 C ATOM 1559 CE1 PHE A 102 -14.295 -13.182 4.470 1.00 0.00 C ATOM 1560 CE2 PHE A 102 -12.756 -14.506 3.207 1.00 0.00 C ATOM 1561 CZ PHE A 102 -13.363 -13.291 3.456 1.00 0.00 C ATOM 0 H PHE A 102 -15.914 -15.773 7.526 1.00 0.00 H new ATOM 0 HA PHE A 102 -16.297 -16.785 4.867 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -14.026 -16.557 6.842 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -13.837 -17.584 5.434 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -15.349 -14.199 6.021 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -12.608 -16.558 3.771 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -14.770 -12.232 4.668 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -12.026 -14.593 2.416 1.00 0.00 H new ATOM 0 HZ PHE A 102 -13.110 -12.427 2.859 1.00 0.00 H new ATOM 1571 N VAL A 103 -16.668 -18.803 7.283 1.00 0.00 N ATOM 1572 CA VAL A 103 -16.937 -20.183 7.671 1.00 0.00 C ATOM 1573 C VAL A 103 -18.431 -20.483 7.631 1.00 0.00 C ATOM 1574 O VAL A 103 -19.235 -19.770 8.232 1.00 0.00 O ATOM 1575 CB VAL A 103 -16.403 -20.482 9.085 1.00 0.00 C ATOM 1576 CG1 VAL A 103 -17.248 -21.552 9.759 1.00 0.00 C ATOM 1577 CG2 VAL A 103 -14.943 -20.905 9.023 1.00 0.00 C ATOM 0 H VAL A 103 -16.956 -18.107 7.971 1.00 0.00 H new ATOM 0 HA VAL A 103 -16.421 -20.821 6.953 1.00 0.00 H new ATOM 0 HB VAL A 103 -16.470 -19.572 9.681 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.856 -21.750 10.757 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -18.279 -21.206 9.836 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -17.215 -22.467 9.168 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -14.581 -21.112 10.030 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -14.850 -21.803 8.412 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -14.350 -20.103 8.583 1.00 0.00 H new ATOM 1587 N SER A 104 -18.797 -21.543 6.918 1.00 0.00 N ATOM 1588 CA SER A 104 -20.196 -21.937 6.795 1.00 0.00 C ATOM 1589 C SER A 104 -20.546 -23.020 7.811 1.00 0.00 C ATOM 1590 O SER A 104 -20.207 -24.188 7.632 1.00 0.00 O ATOM 1591 CB SER A 104 -20.484 -22.439 5.379 1.00 0.00 C ATOM 1592 OG SER A 104 -21.868 -22.685 5.197 1.00 0.00 O ATOM 0 H SER A 104 -18.144 -22.145 6.416 1.00 0.00 H new ATOM 0 HA SER A 104 -20.813 -21.061 6.995 1.00 0.00 H new ATOM 0 HB2 SER A 104 -20.144 -21.701 4.652 1.00 0.00 H new ATOM 0 HB3 SER A 104 -19.921 -23.354 5.192 1.00 0.00 H new ATOM 0 HG SER A 104 -22.026 -23.003 4.284 1.00 0.00 H new ATOM 1598 N GLY A 105 -21.229 -22.620 8.881 1.00 0.00 N ATOM 1599 CA GLY A 105 -21.614 -23.567 9.911 1.00 0.00 C ATOM 1600 C GLY A 105 -23.065 -23.417 10.322 1.00 0.00 C ATOM 1601 O GLY A 105 -23.387 -22.756 11.310 1.00 0.00 O ATOM 0 H GLY A 105 -21.522 -21.658 9.052 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -21.445 -24.581 9.549 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -20.976 -23.429 10.784 1.00 0.00 H new ATOM 1605 N PRO A 106 -23.971 -24.039 9.553 1.00 0.00 N ATOM 1606 CA PRO A 106 -25.410 -23.985 9.823 1.00 0.00 C ATOM 1607 C PRO A 106 -25.795 -24.764 11.076 1.00 0.00 C ATOM 1608 O PRO A 106 -26.934 -24.695 11.537 1.00 0.00 O ATOM 1609 CB PRO A 106 -26.029 -24.630 8.580 1.00 0.00 C ATOM 1610 CG PRO A 106 -24.963 -25.523 8.047 1.00 0.00 C ATOM 1611 CD PRO A 106 -23.658 -24.844 8.360 1.00 0.00 C ATOM 0 HA PRO A 106 -25.752 -22.966 10.006 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -26.928 -25.193 8.832 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -26.319 -23.878 7.846 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -25.011 -26.508 8.511 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -25.078 -25.670 6.973 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -22.866 -25.566 8.559 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -23.320 -24.221 7.532 1.00 0.00 H new ATOM 1619 N SER A 107 -24.837 -25.507 11.622 1.00 0.00 N ATOM 1620 CA SER A 107 -25.077 -26.303 12.820 1.00 0.00 C ATOM 1621 C SER A 107 -24.286 -25.755 14.004 1.00 0.00 C ATOM 1622 O SER A 107 -23.730 -26.513 14.798 1.00 0.00 O ATOM 1623 CB SER A 107 -24.699 -27.764 12.572 1.00 0.00 C ATOM 1624 OG SER A 107 -25.382 -28.627 13.464 1.00 0.00 O ATOM 0 H SER A 107 -23.888 -25.574 11.254 1.00 0.00 H new ATOM 0 HA SER A 107 -26.139 -26.246 13.057 1.00 0.00 H new ATOM 0 HB2 SER A 107 -24.939 -28.035 11.544 1.00 0.00 H new ATOM 0 HB3 SER A 107 -23.623 -27.890 12.692 1.00 0.00 H new ATOM 0 HG SER A 107 -25.124 -29.555 13.283 1.00 0.00 H new ATOM 1630 N SER A 108 -24.240 -24.431 14.115 1.00 0.00 N ATOM 1631 CA SER A 108 -23.513 -23.779 15.199 1.00 0.00 C ATOM 1632 C SER A 108 -22.036 -24.159 15.168 1.00 0.00 C ATOM 1633 O SER A 108 -21.414 -24.364 16.209 1.00 0.00 O ATOM 1634 CB SER A 108 -24.121 -24.161 16.550 1.00 0.00 C ATOM 1635 OG SER A 108 -23.670 -23.293 17.576 1.00 0.00 O ATOM 0 H SER A 108 -24.697 -23.789 13.468 1.00 0.00 H new ATOM 0 HA SER A 108 -23.596 -22.701 15.062 1.00 0.00 H new ATOM 0 HB2 SER A 108 -25.208 -24.121 16.487 1.00 0.00 H new ATOM 0 HB3 SER A 108 -23.854 -25.189 16.795 1.00 0.00 H new ATOM 0 HG SER A 108 -22.690 -23.279 17.585 1.00 0.00 H new ATOM 1641 N GLY A 109 -21.480 -24.249 13.963 1.00 0.00 N ATOM 1642 CA GLY A 109 -20.080 -24.604 13.817 1.00 0.00 C ATOM 1643 C GLY A 109 -19.258 -23.483 13.213 1.00 0.00 C ATOM 1644 O GLY A 109 -18.045 -23.612 13.049 1.00 0.00 O ATOM 0 H GLY A 109 -21.974 -24.083 13.086 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -19.671 -24.865 14.793 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -19.997 -25.491 13.189 1.00 0.00 H new TER 1648 GLY A 109