USER MOD reduce.3.24.130724 H: found=0, std=0, add=987, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 987 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 6 HIS : no HE2:sc= 0.229 K(o=1.2,f=-8.2!) USER MOD Set 1.2: A 121 SER OG : rot 87:sc= 0.947 USER MOD Set 2.1: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 75 LYS NZ :NH3+ -140:sc= -0.83! (180deg=-4.17!) USER MOD Set 3.1: A 69 GLN : amide:sc= 0.584 K(o=0.58,f=0) USER MOD Set 3.2: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 22 MET CE :methyl -157:sc= -0.143 (180deg=-0.641) USER MOD Set 4.2: A 68 GLN : amide:sc= -1.31 K(o=-1.5,f=-6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0 (180deg=-0.000778) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.0638 X(o=-0.064,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 7 HIS :FLIP no HD1:sc= -0.188 F(o=-0.74,f=-0.19) USER MOD Single : A 8 HIS :FLIP no HE2:sc= -0.051 F(o=-0.57,f=-0.051) USER MOD Single : A 9 MET CE :methyl -141:sc= -0.17 (180deg=-0.815) USER MOD Single : A 11 THR OG1 : rot 17:sc= 0.696 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.0039) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot -77:sc= 1.11 USER MOD Single : A 37 SER OG : rot -33:sc= 0.0466 USER MOD Single : A 38 CYS SG : rot 87:sc= -3.9! USER MOD Single : A 39 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 41 ASN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 58 SER OG : rot -158:sc= 0.261 USER MOD Single : A 62 GLN : amide:sc= -1.04 X(o=-1,f=-1.3) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 TYR OH : rot 57:sc= 0.178 USER MOD Single : A 78 LYS NZ :NH3+ 138:sc= 1.26! (180deg=-0.285!) USER MOD Single : A 80 ASN : amide:sc= 0.131 K(o=0.13,f=-4.2!) USER MOD Single : A 84 ASN : amide:sc= -2.05! C(o=-2.1!,f=-5!) USER MOD Single : A 85 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.0696 K(o=-0.07,f=-0.71) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 114:sc= -1.16 USER MOD Single : A 101 MET CE :methyl -111:sc= 0 (180deg=-1.42) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 1.11 (180deg=1.11) USER MOD Single : A 104 ASN : amide:sc= -1.12 K(o=-1.1,f=-9.8!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ -171:sc= 0.528 (180deg=0.436) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN :FLIP amide:sc= -0.955 F(o=-2,f=-0.95) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0522) USER MOD Single : A 124 ASN :FLIP amide:sc= -0.503 F(o=-2.1!,f=-0.5) USER MOD Single : A 125 ASN : amide:sc= 0.537 K(o=0.54,f=-0.43) USER MOD Single : A 126 ASN :FLIP amide:sc= -3.05! C(o=-4.2!,f=-3!) USER MOD Single : A 128 ASN : amide:sc= 0.192 X(o=0.19,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.368 -50.300 15.518 1.00 73.24 N ATOM 2 CA MET A 1 -16.661 -51.521 15.061 1.00 53.02 C ATOM 3 C MET A 1 -15.620 -51.162 14.006 1.00 61.40 C ATOM 4 O MET A 1 -14.456 -51.567 14.105 1.00 10.15 O ATOM 5 CB MET A 1 -17.674 -52.536 14.501 1.00 60.25 C ATOM 6 CG MET A 1 -17.087 -53.899 14.145 1.00 75.42 C ATOM 7 SD MET A 1 -15.965 -53.850 12.732 1.00 33.20 S ATOM 8 CE MET A 1 -15.623 -55.596 12.507 1.00 63.14 C ATOM 0 H1 MET A 1 -18.063 -50.554 16.249 1.00 73.24 H new ATOM 0 H2 MET A 1 -16.680 -49.628 15.913 1.00 73.24 H new ATOM 0 H3 MET A 1 -17.858 -49.860 14.713 1.00 73.24 H new ATOM 0 HA MET A 1 -16.148 -51.974 15.909 1.00 53.02 H new ATOM 0 HB2 MET A 1 -18.467 -52.679 15.235 1.00 60.25 H new ATOM 0 HB3 MET A 1 -18.137 -52.112 13.610 1.00 60.25 H new ATOM 0 HG2 MET A 1 -16.553 -54.293 15.010 1.00 75.42 H new ATOM 0 HG3 MET A 1 -17.901 -54.592 13.929 1.00 75.42 H new ATOM 0 HE1 MET A 1 -14.941 -55.728 11.667 1.00 63.14 H new ATOM 0 HE2 MET A 1 -15.166 -55.997 13.412 1.00 63.14 H new ATOM 0 HE3 MET A 1 -16.554 -56.126 12.305 1.00 63.14 H new ATOM 20 N ALA A 2 -16.043 -50.402 12.999 1.00 4.20 N ATOM 21 CA ALA A 2 -15.142 -49.944 11.949 1.00 23.41 C ATOM 22 C ALA A 2 -14.075 -49.012 12.521 1.00 34.04 C ATOM 23 O ALA A 2 -14.385 -48.076 13.263 1.00 4.43 O ATOM 24 CB ALA A 2 -15.928 -49.247 10.842 1.00 14.54 C ATOM 0 H ALA A 2 -17.008 -50.090 12.889 1.00 4.20 H new ATOM 0 HA ALA A 2 -14.640 -50.813 11.523 1.00 23.41 H new ATOM 0 HB1 ALA A 2 -15.242 -48.910 10.065 1.00 14.54 H new ATOM 0 HB2 ALA A 2 -16.648 -49.944 10.413 1.00 14.54 H new ATOM 0 HB3 ALA A 2 -16.456 -48.388 11.256 1.00 14.54 H new ATOM 30 N HIS A 3 -12.819 -49.274 12.178 1.00 52.43 N ATOM 31 CA HIS A 3 -11.699 -48.500 12.704 1.00 23.31 C ATOM 32 C HIS A 3 -11.416 -47.298 11.807 1.00 63.32 C ATOM 33 O HIS A 3 -10.841 -47.435 10.726 1.00 44.40 O ATOM 34 CB HIS A 3 -10.446 -49.379 12.831 1.00 42.32 C ATOM 35 CG HIS A 3 -10.648 -50.596 13.690 1.00 31.34 C ATOM 36 ND1 HIS A 3 -10.536 -50.578 15.064 1.00 43.53 N ATOM 37 CD2 HIS A 3 -10.955 -51.874 13.360 1.00 4.31 C ATOM 38 CE1 HIS A 3 -10.765 -51.787 15.541 1.00 23.24 C ATOM 39 NE2 HIS A 3 -11.020 -52.592 14.529 1.00 65.04 N ATOM 0 H HIS A 3 -12.549 -50.019 11.536 1.00 52.43 H new ATOM 0 HA HIS A 3 -11.967 -48.139 13.697 1.00 23.31 H new ATOM 0 HB2 HIS A 3 -10.132 -49.695 11.836 1.00 42.32 H new ATOM 0 HB3 HIS A 3 -9.634 -48.782 13.247 1.00 42.32 H new ATOM 0 HD2 HIS A 3 -11.118 -52.257 12.363 1.00 4.31 H new ATOM 0 HE1 HIS A 3 -10.747 -52.069 16.583 1.00 23.24 H new ATOM 0 HE2 HIS A 3 -11.231 -53.587 14.602 1.00 65.04 H new ATOM 48 N HIS A 4 -11.842 -46.122 12.254 1.00 71.22 N ATOM 49 CA HIS A 4 -11.644 -44.888 11.502 1.00 40.44 C ATOM 50 C HIS A 4 -10.669 -43.971 12.235 1.00 42.51 C ATOM 51 O HIS A 4 -10.959 -43.501 13.335 1.00 15.33 O ATOM 52 CB HIS A 4 -12.978 -44.156 11.296 1.00 22.12 C ATOM 53 CG HIS A 4 -14.010 -44.955 10.554 1.00 24.11 C ATOM 54 ND1 HIS A 4 -15.289 -45.161 11.028 1.00 5.22 N ATOM 55 CD2 HIS A 4 -13.957 -45.575 9.349 1.00 70.13 C ATOM 56 CE1 HIS A 4 -15.973 -45.871 10.150 1.00 43.14 C ATOM 57 NE2 HIS A 4 -15.188 -46.134 9.123 1.00 33.43 N ATOM 0 H HIS A 4 -12.331 -45.997 13.141 1.00 71.22 H new ATOM 0 HA HIS A 4 -11.231 -45.150 10.528 1.00 40.44 H new ATOM 0 HB2 HIS A 4 -13.381 -43.878 12.270 1.00 22.12 H new ATOM 0 HB3 HIS A 4 -12.791 -43.230 10.752 1.00 22.12 H new ATOM 0 HD2 HIS A 4 -13.103 -45.620 8.689 1.00 70.13 H new ATOM 0 HE1 HIS A 4 -17.001 -46.184 10.255 1.00 43.14 H new ATOM 0 HE2 HIS A 4 -15.454 -46.667 8.295 1.00 33.43 H new ATOM 66 N HIS A 5 -9.509 -43.732 11.629 1.00 33.03 N ATOM 67 CA HIS A 5 -8.518 -42.807 12.179 1.00 63.31 C ATOM 68 C HIS A 5 -8.303 -41.631 11.231 1.00 14.45 C ATOM 69 O HIS A 5 -7.764 -41.800 10.137 1.00 33.53 O ATOM 70 CB HIS A 5 -7.184 -43.523 12.445 1.00 65.22 C ATOM 71 CG HIS A 5 -7.131 -44.213 13.776 1.00 2.32 C ATOM 72 ND1 HIS A 5 -6.343 -43.770 14.816 1.00 51.22 N ATOM 73 CD2 HIS A 5 -7.776 -45.311 14.239 1.00 52.42 C ATOM 74 CE1 HIS A 5 -6.505 -44.560 15.858 1.00 32.40 C ATOM 75 NE2 HIS A 5 -7.368 -45.503 15.536 1.00 53.32 N ATOM 0 H HIS A 5 -9.230 -44.169 10.751 1.00 33.03 H new ATOM 0 HA HIS A 5 -8.899 -42.430 13.128 1.00 63.31 H new ATOM 0 HB2 HIS A 5 -7.011 -44.256 11.657 1.00 65.22 H new ATOM 0 HB3 HIS A 5 -6.373 -42.797 12.388 1.00 65.22 H new ATOM 0 HD2 HIS A 5 -8.479 -45.921 13.691 1.00 52.42 H new ATOM 0 HE1 HIS A 5 -6.014 -44.453 16.814 1.00 32.40 H new ATOM 0 HE2 HIS A 5 -7.682 -46.254 16.151 1.00 53.32 H new ATOM 84 N HIS A 6 -8.744 -40.446 11.654 1.00 75.12 N ATOM 85 CA HIS A 6 -8.608 -39.221 10.862 1.00 34.43 C ATOM 86 C HIS A 6 -8.677 -37.997 11.767 1.00 23.31 C ATOM 87 O HIS A 6 -9.312 -38.027 12.824 1.00 54.44 O ATOM 88 CB HIS A 6 -9.694 -39.132 9.777 1.00 42.00 C ATOM 89 CG HIS A 6 -9.462 -40.062 8.623 1.00 13.52 C ATOM 90 ND1 HIS A 6 -10.282 -41.133 8.337 1.00 32.33 N ATOM 91 CD2 HIS A 6 -8.476 -40.087 7.693 1.00 12.01 C ATOM 92 CE1 HIS A 6 -9.809 -41.777 7.286 1.00 63.32 C ATOM 93 NE2 HIS A 6 -8.718 -41.161 6.879 1.00 73.40 N ATOM 0 H HIS A 6 -9.205 -40.307 12.553 1.00 75.12 H new ATOM 0 HA HIS A 6 -7.637 -39.250 10.369 1.00 34.43 H new ATOM 0 HB2 HIS A 6 -10.663 -39.355 10.224 1.00 42.00 H new ATOM 0 HB3 HIS A 6 -9.742 -38.109 9.405 1.00 42.00 H new ATOM 0 HD1 HIS A 6 -11.122 -41.388 8.856 1.00 32.33 H new ATOM 0 HD2 HIS A 6 -7.654 -39.391 7.610 1.00 12.01 H new ATOM 0 HE1 HIS A 6 -10.242 -42.658 6.837 1.00 63.32 H new ATOM 102 N HIS A 7 -8.036 -36.915 11.338 1.00 62.42 N ATOM 103 CA HIS A 7 -7.983 -35.683 12.118 1.00 65.13 C ATOM 104 C HIS A 7 -8.520 -34.516 11.293 1.00 32.10 C ATOM 105 O HIS A 7 -7.977 -34.183 10.239 1.00 12.14 O ATOM 106 CB HIS A 7 -6.547 -35.400 12.600 1.00 65.21 C ATOM 107 CG HIS A 7 -5.545 -35.151 11.502 1.00 32.15 C ATOM 108 ND1 HIS A 7 -5.261 -35.850 10.375 1.00 30.24 N flip ATOM 109 CD2 HIS A 7 -4.676 -34.080 11.509 1.00 1.33 C flip ATOM 110 CE1 HIS A 7 -4.242 -35.190 9.734 1.00 0.14 C flip ATOM 111 NE2 HIS A 7 -3.909 -34.128 10.437 1.00 45.42 N flip ATOM 0 H HIS A 7 -7.542 -36.866 10.447 1.00 62.42 H new ATOM 0 HA HIS A 7 -8.612 -35.803 13.000 1.00 65.13 H new ATOM 0 HB2 HIS A 7 -6.565 -34.532 13.259 1.00 65.21 H new ATOM 0 HB3 HIS A 7 -6.207 -36.246 13.197 1.00 65.21 H new ATOM 0 HD2 HIS A 7 -4.631 -33.319 12.274 1.00 1.33 H new ATOM 0 HE1 HIS A 7 -3.787 -35.493 8.803 1.00 0.14 H new ATOM 0 HE2 HIS A 7 -3.181 -33.456 10.194 1.00 45.42 H new ATOM 120 N HIS A 8 -9.606 -33.915 11.768 1.00 13.45 N ATOM 121 CA HIS A 8 -10.227 -32.779 11.089 1.00 23.23 C ATOM 122 C HIS A 8 -10.505 -31.656 12.089 1.00 74.33 C ATOM 123 O HIS A 8 -11.082 -31.889 13.151 1.00 52.42 O ATOM 124 CB HIS A 8 -11.518 -33.217 10.368 1.00 33.02 C ATOM 125 CG HIS A 8 -12.501 -33.965 11.230 1.00 23.32 C ATOM 126 ND1 HIS A 8 -13.254 -33.563 12.283 1.00 24.34 N flip ATOM 127 CD2 HIS A 8 -12.812 -35.294 11.032 1.00 53.33 C flip ATOM 128 CE1 HIS A 8 -13.990 -34.643 12.696 1.00 31.13 C flip ATOM 129 NE2 HIS A 8 -13.707 -35.674 11.925 1.00 15.55 N flip ATOM 0 H HIS A 8 -10.079 -34.197 12.627 1.00 13.45 H new ATOM 0 HA HIS A 8 -9.538 -32.400 10.334 1.00 23.23 H new ATOM 0 HB2 HIS A 8 -12.010 -32.332 9.965 1.00 33.02 H new ATOM 0 HB3 HIS A 8 -11.248 -33.846 9.520 1.00 33.02 H new ATOM 0 HD1 HIS A 8 -13.270 -32.629 12.693 1.00 24.34 H new ATOM 0 HD2 HIS A 8 -12.389 -35.926 10.265 1.00 53.33 H new ATOM 0 HE1 HIS A 8 -14.689 -34.648 13.520 1.00 31.13 H new ATOM 138 N MET A 9 -10.069 -30.444 11.754 1.00 13.43 N ATOM 139 CA MET A 9 -10.200 -29.292 12.652 1.00 15.14 C ATOM 140 C MET A 9 -11.043 -28.195 12.006 1.00 73.11 C ATOM 141 O MET A 9 -11.158 -27.090 12.541 1.00 44.24 O ATOM 142 CB MET A 9 -8.809 -28.731 13.001 1.00 12.04 C ATOM 143 CG MET A 9 -7.875 -29.733 13.675 1.00 32.20 C ATOM 144 SD MET A 9 -6.235 -29.047 14.003 1.00 63.45 S ATOM 145 CE MET A 9 -5.683 -28.654 12.342 1.00 61.35 C ATOM 0 H MET A 9 -9.619 -30.231 10.864 1.00 13.43 H new ATOM 0 HA MET A 9 -10.696 -29.627 13.563 1.00 15.14 H new ATOM 0 HB2 MET A 9 -8.337 -28.370 12.087 1.00 12.04 H new ATOM 0 HB3 MET A 9 -8.932 -27.870 13.657 1.00 12.04 H new ATOM 0 HG2 MET A 9 -8.320 -30.064 14.613 1.00 32.20 H new ATOM 0 HG3 MET A 9 -7.776 -30.614 13.041 1.00 32.20 H new ATOM 0 HE1 MET A 9 -4.623 -28.891 12.245 1.00 61.35 H new ATOM 0 HE2 MET A 9 -6.253 -29.240 11.621 1.00 61.35 H new ATOM 0 HE3 MET A 9 -5.837 -27.592 12.149 1.00 61.35 H new ATOM 155 N GLY A 10 -11.654 -28.508 10.872 1.00 21.04 N ATOM 156 CA GLY A 10 -12.348 -27.493 10.106 1.00 12.25 C ATOM 157 C GLY A 10 -11.369 -26.546 9.439 1.00 70.45 C ATOM 158 O GLY A 10 -10.273 -26.964 9.059 1.00 34.22 O ATOM 0 H GLY A 10 -11.682 -29.445 10.469 1.00 21.04 H new ATOM 0 HA2 GLY A 10 -12.972 -27.968 9.349 1.00 12.25 H new ATOM 0 HA3 GLY A 10 -13.014 -26.931 10.761 1.00 12.25 H new ATOM 162 N THR A 11 -11.764 -25.280 9.297 1.00 23.34 N ATOM 163 CA THR A 11 -10.919 -24.239 8.696 1.00 5.34 C ATOM 164 C THR A 11 -10.360 -24.668 7.333 1.00 73.25 C ATOM 165 O THR A 11 -9.357 -24.128 6.863 1.00 41.22 O ATOM 166 CB THR A 11 -9.757 -23.811 9.642 1.00 3.23 C ATOM 167 OG1 THR A 11 -8.952 -24.941 10.016 1.00 31.45 O ATOM 168 CG2 THR A 11 -10.298 -23.139 10.902 1.00 54.52 C ATOM 0 H THR A 11 -12.680 -24.944 9.595 1.00 23.34 H new ATOM 0 HA THR A 11 -11.566 -23.376 8.541 1.00 5.34 H new ATOM 0 HB THR A 11 -9.139 -23.100 9.094 1.00 3.23 H new ATOM 0 HG1 THR A 11 -9.121 -25.682 9.398 1.00 31.45 H new ATOM 0 HG21 THR A 11 -9.467 -22.850 11.546 1.00 54.52 H new ATOM 0 HG22 THR A 11 -10.868 -22.252 10.625 1.00 54.52 H new ATOM 0 HG23 THR A 11 -10.945 -23.835 11.436 1.00 54.52 H new ATOM 176 N LEU A 12 -11.029 -25.627 6.695 1.00 74.23 N ATOM 177 CA LEU A 12 -10.630 -26.116 5.379 1.00 43.44 C ATOM 178 C LEU A 12 -11.761 -25.895 4.384 1.00 71.21 C ATOM 179 O LEU A 12 -12.699 -26.694 4.316 1.00 3.42 O ATOM 180 CB LEU A 12 -10.263 -27.609 5.434 1.00 12.22 C ATOM 181 CG LEU A 12 -9.024 -27.959 6.276 1.00 24.24 C ATOM 182 CD1 LEU A 12 -8.801 -29.472 6.309 1.00 50.32 C ATOM 183 CD2 LEU A 12 -7.786 -27.237 5.740 1.00 34.25 C ATOM 0 H LEU A 12 -11.858 -26.084 7.074 1.00 74.23 H new ATOM 0 HA LEU A 12 -9.749 -25.561 5.057 1.00 43.44 H new ATOM 0 HB2 LEU A 12 -11.116 -28.160 5.830 1.00 12.22 H new ATOM 0 HB3 LEU A 12 -10.100 -27.962 4.416 1.00 12.22 H new ATOM 0 HG LEU A 12 -9.198 -27.621 7.298 1.00 24.24 H new ATOM 0 HD11 LEU A 12 -7.920 -29.697 6.910 1.00 50.32 H new ATOM 0 HD12 LEU A 12 -9.673 -29.959 6.747 1.00 50.32 H new ATOM 0 HD13 LEU A 12 -8.652 -29.840 5.294 1.00 50.32 H new ATOM 0 HD21 LEU A 12 -6.921 -27.498 6.349 1.00 34.25 H new ATOM 0 HD22 LEU A 12 -7.607 -27.538 4.708 1.00 34.25 H new ATOM 0 HD23 LEU A 12 -7.947 -26.160 5.781 1.00 34.25 H new ATOM 195 N GLU A 13 -11.688 -24.786 3.653 1.00 14.14 N ATOM 196 CA GLU A 13 -12.670 -24.463 2.624 1.00 12.15 C ATOM 197 C GLU A 13 -12.317 -23.143 1.943 1.00 4.31 C ATOM 198 O GLU A 13 -12.716 -22.068 2.400 1.00 75.42 O ATOM 199 CB GLU A 13 -14.091 -24.375 3.207 1.00 73.01 C ATOM 200 CG GLU A 13 -15.156 -24.035 2.167 1.00 3.41 C ATOM 201 CD GLU A 13 -16.529 -23.800 2.775 1.00 32.20 C ATOM 202 OE1 GLU A 13 -17.388 -24.703 2.695 1.00 74.13 O ATOM 203 OE2 GLU A 13 -16.757 -22.703 3.327 1.00 51.23 O1- ATOM 0 H GLU A 13 -10.950 -24.090 3.757 1.00 14.14 H new ATOM 0 HA GLU A 13 -12.648 -25.268 1.890 1.00 12.15 H new ATOM 0 HB2 GLU A 13 -14.343 -25.327 3.675 1.00 73.01 H new ATOM 0 HB3 GLU A 13 -14.107 -23.619 3.992 1.00 73.01 H new ATOM 0 HG2 GLU A 13 -14.850 -23.143 1.620 1.00 3.41 H new ATOM 0 HG3 GLU A 13 -15.220 -24.847 1.442 1.00 3.41 H new ATOM 210 N ALA A 14 -11.547 -23.224 0.867 1.00 44.53 N ATOM 211 CA ALA A 14 -11.269 -22.060 0.035 1.00 21.22 C ATOM 212 C ALA A 14 -12.345 -21.951 -1.043 1.00 50.53 C ATOM 213 O ALA A 14 -12.077 -22.135 -2.226 1.00 52.13 O ATOM 214 CB ALA A 14 -9.875 -22.159 -0.581 1.00 0.11 C ATOM 0 H ALA A 14 -11.103 -24.085 0.549 1.00 44.53 H new ATOM 0 HA ALA A 14 -11.289 -21.159 0.648 1.00 21.22 H new ATOM 0 HB1 ALA A 14 -9.687 -21.281 -1.198 1.00 0.11 H new ATOM 0 HB2 ALA A 14 -9.129 -22.211 0.212 1.00 0.11 H new ATOM 0 HB3 ALA A 14 -9.812 -23.056 -1.197 1.00 0.11 H new ATOM 220 N GLN A 15 -13.571 -21.687 -0.603 1.00 4.44 N ATOM 221 CA GLN A 15 -14.740 -21.720 -1.478 1.00 35.21 C ATOM 222 C GLN A 15 -14.672 -20.631 -2.554 1.00 15.42 C ATOM 223 O GLN A 15 -15.018 -19.470 -2.311 1.00 13.51 O ATOM 224 CB GLN A 15 -16.020 -21.601 -0.630 1.00 23.33 C ATOM 225 CG GLN A 15 -17.327 -21.799 -1.403 1.00 20.14 C ATOM 226 CD GLN A 15 -17.988 -20.489 -1.800 1.00 2.31 C ATOM 227 OE1 GLN A 15 -17.746 -19.954 -2.884 1.00 15.13 O ATOM 228 NE2 GLN A 15 -18.817 -19.956 -0.914 1.00 70.34 N ATOM 0 H GLN A 15 -13.783 -21.445 0.365 1.00 4.44 H new ATOM 0 HA GLN A 15 -14.756 -22.674 -2.005 1.00 35.21 H new ATOM 0 HB2 GLN A 15 -15.975 -22.336 0.174 1.00 23.33 H new ATOM 0 HB3 GLN A 15 -16.038 -20.617 -0.161 1.00 23.33 H new ATOM 0 HG2 GLN A 15 -17.127 -22.385 -2.300 1.00 20.14 H new ATOM 0 HG3 GLN A 15 -18.019 -22.378 -0.792 1.00 20.14 H new ATOM 0 HE21 GLN A 15 -18.991 -20.431 -0.028 1.00 70.34 H new ATOM 0 HE22 GLN A 15 -19.282 -19.071 -1.118 1.00 70.34 H new ATOM 237 N THR A 16 -14.188 -21.021 -3.729 1.00 54.35 N ATOM 238 CA THR A 16 -14.131 -20.147 -4.895 1.00 70.15 C ATOM 239 C THR A 16 -14.568 -20.917 -6.144 1.00 32.44 C ATOM 240 O THR A 16 -14.517 -22.148 -6.168 1.00 63.23 O ATOM 241 CB THR A 16 -12.705 -19.574 -5.109 1.00 55.41 C ATOM 242 OG1 THR A 16 -11.743 -20.638 -5.145 1.00 33.34 O ATOM 243 CG2 THR A 16 -12.327 -18.589 -4.005 1.00 42.31 C ATOM 0 H THR A 16 -13.822 -21.958 -3.900 1.00 54.35 H new ATOM 0 HA THR A 16 -14.809 -19.312 -4.719 1.00 70.15 H new ATOM 0 HB THR A 16 -12.704 -19.043 -6.061 1.00 55.41 H new ATOM 0 HG1 THR A 16 -10.847 -20.265 -5.282 1.00 33.34 H new ATOM 0 HG21 THR A 16 -11.322 -18.207 -4.186 1.00 42.31 H new ATOM 0 HG22 THR A 16 -13.035 -17.760 -3.999 1.00 42.31 H new ATOM 0 HG23 THR A 16 -12.354 -19.096 -3.040 1.00 42.31 H new ATOM 251 N GLN A 17 -14.993 -20.194 -7.177 1.00 5.12 N ATOM 252 CA GLN A 17 -15.477 -20.813 -8.411 1.00 31.24 C ATOM 253 C GLN A 17 -14.953 -20.053 -9.625 1.00 21.02 C ATOM 254 O GLN A 17 -14.968 -18.818 -9.645 1.00 15.31 O ATOM 255 CB GLN A 17 -17.011 -20.826 -8.431 1.00 44.40 C ATOM 256 CG GLN A 17 -17.613 -21.547 -9.633 1.00 20.35 C ATOM 257 CD GLN A 17 -19.125 -21.403 -9.710 1.00 71.40 C ATOM 258 OE1 GLN A 17 -19.804 -21.252 -8.692 1.00 24.53 O ATOM 259 NE2 GLN A 17 -19.665 -21.445 -10.919 1.00 70.42 N ATOM 0 H GLN A 17 -15.012 -19.174 -7.185 1.00 5.12 H new ATOM 0 HA GLN A 17 -15.111 -21.839 -8.450 1.00 31.24 H new ATOM 0 HB2 GLN A 17 -17.371 -21.301 -7.518 1.00 44.40 H new ATOM 0 HB3 GLN A 17 -17.372 -19.798 -8.419 1.00 44.40 H new ATOM 0 HG2 GLN A 17 -17.168 -21.154 -10.547 1.00 20.35 H new ATOM 0 HG3 GLN A 17 -17.355 -22.605 -9.583 1.00 20.35 H new ATOM 0 HE21 GLN A 17 -19.071 -21.571 -11.739 1.00 70.42 H new ATOM 0 HE22 GLN A 17 -20.675 -21.351 -11.030 1.00 70.42 H new ATOM 268 N GLY A 18 -14.496 -20.794 -10.632 1.00 22.20 N ATOM 269 CA GLY A 18 -14.001 -20.187 -11.854 1.00 74.21 C ATOM 270 C GLY A 18 -13.654 -21.230 -12.902 1.00 24.32 C ATOM 271 O GLY A 18 -12.939 -22.188 -12.601 1.00 62.33 O ATOM 0 H GLY A 18 -14.460 -21.813 -10.621 1.00 22.20 H new ATOM 0 HA2 GLY A 18 -14.754 -19.507 -12.253 1.00 74.21 H new ATOM 0 HA3 GLY A 18 -13.118 -19.588 -11.631 1.00 74.21 H new ATOM 275 N PRO A 19 -14.149 -21.082 -14.148 1.00 54.21 N ATOM 276 CA PRO A 19 -13.877 -22.045 -15.223 1.00 75.33 C ATOM 277 C PRO A 19 -12.397 -22.065 -15.615 1.00 4.25 C ATOM 278 O PRO A 19 -11.968 -21.354 -16.529 1.00 21.34 O ATOM 279 CB PRO A 19 -14.757 -21.553 -16.384 1.00 30.43 C ATOM 280 CG PRO A 19 -14.973 -20.102 -16.107 1.00 41.32 C ATOM 281 CD PRO A 19 -15.005 -19.968 -14.606 1.00 21.44 C ATOM 0 HA PRO A 19 -14.100 -23.070 -14.926 1.00 75.33 H new ATOM 0 HB2 PRO A 19 -14.265 -21.704 -17.345 1.00 30.43 H new ATOM 0 HB3 PRO A 19 -15.702 -22.094 -16.421 1.00 30.43 H new ATOM 0 HG2 PRO A 19 -14.173 -19.499 -16.536 1.00 41.32 H new ATOM 0 HG3 PRO A 19 -15.906 -19.754 -16.550 1.00 41.32 H new ATOM 0 HD2 PRO A 19 -14.618 -19.003 -14.280 1.00 21.44 H new ATOM 0 HD3 PRO A 19 -16.019 -20.053 -14.216 1.00 21.44 H new ATOM 289 N GLY A 20 -11.617 -22.849 -14.882 1.00 0.13 N ATOM 290 CA GLY A 20 -10.201 -22.995 -15.170 1.00 11.40 C ATOM 291 C GLY A 20 -9.465 -23.661 -14.027 1.00 30.41 C ATOM 292 O GLY A 20 -8.351 -23.267 -13.673 1.00 31.00 O ATOM 0 H GLY A 20 -11.944 -23.393 -14.083 1.00 0.13 H new ATOM 0 HA2 GLY A 20 -10.073 -23.584 -16.078 1.00 11.40 H new ATOM 0 HA3 GLY A 20 -9.765 -22.014 -15.362 1.00 11.40 H new ATOM 296 N SER A 21 -10.094 -24.678 -13.454 1.00 65.42 N ATOM 297 CA SER A 21 -9.561 -25.366 -12.285 1.00 70.35 C ATOM 298 C SER A 21 -8.456 -26.356 -12.671 1.00 61.03 C ATOM 299 O SER A 21 -8.324 -26.727 -13.841 1.00 35.42 O ATOM 300 CB SER A 21 -10.701 -26.102 -11.569 1.00 2.21 C ATOM 301 OG SER A 21 -11.772 -25.219 -11.279 1.00 14.23 O ATOM 0 H SER A 21 -10.985 -25.049 -13.785 1.00 65.42 H new ATOM 0 HA SER A 21 -9.121 -24.624 -11.619 1.00 70.35 H new ATOM 0 HB2 SER A 21 -11.059 -26.921 -12.193 1.00 2.21 H new ATOM 0 HB3 SER A 21 -10.329 -26.545 -10.645 1.00 2.21 H new ATOM 0 HG SER A 21 -12.487 -25.711 -10.824 1.00 14.23 H new ATOM 307 N MET A 22 -7.660 -26.770 -11.678 1.00 71.32 N ATOM 308 CA MET A 22 -6.661 -27.830 -11.863 1.00 14.44 C ATOM 309 C MET A 22 -7.318 -29.097 -12.406 1.00 34.21 C ATOM 310 O MET A 22 -6.694 -29.868 -13.135 1.00 25.22 O ATOM 311 CB MET A 22 -5.945 -28.138 -10.533 1.00 32.01 C ATOM 312 CG MET A 22 -4.717 -27.275 -10.271 1.00 64.35 C ATOM 313 SD MET A 22 -3.314 -27.730 -11.316 1.00 62.34 S ATOM 314 CE MET A 22 -2.916 -29.363 -10.680 1.00 41.55 C ATOM 0 H MET A 22 -7.689 -26.385 -10.734 1.00 71.32 H new ATOM 0 HA MET A 22 -5.924 -27.479 -12.585 1.00 14.44 H new ATOM 0 HB2 MET A 22 -6.651 -28.004 -9.714 1.00 32.01 H new ATOM 0 HB3 MET A 22 -5.646 -29.186 -10.528 1.00 32.01 H new ATOM 0 HG2 MET A 22 -4.969 -26.229 -10.443 1.00 64.35 H new ATOM 0 HG3 MET A 22 -4.430 -27.366 -9.223 1.00 64.35 H new ATOM 0 HE1 MET A 22 -1.877 -29.600 -10.910 1.00 41.55 H new ATOM 0 HE2 MET A 22 -3.061 -29.378 -9.600 1.00 41.55 H new ATOM 0 HE3 MET A 22 -3.568 -30.103 -11.144 1.00 41.55 H new ATOM 324 N ILE A 23 -8.583 -29.290 -12.043 1.00 11.52 N ATOM 325 CA ILE A 23 -9.361 -30.431 -12.509 1.00 62.20 C ATOM 326 C ILE A 23 -9.516 -30.350 -14.030 1.00 11.52 C ATOM 327 O ILE A 23 -10.303 -29.549 -14.536 1.00 51.53 O ATOM 328 CB ILE A 23 -10.763 -30.466 -11.845 1.00 4.53 C ATOM 329 CG1 ILE A 23 -10.668 -30.121 -10.346 1.00 14.53 C ATOM 330 CG2 ILE A 23 -11.415 -31.833 -12.038 1.00 3.25 C ATOM 331 CD1 ILE A 23 -9.775 -31.051 -9.553 1.00 12.43 C ATOM 0 H ILE A 23 -9.094 -28.663 -11.421 1.00 11.52 H new ATOM 0 HA ILE A 23 -8.832 -31.344 -12.233 1.00 62.20 H new ATOM 0 HB ILE A 23 -11.386 -29.714 -12.330 1.00 4.53 H new ATOM 0 HG12 ILE A 23 -10.297 -29.102 -10.242 1.00 14.53 H new ATOM 0 HG13 ILE A 23 -11.669 -30.141 -9.915 1.00 14.53 H new ATOM 0 HG21 ILE A 23 -12.397 -31.838 -11.565 1.00 3.25 H new ATOM 0 HG22 ILE A 23 -11.524 -32.037 -13.103 1.00 3.25 H new ATOM 0 HG23 ILE A 23 -10.790 -32.602 -11.583 1.00 3.25 H new ATOM 0 HD11 ILE A 23 -9.762 -30.740 -8.508 1.00 12.43 H new ATOM 0 HD12 ILE A 23 -10.156 -32.070 -9.624 1.00 12.43 H new ATOM 0 HD13 ILE A 23 -8.763 -31.014 -9.955 1.00 12.43 H new ATOM 343 N GLU A 24 -8.744 -31.158 -14.748 1.00 63.12 N ATOM 344 CA GLU A 24 -8.678 -31.072 -16.206 1.00 10.03 C ATOM 345 C GLU A 24 -9.941 -31.635 -16.860 1.00 51.50 C ATOM 346 O GLU A 24 -10.317 -32.780 -16.620 1.00 10.23 O ATOM 347 CB GLU A 24 -7.451 -31.829 -16.721 1.00 41.42 C ATOM 348 CG GLU A 24 -7.315 -31.830 -18.243 1.00 40.21 C ATOM 349 CD GLU A 24 -6.942 -30.469 -18.813 1.00 32.25 C ATOM 350 OE1 GLU A 24 -5.769 -30.292 -19.210 1.00 35.10 O ATOM 351 OE2 GLU A 24 -7.813 -29.573 -18.877 1.00 70.14 O1- ATOM 0 H GLU A 24 -8.152 -31.884 -14.344 1.00 63.12 H new ATOM 0 HA GLU A 24 -8.599 -30.018 -16.473 1.00 10.03 H new ATOM 0 HB2 GLU A 24 -6.555 -31.386 -16.287 1.00 41.42 H new ATOM 0 HB3 GLU A 24 -7.499 -32.860 -16.370 1.00 41.42 H new ATOM 0 HG2 GLU A 24 -6.557 -32.558 -18.533 1.00 40.21 H new ATOM 0 HG3 GLU A 24 -8.256 -32.156 -18.685 1.00 40.21 H new ATOM 358 N GLN A 25 -10.580 -30.825 -17.697 1.00 3.42 N ATOM 359 CA GLN A 25 -11.769 -31.249 -18.436 1.00 70.21 C ATOM 360 C GLN A 25 -11.359 -32.075 -19.659 1.00 62.55 C ATOM 361 O GLN A 25 -10.629 -31.591 -20.532 1.00 71.41 O ATOM 362 CB GLN A 25 -12.592 -30.020 -18.859 1.00 35.52 C ATOM 363 CG GLN A 25 -11.780 -28.965 -19.607 1.00 35.52 C ATOM 364 CD GLN A 25 -12.601 -27.764 -20.042 1.00 34.41 C ATOM 365 OE1 GLN A 25 -13.586 -27.394 -19.398 1.00 41.35 O ATOM 366 NE2 GLN A 25 -12.199 -27.147 -21.141 1.00 13.53 N ATOM 0 H GLN A 25 -10.294 -29.864 -17.883 1.00 3.42 H new ATOM 0 HA GLN A 25 -12.388 -31.873 -17.791 1.00 70.21 H new ATOM 0 HB2 GLN A 25 -13.417 -30.347 -19.492 1.00 35.52 H new ATOM 0 HB3 GLN A 25 -13.032 -29.565 -17.971 1.00 35.52 H new ATOM 0 HG2 GLN A 25 -10.965 -28.625 -18.968 1.00 35.52 H new ATOM 0 HG3 GLN A 25 -11.327 -29.423 -20.486 1.00 35.52 H new ATOM 0 HE21 GLN A 25 -11.379 -27.485 -21.645 1.00 13.53 H new ATOM 0 HE22 GLN A 25 -12.709 -26.333 -21.485 1.00 13.53 H new ATOM 375 N ILE A 26 -11.825 -33.319 -19.729 1.00 73.45 N ATOM 376 CA ILE A 26 -11.416 -34.235 -20.796 1.00 30.23 C ATOM 377 C ILE A 26 -12.622 -34.899 -21.461 1.00 44.22 C ATOM 378 O ILE A 26 -13.674 -35.071 -20.838 1.00 73.54 O ATOM 379 CB ILE A 26 -10.464 -35.331 -20.260 1.00 32.02 C ATOM 380 CG1 ILE A 26 -11.147 -36.149 -19.150 1.00 24.53 C ATOM 381 CG2 ILE A 26 -9.159 -34.708 -19.758 1.00 54.44 C ATOM 382 CD1 ILE A 26 -10.303 -37.296 -18.634 1.00 35.42 C ATOM 0 H ILE A 26 -12.485 -33.718 -19.062 1.00 73.45 H new ATOM 0 HA ILE A 26 -10.890 -33.635 -21.539 1.00 30.23 H new ATOM 0 HB ILE A 26 -10.224 -36.010 -21.078 1.00 32.02 H new ATOM 0 HG12 ILE A 26 -11.391 -35.486 -18.320 1.00 24.53 H new ATOM 0 HG13 ILE A 26 -12.089 -36.544 -19.529 1.00 24.53 H new ATOM 0 HG21 ILE A 26 -8.501 -35.493 -19.385 1.00 54.44 H new ATOM 0 HG22 ILE A 26 -8.668 -34.182 -20.577 1.00 54.44 H new ATOM 0 HG23 ILE A 26 -9.377 -34.005 -18.954 1.00 54.44 H new ATOM 0 HD11 ILE A 26 -10.849 -37.827 -17.854 1.00 35.42 H new ATOM 0 HD12 ILE A 26 -10.081 -37.981 -19.452 1.00 35.42 H new ATOM 0 HD13 ILE A 26 -9.371 -36.906 -18.224 1.00 35.42 H new ATOM 394 N GLY A 27 -12.457 -35.254 -22.734 1.00 62.23 N ATOM 395 CA GLY A 27 -13.498 -35.948 -23.477 1.00 35.05 C ATOM 396 C GLY A 27 -13.270 -37.450 -23.542 1.00 75.43 C ATOM 397 O GLY A 27 -12.506 -38.005 -22.751 1.00 55.43 O ATOM 0 H GLY A 27 -11.609 -35.070 -23.270 1.00 62.23 H new ATOM 0 HA2 GLY A 27 -14.464 -35.751 -23.012 1.00 35.05 H new ATOM 0 HA3 GLY A 27 -13.545 -35.547 -24.490 1.00 35.05 H new ATOM 401 N ASP A 28 -13.919 -38.103 -24.507 1.00 55.22 N ATOM 402 CA ASP A 28 -13.879 -39.567 -24.637 1.00 30.13 C ATOM 403 C ASP A 28 -12.465 -40.072 -24.939 1.00 31.43 C ATOM 404 O ASP A 28 -11.915 -40.884 -24.193 1.00 52.43 O ATOM 405 CB ASP A 28 -14.854 -40.022 -25.737 1.00 2.44 C ATOM 406 CG ASP A 28 -14.722 -41.501 -26.094 1.00 31.34 C ATOM 407 OD1 ASP A 28 -14.003 -41.823 -27.070 1.00 33.35 O ATOM 408 OD2 ASP A 28 -15.350 -42.345 -25.418 1.00 65.03 O1- ATOM 0 H ASP A 28 -14.485 -37.639 -25.218 1.00 55.22 H new ATOM 0 HA ASP A 28 -14.183 -39.996 -23.682 1.00 30.13 H new ATOM 0 HB2 ASP A 28 -15.875 -39.825 -25.411 1.00 2.44 H new ATOM 0 HB3 ASP A 28 -14.684 -39.424 -26.632 1.00 2.44 H new ATOM 413 N SER A 29 -11.875 -39.574 -26.023 1.00 43.14 N ATOM 414 CA SER A 29 -10.547 -40.014 -26.446 1.00 21.41 C ATOM 415 C SER A 29 -9.501 -39.614 -25.405 1.00 74.42 C ATOM 416 O SER A 29 -8.560 -40.365 -25.124 1.00 31.25 O ATOM 417 CB SER A 29 -10.198 -39.413 -27.818 1.00 13.32 C ATOM 418 OG SER A 29 -8.945 -39.883 -28.291 1.00 44.32 O ATOM 0 H SER A 29 -12.295 -38.866 -26.625 1.00 43.14 H new ATOM 0 HA SER A 29 -10.550 -41.100 -26.535 1.00 21.41 H new ATOM 0 HB2 SER A 29 -10.977 -39.668 -28.536 1.00 13.32 H new ATOM 0 HB3 SER A 29 -10.175 -38.326 -27.744 1.00 13.32 H new ATOM 0 HG SER A 29 -8.754 -39.483 -29.165 1.00 44.32 H new ATOM 424 N GLU A 30 -9.687 -38.432 -24.821 1.00 44.24 N ATOM 425 CA GLU A 30 -8.770 -37.921 -23.811 1.00 41.13 C ATOM 426 C GLU A 30 -8.830 -38.769 -22.546 1.00 44.35 C ATOM 427 O GLU A 30 -7.835 -38.896 -21.845 1.00 55.03 O ATOM 428 CB GLU A 30 -9.075 -36.452 -23.480 1.00 34.32 C ATOM 429 CG GLU A 30 -8.991 -35.529 -24.687 1.00 30.32 C ATOM 430 CD GLU A 30 -9.145 -34.058 -24.331 1.00 70.04 C ATOM 431 OE1 GLU A 30 -10.260 -33.642 -23.955 1.00 75.54 O ATOM 432 OE2 GLU A 30 -8.156 -33.303 -24.452 1.00 72.31 O1- ATOM 0 H GLU A 30 -10.468 -37.810 -25.032 1.00 44.24 H new ATOM 0 HA GLU A 30 -7.761 -37.978 -24.220 1.00 41.13 H new ATOM 0 HB2 GLU A 30 -10.074 -36.384 -23.049 1.00 34.32 H new ATOM 0 HB3 GLU A 30 -8.376 -36.106 -22.719 1.00 34.32 H new ATOM 0 HG2 GLU A 30 -8.032 -35.677 -25.183 1.00 30.32 H new ATOM 0 HG3 GLU A 30 -9.766 -35.806 -25.402 1.00 30.32 H new ATOM 439 N PHE A 31 -9.994 -39.357 -22.265 1.00 52.35 N ATOM 440 CA PHE A 31 -10.157 -40.204 -21.082 1.00 4.33 C ATOM 441 C PHE A 31 -9.104 -41.310 -21.072 1.00 54.44 C ATOM 442 O PHE A 31 -8.300 -41.403 -20.142 1.00 42.52 O ATOM 443 CB PHE A 31 -11.572 -40.805 -21.028 1.00 52.22 C ATOM 444 CG PHE A 31 -11.811 -41.692 -19.830 1.00 11.55 C ATOM 445 CD1 PHE A 31 -11.854 -43.075 -19.964 1.00 31.15 C ATOM 446 CD2 PHE A 31 -11.994 -41.142 -18.568 1.00 33.32 C ATOM 447 CE1 PHE A 31 -12.072 -43.885 -18.865 1.00 3.32 C ATOM 448 CE2 PHE A 31 -12.212 -41.949 -17.469 1.00 65.25 C ATOM 449 CZ PHE A 31 -12.251 -43.323 -17.617 1.00 11.43 C ATOM 0 H PHE A 31 -10.833 -39.263 -22.837 1.00 52.35 H new ATOM 0 HA PHE A 31 -10.019 -39.584 -20.196 1.00 4.33 H new ATOM 0 HB2 PHE A 31 -12.301 -39.995 -21.020 1.00 52.22 H new ATOM 0 HB3 PHE A 31 -11.747 -41.382 -21.936 1.00 52.22 H new ATOM 0 HD1 PHE A 31 -11.716 -43.522 -20.937 1.00 31.15 H new ATOM 0 HD2 PHE A 31 -11.965 -40.069 -18.445 1.00 33.32 H new ATOM 0 HE1 PHE A 31 -12.102 -44.958 -18.983 1.00 3.32 H new ATOM 0 HE2 PHE A 31 -12.352 -41.507 -16.494 1.00 65.25 H new ATOM 0 HZ PHE A 31 -12.421 -43.955 -16.758 1.00 11.43 H new ATOM 459 N ASP A 32 -9.090 -42.117 -22.129 1.00 24.45 N ATOM 460 CA ASP A 32 -8.138 -43.223 -22.246 1.00 14.44 C ATOM 461 C ASP A 32 -6.708 -42.728 -22.059 1.00 54.45 C ATOM 462 O ASP A 32 -5.977 -43.221 -21.200 1.00 73.42 O ATOM 463 CB ASP A 32 -8.264 -43.907 -23.615 1.00 2.53 C ATOM 464 CG ASP A 32 -7.242 -45.024 -23.807 1.00 22.33 C ATOM 465 OD1 ASP A 32 -7.507 -46.163 -23.369 1.00 54.10 O ATOM 466 OD2 ASP A 32 -6.170 -44.772 -24.404 1.00 35.01 O1- ATOM 0 H ASP A 32 -9.728 -42.027 -22.920 1.00 24.45 H new ATOM 0 HA ASP A 32 -8.372 -43.944 -21.463 1.00 14.44 H new ATOM 0 HB2 ASP A 32 -9.269 -44.316 -23.722 1.00 2.53 H new ATOM 0 HB3 ASP A 32 -8.137 -43.164 -24.402 1.00 2.53 H new ATOM 471 N ASN A 33 -6.331 -41.735 -22.857 1.00 43.22 N ATOM 472 CA ASN A 33 -4.969 -41.201 -22.860 1.00 4.32 C ATOM 473 C ASN A 33 -4.580 -40.682 -21.477 1.00 12.24 C ATOM 474 O ASN A 33 -3.599 -41.130 -20.877 1.00 43.20 O ATOM 475 CB ASN A 33 -4.853 -40.070 -23.892 1.00 4.00 C ATOM 476 CG ASN A 33 -3.416 -39.617 -24.103 1.00 1.45 C ATOM 477 OD1 ASN A 33 -2.934 -38.704 -23.430 1.00 34.52 O ATOM 478 ND2 ASN A 33 -2.719 -40.261 -25.027 1.00 23.04 N ATOM 0 H ASN A 33 -6.957 -41.277 -23.519 1.00 43.22 H new ATOM 0 HA ASN A 33 -4.287 -42.008 -23.127 1.00 4.32 H new ATOM 0 HB2 ASN A 33 -5.268 -40.406 -24.842 1.00 4.00 H new ATOM 0 HB3 ASN A 33 -5.453 -39.221 -23.565 1.00 4.00 H new ATOM 0 HD21 ASN A 33 -1.747 -40.006 -25.202 1.00 23.04 H new ATOM 0 HD22 ASN A 33 -3.154 -41.012 -25.563 1.00 23.04 H new ATOM 485 N LYS A 34 -5.383 -39.753 -20.976 1.00 32.10 N ATOM 486 CA LYS A 34 -5.121 -39.087 -19.706 1.00 63.34 C ATOM 487 C LYS A 34 -5.021 -40.087 -18.555 1.00 13.43 C ATOM 488 O LYS A 34 -4.218 -39.897 -17.641 1.00 20.22 O ATOM 489 CB LYS A 34 -6.214 -38.046 -19.428 1.00 42.13 C ATOM 490 CG LYS A 34 -6.192 -36.862 -20.395 1.00 54.23 C ATOM 491 CD LYS A 34 -4.981 -35.961 -20.155 1.00 2.25 C ATOM 492 CE LYS A 34 -5.014 -34.715 -21.031 1.00 10.31 C ATOM 493 NZ LYS A 34 -3.948 -33.746 -20.658 1.00 61.25 N1+ ATOM 0 H LYS A 34 -6.236 -39.439 -21.439 1.00 32.10 H new ATOM 0 HA LYS A 34 -4.158 -38.582 -19.780 1.00 63.34 H new ATOM 0 HB2 LYS A 34 -7.189 -38.531 -19.483 1.00 42.13 H new ATOM 0 HB3 LYS A 34 -6.100 -37.675 -18.410 1.00 42.13 H new ATOM 0 HG2 LYS A 34 -6.175 -37.230 -21.421 1.00 54.23 H new ATOM 0 HG3 LYS A 34 -7.107 -36.281 -20.280 1.00 54.23 H new ATOM 0 HD2 LYS A 34 -4.951 -35.666 -19.106 1.00 2.25 H new ATOM 0 HD3 LYS A 34 -4.067 -36.521 -20.355 1.00 2.25 H new ATOM 0 HE2 LYS A 34 -4.894 -35.002 -22.076 1.00 10.31 H new ATOM 0 HE3 LYS A 34 -5.988 -34.235 -20.942 1.00 10.31 H new ATOM 0 HZ1 LYS A 34 -4.004 -32.912 -21.277 1.00 61.25 H new ATOM 0 HZ2 LYS A 34 -4.077 -33.452 -19.669 1.00 61.25 H new ATOM 0 HZ3 LYS A 34 -3.017 -34.196 -20.767 1.00 61.25 H new ATOM 507 N VAL A 35 -5.825 -41.150 -18.604 1.00 1.14 N ATOM 508 CA VAL A 35 -5.781 -42.194 -17.578 1.00 22.00 C ATOM 509 C VAL A 35 -4.544 -43.082 -17.753 1.00 74.14 C ATOM 510 O VAL A 35 -3.894 -43.458 -16.776 1.00 12.35 O ATOM 511 CB VAL A 35 -7.067 -43.067 -17.586 1.00 71.34 C ATOM 512 CG1 VAL A 35 -6.940 -44.245 -16.618 1.00 55.41 C ATOM 513 CG2 VAL A 35 -8.294 -42.222 -17.238 1.00 4.12 C ATOM 0 H VAL A 35 -6.512 -41.311 -19.340 1.00 1.14 H new ATOM 0 HA VAL A 35 -5.722 -41.690 -16.613 1.00 22.00 H new ATOM 0 HB VAL A 35 -7.193 -43.467 -18.592 1.00 71.34 H new ATOM 0 HG11 VAL A 35 -7.854 -44.838 -16.645 1.00 55.41 H new ATOM 0 HG12 VAL A 35 -6.095 -44.868 -16.911 1.00 55.41 H new ATOM 0 HG13 VAL A 35 -6.780 -43.870 -15.607 1.00 55.41 H new ATOM 0 HG21 VAL A 35 -9.184 -42.851 -17.249 1.00 4.12 H new ATOM 0 HG22 VAL A 35 -8.168 -41.789 -16.246 1.00 4.12 H new ATOM 0 HG23 VAL A 35 -8.405 -41.423 -17.971 1.00 4.12 H new ATOM 523 N THR A 36 -4.206 -43.403 -18.999 1.00 14.23 N ATOM 524 CA THR A 36 -3.034 -44.234 -19.284 1.00 5.43 C ATOM 525 C THR A 36 -1.746 -43.415 -19.184 1.00 53.41 C ATOM 526 O THR A 36 -0.641 -43.964 -19.221 1.00 51.32 O ATOM 527 CB THR A 36 -3.125 -44.898 -20.681 1.00 11.34 C ATOM 528 OG1 THR A 36 -3.333 -43.903 -21.696 1.00 35.24 O ATOM 529 CG2 THR A 36 -4.258 -45.920 -20.730 1.00 31.14 C ATOM 0 H THR A 36 -4.723 -43.103 -19.826 1.00 14.23 H new ATOM 0 HA THR A 36 -3.014 -45.023 -18.533 1.00 5.43 H new ATOM 0 HB THR A 36 -2.182 -45.412 -20.867 1.00 11.34 H new ATOM 0 HG1 THR A 36 -4.268 -43.611 -21.681 1.00 35.24 H new ATOM 0 HG21 THR A 36 -4.299 -46.370 -21.722 1.00 31.14 H new ATOM 0 HG22 THR A 36 -4.080 -46.696 -19.986 1.00 31.14 H new ATOM 0 HG23 THR A 36 -5.205 -45.424 -20.517 1.00 31.14 H new ATOM 537 N SER A 37 -1.903 -42.098 -19.062 1.00 74.54 N ATOM 538 CA SER A 37 -0.779 -41.184 -18.896 1.00 42.32 C ATOM 539 C SER A 37 0.005 -41.477 -17.607 1.00 73.45 C ATOM 540 O SER A 37 1.118 -40.973 -17.429 1.00 65.42 O ATOM 541 CB SER A 37 -1.284 -39.735 -18.898 1.00 1.24 C ATOM 542 OG SER A 37 -0.211 -38.806 -18.842 1.00 11.40 O ATOM 0 H SER A 37 -2.813 -41.637 -19.076 1.00 74.54 H new ATOM 0 HA SER A 37 -0.097 -41.331 -19.733 1.00 42.32 H new ATOM 0 HB2 SER A 37 -1.874 -39.556 -19.797 1.00 1.24 H new ATOM 0 HB3 SER A 37 -1.946 -39.579 -18.046 1.00 1.24 H new ATOM 0 HG SER A 37 0.524 -39.186 -18.316 1.00 11.40 H new ATOM 548 N CYS A 38 -0.574 -42.286 -16.713 1.00 31.04 N ATOM 549 CA CYS A 38 0.104 -42.688 -15.479 1.00 10.42 C ATOM 550 C CYS A 38 1.514 -43.206 -15.770 1.00 51.55 C ATOM 551 O CYS A 38 1.683 -44.236 -16.428 1.00 23.12 O ATOM 552 CB CYS A 38 -0.689 -43.785 -14.751 1.00 55.23 C ATOM 553 SG CYS A 38 -2.326 -43.292 -14.174 1.00 22.33 S ATOM 0 H CYS A 38 -1.511 -42.674 -16.822 1.00 31.04 H new ATOM 0 HA CYS A 38 0.169 -41.805 -14.844 1.00 10.42 H new ATOM 0 HB2 CYS A 38 -0.799 -44.638 -15.421 1.00 55.23 H new ATOM 0 HB3 CYS A 38 -0.106 -44.125 -13.895 1.00 55.23 H new ATOM 0 HG CYS A 38 -3.192 -43.462 -15.128 1.00 22.33 H new ATOM 559 N ASN A 39 2.523 -42.475 -15.301 1.00 72.42 N ATOM 560 CA ASN A 39 3.910 -42.919 -15.426 1.00 15.33 C ATOM 561 C ASN A 39 4.099 -44.207 -14.631 1.00 11.44 C ATOM 562 O ASN A 39 4.279 -45.282 -15.204 1.00 34.54 O ATOM 563 CB ASN A 39 4.885 -41.837 -14.932 1.00 42.12 C ATOM 564 CG ASN A 39 4.808 -40.555 -15.745 1.00 14.24 C ATOM 565 OD1 ASN A 39 4.486 -40.573 -16.935 1.00 23.53 O ATOM 566 ND2 ASN A 39 5.102 -39.431 -15.113 1.00 10.15 N ATOM 0 H ASN A 39 2.407 -41.576 -14.833 1.00 72.42 H new ATOM 0 HA ASN A 39 4.127 -43.104 -16.478 1.00 15.33 H new ATOM 0 HB2 ASN A 39 4.671 -41.612 -13.887 1.00 42.12 H new ATOM 0 HB3 ASN A 39 5.902 -42.226 -14.972 1.00 42.12 H new ATOM 0 HD21 ASN A 39 5.066 -38.542 -15.611 1.00 10.15 H new ATOM 0 HD22 ASN A 39 5.364 -39.454 -14.128 1.00 10.15 H new ATOM 573 N ASP A 40 4.039 -44.088 -13.307 1.00 2.41 N ATOM 574 CA ASP A 40 4.057 -45.250 -12.422 1.00 42.21 C ATOM 575 C ASP A 40 3.537 -44.877 -11.035 1.00 11.11 C ATOM 576 O ASP A 40 3.927 -43.850 -10.478 1.00 52.12 O ATOM 577 CB ASP A 40 5.467 -45.846 -12.311 1.00 54.20 C ATOM 578 CG ASP A 40 5.519 -46.997 -11.319 1.00 63.42 C ATOM 579 OD1 ASP A 40 4.750 -47.971 -11.492 1.00 24.22 O ATOM 580 OD2 ASP A 40 6.312 -46.927 -10.358 1.00 1.42 O1- ATOM 0 H ASP A 40 3.977 -43.193 -12.821 1.00 2.41 H new ATOM 0 HA ASP A 40 3.401 -46.005 -12.856 1.00 42.21 H new ATOM 0 HB2 ASP A 40 5.791 -46.196 -13.291 1.00 54.20 H new ATOM 0 HB3 ASP A 40 6.166 -45.069 -12.003 1.00 54.20 H new ATOM 585 N ASN A 41 2.639 -45.709 -10.498 1.00 20.22 N ATOM 586 CA ASN A 41 2.032 -45.487 -9.178 1.00 43.41 C ATOM 587 C ASN A 41 1.301 -44.144 -9.111 1.00 72.45 C ATOM 588 O ASN A 41 0.941 -43.679 -8.026 1.00 25.45 O ATOM 589 CB ASN A 41 3.090 -45.588 -8.060 1.00 53.22 C ATOM 590 CG ASN A 41 3.404 -47.029 -7.680 1.00 43.00 C ATOM 591 OD1 ASN A 41 4.352 -47.642 -8.369 1.00 12.13 O flip ATOM 592 ND2 ASN A 41 2.789 -47.588 -6.774 1.00 51.54 N flip ATOM 0 H ASN A 41 2.311 -46.555 -10.964 1.00 20.22 H new ATOM 0 HA ASN A 41 1.293 -46.273 -9.024 1.00 43.41 H new ATOM 0 HB2 ASN A 41 4.006 -45.094 -8.385 1.00 53.22 H new ATOM 0 HB3 ASN A 41 2.735 -45.053 -7.179 1.00 53.22 H new ATOM 0 HD21 ASN A 41 2.064 -47.084 -6.263 1.00 51.54 H new ATOM 0 HD22 ASN A 41 3.004 -48.555 -6.533 1.00 51.54 H new ATOM 599 N ILE A 42 1.041 -43.553 -10.273 1.00 4.44 N ATOM 600 CA ILE A 42 0.396 -42.246 -10.348 1.00 53.42 C ATOM 601 C ILE A 42 -1.097 -42.363 -10.062 1.00 61.41 C ATOM 602 O ILE A 42 -1.808 -43.136 -10.713 1.00 70.51 O ATOM 603 CB ILE A 42 0.609 -41.586 -11.735 1.00 60.24 C ATOM 604 CG1 ILE A 42 2.106 -41.343 -11.989 1.00 24.42 C ATOM 605 CG2 ILE A 42 -0.180 -40.279 -11.848 1.00 31.35 C ATOM 606 CD1 ILE A 42 2.765 -40.433 -10.971 1.00 11.11 C ATOM 0 H ILE A 42 1.268 -43.961 -11.180 1.00 4.44 H new ATOM 0 HA ILE A 42 0.858 -41.614 -9.590 1.00 53.42 H new ATOM 0 HB ILE A 42 0.235 -42.269 -12.498 1.00 60.24 H new ATOM 0 HG12 ILE A 42 2.624 -42.302 -11.992 1.00 24.42 H new ATOM 0 HG13 ILE A 42 2.230 -40.910 -12.982 1.00 24.42 H new ATOM 0 HG21 ILE A 42 -0.013 -39.837 -12.830 1.00 31.35 H new ATOM 0 HG22 ILE A 42 -1.243 -40.483 -11.718 1.00 31.35 H new ATOM 0 HG23 ILE A 42 0.153 -39.585 -11.076 1.00 31.35 H new ATOM 0 HD11 ILE A 42 3.819 -40.312 -11.220 1.00 11.11 H new ATOM 0 HD12 ILE A 42 2.275 -39.459 -10.982 1.00 11.11 H new ATOM 0 HD13 ILE A 42 2.675 -40.873 -9.978 1.00 11.11 H new ATOM 618 N LEU A 43 -1.558 -41.599 -9.080 1.00 61.41 N ATOM 619 CA LEU A 43 -2.963 -41.573 -8.702 1.00 72.33 C ATOM 620 C LEU A 43 -3.722 -40.627 -9.631 1.00 70.42 C ATOM 621 O LEU A 43 -3.437 -39.424 -9.683 1.00 24.44 O ATOM 622 CB LEU A 43 -3.120 -41.104 -7.243 1.00 53.01 C ATOM 623 CG LEU A 43 -4.313 -41.697 -6.456 1.00 15.11 C ATOM 624 CD1 LEU A 43 -4.600 -40.866 -5.208 1.00 20.34 C ATOM 625 CD2 LEU A 43 -5.571 -41.823 -7.319 1.00 60.11 C ATOM 0 H LEU A 43 -0.968 -40.980 -8.524 1.00 61.41 H new ATOM 0 HA LEU A 43 -3.371 -42.580 -8.790 1.00 72.33 H new ATOM 0 HB2 LEU A 43 -2.203 -41.345 -6.706 1.00 53.01 H new ATOM 0 HB3 LEU A 43 -3.215 -40.018 -7.241 1.00 53.01 H new ATOM 0 HG LEU A 43 -4.028 -42.704 -6.152 1.00 15.11 H new ATOM 0 HD11 LEU A 43 -5.442 -41.299 -4.668 1.00 20.34 H new ATOM 0 HD12 LEU A 43 -3.720 -40.861 -4.564 1.00 20.34 H new ATOM 0 HD13 LEU A 43 -4.843 -39.844 -5.499 1.00 20.34 H new ATOM 0 HD21 LEU A 43 -6.381 -42.244 -6.723 1.00 60.11 H new ATOM 0 HD22 LEU A 43 -5.863 -40.838 -7.683 1.00 60.11 H new ATOM 0 HD23 LEU A 43 -5.367 -42.477 -8.167 1.00 60.11 H new ATOM 637 N ILE A 44 -4.680 -41.172 -10.362 1.00 53.43 N ATOM 638 CA ILE A 44 -5.520 -40.376 -11.242 1.00 3.43 C ATOM 639 C ILE A 44 -6.960 -40.382 -10.749 1.00 52.32 C ATOM 640 O ILE A 44 -7.595 -41.433 -10.662 1.00 63.21 O ATOM 641 CB ILE A 44 -5.443 -40.878 -12.709 1.00 54.14 C ATOM 642 CG1 ILE A 44 -4.096 -40.459 -13.326 1.00 72.45 C ATOM 643 CG2 ILE A 44 -6.621 -40.358 -13.539 1.00 35.25 C ATOM 644 CD1 ILE A 44 -3.943 -40.822 -14.786 1.00 52.24 C ATOM 0 H ILE A 44 -4.896 -42.169 -10.363 1.00 53.43 H new ATOM 0 HA ILE A 44 -5.147 -39.352 -11.224 1.00 3.43 H new ATOM 0 HB ILE A 44 -5.509 -41.966 -12.712 1.00 54.14 H new ATOM 0 HG12 ILE A 44 -3.979 -39.381 -13.217 1.00 72.45 H new ATOM 0 HG13 ILE A 44 -3.289 -40.926 -12.761 1.00 72.45 H new ATOM 0 HG21 ILE A 44 -6.537 -40.728 -14.561 1.00 35.25 H new ATOM 0 HG22 ILE A 44 -7.556 -40.708 -13.102 1.00 35.25 H new ATOM 0 HG23 ILE A 44 -6.609 -39.268 -13.545 1.00 35.25 H new ATOM 0 HD11 ILE A 44 -2.967 -40.492 -15.143 1.00 52.24 H new ATOM 0 HD12 ILE A 44 -4.025 -41.903 -14.903 1.00 52.24 H new ATOM 0 HD13 ILE A 44 -4.726 -40.334 -15.366 1.00 52.24 H new ATOM 656 N LEU A 45 -7.451 -39.199 -10.397 1.00 65.44 N ATOM 657 CA LEU A 45 -8.825 -39.026 -9.949 1.00 1.02 C ATOM 658 C LEU A 45 -9.628 -38.394 -11.074 1.00 41.11 C ATOM 659 O LEU A 45 -9.192 -37.411 -11.665 1.00 73.21 O ATOM 660 CB LEU A 45 -8.900 -38.121 -8.705 1.00 45.12 C ATOM 661 CG LEU A 45 -8.085 -38.563 -7.475 1.00 11.25 C ATOM 662 CD1 LEU A 45 -6.587 -38.418 -7.719 1.00 71.43 C ATOM 663 CD2 LEU A 45 -8.501 -37.762 -6.244 1.00 43.24 C ATOM 0 H LEU A 45 -6.908 -38.336 -10.415 1.00 65.44 H new ATOM 0 HA LEU A 45 -9.230 -40.003 -9.684 1.00 1.02 H new ATOM 0 HB2 LEU A 45 -8.569 -37.122 -8.991 1.00 45.12 H new ATOM 0 HB3 LEU A 45 -9.945 -38.038 -8.408 1.00 45.12 H new ATOM 0 HG LEU A 45 -8.295 -39.618 -7.298 1.00 11.25 H new ATOM 0 HD11 LEU A 45 -6.041 -38.738 -6.832 1.00 71.43 H new ATOM 0 HD12 LEU A 45 -6.295 -39.037 -8.568 1.00 71.43 H new ATOM 0 HD13 LEU A 45 -6.352 -37.375 -7.933 1.00 71.43 H new ATOM 0 HD21 LEU A 45 -7.916 -38.087 -5.384 1.00 43.24 H new ATOM 0 HD22 LEU A 45 -8.325 -36.701 -6.423 1.00 43.24 H new ATOM 0 HD23 LEU A 45 -9.560 -37.925 -6.045 1.00 43.24 H new ATOM 675 N VAL A 46 -10.782 -38.959 -11.385 1.00 52.30 N ATOM 676 CA VAL A 46 -11.643 -38.409 -12.423 1.00 52.42 C ATOM 677 C VAL A 46 -13.008 -38.060 -11.844 1.00 21.23 C ATOM 678 O VAL A 46 -13.782 -38.951 -11.488 1.00 14.33 O ATOM 679 CB VAL A 46 -11.816 -39.398 -13.606 1.00 13.25 C ATOM 680 CG1 VAL A 46 -12.718 -38.802 -14.685 1.00 25.32 C ATOM 681 CG2 VAL A 46 -10.455 -39.788 -14.189 1.00 72.45 C ATOM 0 H VAL A 46 -11.146 -39.799 -10.935 1.00 52.30 H new ATOM 0 HA VAL A 46 -11.165 -37.506 -12.803 1.00 52.42 H new ATOM 0 HB VAL A 46 -12.295 -40.301 -13.227 1.00 13.25 H new ATOM 0 HG11 VAL A 46 -12.824 -39.513 -15.504 1.00 25.32 H new ATOM 0 HG12 VAL A 46 -13.699 -38.587 -14.261 1.00 25.32 H new ATOM 0 HG13 VAL A 46 -12.275 -37.880 -15.061 1.00 25.32 H new ATOM 0 HG21 VAL A 46 -10.599 -40.482 -15.017 1.00 72.45 H new ATOM 0 HG22 VAL A 46 -9.944 -38.895 -14.549 1.00 72.45 H new ATOM 0 HG23 VAL A 46 -9.852 -40.265 -13.417 1.00 72.45 H new ATOM 691 N ASP A 47 -13.279 -36.764 -11.715 1.00 11.12 N ATOM 692 CA ASP A 47 -14.579 -36.290 -11.241 1.00 51.13 C ATOM 693 C ASP A 47 -15.583 -36.279 -12.392 1.00 54.22 C ATOM 694 O ASP A 47 -15.244 -35.894 -13.515 1.00 62.13 O ATOM 695 CB ASP A 47 -14.461 -34.878 -10.644 1.00 0.54 C ATOM 696 CG ASP A 47 -15.788 -34.347 -10.100 1.00 13.50 C ATOM 697 OD1 ASP A 47 -16.047 -33.132 -10.245 1.00 30.41 O ATOM 698 OD2 ASP A 47 -16.576 -35.140 -9.534 1.00 0.25 O1- ATOM 0 H ASP A 47 -12.615 -36.021 -11.932 1.00 11.12 H new ATOM 0 HA ASP A 47 -14.927 -36.969 -10.463 1.00 51.13 H new ATOM 0 HB2 ASP A 47 -13.724 -34.889 -9.841 1.00 0.54 H new ATOM 0 HB3 ASP A 47 -14.089 -34.196 -11.409 1.00 0.54 H new ATOM 703 N PHE A 48 -16.808 -36.712 -12.127 1.00 33.43 N ATOM 704 CA PHE A 48 -17.868 -36.648 -13.137 1.00 51.34 C ATOM 705 C PHE A 48 -18.438 -35.231 -13.250 1.00 61.52 C ATOM 706 O PHE A 48 -18.026 -34.316 -12.531 1.00 13.11 O ATOM 707 CB PHE A 48 -18.990 -37.661 -12.846 1.00 65.22 C ATOM 708 CG PHE A 48 -18.784 -38.995 -13.526 1.00 13.55 C ATOM 709 CD1 PHE A 48 -18.751 -40.176 -12.798 1.00 62.52 C ATOM 710 CD2 PHE A 48 -18.622 -39.063 -14.905 1.00 12.32 C ATOM 711 CE1 PHE A 48 -18.561 -41.391 -13.431 1.00 14.23 C ATOM 712 CE2 PHE A 48 -18.431 -40.276 -15.539 1.00 3.03 C ATOM 713 CZ PHE A 48 -18.403 -41.441 -14.801 1.00 0.02 C ATOM 0 H PHE A 48 -17.096 -37.108 -11.232 1.00 33.43 H new ATOM 0 HA PHE A 48 -17.419 -36.914 -14.094 1.00 51.34 H new ATOM 0 HB2 PHE A 48 -19.059 -37.817 -11.769 1.00 65.22 H new ATOM 0 HB3 PHE A 48 -19.942 -37.240 -13.169 1.00 65.22 H new ATOM 0 HD1 PHE A 48 -18.875 -40.146 -11.726 1.00 62.52 H new ATOM 0 HD2 PHE A 48 -18.646 -38.155 -15.489 1.00 12.32 H new ATOM 0 HE1 PHE A 48 -18.536 -42.302 -12.852 1.00 14.23 H new ATOM 0 HE2 PHE A 48 -18.304 -40.312 -16.611 1.00 3.03 H new ATOM 0 HZ PHE A 48 -18.258 -42.391 -15.294 1.00 0.02 H new ATOM 723 N TRP A 49 -19.374 -35.047 -14.172 1.00 62.40 N ATOM 724 CA TRP A 49 -19.963 -33.738 -14.418 1.00 3.51 C ATOM 725 C TRP A 49 -21.130 -33.484 -13.464 1.00 41.31 C ATOM 726 O TRP A 49 -22.030 -34.313 -13.329 1.00 63.54 O ATOM 727 CB TRP A 49 -20.421 -33.631 -15.878 1.00 40.21 C ATOM 728 CG TRP A 49 -20.876 -32.253 -16.269 1.00 42.53 C ATOM 729 CD1 TRP A 49 -20.263 -31.068 -15.967 1.00 65.23 C ATOM 730 CD2 TRP A 49 -22.029 -31.918 -17.051 1.00 72.13 C ATOM 731 NE1 TRP A 49 -20.971 -30.022 -16.502 1.00 33.30 N ATOM 732 CE2 TRP A 49 -22.060 -30.517 -17.173 1.00 34.35 C ATOM 733 CE3 TRP A 49 -23.043 -32.668 -17.654 1.00 22.14 C ATOM 734 CZ2 TRP A 49 -23.061 -29.850 -17.875 1.00 54.21 C ATOM 735 CZ3 TRP A 49 -24.036 -32.006 -18.353 1.00 74.34 C ATOM 736 CH2 TRP A 49 -24.039 -30.610 -18.458 1.00 43.42 C ATOM 0 H TRP A 49 -19.743 -35.791 -14.764 1.00 62.40 H new ATOM 0 HA TRP A 49 -19.206 -32.975 -14.235 1.00 3.51 H new ATOM 0 HB2 TRP A 49 -19.601 -33.932 -16.530 1.00 40.21 H new ATOM 0 HB3 TRP A 49 -21.236 -34.335 -16.046 1.00 40.21 H new ATOM 0 HD1 TRP A 49 -19.354 -30.970 -15.391 1.00 65.23 H new ATOM 0 HE1 TRP A 49 -20.727 -29.035 -16.415 1.00 33.30 H new ATOM 0 HE3 TRP A 49 -23.051 -33.745 -17.575 1.00 22.14 H new ATOM 0 HZ2 TRP A 49 -23.065 -28.773 -17.956 1.00 54.21 H new ATOM 0 HZ3 TRP A 49 -24.822 -32.576 -18.826 1.00 74.34 H new ATOM 0 HH2 TRP A 49 -24.829 -30.123 -19.010 1.00 43.42 H new ATOM 747 N ALA A 50 -21.097 -32.334 -12.803 1.00 41.34 N ATOM 748 CA ALA A 50 -22.141 -31.942 -11.868 1.00 51.22 C ATOM 749 C ALA A 50 -22.355 -30.433 -11.931 1.00 20.23 C ATOM 750 O ALA A 50 -21.733 -29.682 -11.184 1.00 33.32 O ATOM 751 CB ALA A 50 -21.776 -32.378 -10.454 1.00 54.33 C ATOM 0 H ALA A 50 -20.347 -31.649 -12.900 1.00 41.34 H new ATOM 0 HA ALA A 50 -23.072 -32.436 -12.146 1.00 51.22 H new ATOM 0 HB1 ALA A 50 -22.566 -32.078 -9.765 1.00 54.33 H new ATOM 0 HB2 ALA A 50 -21.662 -33.462 -10.425 1.00 54.33 H new ATOM 0 HB3 ALA A 50 -20.839 -31.907 -10.158 1.00 54.33 H new ATOM 757 N PRO A 51 -23.211 -29.968 -12.857 1.00 55.40 N ATOM 758 CA PRO A 51 -23.474 -28.536 -13.032 1.00 12.22 C ATOM 759 C PRO A 51 -24.311 -27.964 -11.888 1.00 34.03 C ATOM 760 O PRO A 51 -24.284 -26.758 -11.619 1.00 2.20 O ATOM 761 CB PRO A 51 -24.239 -28.480 -14.363 1.00 62.34 C ATOM 762 CG PRO A 51 -24.910 -29.811 -14.468 1.00 64.33 C ATOM 763 CD PRO A 51 -23.980 -30.798 -13.811 1.00 24.12 C ATOM 0 HA PRO A 51 -22.561 -27.940 -13.033 1.00 12.22 H new ATOM 0 HB2 PRO A 51 -24.966 -27.668 -14.369 1.00 62.34 H new ATOM 0 HB3 PRO A 51 -23.564 -28.309 -15.201 1.00 62.34 H new ATOM 0 HG2 PRO A 51 -25.880 -29.799 -13.971 1.00 64.33 H new ATOM 0 HG3 PRO A 51 -25.088 -30.077 -15.510 1.00 64.33 H new ATOM 0 HD2 PRO A 51 -24.530 -31.589 -13.302 1.00 24.12 H new ATOM 0 HD3 PRO A 51 -23.328 -31.281 -14.539 1.00 24.12 H new ATOM 771 N TRP A 52 -25.039 -28.842 -11.210 1.00 52.31 N ATOM 772 CA TRP A 52 -25.909 -28.453 -10.106 1.00 61.04 C ATOM 773 C TRP A 52 -25.449 -29.114 -8.810 1.00 61.45 C ATOM 774 O TRP A 52 -25.539 -30.334 -8.661 1.00 73.15 O ATOM 775 CB TRP A 52 -27.361 -28.842 -10.422 1.00 34.34 C ATOM 776 CG TRP A 52 -28.317 -28.575 -9.296 1.00 2.33 C ATOM 777 CD1 TRP A 52 -28.768 -27.358 -8.876 1.00 55.55 C ATOM 778 CD2 TRP A 52 -28.940 -29.549 -8.450 1.00 2.31 C ATOM 779 NE1 TRP A 52 -29.629 -27.515 -7.818 1.00 21.24 N ATOM 780 CE2 TRP A 52 -29.751 -28.852 -7.539 1.00 34.23 C ATOM 781 CE3 TRP A 52 -28.890 -30.945 -8.377 1.00 4.45 C ATOM 782 CZ2 TRP A 52 -30.504 -29.500 -6.562 1.00 10.31 C ATOM 783 CZ3 TRP A 52 -29.639 -31.588 -7.409 1.00 4.30 C ATOM 784 CH2 TRP A 52 -30.436 -30.865 -6.514 1.00 60.21 C ATOM 0 H TRP A 52 -25.044 -29.842 -11.409 1.00 52.31 H new ATOM 0 HA TRP A 52 -25.855 -27.372 -9.977 1.00 61.04 H new ATOM 0 HB2 TRP A 52 -27.691 -28.293 -11.304 1.00 34.34 H new ATOM 0 HB3 TRP A 52 -27.397 -29.902 -10.674 1.00 34.34 H new ATOM 0 HD1 TRP A 52 -28.489 -26.410 -9.312 1.00 55.55 H new ATOM 0 HE1 TRP A 52 -30.101 -26.760 -7.321 1.00 21.24 H new ATOM 0 HE3 TRP A 52 -28.278 -31.510 -9.064 1.00 4.45 H new ATOM 0 HZ2 TRP A 52 -31.118 -28.945 -5.869 1.00 10.31 H new ATOM 0 HZ3 TRP A 52 -29.609 -32.666 -7.342 1.00 4.30 H new ATOM 0 HH2 TRP A 52 -31.010 -31.397 -5.769 1.00 60.21 H new ATOM 795 N CYS A 53 -24.936 -28.302 -7.888 1.00 50.22 N ATOM 796 CA CYS A 53 -24.500 -28.786 -6.583 1.00 20.35 C ATOM 797 C CYS A 53 -24.055 -27.621 -5.706 1.00 44.23 C ATOM 798 O CYS A 53 -23.347 -26.721 -6.168 1.00 40.01 O ATOM 799 CB CYS A 53 -23.355 -29.796 -6.727 1.00 43.12 C ATOM 800 SG CYS A 53 -22.773 -30.484 -5.142 1.00 63.30 S ATOM 0 H CYS A 53 -24.812 -27.299 -8.024 1.00 50.22 H new ATOM 0 HA CYS A 53 -25.345 -29.286 -6.110 1.00 20.35 H new ATOM 0 HB2 CYS A 53 -23.684 -30.614 -7.368 1.00 43.12 H new ATOM 0 HB3 CYS A 53 -22.518 -29.312 -7.231 1.00 43.12 H new ATOM 805 N GLY A 54 -24.476 -27.635 -4.444 1.00 43.40 N ATOM 806 CA GLY A 54 -24.122 -26.575 -3.518 1.00 13.40 C ATOM 807 C GLY A 54 -22.695 -26.703 -3.008 1.00 4.44 C ATOM 808 O GLY A 54 -21.807 -25.978 -3.461 1.00 31.03 O ATOM 0 H GLY A 54 -25.061 -28.369 -4.044 1.00 43.40 H new ATOM 0 HA2 GLY A 54 -24.244 -25.610 -4.011 1.00 13.40 H new ATOM 0 HA3 GLY A 54 -24.810 -26.590 -2.673 1.00 13.40 H new ATOM 812 N PRO A 55 -22.438 -27.657 -2.088 1.00 11.55 N ATOM 813 CA PRO A 55 -21.130 -27.803 -1.425 1.00 25.30 C ATOM 814 C PRO A 55 -19.988 -28.074 -2.406 1.00 32.04 C ATOM 815 O PRO A 55 -18.825 -27.797 -2.108 1.00 53.41 O ATOM 816 CB PRO A 55 -21.331 -29.002 -0.479 1.00 54.22 C ATOM 817 CG PRO A 55 -22.512 -29.733 -1.029 1.00 31.01 C ATOM 818 CD PRO A 55 -23.402 -28.676 -1.621 1.00 51.53 C ATOM 0 HA PRO A 55 -20.839 -26.885 -0.914 1.00 25.30 H new ATOM 0 HB2 PRO A 55 -20.447 -29.640 -0.456 1.00 54.22 H new ATOM 0 HB3 PRO A 55 -21.512 -28.672 0.544 1.00 54.22 H new ATOM 0 HG2 PRO A 55 -22.208 -30.457 -1.785 1.00 31.01 H new ATOM 0 HG3 PRO A 55 -23.029 -30.287 -0.246 1.00 31.01 H new ATOM 0 HD2 PRO A 55 -24.005 -29.068 -2.440 1.00 51.53 H new ATOM 0 HD3 PRO A 55 -24.093 -28.270 -0.883 1.00 51.53 H new ATOM 826 N CYS A 56 -20.324 -28.602 -3.580 1.00 70.12 N ATOM 827 CA CYS A 56 -19.321 -28.933 -4.592 1.00 20.13 C ATOM 828 C CYS A 56 -18.464 -27.718 -4.948 1.00 71.35 C ATOM 829 O CYS A 56 -17.281 -27.866 -5.259 1.00 52.03 O ATOM 830 CB CYS A 56 -19.988 -29.504 -5.848 1.00 24.21 C ATOM 831 SG CYS A 56 -20.876 -31.069 -5.550 1.00 62.21 S ATOM 0 H CYS A 56 -21.284 -28.811 -3.856 1.00 70.12 H new ATOM 0 HA CYS A 56 -18.664 -29.693 -4.169 1.00 20.13 H new ATOM 0 HB2 CYS A 56 -20.687 -28.768 -6.245 1.00 24.21 H new ATOM 0 HB3 CYS A 56 -19.228 -29.666 -6.612 1.00 24.21 H new ATOM 836 N ARG A 57 -19.049 -26.520 -4.860 1.00 42.14 N ATOM 837 CA ARG A 57 -18.324 -25.290 -5.188 1.00 30.24 C ATOM 838 C ARG A 57 -17.093 -25.131 -4.294 1.00 54.23 C ATOM 839 O ARG A 57 -16.085 -24.566 -4.706 1.00 53.21 O ATOM 840 CB ARG A 57 -19.233 -24.061 -5.052 1.00 42.45 C ATOM 841 CG ARG A 57 -18.535 -22.756 -5.429 1.00 14.45 C ATOM 842 CD ARG A 57 -19.445 -21.545 -5.296 1.00 71.53 C ATOM 843 NE ARG A 57 -18.749 -20.316 -5.696 1.00 20.02 N ATOM 844 CZ ARG A 57 -19.346 -19.143 -5.906 1.00 74.44 C ATOM 845 NH1 ARG A 57 -20.650 -19.008 -5.700 1.00 35.42 N1+ ATOM 846 NH2 ARG A 57 -18.632 -18.098 -6.317 1.00 33.01 N ATOM 0 H ARG A 57 -20.015 -26.376 -4.567 1.00 42.14 H new ATOM 0 HA ARG A 57 -17.997 -25.365 -6.225 1.00 30.24 H new ATOM 0 HB2 ARG A 57 -20.110 -24.193 -5.685 1.00 42.45 H new ATOM 0 HB3 ARG A 57 -19.589 -23.992 -4.024 1.00 42.45 H new ATOM 0 HG2 ARG A 57 -17.660 -22.620 -4.793 1.00 14.45 H new ATOM 0 HG3 ARG A 57 -18.175 -22.824 -6.456 1.00 14.45 H new ATOM 0 HD2 ARG A 57 -20.332 -21.683 -5.915 1.00 71.53 H new ATOM 0 HD3 ARG A 57 -19.787 -21.454 -4.265 1.00 71.53 H new ATOM 0 HE ARG A 57 -17.738 -20.363 -5.822 1.00 20.02 H new ATOM 0 HH11 ARG A 57 -21.201 -19.804 -5.379 1.00 35.42 H new ATOM 0 HH12 ARG A 57 -21.101 -18.108 -5.862 1.00 35.42 H new ATOM 0 HH21 ARG A 57 -17.628 -18.195 -6.471 1.00 33.01 H new ATOM 0 HH22 ARG A 57 -19.088 -17.200 -6.478 1.00 33.01 H new ATOM 860 N SER A 58 -17.192 -25.611 -3.060 1.00 22.42 N ATOM 861 CA SER A 58 -16.057 -25.620 -2.143 1.00 70.35 C ATOM 862 C SER A 58 -15.068 -26.720 -2.539 1.00 50.02 C ATOM 863 O SER A 58 -13.841 -26.550 -2.475 1.00 63.20 O ATOM 864 CB SER A 58 -16.556 -25.844 -0.711 1.00 12.11 C ATOM 865 OG SER A 58 -17.576 -24.919 -0.379 1.00 40.31 O ATOM 0 H SER A 58 -18.050 -26.001 -2.670 1.00 22.42 H new ATOM 0 HA SER A 58 -15.545 -24.659 -2.196 1.00 70.35 H new ATOM 0 HB2 SER A 58 -16.935 -26.861 -0.609 1.00 12.11 H new ATOM 0 HB3 SER A 58 -15.726 -25.742 -0.012 1.00 12.11 H new ATOM 0 HG SER A 58 -17.636 -24.834 0.595 1.00 40.31 H new ATOM 871 N LEU A 59 -15.617 -27.851 -2.969 1.00 35.33 N ATOM 872 CA LEU A 59 -14.817 -29.030 -3.282 1.00 33.30 C ATOM 873 C LEU A 59 -13.930 -28.810 -4.502 1.00 51.22 C ATOM 874 O LEU A 59 -12.824 -29.328 -4.542 1.00 44.13 O ATOM 875 CB LEU A 59 -15.709 -30.267 -3.485 1.00 34.51 C ATOM 876 CG LEU A 59 -16.144 -30.993 -2.195 1.00 64.10 C ATOM 877 CD1 LEU A 59 -14.935 -31.572 -1.467 1.00 21.22 C ATOM 878 CD2 LEU A 59 -16.931 -30.061 -1.274 1.00 63.33 C ATOM 0 H LEU A 59 -16.619 -27.976 -3.109 1.00 35.33 H new ATOM 0 HA LEU A 59 -14.166 -29.207 -2.426 1.00 33.30 H new ATOM 0 HB2 LEU A 59 -16.603 -29.963 -4.029 1.00 34.51 H new ATOM 0 HB3 LEU A 59 -15.177 -30.977 -4.118 1.00 34.51 H new ATOM 0 HG LEU A 59 -16.800 -31.815 -2.481 1.00 64.10 H new ATOM 0 HD11 LEU A 59 -15.265 -32.079 -0.560 1.00 21.22 H new ATOM 0 HD12 LEU A 59 -14.426 -32.284 -2.117 1.00 21.22 H new ATOM 0 HD13 LEU A 59 -14.249 -30.767 -1.203 1.00 21.22 H new ATOM 0 HD21 LEU A 59 -17.224 -30.601 -0.374 1.00 63.33 H new ATOM 0 HD22 LEU A 59 -16.308 -29.209 -1.000 1.00 63.33 H new ATOM 0 HD23 LEU A 59 -17.823 -29.707 -1.791 1.00 63.33 H new ATOM 890 N GLU A 60 -14.405 -28.047 -5.485 1.00 25.40 N ATOM 891 CA GLU A 60 -13.612 -27.789 -6.691 1.00 51.24 C ATOM 892 C GLU A 60 -12.232 -27.202 -6.325 1.00 31.13 C ATOM 893 O GLU A 60 -11.204 -27.802 -6.650 1.00 60.23 O ATOM 894 CB GLU A 60 -14.371 -26.877 -7.675 1.00 44.05 C ATOM 895 CG GLU A 60 -15.676 -27.472 -8.196 1.00 51.15 C ATOM 896 CD GLU A 60 -16.391 -26.551 -9.176 1.00 40.34 C ATOM 897 OE1 GLU A 60 -16.119 -26.651 -10.397 1.00 65.12 O ATOM 898 OE2 GLU A 60 -17.219 -25.726 -8.731 1.00 25.24 O1- ATOM 0 H GLU A 60 -15.322 -27.601 -5.474 1.00 25.40 H new ATOM 0 HA GLU A 60 -13.445 -28.741 -7.195 1.00 51.24 H new ATOM 0 HB2 GLU A 60 -14.588 -25.929 -7.182 1.00 44.05 H new ATOM 0 HB3 GLU A 60 -13.722 -26.655 -8.522 1.00 44.05 H new ATOM 0 HG2 GLU A 60 -15.467 -28.424 -8.684 1.00 51.15 H new ATOM 0 HG3 GLU A 60 -16.336 -27.683 -7.355 1.00 51.15 H new ATOM 905 N PRO A 61 -12.174 -26.044 -5.618 1.00 40.44 N ATOM 906 CA PRO A 61 -10.900 -25.464 -5.173 1.00 20.54 C ATOM 907 C PRO A 61 -10.198 -26.335 -4.125 1.00 64.23 C ATOM 908 O PRO A 61 -8.966 -26.359 -4.061 1.00 41.33 O ATOM 909 CB PRO A 61 -11.296 -24.102 -4.585 1.00 61.44 C ATOM 910 CG PRO A 61 -12.729 -24.256 -4.213 1.00 3.54 C ATOM 911 CD PRO A 61 -13.317 -25.199 -5.224 1.00 61.33 C ATOM 0 HA PRO A 61 -10.185 -25.383 -5.991 1.00 20.54 H new ATOM 0 HB2 PRO A 61 -10.686 -23.852 -3.717 1.00 61.44 H new ATOM 0 HB3 PRO A 61 -11.159 -23.301 -5.312 1.00 61.44 H new ATOM 0 HG2 PRO A 61 -12.830 -24.653 -3.203 1.00 3.54 H new ATOM 0 HG3 PRO A 61 -13.243 -23.295 -4.230 1.00 3.54 H new ATOM 0 HD2 PRO A 61 -14.125 -25.792 -4.796 1.00 61.33 H new ATOM 0 HD3 PRO A 61 -13.732 -24.663 -6.078 1.00 61.33 H new ATOM 919 N GLN A 62 -10.971 -27.057 -3.302 1.00 1.31 N ATOM 920 CA GLN A 62 -10.364 -27.976 -2.333 1.00 64.23 C ATOM 921 C GLN A 62 -9.590 -29.078 -3.063 1.00 72.30 C ATOM 922 O GLN A 62 -8.479 -29.449 -2.664 1.00 45.13 O ATOM 923 CB GLN A 62 -11.416 -28.592 -1.398 1.00 52.44 C ATOM 924 CG GLN A 62 -12.014 -27.601 -0.406 1.00 75.21 C ATOM 925 CD GLN A 62 -12.921 -28.264 0.618 1.00 5.22 C ATOM 926 OE1 GLN A 62 -12.474 -28.674 1.684 1.00 5.12 O ATOM 927 NE2 GLN A 62 -14.199 -28.382 0.293 1.00 34.41 N ATOM 0 H GLN A 62 -11.990 -27.025 -3.287 1.00 1.31 H new ATOM 0 HA GLN A 62 -9.673 -27.401 -1.717 1.00 64.23 H new ATOM 0 HB2 GLN A 62 -12.219 -29.018 -2.000 1.00 52.44 H new ATOM 0 HB3 GLN A 62 -10.961 -29.414 -0.846 1.00 52.44 H new ATOM 0 HG2 GLN A 62 -11.208 -27.082 0.112 1.00 75.21 H new ATOM 0 HG3 GLN A 62 -12.581 -26.846 -0.951 1.00 75.21 H new ATOM 0 HE21 GLN A 62 -14.532 -28.028 -0.604 1.00 34.41 H new ATOM 0 HE22 GLN A 62 -14.851 -28.827 0.939 1.00 34.41 H new ATOM 936 N LEU A 63 -10.172 -29.572 -4.152 1.00 4.32 N ATOM 937 CA LEU A 63 -9.542 -30.607 -4.962 1.00 24.11 C ATOM 938 C LEU A 63 -8.320 -30.041 -5.671 1.00 34.30 C ATOM 939 O LEU A 63 -7.333 -30.745 -5.871 1.00 14.04 O ATOM 940 CB LEU A 63 -10.534 -31.186 -5.986 1.00 72.32 C ATOM 941 CG LEU A 63 -11.692 -32.005 -5.393 1.00 45.24 C ATOM 942 CD1 LEU A 63 -12.634 -32.494 -6.493 1.00 73.33 C ATOM 943 CD2 LEU A 63 -11.161 -33.179 -4.574 1.00 74.14 C ATOM 0 H LEU A 63 -11.084 -29.269 -4.494 1.00 4.32 H new ATOM 0 HA LEU A 63 -9.228 -31.416 -4.302 1.00 24.11 H new ATOM 0 HB2 LEU A 63 -10.953 -30.363 -6.566 1.00 72.32 H new ATOM 0 HB3 LEU A 63 -9.983 -31.819 -6.682 1.00 72.32 H new ATOM 0 HG LEU A 63 -12.259 -31.354 -4.727 1.00 45.24 H new ATOM 0 HD11 LEU A 63 -13.445 -33.071 -6.048 1.00 73.33 H new ATOM 0 HD12 LEU A 63 -13.048 -31.637 -7.025 1.00 73.33 H new ATOM 0 HD13 LEU A 63 -12.082 -33.123 -7.191 1.00 73.33 H new ATOM 0 HD21 LEU A 63 -11.998 -33.745 -4.164 1.00 74.14 H new ATOM 0 HD22 LEU A 63 -10.563 -33.828 -5.214 1.00 74.14 H new ATOM 0 HD23 LEU A 63 -10.543 -32.804 -3.759 1.00 74.14 H new ATOM 955 N GLU A 64 -8.392 -28.763 -6.044 1.00 4.53 N ATOM 956 CA GLU A 64 -7.256 -28.081 -6.656 1.00 14.32 C ATOM 957 C GLU A 64 -6.084 -28.030 -5.683 1.00 63.35 C ATOM 958 O GLU A 64 -4.947 -28.302 -6.059 1.00 10.34 O ATOM 959 CB GLU A 64 -7.629 -26.661 -7.101 1.00 61.33 C ATOM 960 CG GLU A 64 -8.688 -26.615 -8.196 1.00 42.54 C ATOM 961 CD GLU A 64 -8.884 -25.217 -8.760 1.00 13.44 C ATOM 962 OE1 GLU A 64 -8.036 -24.784 -9.570 1.00 52.13 O ATOM 963 OE2 GLU A 64 -9.885 -24.556 -8.417 1.00 65.51 O1- ATOM 0 H GLU A 64 -9.223 -28.182 -5.933 1.00 4.53 H new ATOM 0 HA GLU A 64 -6.965 -28.648 -7.541 1.00 14.32 H new ATOM 0 HB2 GLU A 64 -7.990 -26.103 -6.237 1.00 61.33 H new ATOM 0 HB3 GLU A 64 -6.731 -26.154 -7.456 1.00 61.33 H new ATOM 0 HG2 GLU A 64 -8.402 -27.291 -9.002 1.00 42.54 H new ATOM 0 HG3 GLU A 64 -9.635 -26.978 -7.796 1.00 42.54 H new ATOM 970 N LYS A 65 -6.378 -27.691 -4.426 1.00 0.43 N ATOM 971 CA LYS A 65 -5.359 -27.652 -3.379 1.00 4.21 C ATOM 972 C LYS A 65 -4.632 -28.990 -3.292 1.00 63.22 C ATOM 973 O LYS A 65 -3.400 -29.049 -3.355 1.00 64.34 O ATOM 974 CB LYS A 65 -5.990 -27.305 -2.021 1.00 2.10 C ATOM 975 CG LYS A 65 -5.054 -27.518 -0.829 1.00 73.25 C ATOM 976 CD LYS A 65 -5.716 -27.133 0.492 1.00 53.43 C ATOM 977 CE LYS A 65 -4.869 -27.546 1.695 1.00 74.54 C ATOM 978 NZ LYS A 65 -3.555 -26.846 1.738 1.00 62.51 N1+ ATOM 0 H LYS A 65 -7.315 -27.440 -4.110 1.00 0.43 H new ATOM 0 HA LYS A 65 -4.637 -26.876 -3.635 1.00 4.21 H new ATOM 0 HB2 LYS A 65 -6.311 -26.264 -2.036 1.00 2.10 H new ATOM 0 HB3 LYS A 65 -6.884 -27.912 -1.881 1.00 2.10 H new ATOM 0 HG2 LYS A 65 -4.748 -28.563 -0.790 1.00 73.25 H new ATOM 0 HG3 LYS A 65 -4.149 -26.926 -0.968 1.00 73.25 H new ATOM 0 HD2 LYS A 65 -5.880 -26.056 0.516 1.00 53.43 H new ATOM 0 HD3 LYS A 65 -6.696 -27.606 0.558 1.00 53.43 H new ATOM 0 HE2 LYS A 65 -5.419 -27.334 2.612 1.00 74.54 H new ATOM 0 HE3 LYS A 65 -4.702 -28.623 1.665 1.00 74.54 H new ATOM 0 HZ1 LYS A 65 -3.021 -27.162 2.572 1.00 62.51 H new ATOM 0 HZ2 LYS A 65 -3.015 -27.067 0.877 1.00 62.51 H new ATOM 0 HZ3 LYS A 65 -3.710 -25.819 1.795 1.00 62.51 H new ATOM 992 N LEU A 66 -5.403 -30.067 -3.168 1.00 12.42 N ATOM 993 CA LEU A 66 -4.828 -31.405 -3.066 1.00 2.43 C ATOM 994 C LEU A 66 -4.115 -31.773 -4.365 1.00 60.12 C ATOM 995 O LEU A 66 -3.055 -32.398 -4.348 1.00 51.14 O ATOM 996 CB LEU A 66 -5.918 -32.439 -2.737 1.00 45.35 C ATOM 997 CG LEU A 66 -6.810 -32.076 -1.535 1.00 74.51 C ATOM 998 CD1 LEU A 66 -7.883 -33.137 -1.312 1.00 61.45 C ATOM 999 CD2 LEU A 66 -5.968 -31.876 -0.273 1.00 41.11 C ATOM 0 H LEU A 66 -6.422 -30.040 -3.136 1.00 12.42 H new ATOM 0 HA LEU A 66 -4.099 -31.409 -2.256 1.00 2.43 H new ATOM 0 HB2 LEU A 66 -6.551 -32.571 -3.615 1.00 45.35 H new ATOM 0 HB3 LEU A 66 -5.441 -33.399 -2.541 1.00 45.35 H new ATOM 0 HG LEU A 66 -7.311 -31.134 -1.759 1.00 74.51 H new ATOM 0 HD11 LEU A 66 -8.499 -32.857 -0.458 1.00 61.45 H new ATOM 0 HD12 LEU A 66 -8.509 -33.214 -2.201 1.00 61.45 H new ATOM 0 HD13 LEU A 66 -7.409 -34.099 -1.118 1.00 61.45 H new ATOM 0 HD21 LEU A 66 -6.620 -31.620 0.562 1.00 41.11 H new ATOM 0 HD22 LEU A 66 -5.430 -32.796 -0.045 1.00 41.11 H new ATOM 0 HD23 LEU A 66 -5.254 -31.069 -0.436 1.00 41.11 H new ATOM 1011 N ALA A 67 -4.694 -31.350 -5.484 1.00 43.32 N ATOM 1012 CA ALA A 67 -4.128 -31.617 -6.802 1.00 1.23 C ATOM 1013 C ALA A 67 -2.770 -30.942 -6.957 1.00 3.40 C ATOM 1014 O ALA A 67 -1.874 -31.490 -7.582 1.00 21.23 O ATOM 1015 CB ALA A 67 -5.080 -31.151 -7.901 1.00 34.31 C ATOM 0 H ALA A 67 -5.563 -30.816 -5.504 1.00 43.32 H new ATOM 0 HA ALA A 67 -3.989 -32.694 -6.897 1.00 1.23 H new ATOM 0 HB1 ALA A 67 -4.640 -31.359 -8.876 1.00 34.31 H new ATOM 0 HB2 ALA A 67 -6.028 -31.681 -7.810 1.00 34.31 H new ATOM 0 HB3 ALA A 67 -5.253 -30.079 -7.802 1.00 34.31 H new ATOM 1021 N GLN A 68 -2.629 -29.751 -6.383 1.00 30.24 N ATOM 1022 CA GLN A 68 -1.377 -28.999 -6.456 1.00 34.53 C ATOM 1023 C GLN A 68 -0.330 -29.613 -5.535 1.00 14.40 C ATOM 1024 O GLN A 68 0.793 -29.896 -5.951 1.00 34.01 O ATOM 1025 CB GLN A 68 -1.609 -27.527 -6.073 1.00 73.12 C ATOM 1026 CG GLN A 68 -2.437 -26.738 -7.087 1.00 63.23 C ATOM 1027 CD GLN A 68 -1.720 -26.522 -8.413 1.00 72.52 C ATOM 1028 OE1 GLN A 68 -0.905 -27.340 -8.841 1.00 74.13 O ATOM 1029 NE2 GLN A 68 -2.023 -25.419 -9.078 1.00 35.24 N ATOM 0 H GLN A 68 -3.369 -29.283 -5.860 1.00 30.24 H new ATOM 0 HA GLN A 68 -1.014 -29.044 -7.483 1.00 34.53 H new ATOM 0 HB2 GLN A 68 -2.109 -27.490 -5.105 1.00 73.12 H new ATOM 0 HB3 GLN A 68 -0.642 -27.038 -5.951 1.00 73.12 H new ATOM 0 HG2 GLN A 68 -3.373 -27.265 -7.270 1.00 63.23 H new ATOM 0 HG3 GLN A 68 -2.695 -25.769 -6.659 1.00 63.23 H new ATOM 0 HE21 GLN A 68 -2.703 -24.763 -8.694 1.00 35.24 H new ATOM 0 HE22 GLN A 68 -1.577 -25.225 -9.974 1.00 35.24 H new ATOM 1038 N GLN A 69 -0.719 -29.838 -4.285 1.00 23.22 N ATOM 1039 CA GLN A 69 0.196 -30.357 -3.272 1.00 22.40 C ATOM 1040 C GLN A 69 0.680 -31.761 -3.641 1.00 3.21 C ATOM 1041 O GLN A 69 1.826 -32.130 -3.375 1.00 75.41 O ATOM 1042 CB GLN A 69 -0.500 -30.382 -1.902 1.00 11.52 C ATOM 1043 CG GLN A 69 0.416 -30.777 -0.746 1.00 32.44 C ATOM 1044 CD GLN A 69 -0.310 -30.806 0.590 1.00 50.30 C ATOM 1045 OE1 GLN A 69 -0.386 -29.800 1.291 1.00 65.51 O ATOM 1046 NE2 GLN A 69 -0.841 -31.961 0.957 1.00 31.30 N ATOM 0 H GLN A 69 -1.666 -29.669 -3.947 1.00 23.22 H new ATOM 0 HA GLN A 69 1.064 -29.699 -3.223 1.00 22.40 H new ATOM 0 HB2 GLN A 69 -0.917 -29.396 -1.700 1.00 11.52 H new ATOM 0 HB3 GLN A 69 -1.336 -31.080 -1.944 1.00 11.52 H new ATOM 0 HG2 GLN A 69 0.843 -31.760 -0.945 1.00 32.44 H new ATOM 0 HG3 GLN A 69 1.247 -30.074 -0.689 1.00 32.44 H new ATOM 0 HE21 GLN A 69 -0.759 -32.776 0.349 1.00 31.30 H new ATOM 0 HE22 GLN A 69 -1.333 -32.036 1.847 1.00 31.30 H new ATOM 1055 N TYR A 70 -0.202 -32.534 -4.265 1.00 14.41 N ATOM 1056 CA TYR A 70 0.081 -33.927 -4.598 1.00 60.14 C ATOM 1057 C TYR A 70 0.372 -34.118 -6.090 1.00 40.42 C ATOM 1058 O TYR A 70 0.560 -35.246 -6.535 1.00 75.22 O ATOM 1059 CB TYR A 70 -1.085 -34.828 -4.161 1.00 23.30 C ATOM 1060 CG TYR A 70 -1.299 -34.867 -2.656 1.00 14.04 C ATOM 1061 CD1 TYR A 70 -2.536 -34.566 -2.092 1.00 64.52 C ATOM 1062 CD2 TYR A 70 -0.257 -35.201 -1.800 1.00 13.23 C ATOM 1063 CE1 TYR A 70 -2.725 -34.600 -0.725 1.00 62.24 C ATOM 1064 CE2 TYR A 70 -0.440 -35.239 -0.431 1.00 4.24 C ATOM 1065 CZ TYR A 70 -1.675 -34.938 0.100 1.00 51.45 C ATOM 1066 OH TYR A 70 -1.858 -34.969 1.463 1.00 12.52 O ATOM 0 H TYR A 70 -1.128 -32.216 -4.553 1.00 14.41 H new ATOM 0 HA TYR A 70 0.981 -34.214 -4.054 1.00 60.14 H new ATOM 0 HB2 TYR A 70 -2.000 -34.480 -4.640 1.00 23.30 H new ATOM 0 HB3 TYR A 70 -0.903 -35.841 -4.519 1.00 23.30 H new ATOM 0 HD1 TYR A 70 -3.362 -34.301 -2.735 1.00 64.52 H new ATOM 0 HD2 TYR A 70 0.713 -35.435 -2.212 1.00 13.23 H new ATOM 0 HE1 TYR A 70 -3.691 -34.363 -0.305 1.00 62.24 H new ATOM 0 HE2 TYR A 70 0.381 -35.503 0.219 1.00 4.24 H new ATOM 0 HH TYR A 70 -1.019 -35.227 1.900 1.00 12.52 H new ATOM 1076 N THR A 71 0.435 -33.018 -6.851 1.00 61.35 N ATOM 1077 CA THR A 71 0.543 -33.077 -8.323 1.00 51.44 C ATOM 1078 C THR A 71 1.713 -33.954 -8.788 1.00 2.11 C ATOM 1079 O THR A 71 1.734 -34.411 -9.935 1.00 63.31 O ATOM 1080 CB THR A 71 0.716 -31.660 -8.937 1.00 32.42 C ATOM 1081 OG1 THR A 71 0.643 -31.725 -10.372 1.00 20.15 O ATOM 1082 CG2 THR A 71 2.046 -31.033 -8.526 1.00 4.22 C ATOM 0 H THR A 71 0.413 -32.070 -6.474 1.00 61.35 H new ATOM 0 HA THR A 71 -0.390 -33.520 -8.671 1.00 51.44 H new ATOM 0 HB THR A 71 -0.093 -31.037 -8.557 1.00 32.42 H new ATOM 0 HG1 THR A 71 0.752 -30.826 -10.746 1.00 20.15 H new ATOM 0 HG21 THR A 71 2.135 -30.043 -8.973 1.00 4.22 H new ATOM 0 HG22 THR A 71 2.087 -30.946 -7.440 1.00 4.22 H new ATOM 0 HG23 THR A 71 2.867 -31.662 -8.871 1.00 4.22 H new ATOM 1090 N GLU A 72 2.675 -34.186 -7.902 1.00 51.24 N ATOM 1091 CA GLU A 72 3.822 -35.033 -8.210 1.00 74.02 C ATOM 1092 C GLU A 72 3.381 -36.478 -8.442 1.00 60.10 C ATOM 1093 O GLU A 72 3.887 -37.160 -9.332 1.00 53.34 O ATOM 1094 CB GLU A 72 4.839 -34.970 -7.064 1.00 21.44 C ATOM 1095 CG GLU A 72 5.346 -33.562 -6.773 1.00 35.12 C ATOM 1096 CD GLU A 72 6.313 -33.519 -5.600 1.00 32.11 C ATOM 1097 OE1 GLU A 72 7.514 -33.803 -5.798 1.00 53.51 O ATOM 1098 OE2 GLU A 72 5.875 -33.200 -4.474 1.00 0.13 O1- ATOM 0 H GLU A 72 2.683 -33.797 -6.959 1.00 51.24 H new ATOM 0 HA GLU A 72 4.289 -34.666 -9.124 1.00 74.02 H new ATOM 0 HB2 GLU A 72 4.382 -35.376 -6.162 1.00 21.44 H new ATOM 0 HB3 GLU A 72 5.688 -35.609 -7.307 1.00 21.44 H new ATOM 0 HG2 GLU A 72 5.840 -33.167 -7.661 1.00 35.12 H new ATOM 0 HG3 GLU A 72 4.498 -32.910 -6.564 1.00 35.12 H new ATOM 1105 N ASN A 73 2.422 -36.933 -7.638 1.00 54.34 N ATOM 1106 CA ASN A 73 1.946 -38.317 -7.699 1.00 53.33 C ATOM 1107 C ASN A 73 0.482 -38.370 -8.135 1.00 50.23 C ATOM 1108 O ASN A 73 -0.043 -39.443 -8.419 1.00 40.15 O ATOM 1109 CB ASN A 73 2.080 -38.999 -6.325 1.00 52.25 C ATOM 1110 CG ASN A 73 3.445 -38.797 -5.685 1.00 60.25 C ATOM 1111 OD1 ASN A 73 4.382 -39.556 -5.930 1.00 52.33 O ATOM 1112 ND2 ASN A 73 3.556 -37.783 -4.836 1.00 3.30 N ATOM 0 H ASN A 73 1.956 -36.362 -6.933 1.00 54.34 H new ATOM 0 HA ASN A 73 2.561 -38.843 -8.429 1.00 53.33 H new ATOM 0 HB2 ASN A 73 1.312 -38.609 -5.657 1.00 52.25 H new ATOM 0 HB3 ASN A 73 1.893 -40.067 -6.437 1.00 52.25 H new ATOM 0 HD21 ASN A 73 4.442 -37.611 -4.360 1.00 3.30 H new ATOM 0 HD22 ASN A 73 2.756 -37.176 -4.659 1.00 3.30 H new ATOM 1119 N VAL A 74 -0.168 -37.210 -8.185 1.00 42.24 N ATOM 1120 CA VAL A 74 -1.613 -37.134 -8.402 1.00 72.51 C ATOM 1121 C VAL A 74 -1.958 -36.228 -9.580 1.00 33.41 C ATOM 1122 O VAL A 74 -1.275 -35.233 -9.839 1.00 74.22 O ATOM 1123 CB VAL A 74 -2.329 -36.603 -7.130 1.00 15.53 C ATOM 1124 CG1 VAL A 74 -3.807 -36.318 -7.390 1.00 23.10 C ATOM 1125 CG2 VAL A 74 -2.169 -37.583 -5.972 1.00 50.05 C ATOM 0 H VAL A 74 0.286 -36.303 -8.077 1.00 42.24 H new ATOM 0 HA VAL A 74 -1.956 -38.144 -8.625 1.00 72.51 H new ATOM 0 HB VAL A 74 -1.854 -35.660 -6.858 1.00 15.53 H new ATOM 0 HG11 VAL A 74 -4.273 -35.948 -6.476 1.00 23.10 H new ATOM 0 HG12 VAL A 74 -3.900 -35.567 -8.174 1.00 23.10 H new ATOM 0 HG13 VAL A 74 -4.304 -37.235 -7.705 1.00 23.10 H new ATOM 0 HG21 VAL A 74 -2.678 -37.192 -5.091 1.00 50.05 H new ATOM 0 HG22 VAL A 74 -2.605 -38.544 -6.246 1.00 50.05 H new ATOM 0 HG23 VAL A 74 -1.110 -37.715 -5.750 1.00 50.05 H new ATOM 1135 N LYS A 75 -3.013 -36.588 -10.301 1.00 71.33 N ATOM 1136 CA LYS A 75 -3.567 -35.731 -11.340 1.00 20.41 C ATOM 1137 C LYS A 75 -5.073 -35.970 -11.443 1.00 63.15 C ATOM 1138 O LYS A 75 -5.518 -37.114 -11.540 1.00 32.02 O ATOM 1139 CB LYS A 75 -2.875 -36.004 -12.685 1.00 33.32 C ATOM 1140 CG LYS A 75 -3.073 -34.894 -13.713 1.00 15.44 C ATOM 1141 CD LYS A 75 -2.492 -33.553 -13.246 1.00 32.33 C ATOM 1142 CE LYS A 75 -0.958 -33.534 -13.232 1.00 62.53 C ATOM 1143 NZ LYS A 75 -0.367 -34.421 -12.186 1.00 41.05 N1+ ATOM 0 H LYS A 75 -3.504 -37.474 -10.183 1.00 71.33 H new ATOM 0 HA LYS A 75 -3.392 -34.687 -11.081 1.00 20.41 H new ATOM 0 HB2 LYS A 75 -1.807 -36.142 -12.513 1.00 33.32 H new ATOM 0 HB3 LYS A 75 -3.255 -36.939 -13.096 1.00 33.32 H new ATOM 0 HG2 LYS A 75 -2.601 -35.184 -14.652 1.00 15.44 H new ATOM 0 HG3 LYS A 75 -4.138 -34.775 -13.915 1.00 15.44 H new ATOM 0 HD2 LYS A 75 -2.853 -32.760 -13.900 1.00 32.33 H new ATOM 0 HD3 LYS A 75 -2.861 -33.333 -12.244 1.00 32.33 H new ATOM 0 HE2 LYS A 75 -0.589 -33.841 -14.210 1.00 62.53 H new ATOM 0 HE3 LYS A 75 -0.615 -32.512 -13.068 1.00 62.53 H new ATOM 0 HZ1 LYS A 75 0.450 -33.948 -11.751 1.00 41.05 H new ATOM 0 HZ2 LYS A 75 -1.081 -34.621 -11.456 1.00 41.05 H new ATOM 0 HZ3 LYS A 75 -0.058 -35.314 -12.622 1.00 41.05 H new ATOM 1157 N ILE A 76 -5.856 -34.894 -11.398 1.00 10.31 N ATOM 1158 CA ILE A 76 -7.313 -35.009 -11.404 1.00 43.12 C ATOM 1159 C ILE A 76 -7.897 -34.476 -12.708 1.00 51.15 C ATOM 1160 O ILE A 76 -7.583 -33.361 -13.139 1.00 60.02 O ATOM 1161 CB ILE A 76 -7.954 -34.254 -10.211 1.00 3.10 C ATOM 1162 CG1 ILE A 76 -7.259 -34.640 -8.891 1.00 3.44 C ATOM 1163 CG2 ILE A 76 -9.453 -34.555 -10.136 1.00 13.44 C ATOM 1164 CD1 ILE A 76 -7.816 -33.932 -7.672 1.00 73.14 C ATOM 0 H ILE A 76 -5.508 -33.936 -11.357 1.00 10.31 H new ATOM 0 HA ILE A 76 -7.545 -36.070 -11.309 1.00 43.12 H new ATOM 0 HB ILE A 76 -7.822 -33.183 -10.367 1.00 3.10 H new ATOM 0 HG12 ILE A 76 -7.349 -35.717 -8.746 1.00 3.44 H new ATOM 0 HG13 ILE A 76 -6.195 -34.417 -8.974 1.00 3.44 H new ATOM 0 HG21 ILE A 76 -9.890 -34.018 -9.294 1.00 13.44 H new ATOM 0 HG22 ILE A 76 -9.935 -34.235 -11.060 1.00 13.44 H new ATOM 0 HG23 ILE A 76 -9.603 -35.626 -10.001 1.00 13.44 H new ATOM 0 HD11 ILE A 76 -7.275 -34.257 -6.783 1.00 73.14 H new ATOM 0 HD12 ILE A 76 -7.701 -32.855 -7.793 1.00 73.14 H new ATOM 0 HD13 ILE A 76 -8.873 -34.174 -7.562 1.00 73.14 H new ATOM 1176 N TYR A 77 -8.742 -35.285 -13.329 1.00 3.34 N ATOM 1177 CA TYR A 77 -9.440 -34.913 -14.550 1.00 12.22 C ATOM 1178 C TYR A 77 -10.938 -34.841 -14.269 1.00 34.33 C ATOM 1179 O TYR A 77 -11.380 -35.130 -13.153 1.00 1.44 O ATOM 1180 CB TYR A 77 -9.155 -35.935 -15.657 1.00 23.15 C ATOM 1181 CG TYR A 77 -7.679 -36.246 -15.846 1.00 51.23 C ATOM 1182 CD1 TYR A 77 -7.117 -37.383 -15.282 1.00 62.14 C ATOM 1183 CD2 TYR A 77 -6.852 -35.407 -16.584 1.00 61.02 C ATOM 1184 CE1 TYR A 77 -5.778 -37.676 -15.447 1.00 25.40 C ATOM 1185 CE2 TYR A 77 -5.508 -35.695 -16.752 1.00 34.01 C ATOM 1186 CZ TYR A 77 -4.977 -36.833 -16.182 1.00 2.40 C ATOM 1187 OH TYR A 77 -3.643 -37.136 -16.355 1.00 22.34 O ATOM 0 H TYR A 77 -8.964 -36.224 -12.998 1.00 3.34 H new ATOM 0 HA TYR A 77 -9.088 -33.938 -14.886 1.00 12.22 H new ATOM 0 HB2 TYR A 77 -9.684 -36.860 -15.428 1.00 23.15 H new ATOM 0 HB3 TYR A 77 -9.560 -35.560 -16.597 1.00 23.15 H new ATOM 0 HD1 TYR A 77 -7.738 -38.051 -14.704 1.00 62.14 H new ATOM 0 HD2 TYR A 77 -7.265 -34.516 -17.034 1.00 61.02 H new ATOM 0 HE1 TYR A 77 -5.360 -38.566 -15.000 1.00 25.40 H new ATOM 0 HE2 TYR A 77 -4.879 -35.032 -17.327 1.00 34.01 H new ATOM 0 HH TYR A 77 -3.559 -38.019 -16.771 1.00 22.34 H new ATOM 1197 N LYS A 78 -11.718 -34.468 -15.278 1.00 10.01 N ATOM 1198 CA LYS A 78 -13.159 -34.320 -15.123 1.00 3.41 C ATOM 1199 C LYS A 78 -13.875 -34.663 -16.425 1.00 25.15 C ATOM 1200 O LYS A 78 -13.593 -34.079 -17.473 1.00 45.21 O ATOM 1201 CB LYS A 78 -13.505 -32.885 -14.698 1.00 53.32 C ATOM 1202 CG LYS A 78 -14.968 -32.682 -14.303 1.00 32.43 C ATOM 1203 CD LYS A 78 -15.231 -31.249 -13.841 1.00 31.14 C ATOM 1204 CE LYS A 78 -16.666 -31.056 -13.362 1.00 3.31 C ATOM 1205 NZ LYS A 78 -16.988 -31.922 -12.195 1.00 62.33 N1+ ATOM 0 H LYS A 78 -11.374 -34.262 -16.216 1.00 10.01 H new ATOM 0 HA LYS A 78 -13.493 -35.009 -14.348 1.00 3.41 H new ATOM 0 HB2 LYS A 78 -12.871 -32.605 -13.857 1.00 53.32 H new ATOM 0 HB3 LYS A 78 -13.265 -32.208 -15.518 1.00 53.32 H new ATOM 0 HG2 LYS A 78 -15.611 -32.915 -15.152 1.00 32.43 H new ATOM 0 HG3 LYS A 78 -15.230 -33.376 -13.505 1.00 32.43 H new ATOM 0 HD2 LYS A 78 -14.543 -30.996 -13.034 1.00 31.14 H new ATOM 0 HD3 LYS A 78 -15.027 -30.561 -14.661 1.00 31.14 H new ATOM 0 HE2 LYS A 78 -16.820 -30.011 -13.091 1.00 3.31 H new ATOM 0 HE3 LYS A 78 -17.353 -31.278 -14.178 1.00 3.31 H new ATOM 0 HZ1 LYS A 78 -17.539 -31.378 -11.501 1.00 62.33 H new ATOM 0 HZ2 LYS A 78 -17.544 -32.741 -12.514 1.00 62.33 H new ATOM 0 HZ3 LYS A 78 -16.106 -32.253 -11.754 1.00 62.33 H new ATOM 1219 N ILE A 79 -14.792 -35.615 -16.348 1.00 35.25 N ATOM 1220 CA ILE A 79 -15.612 -35.997 -17.490 1.00 51.22 C ATOM 1221 C ILE A 79 -16.842 -35.099 -17.568 1.00 13.33 C ATOM 1222 O ILE A 79 -17.739 -35.193 -16.730 1.00 3.23 O ATOM 1223 CB ILE A 79 -16.051 -37.485 -17.394 1.00 11.23 C ATOM 1224 CG1 ILE A 79 -14.839 -38.415 -17.578 1.00 75.13 C ATOM 1225 CG2 ILE A 79 -17.140 -37.809 -18.419 1.00 32.21 C ATOM 1226 CD1 ILE A 79 -14.179 -38.305 -18.938 1.00 50.20 C ATOM 0 H ILE A 79 -14.989 -36.143 -15.498 1.00 35.25 H new ATOM 0 HA ILE A 79 -15.014 -35.876 -18.393 1.00 51.22 H new ATOM 0 HB ILE A 79 -16.469 -37.650 -16.401 1.00 11.23 H new ATOM 0 HG12 ILE A 79 -14.101 -38.190 -16.808 1.00 75.13 H new ATOM 0 HG13 ILE A 79 -15.158 -39.446 -17.422 1.00 75.13 H new ATOM 0 HG21 ILE A 79 -17.426 -38.857 -18.327 1.00 32.21 H new ATOM 0 HG22 ILE A 79 -18.010 -37.178 -18.237 1.00 32.21 H new ATOM 0 HG23 ILE A 79 -16.761 -37.623 -19.424 1.00 32.21 H new ATOM 0 HD11 ILE A 79 -13.334 -38.991 -18.989 1.00 50.20 H new ATOM 0 HD12 ILE A 79 -14.901 -38.560 -19.714 1.00 50.20 H new ATOM 0 HD13 ILE A 79 -13.827 -37.285 -19.090 1.00 50.20 H new ATOM 1238 N ASN A 80 -16.864 -34.209 -18.556 1.00 52.33 N ATOM 1239 CA ASN A 80 -17.995 -33.298 -18.748 1.00 2.04 C ATOM 1240 C ASN A 80 -18.713 -33.582 -20.067 1.00 60.11 C ATOM 1241 O ASN A 80 -19.638 -32.862 -20.446 1.00 23.20 O ATOM 1242 CB ASN A 80 -17.529 -31.833 -18.694 1.00 23.44 C ATOM 1243 CG ASN A 80 -16.600 -31.456 -19.837 1.00 12.41 C ATOM 1244 OD1 ASN A 80 -15.860 -32.291 -20.362 1.00 32.04 O ATOM 1245 ND2 ASN A 80 -16.622 -30.189 -20.225 1.00 24.31 N ATOM 0 H ASN A 80 -16.113 -34.097 -19.237 1.00 52.33 H new ATOM 0 HA ASN A 80 -18.701 -33.467 -17.935 1.00 2.04 H new ATOM 0 HB2 ASN A 80 -18.402 -31.180 -18.714 1.00 23.44 H new ATOM 0 HB3 ASN A 80 -17.019 -31.656 -17.747 1.00 23.44 H new ATOM 0 HD21 ASN A 80 -16.013 -29.877 -20.982 1.00 24.31 H new ATOM 0 HD22 ASN A 80 -17.248 -29.526 -19.767 1.00 24.31 H new ATOM 1252 N ILE A 81 -18.285 -34.638 -20.763 1.00 22.21 N ATOM 1253 CA ILE A 81 -18.937 -35.050 -22.005 1.00 54.13 C ATOM 1254 C ILE A 81 -20.368 -35.522 -21.709 1.00 65.23 C ATOM 1255 O ILE A 81 -20.586 -36.608 -21.166 1.00 21.40 O ATOM 1256 CB ILE A 81 -18.134 -36.151 -22.761 1.00 63.43 C ATOM 1257 CG1 ILE A 81 -18.929 -36.664 -23.980 1.00 0.10 C ATOM 1258 CG2 ILE A 81 -17.756 -37.302 -21.831 1.00 45.20 C ATOM 1259 CD1 ILE A 81 -18.219 -37.748 -24.771 1.00 64.23 C ATOM 0 H ILE A 81 -17.494 -35.220 -20.488 1.00 22.21 H new ATOM 0 HA ILE A 81 -18.972 -34.183 -22.665 1.00 54.13 H new ATOM 0 HB ILE A 81 -17.208 -35.702 -23.121 1.00 63.43 H new ATOM 0 HG12 ILE A 81 -19.890 -37.049 -23.638 1.00 0.10 H new ATOM 0 HG13 ILE A 81 -19.140 -35.824 -24.643 1.00 0.10 H new ATOM 0 HG21 ILE A 81 -17.197 -38.053 -22.390 1.00 45.20 H new ATOM 0 HG22 ILE A 81 -17.140 -36.923 -21.015 1.00 45.20 H new ATOM 0 HG23 ILE A 81 -18.661 -37.753 -21.423 1.00 45.20 H new ATOM 0 HD11 ILE A 81 -18.843 -38.054 -25.610 1.00 64.23 H new ATOM 0 HD12 ILE A 81 -17.271 -37.363 -25.146 1.00 64.23 H new ATOM 0 HD13 ILE A 81 -18.032 -38.606 -24.126 1.00 64.23 H new ATOM 1271 N GLU A 82 -21.327 -34.675 -22.073 1.00 34.03 N ATOM 1272 CA GLU A 82 -22.738 -34.853 -21.722 1.00 12.21 C ATOM 1273 C GLU A 82 -23.290 -36.214 -22.158 1.00 64.13 C ATOM 1274 O GLU A 82 -24.178 -36.763 -21.507 1.00 42.22 O ATOM 1275 CB GLU A 82 -23.560 -33.729 -22.366 1.00 14.33 C ATOM 1276 CG GLU A 82 -23.043 -32.331 -22.035 1.00 12.32 C ATOM 1277 CD GLU A 82 -23.699 -31.251 -22.874 1.00 44.14 C ATOM 1278 OE1 GLU A 82 -23.259 -31.034 -24.024 1.00 64.21 O ATOM 1279 OE2 GLU A 82 -24.656 -30.611 -22.396 1.00 51.21 O1- ATOM 0 H GLU A 82 -21.147 -33.837 -22.625 1.00 34.03 H new ATOM 0 HA GLU A 82 -22.815 -34.814 -20.635 1.00 12.21 H new ATOM 0 HB2 GLU A 82 -23.558 -33.862 -23.448 1.00 14.33 H new ATOM 0 HB3 GLU A 82 -24.596 -33.812 -22.037 1.00 14.33 H new ATOM 0 HG2 GLU A 82 -23.220 -32.123 -20.980 1.00 12.32 H new ATOM 0 HG3 GLU A 82 -21.964 -32.301 -22.190 1.00 12.32 H new ATOM 1286 N ASP A 83 -22.761 -36.753 -23.253 1.00 63.52 N ATOM 1287 CA ASP A 83 -23.277 -37.999 -23.826 1.00 11.04 C ATOM 1288 C ASP A 83 -22.921 -39.210 -22.964 1.00 33.50 C ATOM 1289 O ASP A 83 -23.550 -40.264 -23.077 1.00 21.21 O ATOM 1290 CB ASP A 83 -22.732 -38.215 -25.245 1.00 23.45 C ATOM 1291 CG ASP A 83 -23.162 -37.126 -26.214 1.00 52.42 C ATOM 1292 OD1 ASP A 83 -24.332 -37.139 -26.657 1.00 43.25 O ATOM 1293 OD2 ASP A 83 -22.330 -36.253 -26.541 1.00 25.20 O1- ATOM 0 H ASP A 83 -21.976 -36.349 -23.763 1.00 63.52 H new ATOM 0 HA ASP A 83 -24.362 -37.904 -23.862 1.00 11.04 H new ATOM 0 HB2 ASP A 83 -21.643 -38.254 -25.209 1.00 23.45 H new ATOM 0 HB3 ASP A 83 -23.073 -39.181 -25.617 1.00 23.45 H new ATOM 1298 N ASN A 84 -21.919 -39.066 -22.103 1.00 32.21 N ATOM 1299 CA ASN A 84 -21.413 -40.203 -21.335 1.00 13.34 C ATOM 1300 C ASN A 84 -22.179 -40.390 -20.029 1.00 61.05 C ATOM 1301 O ASN A 84 -21.808 -39.842 -18.991 1.00 23.22 O ATOM 1302 CB ASN A 84 -19.915 -40.054 -21.043 1.00 61.11 C ATOM 1303 CG ASN A 84 -19.354 -41.234 -20.259 1.00 73.53 C ATOM 1304 OD1 ASN A 84 -19.848 -42.360 -20.364 1.00 44.50 O ATOM 1305 ND2 ASN A 84 -18.318 -40.986 -19.467 1.00 3.45 N ATOM 0 H ASN A 84 -21.443 -38.183 -21.919 1.00 32.21 H new ATOM 0 HA ASN A 84 -21.565 -41.090 -21.950 1.00 13.34 H new ATOM 0 HB2 ASN A 84 -19.373 -39.956 -21.983 1.00 61.11 H new ATOM 0 HB3 ASN A 84 -19.747 -39.135 -20.481 1.00 61.11 H new ATOM 0 HD21 ASN A 84 -17.903 -41.740 -18.919 1.00 3.45 H new ATOM 0 HD22 ASN A 84 -17.937 -40.042 -19.406 1.00 3.45 H new ATOM 1312 N GLN A 85 -23.264 -41.149 -20.099 1.00 14.34 N ATOM 1313 CA GLN A 85 -23.995 -41.577 -18.912 1.00 73.43 C ATOM 1314 C GLN A 85 -23.740 -43.063 -18.670 1.00 30.44 C ATOM 1315 O GLN A 85 -23.711 -43.531 -17.528 1.00 11.40 O ATOM 1316 CB GLN A 85 -25.499 -41.322 -19.092 1.00 62.01 C ATOM 1317 CG GLN A 85 -26.352 -41.791 -17.915 1.00 14.43 C ATOM 1318 CD GLN A 85 -27.842 -41.689 -18.187 1.00 52.52 C ATOM 1319 OE1 GLN A 85 -28.284 -41.784 -19.333 1.00 30.11 O ATOM 1320 NE2 GLN A 85 -28.632 -41.507 -17.139 1.00 22.33 N ATOM 0 H GLN A 85 -23.662 -41.485 -20.976 1.00 14.34 H new ATOM 0 HA GLN A 85 -23.649 -41.005 -18.051 1.00 73.43 H new ATOM 0 HB2 GLN A 85 -25.661 -40.255 -19.243 1.00 62.01 H new ATOM 0 HB3 GLN A 85 -25.837 -41.827 -19.997 1.00 62.01 H new ATOM 0 HG2 GLN A 85 -26.101 -42.825 -17.680 1.00 14.43 H new ATOM 0 HG3 GLN A 85 -26.107 -41.196 -17.035 1.00 14.43 H new ATOM 0 HE21 GLN A 85 -28.230 -41.433 -16.204 1.00 22.33 H new ATOM 0 HE22 GLN A 85 -29.642 -41.441 -17.267 1.00 22.33 H new ATOM 1329 N ASP A 86 -23.516 -43.784 -19.770 1.00 11.41 N ATOM 1330 CA ASP A 86 -23.345 -45.241 -19.762 1.00 44.11 C ATOM 1331 C ASP A 86 -22.403 -45.686 -18.644 1.00 63.32 C ATOM 1332 O ASP A 86 -22.772 -46.496 -17.786 1.00 33.14 O ATOM 1333 CB ASP A 86 -22.788 -45.712 -21.116 1.00 54.34 C ATOM 1334 CG ASP A 86 -23.577 -45.172 -22.299 1.00 51.54 C ATOM 1335 OD1 ASP A 86 -24.497 -45.862 -22.783 1.00 24.41 O ATOM 1336 OD2 ASP A 86 -23.280 -44.038 -22.743 1.00 5.23 O1- ATOM 0 H ASP A 86 -23.447 -43.371 -20.700 1.00 11.41 H new ATOM 0 HA ASP A 86 -24.323 -45.690 -19.587 1.00 44.11 H new ATOM 0 HB2 ASP A 86 -21.748 -45.398 -21.205 1.00 54.34 H new ATOM 0 HB3 ASP A 86 -22.795 -46.802 -21.147 1.00 54.34 H new ATOM 1341 N VAL A 87 -21.195 -45.128 -18.650 1.00 53.31 N ATOM 1342 CA VAL A 87 -20.169 -45.474 -17.669 1.00 43.31 C ATOM 1343 C VAL A 87 -20.679 -45.262 -16.241 1.00 71.01 C ATOM 1344 O VAL A 87 -20.346 -46.025 -15.332 1.00 44.23 O ATOM 1345 CB VAL A 87 -18.878 -44.643 -17.894 1.00 24.23 C ATOM 1346 CG1 VAL A 87 -17.818 -44.962 -16.836 1.00 42.44 C ATOM 1347 CG2 VAL A 87 -18.328 -44.884 -19.302 1.00 22.14 C ATOM 0 H VAL A 87 -20.901 -44.427 -19.330 1.00 53.31 H new ATOM 0 HA VAL A 87 -19.933 -46.530 -17.804 1.00 43.31 H new ATOM 0 HB VAL A 87 -19.135 -43.588 -17.796 1.00 24.23 H new ATOM 0 HG11 VAL A 87 -16.926 -44.363 -17.022 1.00 42.44 H new ATOM 0 HG12 VAL A 87 -18.211 -44.730 -15.846 1.00 42.44 H new ATOM 0 HG13 VAL A 87 -17.561 -46.020 -16.886 1.00 42.44 H new ATOM 0 HG21 VAL A 87 -17.422 -44.294 -19.445 1.00 22.14 H new ATOM 0 HG22 VAL A 87 -18.095 -45.942 -19.426 1.00 22.14 H new ATOM 0 HG23 VAL A 87 -19.074 -44.588 -20.040 1.00 22.14 H new ATOM 1357 N ALA A 88 -21.518 -44.247 -16.058 1.00 74.24 N ATOM 1358 CA ALA A 88 -22.024 -43.910 -14.734 1.00 11.24 C ATOM 1359 C ALA A 88 -22.951 -45.012 -14.229 1.00 40.14 C ATOM 1360 O ALA A 88 -22.798 -45.510 -13.111 1.00 31.23 O ATOM 1361 CB ALA A 88 -22.746 -42.568 -14.767 1.00 44.41 C ATOM 0 H ALA A 88 -21.860 -43.646 -16.808 1.00 74.24 H new ATOM 0 HA ALA A 88 -21.182 -43.826 -14.046 1.00 11.24 H new ATOM 0 HB1 ALA A 88 -23.118 -42.330 -13.770 1.00 44.41 H new ATOM 0 HB2 ALA A 88 -22.054 -41.790 -15.091 1.00 44.41 H new ATOM 0 HB3 ALA A 88 -23.583 -42.622 -15.463 1.00 44.41 H new ATOM 1367 N THR A 89 -23.895 -45.402 -15.078 1.00 43.13 N ATOM 1368 CA THR A 89 -24.869 -46.432 -14.739 1.00 3.03 C ATOM 1369 C THR A 89 -24.194 -47.801 -14.585 1.00 72.34 C ATOM 1370 O THR A 89 -24.626 -48.634 -13.785 1.00 54.24 O ATOM 1371 CB THR A 89 -25.977 -46.510 -15.819 1.00 23.32 C ATOM 1372 OG1 THR A 89 -26.501 -45.194 -16.065 1.00 72.42 O ATOM 1373 CG2 THR A 89 -27.112 -47.435 -15.386 1.00 3.52 C ATOM 0 H THR A 89 -24.006 -45.016 -16.015 1.00 43.13 H new ATOM 0 HA THR A 89 -25.321 -46.160 -13.785 1.00 3.03 H new ATOM 0 HB THR A 89 -25.535 -46.915 -16.730 1.00 23.32 H new ATOM 0 HG1 THR A 89 -27.201 -45.243 -16.749 1.00 72.42 H new ATOM 0 HG21 THR A 89 -27.873 -47.467 -16.166 1.00 3.52 H new ATOM 0 HG22 THR A 89 -26.720 -48.438 -15.219 1.00 3.52 H new ATOM 0 HG23 THR A 89 -27.555 -47.060 -14.463 1.00 3.52 H new ATOM 1381 N GLN A 90 -23.124 -48.019 -15.348 1.00 45.13 N ATOM 1382 CA GLN A 90 -22.394 -49.285 -15.314 1.00 11.14 C ATOM 1383 C GLN A 90 -21.533 -49.407 -14.055 1.00 24.42 C ATOM 1384 O GLN A 90 -21.422 -50.491 -13.475 1.00 33.43 O ATOM 1385 CB GLN A 90 -21.523 -49.429 -16.570 1.00 21.33 C ATOM 1386 CG GLN A 90 -22.327 -49.647 -17.848 1.00 23.40 C ATOM 1387 CD GLN A 90 -23.069 -50.974 -17.854 1.00 32.12 C ATOM 1388 OE1 GLN A 90 -22.608 -51.959 -17.275 1.00 31.51 O ATOM 1389 NE2 GLN A 90 -24.218 -51.012 -18.507 1.00 52.44 N ATOM 0 H GLN A 90 -22.743 -47.333 -15.999 1.00 45.13 H new ATOM 0 HA GLN A 90 -23.128 -50.091 -15.292 1.00 11.14 H new ATOM 0 HB2 GLN A 90 -20.912 -48.533 -16.683 1.00 21.33 H new ATOM 0 HB3 GLN A 90 -20.839 -50.266 -16.434 1.00 21.33 H new ATOM 0 HG2 GLN A 90 -23.044 -48.834 -17.965 1.00 23.40 H new ATOM 0 HG3 GLN A 90 -21.656 -49.606 -18.706 1.00 23.40 H new ATOM 0 HE21 GLN A 90 -24.567 -50.175 -18.974 1.00 52.44 H new ATOM 0 HE22 GLN A 90 -24.755 -51.878 -18.544 1.00 52.44 H new ATOM 1398 N TYR A 91 -20.921 -48.301 -13.637 1.00 23.00 N ATOM 1399 CA TYR A 91 -20.043 -48.304 -12.462 1.00 63.04 C ATOM 1400 C TYR A 91 -20.807 -47.957 -11.182 1.00 53.41 C ATOM 1401 O TYR A 91 -20.284 -48.122 -10.077 1.00 53.15 O ATOM 1402 CB TYR A 91 -18.856 -47.351 -12.675 1.00 50.03 C ATOM 1403 CG TYR A 91 -17.812 -47.900 -13.637 1.00 40.41 C ATOM 1404 CD1 TYR A 91 -16.556 -48.289 -13.184 1.00 1.24 C ATOM 1405 CD2 TYR A 91 -18.089 -48.047 -14.995 1.00 62.23 C ATOM 1406 CE1 TYR A 91 -15.610 -48.801 -14.050 1.00 31.01 C ATOM 1407 CE2 TYR A 91 -17.144 -48.557 -15.867 1.00 43.30 C ATOM 1408 CZ TYR A 91 -15.908 -48.934 -15.388 1.00 51.11 C ATOM 1409 OH TYR A 91 -14.967 -49.450 -16.251 1.00 21.33 O ATOM 0 H TYR A 91 -21.014 -47.392 -14.091 1.00 23.00 H new ATOM 0 HA TYR A 91 -19.655 -49.315 -12.339 1.00 63.04 H new ATOM 0 HB2 TYR A 91 -19.226 -46.399 -13.055 1.00 50.03 H new ATOM 0 HB3 TYR A 91 -18.384 -47.148 -11.714 1.00 50.03 H new ATOM 0 HD1 TYR A 91 -16.316 -48.189 -12.136 1.00 1.24 H new ATOM 0 HD2 TYR A 91 -19.058 -47.758 -15.373 1.00 62.23 H new ATOM 0 HE1 TYR A 91 -14.640 -49.096 -13.679 1.00 31.01 H new ATOM 0 HE2 TYR A 91 -17.374 -48.659 -16.917 1.00 43.30 H new ATOM 0 HH TYR A 91 -15.336 -49.478 -17.158 1.00 21.33 H new ATOM 1419 N GLY A 92 -22.039 -47.481 -11.331 1.00 22.12 N ATOM 1420 CA GLY A 92 -22.904 -47.273 -10.180 1.00 65.55 C ATOM 1421 C GLY A 92 -22.739 -45.905 -9.541 1.00 41.00 C ATOM 1422 O GLY A 92 -22.501 -45.793 -8.334 1.00 12.12 O ATOM 0 H GLY A 92 -22.456 -47.235 -12.229 1.00 22.12 H new ATOM 0 HA2 GLY A 92 -23.942 -47.399 -10.487 1.00 65.55 H new ATOM 0 HA3 GLY A 92 -22.696 -48.041 -9.435 1.00 65.55 H new ATOM 1426 N VAL A 93 -22.857 -44.859 -10.348 1.00 13.51 N ATOM 1427 CA VAL A 93 -22.832 -43.493 -9.841 1.00 13.34 C ATOM 1428 C VAL A 93 -24.197 -43.135 -9.262 1.00 30.02 C ATOM 1429 O VAL A 93 -25.167 -42.935 -9.999 1.00 73.22 O ATOM 1430 CB VAL A 93 -22.441 -42.478 -10.941 1.00 53.43 C ATOM 1431 CG1 VAL A 93 -22.503 -41.045 -10.410 1.00 75.31 C ATOM 1432 CG2 VAL A 93 -21.050 -42.796 -11.481 1.00 13.21 C ATOM 0 H VAL A 93 -22.971 -44.931 -11.359 1.00 13.51 H new ATOM 0 HA VAL A 93 -22.074 -43.439 -9.060 1.00 13.34 H new ATOM 0 HB VAL A 93 -23.158 -42.562 -11.758 1.00 53.43 H new ATOM 0 HG11 VAL A 93 -22.224 -40.351 -11.203 1.00 75.31 H new ATOM 0 HG12 VAL A 93 -23.517 -40.825 -10.075 1.00 75.31 H new ATOM 0 HG13 VAL A 93 -21.813 -40.937 -9.573 1.00 75.31 H new ATOM 0 HG21 VAL A 93 -20.786 -42.075 -12.254 1.00 13.21 H new ATOM 0 HG22 VAL A 93 -20.324 -42.741 -10.670 1.00 13.21 H new ATOM 0 HG23 VAL A 93 -21.045 -43.800 -11.905 1.00 13.21 H new ATOM 1442 N SER A 94 -24.269 -43.084 -7.940 1.00 15.51 N ATOM 1443 CA SER A 94 -25.527 -42.857 -7.243 1.00 63.12 C ATOM 1444 C SER A 94 -25.865 -41.366 -7.172 1.00 52.01 C ATOM 1445 O SER A 94 -27.011 -40.970 -7.396 1.00 33.01 O ATOM 1446 CB SER A 94 -25.449 -43.459 -5.835 1.00 45.35 C ATOM 1447 OG SER A 94 -26.702 -43.417 -5.171 1.00 22.42 O ATOM 0 H SER A 94 -23.464 -43.198 -7.324 1.00 15.51 H new ATOM 0 HA SER A 94 -26.325 -43.346 -7.802 1.00 63.12 H new ATOM 0 HB2 SER A 94 -25.107 -44.492 -5.900 1.00 45.35 H new ATOM 0 HB3 SER A 94 -24.709 -42.915 -5.248 1.00 45.35 H new ATOM 0 HG SER A 94 -26.612 -43.811 -4.278 1.00 22.42 H new ATOM 1453 N ALA A 95 -24.866 -40.543 -6.867 1.00 12.01 N ATOM 1454 CA ALA A 95 -25.072 -39.107 -6.702 1.00 52.44 C ATOM 1455 C ALA A 95 -23.797 -38.341 -7.034 1.00 22.24 C ATOM 1456 O ALA A 95 -22.754 -38.945 -7.289 1.00 22.21 O ATOM 1457 CB ALA A 95 -25.526 -38.794 -5.279 1.00 0.24 C ATOM 0 H ALA A 95 -23.902 -40.847 -6.729 1.00 12.01 H new ATOM 0 HA ALA A 95 -25.853 -38.790 -7.393 1.00 52.44 H new ATOM 0 HB1 ALA A 95 -25.675 -37.719 -5.173 1.00 0.24 H new ATOM 0 HB2 ALA A 95 -26.463 -39.312 -5.074 1.00 0.24 H new ATOM 0 HB3 ALA A 95 -24.765 -39.126 -4.573 1.00 0.24 H new ATOM 1463 N ILE A 96 -23.886 -37.015 -7.016 1.00 40.13 N ATOM 1464 CA ILE A 96 -22.746 -36.151 -7.321 1.00 41.53 C ATOM 1465 C ILE A 96 -22.253 -35.445 -6.049 1.00 24.21 C ATOM 1466 O ILE A 96 -23.042 -35.203 -5.133 1.00 22.54 O ATOM 1467 CB ILE A 96 -23.086 -35.088 -8.409 1.00 44.03 C ATOM 1468 CG1 ILE A 96 -24.160 -34.081 -7.929 1.00 70.20 C ATOM 1469 CG2 ILE A 96 -23.526 -35.769 -9.705 1.00 72.40 C ATOM 1470 CD1 ILE A 96 -25.562 -34.648 -7.806 1.00 75.51 C ATOM 0 H ILE A 96 -24.743 -36.510 -6.791 1.00 40.13 H new ATOM 0 HA ILE A 96 -21.958 -36.793 -7.715 1.00 41.53 H new ATOM 0 HB ILE A 96 -22.176 -34.519 -8.600 1.00 44.03 H new ATOM 0 HG12 ILE A 96 -23.858 -33.686 -6.959 1.00 70.20 H new ATOM 0 HG13 ILE A 96 -24.184 -33.240 -8.622 1.00 70.20 H new ATOM 0 HG21 ILE A 96 -23.759 -35.011 -10.453 1.00 72.40 H new ATOM 0 HG22 ILE A 96 -22.722 -36.406 -10.072 1.00 72.40 H new ATOM 0 HG23 ILE A 96 -24.411 -36.376 -9.515 1.00 72.40 H new ATOM 0 HD11 ILE A 96 -26.241 -33.867 -7.464 1.00 75.51 H new ATOM 0 HD12 ILE A 96 -25.892 -35.016 -8.777 1.00 75.51 H new ATOM 0 HD13 ILE A 96 -25.561 -35.468 -7.088 1.00 75.51 H new ATOM 1482 N PRO A 97 -20.944 -35.114 -5.958 1.00 41.14 N ATOM 1483 CA PRO A 97 -19.952 -35.411 -7.004 1.00 50.44 C ATOM 1484 C PRO A 97 -19.508 -36.874 -6.982 1.00 2.04 C ATOM 1485 O PRO A 97 -19.896 -37.641 -6.091 1.00 63.12 O ATOM 1486 CB PRO A 97 -18.788 -34.480 -6.647 1.00 4.13 C ATOM 1487 CG PRO A 97 -18.861 -34.354 -5.163 1.00 64.14 C ATOM 1488 CD PRO A 97 -20.332 -34.406 -4.813 1.00 35.15 C ATOM 0 HA PRO A 97 -20.346 -35.256 -8.008 1.00 50.44 H new ATOM 0 HB2 PRO A 97 -17.833 -34.898 -6.965 1.00 4.13 H new ATOM 0 HB3 PRO A 97 -18.890 -33.510 -7.134 1.00 4.13 H new ATOM 0 HG2 PRO A 97 -18.315 -35.162 -4.675 1.00 64.14 H new ATOM 0 HG3 PRO A 97 -18.413 -33.419 -4.828 1.00 64.14 H new ATOM 0 HD2 PRO A 97 -20.502 -34.938 -3.877 1.00 35.15 H new ATOM 0 HD3 PRO A 97 -20.750 -33.407 -4.692 1.00 35.15 H new ATOM 1496 N THR A 98 -18.695 -37.256 -7.958 1.00 51.24 N ATOM 1497 CA THR A 98 -18.223 -38.628 -8.081 1.00 74.00 C ATOM 1498 C THR A 98 -16.773 -38.652 -8.550 1.00 5.01 C ATOM 1499 O THR A 98 -16.467 -38.240 -9.672 1.00 43.51 O ATOM 1500 CB THR A 98 -19.098 -39.441 -9.065 1.00 21.00 C ATOM 1501 OG1 THR A 98 -20.456 -39.465 -8.607 1.00 33.40 O ATOM 1502 CG2 THR A 98 -18.588 -40.872 -9.207 1.00 73.42 C ATOM 0 H THR A 98 -18.346 -36.628 -8.682 1.00 51.24 H new ATOM 0 HA THR A 98 -18.294 -39.088 -7.095 1.00 74.00 H new ATOM 0 HB THR A 98 -19.044 -38.956 -10.040 1.00 21.00 H new ATOM 0 HG1 THR A 98 -21.023 -38.974 -9.238 1.00 33.40 H new ATOM 0 HG21 THR A 98 -19.224 -41.417 -9.905 1.00 73.42 H new ATOM 0 HG22 THR A 98 -17.565 -40.858 -9.583 1.00 73.42 H new ATOM 0 HG23 THR A 98 -18.611 -41.364 -8.235 1.00 73.42 H new ATOM 1510 N ILE A 99 -15.893 -39.151 -7.683 1.00 33.32 N ATOM 1511 CA ILE A 99 -14.465 -39.220 -7.967 1.00 62.41 C ATOM 1512 C ILE A 99 -14.033 -40.671 -8.172 1.00 30.42 C ATOM 1513 O ILE A 99 -14.058 -41.484 -7.235 1.00 23.12 O ATOM 1514 CB ILE A 99 -13.632 -38.606 -6.812 1.00 11.51 C ATOM 1515 CG1 ILE A 99 -14.025 -37.140 -6.567 1.00 44.42 C ATOM 1516 CG2 ILE A 99 -12.135 -38.722 -7.095 1.00 43.23 C ATOM 1517 CD1 ILE A 99 -13.653 -36.204 -7.695 1.00 13.43 C ATOM 0 H ILE A 99 -16.152 -39.517 -6.767 1.00 33.32 H new ATOM 0 HA ILE A 99 -14.284 -38.648 -8.877 1.00 62.41 H new ATOM 0 HB ILE A 99 -13.852 -39.172 -5.907 1.00 11.51 H new ATOM 0 HG12 ILE A 99 -15.101 -37.086 -6.404 1.00 44.42 H new ATOM 0 HG13 ILE A 99 -13.547 -36.795 -5.650 1.00 44.42 H new ATOM 0 HG21 ILE A 99 -11.574 -38.284 -6.270 1.00 43.23 H new ATOM 0 HG22 ILE A 99 -11.865 -39.773 -7.200 1.00 43.23 H new ATOM 0 HG23 ILE A 99 -11.897 -38.192 -8.017 1.00 43.23 H new ATOM 0 HD11 ILE A 99 -13.964 -35.190 -7.444 1.00 13.43 H new ATOM 0 HD12 ILE A 99 -12.574 -36.226 -7.845 1.00 13.43 H new ATOM 0 HD13 ILE A 99 -14.153 -36.521 -8.610 1.00 13.43 H new ATOM 1529 N LEU A 100 -13.674 -40.984 -9.411 1.00 43.14 N ATOM 1530 CA LEU A 100 -13.149 -42.293 -9.782 1.00 54.31 C ATOM 1531 C LEU A 100 -11.627 -42.312 -9.605 1.00 72.51 C ATOM 1532 O LEU A 100 -10.932 -41.453 -10.147 1.00 11.02 O ATOM 1533 CB LEU A 100 -13.492 -42.612 -11.256 1.00 62.44 C ATOM 1534 CG LEU A 100 -14.989 -42.767 -11.607 1.00 2.41 C ATOM 1535 CD1 LEU A 100 -15.614 -43.921 -10.836 1.00 3.04 C ATOM 1536 CD2 LEU A 100 -15.755 -41.469 -11.365 1.00 53.13 C ATOM 0 H LEU A 100 -13.739 -40.332 -10.193 1.00 43.14 H new ATOM 0 HA LEU A 100 -13.604 -43.044 -9.137 1.00 54.31 H new ATOM 0 HB2 LEU A 100 -13.077 -41.820 -11.880 1.00 62.44 H new ATOM 0 HB3 LEU A 100 -12.982 -43.535 -11.531 1.00 62.44 H new ATOM 0 HG LEU A 100 -15.056 -42.996 -12.670 1.00 2.41 H new ATOM 0 HD11 LEU A 100 -16.668 -44.008 -11.102 1.00 3.04 H new ATOM 0 HD12 LEU A 100 -15.099 -44.848 -11.087 1.00 3.04 H new ATOM 0 HD13 LEU A 100 -15.524 -43.735 -9.766 1.00 3.04 H new ATOM 0 HD21 LEU A 100 -16.805 -41.613 -11.622 1.00 53.13 H new ATOM 0 HD22 LEU A 100 -15.673 -41.189 -10.315 1.00 53.13 H new ATOM 0 HD23 LEU A 100 -15.335 -40.677 -11.985 1.00 53.13 H new ATOM 1548 N MET A 101 -11.119 -43.279 -8.845 1.00 11.43 N ATOM 1549 CA MET A 101 -9.675 -43.436 -8.649 1.00 4.10 C ATOM 1550 C MET A 101 -9.124 -44.453 -9.653 1.00 43.12 C ATOM 1551 O MET A 101 -9.755 -45.482 -9.910 1.00 65.12 O ATOM 1552 CB MET A 101 -9.370 -43.894 -7.205 1.00 31.24 C ATOM 1553 CG MET A 101 -9.821 -42.916 -6.125 1.00 63.31 C ATOM 1554 SD MET A 101 -8.741 -41.485 -5.955 1.00 12.02 S ATOM 1555 CE MET A 101 -9.425 -40.755 -4.469 1.00 54.53 C ATOM 0 H MET A 101 -11.686 -43.969 -8.352 1.00 11.43 H new ATOM 0 HA MET A 101 -9.192 -42.473 -8.813 1.00 4.10 H new ATOM 0 HB2 MET A 101 -9.853 -44.856 -7.032 1.00 31.24 H new ATOM 0 HB3 MET A 101 -8.296 -44.055 -7.107 1.00 31.24 H new ATOM 0 HG2 MET A 101 -10.830 -42.574 -6.354 1.00 63.31 H new ATOM 0 HG3 MET A 101 -9.871 -43.439 -5.170 1.00 63.31 H new ATOM 0 HE1 MET A 101 -9.920 -39.816 -4.719 1.00 54.53 H new ATOM 0 HE2 MET A 101 -10.149 -41.440 -4.027 1.00 54.53 H new ATOM 0 HE3 MET A 101 -8.624 -40.564 -3.755 1.00 54.53 H new ATOM 1565 N PHE A 102 -7.960 -44.156 -10.228 1.00 13.11 N ATOM 1566 CA PHE A 102 -7.278 -45.068 -11.152 1.00 71.35 C ATOM 1567 C PHE A 102 -5.789 -45.119 -10.819 1.00 34.00 C ATOM 1568 O PHE A 102 -5.205 -44.103 -10.426 1.00 61.02 O ATOM 1569 CB PHE A 102 -7.470 -44.620 -12.611 1.00 21.10 C ATOM 1570 CG PHE A 102 -8.908 -44.621 -13.070 1.00 2.32 C ATOM 1571 CD1 PHE A 102 -9.610 -43.432 -13.210 1.00 2.42 C ATOM 1572 CD2 PHE A 102 -9.556 -45.813 -13.361 1.00 24.22 C ATOM 1573 CE1 PHE A 102 -10.925 -43.432 -13.633 1.00 61.40 C ATOM 1574 CE2 PHE A 102 -10.873 -45.818 -13.783 1.00 73.14 C ATOM 1575 CZ PHE A 102 -11.557 -44.626 -13.918 1.00 3.41 C ATOM 0 H PHE A 102 -7.462 -43.280 -10.069 1.00 13.11 H new ATOM 0 HA PHE A 102 -7.713 -46.061 -11.039 1.00 71.35 H new ATOM 0 HB2 PHE A 102 -7.063 -43.616 -12.728 1.00 21.10 H new ATOM 0 HB3 PHE A 102 -6.892 -45.277 -13.261 1.00 21.10 H new ATOM 0 HD1 PHE A 102 -9.122 -42.495 -12.985 1.00 2.42 H new ATOM 0 HD2 PHE A 102 -9.026 -46.748 -13.257 1.00 24.22 H new ATOM 0 HE1 PHE A 102 -11.458 -42.499 -13.741 1.00 61.40 H new ATOM 0 HE2 PHE A 102 -11.366 -46.753 -14.007 1.00 73.14 H new ATOM 0 HZ PHE A 102 -12.586 -44.628 -14.246 1.00 3.41 H new ATOM 1585 N LYS A 103 -5.171 -46.294 -10.969 1.00 14.01 N ATOM 1586 CA LYS A 103 -3.742 -46.440 -10.662 1.00 2.12 C ATOM 1587 C LYS A 103 -3.031 -47.176 -11.796 1.00 22.12 C ATOM 1588 O LYS A 103 -3.209 -48.382 -11.959 1.00 72.21 O ATOM 1589 CB LYS A 103 -3.567 -47.205 -9.339 1.00 74.24 C ATOM 1590 CG LYS A 103 -2.364 -46.783 -8.497 1.00 43.03 C ATOM 1591 CD LYS A 103 -2.491 -45.339 -7.999 1.00 41.12 C ATOM 1592 CE LYS A 103 -1.915 -45.160 -6.595 1.00 53.33 C ATOM 1593 NZ LYS A 103 -0.470 -45.500 -6.523 1.00 71.52 N1+ ATOM 0 H LYS A 103 -5.627 -47.146 -11.295 1.00 14.01 H new ATOM 0 HA LYS A 103 -3.299 -45.449 -10.559 1.00 2.12 H new ATOM 0 HB2 LYS A 103 -4.470 -47.078 -8.742 1.00 74.24 H new ATOM 0 HB3 LYS A 103 -3.479 -48.268 -9.562 1.00 74.24 H new ATOM 0 HG2 LYS A 103 -2.266 -47.454 -7.643 1.00 43.03 H new ATOM 0 HG3 LYS A 103 -1.454 -46.884 -9.088 1.00 43.03 H new ATOM 0 HD2 LYS A 103 -1.975 -44.672 -8.689 1.00 41.12 H new ATOM 0 HD3 LYS A 103 -3.541 -45.048 -7.999 1.00 41.12 H new ATOM 0 HE2 LYS A 103 -2.058 -44.127 -6.276 1.00 53.33 H new ATOM 0 HE3 LYS A 103 -2.468 -45.788 -5.897 1.00 53.33 H new ATOM 0 HZ1 LYS A 103 -0.129 -45.362 -5.550 1.00 71.52 H new ATOM 0 HZ2 LYS A 103 -0.333 -46.493 -6.800 1.00 71.52 H new ATOM 0 HZ3 LYS A 103 0.064 -44.884 -7.168 1.00 71.52 H new ATOM 1607 N ASN A 104 -2.250 -46.438 -12.586 1.00 41.43 N ATOM 1608 CA ASN A 104 -1.543 -47.004 -13.745 1.00 72.22 C ATOM 1609 C ASN A 104 -2.533 -47.598 -14.744 1.00 0.14 C ATOM 1610 O ASN A 104 -2.196 -48.496 -15.517 1.00 72.20 O ATOM 1611 CB ASN A 104 -0.514 -48.067 -13.309 1.00 20.21 C ATOM 1612 CG ASN A 104 0.723 -47.465 -12.659 1.00 24.30 C ATOM 1613 OD1 ASN A 104 0.662 -46.400 -12.040 1.00 10.43 O ATOM 1614 ND2 ASN A 104 1.858 -48.140 -12.801 1.00 31.24 N ATOM 0 H ASN A 104 -2.088 -45.441 -12.446 1.00 41.43 H new ATOM 0 HA ASN A 104 -1.002 -46.193 -14.232 1.00 72.22 H new ATOM 0 HB2 ASN A 104 -0.986 -48.757 -12.609 1.00 20.21 H new ATOM 0 HB3 ASN A 104 -0.213 -48.652 -14.178 1.00 20.21 H new ATOM 0 HD21 ASN A 104 2.720 -47.781 -12.391 1.00 31.24 H new ATOM 0 HD22 ASN A 104 1.868 -49.018 -13.320 1.00 31.24 H new ATOM 1621 N GLY A 105 -3.754 -47.071 -14.729 1.00 32.31 N ATOM 1622 CA GLY A 105 -4.798 -47.556 -15.612 1.00 42.31 C ATOM 1623 C GLY A 105 -5.548 -48.736 -15.023 1.00 34.43 C ATOM 1624 O GLY A 105 -6.537 -49.198 -15.595 1.00 43.11 O ATOM 0 H GLY A 105 -4.040 -46.309 -14.114 1.00 32.31 H new ATOM 0 HA2 GLY A 105 -5.500 -46.748 -15.819 1.00 42.31 H new ATOM 0 HA3 GLY A 105 -4.358 -47.847 -16.566 1.00 42.31 H new ATOM 1628 N LYS A 106 -5.074 -49.230 -13.881 1.00 12.22 N ATOM 1629 CA LYS A 106 -5.703 -50.358 -13.206 1.00 63.04 C ATOM 1630 C LYS A 106 -6.802 -49.875 -12.259 1.00 35.11 C ATOM 1631 O LYS A 106 -6.738 -48.744 -11.737 1.00 44.30 O ATOM 1632 CB LYS A 106 -4.657 -51.177 -12.437 1.00 13.01 C ATOM 1633 CG LYS A 106 -5.219 -52.450 -11.809 1.00 24.15 C ATOM 1634 CD LYS A 106 -4.144 -53.276 -11.109 1.00 53.23 C ATOM 1635 CE LYS A 106 -3.539 -52.547 -9.914 1.00 13.04 C ATOM 1636 NZ LYS A 106 -2.542 -53.389 -9.202 1.00 41.10 N1+ ATOM 0 H LYS A 106 -4.251 -48.862 -13.403 1.00 12.22 H new ATOM 0 HA LYS A 106 -6.157 -50.998 -13.962 1.00 63.04 H new ATOM 0 HB2 LYS A 106 -3.846 -51.444 -13.115 1.00 13.01 H new ATOM 0 HB3 LYS A 106 -4.225 -50.555 -11.653 1.00 13.01 H new ATOM 0 HG2 LYS A 106 -5.995 -52.186 -11.091 1.00 24.15 H new ATOM 0 HG3 LYS A 106 -5.692 -53.055 -12.582 1.00 24.15 H new ATOM 0 HD2 LYS A 106 -4.574 -54.220 -10.776 1.00 53.23 H new ATOM 0 HD3 LYS A 106 -3.355 -53.519 -11.821 1.00 53.23 H new ATOM 0 HE2 LYS A 106 -3.063 -51.627 -10.252 1.00 13.04 H new ATOM 0 HE3 LYS A 106 -4.332 -52.260 -9.223 1.00 13.04 H new ATOM 0 HZ1 LYS A 106 -2.153 -52.859 -8.396 1.00 41.10 H new ATOM 0 HZ2 LYS A 106 -3.002 -54.255 -8.857 1.00 41.10 H new ATOM 0 HZ3 LYS A 106 -1.772 -53.642 -9.854 1.00 41.10 H new ATOM 1650 N LYS A 107 -7.795 -50.749 -12.046 1.00 44.23 N ATOM 1651 CA LYS A 107 -8.970 -50.441 -11.240 1.00 71.41 C ATOM 1652 C LYS A 107 -8.565 -50.013 -9.833 1.00 52.45 C ATOM 1653 O LYS A 107 -7.726 -50.641 -9.186 1.00 11.33 O ATOM 1654 CB LYS A 107 -9.920 -51.660 -11.195 1.00 63.10 C ATOM 1655 CG LYS A 107 -11.342 -51.364 -10.689 1.00 42.24 C ATOM 1656 CD LYS A 107 -11.415 -51.199 -9.169 1.00 71.43 C ATOM 1657 CE LYS A 107 -12.829 -50.873 -8.692 1.00 14.53 C ATOM 1658 NZ LYS A 107 -13.349 -49.610 -9.288 1.00 70.01 N1+ ATOM 0 H LYS A 107 -7.800 -51.693 -12.433 1.00 44.23 H new ATOM 0 HA LYS A 107 -9.500 -49.608 -11.702 1.00 71.41 H new ATOM 0 HB2 LYS A 107 -9.989 -52.084 -12.197 1.00 63.10 H new ATOM 0 HB3 LYS A 107 -9.476 -52.423 -10.556 1.00 63.10 H new ATOM 0 HG2 LYS A 107 -11.709 -50.455 -11.165 1.00 42.24 H new ATOM 0 HG3 LYS A 107 -12.006 -52.174 -10.993 1.00 42.24 H new ATOM 0 HD2 LYS A 107 -11.074 -52.116 -8.689 1.00 71.43 H new ATOM 0 HD3 LYS A 107 -10.736 -50.405 -8.858 1.00 71.43 H new ATOM 0 HE2 LYS A 107 -13.496 -51.696 -8.950 1.00 14.53 H new ATOM 0 HE3 LYS A 107 -12.833 -50.788 -7.605 1.00 14.53 H new ATOM 0 HZ1 LYS A 107 -14.242 -49.349 -8.824 1.00 70.01 H new ATOM 0 HZ2 LYS A 107 -12.653 -48.849 -9.152 1.00 70.01 H new ATOM 0 HZ3 LYS A 107 -13.515 -49.749 -10.305 1.00 70.01 H new ATOM 1672 N LEU A 108 -9.198 -48.947 -9.381 1.00 60.01 N ATOM 1673 CA LEU A 108 -8.910 -48.304 -8.111 1.00 60.42 C ATOM 1674 C LEU A 108 -10.218 -47.775 -7.527 1.00 41.03 C ATOM 1675 O LEU A 108 -11.257 -47.804 -8.200 1.00 12.22 O ATOM 1676 CB LEU A 108 -7.837 -47.208 -8.242 1.00 52.31 C ATOM 1677 CG LEU A 108 -6.586 -47.405 -7.357 1.00 61.41 C ATOM 1678 CD1 LEU A 108 -6.918 -47.263 -5.875 1.00 21.14 C ATOM 1679 CD2 LEU A 108 -5.944 -48.766 -7.619 1.00 11.12 C ATOM 0 H LEU A 108 -9.948 -48.491 -9.901 1.00 60.01 H new ATOM 0 HA LEU A 108 -8.484 -49.036 -7.425 1.00 60.42 H new ATOM 0 HB2 LEU A 108 -7.521 -47.154 -9.284 1.00 52.31 H new ATOM 0 HB3 LEU A 108 -8.289 -46.247 -7.996 1.00 52.31 H new ATOM 0 HG LEU A 108 -5.876 -46.621 -7.623 1.00 61.41 H new ATOM 0 HD11 LEU A 108 -6.014 -47.408 -5.284 1.00 21.14 H new ATOM 0 HD12 LEU A 108 -7.319 -46.267 -5.686 1.00 21.14 H new ATOM 0 HD13 LEU A 108 -7.659 -48.012 -5.595 1.00 21.14 H new ATOM 0 HD21 LEU A 108 -5.065 -48.882 -6.985 1.00 11.12 H new ATOM 0 HD22 LEU A 108 -6.661 -49.556 -7.394 1.00 11.12 H new ATOM 0 HD23 LEU A 108 -5.647 -48.833 -8.666 1.00 11.12 H new ATOM 1691 N SER A 109 -10.181 -47.357 -6.272 1.00 60.43 N ATOM 1692 CA SER A 109 -11.377 -47.130 -5.477 1.00 11.20 C ATOM 1693 C SER A 109 -12.163 -45.907 -5.962 1.00 20.34 C ATOM 1694 O SER A 109 -11.832 -45.299 -6.977 1.00 72.41 O ATOM 1695 CB SER A 109 -10.940 -46.885 -4.029 1.00 32.42 C ATOM 1696 OG SER A 109 -10.467 -48.071 -3.413 1.00 42.25 O ATOM 0 H SER A 109 -9.313 -47.164 -5.772 1.00 60.43 H new ATOM 0 HA SER A 109 -12.024 -48.002 -5.566 1.00 11.20 H new ATOM 0 HB2 SER A 109 -10.156 -46.128 -4.009 1.00 32.42 H new ATOM 0 HB3 SER A 109 -11.780 -46.489 -3.458 1.00 32.42 H new ATOM 0 HG SER A 109 -10.196 -47.875 -2.492 1.00 42.25 H new ATOM 1702 N GLN A 110 -13.241 -45.591 -5.261 1.00 61.23 N ATOM 1703 CA GLN A 110 -14.156 -44.545 -5.692 1.00 74.54 C ATOM 1704 C GLN A 110 -14.756 -43.842 -4.482 1.00 60.21 C ATOM 1705 O GLN A 110 -15.027 -44.480 -3.462 1.00 10.33 O ATOM 1706 CB GLN A 110 -15.267 -45.167 -6.548 1.00 11.44 C ATOM 1707 CG GLN A 110 -16.149 -44.150 -7.258 1.00 71.21 C ATOM 1708 CD GLN A 110 -17.286 -44.802 -8.024 1.00 13.41 C ATOM 1709 OE1 GLN A 110 -18.348 -44.053 -8.250 1.00 25.31 O flip ATOM 1710 NE2 GLN A 110 -17.194 -45.960 -8.440 1.00 4.42 N flip ATOM 0 H GLN A 110 -13.505 -46.046 -4.387 1.00 61.23 H new ATOM 0 HA GLN A 110 -13.612 -43.809 -6.284 1.00 74.54 H new ATOM 0 HB2 GLN A 110 -14.814 -45.821 -7.293 1.00 11.44 H new ATOM 0 HB3 GLN A 110 -15.893 -45.793 -5.912 1.00 11.44 H new ATOM 0 HG2 GLN A 110 -16.560 -43.456 -6.525 1.00 71.21 H new ATOM 0 HG3 GLN A 110 -15.540 -43.564 -7.946 1.00 71.21 H new ATOM 0 HE21 GLN A 110 -16.356 -46.507 -8.244 1.00 4.42 H new ATOM 0 HE22 GLN A 110 -17.956 -46.370 -8.980 1.00 4.42 H new ATOM 1719 N VAL A 111 -14.947 -42.532 -4.584 1.00 70.11 N ATOM 1720 CA VAL A 111 -15.614 -41.776 -3.528 1.00 60.35 C ATOM 1721 C VAL A 111 -16.749 -40.943 -4.112 1.00 22.32 C ATOM 1722 O VAL A 111 -16.585 -40.278 -5.140 1.00 33.31 O ATOM 1723 CB VAL A 111 -14.638 -40.860 -2.732 1.00 32.14 C ATOM 1724 CG1 VAL A 111 -13.682 -41.693 -1.878 1.00 22.02 C ATOM 1725 CG2 VAL A 111 -13.855 -39.941 -3.664 1.00 44.03 C ATOM 0 H VAL A 111 -14.651 -41.972 -5.383 1.00 70.11 H new ATOM 0 HA VAL A 111 -16.015 -42.505 -2.824 1.00 60.35 H new ATOM 0 HB VAL A 111 -15.239 -40.237 -2.070 1.00 32.14 H new ATOM 0 HG11 VAL A 111 -13.011 -41.030 -1.332 1.00 22.02 H new ATOM 0 HG12 VAL A 111 -14.255 -42.293 -1.171 1.00 22.02 H new ATOM 0 HG13 VAL A 111 -13.098 -42.351 -2.522 1.00 22.02 H new ATOM 0 HG21 VAL A 111 -13.183 -39.315 -3.077 1.00 44.03 H new ATOM 0 HG22 VAL A 111 -13.273 -40.542 -4.363 1.00 44.03 H new ATOM 0 HG23 VAL A 111 -14.548 -39.309 -4.219 1.00 44.03 H new ATOM 1735 N ILE A 112 -17.909 -41.017 -3.471 1.00 51.33 N ATOM 1736 CA ILE A 112 -19.089 -40.267 -3.888 1.00 62.14 C ATOM 1737 C ILE A 112 -19.592 -39.424 -2.722 1.00 15.21 C ATOM 1738 O ILE A 112 -19.667 -39.908 -1.589 1.00 22.02 O ATOM 1739 CB ILE A 112 -20.225 -41.212 -4.379 1.00 32.24 C ATOM 1740 CG1 ILE A 112 -19.762 -42.015 -5.608 1.00 3.11 C ATOM 1741 CG2 ILE A 112 -21.496 -40.421 -4.700 1.00 52.53 C ATOM 1742 CD1 ILE A 112 -20.794 -42.997 -6.131 1.00 61.34 C ATOM 0 H ILE A 112 -18.059 -41.599 -2.647 1.00 51.33 H new ATOM 0 HA ILE A 112 -18.805 -39.624 -4.721 1.00 62.14 H new ATOM 0 HB ILE A 112 -20.457 -41.910 -3.575 1.00 32.24 H new ATOM 0 HG12 ILE A 112 -19.501 -41.320 -6.406 1.00 3.11 H new ATOM 0 HG13 ILE A 112 -18.854 -42.561 -5.351 1.00 3.11 H new ATOM 0 HG21 ILE A 112 -22.274 -41.105 -5.041 1.00 52.53 H new ATOM 0 HG22 ILE A 112 -21.837 -39.901 -3.805 1.00 52.53 H new ATOM 0 HG23 ILE A 112 -21.284 -39.694 -5.483 1.00 52.53 H new ATOM 0 HD11 ILE A 112 -20.390 -43.522 -6.997 1.00 61.34 H new ATOM 0 HD12 ILE A 112 -21.039 -43.718 -5.351 1.00 61.34 H new ATOM 0 HD13 ILE A 112 -21.695 -42.457 -6.422 1.00 61.34 H new ATOM 1754 N GLY A 113 -19.933 -38.171 -2.998 1.00 41.41 N ATOM 1755 CA GLY A 113 -20.369 -37.265 -1.948 1.00 14.45 C ATOM 1756 C GLY A 113 -19.303 -36.242 -1.608 1.00 3.03 C ATOM 1757 O GLY A 113 -18.110 -36.486 -1.811 1.00 60.32 O ATOM 0 H GLY A 113 -19.916 -37.764 -3.933 1.00 41.41 H new ATOM 0 HA2 GLY A 113 -21.277 -36.752 -2.265 1.00 14.45 H new ATOM 0 HA3 GLY A 113 -20.621 -37.838 -1.055 1.00 14.45 H new ATOM 1761 N ALA A 114 -19.724 -35.096 -1.090 1.00 12.52 N ATOM 1762 CA ALA A 114 -18.807 -34.004 -0.799 1.00 24.52 C ATOM 1763 C ALA A 114 -18.190 -34.150 0.593 1.00 0.33 C ATOM 1764 O ALA A 114 -18.582 -33.455 1.531 1.00 33.13 O ATOM 1765 CB ALA A 114 -19.524 -32.663 -0.936 1.00 15.11 C ATOM 0 H ALA A 114 -20.699 -34.899 -0.862 1.00 12.52 H new ATOM 0 HA ALA A 114 -17.994 -34.042 -1.524 1.00 24.52 H new ATOM 0 HB1 ALA A 114 -18.828 -31.854 -0.716 1.00 15.11 H new ATOM 0 HB2 ALA A 114 -19.898 -32.553 -1.954 1.00 15.11 H new ATOM 0 HB3 ALA A 114 -20.359 -32.624 -0.236 1.00 15.11 H new ATOM 1771 N ASP A 115 -17.244 -35.078 0.730 1.00 64.24 N ATOM 1772 CA ASP A 115 -16.495 -35.237 1.978 1.00 1.22 C ATOM 1773 C ASP A 115 -15.001 -35.121 1.693 1.00 22.24 C ATOM 1774 O ASP A 115 -14.338 -36.101 1.325 1.00 33.32 O ATOM 1775 CB ASP A 115 -16.804 -36.579 2.660 1.00 64.14 C ATOM 1776 CG ASP A 115 -16.331 -36.607 4.111 1.00 52.23 C ATOM 1777 OD1 ASP A 115 -15.151 -36.932 4.361 1.00 51.14 O ATOM 1778 OD2 ASP A 115 -17.139 -36.288 5.012 1.00 30.13 O1- ATOM 0 H ASP A 115 -16.977 -35.731 -0.007 1.00 64.24 H new ATOM 0 HA ASP A 115 -16.802 -34.446 2.662 1.00 1.22 H new ATOM 0 HB2 ASP A 115 -17.878 -36.764 2.625 1.00 64.14 H new ATOM 0 HB3 ASP A 115 -16.323 -37.386 2.107 1.00 64.14 H new ATOM 1783 N ILE A 116 -14.481 -33.905 1.844 1.00 10.14 N ATOM 1784 CA ILE A 116 -13.090 -33.608 1.522 1.00 23.23 C ATOM 1785 C ILE A 116 -12.137 -34.476 2.348 1.00 50.32 C ATOM 1786 O ILE A 116 -11.053 -34.832 1.885 1.00 24.53 O ATOM 1787 CB ILE A 116 -12.768 -32.105 1.751 1.00 35.22 C ATOM 1788 CG1 ILE A 116 -11.330 -31.777 1.300 1.00 23.43 C ATOM 1789 CG2 ILE A 116 -12.985 -31.719 3.214 1.00 34.43 C ATOM 1790 CD1 ILE A 116 -11.086 -32.000 -0.179 1.00 62.15 C ATOM 0 H ILE A 116 -15.009 -33.104 2.191 1.00 10.14 H new ATOM 0 HA ILE A 116 -12.946 -33.837 0.466 1.00 23.23 H new ATOM 0 HB ILE A 116 -13.454 -31.515 1.143 1.00 35.22 H new ATOM 0 HG12 ILE A 116 -11.112 -30.737 1.542 1.00 23.43 H new ATOM 0 HG13 ILE A 116 -10.632 -32.390 1.870 1.00 23.43 H new ATOM 0 HG21 ILE A 116 -12.753 -30.663 3.350 1.00 34.43 H new ATOM 0 HG22 ILE A 116 -14.024 -31.901 3.488 1.00 34.43 H new ATOM 0 HG23 ILE A 116 -12.332 -32.318 3.849 1.00 34.43 H new ATOM 0 HD11 ILE A 116 -10.053 -31.748 -0.419 1.00 62.15 H new ATOM 0 HD12 ILE A 116 -11.271 -33.046 -0.425 1.00 62.15 H new ATOM 0 HD13 ILE A 116 -11.758 -31.367 -0.758 1.00 62.15 H new ATOM 1802 N SER A 117 -12.561 -34.836 3.558 1.00 64.32 N ATOM 1803 CA SER A 117 -11.732 -35.635 4.450 1.00 24.52 C ATOM 1804 C SER A 117 -11.558 -37.047 3.888 1.00 72.20 C ATOM 1805 O SER A 117 -10.461 -37.609 3.930 1.00 63.13 O ATOM 1806 CB SER A 117 -12.341 -35.683 5.860 1.00 2.24 C ATOM 1807 OG SER A 117 -11.473 -36.334 6.779 1.00 54.32 O ATOM 0 H SER A 117 -13.473 -34.586 3.940 1.00 64.32 H new ATOM 0 HA SER A 117 -10.750 -35.167 4.522 1.00 24.52 H new ATOM 0 HB2 SER A 117 -12.544 -34.669 6.205 1.00 2.24 H new ATOM 0 HB3 SER A 117 -13.297 -36.206 5.827 1.00 2.24 H new ATOM 0 HG SER A 117 -11.887 -36.347 7.667 1.00 54.32 H new ATOM 1813 N LYS A 118 -12.636 -37.611 3.351 1.00 24.02 N ATOM 1814 CA LYS A 118 -12.589 -38.944 2.758 1.00 23.25 C ATOM 1815 C LYS A 118 -11.800 -38.909 1.452 1.00 51.14 C ATOM 1816 O LYS A 118 -11.001 -39.809 1.174 1.00 44.54 O ATOM 1817 CB LYS A 118 -14.008 -39.487 2.517 1.00 55.14 C ATOM 1818 CG LYS A 118 -14.048 -40.905 1.938 1.00 21.34 C ATOM 1819 CD LYS A 118 -13.342 -41.914 2.848 1.00 32.24 C ATOM 1820 CE LYS A 118 -13.333 -43.315 2.244 1.00 45.55 C ATOM 1821 NZ LYS A 118 -14.703 -43.884 2.124 1.00 20.35 N1+ ATOM 0 H LYS A 118 -13.553 -37.166 3.314 1.00 24.02 H new ATOM 0 HA LYS A 118 -12.086 -39.614 3.455 1.00 23.25 H new ATOM 0 HB2 LYS A 118 -14.554 -39.476 3.460 1.00 55.14 H new ATOM 0 HB3 LYS A 118 -14.532 -38.814 1.838 1.00 55.14 H new ATOM 0 HG2 LYS A 118 -15.085 -41.209 1.794 1.00 21.34 H new ATOM 0 HG3 LYS A 118 -13.575 -40.909 0.956 1.00 21.34 H new ATOM 0 HD2 LYS A 118 -12.317 -41.588 3.025 1.00 32.24 H new ATOM 0 HD3 LYS A 118 -13.840 -41.940 3.817 1.00 32.24 H new ATOM 0 HE2 LYS A 118 -12.868 -43.281 1.259 1.00 45.55 H new ATOM 0 HE3 LYS A 118 -12.722 -43.972 2.863 1.00 45.55 H new ATOM 0 HZ1 LYS A 118 -14.642 -44.872 1.805 1.00 20.35 H new ATOM 0 HZ2 LYS A 118 -15.176 -43.847 3.049 1.00 20.35 H new ATOM 0 HZ3 LYS A 118 -15.249 -43.331 1.434 1.00 20.35 H new ATOM 1835 N ILE A 119 -12.017 -37.858 0.664 1.00 22.14 N ATOM 1836 CA ILE A 119 -11.291 -37.684 -0.592 1.00 2.21 C ATOM 1837 C ILE A 119 -9.782 -37.631 -0.340 1.00 62.22 C ATOM 1838 O ILE A 119 -9.018 -38.426 -0.896 1.00 24.10 O ATOM 1839 CB ILE A 119 -11.737 -36.402 -1.339 1.00 43.35 C ATOM 1840 CG1 ILE A 119 -13.241 -36.462 -1.661 1.00 44.33 C ATOM 1841 CG2 ILE A 119 -10.917 -36.212 -2.617 1.00 11.44 C ATOM 1842 CD1 ILE A 119 -13.774 -35.217 -2.344 1.00 40.14 C ATOM 0 H ILE A 119 -12.687 -37.117 0.872 1.00 22.14 H new ATOM 0 HA ILE A 119 -11.524 -38.544 -1.220 1.00 2.21 H new ATOM 0 HB ILE A 119 -11.560 -35.545 -0.690 1.00 43.35 H new ATOM 0 HG12 ILE A 119 -13.432 -37.325 -2.300 1.00 44.33 H new ATOM 0 HG13 ILE A 119 -13.794 -36.622 -0.736 1.00 44.33 H new ATOM 0 HG21 ILE A 119 -11.244 -35.307 -3.128 1.00 11.44 H new ATOM 0 HG22 ILE A 119 -9.861 -36.123 -2.362 1.00 11.44 H new ATOM 0 HG23 ILE A 119 -11.061 -37.071 -3.273 1.00 11.44 H new ATOM 0 HD11 ILE A 119 -14.840 -35.336 -2.538 1.00 40.14 H new ATOM 0 HD12 ILE A 119 -13.617 -34.353 -1.699 1.00 40.14 H new ATOM 0 HD13 ILE A 119 -13.249 -35.066 -3.287 1.00 40.14 H new ATOM 1854 N ILE A 120 -9.361 -36.704 0.524 1.00 71.14 N ATOM 1855 CA ILE A 120 -7.943 -36.542 0.846 1.00 1.52 C ATOM 1856 C ILE A 120 -7.419 -37.820 1.503 1.00 44.53 C ATOM 1857 O ILE A 120 -6.272 -38.228 1.269 1.00 2.32 O ATOM 1858 CB ILE A 120 -7.696 -35.295 1.758 1.00 41.41 C ATOM 1859 CG1 ILE A 120 -6.200 -34.889 1.782 1.00 72.14 C ATOM 1860 CG2 ILE A 120 -8.213 -35.532 3.176 1.00 5.22 C ATOM 1861 CD1 ILE A 120 -5.316 -35.717 2.700 1.00 43.13 C ATOM 0 H ILE A 120 -9.980 -36.057 1.011 1.00 71.14 H new ATOM 0 HA ILE A 120 -7.395 -36.368 -0.080 1.00 1.52 H new ATOM 0 HB ILE A 120 -8.258 -34.467 1.325 1.00 41.41 H new ATOM 0 HG12 ILE A 120 -5.806 -34.956 0.768 1.00 72.14 H new ATOM 0 HG13 ILE A 120 -6.129 -33.844 2.083 1.00 72.14 H new ATOM 0 HG21 ILE A 120 -8.026 -34.647 3.784 1.00 5.22 H new ATOM 0 HG22 ILE A 120 -9.284 -35.731 3.144 1.00 5.22 H new ATOM 0 HG23 ILE A 120 -7.698 -36.388 3.613 1.00 5.22 H new ATOM 0 HD11 ILE A 120 -4.290 -35.352 2.643 1.00 43.13 H new ATOM 0 HD12 ILE A 120 -5.675 -35.632 3.725 1.00 43.13 H new ATOM 0 HD13 ILE A 120 -5.347 -36.762 2.390 1.00 43.13 H new ATOM 1873 N SER A 121 -8.278 -38.460 2.304 1.00 33.33 N ATOM 1874 CA SER A 121 -7.939 -39.725 2.942 1.00 32.12 C ATOM 1875 C SER A 121 -7.477 -40.725 1.895 1.00 12.31 C ATOM 1876 O SER A 121 -6.395 -41.294 2.012 1.00 23.30 O ATOM 1877 CB SER A 121 -9.143 -40.294 3.706 1.00 43.12 C ATOM 1878 OG SER A 121 -8.830 -41.533 4.330 1.00 42.33 O ATOM 0 H SER A 121 -9.213 -38.117 2.523 1.00 33.33 H new ATOM 0 HA SER A 121 -7.133 -39.544 3.653 1.00 32.12 H new ATOM 0 HB2 SER A 121 -9.467 -39.578 4.461 1.00 43.12 H new ATOM 0 HB3 SER A 121 -9.978 -40.433 3.019 1.00 43.12 H new ATOM 0 HG SER A 121 -8.443 -41.365 5.215 1.00 42.33 H new ATOM 1884 N GLU A 122 -8.288 -40.906 0.857 1.00 14.44 N ATOM 1885 CA GLU A 122 -7.965 -41.853 -0.197 1.00 72.13 C ATOM 1886 C GLU A 122 -6.747 -41.404 -0.992 1.00 73.04 C ATOM 1887 O GLU A 122 -5.911 -42.228 -1.348 1.00 20.21 O ATOM 1888 CB GLU A 122 -9.167 -42.093 -1.118 1.00 32.23 C ATOM 1889 CG GLU A 122 -10.204 -43.037 -0.517 1.00 71.24 C ATOM 1890 CD GLU A 122 -9.587 -44.367 -0.099 1.00 22.22 C ATOM 1891 OE1 GLU A 122 -9.401 -44.588 1.118 1.00 61.24 O ATOM 1892 OE2 GLU A 122 -9.256 -45.181 -0.988 1.00 70.43 O1- ATOM 0 H GLU A 122 -9.170 -40.410 0.726 1.00 14.44 H new ATOM 0 HA GLU A 122 -7.718 -42.801 0.280 1.00 72.13 H new ATOM 0 HB2 GLU A 122 -9.641 -41.138 -1.342 1.00 32.23 H new ATOM 0 HB3 GLU A 122 -8.815 -42.504 -2.064 1.00 32.23 H new ATOM 0 HG2 GLU A 122 -10.667 -42.564 0.349 1.00 71.24 H new ATOM 0 HG3 GLU A 122 -10.996 -43.217 -1.244 1.00 71.24 H new ATOM 1899 N ILE A 123 -6.620 -40.102 -1.245 1.00 11.43 N ATOM 1900 CA ILE A 123 -5.455 -39.595 -1.972 1.00 32.41 C ATOM 1901 C ILE A 123 -4.161 -40.053 -1.289 1.00 5.24 C ATOM 1902 O ILE A 123 -3.322 -40.729 -1.904 1.00 71.51 O ATOM 1903 CB ILE A 123 -5.464 -38.047 -2.092 1.00 73.41 C ATOM 1904 CG1 ILE A 123 -6.673 -37.579 -2.920 1.00 51.34 C ATOM 1905 CG2 ILE A 123 -4.165 -37.548 -2.719 1.00 71.34 C ATOM 1906 CD1 ILE A 123 -6.867 -36.078 -2.928 1.00 15.35 C ATOM 0 H ILE A 123 -7.295 -39.390 -0.964 1.00 11.43 H new ATOM 0 HA ILE A 123 -5.504 -40.005 -2.981 1.00 32.41 H new ATOM 0 HB ILE A 123 -5.546 -37.626 -1.090 1.00 73.41 H new ATOM 0 HG12 ILE A 123 -6.554 -37.926 -3.947 1.00 51.34 H new ATOM 0 HG13 ILE A 123 -7.574 -38.050 -2.527 1.00 51.34 H new ATOM 0 HG21 ILE A 123 -4.191 -36.461 -2.794 1.00 71.34 H new ATOM 0 HG22 ILE A 123 -3.322 -37.848 -2.097 1.00 71.34 H new ATOM 0 HG23 ILE A 123 -4.053 -37.978 -3.714 1.00 71.34 H new ATOM 0 HD11 ILE A 123 -7.739 -35.827 -3.533 1.00 15.35 H new ATOM 0 HD12 ILE A 123 -7.019 -35.725 -1.908 1.00 15.35 H new ATOM 0 HD13 ILE A 123 -5.983 -35.599 -3.349 1.00 15.35 H new ATOM 1918 N ASN A 124 -4.023 -39.740 0.000 1.00 61.24 N ATOM 1919 CA ASN A 124 -2.810 -40.107 0.734 1.00 42.31 C ATOM 1920 C ASN A 124 -2.765 -41.618 0.975 1.00 20.40 C ATOM 1921 O ASN A 124 -1.689 -42.202 1.084 1.00 70.22 O ATOM 1922 CB ASN A 124 -2.690 -39.344 2.069 1.00 5.10 C ATOM 1923 CG ASN A 124 -3.616 -39.859 3.161 1.00 40.22 C ATOM 1924 OD1 ASN A 124 -4.787 -39.260 3.287 1.00 31.24 O flip ATOM 1925 ND2 ASN A 124 -3.269 -40.779 3.903 1.00 15.41 N flip ATOM 0 H ASN A 124 -4.723 -39.242 0.550 1.00 61.24 H new ATOM 0 HA ASN A 124 -1.958 -39.821 0.117 1.00 42.31 H new ATOM 0 HB2 ASN A 124 -1.660 -39.407 2.420 1.00 5.10 H new ATOM 0 HB3 ASN A 124 -2.903 -38.290 1.894 1.00 5.10 H new ATOM 0 HD21 ASN A 124 -2.357 -41.219 3.778 1.00 15.41 H new ATOM 0 HD22 ASN A 124 -3.893 -41.101 4.643 1.00 15.41 H new ATOM 1932 N ASN A 125 -3.945 -42.239 1.036 1.00 31.14 N ATOM 1933 CA ASN A 125 -4.069 -43.689 1.249 1.00 72.20 C ATOM 1934 C ASN A 125 -3.666 -44.461 -0.009 1.00 71.23 C ATOM 1935 O ASN A 125 -3.208 -45.600 0.064 1.00 34.51 O ATOM 1936 CB ASN A 125 -5.515 -44.046 1.631 1.00 65.54 C ATOM 1937 CG ASN A 125 -5.710 -45.518 1.960 1.00 44.14 C ATOM 1938 OD1 ASN A 125 -4.811 -46.176 2.482 1.00 32.44 O ATOM 1939 ND2 ASN A 125 -6.893 -46.046 1.667 1.00 44.23 N ATOM 0 H ASN A 125 -4.839 -41.757 0.940 1.00 31.14 H new ATOM 0 HA ASN A 125 -3.399 -43.971 2.061 1.00 72.20 H new ATOM 0 HB2 ASN A 125 -5.813 -43.447 2.491 1.00 65.54 H new ATOM 0 HB3 ASN A 125 -6.177 -43.775 0.809 1.00 65.54 H new ATOM 0 HD21 ASN A 125 -7.079 -47.027 1.875 1.00 44.23 H new ATOM 0 HD22 ASN A 125 -7.615 -45.470 1.234 1.00 44.23 H new ATOM 1946 N ASN A 126 -3.849 -43.836 -1.167 1.00 24.21 N ATOM 1947 CA ASN A 126 -3.504 -44.461 -2.441 1.00 34.20 C ATOM 1948 C ASN A 126 -2.031 -44.226 -2.761 1.00 61.32 C ATOM 1949 O ASN A 126 -1.364 -45.097 -3.325 1.00 63.21 O ATOM 1950 CB ASN A 126 -4.391 -43.926 -3.579 1.00 71.20 C ATOM 1951 CG ASN A 126 -5.837 -44.415 -3.519 1.00 53.32 C ATOM 1952 OD1 ASN A 126 -6.376 -44.602 -2.321 1.00 60.30 O flip ATOM 1953 ND2 ASN A 126 -6.474 -44.601 -4.554 1.00 41.12 N flip ATOM 0 H ASN A 126 -4.235 -42.896 -1.251 1.00 24.21 H new ATOM 0 HA ASN A 126 -3.680 -45.533 -2.352 1.00 34.20 H new ATOM 0 HB2 ASN A 126 -4.385 -42.836 -3.550 1.00 71.20 H new ATOM 0 HB3 ASN A 126 -3.957 -44.222 -4.534 1.00 71.20 H new ATOM 0 HD21 ASN A 126 -6.031 -44.448 -5.460 1.00 41.12 H new ATOM 0 HD22 ASN A 126 -7.446 -44.908 -4.507 1.00 41.12 H new ATOM 1960 N ILE A 127 -1.528 -43.040 -2.415 1.00 24.11 N ATOM 1961 CA ILE A 127 -0.103 -42.742 -2.575 1.00 45.52 C ATOM 1962 C ILE A 127 0.727 -43.592 -1.608 1.00 24.03 C ATOM 1963 O ILE A 127 1.748 -44.174 -1.985 1.00 24.55 O ATOM 1964 CB ILE A 127 0.208 -41.239 -2.334 1.00 23.43 C ATOM 1965 CG1 ILE A 127 -0.566 -40.358 -3.329 1.00 53.10 C ATOM 1966 CG2 ILE A 127 1.711 -40.972 -2.447 1.00 51.22 C ATOM 1967 CD1 ILE A 127 -0.352 -38.873 -3.120 1.00 54.51 C ATOM 0 H ILE A 127 -2.080 -42.276 -2.025 1.00 24.11 H new ATOM 0 HA ILE A 127 0.162 -42.982 -3.605 1.00 45.52 H new ATOM 0 HB ILE A 127 -0.113 -40.985 -1.324 1.00 23.43 H new ATOM 0 HG12 ILE A 127 -0.266 -40.620 -4.343 1.00 53.10 H new ATOM 0 HG13 ILE A 127 -1.630 -40.578 -3.245 1.00 53.10 H new ATOM 0 HG21 ILE A 127 1.906 -39.914 -2.275 1.00 51.22 H new ATOM 0 HG22 ILE A 127 2.243 -41.565 -1.703 1.00 51.22 H new ATOM 0 HG23 ILE A 127 2.055 -41.247 -3.444 1.00 51.22 H new ATOM 0 HD11 ILE A 127 -0.929 -38.315 -3.858 1.00 54.51 H new ATOM 0 HD12 ILE A 127 -0.679 -38.596 -2.118 1.00 54.51 H new ATOM 0 HD13 ILE A 127 0.706 -38.638 -3.234 1.00 54.51 H new ATOM 1979 N ASN A 128 0.270 -43.664 -0.364 1.00 64.33 N ATOM 1980 CA ASN A 128 0.963 -44.412 0.681 1.00 71.43 C ATOM 1981 C ASN A 128 0.193 -45.691 1.005 1.00 23.15 C ATOM 1982 O ASN A 128 0.537 -46.757 0.448 1.00 65.33 O ATOM 1983 CB ASN A 128 1.123 -43.551 1.946 1.00 24.12 C ATOM 1984 CG ASN A 128 1.940 -42.293 1.701 1.00 23.51 C ATOM 1985 OD1 ASN A 128 3.164 -42.286 1.855 1.00 5.34 O ATOM 1986 ND2 ASN A 128 1.266 -41.216 1.318 1.00 22.35 N ATOM 1987 OXT ASN A 128 -0.763 -45.629 1.797 1.00 0.00 O1- ATOM 0 H ASN A 128 -0.587 -43.208 -0.051 1.00 64.33 H new ATOM 0 HA ASN A 128 1.956 -44.678 0.319 1.00 71.43 H new ATOM 0 HB2 ASN A 128 0.137 -43.272 2.318 1.00 24.12 H new ATOM 0 HB3 ASN A 128 1.601 -44.144 2.726 1.00 24.12 H new ATOM 0 HD21 ASN A 128 1.760 -40.342 1.140 1.00 22.35 H new ATOM 0 HD22 ASN A 128 0.254 -41.262 1.202 1.00 22.35 H new TER 1994 ASN A 128