USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1132 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 56 MET CE :methyl -121:sc= -1.36 (180deg=-2.78) USER MOD Set 1.2: A 123 MET CE :methyl -163:sc= -2.31! (180deg=-3.29) USER MOD Set 1.3: A 133 TYR OH : rot 165:sc=-0.00671 USER MOD Set 2.1: A 91 GLN : amide:sc= -1.98 K(o=-2.3,f=-3.7) USER MOD Set 2.2: A 95 ASN : amide:sc= -0.336 K(o=-2.3,f=-4!) USER MOD Set 3.1: A 33 SER OG : rot -95:sc= 1.27 USER MOD Set 3.2: A 75 HIS : no HD1:sc= -0.704 K(o=0.56,f=-0.28) USER MOD Set 4.1: A 26 TYR OH : rot 180:sc= 0.757 USER MOD Set 4.2: A 102 TYR OH : rot 29:sc= 0.389 USER MOD Single : A 1 ALA N :NH3+ -170:sc= -0.137 (180deg=-0.427) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.443 K(o=-0.44,f=-7.5!) USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 12 GLN : amide:sc= -0.257 K(o=-0.26,f=-5!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.965! C(o=-0.97!,f=-0.97!) USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HE2:sc= 0.0252 X(o=0.025,f=-0.17) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0.00226 X(o=0.0023,f=-0.21) USER MOD Single : A 37 HIS : no HD1:sc= -0.762 K(o=-0.76,f=-0.19) USER MOD Single : A 38 LYS NZ :NH3+ 173:sc= 0.589 (180deg=0.564) USER MOD Single : A 45 THR OG1 : rot -133:sc= 0.0638 USER MOD Single : A 47 SER OG : rot 170:sc= 0.183 USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 GLN : amide:sc= -0.0617 X(o=-0.062,f=-0.062) USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 63 SER OG : rot -81:sc= 0.276 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -178:sc= -0.0224 (180deg=-0.0275) USER MOD Single : A 68 HIS : no HD1:sc= -0.0166 X(o=-0.017,f=-0.22) USER MOD Single : A 73 HIS : no HD1:sc= -0.265 X(o=-0.26,f=-0.41) USER MOD Single : A 76 MET CE :methyl -153:sc= -0.134 (180deg=-1.79) USER MOD Single : A 83 GLN : amide:sc= -1.25! C(o=-1.2!,f=-2.7!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -0.26 K(o=-0.26,f=-3.3!) USER MOD Single : A 86 HIS : no HE2:sc= -1.11 K(o=-1.1,f=-4.9!) USER MOD Single : A 87 GLN : amide:sc= -1.44 K(o=-1.4,f=-0.25) USER MOD Single : A 93 GLN : amide:sc= -0.0745 X(o=-0.074,f=-0.55) USER MOD Single : A 94 LYS NZ :NH3+ -109:sc= -0.0868 (180deg=-0.796!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= -0.0122 K(o=-0.012,f=-1.8!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.113 K(o=-0.11,f=-2.4!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -163:sc= -0.0936 (180deg=-0.719) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 76:sc= 0.71 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 170.113 4.187 -16.579 1.00 1.00 N ATOM 2 CA ALA A 1 169.764 2.775 -16.461 1.00 1.00 C ATOM 3 C ALA A 1 168.870 2.560 -15.248 1.00 1.00 C ATOM 4 O ALA A 1 168.195 1.537 -15.124 1.00 1.00 O ATOM 5 CB ALA A 1 171.031 1.934 -16.312 1.00 1.00 C ATOM 0 H1 ALA A 1 170.578 4.354 -17.494 1.00 1.00 H new ATOM 0 H2 ALA A 1 169.250 4.764 -16.518 1.00 1.00 H new ATOM 0 H3 ALA A 1 170.760 4.450 -15.809 1.00 1.00 H new ATOM 0 HA ALA A 1 169.231 2.469 -17.362 1.00 1.00 H new ATOM 0 HB1 ALA A 1 170.761 0.882 -16.225 1.00 1.00 H new ATOM 0 HB2 ALA A 1 171.666 2.074 -17.187 1.00 1.00 H new ATOM 0 HB3 ALA A 1 171.571 2.245 -15.418 1.00 1.00 H new ATOM 11 N ARG A 2 168.881 3.542 -14.357 1.00 1.00 N ATOM 12 CA ARG A 2 168.079 3.486 -13.142 1.00 1.00 C ATOM 13 C ARG A 2 167.312 4.794 -12.967 1.00 1.00 C ATOM 14 O ARG A 2 167.825 5.865 -13.289 1.00 1.00 O ATOM 15 CB ARG A 2 168.993 3.266 -11.934 1.00 1.00 C ATOM 16 CG ARG A 2 169.624 1.874 -12.007 1.00 1.00 C ATOM 17 CD ARG A 2 170.536 1.667 -10.795 1.00 1.00 C ATOM 18 NE ARG A 2 171.169 0.357 -10.852 1.00 1.00 N ATOM 19 CZ ARG A 2 171.700 -0.198 -9.766 1.00 1.00 C ATOM 20 NH1 ARG A 2 171.658 0.435 -8.625 1.00 1.00 N ATOM 21 NH2 ARG A 2 172.259 -1.375 -9.843 1.00 1.00 N ATOM 0 H ARG A 2 169.439 4.390 -14.453 1.00 1.00 H new ATOM 0 HA ARG A 2 167.371 2.661 -13.219 1.00 1.00 H new ATOM 0 HB2 ARG A 2 169.772 4.028 -11.913 1.00 1.00 H new ATOM 0 HB3 ARG A 2 168.422 3.368 -11.011 1.00 1.00 H new ATOM 0 HG2 ARG A 2 168.846 1.110 -12.026 1.00 1.00 H new ATOM 0 HG3 ARG A 2 170.196 1.769 -12.929 1.00 1.00 H new ATOM 0 HD2 ARG A 2 171.299 2.445 -10.769 1.00 1.00 H new ATOM 0 HD3 ARG A 2 169.956 1.758 -9.876 1.00 1.00 H new ATOM 0 HE ARG A 2 171.206 -0.144 -11.740 1.00 1.00 H new ATOM 0 HH11 ARG A 2 171.218 1.354 -8.567 1.00 1.00 H new ATOM 0 HH12 ARG A 2 172.065 0.011 -7.791 1.00 1.00 H new ATOM 0 HH21 ARG A 2 172.288 -1.868 -10.735 1.00 1.00 H new ATOM 0 HH22 ARG A 2 172.666 -1.801 -9.011 1.00 1.00 H new ATOM 35 N ARG A 3 166.089 4.709 -12.453 1.00 1.00 N ATOM 36 CA ARG A 3 165.283 5.909 -12.242 1.00 1.00 C ATOM 37 C ARG A 3 165.410 6.382 -10.795 1.00 1.00 C ATOM 38 O ARG A 3 165.371 5.577 -9.865 1.00 1.00 O ATOM 39 CB ARG A 3 163.813 5.624 -12.575 1.00 1.00 C ATOM 40 CG ARG A 3 163.664 5.427 -14.089 1.00 1.00 C ATOM 41 CD ARG A 3 162.210 5.087 -14.428 1.00 1.00 C ATOM 42 NE ARG A 3 162.070 4.859 -15.863 1.00 1.00 N ATOM 43 CZ ARG A 3 160.873 4.801 -16.441 1.00 1.00 C ATOM 44 NH1 ARG A 3 159.793 4.967 -15.729 1.00 1.00 N ATOM 45 NH2 ARG A 3 160.782 4.577 -17.724 1.00 1.00 N ATOM 0 H ARG A 3 165.638 3.836 -12.178 1.00 1.00 H new ATOM 0 HA ARG A 3 165.648 6.696 -12.902 1.00 1.00 H new ATOM 0 HB2 ARG A 3 163.475 4.733 -12.046 1.00 1.00 H new ATOM 0 HB3 ARG A 3 163.186 6.451 -12.241 1.00 1.00 H new ATOM 0 HG2 ARG A 3 163.967 6.333 -14.614 1.00 1.00 H new ATOM 0 HG3 ARG A 3 164.322 4.627 -14.427 1.00 1.00 H new ATOM 0 HD2 ARG A 3 161.898 4.199 -13.879 1.00 1.00 H new ATOM 0 HD3 ARG A 3 161.556 5.901 -14.116 1.00 1.00 H new ATOM 0 HE ARG A 3 162.907 4.742 -16.434 1.00 1.00 H new ATOM 0 HH11 ARG A 3 159.865 5.142 -14.727 1.00 1.00 H new ATOM 0 HH12 ARG A 3 158.877 4.922 -16.175 1.00 1.00 H new ATOM 0 HH21 ARG A 3 161.627 4.447 -18.280 1.00 1.00 H new ATOM 0 HH22 ARG A 3 159.866 4.532 -18.170 1.00 1.00 H new ATOM 59 N ARG A 4 165.577 7.691 -10.612 1.00 1.00 N ATOM 60 CA ARG A 4 165.728 8.250 -9.270 1.00 1.00 C ATOM 61 C ARG A 4 164.473 7.999 -8.446 1.00 1.00 C ATOM 62 O ARG A 4 164.549 7.687 -7.257 1.00 1.00 O ATOM 63 CB ARG A 4 165.970 9.761 -9.342 1.00 1.00 C ATOM 64 CG ARG A 4 167.361 10.041 -9.917 1.00 1.00 C ATOM 65 CD ARG A 4 167.590 11.555 -9.992 1.00 1.00 C ATOM 66 NE ARG A 4 168.916 11.834 -10.535 1.00 1.00 N ATOM 67 CZ ARG A 4 169.321 13.080 -10.768 1.00 1.00 C ATOM 68 NH1 ARG A 4 168.531 14.087 -10.510 1.00 1.00 N ATOM 69 NH2 ARG A 4 170.512 13.296 -11.254 1.00 1.00 N ATOM 0 H ARG A 4 165.611 8.377 -11.366 1.00 1.00 H new ATOM 0 HA ARG A 4 166.582 7.763 -8.800 1.00 1.00 H new ATOM 0 HB2 ARG A 4 165.209 10.230 -9.965 1.00 1.00 H new ATOM 0 HB3 ARG A 4 165.883 10.199 -8.348 1.00 1.00 H new ATOM 0 HG2 ARG A 4 168.124 9.578 -9.292 1.00 1.00 H new ATOM 0 HG3 ARG A 4 167.451 9.600 -10.910 1.00 1.00 H new ATOM 0 HD2 ARG A 4 166.827 12.016 -10.619 1.00 1.00 H new ATOM 0 HD3 ARG A 4 167.495 11.995 -8.999 1.00 1.00 H new ATOM 0 HE ARG A 4 169.545 11.058 -10.740 1.00 1.00 H new ATOM 0 HH11 ARG A 4 167.600 13.920 -10.128 1.00 1.00 H new ATOM 0 HH12 ARG A 4 168.845 15.041 -10.690 1.00 1.00 H new ATOM 0 HH21 ARG A 4 171.131 12.511 -11.455 1.00 1.00 H new ATOM 0 HH22 ARG A 4 170.824 14.250 -11.433 1.00 1.00 H new ATOM 83 N ALA A 5 163.321 8.149 -9.084 1.00 1.00 N ATOM 84 CA ALA A 5 162.051 7.949 -8.402 1.00 1.00 C ATOM 85 C ALA A 5 161.715 6.466 -8.300 1.00 1.00 C ATOM 86 O ALA A 5 160.869 5.957 -9.036 1.00 1.00 O ATOM 87 CB ALA A 5 160.940 8.682 -9.152 1.00 1.00 C ATOM 0 H ALA A 5 163.240 8.407 -10.067 1.00 1.00 H new ATOM 0 HA ALA A 5 162.136 8.351 -7.393 1.00 1.00 H new ATOM 0 HB1 ALA A 5 159.991 8.529 -8.637 1.00 1.00 H new ATOM 0 HB2 ALA A 5 161.166 9.748 -9.187 1.00 1.00 H new ATOM 0 HB3 ALA A 5 160.869 8.293 -10.168 1.00 1.00 H new ATOM 93 N SER A 6 162.377 5.782 -7.372 1.00 1.00 N ATOM 94 CA SER A 6 162.139 4.359 -7.164 1.00 1.00 C ATOM 95 C SER A 6 160.685 4.129 -6.760 1.00 1.00 C ATOM 96 O SER A 6 160.075 3.129 -7.140 1.00 1.00 O ATOM 97 CB SER A 6 163.073 3.824 -6.075 1.00 1.00 C ATOM 98 OG SER A 6 164.422 3.915 -6.522 1.00 1.00 O ATOM 0 H SER A 6 163.080 6.189 -6.755 1.00 1.00 H new ATOM 0 HA SER A 6 162.339 3.827 -8.094 1.00 1.00 H new ATOM 0 HB2 SER A 6 162.943 4.396 -5.156 1.00 1.00 H new ATOM 0 HB3 SER A 6 162.824 2.788 -5.844 1.00 1.00 H new ATOM 0 HG SER A 6 165.021 3.574 -5.825 1.00 1.00 H new ATOM 104 N GLY A 7 160.144 5.060 -5.982 1.00 1.00 N ATOM 105 CA GLY A 7 158.763 4.953 -5.523 1.00 1.00 C ATOM 106 C GLY A 7 157.812 5.736 -6.427 1.00 1.00 C ATOM 107 O GLY A 7 158.241 6.394 -7.374 1.00 1.00 O ATOM 0 H GLY A 7 160.636 5.892 -5.657 1.00 1.00 H new ATOM 0 HA2 GLY A 7 158.466 3.905 -5.501 1.00 1.00 H new ATOM 0 HA3 GLY A 7 158.687 5.327 -4.502 1.00 1.00 H new ATOM 111 N GLU A 8 156.521 5.657 -6.119 1.00 1.00 N ATOM 112 CA GLU A 8 155.502 6.359 -6.898 1.00 1.00 C ATOM 113 C GLU A 8 155.715 7.870 -6.814 1.00 1.00 C ATOM 114 O GLU A 8 156.199 8.380 -5.804 1.00 1.00 O ATOM 115 CB GLU A 8 154.111 5.996 -6.362 1.00 1.00 C ATOM 116 CG GLU A 8 153.025 6.676 -7.200 1.00 1.00 C ATOM 117 CD GLU A 8 151.648 6.319 -6.650 1.00 1.00 C ATOM 118 OE1 GLU A 8 151.564 5.366 -5.891 1.00 1.00 O ATOM 119 OE2 GLU A 8 150.699 7.008 -6.989 1.00 1.00 O ATOM 0 H GLU A 8 156.154 5.115 -5.337 1.00 1.00 H new ATOM 0 HA GLU A 8 155.580 6.056 -7.942 1.00 1.00 H new ATOM 0 HB2 GLU A 8 153.975 4.915 -6.386 1.00 1.00 H new ATOM 0 HB3 GLU A 8 154.023 6.305 -5.320 1.00 1.00 H new ATOM 0 HG2 GLU A 8 153.164 7.757 -7.184 1.00 1.00 H new ATOM 0 HG3 GLU A 8 153.104 6.360 -8.240 1.00 1.00 H new ATOM 126 N ASN A 9 155.353 8.581 -7.881 1.00 1.00 N ATOM 127 CA ASN A 9 155.518 10.033 -7.909 1.00 1.00 C ATOM 128 C ASN A 9 154.707 10.688 -6.790 1.00 1.00 C ATOM 129 O ASN A 9 153.512 10.431 -6.635 1.00 1.00 O ATOM 130 CB ASN A 9 155.072 10.591 -9.262 1.00 1.00 C ATOM 131 CG ASN A 9 155.527 12.041 -9.407 1.00 1.00 C ATOM 132 OD1 ASN A 9 156.016 12.637 -8.447 1.00 1.00 O ATOM 133 ND2 ASN A 9 155.392 12.647 -10.554 1.00 1.00 N ATOM 0 H ASN A 9 154.948 8.181 -8.728 1.00 1.00 H new ATOM 0 HA ASN A 9 156.574 10.259 -7.758 1.00 1.00 H new ATOM 0 HB2 ASN A 9 155.490 9.988 -10.068 1.00 1.00 H new ATOM 0 HB3 ASN A 9 153.987 10.532 -9.349 1.00 1.00 H new ATOM 0 HD21 ASN A 9 155.692 13.616 -10.657 1.00 1.00 H new ATOM 0 HD22 ASN A 9 154.987 12.151 -11.348 1.00 1.00 H new ATOM 140 N LEU A 10 155.378 11.528 -6.011 1.00 1.00 N ATOM 141 CA LEU A 10 154.746 12.224 -4.895 1.00 1.00 C ATOM 142 C LEU A 10 153.667 13.191 -5.384 1.00 1.00 C ATOM 143 O LEU A 10 152.613 13.324 -4.764 1.00 1.00 O ATOM 144 CB LEU A 10 155.816 12.986 -4.103 1.00 1.00 C ATOM 145 CG LEU A 10 155.203 13.661 -2.872 1.00 1.00 C ATOM 146 CD1 LEU A 10 154.595 12.608 -1.941 1.00 1.00 C ATOM 147 CD2 LEU A 10 156.303 14.416 -2.125 1.00 1.00 C ATOM 0 H LEU A 10 156.367 11.745 -6.133 1.00 1.00 H new ATOM 0 HA LEU A 10 154.265 11.486 -4.252 1.00 1.00 H new ATOM 0 HB2 LEU A 10 156.603 12.299 -3.793 1.00 1.00 H new ATOM 0 HB3 LEU A 10 156.282 13.737 -4.741 1.00 1.00 H new ATOM 0 HG LEU A 10 154.419 14.349 -3.190 1.00 1.00 H new ATOM 0 HD11 LEU A 10 154.162 13.099 -1.069 1.00 1.00 H new ATOM 0 HD12 LEU A 10 153.817 12.059 -2.472 1.00 1.00 H new ATOM 0 HD13 LEU A 10 155.372 11.915 -1.618 1.00 1.00 H new ATOM 0 HD21 LEU A 10 155.879 14.901 -1.246 1.00 1.00 H new ATOM 0 HD22 LEU A 10 157.078 13.716 -1.814 1.00 1.00 H new ATOM 0 HD23 LEU A 10 156.737 15.170 -2.782 1.00 1.00 H new ATOM 159 N GLN A 11 153.944 13.871 -6.493 1.00 1.00 N ATOM 160 CA GLN A 11 152.991 14.831 -7.044 1.00 1.00 C ATOM 161 C GLN A 11 151.677 14.147 -7.399 1.00 1.00 C ATOM 162 O GLN A 11 150.601 14.705 -7.187 1.00 1.00 O ATOM 163 CB GLN A 11 153.574 15.492 -8.301 1.00 1.00 C ATOM 164 CG GLN A 11 152.583 16.528 -8.845 1.00 1.00 C ATOM 165 CD GLN A 11 153.165 17.214 -10.076 1.00 1.00 C ATOM 166 OE1 GLN A 11 154.383 17.251 -10.249 1.00 1.00 O ATOM 167 NE2 GLN A 11 152.360 17.750 -10.951 1.00 1.00 N ATOM 0 H GLN A 11 154.810 13.777 -7.023 1.00 1.00 H new ATOM 0 HA GLN A 11 152.800 15.590 -6.286 1.00 1.00 H new ATOM 0 HB2 GLN A 11 154.524 15.972 -8.064 1.00 1.00 H new ATOM 0 HB3 GLN A 11 153.779 14.737 -9.060 1.00 1.00 H new ATOM 0 HG2 GLN A 11 151.641 16.042 -9.101 1.00 1.00 H new ATOM 0 HG3 GLN A 11 152.361 17.269 -8.077 1.00 1.00 H new ATOM 0 HE21 GLN A 11 151.351 17.717 -10.803 1.00 1.00 H new ATOM 0 HE22 GLN A 11 152.739 18.202 -11.783 1.00 1.00 H new ATOM 176 N GLN A 12 151.766 12.945 -7.953 1.00 1.00 N ATOM 177 CA GLN A 12 150.568 12.218 -8.340 1.00 1.00 C ATOM 178 C GLN A 12 149.920 11.572 -7.122 1.00 1.00 C ATOM 179 O GLN A 12 150.558 10.802 -6.405 1.00 1.00 O ATOM 180 CB GLN A 12 150.922 11.141 -9.366 1.00 1.00 C ATOM 181 CG GLN A 12 151.391 11.805 -10.663 1.00 1.00 C ATOM 182 CD GLN A 12 151.858 10.745 -11.654 1.00 1.00 C ATOM 183 OE1 GLN A 12 152.879 10.095 -11.435 1.00 1.00 O ATOM 184 NE2 GLN A 12 151.158 10.523 -12.732 1.00 1.00 N ATOM 0 H GLN A 12 152.643 12.460 -8.142 1.00 1.00 H new ATOM 0 HA GLN A 12 149.862 12.922 -8.782 1.00 1.00 H new ATOM 0 HB2 GLN A 12 151.705 10.493 -8.973 1.00 1.00 H new ATOM 0 HB3 GLN A 12 150.055 10.510 -9.561 1.00 1.00 H new ATOM 0 HG2 GLN A 12 150.578 12.387 -11.097 1.00 1.00 H new ATOM 0 HG3 GLN A 12 152.204 12.500 -10.452 1.00 1.00 H new ATOM 0 HE21 GLN A 12 150.312 11.064 -12.911 1.00 1.00 H new ATOM 0 HE22 GLN A 12 151.457 9.809 -13.396 1.00 1.00 H new ATOM 193 N THR A 13 148.650 11.888 -6.901 1.00 1.00 N ATOM 194 CA THR A 13 147.916 11.329 -5.774 1.00 1.00 C ATOM 195 C THR A 13 146.603 10.729 -6.263 1.00 1.00 C ATOM 196 O THR A 13 145.821 11.396 -6.944 1.00 1.00 O ATOM 197 CB THR A 13 147.659 12.416 -4.727 1.00 1.00 C ATOM 198 OG1 THR A 13 148.903 12.963 -4.309 1.00 1.00 O ATOM 199 CG2 THR A 13 146.942 11.812 -3.521 1.00 1.00 C ATOM 0 H THR A 13 148.109 12.526 -7.485 1.00 1.00 H new ATOM 0 HA THR A 13 148.508 10.540 -5.311 1.00 1.00 H new ATOM 0 HB THR A 13 147.036 13.198 -5.161 1.00 1.00 H new ATOM 0 HG1 THR A 13 148.745 13.661 -3.640 1.00 1.00 H new ATOM 0 HG21 THR A 13 146.761 12.589 -2.778 1.00 1.00 H new ATOM 0 HG22 THR A 13 145.991 11.386 -3.839 1.00 1.00 H new ATOM 0 HG23 THR A 13 147.562 11.029 -3.084 1.00 1.00 H new ATOM 207 N ARG A 14 146.379 9.466 -5.927 1.00 1.00 N ATOM 208 CA ARG A 14 145.172 8.770 -6.350 1.00 1.00 C ATOM 209 C ARG A 14 144.544 8.012 -5.177 1.00 1.00 C ATOM 210 O ARG A 14 144.706 6.799 -5.055 1.00 1.00 O ATOM 211 CB ARG A 14 145.528 7.794 -7.471 1.00 1.00 C ATOM 212 CG ARG A 14 146.618 8.410 -8.350 1.00 1.00 C ATOM 213 CD ARG A 14 146.810 7.544 -9.593 1.00 1.00 C ATOM 214 NE ARG A 14 148.222 7.471 -9.955 1.00 1.00 N ATOM 215 CZ ARG A 14 148.596 7.036 -11.153 1.00 1.00 C ATOM 216 NH1 ARG A 14 147.690 6.737 -12.043 1.00 1.00 N ATOM 217 NH2 ARG A 14 149.862 6.917 -11.446 1.00 1.00 N ATOM 0 H ARG A 14 147.016 8.903 -5.364 1.00 1.00 H new ATOM 0 HA ARG A 14 144.447 9.500 -6.710 1.00 1.00 H new ATOM 0 HB2 ARG A 14 145.874 6.850 -7.051 1.00 1.00 H new ATOM 0 HB3 ARG A 14 144.645 7.572 -8.069 1.00 1.00 H new ATOM 0 HG2 ARG A 14 146.340 9.424 -8.638 1.00 1.00 H new ATOM 0 HG3 ARG A 14 147.553 8.482 -7.794 1.00 1.00 H new ATOM 0 HD2 ARG A 14 146.424 6.542 -9.408 1.00 1.00 H new ATOM 0 HD3 ARG A 14 146.237 7.958 -10.423 1.00 1.00 H new ATOM 0 HE ARG A 14 148.931 7.758 -9.280 1.00 1.00 H new ATOM 0 HH11 ARG A 14 146.700 6.838 -11.817 1.00 1.00 H new ATOM 0 HH12 ARG A 14 147.971 6.403 -12.965 1.00 1.00 H new ATOM 0 HH21 ARG A 14 150.571 7.159 -10.753 1.00 1.00 H new ATOM 0 HH22 ARG A 14 150.143 6.582 -12.368 1.00 1.00 H new ATOM 231 N PRO A 15 143.845 8.700 -4.309 1.00 1.00 N ATOM 232 CA PRO A 15 143.198 8.071 -3.125 1.00 1.00 C ATOM 233 C PRO A 15 141.892 7.371 -3.485 1.00 1.00 C ATOM 234 O PRO A 15 141.219 7.752 -4.442 1.00 1.00 O ATOM 235 CB PRO A 15 142.944 9.258 -2.198 1.00 1.00 C ATOM 236 CG PRO A 15 142.717 10.410 -3.117 1.00 1.00 C ATOM 237 CD PRO A 15 143.578 10.151 -4.357 1.00 1.00 C ATOM 0 HA PRO A 15 143.816 7.292 -2.679 1.00 1.00 H new ATOM 0 HB2 PRO A 15 142.078 9.084 -1.559 1.00 1.00 H new ATOM 0 HB3 PRO A 15 143.795 9.437 -1.540 1.00 1.00 H new ATOM 0 HG2 PRO A 15 141.664 10.491 -3.386 1.00 1.00 H new ATOM 0 HG3 PRO A 15 142.997 11.349 -2.639 1.00 1.00 H new ATOM 0 HD2 PRO A 15 143.055 10.431 -5.272 1.00 1.00 H new ATOM 0 HD3 PRO A 15 144.502 10.728 -4.329 1.00 1.00 H new ATOM 245 N ILE A 16 141.526 6.364 -2.701 1.00 1.00 N ATOM 246 CA ILE A 16 140.284 5.641 -2.943 1.00 1.00 C ATOM 247 C ILE A 16 139.096 6.583 -2.788 1.00 1.00 C ATOM 248 O ILE A 16 138.177 6.582 -3.607 1.00 1.00 O ATOM 249 CB ILE A 16 140.166 4.469 -1.964 1.00 1.00 C ATOM 250 CG1 ILE A 16 141.198 3.401 -2.337 1.00 1.00 C ATOM 251 CG2 ILE A 16 138.757 3.877 -2.022 1.00 1.00 C ATOM 252 CD1 ILE A 16 141.272 2.346 -1.233 1.00 1.00 C ATOM 0 H ILE A 16 142.065 6.032 -1.901 1.00 1.00 H new ATOM 0 HA ILE A 16 140.289 5.250 -3.960 1.00 1.00 H new ATOM 0 HB ILE A 16 140.354 4.821 -0.950 1.00 1.00 H new ATOM 0 HG12 ILE A 16 140.925 2.933 -3.283 1.00 1.00 H new ATOM 0 HG13 ILE A 16 142.176 3.861 -2.480 1.00 1.00 H new ATOM 0 HG21 ILE A 16 138.683 3.044 -1.322 1.00 1.00 H new ATOM 0 HG22 ILE A 16 138.029 4.643 -1.753 1.00 1.00 H new ATOM 0 HG23 ILE A 16 138.553 3.521 -3.032 1.00 1.00 H new ATOM 0 HD11 ILE A 16 142.008 1.588 -1.503 1.00 1.00 H new ATOM 0 HD12 ILE A 16 141.566 2.820 -0.296 1.00 1.00 H new ATOM 0 HD13 ILE A 16 140.296 1.877 -1.112 1.00 1.00 H new ATOM 264 N ALA A 17 139.131 7.403 -1.742 1.00 1.00 N ATOM 265 CA ALA A 17 138.062 8.363 -1.499 1.00 1.00 C ATOM 266 C ALA A 17 138.611 9.595 -0.791 1.00 1.00 C ATOM 267 O ALA A 17 139.563 9.504 -0.016 1.00 1.00 O ATOM 268 CB ALA A 17 136.958 7.732 -0.651 1.00 1.00 C ATOM 0 H ALA A 17 139.883 7.422 -1.054 1.00 1.00 H new ATOM 0 HA ALA A 17 137.643 8.659 -2.461 1.00 1.00 H new ATOM 0 HB1 ALA A 17 136.168 8.463 -0.479 1.00 1.00 H new ATOM 0 HB2 ALA A 17 136.546 6.869 -1.174 1.00 1.00 H new ATOM 0 HB3 ALA A 17 137.371 7.413 0.306 1.00 1.00 H new ATOM 274 N ALA A 18 138.013 10.748 -1.064 1.00 1.00 N ATOM 275 CA ALA A 18 138.465 11.984 -0.444 1.00 1.00 C ATOM 276 C ALA A 18 137.322 12.986 -0.313 1.00 1.00 C ATOM 277 O ALA A 18 137.555 14.177 -0.110 1.00 1.00 O ATOM 278 CB ALA A 18 139.596 12.597 -1.274 1.00 1.00 C ATOM 0 H ALA A 18 137.224 10.852 -1.702 1.00 1.00 H new ATOM 0 HA ALA A 18 138.829 11.749 0.556 1.00 1.00 H new ATOM 0 HB1 ALA A 18 139.931 13.522 -0.805 1.00 1.00 H new ATOM 0 HB2 ALA A 18 140.429 11.896 -1.328 1.00 1.00 H new ATOM 0 HB3 ALA A 18 139.235 12.810 -2.280 1.00 1.00 H new ATOM 284 N ALA A 19 136.089 12.498 -0.424 1.00 1.00 N ATOM 285 CA ALA A 19 134.928 13.369 -0.302 1.00 1.00 C ATOM 286 C ALA A 19 134.749 13.804 1.147 1.00 1.00 C ATOM 287 O ALA A 19 134.967 13.018 2.071 1.00 1.00 O ATOM 288 CB ALA A 19 133.666 12.648 -0.781 1.00 1.00 C ATOM 0 H ALA A 19 135.871 11.516 -0.596 1.00 1.00 H new ATOM 0 HA ALA A 19 135.091 14.249 -0.924 1.00 1.00 H new ATOM 0 HB1 ALA A 19 132.808 13.313 -0.683 1.00 1.00 H new ATOM 0 HB2 ALA A 19 133.785 12.361 -1.826 1.00 1.00 H new ATOM 0 HB3 ALA A 19 133.505 11.756 -0.176 1.00 1.00 H new ATOM 294 N ASN A 20 134.366 15.059 1.339 1.00 1.00 N ATOM 295 CA ASN A 20 134.176 15.595 2.683 1.00 1.00 C ATOM 296 C ASN A 20 132.694 15.694 3.038 1.00 1.00 C ATOM 297 O ASN A 20 132.325 16.278 4.056 1.00 1.00 O ATOM 298 CB ASN A 20 134.846 16.965 2.782 1.00 1.00 C ATOM 299 CG ASN A 20 134.593 17.581 4.153 1.00 1.00 C ATOM 300 OD1 ASN A 20 134.889 16.966 5.177 1.00 1.00 O ATOM 301 ND2 ASN A 20 134.060 18.769 4.232 1.00 1.00 N ATOM 0 H ASN A 20 134.181 15.723 0.587 1.00 1.00 H new ATOM 0 HA ASN A 20 134.637 14.914 3.398 1.00 1.00 H new ATOM 0 HB2 ASN A 20 135.918 16.866 2.613 1.00 1.00 H new ATOM 0 HB3 ASN A 20 134.460 17.623 2.003 1.00 1.00 H new ATOM 0 HD21 ASN A 20 133.887 19.191 5.144 1.00 1.00 H new ATOM 0 HD22 ASN A 20 133.816 19.276 3.381 1.00 1.00 H new ATOM 308 N LEU A 21 131.854 15.116 2.190 1.00 1.00 N ATOM 309 CA LEU A 21 130.404 15.130 2.401 1.00 1.00 C ATOM 310 C LEU A 21 130.022 14.105 3.465 1.00 1.00 C ATOM 311 O LEU A 21 130.538 12.986 3.492 1.00 1.00 O ATOM 312 CB LEU A 21 129.678 14.809 1.089 1.00 1.00 C ATOM 313 CG LEU A 21 128.185 15.182 1.200 1.00 1.00 C ATOM 314 CD1 LEU A 21 127.994 16.686 0.944 1.00 1.00 C ATOM 315 CD2 LEU A 21 127.366 14.404 0.159 1.00 1.00 C ATOM 0 H LEU A 21 132.149 14.628 1.344 1.00 1.00 H new ATOM 0 HA LEU A 21 130.108 16.123 2.738 1.00 1.00 H new ATOM 0 HB2 LEU A 21 130.137 15.358 0.267 1.00 1.00 H new ATOM 0 HB3 LEU A 21 129.779 13.748 0.859 1.00 1.00 H new ATOM 0 HG LEU A 21 127.845 14.930 2.204 1.00 1.00 H new ATOM 0 HD11 LEU A 21 126.936 16.937 1.025 1.00 1.00 H new ATOM 0 HD12 LEU A 21 128.560 17.255 1.681 1.00 1.00 H new ATOM 0 HD13 LEU A 21 128.350 16.933 -0.056 1.00 1.00 H new ATOM 0 HD21 LEU A 21 126.314 14.675 0.247 1.00 1.00 H new ATOM 0 HD22 LEU A 21 127.722 14.650 -0.842 1.00 1.00 H new ATOM 0 HD23 LEU A 21 127.480 13.334 0.332 1.00 1.00 H new ATOM 327 N GLN A 22 129.107 14.513 4.330 1.00 1.00 N ATOM 328 CA GLN A 22 128.640 13.640 5.402 1.00 1.00 C ATOM 329 C GLN A 22 127.285 13.041 5.043 1.00 1.00 C ATOM 330 O GLN A 22 126.265 13.730 5.055 1.00 1.00 O ATOM 331 CB GLN A 22 128.524 14.444 6.690 1.00 1.00 C ATOM 332 CG GLN A 22 129.899 15.006 7.035 1.00 1.00 C ATOM 333 CD GLN A 22 129.811 15.901 8.265 1.00 1.00 C ATOM 334 OE1 GLN A 22 128.753 16.007 8.884 1.00 1.00 O ATOM 335 NE2 GLN A 22 130.869 16.555 8.655 1.00 1.00 N ATOM 0 H GLN A 22 128.674 15.436 4.314 1.00 1.00 H new ATOM 0 HA GLN A 22 129.354 12.828 5.540 1.00 1.00 H new ATOM 0 HB2 GLN A 22 127.804 15.253 6.568 1.00 1.00 H new ATOM 0 HB3 GLN A 22 128.159 13.812 7.500 1.00 1.00 H new ATOM 0 HG2 GLN A 22 130.597 14.190 7.220 1.00 1.00 H new ATOM 0 HG3 GLN A 22 130.290 15.574 6.191 1.00 1.00 H new ATOM 0 HE21 GLN A 22 131.744 16.464 8.139 1.00 1.00 H new ATOM 0 HE22 GLN A 22 130.822 17.158 9.477 1.00 1.00 H new ATOM 344 N TRP A 23 127.276 11.745 4.743 1.00 1.00 N ATOM 345 CA TRP A 23 126.031 11.068 4.405 1.00 1.00 C ATOM 346 C TRP A 23 125.240 10.771 5.669 1.00 1.00 C ATOM 347 O TRP A 23 125.785 10.343 6.686 1.00 1.00 O ATOM 348 CB TRP A 23 126.332 9.761 3.674 1.00 1.00 C ATOM 349 CG TRP A 23 127.338 10.021 2.604 1.00 1.00 C ATOM 350 CD1 TRP A 23 127.286 11.044 1.720 1.00 1.00 C ATOM 351 CD2 TRP A 23 128.545 9.270 2.292 1.00 1.00 C ATOM 352 NE1 TRP A 23 128.386 10.965 0.885 1.00 1.00 N ATOM 353 CE2 TRP A 23 129.187 9.888 1.197 1.00 1.00 C ATOM 354 CE3 TRP A 23 129.136 8.120 2.844 1.00 1.00 C ATOM 355 CZ2 TRP A 23 130.376 9.394 0.670 1.00 1.00 C ATOM 356 CZ3 TRP A 23 130.336 7.614 2.316 1.00 1.00 C ATOM 357 CH2 TRP A 23 130.953 8.249 1.228 1.00 1.00 C ATOM 0 H TRP A 23 128.105 11.151 4.727 1.00 1.00 H new ATOM 0 HA TRP A 23 125.442 11.718 3.757 1.00 1.00 H new ATOM 0 HB2 TRP A 23 126.712 9.017 4.374 1.00 1.00 H new ATOM 0 HB3 TRP A 23 125.419 9.354 3.241 1.00 1.00 H new ATOM 0 HD1 TRP A 23 126.514 11.797 1.674 1.00 1.00 H new ATOM 0 HE1 TRP A 23 128.580 11.623 0.131 1.00 1.00 H new ATOM 0 HE3 TRP A 23 128.665 7.622 3.679 1.00 1.00 H new ATOM 0 HZ2 TRP A 23 130.850 9.891 -0.164 1.00 1.00 H new ATOM 0 HZ3 TRP A 23 130.785 6.733 2.750 1.00 1.00 H new ATOM 0 HH2 TRP A 23 131.872 7.854 0.822 1.00 1.00 H new ATOM 368 N GLU A 24 123.938 10.996 5.570 1.00 1.00 N ATOM 369 CA GLU A 24 123.022 10.751 6.673 1.00 1.00 C ATOM 370 C GLU A 24 121.928 9.798 6.200 1.00 1.00 C ATOM 371 O GLU A 24 121.731 9.627 4.998 1.00 1.00 O ATOM 372 CB GLU A 24 122.407 12.074 7.126 1.00 1.00 C ATOM 373 CG GLU A 24 123.499 12.964 7.727 1.00 1.00 C ATOM 374 CD GLU A 24 122.924 14.331 8.082 1.00 1.00 C ATOM 375 OE1 GLU A 24 121.733 14.518 7.890 1.00 1.00 O ATOM 376 OE2 GLU A 24 123.686 15.173 8.536 1.00 1.00 O ATOM 0 H GLU A 24 123.489 11.352 4.726 1.00 1.00 H new ATOM 0 HA GLU A 24 123.555 10.305 7.513 1.00 1.00 H new ATOM 0 HB2 GLU A 24 121.937 12.577 6.281 1.00 1.00 H new ATOM 0 HB3 GLU A 24 121.625 11.891 7.863 1.00 1.00 H new ATOM 0 HG2 GLU A 24 123.914 12.493 8.618 1.00 1.00 H new ATOM 0 HG3 GLU A 24 124.318 13.078 7.017 1.00 1.00 H new ATOM 383 N SER A 25 121.209 9.191 7.135 1.00 1.00 N ATOM 384 CA SER A 25 120.146 8.285 6.751 1.00 1.00 C ATOM 385 C SER A 25 118.920 9.093 6.359 1.00 1.00 C ATOM 386 O SER A 25 118.769 10.245 6.762 1.00 1.00 O ATOM 387 CB SER A 25 119.811 7.311 7.880 1.00 1.00 C ATOM 388 OG SER A 25 120.797 6.288 7.921 1.00 1.00 O ATOM 0 H SER A 25 121.340 9.308 8.140 1.00 1.00 H new ATOM 0 HA SER A 25 120.479 7.692 5.900 1.00 1.00 H new ATOM 0 HB2 SER A 25 119.777 7.838 8.833 1.00 1.00 H new ATOM 0 HB3 SER A 25 118.824 6.876 7.721 1.00 1.00 H new ATOM 0 HG SER A 25 120.588 5.661 8.645 1.00 1.00 H new ATOM 394 N TYR A 26 118.057 8.488 5.571 1.00 1.00 N ATOM 395 CA TYR A 26 116.851 9.155 5.120 1.00 1.00 C ATOM 396 C TYR A 26 116.025 9.583 6.315 1.00 1.00 C ATOM 397 O TYR A 26 115.480 10.688 6.357 1.00 1.00 O ATOM 398 CB TYR A 26 116.048 8.190 4.260 1.00 1.00 C ATOM 399 CG TYR A 26 114.717 8.797 3.910 1.00 1.00 C ATOM 400 CD1 TYR A 26 114.609 9.679 2.832 1.00 1.00 C ATOM 401 CD2 TYR A 26 113.588 8.457 4.658 1.00 1.00 C ATOM 402 CE1 TYR A 26 113.364 10.223 2.498 1.00 1.00 C ATOM 403 CE2 TYR A 26 112.342 9.002 4.327 1.00 1.00 C ATOM 404 CZ TYR A 26 112.230 9.884 3.244 1.00 1.00 C ATOM 405 OH TYR A 26 111.001 10.419 2.911 1.00 1.00 O ATOM 0 H TYR A 26 118.167 7.534 5.228 1.00 1.00 H new ATOM 0 HA TYR A 26 117.114 10.038 4.538 1.00 1.00 H new ATOM 0 HB2 TYR A 26 116.600 7.955 3.350 1.00 1.00 H new ATOM 0 HB3 TYR A 26 115.900 7.251 4.794 1.00 1.00 H new ATOM 0 HD1 TYR A 26 115.485 9.941 2.257 1.00 1.00 H new ATOM 0 HD2 TYR A 26 113.676 7.775 5.491 1.00 1.00 H new ATOM 0 HE1 TYR A 26 113.278 10.904 1.665 1.00 1.00 H new ATOM 0 HE2 TYR A 26 111.468 8.743 4.906 1.00 1.00 H new ATOM 0 HH TYR A 26 110.319 10.081 3.528 1.00 1.00 H new ATOM 415 N ALA A 27 115.946 8.683 7.280 1.00 1.00 N ATOM 416 CA ALA A 27 115.185 8.949 8.484 1.00 1.00 C ATOM 417 C ALA A 27 115.857 10.036 9.287 1.00 1.00 C ATOM 418 O ALA A 27 115.200 10.865 9.916 1.00 1.00 O ATOM 419 CB ALA A 27 115.053 7.682 9.323 1.00 1.00 C ATOM 0 H ALA A 27 116.397 7.768 7.252 1.00 1.00 H new ATOM 0 HA ALA A 27 114.186 9.281 8.200 1.00 1.00 H new ATOM 0 HB1 ALA A 27 114.479 7.900 10.223 1.00 1.00 H new ATOM 0 HB2 ALA A 27 114.541 6.914 8.743 1.00 1.00 H new ATOM 0 HB3 ALA A 27 116.044 7.326 9.603 1.00 1.00 H new ATOM 425 N GLU A 28 117.170 10.025 9.261 1.00 1.00 N ATOM 426 CA GLU A 28 117.942 11.005 9.991 1.00 1.00 C ATOM 427 C GLU A 28 117.789 12.384 9.378 1.00 1.00 C ATOM 428 O GLU A 28 117.708 13.384 10.093 1.00 1.00 O ATOM 429 CB GLU A 28 119.405 10.592 9.995 1.00 1.00 C ATOM 430 CG GLU A 28 119.592 9.430 10.973 1.00 1.00 C ATOM 431 CD GLU A 28 121.008 8.872 10.862 1.00 1.00 C ATOM 432 OE1 GLU A 28 121.796 9.448 10.132 1.00 1.00 O ATOM 433 OE2 GLU A 28 121.282 7.874 11.509 1.00 1.00 O ATOM 0 H GLU A 28 117.727 9.347 8.741 1.00 1.00 H new ATOM 0 HA GLU A 28 117.572 11.051 11.015 1.00 1.00 H new ATOM 0 HB2 GLU A 28 119.715 10.295 8.993 1.00 1.00 H new ATOM 0 HB3 GLU A 28 120.033 11.434 10.286 1.00 1.00 H new ATOM 0 HG2 GLU A 28 119.405 9.769 11.992 1.00 1.00 H new ATOM 0 HG3 GLU A 28 118.866 8.645 10.760 1.00 1.00 H new ATOM 440 N ALA A 29 117.751 12.438 8.056 1.00 1.00 N ATOM 441 CA ALA A 29 117.610 13.699 7.353 1.00 1.00 C ATOM 442 C ALA A 29 116.328 14.410 7.723 1.00 1.00 C ATOM 443 O ALA A 29 116.317 15.617 7.965 1.00 1.00 O ATOM 444 CB ALA A 29 117.549 13.430 5.861 1.00 1.00 C ATOM 0 H ALA A 29 117.816 11.621 7.449 1.00 1.00 H new ATOM 0 HA ALA A 29 118.463 14.320 7.627 1.00 1.00 H new ATOM 0 HB1 ALA A 29 117.443 14.373 5.325 1.00 1.00 H new ATOM 0 HB2 ALA A 29 118.466 12.933 5.543 1.00 1.00 H new ATOM 0 HB3 ALA A 29 116.694 12.790 5.641 1.00 1.00 H new ATOM 450 N LEU A 30 115.243 13.665 7.729 1.00 1.00 N ATOM 451 CA LEU A 30 113.958 14.243 8.028 1.00 1.00 C ATOM 452 C LEU A 30 113.935 14.750 9.450 1.00 1.00 C ATOM 453 O LEU A 30 113.437 15.829 9.725 1.00 1.00 O ATOM 454 CB LEU A 30 112.865 13.206 7.815 1.00 1.00 C ATOM 455 CG LEU A 30 112.812 12.836 6.335 1.00 1.00 C ATOM 456 CD1 LEU A 30 112.295 11.411 6.193 1.00 1.00 C ATOM 457 CD2 LEU A 30 111.852 13.777 5.600 1.00 1.00 C ATOM 0 H LEU A 30 115.228 12.664 7.531 1.00 1.00 H new ATOM 0 HA LEU A 30 113.779 15.084 7.359 1.00 1.00 H new ATOM 0 HB2 LEU A 30 113.064 12.320 8.418 1.00 1.00 H new ATOM 0 HB3 LEU A 30 111.902 13.602 8.139 1.00 1.00 H new ATOM 0 HG LEU A 30 113.812 12.921 5.909 1.00 1.00 H new ATOM 0 HD11 LEU A 30 112.255 11.142 5.137 1.00 1.00 H new ATOM 0 HD12 LEU A 30 112.963 10.728 6.717 1.00 1.00 H new ATOM 0 HD13 LEU A 30 111.296 11.342 6.623 1.00 1.00 H new ATOM 0 HD21 LEU A 30 111.817 13.509 4.544 1.00 1.00 H new ATOM 0 HD22 LEU A 30 110.854 13.687 6.030 1.00 1.00 H new ATOM 0 HD23 LEU A 30 112.200 14.805 5.702 1.00 1.00 H new ATOM 469 N GLU A 31 114.498 13.973 10.353 1.00 1.00 N ATOM 470 CA GLU A 31 114.531 14.350 11.731 1.00 1.00 C ATOM 471 C GLU A 31 115.226 15.667 11.905 1.00 1.00 C ATOM 472 O GLU A 31 114.773 16.533 12.645 1.00 1.00 O ATOM 473 CB GLU A 31 115.271 13.291 12.541 1.00 1.00 C ATOM 474 CG GLU A 31 114.256 12.500 13.339 1.00 1.00 C ATOM 475 CD GLU A 31 114.941 11.367 14.099 1.00 1.00 C ATOM 476 OE1 GLU A 31 116.146 11.233 13.966 1.00 1.00 O ATOM 477 OE2 GLU A 31 114.248 10.649 14.802 1.00 1.00 O ATOM 0 H GLU A 31 114.937 13.076 10.146 1.00 1.00 H new ATOM 0 HA GLU A 31 113.503 14.439 12.083 1.00 1.00 H new ATOM 0 HB2 GLU A 31 115.830 12.630 11.879 1.00 1.00 H new ATOM 0 HB3 GLU A 31 115.994 13.761 13.208 1.00 1.00 H new ATOM 0 HG2 GLU A 31 113.743 13.158 14.040 1.00 1.00 H new ATOM 0 HG3 GLU A 31 113.497 12.092 12.671 1.00 1.00 H new ATOM 484 N HIS A 32 116.336 15.808 11.221 1.00 1.00 N ATOM 485 CA HIS A 32 117.074 17.032 11.332 1.00 1.00 C ATOM 486 C HIS A 32 116.303 18.186 10.686 1.00 1.00 C ATOM 487 O HIS A 32 116.261 19.293 11.226 1.00 1.00 O ATOM 488 CB HIS A 32 118.456 16.888 10.692 1.00 1.00 C ATOM 489 CG HIS A 32 119.437 16.412 11.730 1.00 1.00 C ATOM 490 ND1 HIS A 32 119.807 15.080 11.840 1.00 1.00 N ATOM 491 CD2 HIS A 32 120.126 17.074 12.717 1.00 1.00 C ATOM 492 CE1 HIS A 32 120.680 14.985 12.861 1.00 1.00 C ATOM 493 NE2 HIS A 32 120.910 16.171 13.428 1.00 1.00 N ATOM 0 H HIS A 32 116.736 15.107 10.598 1.00 1.00 H new ATOM 0 HA HIS A 32 117.207 17.256 12.390 1.00 1.00 H new ATOM 0 HB2 HIS A 32 118.414 16.181 9.863 1.00 1.00 H new ATOM 0 HB3 HIS A 32 118.780 17.844 10.280 1.00 1.00 H new ATOM 0 HD1 HIS A 32 119.478 14.312 11.254 1.00 1.00 H new ATOM 0 HD2 HIS A 32 120.068 18.135 12.912 1.00 1.00 H new ATOM 0 HE1 HIS A 32 121.138 14.061 13.182 1.00 1.00 H new ATOM 501 N SER A 33 115.712 17.928 9.516 1.00 1.00 N ATOM 502 CA SER A 33 114.965 18.945 8.784 1.00 1.00 C ATOM 503 C SER A 33 113.741 19.420 9.539 1.00 1.00 C ATOM 504 O SER A 33 113.395 20.600 9.488 1.00 1.00 O ATOM 505 CB SER A 33 114.557 18.395 7.424 1.00 1.00 C ATOM 506 OG SER A 33 115.741 18.129 6.707 1.00 1.00 O ATOM 0 H SER A 33 115.739 17.018 9.057 1.00 1.00 H new ATOM 0 HA SER A 33 115.619 19.808 8.660 1.00 1.00 H new ATOM 0 HB2 SER A 33 113.965 17.487 7.539 1.00 1.00 H new ATOM 0 HB3 SER A 33 113.937 19.114 6.889 1.00 1.00 H new ATOM 0 HG SER A 33 115.956 18.895 6.134 1.00 1.00 H new ATOM 512 N LYS A 34 113.093 18.515 10.257 1.00 1.00 N ATOM 513 CA LYS A 34 111.927 18.892 11.021 1.00 1.00 C ATOM 514 C LYS A 34 112.333 19.967 12.006 1.00 1.00 C ATOM 515 O LYS A 34 111.528 20.812 12.403 1.00 1.00 O ATOM 516 CB LYS A 34 111.371 17.688 11.776 1.00 1.00 C ATOM 517 CG LYS A 34 110.767 16.696 10.774 1.00 1.00 C ATOM 518 CD LYS A 34 110.530 15.338 11.448 1.00 1.00 C ATOM 519 CE LYS A 34 110.605 14.228 10.399 1.00 1.00 C ATOM 520 NZ LYS A 34 109.757 13.079 10.828 1.00 1.00 N ATOM 0 H LYS A 34 113.354 17.531 10.323 1.00 1.00 H new ATOM 0 HA LYS A 34 111.152 19.262 10.350 1.00 1.00 H new ATOM 0 HB2 LYS A 34 112.163 17.206 12.349 1.00 1.00 H new ATOM 0 HB3 LYS A 34 110.612 18.010 12.489 1.00 1.00 H new ATOM 0 HG2 LYS A 34 109.826 17.087 10.387 1.00 1.00 H new ATOM 0 HG3 LYS A 34 111.437 16.575 9.922 1.00 1.00 H new ATOM 0 HD2 LYS A 34 111.276 15.170 12.224 1.00 1.00 H new ATOM 0 HD3 LYS A 34 109.555 15.327 11.935 1.00 1.00 H new ATOM 0 HE2 LYS A 34 110.266 14.603 9.433 1.00 1.00 H new ATOM 0 HE3 LYS A 34 111.638 13.904 10.271 1.00 1.00 H new ATOM 0 HZ1 LYS A 34 109.808 12.324 10.114 1.00 1.00 H new ATOM 0 HZ2 LYS A 34 110.100 12.716 11.741 1.00 1.00 H new ATOM 0 HZ3 LYS A 34 108.771 13.394 10.929 1.00 1.00 H new ATOM 534 N GLN A 35 113.589 19.887 12.435 1.00 1.00 N ATOM 535 CA GLN A 35 114.096 20.830 13.431 1.00 1.00 C ATOM 536 C GLN A 35 114.902 21.950 12.808 1.00 1.00 C ATOM 537 O GLN A 35 114.833 23.094 13.257 1.00 1.00 O ATOM 538 CB GLN A 35 114.997 20.108 14.422 1.00 1.00 C ATOM 539 CG GLN A 35 114.304 18.846 14.905 1.00 1.00 C ATOM 540 CD GLN A 35 115.189 18.126 15.920 1.00 1.00 C ATOM 541 OE1 GLN A 35 115.685 18.745 16.862 1.00 1.00 O ATOM 542 NE2 GLN A 35 115.423 16.850 15.780 1.00 1.00 N ATOM 0 H GLN A 35 114.265 19.193 12.117 1.00 1.00 H new ATOM 0 HA GLN A 35 113.223 21.256 13.926 1.00 1.00 H new ATOM 0 HB2 GLN A 35 115.947 19.857 13.951 1.00 1.00 H new ATOM 0 HB3 GLN A 35 115.222 20.759 15.267 1.00 1.00 H new ATOM 0 HG2 GLN A 35 113.345 19.097 15.359 1.00 1.00 H new ATOM 0 HG3 GLN A 35 114.095 18.189 14.061 1.00 1.00 H new ATOM 0 HE21 GLN A 35 115.011 16.339 14.999 1.00 1.00 H new ATOM 0 HE22 GLN A 35 116.017 16.364 16.451 1.00 1.00 H new ATOM 551 N ASP A 36 115.703 21.622 11.811 1.00 1.00 N ATOM 552 CA ASP A 36 116.561 22.616 11.174 1.00 1.00 C ATOM 553 C ASP A 36 115.920 23.242 9.932 1.00 1.00 C ATOM 554 O ASP A 36 116.348 24.309 9.494 1.00 1.00 O ATOM 555 CB ASP A 36 117.888 21.962 10.781 1.00 1.00 C ATOM 556 CG ASP A 36 118.660 21.562 12.034 1.00 1.00 C ATOM 557 OD1 ASP A 36 118.334 22.071 13.094 1.00 1.00 O ATOM 558 OD2 ASP A 36 119.565 20.750 11.916 1.00 1.00 O ATOM 0 H ASP A 36 115.781 20.682 11.423 1.00 1.00 H new ATOM 0 HA ASP A 36 116.721 23.417 11.896 1.00 1.00 H new ATOM 0 HB2 ASP A 36 117.702 21.084 10.162 1.00 1.00 H new ATOM 0 HB3 ASP A 36 118.481 22.654 10.183 1.00 1.00 H new ATOM 563 N HIS A 37 114.896 22.591 9.379 1.00 1.00 N ATOM 564 CA HIS A 37 114.183 23.092 8.198 1.00 1.00 C ATOM 565 C HIS A 37 115.036 23.041 6.935 1.00 1.00 C ATOM 566 O HIS A 37 114.676 23.633 5.917 1.00 1.00 O ATOM 567 CB HIS A 37 113.707 24.535 8.409 1.00 1.00 C ATOM 568 CG HIS A 37 113.035 24.669 9.747 1.00 1.00 C ATOM 569 ND1 HIS A 37 111.672 24.477 9.914 1.00 1.00 N ATOM 570 CD2 HIS A 37 113.521 24.997 10.986 1.00 1.00 C ATOM 571 CE1 HIS A 37 111.388 24.689 11.210 1.00 1.00 C ATOM 572 NE2 HIS A 37 112.480 25.010 11.909 1.00 1.00 N ATOM 0 H HIS A 37 114.537 21.705 9.734 1.00 1.00 H new ATOM 0 HA HIS A 37 113.326 22.432 8.065 1.00 1.00 H new ATOM 0 HB2 HIS A 37 114.555 25.218 8.349 1.00 1.00 H new ATOM 0 HB3 HIS A 37 113.014 24.817 7.616 1.00 1.00 H new ATOM 0 HD2 HIS A 37 114.555 25.213 11.211 1.00 1.00 H new ATOM 0 HE1 HIS A 37 110.398 24.610 11.635 1.00 1.00 H new ATOM 0 HE2 HIS A 37 112.538 25.220 12.906 1.00 1.00 H new ATOM 580 N LYS A 38 116.167 22.346 6.995 1.00 1.00 N ATOM 581 CA LYS A 38 117.040 22.256 5.832 1.00 1.00 C ATOM 582 C LYS A 38 116.483 21.248 4.817 1.00 1.00 C ATOM 583 O LYS A 38 115.905 20.235 5.206 1.00 1.00 O ATOM 584 CB LYS A 38 118.441 21.826 6.273 1.00 1.00 C ATOM 585 CG LYS A 38 119.316 23.065 6.488 1.00 1.00 C ATOM 586 CD LYS A 38 120.507 22.698 7.377 1.00 1.00 C ATOM 587 CE LYS A 38 121.740 23.495 6.946 1.00 1.00 C ATOM 588 NZ LYS A 38 122.739 23.499 8.053 1.00 1.00 N ATOM 0 H LYS A 38 116.496 21.846 7.821 1.00 1.00 H new ATOM 0 HA LYS A 38 117.092 23.235 5.357 1.00 1.00 H new ATOM 0 HB2 LYS A 38 118.381 21.247 7.194 1.00 1.00 H new ATOM 0 HB3 LYS A 38 118.888 21.179 5.518 1.00 1.00 H new ATOM 0 HG2 LYS A 38 119.668 23.446 5.529 1.00 1.00 H new ATOM 0 HG3 LYS A 38 118.732 23.860 6.953 1.00 1.00 H new ATOM 0 HD2 LYS A 38 120.273 22.909 8.420 1.00 1.00 H new ATOM 0 HD3 LYS A 38 120.710 21.629 7.306 1.00 1.00 H new ATOM 0 HE2 LYS A 38 122.176 23.055 6.049 1.00 1.00 H new ATOM 0 HE3 LYS A 38 121.456 24.517 6.694 1.00 1.00 H new ATOM 0 HZ1 LYS A 38 123.622 23.937 7.722 1.00 1.00 H new ATOM 0 HZ2 LYS A 38 122.364 24.042 8.857 1.00 1.00 H new ATOM 0 HZ3 LYS A 38 122.928 22.521 8.353 1.00 1.00 H new ATOM 602 N PRO A 39 116.631 21.501 3.534 1.00 1.00 N ATOM 603 CA PRO A 39 116.122 20.583 2.472 1.00 1.00 C ATOM 604 C PRO A 39 116.916 19.282 2.389 1.00 1.00 C ATOM 605 O PRO A 39 118.088 19.232 2.760 1.00 1.00 O ATOM 606 CB PRO A 39 116.253 21.401 1.190 1.00 1.00 C ATOM 607 CG PRO A 39 117.378 22.332 1.455 1.00 1.00 C ATOM 608 CD PRO A 39 117.306 22.670 2.944 1.00 1.00 C ATOM 0 HA PRO A 39 115.100 20.261 2.670 1.00 1.00 H new ATOM 0 HB2 PRO A 39 116.460 20.762 0.331 1.00 1.00 H new ATOM 0 HB3 PRO A 39 115.333 21.943 0.969 1.00 1.00 H new ATOM 0 HG2 PRO A 39 118.333 21.870 1.206 1.00 1.00 H new ATOM 0 HG3 PRO A 39 117.291 23.232 0.846 1.00 1.00 H new ATOM 0 HD2 PRO A 39 118.299 22.817 3.370 1.00 1.00 H new ATOM 0 HD3 PRO A 39 116.745 23.588 3.120 1.00 1.00 H new ATOM 616 N ILE A 40 116.255 18.230 1.917 1.00 1.00 N ATOM 617 CA ILE A 40 116.881 16.917 1.804 1.00 1.00 C ATOM 618 C ILE A 40 117.132 16.567 0.343 1.00 1.00 C ATOM 619 O ILE A 40 116.208 16.592 -0.465 1.00 1.00 O ATOM 620 CB ILE A 40 115.951 15.844 2.376 1.00 1.00 C ATOM 621 CG1 ILE A 40 115.178 16.406 3.578 1.00 1.00 C ATOM 622 CG2 ILE A 40 116.793 14.645 2.810 1.00 1.00 C ATOM 623 CD1 ILE A 40 114.272 15.323 4.171 1.00 1.00 C ATOM 0 H ILE A 40 115.284 18.261 1.606 1.00 1.00 H new ATOM 0 HA ILE A 40 117.822 16.950 2.353 1.00 1.00 H new ATOM 0 HB ILE A 40 115.233 15.535 1.616 1.00 1.00 H new ATOM 0 HG12 ILE A 40 115.876 16.762 4.335 1.00 1.00 H new ATOM 0 HG13 ILE A 40 114.580 17.263 3.268 1.00 1.00 H new ATOM 0 HG21 ILE A 40 116.142 13.873 3.220 1.00 1.00 H new ATOM 0 HG22 ILE A 40 117.331 14.247 1.949 1.00 1.00 H new ATOM 0 HG23 ILE A 40 117.508 14.959 3.571 1.00 1.00 H new ATOM 0 HD11 ILE A 40 113.728 15.730 5.023 1.00 1.00 H new ATOM 0 HD12 ILE A 40 113.563 14.987 3.414 1.00 1.00 H new ATOM 0 HD13 ILE A 40 114.880 14.479 4.498 1.00 1.00 H new ATOM 635 N GLY A 41 118.368 16.197 0.015 1.00 1.00 N ATOM 636 CA GLY A 41 118.701 15.801 -1.345 1.00 1.00 C ATOM 637 C GLY A 41 118.866 14.288 -1.402 1.00 1.00 C ATOM 638 O GLY A 41 119.790 13.731 -0.808 1.00 1.00 O ATOM 0 H GLY A 41 119.149 16.164 0.670 1.00 1.00 H new ATOM 0 HA2 GLY A 41 117.916 16.119 -2.031 1.00 1.00 H new ATOM 0 HA3 GLY A 41 119.621 16.291 -1.664 1.00 1.00 H new ATOM 642 N LEU A 42 117.973 13.634 -2.135 1.00 1.00 N ATOM 643 CA LEU A 42 118.024 12.193 -2.292 1.00 1.00 C ATOM 644 C LEU A 42 118.773 11.860 -3.565 1.00 1.00 C ATOM 645 O LEU A 42 118.365 12.253 -4.657 1.00 1.00 O ATOM 646 CB LEU A 42 116.618 11.616 -2.443 1.00 1.00 C ATOM 647 CG LEU A 42 115.762 11.853 -1.200 1.00 1.00 C ATOM 648 CD1 LEU A 42 115.642 13.342 -0.903 1.00 1.00 C ATOM 649 CD2 LEU A 42 114.365 11.301 -1.469 1.00 1.00 C ATOM 0 H LEU A 42 117.203 14.085 -2.630 1.00 1.00 H new ATOM 0 HA LEU A 42 118.512 11.774 -1.412 1.00 1.00 H new ATOM 0 HB2 LEU A 42 116.133 12.067 -3.308 1.00 1.00 H new ATOM 0 HB3 LEU A 42 116.685 10.546 -2.638 1.00 1.00 H new ATOM 0 HG LEU A 42 116.227 11.359 -0.347 1.00 1.00 H new ATOM 0 HD11 LEU A 42 115.028 13.487 -0.014 1.00 1.00 H new ATOM 0 HD12 LEU A 42 116.634 13.760 -0.731 1.00 1.00 H new ATOM 0 HD13 LEU A 42 115.178 13.846 -1.751 1.00 1.00 H new ATOM 0 HD21 LEU A 42 113.736 11.460 -0.593 1.00 1.00 H new ATOM 0 HD22 LEU A 42 113.930 11.815 -2.326 1.00 1.00 H new ATOM 0 HD23 LEU A 42 114.430 10.234 -1.680 1.00 1.00 H new ATOM 661 N PHE A 43 119.875 11.150 -3.423 1.00 1.00 N ATOM 662 CA PHE A 43 120.674 10.789 -4.580 1.00 1.00 C ATOM 663 C PHE A 43 120.264 9.407 -5.085 1.00 1.00 C ATOM 664 O PHE A 43 120.632 8.393 -4.492 1.00 1.00 O ATOM 665 CB PHE A 43 122.151 10.807 -4.175 1.00 1.00 C ATOM 666 CG PHE A 43 123.039 10.833 -5.393 1.00 1.00 C ATOM 667 CD1 PHE A 43 122.978 11.911 -6.285 1.00 1.00 C ATOM 668 CD2 PHE A 43 123.935 9.784 -5.624 1.00 1.00 C ATOM 669 CE1 PHE A 43 123.807 11.937 -7.408 1.00 1.00 C ATOM 670 CE2 PHE A 43 124.766 9.811 -6.745 1.00 1.00 C ATOM 671 CZ PHE A 43 124.701 10.886 -7.640 1.00 1.00 C ATOM 0 H PHE A 43 120.235 10.814 -2.530 1.00 1.00 H new ATOM 0 HA PHE A 43 120.513 11.502 -5.389 1.00 1.00 H new ATOM 0 HB2 PHE A 43 122.352 11.680 -3.554 1.00 1.00 H new ATOM 0 HB3 PHE A 43 122.378 9.928 -3.572 1.00 1.00 H new ATOM 0 HD1 PHE A 43 122.289 12.723 -6.104 1.00 1.00 H new ATOM 0 HD2 PHE A 43 123.984 8.954 -4.935 1.00 1.00 H new ATOM 0 HE1 PHE A 43 123.758 12.767 -8.097 1.00 1.00 H new ATOM 0 HE2 PHE A 43 125.460 9.002 -6.922 1.00 1.00 H new ATOM 0 HZ PHE A 43 125.341 10.904 -8.510 1.00 1.00 H new ATOM 681 N PHE A 44 119.529 9.364 -6.202 1.00 1.00 N ATOM 682 CA PHE A 44 119.101 8.100 -6.808 1.00 1.00 C ATOM 683 C PHE A 44 120.098 7.719 -7.896 1.00 1.00 C ATOM 684 O PHE A 44 120.303 8.491 -8.832 1.00 1.00 O ATOM 685 CB PHE A 44 117.702 8.260 -7.408 1.00 1.00 C ATOM 686 CG PHE A 44 116.677 8.244 -6.302 1.00 1.00 C ATOM 687 CD1 PHE A 44 116.140 7.026 -5.873 1.00 1.00 C ATOM 688 CD2 PHE A 44 116.259 9.443 -5.709 1.00 1.00 C ATOM 689 CE1 PHE A 44 115.186 7.002 -4.851 1.00 1.00 C ATOM 690 CE2 PHE A 44 115.302 9.417 -4.689 1.00 1.00 C ATOM 691 CZ PHE A 44 114.768 8.199 -4.260 1.00 1.00 C ATOM 0 H PHE A 44 119.218 10.194 -6.706 1.00 1.00 H new ATOM 0 HA PHE A 44 119.066 7.316 -6.051 1.00 1.00 H new ATOM 0 HB2 PHE A 44 117.638 9.195 -7.965 1.00 1.00 H new ATOM 0 HB3 PHE A 44 117.503 7.454 -8.115 1.00 1.00 H new ATOM 0 HD1 PHE A 44 116.463 6.103 -6.332 1.00 1.00 H new ATOM 0 HD2 PHE A 44 116.674 10.384 -6.038 1.00 1.00 H new ATOM 0 HE1 PHE A 44 114.773 6.061 -4.519 1.00 1.00 H new ATOM 0 HE2 PHE A 44 114.975 10.340 -4.232 1.00 1.00 H new ATOM 0 HZ PHE A 44 114.031 8.182 -3.471 1.00 1.00 H new ATOM 701 N THR A 45 120.726 6.541 -7.771 1.00 1.00 N ATOM 702 CA THR A 45 121.713 6.134 -8.777 1.00 1.00 C ATOM 703 C THR A 45 121.928 4.624 -8.899 1.00 1.00 C ATOM 704 O THR A 45 121.312 3.819 -8.201 1.00 1.00 O ATOM 705 CB THR A 45 123.058 6.807 -8.473 1.00 1.00 C ATOM 706 OG1 THR A 45 123.374 6.621 -7.099 1.00 1.00 O ATOM 707 CG2 THR A 45 122.977 8.304 -8.783 1.00 1.00 C ATOM 0 H THR A 45 120.576 5.876 -7.012 1.00 1.00 H new ATOM 0 HA THR A 45 121.303 6.456 -9.734 1.00 1.00 H new ATOM 0 HB THR A 45 123.834 6.359 -9.094 1.00 1.00 H new ATOM 0 HG1 THR A 45 123.657 7.475 -6.710 1.00 1.00 H new ATOM 0 HG21 THR A 45 123.936 8.773 -8.564 1.00 1.00 H new ATOM 0 HG22 THR A 45 122.736 8.445 -9.837 1.00 1.00 H new ATOM 0 HG23 THR A 45 122.201 8.761 -8.169 1.00 1.00 H new ATOM 715 N GLY A 46 122.893 4.281 -9.751 1.00 1.00 N ATOM 716 CA GLY A 46 123.341 2.913 -9.968 1.00 1.00 C ATOM 717 C GLY A 46 124.859 2.950 -9.879 1.00 1.00 C ATOM 718 O GLY A 46 125.549 3.200 -10.868 1.00 1.00 O ATOM 0 H GLY A 46 123.394 4.964 -10.320 1.00 1.00 H new ATOM 0 HA2 GLY A 46 122.922 2.242 -9.218 1.00 1.00 H new ATOM 0 HA3 GLY A 46 123.016 2.546 -10.941 1.00 1.00 H new ATOM 722 N SER A 47 125.358 2.785 -8.661 1.00 1.00 N ATOM 723 CA SER A 47 126.784 2.884 -8.384 1.00 1.00 C ATOM 724 C SER A 47 127.670 1.963 -9.216 1.00 1.00 C ATOM 725 O SER A 47 128.810 2.326 -9.507 1.00 1.00 O ATOM 726 CB SER A 47 127.036 2.607 -6.902 1.00 1.00 C ATOM 727 OG SER A 47 126.291 3.530 -6.118 1.00 1.00 O ATOM 0 H SER A 47 124.788 2.580 -7.841 1.00 1.00 H new ATOM 0 HA SER A 47 127.062 3.900 -8.662 1.00 1.00 H new ATOM 0 HB2 SER A 47 126.745 1.586 -6.657 1.00 1.00 H new ATOM 0 HB3 SER A 47 128.099 2.698 -6.679 1.00 1.00 H new ATOM 0 HG SER A 47 126.318 3.256 -5.177 1.00 1.00 H new ATOM 733 N ASP A 48 127.200 0.759 -9.555 1.00 1.00 N ATOM 734 CA ASP A 48 128.035 -0.183 -10.293 1.00 1.00 C ATOM 735 C ASP A 48 127.689 -0.320 -11.779 1.00 1.00 C ATOM 736 O ASP A 48 128.375 -1.066 -12.478 1.00 1.00 O ATOM 737 CB ASP A 48 127.942 -1.559 -9.629 1.00 1.00 C ATOM 738 CG ASP A 48 128.665 -1.549 -8.285 1.00 1.00 C ATOM 739 OD1 ASP A 48 129.313 -0.559 -7.986 1.00 1.00 O ATOM 740 OD2 ASP A 48 128.564 -2.535 -7.573 1.00 1.00 O ATOM 0 H ASP A 48 126.263 0.421 -9.334 1.00 1.00 H new ATOM 0 HA ASP A 48 129.047 0.221 -10.257 1.00 1.00 H new ATOM 0 HB2 ASP A 48 126.896 -1.831 -9.485 1.00 1.00 H new ATOM 0 HB3 ASP A 48 128.381 -2.315 -10.280 1.00 1.00 H new ATOM 745 N TRP A 49 126.623 0.331 -12.270 1.00 1.00 N ATOM 746 CA TRP A 49 126.260 0.148 -13.685 1.00 1.00 C ATOM 747 C TRP A 49 125.938 1.434 -14.441 1.00 1.00 C ATOM 748 O TRP A 49 126.006 1.450 -15.672 1.00 1.00 O ATOM 749 CB TRP A 49 125.059 -0.794 -13.785 1.00 1.00 C ATOM 750 CG TRP A 49 123.966 -0.322 -12.882 1.00 1.00 C ATOM 751 CD1 TRP A 49 124.033 -0.307 -11.532 1.00 1.00 C ATOM 752 CD2 TRP A 49 122.647 0.190 -13.232 1.00 1.00 C ATOM 753 NE1 TRP A 49 122.843 0.180 -11.031 1.00 1.00 N ATOM 754 CE2 TRP A 49 121.957 0.502 -12.038 1.00 1.00 C ATOM 755 CE3 TRP A 49 121.990 0.418 -14.455 1.00 1.00 C ATOM 756 CZ2 TRP A 49 120.660 1.011 -12.052 1.00 1.00 C ATOM 757 CZ3 TRP A 49 120.683 0.931 -14.474 1.00 1.00 C ATOM 758 CH2 TRP A 49 120.022 1.230 -13.275 1.00 1.00 C ATOM 0 H TRP A 49 126.022 0.960 -11.739 1.00 1.00 H new ATOM 0 HA TRP A 49 127.149 -0.268 -14.160 1.00 1.00 H new ATOM 0 HB2 TRP A 49 124.701 -0.833 -14.814 1.00 1.00 H new ATOM 0 HB3 TRP A 49 125.356 -1.807 -13.512 1.00 1.00 H new ATOM 0 HD1 TRP A 49 124.880 -0.624 -10.942 1.00 1.00 H new ATOM 0 HE1 TRP A 49 122.643 0.289 -10.037 1.00 1.00 H new ATOM 0 HE3 TRP A 49 122.494 0.197 -15.384 1.00 1.00 H new ATOM 0 HZ2 TRP A 49 120.152 1.234 -11.125 1.00 1.00 H new ATOM 0 HZ3 TRP A 49 120.184 1.096 -15.418 1.00 1.00 H new ATOM 0 HH2 TRP A 49 119.019 1.630 -13.297 1.00 1.00 H new ATOM 769 N CYS A 50 125.594 2.511 -13.750 1.00 1.00 N ATOM 770 CA CYS A 50 125.279 3.764 -14.431 1.00 1.00 C ATOM 771 C CYS A 50 126.528 4.645 -14.533 1.00 1.00 C ATOM 772 O CYS A 50 127.235 4.841 -13.548 1.00 1.00 O ATOM 773 CB CYS A 50 124.172 4.484 -13.661 1.00 1.00 C ATOM 774 SG CYS A 50 123.945 6.151 -14.317 1.00 1.00 S ATOM 0 H CYS A 50 125.526 2.547 -12.733 1.00 1.00 H new ATOM 0 HA CYS A 50 124.935 3.553 -15.444 1.00 1.00 H new ATOM 0 HB2 CYS A 50 123.240 3.924 -13.739 1.00 1.00 H new ATOM 0 HB3 CYS A 50 124.427 4.533 -12.602 1.00 1.00 H new ATOM 779 N MET A 51 126.811 5.151 -15.737 1.00 1.00 N ATOM 780 CA MET A 51 127.999 5.983 -15.951 1.00 1.00 C ATOM 781 C MET A 51 127.706 7.467 -15.747 1.00 1.00 C ATOM 782 O MET A 51 128.505 8.180 -15.144 1.00 1.00 O ATOM 783 CB MET A 51 128.553 5.752 -17.360 1.00 1.00 C ATOM 784 CG MET A 51 129.881 6.496 -17.518 1.00 1.00 C ATOM 785 SD MET A 51 130.568 6.171 -19.162 1.00 1.00 S ATOM 786 CE MET A 51 129.726 7.510 -20.041 1.00 1.00 C ATOM 0 H MET A 51 126.241 5.002 -16.570 1.00 1.00 H new ATOM 0 HA MET A 51 128.741 5.689 -15.209 1.00 1.00 H new ATOM 0 HB2 MET A 51 128.699 4.686 -17.534 1.00 1.00 H new ATOM 0 HB3 MET A 51 127.838 6.102 -18.105 1.00 1.00 H new ATOM 0 HG2 MET A 51 129.728 7.567 -17.382 1.00 1.00 H new ATOM 0 HG3 MET A 51 130.583 6.174 -16.749 1.00 1.00 H new ATOM 0 HE1 MET A 51 130.013 7.492 -21.092 1.00 1.00 H new ATOM 0 HE2 MET A 51 128.647 7.378 -19.957 1.00 1.00 H new ATOM 0 HE3 MET A 51 130.010 8.467 -19.603 1.00 1.00 H new ATOM 796 N TRP A 52 126.564 7.935 -16.240 1.00 1.00 N ATOM 797 CA TRP A 52 126.197 9.336 -16.084 1.00 1.00 C ATOM 798 C TRP A 52 126.087 9.655 -14.607 1.00 1.00 C ATOM 799 O TRP A 52 126.329 10.781 -14.173 1.00 1.00 O ATOM 800 CB TRP A 52 124.863 9.621 -16.773 1.00 1.00 C ATOM 801 CG TRP A 52 125.079 9.760 -18.246 1.00 1.00 C ATOM 802 CD1 TRP A 52 125.929 9.010 -18.987 1.00 1.00 C ATOM 803 CD2 TRP A 52 124.452 10.699 -19.169 1.00 1.00 C ATOM 804 NE1 TRP A 52 125.858 9.427 -20.305 1.00 1.00 N ATOM 805 CE2 TRP A 52 124.962 10.463 -20.467 1.00 1.00 C ATOM 806 CE3 TRP A 52 123.496 11.720 -19.007 1.00 1.00 C ATOM 807 CZ2 TRP A 52 124.542 11.213 -21.565 1.00 1.00 C ATOM 808 CZ3 TRP A 52 123.071 12.476 -20.112 1.00 1.00 C ATOM 809 CH2 TRP A 52 123.593 12.223 -21.387 1.00 1.00 C ATOM 0 H TRP A 52 125.883 7.370 -16.746 1.00 1.00 H new ATOM 0 HA TRP A 52 126.963 9.960 -16.545 1.00 1.00 H new ATOM 0 HB2 TRP A 52 124.159 8.813 -16.573 1.00 1.00 H new ATOM 0 HB3 TRP A 52 124.423 10.534 -16.372 1.00 1.00 H new ATOM 0 HD1 TRP A 52 126.559 8.217 -18.611 1.00 1.00 H new ATOM 0 HE1 TRP A 52 126.402 9.018 -21.064 1.00 1.00 H new ATOM 0 HE3 TRP A 52 123.087 11.923 -18.028 1.00 1.00 H new ATOM 0 HZ2 TRP A 52 124.947 11.015 -22.546 1.00 1.00 H new ATOM 0 HZ3 TRP A 52 122.337 13.257 -19.978 1.00 1.00 H new ATOM 0 HH2 TRP A 52 123.262 12.808 -22.232 1.00 1.00 H new ATOM 820 N CYS A 53 125.729 8.639 -13.841 1.00 1.00 N ATOM 821 CA CYS A 53 125.591 8.785 -12.408 1.00 1.00 C ATOM 822 C CYS A 53 126.957 9.007 -11.789 1.00 1.00 C ATOM 823 O CYS A 53 127.123 9.857 -10.916 1.00 1.00 O ATOM 824 CB CYS A 53 124.942 7.533 -11.828 1.00 1.00 C ATOM 825 SG CYS A 53 123.387 7.215 -12.695 1.00 1.00 S ATOM 0 H CYS A 53 125.529 7.702 -14.192 1.00 1.00 H new ATOM 0 HA CYS A 53 124.959 9.644 -12.185 1.00 1.00 H new ATOM 0 HB2 CYS A 53 125.612 6.680 -11.933 1.00 1.00 H new ATOM 0 HB3 CYS A 53 124.758 7.665 -10.762 1.00 1.00 H new ATOM 830 N ILE A 54 127.934 8.258 -12.274 1.00 1.00 N ATOM 831 CA ILE A 54 129.286 8.406 -11.786 1.00 1.00 C ATOM 832 C ILE A 54 129.742 9.815 -12.089 1.00 1.00 C ATOM 833 O ILE A 54 130.359 10.468 -11.249 1.00 1.00 O ATOM 834 CB ILE A 54 130.205 7.407 -12.476 1.00 1.00 C ATOM 835 CG1 ILE A 54 129.842 5.989 -12.031 1.00 1.00 C ATOM 836 CG2 ILE A 54 131.659 7.701 -12.112 1.00 1.00 C ATOM 837 CD1 ILE A 54 130.574 4.971 -12.908 1.00 1.00 C ATOM 0 H ILE A 54 127.814 7.550 -12.998 1.00 1.00 H new ATOM 0 HA ILE A 54 129.319 8.218 -10.713 1.00 1.00 H new ATOM 0 HB ILE A 54 130.083 7.493 -13.556 1.00 1.00 H new ATOM 0 HG12 ILE A 54 130.114 5.845 -10.985 1.00 1.00 H new ATOM 0 HG13 ILE A 54 128.765 5.839 -12.104 1.00 1.00 H new ATOM 0 HG21 ILE A 54 132.311 6.983 -12.609 1.00 1.00 H new ATOM 0 HG22 ILE A 54 131.918 8.710 -12.434 1.00 1.00 H new ATOM 0 HG23 ILE A 54 131.787 7.621 -11.033 1.00 1.00 H new ATOM 0 HD11 ILE A 54 130.314 3.962 -12.589 1.00 1.00 H new ATOM 0 HD12 ILE A 54 130.281 5.110 -13.949 1.00 1.00 H new ATOM 0 HD13 ILE A 54 131.650 5.115 -12.812 1.00 1.00 H new ATOM 849 N LYS A 55 129.455 10.288 -13.302 1.00 1.00 N ATOM 850 CA LYS A 55 129.866 11.618 -13.696 1.00 1.00 C ATOM 851 C LYS A 55 129.232 12.667 -12.799 1.00 1.00 C ATOM 852 O LYS A 55 129.911 13.580 -12.335 1.00 1.00 O ATOM 853 CB LYS A 55 129.476 11.895 -15.151 1.00 1.00 C ATOM 854 CG LYS A 55 130.195 10.927 -16.103 1.00 1.00 C ATOM 855 CD LYS A 55 131.709 11.189 -16.101 1.00 1.00 C ATOM 856 CE LYS A 55 132.329 10.582 -17.365 1.00 1.00 C ATOM 857 NZ LYS A 55 133.790 10.878 -17.404 1.00 1.00 N ATOM 0 H LYS A 55 128.944 9.769 -14.016 1.00 1.00 H new ATOM 0 HA LYS A 55 130.950 11.672 -13.597 1.00 1.00 H new ATOM 0 HB2 LYS A 55 128.397 11.793 -15.269 1.00 1.00 H new ATOM 0 HB3 LYS A 55 129.730 12.923 -15.411 1.00 1.00 H new ATOM 0 HG2 LYS A 55 129.998 9.898 -15.801 1.00 1.00 H new ATOM 0 HG3 LYS A 55 129.802 11.043 -17.113 1.00 1.00 H new ATOM 0 HD2 LYS A 55 131.904 12.261 -16.065 1.00 1.00 H new ATOM 0 HD3 LYS A 55 132.164 10.752 -15.212 1.00 1.00 H new ATOM 0 HE2 LYS A 55 132.167 9.504 -17.379 1.00 1.00 H new ATOM 0 HE3 LYS A 55 131.842 10.989 -18.251 1.00 1.00 H new ATOM 0 HZ1 LYS A 55 134.205 10.464 -18.263 1.00 1.00 H new ATOM 0 HZ2 LYS A 55 133.936 11.908 -17.411 1.00 1.00 H new ATOM 0 HZ3 LYS A 55 134.250 10.469 -16.566 1.00 1.00 H new ATOM 871 N MET A 56 127.931 12.534 -12.532 1.00 1.00 N ATOM 872 CA MET A 56 127.259 13.485 -11.674 1.00 1.00 C ATOM 873 C MET A 56 127.867 13.425 -10.289 1.00 1.00 C ATOM 874 O MET A 56 128.181 14.443 -9.678 1.00 1.00 O ATOM 875 CB MET A 56 125.760 13.191 -11.618 1.00 1.00 C ATOM 876 CG MET A 56 125.098 14.133 -10.616 1.00 1.00 C ATOM 877 SD MET A 56 123.318 14.205 -10.937 1.00 1.00 S ATOM 878 CE MET A 56 122.831 15.042 -9.407 1.00 1.00 C ATOM 0 H MET A 56 127.339 11.787 -12.895 1.00 1.00 H new ATOM 0 HA MET A 56 127.388 14.489 -12.078 1.00 1.00 H new ATOM 0 HB2 MET A 56 125.315 13.320 -12.605 1.00 1.00 H new ATOM 0 HB3 MET A 56 125.592 12.154 -11.326 1.00 1.00 H new ATOM 0 HG2 MET A 56 125.281 13.786 -9.599 1.00 1.00 H new ATOM 0 HG3 MET A 56 125.533 15.129 -10.696 1.00 1.00 H new ATOM 0 HE1 MET A 56 122.125 14.418 -8.860 1.00 1.00 H new ATOM 0 HE2 MET A 56 123.713 15.217 -8.791 1.00 1.00 H new ATOM 0 HE3 MET A 56 122.362 15.996 -9.648 1.00 1.00 H new ATOM 888 N GLN A 57 128.039 12.200 -9.804 1.00 1.00 N ATOM 889 CA GLN A 57 128.610 11.965 -8.494 1.00 1.00 C ATOM 890 C GLN A 57 130.079 12.384 -8.455 1.00 1.00 C ATOM 891 O GLN A 57 130.499 13.073 -7.527 1.00 1.00 O ATOM 892 CB GLN A 57 128.458 10.478 -8.153 1.00 1.00 C ATOM 893 CG GLN A 57 129.516 10.071 -7.139 1.00 1.00 C ATOM 894 CD GLN A 57 129.085 8.797 -6.419 1.00 1.00 C ATOM 895 OE1 GLN A 57 128.753 7.800 -7.060 1.00 1.00 O ATOM 896 NE2 GLN A 57 129.074 8.770 -5.113 1.00 1.00 N ATOM 0 H GLN A 57 127.786 11.350 -10.309 1.00 1.00 H new ATOM 0 HA GLN A 57 128.082 12.566 -7.754 1.00 1.00 H new ATOM 0 HB2 GLN A 57 127.463 10.288 -7.750 1.00 1.00 H new ATOM 0 HB3 GLN A 57 128.557 9.876 -9.057 1.00 1.00 H new ATOM 0 HG2 GLN A 57 130.470 9.910 -7.641 1.00 1.00 H new ATOM 0 HG3 GLN A 57 129.667 10.873 -6.417 1.00 1.00 H new ATOM 0 HE21 GLN A 57 129.349 9.597 -4.583 1.00 1.00 H new ATOM 0 HE22 GLN A 57 128.790 7.922 -4.623 1.00 1.00 H new ATOM 905 N ASP A 58 130.859 11.971 -9.437 1.00 1.00 N ATOM 906 CA ASP A 58 132.280 12.312 -9.450 1.00 1.00 C ATOM 907 C ASP A 58 132.517 13.797 -9.733 1.00 1.00 C ATOM 908 O ASP A 58 133.460 14.385 -9.201 1.00 1.00 O ATOM 909 CB ASP A 58 132.992 11.468 -10.512 1.00 1.00 C ATOM 910 CG ASP A 58 134.493 11.745 -10.490 1.00 1.00 C ATOM 911 OD1 ASP A 58 134.904 12.628 -9.756 1.00 1.00 O ATOM 912 OD2 ASP A 58 135.209 11.069 -11.211 1.00 1.00 O ATOM 0 H ASP A 58 130.545 11.407 -10.227 1.00 1.00 H new ATOM 0 HA ASP A 58 132.682 12.100 -8.459 1.00 1.00 H new ATOM 0 HB2 ASP A 58 132.808 10.409 -10.329 1.00 1.00 H new ATOM 0 HB3 ASP A 58 132.588 11.696 -11.498 1.00 1.00 H new ATOM 917 N GLN A 59 131.712 14.391 -10.599 1.00 1.00 N ATOM 918 CA GLN A 59 131.939 15.792 -10.947 1.00 1.00 C ATOM 919 C GLN A 59 131.191 16.800 -10.065 1.00 1.00 C ATOM 920 O GLN A 59 131.627 17.948 -9.977 1.00 1.00 O ATOM 921 CB GLN A 59 131.540 16.023 -12.406 1.00 1.00 C ATOM 922 CG GLN A 59 132.325 15.070 -13.311 1.00 1.00 C ATOM 923 CD GLN A 59 133.812 15.405 -13.268 1.00 1.00 C ATOM 924 OE1 GLN A 59 134.209 16.521 -13.604 1.00 1.00 O ATOM 925 NE2 GLN A 59 134.665 14.499 -12.871 1.00 1.00 N ATOM 0 H GLN A 59 130.920 13.947 -11.063 1.00 1.00 H new ATOM 0 HA GLN A 59 133.002 15.969 -10.782 1.00 1.00 H new ATOM 0 HB2 GLN A 59 130.470 15.860 -12.531 1.00 1.00 H new ATOM 0 HB3 GLN A 59 131.740 17.056 -12.689 1.00 1.00 H new ATOM 0 HG2 GLN A 59 132.168 14.040 -12.990 1.00 1.00 H new ATOM 0 HG3 GLN A 59 131.958 15.144 -14.335 1.00 1.00 H new ATOM 0 HE21 GLN A 59 134.335 13.575 -12.593 1.00 1.00 H new ATOM 0 HE22 GLN A 59 135.661 14.716 -12.839 1.00 1.00 H new ATOM 934 N ILE A 60 130.060 16.417 -9.457 1.00 1.00 N ATOM 935 CA ILE A 60 129.299 17.389 -8.654 1.00 1.00 C ATOM 936 C ILE A 60 129.230 17.044 -7.172 1.00 1.00 C ATOM 937 O ILE A 60 129.555 17.888 -6.341 1.00 1.00 O ATOM 938 CB ILE A 60 127.873 17.507 -9.207 1.00 1.00 C ATOM 939 CG1 ILE A 60 127.939 18.045 -10.639 1.00 1.00 C ATOM 940 CG2 ILE A 60 127.052 18.470 -8.340 1.00 1.00 C ATOM 941 CD1 ILE A 60 126.575 17.882 -11.312 1.00 1.00 C ATOM 0 H ILE A 60 129.662 15.479 -9.500 1.00 1.00 H new ATOM 0 HA ILE A 60 129.834 18.335 -8.733 1.00 1.00 H new ATOM 0 HB ILE A 60 127.397 16.526 -9.197 1.00 1.00 H new ATOM 0 HG12 ILE A 60 128.228 19.096 -10.630 1.00 1.00 H new ATOM 0 HG13 ILE A 60 128.701 17.509 -11.205 1.00 1.00 H new ATOM 0 HG21 ILE A 60 126.041 18.548 -8.740 1.00 1.00 H new ATOM 0 HG22 ILE A 60 127.010 18.094 -7.318 1.00 1.00 H new ATOM 0 HG23 ILE A 60 127.521 19.454 -8.345 1.00 1.00 H new ATOM 0 HD11 ILE A 60 126.624 18.266 -12.331 1.00 1.00 H new ATOM 0 HD12 ILE A 60 126.304 16.826 -11.334 1.00 1.00 H new ATOM 0 HD13 ILE A 60 125.824 18.438 -10.751 1.00 1.00 H new ATOM 953 N LEU A 61 128.781 15.856 -6.811 1.00 1.00 N ATOM 954 CA LEU A 61 128.652 15.516 -5.398 1.00 1.00 C ATOM 955 C LEU A 61 129.997 15.594 -4.680 1.00 1.00 C ATOM 956 O LEU A 61 130.071 16.049 -3.541 1.00 1.00 O ATOM 957 CB LEU A 61 128.091 14.098 -5.212 1.00 1.00 C ATOM 958 CG LEU A 61 126.598 14.006 -5.613 1.00 1.00 C ATOM 959 CD1 LEU A 61 125.698 14.574 -4.514 1.00 1.00 C ATOM 960 CD2 LEU A 61 126.313 14.791 -6.885 1.00 1.00 C ATOM 0 H LEU A 61 128.503 15.120 -7.460 1.00 1.00 H new ATOM 0 HA LEU A 61 127.964 16.244 -4.968 1.00 1.00 H new ATOM 0 HB2 LEU A 61 128.671 13.397 -5.812 1.00 1.00 H new ATOM 0 HB3 LEU A 61 128.206 13.797 -4.171 1.00 1.00 H new ATOM 0 HG LEU A 61 126.387 12.948 -5.771 1.00 1.00 H new ATOM 0 HD11 LEU A 61 124.655 14.497 -4.822 1.00 1.00 H new ATOM 0 HD12 LEU A 61 125.847 14.010 -3.594 1.00 1.00 H new ATOM 0 HD13 LEU A 61 125.949 15.621 -4.343 1.00 1.00 H new ATOM 0 HD21 LEU A 61 125.256 14.704 -7.137 1.00 1.00 H new ATOM 0 HD22 LEU A 61 126.564 15.840 -6.729 1.00 1.00 H new ATOM 0 HD23 LEU A 61 126.914 14.392 -7.702 1.00 1.00 H new ATOM 972 N GLN A 62 131.055 15.117 -5.331 1.00 1.00 N ATOM 973 CA GLN A 62 132.378 15.110 -4.714 1.00 1.00 C ATOM 974 C GLN A 62 133.181 16.386 -4.996 1.00 1.00 C ATOM 975 O GLN A 62 134.352 16.472 -4.627 1.00 1.00 O ATOM 976 CB GLN A 62 133.163 13.889 -5.198 1.00 1.00 C ATOM 977 CG GLN A 62 132.545 12.622 -4.599 1.00 1.00 C ATOM 978 CD GLN A 62 133.258 11.386 -5.141 1.00 1.00 C ATOM 979 OE1 GLN A 62 134.200 11.504 -5.925 1.00 1.00 O ATOM 980 NE2 GLN A 62 132.868 10.199 -4.759 1.00 1.00 N ATOM 0 H GLN A 62 131.023 14.734 -6.276 1.00 1.00 H new ATOM 0 HA GLN A 62 132.226 15.065 -3.636 1.00 1.00 H new ATOM 0 HB2 GLN A 62 133.144 13.838 -6.287 1.00 1.00 H new ATOM 0 HB3 GLN A 62 134.208 13.973 -4.901 1.00 1.00 H new ATOM 0 HG2 GLN A 62 132.622 12.649 -3.512 1.00 1.00 H new ATOM 0 HG3 GLN A 62 131.484 12.575 -4.842 1.00 1.00 H new ATOM 0 HE21 GLN A 62 132.087 10.103 -4.109 1.00 1.00 H new ATOM 0 HE22 GLN A 62 133.344 9.368 -5.110 1.00 1.00 H new ATOM 989 N SER A 63 132.566 17.371 -5.648 1.00 1.00 N ATOM 990 CA SER A 63 133.267 18.620 -5.959 1.00 1.00 C ATOM 991 C SER A 63 133.299 19.539 -4.738 1.00 1.00 C ATOM 992 O SER A 63 132.431 19.457 -3.874 1.00 1.00 O ATOM 993 CB SER A 63 132.569 19.329 -7.118 1.00 1.00 C ATOM 994 OG SER A 63 131.525 20.150 -6.610 1.00 1.00 O ATOM 0 H SER A 63 131.598 17.333 -5.968 1.00 1.00 H new ATOM 0 HA SER A 63 134.292 18.381 -6.242 1.00 1.00 H new ATOM 0 HB2 SER A 63 133.286 19.935 -7.673 1.00 1.00 H new ATOM 0 HB3 SER A 63 132.163 18.596 -7.816 1.00 1.00 H new ATOM 0 HG SER A 63 130.732 19.601 -6.438 1.00 1.00 H new ATOM 1000 N SER A 64 134.322 20.385 -4.647 1.00 1.00 N ATOM 1001 CA SER A 64 134.476 21.268 -3.494 1.00 1.00 C ATOM 1002 C SER A 64 133.301 22.230 -3.301 1.00 1.00 C ATOM 1003 O SER A 64 132.862 22.437 -2.171 1.00 1.00 O ATOM 1004 CB SER A 64 135.779 22.061 -3.625 1.00 1.00 C ATOM 1005 OG SER A 64 136.880 21.156 -3.635 1.00 1.00 O ATOM 0 H SER A 64 135.052 20.478 -5.353 1.00 1.00 H new ATOM 0 HA SER A 64 134.502 20.629 -2.611 1.00 1.00 H new ATOM 0 HB2 SER A 64 135.769 22.651 -4.542 1.00 1.00 H new ATOM 0 HB3 SER A 64 135.877 22.762 -2.796 1.00 1.00 H new ATOM 0 HG SER A 64 137.716 21.659 -3.720 1.00 1.00 H new ATOM 1011 N GLU A 65 132.810 22.845 -4.374 1.00 1.00 N ATOM 1012 CA GLU A 65 131.716 23.801 -4.240 1.00 1.00 C ATOM 1013 C GLU A 65 130.434 23.143 -3.739 1.00 1.00 C ATOM 1014 O GLU A 65 129.761 23.687 -2.864 1.00 1.00 O ATOM 1015 CB GLU A 65 131.446 24.490 -5.585 1.00 1.00 C ATOM 1016 CG GLU A 65 132.643 25.367 -5.979 1.00 1.00 C ATOM 1017 CD GLU A 65 132.816 26.510 -4.981 1.00 1.00 C ATOM 1018 OE1 GLU A 65 131.865 26.808 -4.278 1.00 1.00 O ATOM 1019 OE2 GLU A 65 133.899 27.068 -4.934 1.00 1.00 O ATOM 0 H GLU A 65 133.144 22.703 -5.327 1.00 1.00 H new ATOM 0 HA GLU A 65 132.024 24.539 -3.500 1.00 1.00 H new ATOM 0 HB2 GLU A 65 131.265 23.741 -6.356 1.00 1.00 H new ATOM 0 HB3 GLU A 65 130.546 25.100 -5.515 1.00 1.00 H new ATOM 0 HG2 GLU A 65 133.550 24.763 -6.011 1.00 1.00 H new ATOM 0 HG3 GLU A 65 132.493 25.770 -6.981 1.00 1.00 H new ATOM 1026 N PHE A 66 130.093 21.976 -4.279 1.00 1.00 N ATOM 1027 CA PHE A 66 128.883 21.289 -3.844 1.00 1.00 C ATOM 1028 C PHE A 66 129.022 20.811 -2.407 1.00 1.00 C ATOM 1029 O PHE A 66 128.079 20.917 -1.622 1.00 1.00 O ATOM 1030 CB PHE A 66 128.565 20.096 -4.742 1.00 1.00 C ATOM 1031 CG PHE A 66 127.153 19.645 -4.450 1.00 1.00 C ATOM 1032 CD1 PHE A 66 126.074 20.402 -4.920 1.00 1.00 C ATOM 1033 CD2 PHE A 66 126.922 18.487 -3.697 1.00 1.00 C ATOM 1034 CE1 PHE A 66 124.763 20.003 -4.637 1.00 1.00 C ATOM 1035 CE2 PHE A 66 125.610 18.086 -3.418 1.00 1.00 C ATOM 1036 CZ PHE A 66 124.530 18.847 -3.887 1.00 1.00 C ATOM 0 H PHE A 66 130.626 21.495 -5.004 1.00 1.00 H new ATOM 0 HA PHE A 66 128.065 22.006 -3.911 1.00 1.00 H new ATOM 0 HB2 PHE A 66 128.666 20.373 -5.791 1.00 1.00 H new ATOM 0 HB3 PHE A 66 129.269 19.284 -4.558 1.00 1.00 H new ATOM 0 HD1 PHE A 66 126.253 21.294 -5.501 1.00 1.00 H new ATOM 0 HD2 PHE A 66 127.755 17.904 -3.332 1.00 1.00 H new ATOM 0 HE1 PHE A 66 123.931 20.589 -4.998 1.00 1.00 H new ATOM 0 HE2 PHE A 66 125.430 17.191 -2.842 1.00 1.00 H new ATOM 0 HZ PHE A 66 123.518 18.540 -3.669 1.00 1.00 H new ATOM 1046 N LYS A 67 130.189 20.270 -2.066 1.00 1.00 N ATOM 1047 CA LYS A 67 130.398 19.769 -0.721 1.00 1.00 C ATOM 1048 C LYS A 67 130.276 20.894 0.278 1.00 1.00 C ATOM 1049 O LYS A 67 129.658 20.736 1.331 1.00 1.00 O ATOM 1050 CB LYS A 67 131.769 19.103 -0.589 1.00 1.00 C ATOM 1051 CG LYS A 67 131.754 17.746 -1.302 1.00 1.00 C ATOM 1052 CD LYS A 67 133.063 17.002 -1.022 1.00 1.00 C ATOM 1053 CE LYS A 67 134.230 17.691 -1.733 1.00 1.00 C ATOM 1054 NZ LYS A 67 135.394 16.762 -1.776 1.00 1.00 N ATOM 0 H LYS A 67 130.987 20.171 -2.693 1.00 1.00 H new ATOM 0 HA LYS A 67 129.632 19.021 -0.516 1.00 1.00 H new ATOM 0 HB2 LYS A 67 132.538 19.743 -1.021 1.00 1.00 H new ATOM 0 HB3 LYS A 67 132.019 18.969 0.463 1.00 1.00 H new ATOM 0 HG2 LYS A 67 130.907 17.153 -0.958 1.00 1.00 H new ATOM 0 HG3 LYS A 67 131.628 17.889 -2.375 1.00 1.00 H new ATOM 0 HD2 LYS A 67 133.249 16.972 0.052 1.00 1.00 H new ATOM 0 HD3 LYS A 67 132.981 15.969 -1.360 1.00 1.00 H new ATOM 0 HE2 LYS A 67 133.939 17.975 -2.744 1.00 1.00 H new ATOM 0 HE3 LYS A 67 134.500 18.608 -1.209 1.00 1.00 H new ATOM 0 HZ1 LYS A 67 136.201 17.237 -2.228 1.00 1.00 H new ATOM 0 HZ2 LYS A 67 135.653 16.485 -0.808 1.00 1.00 H new ATOM 0 HZ3 LYS A 67 135.141 15.914 -2.322 1.00 1.00 H new ATOM 1068 N HIS A 68 130.877 22.034 -0.040 1.00 1.00 N ATOM 1069 CA HIS A 68 130.831 23.159 0.856 1.00 1.00 C ATOM 1070 C HIS A 68 129.416 23.685 0.977 1.00 1.00 C ATOM 1071 O HIS A 68 128.937 23.947 2.080 1.00 1.00 O ATOM 1072 CB HIS A 68 131.754 24.267 0.354 1.00 1.00 C ATOM 1073 CG HIS A 68 131.702 25.417 1.315 1.00 1.00 C ATOM 1074 ND1 HIS A 68 131.744 25.231 2.687 1.00 1.00 N ATOM 1075 CD2 HIS A 68 131.606 26.770 1.120 1.00 1.00 C ATOM 1076 CE1 HIS A 68 131.675 26.443 3.263 1.00 1.00 C ATOM 1077 NE2 HIS A 68 131.589 27.418 2.352 1.00 1.00 N ATOM 0 H HIS A 68 131.394 22.193 -0.905 1.00 1.00 H new ATOM 0 HA HIS A 68 131.167 22.830 1.839 1.00 1.00 H new ATOM 0 HB2 HIS A 68 132.775 23.896 0.266 1.00 1.00 H new ATOM 0 HB3 HIS A 68 131.446 24.592 -0.640 1.00 1.00 H new ATOM 0 HD2 HIS A 68 131.552 27.259 0.158 1.00 1.00 H new ATOM 0 HE1 HIS A 68 131.687 26.609 4.330 1.00 1.00 H new ATOM 0 HE2 HIS A 68 131.525 28.421 2.523 1.00 1.00 H new ATOM 1085 N PHE A 69 128.745 23.844 -0.158 1.00 1.00 N ATOM 1086 CA PHE A 69 127.393 24.348 -0.163 1.00 1.00 C ATOM 1087 C PHE A 69 126.502 23.397 0.610 1.00 1.00 C ATOM 1088 O PHE A 69 125.685 23.812 1.433 1.00 1.00 O ATOM 1089 CB PHE A 69 126.913 24.469 -1.613 1.00 1.00 C ATOM 1090 CG PHE A 69 125.574 25.163 -1.670 1.00 1.00 C ATOM 1091 CD1 PHE A 69 125.492 26.546 -1.466 1.00 1.00 C ATOM 1092 CD2 PHE A 69 124.417 24.428 -1.946 1.00 1.00 C ATOM 1093 CE1 PHE A 69 124.253 27.193 -1.537 1.00 1.00 C ATOM 1094 CE2 PHE A 69 123.175 25.076 -2.016 1.00 1.00 C ATOM 1095 CZ PHE A 69 123.095 26.459 -1.812 1.00 1.00 C ATOM 0 H PHE A 69 129.122 23.629 -1.081 1.00 1.00 H new ATOM 0 HA PHE A 69 127.354 25.329 0.310 1.00 1.00 H new ATOM 0 HB2 PHE A 69 127.644 25.027 -2.199 1.00 1.00 H new ATOM 0 HB3 PHE A 69 126.835 23.478 -2.060 1.00 1.00 H new ATOM 0 HD1 PHE A 69 126.386 27.114 -1.254 1.00 1.00 H new ATOM 0 HD2 PHE A 69 124.480 23.362 -2.105 1.00 1.00 H new ATOM 0 HE1 PHE A 69 124.191 28.260 -1.379 1.00 1.00 H new ATOM 0 HE2 PHE A 69 122.281 24.508 -2.227 1.00 1.00 H new ATOM 0 HZ PHE A 69 122.139 26.959 -1.867 1.00 1.00 H new ATOM 1105 N ALA A 70 126.643 22.115 0.299 1.00 1.00 N ATOM 1106 CA ALA A 70 125.845 21.076 0.905 1.00 1.00 C ATOM 1107 C ALA A 70 126.114 20.917 2.395 1.00 1.00 C ATOM 1108 O ALA A 70 125.199 20.634 3.169 1.00 1.00 O ATOM 1109 CB ALA A 70 126.118 19.750 0.195 1.00 1.00 C ATOM 0 H ALA A 70 127.319 21.773 -0.384 1.00 1.00 H new ATOM 0 HA ALA A 70 124.800 21.366 0.796 1.00 1.00 H new ATOM 0 HB1 ALA A 70 125.517 18.963 0.650 1.00 1.00 H new ATOM 0 HB2 ALA A 70 125.858 19.842 -0.859 1.00 1.00 H new ATOM 0 HB3 ALA A 70 127.175 19.499 0.287 1.00 1.00 H new ATOM 1115 N GLY A 71 127.361 21.092 2.796 1.00 1.00 N ATOM 1116 CA GLY A 71 127.710 20.951 4.194 1.00 1.00 C ATOM 1117 C GLY A 71 127.047 22.037 5.019 1.00 1.00 C ATOM 1118 O GLY A 71 126.652 21.812 6.163 1.00 1.00 O ATOM 0 H GLY A 71 128.139 21.329 2.180 1.00 1.00 H new ATOM 0 HA2 GLY A 71 127.399 19.971 4.555 1.00 1.00 H new ATOM 0 HA3 GLY A 71 128.792 21.006 4.312 1.00 1.00 H new ATOM 1122 N VAL A 72 126.964 23.230 4.444 1.00 1.00 N ATOM 1123 CA VAL A 72 126.395 24.369 5.127 1.00 1.00 C ATOM 1124 C VAL A 72 124.867 24.444 5.024 1.00 1.00 C ATOM 1125 O VAL A 72 124.210 24.753 6.021 1.00 1.00 O ATOM 1126 CB VAL A 72 127.004 25.638 4.529 1.00 1.00 C ATOM 1127 CG1 VAL A 72 126.146 26.840 4.896 1.00 1.00 C ATOM 1128 CG2 VAL A 72 128.420 25.837 5.071 1.00 1.00 C ATOM 0 H VAL A 72 127.289 23.428 3.497 1.00 1.00 H new ATOM 0 HA VAL A 72 126.628 24.266 6.187 1.00 1.00 H new ATOM 0 HB VAL A 72 127.044 25.539 3.444 1.00 1.00 H new ATOM 0 HG11 VAL A 72 126.582 27.743 4.469 1.00 1.00 H new ATOM 0 HG12 VAL A 72 125.139 26.702 4.502 1.00 1.00 H new ATOM 0 HG13 VAL A 72 126.101 26.937 5.981 1.00 1.00 H new ATOM 0 HG21 VAL A 72 128.850 26.742 4.642 1.00 1.00 H new ATOM 0 HG22 VAL A 72 128.384 25.931 6.156 1.00 1.00 H new ATOM 0 HG23 VAL A 72 129.037 24.980 4.801 1.00 1.00 H new ATOM 1138 N HIS A 73 124.300 24.269 3.824 1.00 1.00 N ATOM 1139 CA HIS A 73 122.852 24.443 3.641 1.00 1.00 C ATOM 1140 C HIS A 73 122.025 23.170 3.389 1.00 1.00 C ATOM 1141 O HIS A 73 120.810 23.304 3.236 1.00 1.00 O ATOM 1142 CB HIS A 73 122.602 25.420 2.486 1.00 1.00 C ATOM 1143 CG HIS A 73 122.959 26.825 2.902 1.00 1.00 C ATOM 1144 ND1 HIS A 73 123.896 27.584 2.214 1.00 1.00 N ATOM 1145 CD2 HIS A 73 122.500 27.633 3.917 1.00 1.00 C ATOM 1146 CE1 HIS A 73 123.970 28.785 2.815 1.00 1.00 C ATOM 1147 NE2 HIS A 73 123.141 28.869 3.858 1.00 1.00 N ATOM 0 H HIS A 73 124.810 24.012 2.979 1.00 1.00 H new ATOM 0 HA HIS A 73 122.506 24.818 4.604 1.00 1.00 H new ATOM 0 HB2 HIS A 73 123.195 25.128 1.619 1.00 1.00 H new ATOM 0 HB3 HIS A 73 121.555 25.378 2.185 1.00 1.00 H new ATOM 0 HD2 HIS A 73 121.756 27.352 4.648 1.00 1.00 H new ATOM 0 HE1 HIS A 73 124.621 29.584 2.493 1.00 1.00 H new ATOM 0 HE2 HIS A 73 123.006 29.667 4.479 1.00 1.00 H new ATOM 1155 N LEU A 74 122.612 21.965 3.263 1.00 1.00 N ATOM 1156 CA LEU A 74 121.752 20.809 2.934 1.00 1.00 C ATOM 1157 C LEU A 74 122.029 19.523 3.701 1.00 1.00 C ATOM 1158 O LEU A 74 123.113 19.320 4.248 1.00 1.00 O ATOM 1159 CB LEU A 74 121.863 20.486 1.445 1.00 1.00 C ATOM 1160 CG LEU A 74 121.317 21.640 0.599 1.00 1.00 C ATOM 1161 CD1 LEU A 74 122.449 22.587 0.196 1.00 1.00 C ATOM 1162 CD2 LEU A 74 120.669 21.054 -0.651 1.00 1.00 C ATOM 0 H LEU A 74 123.607 21.770 3.374 1.00 1.00 H new ATOM 0 HA LEU A 74 120.755 21.135 3.230 1.00 1.00 H new ATOM 0 HB2 LEU A 74 122.905 20.299 1.185 1.00 1.00 H new ATOM 0 HB3 LEU A 74 121.310 19.573 1.224 1.00 1.00 H new ATOM 0 HG LEU A 74 120.586 22.205 1.177 1.00 1.00 H new ATOM 0 HD11 LEU A 74 122.045 23.402 -0.405 1.00 1.00 H new ATOM 0 HD12 LEU A 74 122.919 22.994 1.091 1.00 1.00 H new ATOM 0 HD13 LEU A 74 123.191 22.040 -0.386 1.00 1.00 H new ATOM 0 HD21 LEU A 74 120.273 21.861 -1.268 1.00 1.00 H new ATOM 0 HD22 LEU A 74 121.413 20.495 -1.218 1.00 1.00 H new ATOM 0 HD23 LEU A 74 119.857 20.387 -0.361 1.00 1.00 H new ATOM 1174 N HIS A 75 121.052 18.618 3.627 1.00 1.00 N ATOM 1175 CA HIS A 75 121.167 17.283 4.194 1.00 1.00 C ATOM 1176 C HIS A 75 121.193 16.332 3.005 1.00 1.00 C ATOM 1177 O HIS A 75 120.279 16.366 2.179 1.00 1.00 O ATOM 1178 CB HIS A 75 119.974 16.955 5.088 1.00 1.00 C ATOM 1179 CG HIS A 75 120.017 17.804 6.328 1.00 1.00 C ATOM 1180 ND1 HIS A 75 121.097 17.789 7.196 1.00 1.00 N ATOM 1181 CD2 HIS A 75 119.109 18.676 6.873 1.00 1.00 C ATOM 1182 CE1 HIS A 75 120.814 18.628 8.209 1.00 1.00 C ATOM 1183 NE2 HIS A 75 119.615 19.196 8.061 1.00 1.00 N ATOM 0 H HIS A 75 120.158 18.796 3.170 1.00 1.00 H new ATOM 0 HA HIS A 75 122.060 17.200 4.813 1.00 1.00 H new ATOM 0 HB2 HIS A 75 119.044 17.131 4.548 1.00 1.00 H new ATOM 0 HB3 HIS A 75 119.990 15.899 5.359 1.00 1.00 H new ATOM 0 HD2 HIS A 75 118.148 18.922 6.446 1.00 1.00 H new ATOM 0 HE1 HIS A 75 121.476 18.819 9.041 1.00 1.00 H new ATOM 0 HE2 HIS A 75 119.166 19.867 8.684 1.00 1.00 H new ATOM 1191 N MET A 76 122.235 15.520 2.888 1.00 1.00 N ATOM 1192 CA MET A 76 122.344 14.617 1.744 1.00 1.00 C ATOM 1193 C MET A 76 122.074 13.167 2.136 1.00 1.00 C ATOM 1194 O MET A 76 122.502 12.695 3.190 1.00 1.00 O ATOM 1195 CB MET A 76 123.738 14.749 1.130 1.00 1.00 C ATOM 1196 CG MET A 76 124.008 16.222 0.785 1.00 1.00 C ATOM 1197 SD MET A 76 122.759 16.839 -0.376 1.00 1.00 S ATOM 1198 CE MET A 76 123.220 15.828 -1.806 1.00 1.00 C ATOM 0 H MET A 76 123.004 15.465 3.555 1.00 1.00 H new ATOM 0 HA MET A 76 121.587 14.899 1.012 1.00 1.00 H new ATOM 0 HB2 MET A 76 124.491 14.384 1.829 1.00 1.00 H new ATOM 0 HB3 MET A 76 123.812 14.135 0.233 1.00 1.00 H new ATOM 0 HG2 MET A 76 123.997 16.823 1.694 1.00 1.00 H new ATOM 0 HG3 MET A 76 125.001 16.324 0.348 1.00 1.00 H new ATOM 0 HE1 MET A 76 122.938 16.345 -2.723 1.00 1.00 H new ATOM 0 HE2 MET A 76 124.297 15.660 -1.801 1.00 1.00 H new ATOM 0 HE3 MET A 76 122.703 14.870 -1.756 1.00 1.00 H new ATOM 1208 N VAL A 77 121.348 12.471 1.262 1.00 1.00 N ATOM 1209 CA VAL A 77 121.006 11.080 1.489 1.00 1.00 C ATOM 1210 C VAL A 77 121.383 10.264 0.260 1.00 1.00 C ATOM 1211 O VAL A 77 121.087 10.650 -0.871 1.00 1.00 O ATOM 1212 CB VAL A 77 119.506 10.971 1.771 1.00 1.00 C ATOM 1213 CG1 VAL A 77 119.069 9.506 1.752 1.00 1.00 C ATOM 1214 CG2 VAL A 77 119.212 11.566 3.147 1.00 1.00 C ATOM 0 H VAL A 77 120.987 12.856 0.389 1.00 1.00 H new ATOM 0 HA VAL A 77 121.554 10.692 2.348 1.00 1.00 H new ATOM 0 HB VAL A 77 118.957 11.515 1.002 1.00 1.00 H new ATOM 0 HG11 VAL A 77 118.000 9.443 1.954 1.00 1.00 H new ATOM 0 HG12 VAL A 77 119.279 9.076 0.773 1.00 1.00 H new ATOM 0 HG13 VAL A 77 119.616 8.953 2.516 1.00 1.00 H new ATOM 0 HG21 VAL A 77 118.145 11.492 3.355 1.00 1.00 H new ATOM 0 HG22 VAL A 77 119.769 11.018 3.907 1.00 1.00 H new ATOM 0 HG23 VAL A 77 119.513 12.614 3.162 1.00 1.00 H new ATOM 1224 N GLU A 78 122.043 9.136 0.490 1.00 1.00 N ATOM 1225 CA GLU A 78 122.465 8.275 -0.604 1.00 1.00 C ATOM 1226 C GLU A 78 121.457 7.160 -0.819 1.00 1.00 C ATOM 1227 O GLU A 78 121.138 6.407 0.101 1.00 1.00 O ATOM 1228 CB GLU A 78 123.837 7.669 -0.302 1.00 1.00 C ATOM 1229 CG GLU A 78 124.306 6.843 -1.500 1.00 1.00 C ATOM 1230 CD GLU A 78 125.733 6.358 -1.272 1.00 1.00 C ATOM 1231 OE1 GLU A 78 126.213 6.497 -0.158 1.00 1.00 O ATOM 1232 OE2 GLU A 78 126.324 5.855 -2.215 1.00 1.00 O ATOM 0 H GLU A 78 122.296 8.799 1.419 1.00 1.00 H new ATOM 0 HA GLU A 78 122.529 8.879 -1.509 1.00 1.00 H new ATOM 0 HB2 GLU A 78 124.556 8.460 -0.088 1.00 1.00 H new ATOM 0 HB3 GLU A 78 123.781 7.040 0.587 1.00 1.00 H new ATOM 0 HG2 GLU A 78 123.643 5.991 -1.647 1.00 1.00 H new ATOM 0 HG3 GLU A 78 124.258 7.444 -2.408 1.00 1.00 H new ATOM 1239 N VAL A 79 120.969 7.056 -2.045 1.00 1.00 N ATOM 1240 CA VAL A 79 120.007 6.031 -2.395 1.00 1.00 C ATOM 1241 C VAL A 79 120.482 5.337 -3.666 1.00 1.00 C ATOM 1242 O VAL A 79 120.306 5.842 -4.771 1.00 1.00 O ATOM 1243 CB VAL A 79 118.630 6.669 -2.624 1.00 1.00 C ATOM 1244 CG1 VAL A 79 117.532 5.622 -2.427 1.00 1.00 C ATOM 1245 CG2 VAL A 79 118.425 7.816 -1.625 1.00 1.00 C ATOM 0 H VAL A 79 121.227 7.673 -2.815 1.00 1.00 H new ATOM 0 HA VAL A 79 119.921 5.304 -1.588 1.00 1.00 H new ATOM 0 HB VAL A 79 118.580 7.056 -3.642 1.00 1.00 H new ATOM 0 HG11 VAL A 79 116.557 6.082 -2.591 1.00 1.00 H new ATOM 0 HG12 VAL A 79 117.674 4.808 -3.138 1.00 1.00 H new ATOM 0 HG13 VAL A 79 117.582 5.229 -1.411 1.00 1.00 H new ATOM 0 HG21 VAL A 79 117.447 8.269 -1.787 1.00 1.00 H new ATOM 0 HG22 VAL A 79 118.480 7.427 -0.608 1.00 1.00 H new ATOM 0 HG23 VAL A 79 119.202 8.567 -1.769 1.00 1.00 H new ATOM 1255 N ASP A 80 121.189 4.225 -3.474 1.00 1.00 N ATOM 1256 CA ASP A 80 121.808 3.526 -4.601 1.00 1.00 C ATOM 1257 C ASP A 80 121.108 2.244 -5.033 1.00 1.00 C ATOM 1258 O ASP A 80 120.605 1.491 -4.198 1.00 1.00 O ATOM 1259 CB ASP A 80 123.270 3.209 -4.268 1.00 1.00 C ATOM 1260 CG ASP A 80 124.090 4.497 -4.226 1.00 1.00 C ATOM 1261 OD1 ASP A 80 123.580 5.517 -4.661 1.00 1.00 O ATOM 1262 OD2 ASP A 80 125.216 4.443 -3.756 1.00 1.00 O ATOM 0 H ASP A 80 121.347 3.793 -2.564 1.00 1.00 H new ATOM 0 HA ASP A 80 121.722 4.211 -5.445 1.00 1.00 H new ATOM 0 HB2 ASP A 80 123.330 2.699 -3.306 1.00 1.00 H new ATOM 0 HB3 ASP A 80 123.682 2.530 -5.015 1.00 1.00 H new ATOM 1267 N PHE A 81 121.116 1.982 -6.336 1.00 1.00 N ATOM 1268 CA PHE A 81 120.515 0.764 -6.866 1.00 1.00 C ATOM 1269 C PHE A 81 121.557 0.041 -7.718 1.00 1.00 C ATOM 1270 O PHE A 81 121.524 0.117 -8.946 1.00 1.00 O ATOM 1271 CB PHE A 81 119.298 1.107 -7.724 1.00 1.00 C ATOM 1272 CG PHE A 81 118.097 1.323 -6.834 1.00 1.00 C ATOM 1273 CD1 PHE A 81 117.304 0.233 -6.453 1.00 1.00 C ATOM 1274 CD2 PHE A 81 117.774 2.611 -6.391 1.00 1.00 C ATOM 1275 CE1 PHE A 81 116.190 0.432 -5.628 1.00 1.00 C ATOM 1276 CE2 PHE A 81 116.660 2.810 -5.567 1.00 1.00 C ATOM 1277 CZ PHE A 81 115.868 1.721 -5.186 1.00 1.00 C ATOM 0 H PHE A 81 121.529 2.593 -7.040 1.00 1.00 H new ATOM 0 HA PHE A 81 120.191 0.126 -6.044 1.00 1.00 H new ATOM 0 HB2 PHE A 81 119.495 2.004 -8.311 1.00 1.00 H new ATOM 0 HB3 PHE A 81 119.100 0.301 -8.431 1.00 1.00 H new ATOM 0 HD1 PHE A 81 117.552 -0.761 -6.795 1.00 1.00 H new ATOM 0 HD2 PHE A 81 118.385 3.452 -6.685 1.00 1.00 H new ATOM 0 HE1 PHE A 81 115.579 -0.409 -5.333 1.00 1.00 H new ATOM 0 HE2 PHE A 81 116.412 3.804 -5.225 1.00 1.00 H new ATOM 0 HZ PHE A 81 115.008 1.875 -4.551 1.00 1.00 H new ATOM 1287 N PRO A 82 122.501 -0.618 -7.092 1.00 1.00 N ATOM 1288 CA PRO A 82 123.604 -1.321 -7.806 1.00 1.00 C ATOM 1289 C PRO A 82 123.188 -2.649 -8.425 1.00 1.00 C ATOM 1290 O PRO A 82 122.167 -3.228 -8.055 1.00 1.00 O ATOM 1291 CB PRO A 82 124.656 -1.524 -6.721 1.00 1.00 C ATOM 1292 CG PRO A 82 123.883 -1.637 -5.454 1.00 1.00 C ATOM 1293 CD PRO A 82 122.621 -0.783 -5.630 1.00 1.00 C ATOM 0 HA PRO A 82 123.956 -0.741 -8.659 1.00 1.00 H new ATOM 0 HB2 PRO A 82 125.246 -2.422 -6.905 1.00 1.00 H new ATOM 0 HB3 PRO A 82 125.353 -0.687 -6.685 1.00 1.00 H new ATOM 0 HG2 PRO A 82 123.622 -2.676 -5.251 1.00 1.00 H new ATOM 0 HG3 PRO A 82 124.473 -1.285 -4.608 1.00 1.00 H new ATOM 0 HD2 PRO A 82 121.744 -1.276 -5.211 1.00 1.00 H new ATOM 0 HD3 PRO A 82 122.717 0.179 -5.126 1.00 1.00 H new ATOM 1301 N GLN A 83 124.010 -3.137 -9.345 1.00 1.00 N ATOM 1302 CA GLN A 83 123.730 -4.420 -9.976 1.00 1.00 C ATOM 1303 C GLN A 83 124.007 -5.547 -8.984 1.00 1.00 C ATOM 1304 O GLN A 83 123.217 -6.483 -8.857 1.00 1.00 O ATOM 1305 CB GLN A 83 124.592 -4.619 -11.227 1.00 1.00 C ATOM 1306 CG GLN A 83 125.897 -3.835 -11.094 1.00 1.00 C ATOM 1307 CD GLN A 83 126.871 -4.258 -12.187 1.00 1.00 C ATOM 1308 OE1 GLN A 83 126.901 -5.426 -12.574 1.00 1.00 O ATOM 1309 NE2 GLN A 83 127.673 -3.373 -12.713 1.00 1.00 N ATOM 0 H GLN A 83 124.860 -2.674 -9.666 1.00 1.00 H new ATOM 0 HA GLN A 83 122.682 -4.434 -10.274 1.00 1.00 H new ATOM 0 HB2 GLN A 83 124.807 -5.679 -11.365 1.00 1.00 H new ATOM 0 HB3 GLN A 83 124.047 -4.287 -12.111 1.00 1.00 H new ATOM 0 HG2 GLN A 83 125.698 -2.766 -11.166 1.00 1.00 H new ATOM 0 HG3 GLN A 83 126.339 -4.011 -10.113 1.00 1.00 H new ATOM 0 HE21 GLN A 83 127.647 -2.406 -12.391 1.00 1.00 H new ATOM 0 HE22 GLN A 83 128.326 -3.649 -13.446 1.00 1.00 H new ATOM 1318 N LYS A 84 125.099 -5.420 -8.245 1.00 1.00 N ATOM 1319 CA LYS A 84 125.436 -6.393 -7.225 1.00 1.00 C ATOM 1320 C LYS A 84 124.996 -5.819 -5.892 1.00 1.00 C ATOM 1321 O LYS A 84 125.634 -4.937 -5.316 1.00 1.00 O ATOM 1322 CB LYS A 84 126.933 -6.667 -7.218 1.00 1.00 C ATOM 1323 CG LYS A 84 127.195 -8.105 -6.770 1.00 1.00 C ATOM 1324 CD LYS A 84 128.687 -8.382 -6.890 1.00 1.00 C ATOM 1325 CE LYS A 84 129.001 -9.810 -6.442 1.00 1.00 C ATOM 1326 NZ LYS A 84 130.465 -10.052 -6.578 1.00 1.00 N ATOM 0 H LYS A 84 125.764 -4.652 -8.335 1.00 1.00 H new ATOM 0 HA LYS A 84 124.934 -7.340 -7.421 1.00 1.00 H new ATOM 0 HB2 LYS A 84 127.346 -6.506 -8.214 1.00 1.00 H new ATOM 0 HB3 LYS A 84 127.436 -5.970 -6.548 1.00 1.00 H new ATOM 0 HG2 LYS A 84 126.864 -8.248 -5.741 1.00 1.00 H new ATOM 0 HG3 LYS A 84 126.629 -8.803 -7.387 1.00 1.00 H new ATOM 0 HD2 LYS A 84 129.008 -8.239 -7.922 1.00 1.00 H new ATOM 0 HD3 LYS A 84 129.246 -7.672 -6.281 1.00 1.00 H new ATOM 0 HE2 LYS A 84 128.690 -9.957 -5.408 1.00 1.00 H new ATOM 0 HE3 LYS A 84 128.444 -10.525 -7.047 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 130.686 -11.022 -6.275 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 130.747 -9.927 -7.571 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 130.985 -9.376 -5.983 1.00 1.00 H new ATOM 1340 N ASN A 85 123.871 -6.327 -5.452 1.00 1.00 N ATOM 1341 CA ASN A 85 123.257 -5.878 -4.202 1.00 1.00 C ATOM 1342 C ASN A 85 123.785 -6.631 -2.979 1.00 1.00 C ATOM 1343 O ASN A 85 123.664 -7.850 -2.863 1.00 1.00 O ATOM 1344 CB ASN A 85 121.742 -6.076 -4.271 1.00 1.00 C ATOM 1345 CG ASN A 85 121.140 -5.168 -5.333 1.00 1.00 C ATOM 1346 OD1 ASN A 85 121.620 -4.056 -5.549 1.00 1.00 O ATOM 1347 ND2 ASN A 85 120.107 -5.582 -6.012 1.00 1.00 N ATOM 0 H ASN A 85 123.350 -7.058 -5.937 1.00 1.00 H new ATOM 0 HA ASN A 85 123.513 -4.825 -4.088 1.00 1.00 H new ATOM 0 HB2 ASN A 85 121.514 -7.117 -4.501 1.00 1.00 H new ATOM 0 HB3 ASN A 85 121.295 -5.859 -3.301 1.00 1.00 H new ATOM 0 HD21 ASN A 85 119.693 -4.983 -6.726 1.00 1.00 H new ATOM 0 HD22 ASN A 85 119.713 -6.505 -5.829 1.00 1.00 H new ATOM 1354 N HIS A 86 124.354 -5.845 -2.068 1.00 1.00 N ATOM 1355 CA HIS A 86 124.891 -6.395 -0.826 1.00 1.00 C ATOM 1356 C HIS A 86 124.300 -5.658 0.379 1.00 1.00 C ATOM 1357 O HIS A 86 124.792 -5.796 1.497 1.00 1.00 O ATOM 1358 CB HIS A 86 126.418 -6.273 -0.810 1.00 1.00 C ATOM 1359 CG HIS A 86 127.012 -7.195 -1.841 1.00 1.00 C ATOM 1360 ND1 HIS A 86 127.119 -8.563 -1.638 1.00 1.00 N ATOM 1361 CD2 HIS A 86 127.550 -6.959 -3.080 1.00 1.00 C ATOM 1362 CE1 HIS A 86 127.703 -9.090 -2.729 1.00 1.00 C ATOM 1363 NE2 HIS A 86 127.987 -8.156 -3.639 1.00 1.00 N ATOM 0 H HIS A 86 124.455 -4.835 -2.165 1.00 1.00 H new ATOM 0 HA HIS A 86 124.618 -7.449 -0.767 1.00 1.00 H new ATOM 0 HB2 HIS A 86 126.712 -5.244 -1.016 1.00 1.00 H new ATOM 0 HB3 HIS A 86 126.802 -6.522 0.179 1.00 1.00 H new ATOM 0 HD1 HIS A 86 126.811 -9.076 -0.812 1.00 1.00 H new ATOM 0 HD2 HIS A 86 127.623 -5.990 -3.551 1.00 1.00 H new ATOM 0 HE1 HIS A 86 127.916 -10.141 -2.854 1.00 1.00 H new ATOM 1371 N GLN A 87 123.232 -4.893 0.153 1.00 1.00 N ATOM 1372 CA GLN A 87 122.583 -4.165 1.243 1.00 1.00 C ATOM 1373 C GLN A 87 121.618 -5.091 1.990 1.00 1.00 C ATOM 1374 O GLN A 87 121.119 -6.059 1.418 1.00 1.00 O ATOM 1375 CB GLN A 87 121.803 -2.973 0.679 1.00 1.00 C ATOM 1376 CG GLN A 87 122.651 -1.700 0.766 1.00 1.00 C ATOM 1377 CD GLN A 87 123.966 -1.892 0.016 1.00 1.00 C ATOM 1378 OE1 GLN A 87 124.082 -1.500 -1.145 1.00 1.00 O ATOM 1379 NE2 GLN A 87 124.967 -2.472 0.616 1.00 1.00 N ATOM 0 H GLN A 87 122.802 -4.762 -0.763 1.00 1.00 H new ATOM 0 HA GLN A 87 123.349 -3.808 1.932 1.00 1.00 H new ATOM 0 HB2 GLN A 87 121.528 -3.166 -0.358 1.00 1.00 H new ATOM 0 HB3 GLN A 87 120.875 -2.840 1.235 1.00 1.00 H new ATOM 0 HG2 GLN A 87 122.102 -0.859 0.343 1.00 1.00 H new ATOM 0 HG3 GLN A 87 122.851 -1.458 1.810 1.00 1.00 H new ATOM 0 HE21 GLN A 87 124.867 -2.795 1.578 1.00 1.00 H new ATOM 0 HE22 GLN A 87 125.851 -2.602 0.123 1.00 1.00 H new ATOM 1388 N PRO A 88 121.332 -4.818 3.245 1.00 1.00 N ATOM 1389 CA PRO A 88 120.393 -5.655 4.055 1.00 1.00 C ATOM 1390 C PRO A 88 118.957 -5.521 3.554 1.00 1.00 C ATOM 1391 O PRO A 88 118.610 -4.530 2.911 1.00 1.00 O ATOM 1392 CB PRO A 88 120.536 -5.098 5.472 1.00 1.00 C ATOM 1393 CG PRO A 88 120.976 -3.689 5.281 1.00 1.00 C ATOM 1394 CD PRO A 88 121.858 -3.688 4.032 1.00 1.00 C ATOM 0 HA PRO A 88 120.624 -6.719 3.995 1.00 1.00 H new ATOM 0 HB2 PRO A 88 119.592 -5.148 6.014 1.00 1.00 H new ATOM 0 HB3 PRO A 88 121.266 -5.666 6.049 1.00 1.00 H new ATOM 0 HG2 PRO A 88 120.120 -3.027 5.154 1.00 1.00 H new ATOM 0 HG3 PRO A 88 121.529 -3.332 6.150 1.00 1.00 H new ATOM 0 HD2 PRO A 88 121.782 -2.748 3.486 1.00 1.00 H new ATOM 0 HD3 PRO A 88 122.910 -3.827 4.282 1.00 1.00 H new ATOM 1402 N GLU A 89 118.132 -6.531 3.819 1.00 1.00 N ATOM 1403 CA GLU A 89 116.749 -6.518 3.360 1.00 1.00 C ATOM 1404 C GLU A 89 116.031 -5.222 3.738 1.00 1.00 C ATOM 1405 O GLU A 89 115.363 -4.627 2.901 1.00 1.00 O ATOM 1406 CB GLU A 89 115.995 -7.720 3.945 1.00 1.00 C ATOM 1407 CG GLU A 89 116.527 -9.010 3.316 1.00 1.00 C ATOM 1408 CD GLU A 89 115.812 -10.219 3.914 1.00 1.00 C ATOM 1409 OE1 GLU A 89 114.976 -10.019 4.780 1.00 1.00 O ATOM 1410 OE2 GLU A 89 116.107 -11.325 3.493 1.00 1.00 O ATOM 0 H GLU A 89 118.397 -7.363 4.346 1.00 1.00 H new ATOM 0 HA GLU A 89 116.763 -6.582 2.272 1.00 1.00 H new ATOM 0 HB2 GLU A 89 116.122 -7.751 5.027 1.00 1.00 H new ATOM 0 HB3 GLU A 89 114.927 -7.622 3.752 1.00 1.00 H new ATOM 0 HG2 GLU A 89 116.377 -8.986 2.237 1.00 1.00 H new ATOM 0 HG3 GLU A 89 117.600 -9.091 3.487 1.00 1.00 H new ATOM 1417 N GLU A 90 116.140 -4.785 4.991 1.00 1.00 N ATOM 1418 CA GLU A 90 115.451 -3.565 5.420 1.00 1.00 C ATOM 1419 C GLU A 90 115.846 -2.358 4.579 1.00 1.00 C ATOM 1420 O GLU A 90 114.995 -1.549 4.209 1.00 1.00 O ATOM 1421 CB GLU A 90 115.775 -3.270 6.886 1.00 1.00 C ATOM 1422 CG GLU A 90 115.127 -4.325 7.779 1.00 1.00 C ATOM 1423 CD GLU A 90 115.531 -4.097 9.232 1.00 1.00 C ATOM 1424 OE1 GLU A 90 116.153 -3.081 9.501 1.00 1.00 O ATOM 1425 OE2 GLU A 90 115.206 -4.938 10.056 1.00 1.00 O ATOM 0 H GLU A 90 116.688 -5.246 5.717 1.00 1.00 H new ATOM 0 HA GLU A 90 114.383 -3.738 5.291 1.00 1.00 H new ATOM 0 HB2 GLU A 90 116.855 -3.266 7.036 1.00 1.00 H new ATOM 0 HB3 GLU A 90 115.412 -2.278 7.156 1.00 1.00 H new ATOM 0 HG2 GLU A 90 114.042 -4.278 7.683 1.00 1.00 H new ATOM 0 HG3 GLU A 90 115.433 -5.321 7.460 1.00 1.00 H new ATOM 1432 N GLN A 91 117.128 -2.240 4.271 1.00 1.00 N ATOM 1433 CA GLN A 91 117.594 -1.117 3.467 1.00 1.00 C ATOM 1434 C GLN A 91 117.097 -1.249 2.036 1.00 1.00 C ATOM 1435 O GLN A 91 116.723 -0.256 1.414 1.00 1.00 O ATOM 1436 CB GLN A 91 119.123 -1.035 3.469 1.00 1.00 C ATOM 1437 CG GLN A 91 119.570 0.189 2.659 1.00 1.00 C ATOM 1438 CD GLN A 91 121.086 0.325 2.691 1.00 1.00 C ATOM 1439 OE1 GLN A 91 121.745 -0.228 3.573 1.00 1.00 O ATOM 1440 NE2 GLN A 91 121.683 1.033 1.770 1.00 1.00 N ATOM 0 H GLN A 91 117.855 -2.895 4.559 1.00 1.00 H new ATOM 0 HA GLN A 91 117.194 -0.204 3.908 1.00 1.00 H new ATOM 0 HB2 GLN A 91 119.493 -0.962 4.492 1.00 1.00 H new ATOM 0 HB3 GLN A 91 119.547 -1.943 3.040 1.00 1.00 H new ATOM 0 HG2 GLN A 91 119.229 0.094 1.628 1.00 1.00 H new ATOM 0 HG3 GLN A 91 119.110 1.089 3.066 1.00 1.00 H new ATOM 0 HE21 GLN A 91 121.134 1.489 1.042 1.00 1.00 H new ATOM 0 HE22 GLN A 91 122.698 1.130 1.779 1.00 1.00 H new ATOM 1449 N ARG A 92 117.096 -2.470 1.509 1.00 1.00 N ATOM 1450 CA ARG A 92 116.641 -2.699 0.145 1.00 1.00 C ATOM 1451 C ARG A 92 115.153 -2.392 0.011 1.00 1.00 C ATOM 1452 O ARG A 92 114.735 -1.763 -0.960 1.00 1.00 O ATOM 1453 CB ARG A 92 116.901 -4.153 -0.256 1.00 1.00 C ATOM 1454 CG ARG A 92 118.404 -4.378 -0.431 1.00 1.00 C ATOM 1455 CD ARG A 92 118.662 -5.856 -0.727 1.00 1.00 C ATOM 1456 NE ARG A 92 118.066 -6.229 -2.003 1.00 1.00 N ATOM 1457 CZ ARG A 92 118.018 -7.499 -2.390 1.00 1.00 C ATOM 1458 NH1 ARG A 92 118.525 -8.433 -1.629 1.00 1.00 N ATOM 1459 NH2 ARG A 92 117.468 -7.817 -3.530 1.00 1.00 N ATOM 0 H ARG A 92 117.403 -3.308 2.002 1.00 1.00 H new ATOM 0 HA ARG A 92 117.196 -2.033 -0.516 1.00 1.00 H new ATOM 0 HB2 ARG A 92 116.509 -4.826 0.506 1.00 1.00 H new ATOM 0 HB3 ARG A 92 116.378 -4.383 -1.184 1.00 1.00 H new ATOM 0 HG2 ARG A 92 118.784 -3.760 -1.245 1.00 1.00 H new ATOM 0 HG3 ARG A 92 118.936 -4.078 0.472 1.00 1.00 H new ATOM 0 HD2 ARG A 92 119.735 -6.047 -0.750 1.00 1.00 H new ATOM 0 HD3 ARG A 92 118.245 -6.471 0.070 1.00 1.00 H new ATOM 0 HE ARG A 92 117.680 -5.504 -2.608 1.00 1.00 H new ATOM 0 HH11 ARG A 92 118.957 -8.187 -0.739 1.00 1.00 H new ATOM 0 HH12 ARG A 92 118.488 -9.408 -1.926 1.00 1.00 H new ATOM 0 HH21 ARG A 92 117.074 -7.090 -4.126 1.00 1.00 H new ATOM 0 HH22 ARG A 92 117.433 -8.793 -3.825 1.00 1.00 H new ATOM 1473 N GLN A 93 114.350 -2.834 0.976 1.00 1.00 N ATOM 1474 CA GLN A 93 112.914 -2.587 0.920 1.00 1.00 C ATOM 1475 C GLN A 93 112.637 -1.088 1.002 1.00 1.00 C ATOM 1476 O GLN A 93 111.804 -0.555 0.267 1.00 1.00 O ATOM 1477 CB GLN A 93 112.217 -3.316 2.072 1.00 1.00 C ATOM 1478 CG GLN A 93 112.429 -4.825 1.915 1.00 1.00 C ATOM 1479 CD GLN A 93 111.584 -5.363 0.767 1.00 1.00 C ATOM 1480 OE1 GLN A 93 110.406 -5.021 0.648 1.00 1.00 O ATOM 1481 NE2 GLN A 93 112.114 -6.193 -0.090 1.00 1.00 N ATOM 0 H GLN A 93 114.664 -3.357 1.794 1.00 1.00 H new ATOM 0 HA GLN A 93 112.524 -2.964 -0.026 1.00 1.00 H new ATOM 0 HB2 GLN A 93 112.618 -2.978 3.028 1.00 1.00 H new ATOM 0 HB3 GLN A 93 111.152 -3.085 2.073 1.00 1.00 H new ATOM 0 HG2 GLN A 93 113.483 -5.033 1.728 1.00 1.00 H new ATOM 0 HG3 GLN A 93 112.163 -5.334 2.841 1.00 1.00 H new ATOM 0 HE21 GLN A 93 113.089 -6.475 0.010 1.00 1.00 H new ATOM 0 HE22 GLN A 93 111.553 -6.559 -0.859 1.00 1.00 H new ATOM 1490 N LYS A 94 113.339 -0.421 1.906 1.00 1.00 N ATOM 1491 CA LYS A 94 113.178 1.014 2.104 1.00 1.00 C ATOM 1492 C LYS A 94 113.526 1.794 0.834 1.00 1.00 C ATOM 1493 O LYS A 94 112.790 2.689 0.419 1.00 1.00 O ATOM 1494 CB LYS A 94 114.095 1.436 3.249 1.00 1.00 C ATOM 1495 CG LYS A 94 113.958 2.927 3.513 1.00 1.00 C ATOM 1496 CD LYS A 94 114.833 3.301 4.703 1.00 1.00 C ATOM 1497 CE LYS A 94 114.817 4.811 4.863 1.00 1.00 C ATOM 1498 NZ LYS A 94 113.435 5.259 5.194 1.00 1.00 N ATOM 0 H LYS A 94 114.031 -0.853 2.519 1.00 1.00 H new ATOM 0 HA LYS A 94 112.138 1.234 2.343 1.00 1.00 H new ATOM 0 HB2 LYS A 94 113.844 0.876 4.150 1.00 1.00 H new ATOM 0 HB3 LYS A 94 115.129 1.197 3.002 1.00 1.00 H new ATOM 0 HG2 LYS A 94 114.257 3.495 2.632 1.00 1.00 H new ATOM 0 HG3 LYS A 94 112.917 3.180 3.716 1.00 1.00 H new ATOM 0 HD2 LYS A 94 114.464 2.821 5.609 1.00 1.00 H new ATOM 0 HD3 LYS A 94 115.853 2.948 4.548 1.00 1.00 H new ATOM 0 HE2 LYS A 94 115.507 5.112 5.651 1.00 1.00 H new ATOM 0 HE3 LYS A 94 115.156 5.289 3.944 1.00 1.00 H new ATOM 0 HZ1 LYS A 94 113.028 5.760 4.379 1.00 1.00 H new ATOM 0 HZ2 LYS A 94 112.847 4.432 5.421 1.00 1.00 H new ATOM 0 HZ3 LYS A 94 113.464 5.899 6.014 1.00 1.00 H new ATOM 1512 N ASN A 95 114.658 1.452 0.240 1.00 1.00 N ATOM 1513 CA ASN A 95 115.111 2.131 -0.972 1.00 1.00 C ATOM 1514 C ASN A 95 114.063 2.027 -2.080 1.00 1.00 C ATOM 1515 O ASN A 95 113.844 2.988 -2.817 1.00 1.00 O ATOM 1516 CB ASN A 95 116.423 1.511 -1.465 1.00 1.00 C ATOM 1517 CG ASN A 95 117.584 1.944 -0.577 1.00 1.00 C ATOM 1518 OD1 ASN A 95 117.480 2.934 0.147 1.00 1.00 O ATOM 1519 ND2 ASN A 95 118.694 1.256 -0.591 1.00 1.00 N ATOM 0 H ASN A 95 115.279 0.714 0.571 1.00 1.00 H new ATOM 0 HA ASN A 95 115.267 3.182 -0.729 1.00 1.00 H new ATOM 0 HB2 ASN A 95 116.342 0.424 -1.463 1.00 1.00 H new ATOM 0 HB3 ASN A 95 116.612 1.815 -2.495 1.00 1.00 H new ATOM 0 HD21 ASN A 95 119.477 1.539 -0.001 1.00 1.00 H new ATOM 0 HD22 ASN A 95 118.778 0.436 -1.192 1.00 1.00 H new ATOM 1526 N GLN A 96 113.415 0.872 -2.205 1.00 1.00 N ATOM 1527 CA GLN A 96 112.405 0.690 -3.240 1.00 1.00 C ATOM 1528 C GLN A 96 111.185 1.553 -2.966 1.00 1.00 C ATOM 1529 O GLN A 96 110.598 2.114 -3.889 1.00 1.00 O ATOM 1530 CB GLN A 96 111.989 -0.776 -3.315 1.00 1.00 C ATOM 1531 CG GLN A 96 113.164 -1.603 -3.834 1.00 1.00 C ATOM 1532 CD GLN A 96 112.796 -3.081 -3.858 1.00 1.00 C ATOM 1533 OE1 GLN A 96 111.701 -3.445 -4.281 1.00 1.00 O ATOM 1534 NE2 GLN A 96 113.662 -3.960 -3.432 1.00 1.00 N ATOM 0 H GLN A 96 113.569 0.058 -1.610 1.00 1.00 H new ATOM 0 HA GLN A 96 112.839 0.994 -4.193 1.00 1.00 H new ATOM 0 HB2 GLN A 96 111.685 -1.131 -2.330 1.00 1.00 H new ATOM 0 HB3 GLN A 96 111.129 -0.890 -3.975 1.00 1.00 H new ATOM 0 HG2 GLN A 96 113.437 -1.272 -4.836 1.00 1.00 H new ATOM 0 HG3 GLN A 96 114.036 -1.448 -3.199 1.00 1.00 H new ATOM 0 HE21 GLN A 96 114.570 -3.653 -3.082 1.00 1.00 H new ATOM 0 HE22 GLN A 96 113.431 -4.953 -3.449 1.00 1.00 H new ATOM 1543 N GLU A 97 110.800 1.665 -1.700 1.00 1.00 N ATOM 1544 CA GLU A 97 109.644 2.475 -1.368 1.00 1.00 C ATOM 1545 C GLU A 97 109.894 3.925 -1.752 1.00 1.00 C ATOM 1546 O GLU A 97 109.032 4.588 -2.324 1.00 1.00 O ATOM 1547 CB GLU A 97 109.322 2.385 0.126 1.00 1.00 C ATOM 1548 CG GLU A 97 108.786 0.992 0.469 1.00 1.00 C ATOM 1549 CD GLU A 97 108.501 0.902 1.965 1.00 1.00 C ATOM 1550 OE1 GLU A 97 108.736 1.881 2.653 1.00 1.00 O ATOM 1551 OE2 GLU A 97 108.046 -0.142 2.402 1.00 1.00 O ATOM 0 H GLU A 97 111.260 1.216 -0.908 1.00 1.00 H new ATOM 0 HA GLU A 97 108.791 2.093 -1.929 1.00 1.00 H new ATOM 0 HB2 GLU A 97 110.218 2.592 0.712 1.00 1.00 H new ATOM 0 HB3 GLU A 97 108.585 3.142 0.393 1.00 1.00 H new ATOM 0 HG2 GLU A 97 107.876 0.793 -0.097 1.00 1.00 H new ATOM 0 HG3 GLU A 97 109.512 0.232 0.181 1.00 1.00 H new ATOM 1558 N LEU A 98 111.093 4.408 -1.447 1.00 1.00 N ATOM 1559 CA LEU A 98 111.468 5.778 -1.772 1.00 1.00 C ATOM 1560 C LEU A 98 111.539 5.981 -3.280 1.00 1.00 C ATOM 1561 O LEU A 98 111.128 7.015 -3.802 1.00 1.00 O ATOM 1562 CB LEU A 98 112.816 6.130 -1.127 1.00 1.00 C ATOM 1563 CG LEU A 98 112.600 6.736 0.270 1.00 1.00 C ATOM 1564 CD1 LEU A 98 111.580 5.921 1.072 1.00 1.00 C ATOM 1565 CD2 LEU A 98 113.930 6.746 1.026 1.00 1.00 C ATOM 0 H LEU A 98 111.821 3.871 -0.976 1.00 1.00 H new ATOM 0 HA LEU A 98 110.701 6.442 -1.373 1.00 1.00 H new ATOM 0 HB2 LEU A 98 113.434 5.236 -1.051 1.00 1.00 H new ATOM 0 HB3 LEU A 98 113.355 6.837 -1.758 1.00 1.00 H new ATOM 0 HG LEU A 98 112.220 7.751 0.149 1.00 1.00 H new ATOM 0 HD11 LEU A 98 111.447 6.372 2.055 1.00 1.00 H new ATOM 0 HD12 LEU A 98 110.626 5.912 0.545 1.00 1.00 H new ATOM 0 HD13 LEU A 98 111.941 4.899 1.187 1.00 1.00 H new ATOM 0 HD21 LEU A 98 113.782 7.175 2.017 1.00 1.00 H new ATOM 0 HD22 LEU A 98 114.301 5.726 1.124 1.00 1.00 H new ATOM 0 HD23 LEU A 98 114.656 7.345 0.476 1.00 1.00 H new ATOM 1577 N LYS A 99 112.057 4.983 -3.978 1.00 1.00 N ATOM 1578 CA LYS A 99 112.172 5.062 -5.419 1.00 1.00 C ATOM 1579 C LYS A 99 110.787 5.209 -6.019 1.00 1.00 C ATOM 1580 O LYS A 99 110.595 5.953 -6.981 1.00 1.00 O ATOM 1581 CB LYS A 99 112.850 3.790 -5.945 1.00 1.00 C ATOM 1582 CG LYS A 99 113.100 3.900 -7.452 1.00 1.00 C ATOM 1583 CD LYS A 99 113.824 2.641 -7.939 1.00 1.00 C ATOM 1584 CE LYS A 99 114.099 2.750 -9.440 1.00 1.00 C ATOM 1585 NZ LYS A 99 114.824 1.532 -9.904 1.00 1.00 N ATOM 0 H LYS A 99 112.402 4.114 -3.570 1.00 1.00 H new ATOM 0 HA LYS A 99 112.776 5.925 -5.701 1.00 1.00 H new ATOM 0 HB2 LYS A 99 113.794 3.632 -5.424 1.00 1.00 H new ATOM 0 HB3 LYS A 99 112.222 2.923 -5.737 1.00 1.00 H new ATOM 0 HG2 LYS A 99 112.154 4.017 -7.981 1.00 1.00 H new ATOM 0 HG3 LYS A 99 113.699 4.785 -7.669 1.00 1.00 H new ATOM 0 HD2 LYS A 99 114.761 2.516 -7.396 1.00 1.00 H new ATOM 0 HD3 LYS A 99 113.217 1.759 -7.734 1.00 1.00 H new ATOM 0 HE2 LYS A 99 113.161 2.857 -9.985 1.00 1.00 H new ATOM 0 HE3 LYS A 99 114.692 3.640 -9.648 1.00 1.00 H new ATOM 0 HZ1 LYS A 99 115.011 1.607 -10.924 1.00 1.00 H new ATOM 0 HZ2 LYS A 99 115.726 1.449 -9.392 1.00 1.00 H new ATOM 0 HZ3 LYS A 99 114.242 0.690 -9.719 1.00 1.00 H new ATOM 1599 N ALA A 100 109.820 4.499 -5.449 1.00 1.00 N ATOM 1600 CA ALA A 100 108.455 4.561 -5.933 1.00 1.00 C ATOM 1601 C ALA A 100 107.712 5.768 -5.364 1.00 1.00 C ATOM 1602 O ALA A 100 106.892 6.377 -6.046 1.00 1.00 O ATOM 1603 CB ALA A 100 107.723 3.294 -5.536 1.00 1.00 C ATOM 0 H ALA A 100 109.960 3.876 -4.653 1.00 1.00 H new ATOM 0 HA ALA A 100 108.486 4.660 -7.018 1.00 1.00 H new ATOM 0 HB1 ALA A 100 106.696 3.338 -5.899 1.00 1.00 H new ATOM 0 HB2 ALA A 100 108.226 2.431 -5.973 1.00 1.00 H new ATOM 0 HB3 ALA A 100 107.720 3.200 -4.450 1.00 1.00 H new ATOM 1609 N GLN A 101 107.976 6.095 -4.099 1.00 1.00 N ATOM 1610 CA GLN A 101 107.291 7.198 -3.463 1.00 1.00 C ATOM 1611 C GLN A 101 107.647 8.522 -4.122 1.00 1.00 C ATOM 1612 O GLN A 101 106.794 9.392 -4.286 1.00 1.00 O ATOM 1613 CB GLN A 101 107.596 7.194 -1.967 1.00 1.00 C ATOM 1614 CG GLN A 101 106.952 8.402 -1.308 1.00 1.00 C ATOM 1615 CD GLN A 101 107.066 8.293 0.210 1.00 1.00 C ATOM 1616 OE1 GLN A 101 107.274 7.202 0.740 1.00 1.00 O ATOM 1617 NE2 GLN A 101 106.949 9.365 0.944 1.00 1.00 N ATOM 0 H GLN A 101 108.653 5.613 -3.508 1.00 1.00 H new ATOM 0 HA GLN A 101 106.216 7.074 -3.589 1.00 1.00 H new ATOM 0 HB2 GLN A 101 107.221 6.277 -1.512 1.00 1.00 H new ATOM 0 HB3 GLN A 101 108.674 7.212 -1.806 1.00 1.00 H new ATOM 0 HG2 GLN A 101 107.437 9.316 -1.652 1.00 1.00 H new ATOM 0 HG3 GLN A 101 105.903 8.469 -1.598 1.00 1.00 H new ATOM 0 HE21 GLN A 101 106.777 10.269 0.503 1.00 1.00 H new ATOM 0 HE22 GLN A 101 107.030 9.300 1.959 1.00 1.00 H new ATOM 1626 N TYR A 102 108.918 8.680 -4.481 1.00 1.00 N ATOM 1627 CA TYR A 102 109.390 9.908 -5.100 1.00 1.00 C ATOM 1628 C TYR A 102 109.279 9.814 -6.614 1.00 1.00 C ATOM 1629 O TYR A 102 109.711 10.704 -7.345 1.00 1.00 O ATOM 1630 CB TYR A 102 110.854 10.170 -4.702 1.00 1.00 C ATOM 1631 CG TYR A 102 110.941 10.584 -3.243 1.00 1.00 C ATOM 1632 CD1 TYR A 102 110.580 9.682 -2.233 1.00 1.00 C ATOM 1633 CD2 TYR A 102 111.391 11.868 -2.895 1.00 1.00 C ATOM 1634 CE1 TYR A 102 110.661 10.059 -0.889 1.00 1.00 C ATOM 1635 CE2 TYR A 102 111.472 12.241 -1.548 1.00 1.00 C ATOM 1636 CZ TYR A 102 111.106 11.337 -0.547 1.00 1.00 C ATOM 1637 OH TYR A 102 111.187 11.705 0.779 1.00 1.00 O ATOM 0 H TYR A 102 109.638 7.969 -4.352 1.00 1.00 H new ATOM 0 HA TYR A 102 108.770 10.734 -4.751 1.00 1.00 H new ATOM 0 HB2 TYR A 102 111.449 9.272 -4.868 1.00 1.00 H new ATOM 0 HB3 TYR A 102 111.275 10.952 -5.334 1.00 1.00 H new ATOM 0 HD1 TYR A 102 110.238 8.691 -2.494 1.00 1.00 H new ATOM 0 HD2 TYR A 102 111.675 12.568 -3.667 1.00 1.00 H new ATOM 0 HE1 TYR A 102 110.379 9.361 -0.115 1.00 1.00 H new ATOM 0 HE2 TYR A 102 111.818 13.229 -1.282 1.00 1.00 H new ATOM 0 HH TYR A 102 111.357 10.912 1.329 1.00 1.00 H new ATOM 1647 N LYS A 103 108.676 8.712 -7.064 1.00 1.00 N ATOM 1648 CA LYS A 103 108.478 8.478 -8.483 1.00 1.00 C ATOM 1649 C LYS A 103 109.784 8.627 -9.233 1.00 1.00 C ATOM 1650 O LYS A 103 109.854 9.330 -10.240 1.00 1.00 O ATOM 1651 CB LYS A 103 107.450 9.450 -9.052 1.00 1.00 C ATOM 1652 CG LYS A 103 106.063 9.101 -8.512 1.00 1.00 C ATOM 1653 CD LYS A 103 105.034 10.028 -9.157 1.00 1.00 C ATOM 1654 CE LYS A 103 103.642 9.719 -8.612 1.00 1.00 C ATOM 1655 NZ LYS A 103 102.639 10.546 -9.337 1.00 1.00 N ATOM 0 H LYS A 103 108.319 7.971 -6.461 1.00 1.00 H new ATOM 0 HA LYS A 103 108.109 7.460 -8.606 1.00 1.00 H new ATOM 0 HB2 LYS A 103 107.711 10.473 -8.779 1.00 1.00 H new ATOM 0 HB3 LYS A 103 107.451 9.400 -10.141 1.00 1.00 H new ATOM 0 HG2 LYS A 103 105.824 8.061 -8.732 1.00 1.00 H new ATOM 0 HG3 LYS A 103 106.042 9.211 -7.428 1.00 1.00 H new ATOM 0 HD2 LYS A 103 105.291 11.068 -8.954 1.00 1.00 H new ATOM 0 HD3 LYS A 103 105.046 9.902 -10.240 1.00 1.00 H new ATOM 0 HE2 LYS A 103 103.416 8.660 -8.736 1.00 1.00 H new ATOM 0 HE3 LYS A 103 103.601 9.930 -7.543 1.00 1.00 H new ATOM 0 HZ1 LYS A 103 101.688 10.340 -8.970 1.00 1.00 H new ATOM 0 HZ2 LYS A 103 102.853 11.554 -9.196 1.00 1.00 H new ATOM 0 HZ3 LYS A 103 102.674 10.323 -10.352 1.00 1.00 H new ATOM 1669 N VAL A 104 110.817 7.967 -8.745 1.00 1.00 N ATOM 1670 CA VAL A 104 112.109 8.046 -9.392 1.00 1.00 C ATOM 1671 C VAL A 104 112.214 6.941 -10.441 1.00 1.00 C ATOM 1672 O VAL A 104 112.003 5.767 -10.136 1.00 1.00 O ATOM 1673 CB VAL A 104 113.219 7.911 -8.349 1.00 1.00 C ATOM 1674 CG1 VAL A 104 114.596 7.945 -9.018 1.00 1.00 C ATOM 1675 CG2 VAL A 104 113.117 9.069 -7.359 1.00 1.00 C ATOM 0 H VAL A 104 110.787 7.378 -7.913 1.00 1.00 H new ATOM 0 HA VAL A 104 112.218 9.012 -9.885 1.00 1.00 H new ATOM 0 HB VAL A 104 113.102 6.958 -7.833 1.00 1.00 H new ATOM 0 HG11 VAL A 104 115.372 7.848 -8.259 1.00 1.00 H new ATOM 0 HG12 VAL A 104 114.677 7.121 -9.727 1.00 1.00 H new ATOM 0 HG13 VAL A 104 114.721 8.891 -9.545 1.00 1.00 H new ATOM 0 HG21 VAL A 104 113.906 8.979 -6.612 1.00 1.00 H new ATOM 0 HG22 VAL A 104 113.227 10.014 -7.891 1.00 1.00 H new ATOM 0 HG23 VAL A 104 112.145 9.042 -6.866 1.00 1.00 H new ATOM 1685 N THR A 105 112.517 7.331 -11.680 1.00 1.00 N ATOM 1686 CA THR A 105 112.625 6.381 -12.776 1.00 1.00 C ATOM 1687 C THR A 105 114.021 6.388 -13.385 1.00 1.00 C ATOM 1688 O THR A 105 114.639 5.340 -13.571 1.00 1.00 O ATOM 1689 CB THR A 105 111.598 6.724 -13.853 1.00 1.00 C ATOM 1690 OG1 THR A 105 111.528 8.134 -14.007 1.00 1.00 O ATOM 1691 CG2 THR A 105 110.230 6.187 -13.445 1.00 1.00 C ATOM 0 H THR A 105 112.691 8.301 -11.945 1.00 1.00 H new ATOM 0 HA THR A 105 112.433 5.384 -12.379 1.00 1.00 H new ATOM 0 HB THR A 105 111.897 6.269 -14.797 1.00 1.00 H new ATOM 0 HG1 THR A 105 110.870 8.355 -14.699 1.00 1.00 H new ATOM 0 HG21 THR A 105 109.498 6.433 -14.215 1.00 1.00 H new ATOM 0 HG22 THR A 105 110.284 5.105 -13.328 1.00 1.00 H new ATOM 0 HG23 THR A 105 109.929 6.639 -12.500 1.00 1.00 H new ATOM 1699 N GLY A 106 114.498 7.584 -13.714 1.00 1.00 N ATOM 1700 CA GLY A 106 115.810 7.731 -14.327 1.00 1.00 C ATOM 1701 C GLY A 106 116.839 8.247 -13.333 1.00 1.00 C ATOM 1702 O GLY A 106 116.519 8.984 -12.400 1.00 1.00 O ATOM 0 H GLY A 106 113.997 8.460 -13.567 1.00 1.00 H new ATOM 0 HA2 GLY A 106 116.137 6.770 -14.723 1.00 1.00 H new ATOM 0 HA3 GLY A 106 115.743 8.417 -15.171 1.00 1.00 H new ATOM 1706 N PHE A 107 118.080 7.848 -13.555 1.00 1.00 N ATOM 1707 CA PHE A 107 119.189 8.253 -12.702 1.00 1.00 C ATOM 1708 C PHE A 107 120.320 8.836 -13.564 1.00 1.00 C ATOM 1709 O PHE A 107 120.469 8.448 -14.724 1.00 1.00 O ATOM 1710 CB PHE A 107 119.681 7.034 -11.925 1.00 1.00 C ATOM 1711 CG PHE A 107 118.885 5.828 -12.367 1.00 1.00 C ATOM 1712 CD1 PHE A 107 118.993 5.365 -13.685 1.00 1.00 C ATOM 1713 CD2 PHE A 107 118.026 5.186 -11.467 1.00 1.00 C ATOM 1714 CE1 PHE A 107 118.242 4.262 -14.101 1.00 1.00 C ATOM 1715 CE2 PHE A 107 117.272 4.083 -11.887 1.00 1.00 C ATOM 1716 CZ PHE A 107 117.380 3.621 -13.204 1.00 1.00 C ATOM 0 H PHE A 107 118.348 7.237 -14.327 1.00 1.00 H new ATOM 0 HA PHE A 107 118.862 9.020 -12.000 1.00 1.00 H new ATOM 0 HB2 PHE A 107 120.744 6.873 -12.106 1.00 1.00 H new ATOM 0 HB3 PHE A 107 119.561 7.195 -10.854 1.00 1.00 H new ATOM 0 HD1 PHE A 107 119.656 5.860 -14.379 1.00 1.00 H new ATOM 0 HD2 PHE A 107 117.945 5.541 -10.450 1.00 1.00 H new ATOM 0 HE1 PHE A 107 118.327 3.904 -15.116 1.00 1.00 H new ATOM 0 HE2 PHE A 107 116.607 3.589 -11.194 1.00 1.00 H new ATOM 0 HZ PHE A 107 116.798 2.770 -13.528 1.00 1.00 H new ATOM 1726 N PRO A 108 121.114 9.749 -13.043 1.00 1.00 N ATOM 1727 CA PRO A 108 120.996 10.269 -11.643 1.00 1.00 C ATOM 1728 C PRO A 108 119.880 11.290 -11.482 1.00 1.00 C ATOM 1729 O PRO A 108 119.652 12.119 -12.362 1.00 1.00 O ATOM 1730 CB PRO A 108 122.346 10.939 -11.412 1.00 1.00 C ATOM 1731 CG PRO A 108 122.734 11.446 -12.759 1.00 1.00 C ATOM 1732 CD PRO A 108 122.233 10.399 -13.756 1.00 1.00 C ATOM 0 HA PRO A 108 120.756 9.474 -10.938 1.00 1.00 H new ATOM 0 HB2 PRO A 108 122.270 11.750 -10.687 1.00 1.00 H new ATOM 0 HB3 PRO A 108 123.081 10.233 -11.025 1.00 1.00 H new ATOM 0 HG2 PRO A 108 122.285 12.420 -12.955 1.00 1.00 H new ATOM 0 HG3 PRO A 108 123.814 11.572 -12.834 1.00 1.00 H new ATOM 0 HD2 PRO A 108 121.902 10.858 -14.688 1.00 1.00 H new ATOM 0 HD3 PRO A 108 123.014 9.684 -14.013 1.00 1.00 H new ATOM 1740 N GLU A 109 119.195 11.239 -10.343 1.00 1.00 N ATOM 1741 CA GLU A 109 118.117 12.180 -10.074 1.00 1.00 C ATOM 1742 C GLU A 109 118.218 12.677 -8.640 1.00 1.00 C ATOM 1743 O GLU A 109 118.243 11.881 -7.700 1.00 1.00 O ATOM 1744 CB GLU A 109 116.760 11.509 -10.286 1.00 1.00 C ATOM 1745 CG GLU A 109 115.647 12.542 -10.089 1.00 1.00 C ATOM 1746 CD GLU A 109 114.293 11.917 -10.406 1.00 1.00 C ATOM 1747 OE1 GLU A 109 114.280 10.842 -10.980 1.00 1.00 O ATOM 1748 OE2 GLU A 109 113.290 12.524 -10.069 1.00 1.00 O ATOM 0 H GLU A 109 119.366 10.562 -9.599 1.00 1.00 H new ATOM 0 HA GLU A 109 118.207 13.021 -10.761 1.00 1.00 H new ATOM 0 HB2 GLU A 109 116.704 11.084 -11.288 1.00 1.00 H new ATOM 0 HB3 GLU A 109 116.635 10.685 -9.583 1.00 1.00 H new ATOM 0 HG2 GLU A 109 115.657 12.908 -9.062 1.00 1.00 H new ATOM 0 HG3 GLU A 109 115.820 13.403 -10.735 1.00 1.00 H new ATOM 1755 N LEU A 110 118.274 13.993 -8.466 1.00 1.00 N ATOM 1756 CA LEU A 110 118.366 14.596 -7.148 1.00 1.00 C ATOM 1757 C LEU A 110 117.087 15.385 -6.901 1.00 1.00 C ATOM 1758 O LEU A 110 116.749 16.291 -7.664 1.00 1.00 O ATOM 1759 CB LEU A 110 119.591 15.529 -7.120 1.00 1.00 C ATOM 1760 CG LEU A 110 120.471 15.302 -5.877 1.00 1.00 C ATOM 1761 CD1 LEU A 110 121.853 15.916 -6.125 1.00 1.00 C ATOM 1762 CD2 LEU A 110 119.854 15.980 -4.657 1.00 1.00 C ATOM 0 H LEU A 110 118.257 14.666 -9.232 1.00 1.00 H new ATOM 0 HA LEU A 110 118.481 13.839 -6.372 1.00 1.00 H new ATOM 0 HB2 LEU A 110 120.187 15.369 -8.018 1.00 1.00 H new ATOM 0 HB3 LEU A 110 119.256 16.566 -7.140 1.00 1.00 H new ATOM 0 HG LEU A 110 120.551 14.230 -5.694 1.00 1.00 H new ATOM 0 HD11 LEU A 110 122.483 15.760 -5.249 1.00 1.00 H new ATOM 0 HD12 LEU A 110 122.312 15.441 -6.992 1.00 1.00 H new ATOM 0 HD13 LEU A 110 121.748 16.985 -6.311 1.00 1.00 H new ATOM 0 HD21 LEU A 110 120.488 15.810 -3.787 1.00 1.00 H new ATOM 0 HD22 LEU A 110 119.769 17.051 -4.840 1.00 1.00 H new ATOM 0 HD23 LEU A 110 118.864 15.564 -4.471 1.00 1.00 H new ATOM 1774 N VAL A 111 116.373 15.016 -5.845 1.00 1.00 N ATOM 1775 CA VAL A 111 115.118 15.670 -5.515 1.00 1.00 C ATOM 1776 C VAL A 111 115.202 16.364 -4.171 1.00 1.00 C ATOM 1777 O VAL A 111 115.692 15.789 -3.200 1.00 1.00 O ATOM 1778 CB VAL A 111 113.967 14.658 -5.520 1.00 1.00 C ATOM 1779 CG1 VAL A 111 113.593 14.328 -6.963 1.00 1.00 C ATOM 1780 CG2 VAL A 111 114.379 13.379 -4.810 1.00 1.00 C ATOM 0 H VAL A 111 116.643 14.269 -5.205 1.00 1.00 H new ATOM 0 HA VAL A 111 114.923 16.426 -6.276 1.00 1.00 H new ATOM 0 HB VAL A 111 113.114 15.094 -4.999 1.00 1.00 H new ATOM 0 HG11 VAL A 111 112.774 13.608 -6.971 1.00 1.00 H new ATOM 0 HG12 VAL A 111 113.281 15.238 -7.475 1.00 1.00 H new ATOM 0 HG13 VAL A 111 114.456 13.902 -7.474 1.00 1.00 H new ATOM 0 HG21 VAL A 111 113.549 12.672 -4.823 1.00 1.00 H new ATOM 0 HG22 VAL A 111 115.237 12.941 -5.319 1.00 1.00 H new ATOM 0 HG23 VAL A 111 114.646 13.606 -3.778 1.00 1.00 H new ATOM 1790 N PHE A 112 114.744 17.602 -4.119 1.00 1.00 N ATOM 1791 CA PHE A 112 114.797 18.363 -2.887 1.00 1.00 C ATOM 1792 C PHE A 112 113.448 18.392 -2.215 1.00 1.00 C ATOM 1793 O PHE A 112 112.447 18.751 -2.831 1.00 1.00 O ATOM 1794 CB PHE A 112 115.266 19.779 -3.187 1.00 1.00 C ATOM 1795 CG PHE A 112 116.654 19.674 -3.740 1.00 1.00 C ATOM 1796 CD1 PHE A 112 117.744 19.636 -2.874 1.00 1.00 C ATOM 1797 CD2 PHE A 112 116.841 19.578 -5.118 1.00 1.00 C ATOM 1798 CE1 PHE A 112 119.038 19.496 -3.390 1.00 1.00 C ATOM 1799 CE2 PHE A 112 118.132 19.444 -5.639 1.00 1.00 C ATOM 1800 CZ PHE A 112 119.232 19.402 -4.775 1.00 1.00 C ATOM 0 H PHE A 112 114.334 18.098 -4.911 1.00 1.00 H new ATOM 0 HA PHE A 112 115.501 17.883 -2.207 1.00 1.00 H new ATOM 0 HB2 PHE A 112 114.601 20.262 -3.903 1.00 1.00 H new ATOM 0 HB3 PHE A 112 115.256 20.388 -2.283 1.00 1.00 H new ATOM 0 HD1 PHE A 112 117.592 19.714 -1.808 1.00 1.00 H new ATOM 0 HD2 PHE A 112 115.990 19.607 -5.782 1.00 1.00 H new ATOM 0 HE1 PHE A 112 119.886 19.460 -2.722 1.00 1.00 H new ATOM 0 HE2 PHE A 112 118.280 19.373 -6.706 1.00 1.00 H new ATOM 0 HZ PHE A 112 120.230 19.297 -5.175 1.00 1.00 H new ATOM 1810 N ILE A 113 113.434 18.009 -0.944 1.00 1.00 N ATOM 1811 CA ILE A 113 112.206 18.009 -0.182 1.00 1.00 C ATOM 1812 C ILE A 113 112.404 18.669 1.161 1.00 1.00 C ATOM 1813 O ILE A 113 113.515 18.747 1.686 1.00 1.00 O ATOM 1814 CB ILE A 113 111.663 16.586 -0.001 1.00 1.00 C ATOM 1815 CG1 ILE A 113 112.681 15.719 0.743 1.00 1.00 C ATOM 1816 CG2 ILE A 113 111.390 15.965 -1.373 1.00 1.00 C ATOM 1817 CD1 ILE A 113 112.015 14.412 1.174 1.00 1.00 C ATOM 0 H ILE A 113 114.257 17.698 -0.428 1.00 1.00 H new ATOM 0 HA ILE A 113 111.471 18.584 -0.745 1.00 1.00 H new ATOM 0 HB ILE A 113 110.741 16.635 0.578 1.00 1.00 H new ATOM 0 HG12 ILE A 113 113.536 15.510 0.100 1.00 1.00 H new ATOM 0 HG13 ILE A 113 113.061 16.252 1.615 1.00 1.00 H new ATOM 0 HG21 ILE A 113 111.004 14.954 -1.244 1.00 1.00 H new ATOM 0 HG22 ILE A 113 110.655 16.569 -1.906 1.00 1.00 H new ATOM 0 HG23 ILE A 113 112.316 15.930 -1.947 1.00 1.00 H new ATOM 0 HD11 ILE A 113 112.738 13.793 1.704 1.00 1.00 H new ATOM 0 HD12 ILE A 113 111.174 14.632 1.832 1.00 1.00 H new ATOM 0 HD13 ILE A 113 111.657 13.878 0.294 1.00 1.00 H new ATOM 1829 N ASP A 114 111.291 19.086 1.731 1.00 1.00 N ATOM 1830 CA ASP A 114 111.300 19.676 3.044 1.00 1.00 C ATOM 1831 C ASP A 114 111.072 18.558 4.042 1.00 1.00 C ATOM 1832 O ASP A 114 110.969 17.392 3.667 1.00 1.00 O ATOM 1833 CB ASP A 114 110.210 20.746 3.162 1.00 1.00 C ATOM 1834 CG ASP A 114 110.668 22.051 2.513 1.00 1.00 C ATOM 1835 OD1 ASP A 114 111.867 22.248 2.395 1.00 1.00 O ATOM 1836 OD2 ASP A 114 109.814 22.845 2.160 1.00 1.00 O ATOM 0 H ASP A 114 110.369 19.024 1.299 1.00 1.00 H new ATOM 0 HA ASP A 114 112.253 20.169 3.238 1.00 1.00 H new ATOM 0 HB2 ASP A 114 109.296 20.396 2.683 1.00 1.00 H new ATOM 0 HB3 ASP A 114 109.974 20.919 4.212 1.00 1.00 H new ATOM 1841 N ALA A 115 111.019 18.902 5.304 1.00 1.00 N ATOM 1842 CA ALA A 115 110.835 17.919 6.360 1.00 1.00 C ATOM 1843 C ALA A 115 109.433 17.309 6.326 1.00 1.00 C ATOM 1844 O ALA A 115 109.177 16.297 6.981 1.00 1.00 O ATOM 1845 CB ALA A 115 111.050 18.595 7.709 1.00 1.00 C ATOM 0 H ALA A 115 111.101 19.863 5.635 1.00 1.00 H new ATOM 0 HA ALA A 115 111.557 17.117 6.208 1.00 1.00 H new ATOM 0 HB1 ALA A 115 110.914 17.865 8.507 1.00 1.00 H new ATOM 0 HB2 ALA A 115 112.061 19.000 7.756 1.00 1.00 H new ATOM 0 HB3 ALA A 115 110.329 19.404 7.830 1.00 1.00 H new ATOM 1851 N GLU A 116 108.530 17.906 5.548 1.00 1.00 N ATOM 1852 CA GLU A 116 107.167 17.395 5.422 1.00 1.00 C ATOM 1853 C GLU A 116 107.061 16.540 4.164 1.00 1.00 C ATOM 1854 O GLU A 116 106.013 15.957 3.886 1.00 1.00 O ATOM 1855 CB GLU A 116 106.171 18.554 5.324 1.00 1.00 C ATOM 1856 CG GLU A 116 106.116 19.316 6.650 1.00 1.00 C ATOM 1857 CD GLU A 116 105.149 20.490 6.530 1.00 1.00 C ATOM 1858 OE1 GLU A 116 104.583 20.657 5.460 1.00 1.00 O ATOM 1859 OE2 GLU A 116 104.984 21.201 7.508 1.00 1.00 O ATOM 0 H GLU A 116 108.718 18.743 4.996 1.00 1.00 H new ATOM 0 HA GLU A 116 106.933 16.796 6.302 1.00 1.00 H new ATOM 0 HB2 GLU A 116 106.465 19.229 4.520 1.00 1.00 H new ATOM 0 HB3 GLU A 116 105.181 18.172 5.074 1.00 1.00 H new ATOM 0 HG2 GLU A 116 105.796 18.649 7.450 1.00 1.00 H new ATOM 0 HG3 GLU A 116 107.110 19.677 6.914 1.00 1.00 H new ATOM 1866 N GLY A 117 108.153 16.453 3.418 1.00 1.00 N ATOM 1867 CA GLY A 117 108.168 15.649 2.206 1.00 1.00 C ATOM 1868 C GLY A 117 107.652 16.426 1.001 1.00 1.00 C ATOM 1869 O GLY A 117 107.307 15.825 -0.019 1.00 1.00 O ATOM 0 H GLY A 117 109.032 16.925 3.628 1.00 1.00 H new ATOM 0 HA2 GLY A 117 109.184 15.308 2.010 1.00 1.00 H new ATOM 0 HA3 GLY A 117 107.556 14.759 2.353 1.00 1.00 H new ATOM 1873 N LYS A 118 107.593 17.752 1.101 1.00 1.00 N ATOM 1874 CA LYS A 118 107.112 18.560 -0.016 1.00 1.00 C ATOM 1875 C LYS A 118 108.242 18.784 -0.991 1.00 1.00 C ATOM 1876 O LYS A 118 109.363 19.015 -0.581 1.00 1.00 O ATOM 1877 CB LYS A 118 106.595 19.909 0.482 1.00 1.00 C ATOM 1878 CG LYS A 118 105.146 19.756 0.928 1.00 1.00 C ATOM 1879 CD LYS A 118 104.656 21.065 1.547 1.00 1.00 C ATOM 1880 CE LYS A 118 103.223 20.878 2.043 1.00 1.00 C ATOM 1881 NZ LYS A 118 102.771 22.112 2.745 1.00 1.00 N ATOM 0 H LYS A 118 107.867 18.282 1.928 1.00 1.00 H new ATOM 0 HA LYS A 118 106.295 18.032 -0.507 1.00 1.00 H new ATOM 0 HB2 LYS A 118 107.208 20.263 1.311 1.00 1.00 H new ATOM 0 HB3 LYS A 118 106.668 20.655 -0.310 1.00 1.00 H new ATOM 0 HG2 LYS A 118 104.520 19.488 0.077 1.00 1.00 H new ATOM 0 HG3 LYS A 118 105.062 18.946 1.653 1.00 1.00 H new ATOM 0 HD2 LYS A 118 105.305 21.356 2.373 1.00 1.00 H new ATOM 0 HD3 LYS A 118 104.697 21.868 0.811 1.00 1.00 H new ATOM 0 HE2 LYS A 118 102.562 20.663 1.203 1.00 1.00 H new ATOM 0 HE3 LYS A 118 103.170 20.024 2.718 1.00 1.00 H new ATOM 0 HZ1 LYS A 118 101.796 21.982 3.082 1.00 1.00 H new ATOM 0 HZ2 LYS A 118 103.395 22.299 3.556 1.00 1.00 H new ATOM 0 HZ3 LYS A 118 102.806 22.918 2.088 1.00 1.00 H new ATOM 1895 N GLN A 119 107.947 18.709 -2.284 1.00 1.00 N ATOM 1896 CA GLN A 119 108.952 18.889 -3.309 1.00 1.00 C ATOM 1897 C GLN A 119 109.179 20.361 -3.605 1.00 1.00 C ATOM 1898 O GLN A 119 108.253 21.085 -3.974 1.00 1.00 O ATOM 1899 CB GLN A 119 108.504 18.147 -4.568 1.00 1.00 C ATOM 1900 CG GLN A 119 109.199 18.737 -5.784 1.00 1.00 C ATOM 1901 CD GLN A 119 109.171 17.741 -6.943 1.00 1.00 C ATOM 1902 OE1 GLN A 119 109.012 16.539 -6.728 1.00 1.00 O ATOM 1903 NE2 GLN A 119 109.319 18.170 -8.166 1.00 1.00 N ATOM 0 H GLN A 119 107.010 18.523 -2.643 1.00 1.00 H new ATOM 0 HA GLN A 119 109.900 18.482 -2.958 1.00 1.00 H new ATOM 0 HB2 GLN A 119 108.741 17.087 -4.481 1.00 1.00 H new ATOM 0 HB3 GLN A 119 107.423 18.224 -4.682 1.00 1.00 H new ATOM 0 HG2 GLN A 119 108.707 19.664 -6.079 1.00 1.00 H new ATOM 0 HG3 GLN A 119 110.230 18.989 -5.536 1.00 1.00 H new ATOM 0 HE21 GLN A 119 109.451 19.166 -8.345 1.00 1.00 H new ATOM 0 HE22 GLN A 119 109.303 17.510 -8.943 1.00 1.00 H new ATOM 1912 N LEU A 120 110.425 20.796 -3.438 1.00 1.00 N ATOM 1913 CA LEU A 120 110.766 22.188 -3.689 1.00 1.00 C ATOM 1914 C LEU A 120 111.419 22.322 -5.055 1.00 1.00 C ATOM 1915 O LEU A 120 111.269 23.347 -5.722 1.00 1.00 O ATOM 1916 CB LEU A 120 111.719 22.750 -2.613 1.00 1.00 C ATOM 1917 CG LEU A 120 111.921 21.745 -1.472 1.00 1.00 C ATOM 1918 CD1 LEU A 120 113.007 22.235 -0.526 1.00 1.00 C ATOM 1919 CD2 LEU A 120 110.645 21.588 -0.655 1.00 1.00 C ATOM 0 H LEU A 120 111.204 20.212 -3.134 1.00 1.00 H new ATOM 0 HA LEU A 120 109.840 22.763 -3.656 1.00 1.00 H new ATOM 0 HB2 LEU A 120 112.682 22.989 -3.065 1.00 1.00 H new ATOM 0 HB3 LEU A 120 111.314 23.680 -2.215 1.00 1.00 H new ATOM 0 HG LEU A 120 112.199 20.793 -1.923 1.00 1.00 H new ATOM 0 HD11 LEU A 120 113.141 21.513 0.279 1.00 1.00 H new ATOM 0 HD12 LEU A 120 113.943 22.346 -1.073 1.00 1.00 H new ATOM 0 HD13 LEU A 120 112.716 23.198 -0.106 1.00 1.00 H new ATOM 0 HD21 LEU A 120 110.813 20.870 0.148 1.00 1.00 H new ATOM 0 HD22 LEU A 120 110.365 22.551 -0.228 1.00 1.00 H new ATOM 0 HD23 LEU A 120 109.842 21.230 -1.299 1.00 1.00 H new ATOM 1931 N ALA A 121 112.127 21.275 -5.485 1.00 1.00 N ATOM 1932 CA ALA A 121 112.782 21.282 -6.789 1.00 1.00 C ATOM 1933 C ALA A 121 113.461 19.944 -7.066 1.00 1.00 C ATOM 1934 O ALA A 121 113.659 19.137 -6.157 1.00 1.00 O ATOM 1935 CB ALA A 121 113.836 22.380 -6.865 1.00 1.00 C ATOM 0 H ALA A 121 112.259 20.417 -4.950 1.00 1.00 H new ATOM 0 HA ALA A 121 112.008 21.463 -7.534 1.00 1.00 H new ATOM 0 HB1 ALA A 121 114.309 22.363 -7.847 1.00 1.00 H new ATOM 0 HB2 ALA A 121 113.364 23.349 -6.706 1.00 1.00 H new ATOM 0 HB3 ALA A 121 114.591 22.214 -6.096 1.00 1.00 H new ATOM 1941 N ARG A 122 113.829 19.723 -8.318 1.00 1.00 N ATOM 1942 CA ARG A 122 114.502 18.487 -8.695 1.00 1.00 C ATOM 1943 C ARG A 122 115.454 18.740 -9.855 1.00 1.00 C ATOM 1944 O ARG A 122 115.150 19.510 -10.765 1.00 1.00 O ATOM 1945 CB ARG A 122 113.472 17.421 -9.082 1.00 1.00 C ATOM 1946 CG ARG A 122 112.614 17.916 -10.252 1.00 1.00 C ATOM 1947 CD ARG A 122 111.671 16.800 -10.697 1.00 1.00 C ATOM 1948 NE ARG A 122 110.891 17.238 -11.848 1.00 1.00 N ATOM 1949 CZ ARG A 122 110.067 16.405 -12.473 1.00 1.00 C ATOM 1950 NH1 ARG A 122 109.929 15.182 -12.043 1.00 1.00 N ATOM 1951 NH2 ARG A 122 109.394 16.812 -13.516 1.00 1.00 N ATOM 0 H ARG A 122 113.675 20.376 -9.086 1.00 1.00 H new ATOM 0 HA ARG A 122 115.076 18.127 -7.841 1.00 1.00 H new ATOM 0 HB2 ARG A 122 113.980 16.497 -9.359 1.00 1.00 H new ATOM 0 HB3 ARG A 122 112.836 17.191 -8.227 1.00 1.00 H new ATOM 0 HG2 ARG A 122 112.041 18.793 -9.952 1.00 1.00 H new ATOM 0 HG3 ARG A 122 113.252 18.221 -11.082 1.00 1.00 H new ATOM 0 HD2 ARG A 122 112.244 15.909 -10.953 1.00 1.00 H new ATOM 0 HD3 ARG A 122 111.005 16.527 -9.878 1.00 1.00 H new ATOM 0 HE ARG A 122 110.979 18.199 -12.178 1.00 1.00 H new ATOM 0 HH11 ARG A 122 110.454 14.866 -11.227 1.00 1.00 H new ATOM 0 HH12 ARG A 122 109.296 14.541 -12.522 1.00 1.00 H new ATOM 0 HH21 ARG A 122 109.501 17.770 -13.850 1.00 1.00 H new ATOM 0 HH22 ARG A 122 108.761 16.172 -13.996 1.00 1.00 H new ATOM 1965 N MET A 123 116.601 18.065 -9.827 1.00 1.00 N ATOM 1966 CA MET A 123 117.574 18.206 -10.894 1.00 1.00 C ATOM 1967 C MET A 123 118.315 16.894 -11.125 1.00 1.00 C ATOM 1968 O MET A 123 118.360 16.026 -10.254 1.00 1.00 O ATOM 1969 CB MET A 123 118.592 19.302 -10.573 1.00 1.00 C ATOM 1970 CG MET A 123 117.871 20.614 -10.259 1.00 1.00 C ATOM 1971 SD MET A 123 119.042 21.978 -10.388 1.00 1.00 S ATOM 1972 CE MET A 123 120.191 21.368 -9.143 1.00 1.00 C ATOM 0 H MET A 123 116.873 17.423 -9.083 1.00 1.00 H new ATOM 0 HA MET A 123 117.027 18.480 -11.796 1.00 1.00 H new ATOM 0 HB2 MET A 123 119.205 19.002 -9.723 1.00 1.00 H new ATOM 0 HB3 MET A 123 119.266 19.442 -11.418 1.00 1.00 H new ATOM 0 HG2 MET A 123 117.043 20.763 -10.952 1.00 1.00 H new ATOM 0 HG3 MET A 123 117.445 20.578 -9.256 1.00 1.00 H new ATOM 0 HE1 MET A 123 120.846 22.179 -8.824 1.00 1.00 H new ATOM 0 HE2 MET A 123 119.633 20.994 -8.285 1.00 1.00 H new ATOM 0 HE3 MET A 123 120.791 20.562 -9.565 1.00 1.00 H new ATOM 1982 N GLY A 124 118.894 16.771 -12.304 1.00 1.00 N ATOM 1983 CA GLY A 124 119.642 15.574 -12.662 1.00 1.00 C ATOM 1984 C GLY A 124 121.072 15.937 -13.005 1.00 1.00 C ATOM 1985 O GLY A 124 121.658 16.831 -12.394 1.00 1.00 O ATOM 0 H GLY A 124 118.863 17.484 -13.033 1.00 1.00 H new ATOM 0 HA2 GLY A 124 119.627 14.865 -11.834 1.00 1.00 H new ATOM 0 HA3 GLY A 124 119.170 15.081 -13.512 1.00 1.00 H new ATOM 1989 N PHE A 125 121.621 15.269 -14.004 1.00 1.00 N ATOM 1990 CA PHE A 125 122.973 15.560 -14.438 1.00 1.00 C ATOM 1991 C PHE A 125 122.949 16.770 -15.361 1.00 1.00 C ATOM 1992 O PHE A 125 122.107 16.856 -16.254 1.00 1.00 O ATOM 1993 CB PHE A 125 123.563 14.352 -15.162 1.00 1.00 C ATOM 1994 CG PHE A 125 124.847 14.755 -15.840 1.00 1.00 C ATOM 1995 CD1 PHE A 125 125.949 15.147 -15.071 1.00 1.00 C ATOM 1996 CD2 PHE A 125 124.934 14.737 -17.236 1.00 1.00 C ATOM 1997 CE1 PHE A 125 127.140 15.522 -15.701 1.00 1.00 C ATOM 1998 CE2 PHE A 125 126.124 15.114 -17.865 1.00 1.00 C ATOM 1999 CZ PHE A 125 127.228 15.505 -17.098 1.00 1.00 C ATOM 0 H PHE A 125 121.155 14.527 -14.526 1.00 1.00 H new ATOM 0 HA PHE A 125 123.597 15.778 -13.571 1.00 1.00 H new ATOM 0 HB2 PHE A 125 123.750 13.545 -14.454 1.00 1.00 H new ATOM 0 HB3 PHE A 125 122.854 13.972 -15.897 1.00 1.00 H new ATOM 0 HD1 PHE A 125 125.880 15.160 -13.993 1.00 1.00 H new ATOM 0 HD2 PHE A 125 124.083 14.432 -17.827 1.00 1.00 H new ATOM 0 HE1 PHE A 125 127.992 15.825 -15.110 1.00 1.00 H new ATOM 0 HE2 PHE A 125 126.192 15.104 -18.943 1.00 1.00 H new ATOM 0 HZ PHE A 125 128.148 15.794 -17.584 1.00 1.00 H new ATOM 2009 N GLU A 126 123.857 17.711 -15.135 1.00 1.00 N ATOM 2010 CA GLU A 126 123.902 18.915 -15.953 1.00 1.00 C ATOM 2011 C GLU A 126 125.350 19.357 -16.198 1.00 1.00 C ATOM 2012 O GLU A 126 126.047 19.707 -15.247 1.00 1.00 O ATOM 2013 CB GLU A 126 123.169 20.049 -15.231 1.00 1.00 C ATOM 2014 CG GLU A 126 121.909 20.435 -16.009 1.00 1.00 C ATOM 2015 CD GLU A 126 120.924 19.272 -16.019 1.00 1.00 C ATOM 2016 OE1 GLU A 126 120.361 18.990 -14.973 1.00 1.00 O ATOM 2017 OE2 GLU A 126 120.747 18.680 -17.069 1.00 1.00 O ATOM 0 H GLU A 126 124.564 17.665 -14.401 1.00 1.00 H new ATOM 0 HA GLU A 126 123.427 18.694 -16.909 1.00 1.00 H new ATOM 0 HB2 GLU A 126 122.902 19.736 -14.222 1.00 1.00 H new ATOM 0 HB3 GLU A 126 123.826 20.914 -15.133 1.00 1.00 H new ATOM 0 HG2 GLU A 126 121.445 21.311 -15.555 1.00 1.00 H new ATOM 0 HG3 GLU A 126 122.172 20.708 -17.031 1.00 1.00 H new ATOM 2024 N PRO A 127 125.823 19.381 -17.427 1.00 1.00 N ATOM 2025 CA PRO A 127 127.214 19.832 -17.707 1.00 1.00 C ATOM 2026 C PRO A 127 127.478 21.220 -17.138 1.00 1.00 C ATOM 2027 O PRO A 127 126.560 22.029 -16.992 1.00 1.00 O ATOM 2028 CB PRO A 127 127.316 19.867 -19.232 1.00 1.00 C ATOM 2029 CG PRO A 127 126.183 19.050 -19.754 1.00 1.00 C ATOM 2030 CD PRO A 127 125.118 18.980 -18.659 1.00 1.00 C ATOM 0 HA PRO A 127 127.945 19.167 -17.248 1.00 1.00 H new ATOM 0 HB2 PRO A 127 127.257 20.891 -19.601 1.00 1.00 H new ATOM 0 HB3 PRO A 127 128.271 19.462 -19.566 1.00 1.00 H new ATOM 0 HG2 PRO A 127 125.773 19.499 -20.659 1.00 1.00 H new ATOM 0 HG3 PRO A 127 126.524 18.050 -20.021 1.00 1.00 H new ATOM 0 HD2 PRO A 127 124.284 19.648 -18.874 1.00 1.00 H new ATOM 0 HD3 PRO A 127 124.706 17.975 -18.571 1.00 1.00 H new ATOM 2038 N GLY A 128 128.741 21.483 -16.823 1.00 1.00 N ATOM 2039 CA GLY A 128 129.117 22.780 -16.270 1.00 1.00 C ATOM 2040 C GLY A 128 129.959 22.630 -15.021 1.00 1.00 C ATOM 2041 O GLY A 128 130.681 23.562 -14.664 1.00 1.00 O ATOM 0 H GLY A 128 129.513 20.826 -16.939 1.00 1.00 H new ATOM 0 HA2 GLY A 128 129.671 23.348 -17.017 1.00 1.00 H new ATOM 0 HA3 GLY A 128 128.218 23.351 -16.037 1.00 1.00 H new ATOM 2045 N GLY A 129 129.918 21.481 -14.357 1.00 1.00 N ATOM 2046 CA GLY A 129 130.737 21.291 -13.173 1.00 1.00 C ATOM 2047 C GLY A 129 129.989 21.592 -11.873 1.00 1.00 C ATOM 2048 O GLY A 129 128.799 21.905 -11.874 1.00 1.00 O ATOM 0 H GLY A 129 129.337 20.683 -14.614 1.00 1.00 H new ATOM 0 HA2 GLY A 129 131.097 20.262 -13.149 1.00 1.00 H new ATOM 0 HA3 GLY A 129 131.614 21.934 -13.238 1.00 1.00 H new ATOM 2052 N GLY A 130 130.700 21.412 -10.764 1.00 1.00 N ATOM 2053 CA GLY A 130 130.101 21.574 -9.442 1.00 1.00 C ATOM 2054 C GLY A 130 129.654 22.992 -9.125 1.00 1.00 C ATOM 2055 O GLY A 130 128.572 23.183 -8.580 1.00 1.00 O ATOM 0 H GLY A 130 131.687 21.155 -10.753 1.00 1.00 H new ATOM 0 HA2 GLY A 130 129.241 20.909 -9.362 1.00 1.00 H new ATOM 0 HA3 GLY A 130 130.822 21.256 -8.688 1.00 1.00 H new ATOM 2059 N ALA A 131 130.474 23.978 -9.461 1.00 1.00 N ATOM 2060 CA ALA A 131 130.135 25.366 -9.182 1.00 1.00 C ATOM 2061 C ALA A 131 128.837 25.736 -9.867 1.00 1.00 C ATOM 2062 O ALA A 131 127.953 26.339 -9.265 1.00 1.00 O ATOM 2063 CB ALA A 131 131.246 26.280 -9.703 1.00 1.00 C ATOM 0 H ALA A 131 131.373 23.844 -9.924 1.00 1.00 H new ATOM 0 HA ALA A 131 130.024 25.488 -8.105 1.00 1.00 H new ATOM 0 HB1 ALA A 131 130.991 27.319 -9.493 1.00 1.00 H new ATOM 0 HB2 ALA A 131 132.185 26.030 -9.208 1.00 1.00 H new ATOM 0 HB3 ALA A 131 131.355 26.143 -10.779 1.00 1.00 H new ATOM 2069 N ALA A 132 128.733 25.403 -11.131 1.00 1.00 N ATOM 2070 CA ALA A 132 127.544 25.734 -11.880 1.00 1.00 C ATOM 2071 C ALA A 132 126.314 25.027 -11.313 1.00 1.00 C ATOM 2072 O ALA A 132 125.217 25.585 -11.299 1.00 1.00 O ATOM 2073 CB ALA A 132 127.745 25.345 -13.340 1.00 1.00 C ATOM 0 H ALA A 132 129.451 24.907 -11.660 1.00 1.00 H new ATOM 0 HA ALA A 132 127.374 26.808 -11.803 1.00 1.00 H new ATOM 0 HB1 ALA A 132 126.849 25.593 -13.909 1.00 1.00 H new ATOM 0 HB2 ALA A 132 128.597 25.890 -13.748 1.00 1.00 H new ATOM 0 HB3 ALA A 132 127.933 24.274 -13.408 1.00 1.00 H new ATOM 2079 N TYR A 133 126.500 23.795 -10.859 1.00 1.00 N ATOM 2080 CA TYR A 133 125.408 23.007 -10.303 1.00 1.00 C ATOM 2081 C TYR A 133 124.832 23.656 -9.049 1.00 1.00 C ATOM 2082 O TYR A 133 123.615 23.686 -8.862 1.00 1.00 O ATOM 2083 CB TYR A 133 125.920 21.616 -9.948 1.00 1.00 C ATOM 2084 CG TYR A 133 124.762 20.719 -9.584 1.00 1.00 C ATOM 2085 CD1 TYR A 133 124.304 20.656 -8.262 1.00 1.00 C ATOM 2086 CD2 TYR A 133 124.158 19.934 -10.572 1.00 1.00 C ATOM 2087 CE1 TYR A 133 123.246 19.799 -7.930 1.00 1.00 C ATOM 2088 CE2 TYR A 133 123.101 19.083 -10.239 1.00 1.00 C ATOM 2089 CZ TYR A 133 122.644 19.016 -8.919 1.00 1.00 C ATOM 2090 OH TYR A 133 121.597 18.177 -8.594 1.00 1.00 O ATOM 0 H TYR A 133 127.401 23.318 -10.865 1.00 1.00 H new ATOM 0 HA TYR A 133 124.620 22.947 -11.053 1.00 1.00 H new ATOM 0 HB2 TYR A 133 126.467 21.194 -10.791 1.00 1.00 H new ATOM 0 HB3 TYR A 133 126.619 21.678 -9.114 1.00 1.00 H new ATOM 0 HD1 TYR A 133 124.765 21.267 -7.500 1.00 1.00 H new ATOM 0 HD2 TYR A 133 124.509 19.986 -11.592 1.00 1.00 H new ATOM 0 HE1 TYR A 133 122.896 19.744 -6.910 1.00 1.00 H new ATOM 0 HE2 TYR A 133 122.636 18.476 -11.002 1.00 1.00 H new ATOM 0 HH TYR A 133 121.140 17.891 -9.413 1.00 1.00 H new ATOM 2100 N VAL A 134 125.703 24.153 -8.174 1.00 1.00 N ATOM 2101 CA VAL A 134 125.232 24.760 -6.943 1.00 1.00 C ATOM 2102 C VAL A 134 124.398 25.995 -7.247 1.00 1.00 C ATOM 2103 O VAL A 134 123.402 26.259 -6.589 1.00 1.00 O ATOM 2104 CB VAL A 134 126.389 25.107 -6.002 1.00 1.00 C ATOM 2105 CG1 VAL A 134 127.557 24.152 -6.207 1.00 1.00 C ATOM 2106 CG2 VAL A 134 126.852 26.549 -6.220 1.00 1.00 C ATOM 0 H VAL A 134 126.716 24.146 -8.294 1.00 1.00 H new ATOM 0 HA VAL A 134 124.605 24.029 -6.432 1.00 1.00 H new ATOM 0 HB VAL A 134 126.028 25.005 -4.978 1.00 1.00 H new ATOM 0 HG11 VAL A 134 128.367 24.417 -5.528 1.00 1.00 H new ATOM 0 HG12 VAL A 134 127.233 23.131 -6.003 1.00 1.00 H new ATOM 0 HG13 VAL A 134 127.908 24.223 -7.236 1.00 1.00 H new ATOM 0 HG21 VAL A 134 127.675 26.774 -5.541 1.00 1.00 H new ATOM 0 HG22 VAL A 134 127.188 26.672 -7.250 1.00 1.00 H new ATOM 0 HG23 VAL A 134 126.024 27.230 -6.025 1.00 1.00 H new ATOM 2116 N SER A 135 124.788 26.768 -8.241 1.00 1.00 N ATOM 2117 CA SER A 135 124.007 27.945 -8.564 1.00 1.00 C ATOM 2118 C SER A 135 122.575 27.526 -8.912 1.00 1.00 C ATOM 2119 O SER A 135 121.606 28.172 -8.513 1.00 1.00 O ATOM 2120 CB SER A 135 124.631 28.684 -9.747 1.00 1.00 C ATOM 2121 OG SER A 135 125.986 28.996 -9.447 1.00 1.00 O ATOM 0 H SER A 135 125.612 26.611 -8.822 1.00 1.00 H new ATOM 0 HA SER A 135 123.993 28.612 -7.702 1.00 1.00 H new ATOM 0 HB2 SER A 135 124.578 28.067 -10.644 1.00 1.00 H new ATOM 0 HB3 SER A 135 124.073 29.597 -9.955 1.00 1.00 H new ATOM 0 HG SER A 135 126.389 29.469 -10.205 1.00 1.00 H new ATOM 2127 N LYS A 136 122.466 26.442 -9.684 1.00 1.00 N ATOM 2128 CA LYS A 136 121.164 25.932 -10.119 1.00 1.00 C ATOM 2129 C LYS A 136 120.313 25.439 -8.954 1.00 1.00 C ATOM 2130 O LYS A 136 119.122 25.741 -8.881 1.00 1.00 O ATOM 2131 CB LYS A 136 121.348 24.778 -11.110 1.00 1.00 C ATOM 2132 CG LYS A 136 121.914 25.315 -12.424 1.00 1.00 C ATOM 2133 CD LYS A 136 122.093 24.158 -13.412 1.00 1.00 C ATOM 2134 CE LYS A 136 122.763 24.679 -14.681 1.00 1.00 C ATOM 2135 NZ LYS A 136 121.950 25.788 -15.255 1.00 1.00 N ATOM 0 H LYS A 136 123.263 25.901 -10.020 1.00 1.00 H new ATOM 0 HA LYS A 136 120.647 26.766 -10.594 1.00 1.00 H new ATOM 0 HB2 LYS A 136 122.021 24.030 -10.691 1.00 1.00 H new ATOM 0 HB3 LYS A 136 120.393 24.283 -11.289 1.00 1.00 H new ATOM 0 HG2 LYS A 136 121.242 26.064 -12.843 1.00 1.00 H new ATOM 0 HG3 LYS A 136 122.870 25.807 -12.247 1.00 1.00 H new ATOM 0 HD2 LYS A 136 122.700 23.372 -12.963 1.00 1.00 H new ATOM 0 HD3 LYS A 136 121.126 23.717 -13.652 1.00 1.00 H new ATOM 0 HE2 LYS A 136 123.769 25.031 -14.455 1.00 1.00 H new ATOM 0 HE3 LYS A 136 122.863 23.874 -15.409 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 122.231 25.949 -16.243 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 120.942 25.535 -15.218 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 122.109 26.656 -14.705 1.00 1.00 H new ATOM 2149 N VAL A 137 120.917 24.680 -8.044 1.00 1.00 N ATOM 2150 CA VAL A 137 120.175 24.165 -6.907 1.00 1.00 C ATOM 2151 C VAL A 137 119.726 25.323 -6.030 1.00 1.00 C ATOM 2152 O VAL A 137 118.604 25.357 -5.535 1.00 1.00 O ATOM 2153 CB VAL A 137 121.024 23.159 -6.111 1.00 1.00 C ATOM 2154 CG1 VAL A 137 121.894 23.871 -5.102 1.00 1.00 C ATOM 2155 CG2 VAL A 137 120.100 22.186 -5.386 1.00 1.00 C ATOM 0 H VAL A 137 121.901 24.414 -8.073 1.00 1.00 H new ATOM 0 HA VAL A 137 119.293 23.634 -7.265 1.00 1.00 H new ATOM 0 HB VAL A 137 121.669 22.619 -6.804 1.00 1.00 H new ATOM 0 HG11 VAL A 137 122.485 23.140 -4.551 1.00 1.00 H new ATOM 0 HG12 VAL A 137 122.561 24.561 -5.619 1.00 1.00 H new ATOM 0 HG13 VAL A 137 121.265 24.427 -4.407 1.00 1.00 H new ATOM 0 HG21 VAL A 137 120.697 21.471 -4.820 1.00 1.00 H new ATOM 0 HG22 VAL A 137 119.453 22.738 -4.704 1.00 1.00 H new ATOM 0 HG23 VAL A 137 119.489 21.653 -6.115 1.00 1.00 H new ATOM 2165 N LYS A 138 120.633 26.269 -5.842 1.00 1.00 N ATOM 2166 CA LYS A 138 120.350 27.430 -5.017 1.00 1.00 C ATOM 2167 C LYS A 138 119.103 28.147 -5.521 1.00 1.00 C ATOM 2168 O LYS A 138 118.232 28.516 -4.735 1.00 1.00 O ATOM 2169 CB LYS A 138 121.547 28.387 -5.059 1.00 1.00 C ATOM 2170 CG LYS A 138 121.450 29.398 -3.912 1.00 1.00 C ATOM 2171 CD LYS A 138 122.739 30.223 -3.828 1.00 1.00 C ATOM 2172 CE LYS A 138 122.955 30.982 -5.137 1.00 1.00 C ATOM 2173 NZ LYS A 138 123.936 32.080 -4.917 1.00 1.00 N ATOM 0 H LYS A 138 121.568 26.255 -6.249 1.00 1.00 H new ATOM 0 HA LYS A 138 120.176 27.103 -3.992 1.00 1.00 H new ATOM 0 HB2 LYS A 138 122.477 27.823 -4.980 1.00 1.00 H new ATOM 0 HB3 LYS A 138 121.571 28.910 -6.015 1.00 1.00 H new ATOM 0 HG2 LYS A 138 120.596 30.057 -4.069 1.00 1.00 H new ATOM 0 HG3 LYS A 138 121.281 28.876 -2.970 1.00 1.00 H new ATOM 0 HD2 LYS A 138 122.679 30.925 -2.996 1.00 1.00 H new ATOM 0 HD3 LYS A 138 123.588 29.568 -3.632 1.00 1.00 H new ATOM 0 HE2 LYS A 138 123.320 30.303 -5.908 1.00 1.00 H new ATOM 0 HE3 LYS A 138 122.009 31.391 -5.493 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 124.084 32.597 -5.807 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 123.571 32.732 -4.194 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 124.840 31.679 -4.596 1.00 1.00 H new ATOM 2187 N SER A 139 119.027 28.354 -6.827 1.00 1.00 N ATOM 2188 CA SER A 139 117.885 29.040 -7.407 1.00 1.00 C ATOM 2189 C SER A 139 116.620 28.195 -7.280 1.00 1.00 C ATOM 2190 O SER A 139 115.529 28.719 -7.063 1.00 1.00 O ATOM 2191 CB SER A 139 118.151 29.343 -8.881 1.00 1.00 C ATOM 2192 OG SER A 139 119.401 30.005 -9.009 1.00 1.00 O ATOM 0 H SER A 139 119.736 28.060 -7.499 1.00 1.00 H new ATOM 0 HA SER A 139 117.737 29.973 -6.863 1.00 1.00 H new ATOM 0 HB2 SER A 139 118.156 28.419 -9.458 1.00 1.00 H new ATOM 0 HB3 SER A 139 117.354 29.967 -9.285 1.00 1.00 H new ATOM 0 HG SER A 139 120.127 29.356 -8.899 1.00 1.00 H new ATOM 2198 N ALA A 140 116.772 26.887 -7.444 1.00 1.00 N ATOM 2199 CA ALA A 140 115.637 25.972 -7.386 1.00 1.00 C ATOM 2200 C ALA A 140 115.027 25.890 -5.986 1.00 1.00 C ATOM 2201 O ALA A 140 113.808 25.802 -5.845 1.00 1.00 O ATOM 2202 CB ALA A 140 116.099 24.589 -7.839 1.00 1.00 C ATOM 0 H ALA A 140 117.670 26.435 -7.618 1.00 1.00 H new ATOM 0 HA ALA A 140 114.858 26.352 -8.047 1.00 1.00 H new ATOM 0 HB1 ALA A 140 115.260 23.894 -7.801 1.00 1.00 H new ATOM 0 HB2 ALA A 140 116.475 24.648 -8.860 1.00 1.00 H new ATOM 0 HB3 ALA A 140 116.892 24.236 -7.180 1.00 1.00 H new ATOM 2208 N LEU A 141 115.863 25.880 -4.970 1.00 1.00 N ATOM 2209 CA LEU A 141 115.364 25.757 -3.602 1.00 1.00 C ATOM 2210 C LEU A 141 115.045 27.111 -2.977 1.00 1.00 C ATOM 2211 O LEU A 141 114.609 27.167 -1.829 1.00 1.00 O ATOM 2212 CB LEU A 141 116.399 25.042 -2.742 1.00 1.00 C ATOM 2213 CG LEU A 141 116.268 23.534 -2.915 1.00 1.00 C ATOM 2214 CD1 LEU A 141 116.319 23.189 -4.397 1.00 1.00 C ATOM 2215 CD2 LEU A 141 117.416 22.834 -2.183 1.00 1.00 C ATOM 0 H LEU A 141 116.877 25.954 -5.054 1.00 1.00 H new ATOM 0 HA LEU A 141 114.438 25.183 -3.645 1.00 1.00 H new ATOM 0 HB2 LEU A 141 117.402 25.363 -3.023 1.00 1.00 H new ATOM 0 HB3 LEU A 141 116.261 25.310 -1.694 1.00 1.00 H new ATOM 0 HG LEU A 141 115.318 23.200 -2.498 1.00 1.00 H new ATOM 0 HD11 LEU A 141 116.225 22.110 -4.523 1.00 1.00 H new ATOM 0 HD12 LEU A 141 115.500 23.687 -4.915 1.00 1.00 H new ATOM 0 HD13 LEU A 141 117.269 23.522 -4.816 1.00 1.00 H new ATOM 0 HD21 LEU A 141 117.322 21.755 -2.307 1.00 1.00 H new ATOM 0 HD22 LEU A 141 118.368 23.166 -2.598 1.00 1.00 H new ATOM 0 HD23 LEU A 141 117.376 23.082 -1.122 1.00 1.00 H new ATOM 2227 N LYS A 142 115.271 28.199 -3.714 1.00 1.00 N ATOM 2228 CA LYS A 142 115.005 29.537 -3.189 1.00 1.00 C ATOM 2229 C LYS A 142 115.882 29.817 -1.974 1.00 1.00 C ATOM 2230 O LYS A 142 115.421 30.354 -0.968 1.00 1.00 O ATOM 2231 CB LYS A 142 113.527 29.683 -2.807 1.00 1.00 C ATOM 2232 CG LYS A 142 112.656 29.259 -3.997 1.00 1.00 C ATOM 2233 CD LYS A 142 111.805 28.033 -3.640 1.00 1.00 C ATOM 2234 CE LYS A 142 110.600 28.468 -2.804 1.00 1.00 C ATOM 2235 NZ LYS A 142 109.776 27.273 -2.459 1.00 1.00 N ATOM 0 H LYS A 142 115.634 28.181 -4.667 1.00 1.00 H new ATOM 0 HA LYS A 142 115.240 30.260 -3.970 1.00 1.00 H new ATOM 0 HB2 LYS A 142 113.301 29.066 -1.937 1.00 1.00 H new ATOM 0 HB3 LYS A 142 113.310 30.715 -2.531 1.00 1.00 H new ATOM 0 HG2 LYS A 142 112.008 30.084 -4.291 1.00 1.00 H new ATOM 0 HG3 LYS A 142 113.290 29.030 -4.854 1.00 1.00 H new ATOM 0 HD2 LYS A 142 111.468 27.535 -4.549 1.00 1.00 H new ATOM 0 HD3 LYS A 142 112.404 27.312 -3.084 1.00 1.00 H new ATOM 0 HE2 LYS A 142 110.936 28.966 -1.895 1.00 1.00 H new ATOM 0 HE3 LYS A 142 110.000 29.189 -3.359 1.00 1.00 H new ATOM 0 HZ1 LYS A 142 108.957 27.569 -1.891 1.00 1.00 H new ATOM 0 HZ2 LYS A 142 109.445 26.816 -3.332 1.00 1.00 H new ATOM 0 HZ3 LYS A 142 110.351 26.600 -1.913 1.00 1.00 H new ATOM 2249 N LEU A 143 117.163 29.480 -2.092 1.00 1.00 N ATOM 2250 CA LEU A 143 118.129 29.726 -1.026 1.00 1.00 C ATOM 2251 C LEU A 143 118.859 31.032 -1.320 1.00 1.00 C ATOM 2252 O LEU A 143 119.487 31.180 -2.365 1.00 1.00 O ATOM 2253 CB LEU A 143 119.162 28.593 -0.991 1.00 1.00 C ATOM 2254 CG LEU A 143 118.732 27.410 -0.089 1.00 1.00 C ATOM 2255 CD1 LEU A 143 117.208 27.240 -0.037 1.00 1.00 C ATOM 2256 CD2 LEU A 143 119.349 26.120 -0.643 1.00 1.00 C ATOM 0 H LEU A 143 117.558 29.033 -2.920 1.00 1.00 H new ATOM 0 HA LEU A 143 117.608 29.780 -0.070 1.00 1.00 H new ATOM 0 HB2 LEU A 143 119.328 28.228 -2.005 1.00 1.00 H new ATOM 0 HB3 LEU A 143 120.114 28.987 -0.635 1.00 1.00 H new ATOM 0 HG LEU A 143 119.080 27.619 0.922 1.00 1.00 H new ATOM 0 HD11 LEU A 143 116.958 26.398 0.608 1.00 1.00 H new ATOM 0 HD12 LEU A 143 116.754 28.148 0.359 1.00 1.00 H new ATOM 0 HD13 LEU A 143 116.828 27.053 -1.041 1.00 1.00 H new ATOM 0 HD21 LEU A 143 119.054 25.278 -0.017 1.00 1.00 H new ATOM 0 HD22 LEU A 143 118.996 25.956 -1.661 1.00 1.00 H new ATOM 0 HD23 LEU A 143 120.435 26.208 -0.645 1.00 1.00 H new ATOM 2268 N ARG A 144 118.782 31.978 -0.389 1.00 1.00 N ATOM 2269 CA ARG A 144 119.454 33.260 -0.569 1.00 1.00 C ATOM 2270 C ARG A 144 120.958 33.086 -0.389 1.00 1.00 C ATOM 2271 O ARG A 144 121.622 32.805 -1.372 1.00 1.00 O ATOM 2272 CB ARG A 144 118.929 34.283 0.443 1.00 1.00 C ATOM 2273 CG ARG A 144 119.573 35.649 0.177 1.00 1.00 C ATOM 2274 CD ARG A 144 119.017 36.667 1.172 1.00 1.00 C ATOM 2275 NE ARG A 144 119.513 38.008 0.877 1.00 1.00 N ATOM 2276 CZ ARG A 144 119.387 38.988 1.768 1.00 1.00 C ATOM 2277 NH1 ARG A 144 118.816 38.746 2.915 1.00 1.00 N ATOM 2278 NH2 ARG A 144 119.835 40.187 1.501 1.00 1.00 N ATOM 2279 OXT ARG A 144 121.420 33.228 0.729 1.00 1.00 O ATOM 0 H ARG A 144 118.268 31.884 0.487 1.00 1.00 H new ATOM 0 HA ARG A 144 119.250 33.623 -1.576 1.00 1.00 H new ATOM 0 HB2 ARG A 144 117.844 34.360 0.367 1.00 1.00 H new ATOM 0 HB3 ARG A 144 119.155 33.955 1.457 1.00 1.00 H new ATOM 0 HG2 ARG A 144 120.656 35.580 0.276 1.00 1.00 H new ATOM 0 HG3 ARG A 144 119.366 35.970 -0.844 1.00 1.00 H new ATOM 0 HD2 ARG A 144 117.928 36.661 1.134 1.00 1.00 H new ATOM 0 HD3 ARG A 144 119.302 36.384 2.185 1.00 1.00 H new ATOM 0 HE ARG A 144 119.960 38.195 -0.020 1.00 1.00 H new ATOM 0 HH11 ARG A 144 118.469 37.810 3.125 1.00 1.00 H new ATOM 0 HH12 ARG A 144 118.716 39.493 3.603 1.00 1.00 H new ATOM 0 HH21 ARG A 144 120.284 40.376 0.605 1.00 1.00 H new ATOM 0 HH22 ARG A 144 119.735 40.934 2.189 1.00 1.00 H new TER 2293 ARG A 144