USER MOD reduce.3.24.130724 H: found=0, std=0, add=1380, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1376 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 106 GLN : amide:sc= -3.81! C(o=-5.4!,f=-7.7!) USER MOD Set 1.2: A 108 TYR OH : rot 69:sc= -1.6! USER MOD Set 2.1: A 92 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.34) USER MOD Set 2.2: A 111 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 49 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 22 CYS SG : rot 123:sc= -2.38! USER MOD Set 4.2: A 26 CYS SG : rot 92:sc= -1.8! USER MOD Single : A 1 SER N :NH3+ -179:sc= 0 (180deg=-0.0015) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 LYS NZ :NH3+ -160:sc= -0.0956 (180deg=-0.727) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.522 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= -0.0519 USER MOD Single : A 14 ASN : amide:sc= -1.81! C(o=-1.8!,f=-4.9!) USER MOD Single : A 16 GLN : amide:sc= -0.413 X(o=-0.41,f=0) USER MOD Single : A 20 TYR OH : rot -142:sc= 0.152 USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 8:sc= -2.56! USER MOD Single : A 37 ASN : amide:sc= -6.07! C(o=-6.1!,f=-13!) USER MOD Single : A 38 SER OG : rot -150:sc= -1.05! USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -1.44 K(o=-1.4,f=0.55) USER MOD Single : A 55 SER OG : rot -87:sc= 0.92 USER MOD Single : A 57 HIS : no HD1:sc= -1.2 K(o=-1.2,f=-5.5!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 66 TYR OH : rot 180:sc= -0.132 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 ASN : amide:sc= -0.872! C(o=-0.87!,f=-3.4!) USER MOD Single : A 81 SER OG : rot -85:sc= -0.0565 USER MOD Single : A 82 CYS SG : rot 24:sc= 0.236 USER MOD Single : A 86 HIS : no HD1:sc= -0.0948 X(o=-0.095,f=-0.27) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -2.48 X(o=-2.5,f=-2.4) USER MOD Single : A 100 LYS NZ :NH3+ 178:sc= -1.74 (180deg=-1.79) USER MOD Single : A 104 ASN : amide:sc= -1.35 K(o=-1.3,f=-3.2!) USER MOD Single : A 107 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0202 USER MOD Single : A 114 CYS SG : rot 140:sc= -0.729 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 GLN : amide:sc= -0.253 K(o=-0.25,f=-0.77) USER MOD Single : A 122 HIS : no HD1:sc= -0.455 X(o=-0.45,f=-0.23) USER MOD Single : A 127 HIS : no HD1:sc= -2.26 K(o=-2.3,f=-5.4!) USER MOD Single : A 128 SER OG : rot -74:sc= -1.12! USER MOD Single : A 129 CYS SG : rot 47:sc= -1.46 USER MOD Single : A 130 LYS NZ :NH3+ 158:sc= -0.463 (180deg=-1.3!) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 TYR OH : rot 180:sc= -0.106 USER MOD Single : A 143 ASN : amide:sc= -0.847 X(o=-0.85,f=-0.35) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 GLN : amide:sc= -0.805 X(o=-0.81,f=-0.41) USER MOD Single : A 149 TYR OH : rot 180:sc= -1.36 USER MOD Single : A 153 LYS NZ :NH3+ -136:sc= -1.65 (180deg=-3.02!) USER MOD Single : A 154 LYS NZ :NH3+ -157:sc= 0.578 (180deg=-0.524) USER MOD Single : A 156 TYR OH : rot 132:sc= 0.314 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 SER OG : rot 180:sc= -0.394 USER MOD Single : A 170 GLN : amide:sc= -0.798 K(o=-0.8,f=-0.087) USER MOD Single : A 171 SER OG : rot 47:sc= 0.0547 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 18.838 -20.349 8.586 1.00 4.50 N ATOM 2 CA SER A 1 18.359 -21.028 7.348 1.00 4.52 C ATOM 3 C SER A 1 17.337 -20.135 6.642 1.00 3.57 C ATOM 4 O SER A 1 17.400 -19.930 5.446 1.00 3.03 O ATOM 5 CB SER A 1 17.704 -22.361 7.715 1.00 4.81 C ATOM 6 OG SER A 1 17.311 -23.035 6.526 1.00 5.28 O ATOM 0 H1 SER A 1 19.546 -20.947 9.058 1.00 4.50 H new ATOM 0 H2 SER A 1 19.268 -19.435 8.337 1.00 4.50 H new ATOM 0 H3 SER A 1 18.035 -20.190 9.228 1.00 4.50 H new ATOM 0 HA SER A 1 19.204 -21.211 6.684 1.00 4.52 H new ATOM 0 HB2 SER A 1 18.401 -22.978 8.283 1.00 4.81 H new ATOM 0 HB3 SER A 1 16.837 -22.190 8.353 1.00 4.81 H new ATOM 0 HG SER A 1 16.892 -23.890 6.758 1.00 5.28 H new ATOM 14 N LYS A 2 16.393 -19.605 7.372 1.00 3.60 N ATOM 15 CA LYS A 2 15.366 -18.727 6.743 1.00 3.08 C ATOM 16 C LYS A 2 16.059 -17.585 5.998 1.00 2.11 C ATOM 17 O LYS A 2 16.693 -16.740 6.598 1.00 2.12 O ATOM 18 CB LYS A 2 14.452 -18.155 7.827 1.00 3.28 C ATOM 19 CG LYS A 2 13.760 -19.301 8.567 1.00 3.95 C ATOM 20 CD LYS A 2 12.798 -18.727 9.610 1.00 4.66 C ATOM 21 CE LYS A 2 12.211 -19.868 10.443 1.00 5.66 C ATOM 22 NZ LYS A 2 11.583 -20.871 9.538 1.00 5.96 N ATOM 0 H LYS A 2 16.289 -19.742 8.377 1.00 3.60 H new ATOM 0 HA LYS A 2 14.771 -19.308 6.039 1.00 3.08 H new ATOM 0 HB2 LYS A 2 15.032 -17.554 8.527 1.00 3.28 H new ATOM 0 HB3 LYS A 2 13.709 -17.495 7.380 1.00 3.28 H new ATOM 0 HG2 LYS A 2 13.216 -19.928 7.861 1.00 3.95 H new ATOM 0 HG3 LYS A 2 14.502 -19.936 9.051 1.00 3.95 H new ATOM 0 HD2 LYS A 2 13.323 -18.023 10.256 1.00 4.66 H new ATOM 0 HD3 LYS A 2 11.999 -18.173 9.118 1.00 4.66 H new ATOM 0 HE2 LYS A 2 12.994 -20.339 11.038 1.00 5.66 H new ATOM 0 HE3 LYS A 2 11.471 -19.479 11.142 1.00 5.66 H new ATOM 0 HZ1 LYS A 2 10.907 -21.450 10.077 1.00 5.96 H new ATOM 0 HZ2 LYS A 2 11.083 -20.380 8.770 1.00 5.96 H new ATOM 0 HZ3 LYS A 2 12.320 -21.484 9.135 1.00 5.96 H new ATOM 36 N THR A 3 15.906 -17.516 4.702 1.00 1.72 N ATOM 37 CA THR A 3 16.515 -16.385 3.941 1.00 1.18 C ATOM 38 C THR A 3 15.484 -15.258 3.896 1.00 1.02 C ATOM 39 O THR A 3 14.809 -15.017 4.878 1.00 1.63 O ATOM 40 CB THR A 3 16.899 -16.836 2.527 1.00 1.48 C ATOM 41 OG1 THR A 3 15.738 -16.855 1.707 1.00 2.13 O ATOM 42 CG2 THR A 3 17.508 -18.237 2.583 1.00 2.22 C ATOM 0 H THR A 3 15.388 -18.191 4.139 1.00 1.72 H new ATOM 0 HA THR A 3 17.428 -16.040 4.426 1.00 1.18 H new ATOM 0 HB THR A 3 17.629 -16.142 2.110 1.00 1.48 H new ATOM 0 HG1 THR A 3 15.981 -17.141 0.802 1.00 2.13 H new ATOM 0 HG21 THR A 3 17.780 -18.556 1.577 1.00 2.22 H new ATOM 0 HG22 THR A 3 18.398 -18.222 3.212 1.00 2.22 H new ATOM 0 HG23 THR A 3 16.781 -18.934 3.000 1.00 2.22 H new ATOM 50 N GLY A 4 15.320 -14.560 2.804 1.00 0.52 N ATOM 51 CA GLY A 4 14.290 -13.483 2.826 1.00 0.30 C ATOM 52 C GLY A 4 14.306 -12.618 1.564 1.00 0.41 C ATOM 53 O GLY A 4 15.031 -12.853 0.618 1.00 0.81 O ATOM 0 H GLY A 4 15.832 -14.681 1.930 1.00 0.52 H new ATOM 0 HA2 GLY A 4 13.304 -13.933 2.940 1.00 0.30 H new ATOM 0 HA3 GLY A 4 14.453 -12.849 3.697 1.00 0.30 H new ATOM 57 N GLY A 5 13.490 -11.600 1.587 1.00 0.01 N ATOM 58 CA GLY A 5 13.394 -10.652 0.441 1.00 0.01 C ATOM 59 C GLY A 5 14.556 -9.658 0.504 1.00 0.01 C ATOM 60 O GLY A 5 15.170 -9.474 1.536 1.00 0.01 O ATOM 0 H GLY A 5 12.873 -11.381 2.369 1.00 0.01 H new ATOM 0 HA2 GLY A 5 13.420 -11.200 -0.501 1.00 0.01 H new ATOM 0 HA3 GLY A 5 12.443 -10.120 0.474 1.00 0.01 H new ATOM 64 N LYS A 6 14.869 -9.017 -0.591 1.00 0.00 N ATOM 65 CA LYS A 6 15.999 -8.038 -0.585 1.00 0.01 C ATOM 66 C LYS A 6 15.720 -6.902 -1.567 1.00 0.01 C ATOM 67 O LYS A 6 15.294 -7.118 -2.690 1.00 0.00 O ATOM 68 CB LYS A 6 17.310 -8.738 -0.959 1.00 0.02 C ATOM 69 CG LYS A 6 18.429 -7.702 -1.096 1.00 0.02 C ATOM 70 CD LYS A 6 19.787 -8.407 -1.081 1.00 0.02 C ATOM 71 CE LYS A 6 19.812 -9.498 -2.154 1.00 0.02 C ATOM 72 NZ LYS A 6 21.222 -9.899 -2.422 1.00 0.02 N ATOM 0 H LYS A 6 14.394 -9.127 -1.487 1.00 0.00 H new ATOM 0 HA LYS A 6 16.093 -7.624 0.419 1.00 0.01 H new ATOM 0 HB2 LYS A 6 17.572 -9.471 -0.196 1.00 0.02 H new ATOM 0 HB3 LYS A 6 17.188 -9.282 -1.896 1.00 0.02 H new ATOM 0 HG2 LYS A 6 18.309 -7.143 -2.024 1.00 0.02 H new ATOM 0 HG3 LYS A 6 18.373 -6.982 -0.280 1.00 0.02 H new ATOM 0 HD2 LYS A 6 20.584 -7.686 -1.263 1.00 0.02 H new ATOM 0 HD3 LYS A 6 19.970 -8.844 -0.099 1.00 0.02 H new ATOM 0 HE2 LYS A 6 19.234 -10.361 -1.824 1.00 0.02 H new ATOM 0 HE3 LYS A 6 19.346 -9.133 -3.069 1.00 0.02 H new ATOM 0 HZ1 LYS A 6 21.239 -10.640 -3.151 1.00 0.02 H new ATOM 0 HZ2 LYS A 6 21.760 -9.074 -2.754 1.00 0.02 H new ATOM 0 HZ3 LYS A 6 21.652 -10.263 -1.548 1.00 0.02 H new ATOM 86 N ILE A 7 15.986 -5.689 -1.137 1.00 0.02 N ATOM 87 CA ILE A 7 15.774 -4.485 -2.001 1.00 0.00 C ATOM 88 C ILE A 7 17.041 -3.617 -1.978 1.00 0.02 C ATOM 89 O ILE A 7 17.669 -3.451 -0.949 1.00 0.01 O ATOM 90 CB ILE A 7 14.559 -3.707 -1.489 1.00 0.02 C ATOM 91 CG1 ILE A 7 14.355 -2.449 -2.335 1.00 0.02 C ATOM 92 CG2 ILE A 7 14.788 -3.303 -0.038 1.00 0.01 C ATOM 93 CD1 ILE A 7 13.010 -1.811 -1.978 1.00 0.02 C ATOM 0 H ILE A 7 16.348 -5.481 -0.206 1.00 0.02 H new ATOM 0 HA ILE A 7 15.582 -4.784 -3.031 1.00 0.00 H new ATOM 0 HB ILE A 7 13.674 -4.339 -1.560 1.00 0.02 H new ATOM 0 HG12 ILE A 7 15.165 -1.742 -2.156 1.00 0.02 H new ATOM 0 HG13 ILE A 7 14.381 -2.702 -3.395 1.00 0.02 H new ATOM 0 HG21 ILE A 7 13.923 -2.749 0.326 1.00 0.01 H new ATOM 0 HG22 ILE A 7 14.929 -4.196 0.570 1.00 0.01 H new ATOM 0 HG23 ILE A 7 15.676 -2.674 0.029 1.00 0.01 H new ATOM 0 HD11 ILE A 7 12.862 -0.914 -2.579 1.00 0.02 H new ATOM 0 HD12 ILE A 7 12.206 -2.520 -2.179 1.00 0.02 H new ATOM 0 HD13 ILE A 7 13.003 -1.544 -0.921 1.00 0.02 H new ATOM 105 N SER A 8 17.417 -3.059 -3.109 1.00 0.02 N ATOM 106 CA SER A 8 18.644 -2.191 -3.174 1.00 0.02 C ATOM 107 C SER A 8 18.276 -0.791 -3.683 1.00 0.01 C ATOM 108 O SER A 8 17.612 -0.639 -4.689 1.00 0.02 O ATOM 109 CB SER A 8 19.681 -2.816 -4.115 1.00 0.30 C ATOM 110 OG SER A 8 19.673 -4.227 -3.949 1.00 0.39 O ATOM 0 H SER A 8 16.924 -3.168 -3.995 1.00 0.02 H new ATOM 0 HA SER A 8 19.065 -2.111 -2.172 1.00 0.02 H new ATOM 0 HB2 SER A 8 19.453 -2.558 -5.149 1.00 0.30 H new ATOM 0 HB3 SER A 8 20.672 -2.418 -3.899 1.00 0.30 H new ATOM 0 HG SER A 8 20.333 -4.631 -4.550 1.00 0.39 H new ATOM 116 N PHE A 9 18.723 0.236 -2.991 1.00 0.02 N ATOM 117 CA PHE A 9 18.432 1.647 -3.413 1.00 0.01 C ATOM 118 C PHE A 9 19.729 2.316 -3.894 1.00 0.01 C ATOM 119 O PHE A 9 20.782 2.113 -3.317 1.00 0.02 O ATOM 120 CB PHE A 9 17.883 2.432 -2.215 1.00 0.02 C ATOM 121 CG PHE A 9 16.905 1.579 -1.446 1.00 0.01 C ATOM 122 CD1 PHE A 9 17.376 0.664 -0.499 1.00 0.01 C ATOM 123 CD2 PHE A 9 15.531 1.708 -1.676 1.00 0.01 C ATOM 124 CE1 PHE A 9 16.471 -0.124 0.221 1.00 0.02 C ATOM 125 CE2 PHE A 9 14.626 0.919 -0.957 1.00 0.02 C ATOM 126 CZ PHE A 9 15.095 0.004 -0.008 1.00 0.02 C ATOM 0 H PHE A 9 19.283 0.154 -2.143 1.00 0.02 H new ATOM 0 HA PHE A 9 17.699 1.639 -4.220 1.00 0.01 H new ATOM 0 HB2 PHE A 9 18.702 2.738 -1.564 1.00 0.02 H new ATOM 0 HB3 PHE A 9 17.392 3.342 -2.560 1.00 0.02 H new ATOM 0 HD1 PHE A 9 18.437 0.566 -0.324 1.00 0.01 H new ATOM 0 HD2 PHE A 9 15.169 2.416 -2.407 1.00 0.01 H new ATOM 0 HE1 PHE A 9 16.833 -0.831 0.953 1.00 0.02 H new ATOM 0 HE2 PHE A 9 13.565 1.016 -1.135 1.00 0.02 H new ATOM 0 HZ PHE A 9 14.396 -0.604 0.548 1.00 0.02 H new ATOM 136 N TYR A 10 19.664 3.110 -4.943 1.00 0.02 N ATOM 137 CA TYR A 10 20.897 3.794 -5.467 1.00 0.01 C ATOM 138 C TYR A 10 20.683 5.313 -5.457 1.00 0.02 C ATOM 139 O TYR A 10 19.618 5.804 -5.781 1.00 0.01 O ATOM 140 CB TYR A 10 21.161 3.340 -6.906 1.00 0.02 C ATOM 141 CG TYR A 10 21.040 1.834 -7.005 1.00 0.02 C ATOM 142 CD1 TYR A 10 19.779 1.226 -6.936 1.00 0.02 C ATOM 143 CD2 TYR A 10 22.186 1.047 -7.172 1.00 0.00 C ATOM 144 CE1 TYR A 10 19.666 -0.166 -7.034 1.00 0.02 C ATOM 145 CE2 TYR A 10 22.071 -0.345 -7.269 1.00 0.02 C ATOM 146 CZ TYR A 10 20.812 -0.951 -7.200 1.00 0.00 C ATOM 147 OH TYR A 10 20.700 -2.323 -7.295 1.00 0.02 O ATOM 0 H TYR A 10 18.808 3.314 -5.460 1.00 0.02 H new ATOM 0 HA TYR A 10 21.747 3.536 -4.836 1.00 0.01 H new ATOM 0 HB2 TYR A 10 20.450 3.815 -7.582 1.00 0.02 H new ATOM 0 HB3 TYR A 10 22.157 3.654 -7.218 1.00 0.02 H new ATOM 0 HD1 TYR A 10 18.894 1.832 -6.807 1.00 0.02 H new ATOM 0 HD2 TYR A 10 23.158 1.514 -7.226 1.00 0.00 H new ATOM 0 HE1 TYR A 10 18.694 -0.634 -6.981 1.00 0.02 H new ATOM 0 HE2 TYR A 10 22.955 -0.952 -7.397 1.00 0.02 H new ATOM 0 HH TYR A 10 21.590 -2.717 -7.408 1.00 0.02 H new ATOM 157 N GLU A 11 21.677 6.065 -5.055 1.00 0.00 N ATOM 158 CA GLU A 11 21.504 7.544 -4.988 1.00 0.02 C ATOM 159 C GLU A 11 21.396 8.164 -6.382 1.00 0.03 C ATOM 160 O GLU A 11 20.784 9.203 -6.539 1.00 0.03 O ATOM 161 CB GLU A 11 22.701 8.164 -4.266 1.00 0.00 C ATOM 162 CG GLU A 11 22.804 7.578 -2.861 1.00 0.00 C ATOM 163 CD GLU A 11 23.818 8.380 -2.045 1.00 0.02 C ATOM 164 OE1 GLU A 11 24.564 9.137 -2.644 1.00 0.02 O ATOM 165 OE2 GLU A 11 23.829 8.226 -0.835 1.00 0.01 O ATOM 0 H GLU A 11 22.594 5.719 -4.773 1.00 0.00 H new ATOM 0 HA GLU A 11 20.579 7.747 -4.447 1.00 0.02 H new ATOM 0 HB2 GLU A 11 23.617 7.967 -4.822 1.00 0.00 H new ATOM 0 HB3 GLU A 11 22.587 9.247 -4.213 1.00 0.00 H new ATOM 0 HG2 GLU A 11 21.829 7.602 -2.374 1.00 0.00 H new ATOM 0 HG3 GLU A 11 23.109 6.533 -2.913 1.00 0.00 H new ATOM 172 N ASP A 12 21.973 7.558 -7.399 1.00 0.02 N ATOM 173 CA ASP A 12 21.883 8.149 -8.775 1.00 0.01 C ATOM 174 C ASP A 12 21.064 7.236 -9.690 1.00 0.02 C ATOM 175 O ASP A 12 20.734 6.117 -9.350 1.00 0.02 O ATOM 176 CB ASP A 12 23.288 8.305 -9.362 1.00 0.01 C ATOM 177 CG ASP A 12 23.223 9.182 -10.614 1.00 0.01 C ATOM 178 OD1 ASP A 12 22.975 8.642 -11.678 1.00 0.02 O ATOM 179 OD2 ASP A 12 23.420 10.379 -10.487 1.00 0.03 O ATOM 0 H ASP A 12 22.498 6.686 -7.335 1.00 0.02 H new ATOM 0 HA ASP A 12 21.398 9.123 -8.705 1.00 0.01 H new ATOM 0 HB2 ASP A 12 23.954 8.754 -8.625 1.00 0.01 H new ATOM 0 HB3 ASP A 12 23.700 7.327 -9.611 1.00 0.01 H new ATOM 184 N ARG A 13 20.733 7.728 -10.849 1.00 0.02 N ATOM 185 CA ARG A 13 19.928 6.935 -11.820 1.00 0.02 C ATOM 186 C ARG A 13 20.806 5.873 -12.491 1.00 0.00 C ATOM 187 O ARG A 13 22.014 5.987 -12.545 1.00 0.02 O ATOM 188 CB ARG A 13 19.380 7.887 -12.885 1.00 0.00 C ATOM 189 CG ARG A 13 18.277 8.757 -12.275 1.00 0.01 C ATOM 190 CD ARG A 13 17.999 9.946 -13.198 1.00 0.02 C ATOM 191 NE ARG A 13 18.070 9.499 -14.617 1.00 0.03 N ATOM 192 CZ ARG A 13 17.583 10.253 -15.565 1.00 0.02 C ATOM 193 NH1 ARG A 13 17.038 11.401 -15.269 1.00 0.02 N ATOM 194 NH2 ARG A 13 17.645 9.862 -16.808 1.00 0.02 N ATOM 0 H ARG A 13 20.990 8.661 -11.171 1.00 0.02 H new ATOM 0 HA ARG A 13 19.111 6.436 -11.298 1.00 0.02 H new ATOM 0 HB2 ARG A 13 20.181 8.516 -13.272 1.00 0.00 H new ATOM 0 HB3 ARG A 13 18.985 7.319 -13.727 1.00 0.00 H new ATOM 0 HG2 ARG A 13 17.369 8.169 -12.137 1.00 0.01 H new ATOM 0 HG3 ARG A 13 18.580 9.111 -11.290 1.00 0.01 H new ATOM 0 HD2 ARG A 13 17.015 10.363 -12.986 1.00 0.02 H new ATOM 0 HD3 ARG A 13 18.726 10.738 -13.018 1.00 0.02 H new ATOM 0 HE ARG A 13 18.499 8.603 -14.848 1.00 0.03 H new ATOM 0 HH11 ARG A 13 16.993 11.709 -14.298 1.00 0.02 H new ATOM 0 HH12 ARG A 13 16.657 11.991 -16.009 1.00 0.02 H new ATOM 0 HH21 ARG A 13 18.074 8.966 -17.040 1.00 0.02 H new ATOM 0 HH22 ARG A 13 17.264 10.452 -17.548 1.00 0.02 H new ATOM 208 N ASN A 14 20.188 4.849 -13.016 1.00 0.02 N ATOM 209 CA ASN A 14 20.942 3.765 -13.710 1.00 0.02 C ATOM 210 C ASN A 14 21.824 2.989 -12.725 1.00 0.02 C ATOM 211 O ASN A 14 22.876 2.486 -13.061 1.00 0.02 O ATOM 212 CB ASN A 14 21.790 4.382 -14.828 1.00 0.26 C ATOM 213 CG ASN A 14 21.022 5.540 -15.469 1.00 0.12 C ATOM 214 OD1 ASN A 14 19.817 5.632 -15.338 1.00 0.74 O ATOM 215 ND2 ASN A 14 21.674 6.435 -16.159 1.00 0.46 N ATOM 0 H ASN A 14 19.177 4.716 -12.993 1.00 0.02 H new ATOM 0 HA ASN A 14 20.234 3.057 -14.140 1.00 0.02 H new ATOM 0 HB2 ASN A 14 22.738 4.739 -14.426 1.00 0.26 H new ATOM 0 HB3 ASN A 14 22.026 3.628 -15.579 1.00 0.26 H new ATOM 0 HD21 ASN A 14 21.173 7.212 -16.589 1.00 0.46 H new ATOM 0 HD22 ASN A 14 22.685 6.357 -16.269 1.00 0.46 H new ATOM 222 N PHE A 15 21.353 2.864 -11.512 1.00 0.02 N ATOM 223 CA PHE A 15 22.092 2.092 -10.468 1.00 0.02 C ATOM 224 C PHE A 15 23.519 2.619 -10.289 1.00 0.00 C ATOM 225 O PHE A 15 24.457 1.862 -10.135 1.00 0.02 O ATOM 226 CB PHE A 15 22.137 0.608 -10.880 1.00 0.02 C ATOM 227 CG PHE A 15 20.880 0.253 -11.641 1.00 0.02 C ATOM 228 CD1 PHE A 15 19.673 0.068 -10.956 1.00 0.02 C ATOM 229 CD2 PHE A 15 20.922 0.109 -13.035 1.00 0.02 C ATOM 230 CE1 PHE A 15 18.510 -0.260 -11.661 1.00 0.02 C ATOM 231 CE2 PHE A 15 19.759 -0.218 -13.740 1.00 0.02 C ATOM 232 CZ PHE A 15 18.551 -0.402 -13.055 1.00 0.02 C ATOM 0 H PHE A 15 20.473 3.271 -11.195 1.00 0.02 H new ATOM 0 HA PHE A 15 21.570 2.207 -9.518 1.00 0.02 H new ATOM 0 HB2 PHE A 15 23.014 0.419 -11.499 1.00 0.02 H new ATOM 0 HB3 PHE A 15 22.229 -0.022 -9.996 1.00 0.02 H new ATOM 0 HD1 PHE A 15 19.640 0.179 -9.882 1.00 0.02 H new ATOM 0 HD2 PHE A 15 21.853 0.251 -13.565 1.00 0.02 H new ATOM 0 HE1 PHE A 15 17.580 -0.404 -11.131 1.00 0.02 H new ATOM 0 HE2 PHE A 15 19.792 -0.329 -14.814 1.00 0.02 H new ATOM 0 HZ PHE A 15 17.653 -0.653 -13.600 1.00 0.02 H new ATOM 242 N GLN A 16 23.678 3.916 -10.288 1.00 0.02 N ATOM 243 CA GLN A 16 25.030 4.529 -10.097 1.00 0.02 C ATOM 244 C GLN A 16 25.036 5.278 -8.759 1.00 0.02 C ATOM 245 O GLN A 16 23.998 5.522 -8.171 1.00 0.02 O ATOM 246 CB GLN A 16 25.305 5.518 -11.239 1.00 0.02 C ATOM 247 CG GLN A 16 25.739 4.751 -12.491 1.00 0.00 C ATOM 248 CD GLN A 16 25.824 5.716 -13.677 1.00 0.00 C ATOM 249 OE1 GLN A 16 25.512 5.354 -14.794 1.00 0.02 O ATOM 250 NE2 GLN A 16 26.236 6.939 -13.479 1.00 0.02 N ATOM 0 H GLN A 16 22.920 4.587 -10.413 1.00 0.02 H new ATOM 0 HA GLN A 16 25.799 3.757 -10.098 1.00 0.02 H new ATOM 0 HB2 GLN A 16 24.410 6.102 -11.451 1.00 0.02 H new ATOM 0 HB3 GLN A 16 26.083 6.222 -10.944 1.00 0.02 H new ATOM 0 HG2 GLN A 16 26.707 4.278 -12.323 1.00 0.00 H new ATOM 0 HG3 GLN A 16 25.028 3.954 -12.707 1.00 0.00 H new ATOM 0 HE21 GLN A 16 26.498 7.243 -12.541 1.00 0.02 H new ATOM 0 HE22 GLN A 16 26.296 7.590 -14.262 1.00 0.02 H new ATOM 259 N GLY A 17 26.192 5.642 -8.267 1.00 0.03 N ATOM 260 CA GLY A 17 26.249 6.376 -6.967 1.00 0.03 C ATOM 261 C GLY A 17 26.344 5.389 -5.795 1.00 0.02 C ATOM 262 O GLY A 17 26.570 4.209 -5.980 1.00 0.02 O ATOM 0 H GLY A 17 27.095 5.464 -8.706 1.00 0.03 H new ATOM 0 HA2 GLY A 17 27.110 7.044 -6.958 1.00 0.03 H new ATOM 0 HA3 GLY A 17 25.361 6.998 -6.855 1.00 0.03 H new ATOM 266 N ARG A 18 26.159 5.867 -4.594 1.00 0.00 N ATOM 267 CA ARG A 18 26.221 4.967 -3.404 1.00 0.02 C ATOM 268 C ARG A 18 25.013 4.027 -3.428 1.00 0.02 C ATOM 269 O ARG A 18 23.926 4.400 -3.826 1.00 0.02 O ATOM 270 CB ARG A 18 26.197 5.818 -2.129 1.00 0.79 C ATOM 271 CG ARG A 18 26.668 4.973 -0.942 1.00 1.49 C ATOM 272 CD ARG A 18 26.551 5.792 0.346 1.00 1.42 C ATOM 273 NE ARG A 18 27.633 6.814 0.385 1.00 2.07 N ATOM 274 CZ ARG A 18 27.556 7.813 1.221 1.00 2.35 C ATOM 275 NH1 ARG A 18 26.528 7.921 2.017 1.00 2.53 N ATOM 276 NH2 ARG A 18 28.506 8.707 1.260 1.00 2.76 N ATOM 0 H ARG A 18 25.967 6.846 -4.384 1.00 0.00 H new ATOM 0 HA ARG A 18 27.138 4.378 -3.425 1.00 0.02 H new ATOM 0 HB2 ARG A 18 26.842 6.689 -2.248 1.00 0.79 H new ATOM 0 HB3 ARG A 18 25.189 6.191 -1.947 1.00 0.79 H new ATOM 0 HG2 ARG A 18 26.067 4.067 -0.865 1.00 1.49 H new ATOM 0 HG3 ARG A 18 27.701 4.658 -1.093 1.00 1.49 H new ATOM 0 HD2 ARG A 18 25.576 6.277 0.394 1.00 1.42 H new ATOM 0 HD3 ARG A 18 26.624 5.137 1.214 1.00 1.42 H new ATOM 0 HE ARG A 18 28.434 6.733 -0.241 1.00 2.07 H new ATOM 0 HH11 ARG A 18 25.784 7.224 1.986 1.00 2.53 H new ATOM 0 HH12 ARG A 18 26.469 8.702 2.670 1.00 2.53 H new ATOM 0 HH21 ARG A 18 29.309 8.625 0.637 1.00 2.76 H new ATOM 0 HH22 ARG A 18 28.445 9.488 1.914 1.00 2.76 H new ATOM 290 N ARG A 19 25.211 2.795 -3.021 1.00 0.02 N ATOM 291 CA ARG A 19 24.100 1.792 -3.030 1.00 0.02 C ATOM 292 C ARG A 19 23.884 1.235 -1.620 1.00 0.02 C ATOM 293 O ARG A 19 24.807 1.113 -0.839 1.00 0.02 O ATOM 294 CB ARG A 19 24.497 0.636 -3.955 1.00 0.85 C ATOM 295 CG ARG A 19 23.312 -0.315 -4.155 1.00 1.31 C ATOM 296 CD ARG A 19 23.782 -1.576 -4.890 1.00 1.34 C ATOM 297 NE ARG A 19 24.443 -2.497 -3.920 1.00 1.50 N ATOM 298 CZ ARG A 19 24.656 -3.743 -4.245 1.00 1.63 C ATOM 299 NH1 ARG A 19 24.297 -4.182 -5.420 1.00 1.72 N ATOM 300 NH2 ARG A 19 25.232 -4.549 -3.395 1.00 1.89 N ATOM 0 H ARG A 19 26.104 2.439 -2.680 1.00 0.02 H new ATOM 0 HA ARG A 19 23.183 2.269 -3.375 1.00 0.02 H new ATOM 0 HB2 ARG A 19 24.824 1.028 -4.918 1.00 0.85 H new ATOM 0 HB3 ARG A 19 25.340 0.093 -3.528 1.00 0.85 H new ATOM 0 HG2 ARG A 19 22.881 -0.583 -3.190 1.00 1.31 H new ATOM 0 HG3 ARG A 19 22.528 0.181 -4.727 1.00 1.31 H new ATOM 0 HD2 ARG A 19 22.934 -2.073 -5.361 1.00 1.34 H new ATOM 0 HD3 ARG A 19 24.477 -1.309 -5.686 1.00 1.34 H new ATOM 0 HE ARG A 19 24.728 -2.153 -3.003 1.00 1.50 H new ATOM 0 HH11 ARG A 19 23.850 -3.551 -6.085 1.00 1.72 H new ATOM 0 HH12 ARG A 19 24.464 -5.156 -5.673 1.00 1.72 H new ATOM 0 HH21 ARG A 19 25.515 -4.205 -2.478 1.00 1.89 H new ATOM 0 HH22 ARG A 19 25.399 -5.523 -3.648 1.00 1.89 H new ATOM 314 N TYR A 20 22.668 0.859 -1.313 1.00 0.02 N ATOM 315 CA TYR A 20 22.372 0.258 0.030 1.00 0.02 C ATOM 316 C TYR A 20 21.451 -0.951 -0.148 1.00 0.02 C ATOM 317 O TYR A 20 20.459 -0.879 -0.842 1.00 0.02 O ATOM 318 CB TYR A 20 21.718 1.285 0.970 1.00 0.02 C ATOM 319 CG TYR A 20 22.054 0.913 2.402 1.00 0.01 C ATOM 320 CD1 TYR A 20 21.331 -0.091 3.058 1.00 0.01 C ATOM 321 CD2 TYR A 20 23.112 1.553 3.059 1.00 0.02 C ATOM 322 CE1 TYR A 20 21.662 -0.451 4.372 1.00 0.02 C ATOM 323 CE2 TYR A 20 23.446 1.190 4.370 1.00 0.02 C ATOM 324 CZ TYR A 20 22.720 0.189 5.026 1.00 0.02 C ATOM 325 OH TYR A 20 23.051 -0.169 6.318 1.00 0.01 O ATOM 0 H TYR A 20 21.863 0.941 -1.934 1.00 0.02 H new ATOM 0 HA TYR A 20 23.312 -0.057 0.483 1.00 0.02 H new ATOM 0 HB2 TYR A 20 22.080 2.288 0.745 1.00 0.02 H new ATOM 0 HB3 TYR A 20 20.638 1.296 0.825 1.00 0.02 H new ATOM 0 HD1 TYR A 20 20.517 -0.589 2.551 1.00 0.01 H new ATOM 0 HD2 TYR A 20 23.671 2.327 2.554 1.00 0.02 H new ATOM 0 HE1 TYR A 20 21.101 -1.222 4.879 1.00 0.02 H new ATOM 0 HE2 TYR A 20 24.264 1.683 4.875 1.00 0.02 H new ATOM 0 HH TYR A 20 23.300 0.631 6.826 1.00 0.01 H new ATOM 335 N ASP A 21 21.761 -2.054 0.486 1.00 0.01 N ATOM 336 CA ASP A 21 20.902 -3.277 0.373 1.00 0.02 C ATOM 337 C ASP A 21 20.184 -3.499 1.706 1.00 0.00 C ATOM 338 O ASP A 21 20.764 -3.354 2.766 1.00 0.01 O ATOM 339 CB ASP A 21 21.797 -4.480 0.070 1.00 0.12 C ATOM 340 CG ASP A 21 22.974 -4.500 1.047 1.00 0.41 C ATOM 341 OD1 ASP A 21 23.051 -3.602 1.869 1.00 1.12 O ATOM 342 OD2 ASP A 21 23.776 -5.413 0.957 1.00 0.56 O ATOM 0 H ASP A 21 22.581 -2.162 1.084 1.00 0.01 H new ATOM 0 HA ASP A 21 20.168 -3.154 -0.424 1.00 0.02 H new ATOM 0 HB2 ASP A 21 21.224 -5.403 0.155 1.00 0.12 H new ATOM 0 HB3 ASP A 21 22.163 -4.425 -0.955 1.00 0.12 H new ATOM 347 N CYS A 22 18.910 -3.827 1.657 1.00 0.01 N ATOM 348 CA CYS A 22 18.120 -4.038 2.915 1.00 0.00 C ATOM 349 C CYS A 22 17.404 -5.391 2.860 1.00 0.02 C ATOM 350 O CYS A 22 16.867 -5.780 1.838 1.00 0.01 O ATOM 351 CB CYS A 22 17.088 -2.923 3.039 1.00 0.00 C ATOM 352 SG CYS A 22 15.950 -3.314 4.385 1.00 0.02 S ATOM 0 H CYS A 22 18.382 -3.958 0.794 1.00 0.01 H new ATOM 0 HA CYS A 22 18.790 -4.026 3.775 1.00 0.00 H new ATOM 0 HB2 CYS A 22 17.584 -1.972 3.231 1.00 0.00 H new ATOM 0 HB3 CYS A 22 16.540 -2.813 2.103 1.00 0.00 H new ATOM 0 HG CYS A 22 15.964 -2.352 5.259 1.00 0.02 H new ATOM 358 N ASP A 23 17.397 -6.111 3.960 1.00 0.01 N ATOM 359 CA ASP A 23 16.726 -7.453 4.006 1.00 0.02 C ATOM 360 C ASP A 23 15.603 -7.466 5.058 1.00 0.00 C ATOM 361 O ASP A 23 15.079 -8.512 5.389 1.00 0.02 O ATOM 362 CB ASP A 23 17.768 -8.513 4.367 1.00 0.16 C ATOM 363 CG ASP A 23 18.445 -8.132 5.684 1.00 0.17 C ATOM 364 OD1 ASP A 23 17.743 -8.010 6.674 1.00 0.17 O ATOM 365 OD2 ASP A 23 19.654 -7.966 5.681 1.00 0.20 O ATOM 0 H ASP A 23 17.832 -5.823 4.836 1.00 0.01 H new ATOM 0 HA ASP A 23 16.289 -7.664 3.030 1.00 0.02 H new ATOM 0 HB2 ASP A 23 17.293 -9.490 4.459 1.00 0.16 H new ATOM 0 HB3 ASP A 23 18.511 -8.594 3.573 1.00 0.16 H new ATOM 370 N CYS A 24 15.216 -6.328 5.588 1.00 0.01 N ATOM 371 CA CYS A 24 14.118 -6.316 6.609 1.00 0.01 C ATOM 372 C CYS A 24 13.513 -4.906 6.692 1.00 0.01 C ATOM 373 O CYS A 24 14.001 -3.983 6.079 1.00 0.01 O ATOM 374 CB CYS A 24 14.685 -6.712 7.973 1.00 0.62 C ATOM 375 SG CYS A 24 15.986 -5.549 8.453 1.00 1.23 S ATOM 0 H CYS A 24 15.609 -5.415 5.360 1.00 0.01 H new ATOM 0 HA CYS A 24 13.344 -7.026 6.320 1.00 0.01 H new ATOM 0 HB2 CYS A 24 13.892 -6.714 8.721 1.00 0.62 H new ATOM 0 HB3 CYS A 24 15.086 -7.725 7.931 1.00 0.62 H new ATOM 0 HG CYS A 24 16.464 -5.887 9.614 1.00 1.23 H new ATOM 381 N ASP A 25 12.451 -4.720 7.436 1.00 0.02 N ATOM 382 CA ASP A 25 11.829 -3.362 7.535 1.00 0.01 C ATOM 383 C ASP A 25 12.804 -2.365 8.170 1.00 0.02 C ATOM 384 O ASP A 25 13.567 -2.703 9.053 1.00 0.00 O ATOM 385 CB ASP A 25 10.581 -3.449 8.413 1.00 0.01 C ATOM 386 CG ASP A 25 10.919 -4.189 9.710 1.00 0.01 C ATOM 387 OD1 ASP A 25 11.741 -3.687 10.458 1.00 0.01 O ATOM 388 OD2 ASP A 25 10.349 -5.245 9.931 1.00 0.01 O ATOM 0 H ASP A 25 11.988 -5.449 7.979 1.00 0.02 H new ATOM 0 HA ASP A 25 11.573 -3.021 6.532 1.00 0.01 H new ATOM 0 HB2 ASP A 25 10.212 -2.449 8.638 1.00 0.01 H new ATOM 0 HB3 ASP A 25 9.785 -3.970 7.881 1.00 0.01 H new ATOM 393 N CYS A 26 12.755 -1.123 7.740 1.00 0.01 N ATOM 394 CA CYS A 26 13.646 -0.069 8.329 1.00 0.01 C ATOM 395 C CYS A 26 12.816 1.199 8.594 1.00 0.01 C ATOM 396 O CYS A 26 12.221 1.760 7.696 1.00 0.01 O ATOM 397 CB CYS A 26 14.793 0.241 7.363 1.00 0.01 C ATOM 398 SG CYS A 26 15.297 -1.278 6.524 1.00 0.02 S ATOM 0 H CYS A 26 12.132 -0.793 7.002 1.00 0.01 H new ATOM 0 HA CYS A 26 14.070 -0.427 9.267 1.00 0.01 H new ATOM 0 HB2 CYS A 26 14.477 0.985 6.632 1.00 0.01 H new ATOM 0 HB3 CYS A 26 15.636 0.666 7.907 1.00 0.01 H new ATOM 0 HG CYS A 26 14.643 -1.394 5.407 1.00 0.02 H new ATOM 404 N ALA A 27 12.742 1.622 9.830 1.00 0.01 N ATOM 405 CA ALA A 27 11.912 2.819 10.175 1.00 0.01 C ATOM 406 C ALA A 27 12.610 4.131 9.789 1.00 0.01 C ATOM 407 O ALA A 27 11.969 5.157 9.669 1.00 0.02 O ATOM 408 CB ALA A 27 11.631 2.823 11.677 1.00 0.24 C ATOM 0 H ALA A 27 13.222 1.189 10.619 1.00 0.01 H new ATOM 0 HA ALA A 27 10.982 2.754 9.610 1.00 0.01 H new ATOM 0 HB1 ALA A 27 11.027 3.694 11.932 1.00 0.24 H new ATOM 0 HB2 ALA A 27 11.092 1.915 11.949 1.00 0.24 H new ATOM 0 HB3 ALA A 27 12.573 2.863 12.223 1.00 0.24 H new ATOM 414 N ASP A 28 13.903 4.126 9.615 1.00 0.01 N ATOM 415 CA ASP A 28 14.607 5.399 9.252 1.00 0.02 C ATOM 416 C ASP A 28 15.895 5.080 8.494 1.00 0.01 C ATOM 417 O ASP A 28 16.864 4.613 9.063 1.00 0.02 O ATOM 418 CB ASP A 28 14.937 6.186 10.522 1.00 0.67 C ATOM 419 CG ASP A 28 15.895 5.373 11.393 1.00 0.90 C ATOM 420 OD1 ASP A 28 15.435 4.440 12.034 1.00 1.14 O ATOM 421 OD2 ASP A 28 17.071 5.695 11.405 1.00 0.87 O ATOM 0 H ASP A 28 14.502 3.306 9.706 1.00 0.01 H new ATOM 0 HA ASP A 28 13.957 5.999 8.616 1.00 0.02 H new ATOM 0 HB2 ASP A 28 15.389 7.143 10.262 1.00 0.67 H new ATOM 0 HB3 ASP A 28 14.023 6.405 11.075 1.00 0.67 H new ATOM 426 N PHE A 29 15.908 5.314 7.205 1.00 0.02 N ATOM 427 CA PHE A 29 17.115 5.016 6.370 1.00 0.02 C ATOM 428 C PHE A 29 17.879 6.314 6.054 1.00 0.00 C ATOM 429 O PHE A 29 18.804 6.332 5.265 1.00 0.02 O ATOM 430 CB PHE A 29 16.632 4.339 5.056 1.00 2.87 C ATOM 431 CG PHE A 29 17.302 2.993 4.850 1.00 3.99 C ATOM 432 CD1 PHE A 29 17.279 2.037 5.874 1.00 4.68 C ATOM 433 CD2 PHE A 29 17.932 2.697 3.635 1.00 4.52 C ATOM 434 CE1 PHE A 29 17.885 0.792 5.685 1.00 5.85 C ATOM 435 CE2 PHE A 29 18.539 1.453 3.447 1.00 5.75 C ATOM 436 CZ PHE A 29 18.515 0.500 4.471 1.00 6.37 C ATOM 0 H PHE A 29 15.121 5.705 6.687 1.00 0.02 H new ATOM 0 HA PHE A 29 17.792 4.353 6.908 1.00 0.02 H new ATOM 0 HB2 PHE A 29 15.550 4.208 5.088 1.00 2.87 H new ATOM 0 HB3 PHE A 29 16.849 4.989 4.208 1.00 2.87 H new ATOM 0 HD1 PHE A 29 16.792 2.263 6.811 1.00 4.68 H new ATOM 0 HD2 PHE A 29 17.949 3.431 2.843 1.00 4.52 H new ATOM 0 HE1 PHE A 29 17.867 0.056 6.475 1.00 5.85 H new ATOM 0 HE2 PHE A 29 19.027 1.227 2.511 1.00 5.75 H new ATOM 0 HZ PHE A 29 18.983 -0.462 4.324 1.00 6.37 H new ATOM 446 N ARG A 30 17.454 7.406 6.627 1.00 0.01 N ATOM 447 CA ARG A 30 18.101 8.717 6.338 1.00 0.00 C ATOM 448 C ARG A 30 19.585 8.722 6.724 1.00 0.01 C ATOM 449 O ARG A 30 20.370 9.443 6.141 1.00 0.02 O ATOM 450 CB ARG A 30 17.388 9.822 7.118 1.00 0.32 C ATOM 451 CG ARG A 30 15.983 10.027 6.545 1.00 0.86 C ATOM 452 CD ARG A 30 15.307 11.203 7.253 1.00 1.62 C ATOM 453 NE ARG A 30 14.088 11.603 6.496 1.00 2.25 N ATOM 454 CZ ARG A 30 13.194 12.370 7.058 1.00 2.70 C ATOM 455 NH1 ARG A 30 13.367 12.784 8.282 1.00 3.11 N ATOM 456 NH2 ARG A 30 12.126 12.723 6.394 1.00 3.02 N ATOM 0 H ARG A 30 16.679 7.446 7.289 1.00 0.01 H new ATOM 0 HA ARG A 30 18.025 8.890 5.264 1.00 0.00 H new ATOM 0 HB2 ARG A 30 17.327 9.555 8.173 1.00 0.32 H new ATOM 0 HB3 ARG A 30 17.956 10.750 7.056 1.00 0.32 H new ATOM 0 HG2 ARG A 30 16.041 10.219 5.474 1.00 0.86 H new ATOM 0 HG3 ARG A 30 15.390 9.122 6.675 1.00 0.86 H new ATOM 0 HD2 ARG A 30 15.040 10.923 8.272 1.00 1.62 H new ATOM 0 HD3 ARG A 30 15.997 12.044 7.324 1.00 1.62 H new ATOM 0 HE ARG A 30 13.952 11.278 5.539 1.00 2.25 H new ATOM 0 HH11 ARG A 30 14.201 12.509 8.800 1.00 3.11 H new ATOM 0 HH12 ARG A 30 12.668 13.383 8.721 1.00 3.11 H new ATOM 0 HH21 ARG A 30 11.991 12.399 5.436 1.00 3.02 H new ATOM 0 HH22 ARG A 30 11.427 13.322 6.833 1.00 3.02 H new ATOM 470 N SER A 31 19.990 7.959 7.704 1.00 0.02 N ATOM 471 CA SER A 31 21.426 7.980 8.113 1.00 0.02 C ATOM 472 C SER A 31 22.290 7.189 7.127 1.00 0.01 C ATOM 473 O SER A 31 23.500 7.305 7.120 1.00 0.02 O ATOM 474 CB SER A 31 21.558 7.357 9.503 1.00 0.37 C ATOM 475 OG SER A 31 21.000 6.051 9.486 1.00 0.88 O ATOM 0 H SER A 31 19.394 7.326 8.236 1.00 0.02 H new ATOM 0 HA SER A 31 21.769 9.015 8.123 1.00 0.02 H new ATOM 0 HB2 SER A 31 22.607 7.313 9.797 1.00 0.37 H new ATOM 0 HB3 SER A 31 21.046 7.974 10.241 1.00 0.37 H new ATOM 0 HG SER A 31 21.084 5.648 10.375 1.00 0.88 H new ATOM 481 N TYR A 32 21.682 6.362 6.318 1.00 0.01 N ATOM 482 CA TYR A 32 22.465 5.525 5.354 1.00 0.01 C ATOM 483 C TYR A 32 22.312 6.056 3.931 1.00 0.02 C ATOM 484 O TYR A 32 23.116 5.767 3.065 1.00 0.02 O ATOM 485 CB TYR A 32 21.928 4.097 5.407 1.00 0.02 C ATOM 486 CG TYR A 32 22.287 3.470 6.737 1.00 0.02 C ATOM 487 CD1 TYR A 32 23.629 3.228 7.057 1.00 0.01 C ATOM 488 CD2 TYR A 32 21.279 3.133 7.652 1.00 0.01 C ATOM 489 CE1 TYR A 32 23.964 2.649 8.287 1.00 0.00 C ATOM 490 CE2 TYR A 32 21.613 2.555 8.881 1.00 0.02 C ATOM 491 CZ TYR A 32 22.955 2.313 9.199 1.00 0.02 C ATOM 492 OH TYR A 32 23.283 1.742 10.412 1.00 0.02 O ATOM 0 H TYR A 32 20.672 6.228 6.281 1.00 0.01 H new ATOM 0 HA TYR A 32 23.519 5.556 5.629 1.00 0.01 H new ATOM 0 HB2 TYR A 32 20.846 4.099 5.275 1.00 0.02 H new ATOM 0 HB3 TYR A 32 22.348 3.509 4.591 1.00 0.02 H new ATOM 0 HD1 TYR A 32 24.406 3.488 6.354 1.00 0.01 H new ATOM 0 HD2 TYR A 32 20.244 3.320 7.407 1.00 0.01 H new ATOM 0 HE1 TYR A 32 24.999 2.462 8.532 1.00 0.00 H new ATOM 0 HE2 TYR A 32 20.836 2.295 9.585 1.00 0.02 H new ATOM 0 HH TYR A 32 22.466 1.573 10.925 1.00 0.02 H new ATOM 502 N LEU A 33 21.275 6.798 3.663 1.00 0.02 N ATOM 503 CA LEU A 33 21.059 7.306 2.272 1.00 0.02 C ATOM 504 C LEU A 33 20.336 8.655 2.326 1.00 0.02 C ATOM 505 O LEU A 33 19.314 8.803 2.967 1.00 0.02 O ATOM 506 CB LEU A 33 20.168 6.291 1.531 1.00 1.66 C ATOM 507 CG LEU A 33 20.408 6.376 0.009 1.00 2.38 C ATOM 508 CD1 LEU A 33 21.622 5.524 -0.387 1.00 3.32 C ATOM 509 CD2 LEU A 33 19.175 5.861 -0.737 1.00 2.80 C ATOM 0 H LEU A 33 20.567 7.076 4.342 1.00 0.02 H new ATOM 0 HA LEU A 33 22.014 7.430 1.762 1.00 0.02 H new ATOM 0 HB2 LEU A 33 20.383 5.282 1.884 1.00 1.66 H new ATOM 0 HB3 LEU A 33 19.119 6.489 1.752 1.00 1.66 H new ATOM 0 HG LEU A 33 20.595 7.417 -0.256 1.00 2.38 H new ATOM 0 HD11 LEU A 33 21.780 5.593 -1.463 1.00 3.32 H new ATOM 0 HD12 LEU A 33 22.508 5.888 0.134 1.00 3.32 H new ATOM 0 HD13 LEU A 33 21.442 4.485 -0.113 1.00 3.32 H new ATOM 0 HD21 LEU A 33 19.348 5.922 -1.811 1.00 2.80 H new ATOM 0 HD22 LEU A 33 18.988 4.824 -0.458 1.00 2.80 H new ATOM 0 HD23 LEU A 33 18.310 6.469 -0.473 1.00 2.80 H new ATOM 521 N SER A 34 20.881 9.646 1.667 1.00 0.02 N ATOM 522 CA SER A 34 20.259 11.001 1.682 1.00 0.02 C ATOM 523 C SER A 34 19.215 11.137 0.570 1.00 0.00 C ATOM 524 O SER A 34 18.446 12.079 0.550 1.00 0.01 O ATOM 525 CB SER A 34 21.345 12.056 1.478 1.00 0.02 C ATOM 526 OG SER A 34 22.250 12.014 2.574 1.00 0.02 O ATOM 0 H SER A 34 21.736 9.572 1.116 1.00 0.02 H new ATOM 0 HA SER A 34 19.766 11.144 2.643 1.00 0.02 H new ATOM 0 HB2 SER A 34 21.877 11.872 0.545 1.00 0.02 H new ATOM 0 HB3 SER A 34 20.896 13.046 1.399 1.00 0.02 H new ATOM 0 HG SER A 34 22.950 12.688 2.447 1.00 0.02 H new ATOM 532 N ARG A 35 19.175 10.218 -0.361 1.00 0.02 N ATOM 533 CA ARG A 35 18.184 10.305 -1.471 1.00 0.01 C ATOM 534 C ARG A 35 18.239 9.000 -2.278 1.00 0.02 C ATOM 535 O ARG A 35 19.207 8.269 -2.218 1.00 0.02 O ATOM 536 CB ARG A 35 18.542 11.487 -2.377 1.00 0.02 C ATOM 537 CG ARG A 35 17.556 11.562 -3.543 1.00 0.02 C ATOM 538 CD ARG A 35 17.741 12.887 -4.286 1.00 0.02 C ATOM 539 NE ARG A 35 19.195 13.157 -4.473 1.00 0.02 N ATOM 540 CZ ARG A 35 19.585 14.059 -5.331 1.00 0.02 C ATOM 541 NH1 ARG A 35 18.702 14.725 -6.024 1.00 0.00 N ATOM 542 NH2 ARG A 35 20.858 14.297 -5.496 1.00 0.02 N ATOM 0 H ARG A 35 19.792 9.406 -0.398 1.00 0.02 H new ATOM 0 HA ARG A 35 17.181 10.452 -1.071 1.00 0.01 H new ATOM 0 HB2 ARG A 35 18.516 12.415 -1.806 1.00 0.02 H new ATOM 0 HB3 ARG A 35 19.558 11.373 -2.755 1.00 0.02 H new ATOM 0 HG2 ARG A 35 17.717 10.726 -4.224 1.00 0.02 H new ATOM 0 HG3 ARG A 35 16.534 11.480 -3.174 1.00 0.02 H new ATOM 0 HD2 ARG A 35 17.241 12.846 -5.254 1.00 0.02 H new ATOM 0 HD3 ARG A 35 17.280 13.699 -3.723 1.00 0.02 H new ATOM 0 HE ARG A 35 19.885 12.637 -3.930 1.00 0.02 H new ATOM 0 HH11 ARG A 35 17.707 14.540 -5.895 1.00 0.00 H new ATOM 0 HH12 ARG A 35 19.007 15.430 -6.695 1.00 0.00 H new ATOM 0 HH21 ARG A 35 21.548 13.778 -4.954 1.00 0.02 H new ATOM 0 HH22 ARG A 35 21.162 15.002 -6.167 1.00 0.02 H new ATOM 556 N CYS A 36 17.217 8.704 -3.042 1.00 0.02 N ATOM 557 CA CYS A 36 17.214 7.449 -3.862 1.00 0.02 C ATOM 558 C CYS A 36 16.526 7.734 -5.200 1.00 0.02 C ATOM 559 O CYS A 36 15.358 8.065 -5.220 1.00 0.02 O ATOM 560 CB CYS A 36 16.435 6.364 -3.116 1.00 0.02 C ATOM 561 SG CYS A 36 14.965 7.105 -2.366 1.00 0.02 S ATOM 0 H CYS A 36 16.380 9.279 -3.135 1.00 0.02 H new ATOM 0 HA CYS A 36 18.237 7.113 -4.034 1.00 0.02 H new ATOM 0 HB2 CYS A 36 16.147 5.568 -3.803 1.00 0.02 H new ATOM 0 HB3 CYS A 36 17.062 5.911 -2.348 1.00 0.02 H new ATOM 0 HG CYS A 36 14.838 8.331 -2.779 1.00 0.02 H new ATOM 567 N ASN A 37 17.221 7.641 -6.317 1.00 0.02 N ATOM 568 CA ASN A 37 16.563 7.956 -7.634 1.00 0.01 C ATOM 569 C ASN A 37 16.337 6.688 -8.462 1.00 0.02 C ATOM 570 O ASN A 37 15.768 6.725 -9.537 1.00 0.02 O ATOM 571 CB ASN A 37 17.443 8.921 -8.433 1.00 0.02 C ATOM 572 CG ASN A 37 17.901 10.064 -7.526 1.00 0.01 C ATOM 573 OD1 ASN A 37 18.185 9.859 -6.363 1.00 0.03 O ATOM 574 ND2 ASN A 37 17.986 11.271 -8.013 1.00 0.02 N ATOM 0 H ASN A 37 18.201 7.365 -6.374 1.00 0.02 H new ATOM 0 HA ASN A 37 15.595 8.412 -7.424 1.00 0.01 H new ATOM 0 HB2 ASN A 37 18.308 8.393 -8.835 1.00 0.02 H new ATOM 0 HB3 ASN A 37 16.888 9.317 -9.283 1.00 0.02 H new ATOM 0 HD21 ASN A 37 18.291 12.041 -7.417 1.00 0.02 H new ATOM 0 HD22 ASN A 37 17.748 11.445 -8.989 1.00 0.02 H new ATOM 581 N SER A 38 16.743 5.560 -7.948 1.00 0.02 N ATOM 582 CA SER A 38 16.530 4.273 -8.664 1.00 0.02 C ATOM 583 C SER A 38 16.505 3.159 -7.626 1.00 0.01 C ATOM 584 O SER A 38 17.064 3.287 -6.553 1.00 0.02 O ATOM 585 CB SER A 38 17.649 4.027 -9.676 1.00 0.01 C ATOM 586 OG SER A 38 17.450 4.867 -10.804 1.00 0.02 O ATOM 0 H SER A 38 17.220 5.476 -7.050 1.00 0.02 H new ATOM 0 HA SER A 38 15.589 4.303 -9.213 1.00 0.02 H new ATOM 0 HB2 SER A 38 18.618 4.232 -9.221 1.00 0.01 H new ATOM 0 HB3 SER A 38 17.655 2.981 -9.983 1.00 0.01 H new ATOM 0 HG SER A 38 17.817 4.434 -11.603 1.00 0.02 H new ATOM 592 N ILE A 39 15.837 2.074 -7.914 1.00 0.02 N ATOM 593 CA ILE A 39 15.747 0.967 -6.913 1.00 0.02 C ATOM 594 C ILE A 39 15.703 -0.393 -7.612 1.00 0.02 C ATOM 595 O ILE A 39 15.133 -0.560 -8.673 1.00 0.02 O ATOM 596 CB ILE A 39 14.455 1.138 -6.110 1.00 0.00 C ATOM 597 CG1 ILE A 39 14.297 2.603 -5.692 1.00 0.01 C ATOM 598 CG2 ILE A 39 14.511 0.256 -4.863 1.00 0.01 C ATOM 599 CD1 ILE A 39 13.085 2.747 -4.770 1.00 0.00 C ATOM 0 H ILE A 39 15.351 1.905 -8.795 1.00 0.02 H new ATOM 0 HA ILE A 39 16.622 1.007 -6.265 1.00 0.02 H new ATOM 0 HB ILE A 39 13.605 0.845 -6.727 1.00 0.00 H new ATOM 0 HG12 ILE A 39 15.197 2.945 -5.181 1.00 0.01 H new ATOM 0 HG13 ILE A 39 14.172 3.232 -6.574 1.00 0.01 H new ATOM 0 HG21 ILE A 39 13.592 0.377 -4.290 1.00 0.01 H new ATOM 0 HG22 ILE A 39 14.619 -0.787 -5.160 1.00 0.01 H new ATOM 0 HG23 ILE A 39 15.362 0.548 -4.248 1.00 0.01 H new ATOM 0 HD11 ILE A 39 12.975 3.790 -4.474 1.00 0.00 H new ATOM 0 HD12 ILE A 39 12.187 2.422 -5.296 1.00 0.00 H new ATOM 0 HD13 ILE A 39 13.228 2.131 -3.882 1.00 0.00 H new ATOM 611 N ARG A 40 16.265 -1.390 -6.975 1.00 0.02 N ATOM 612 CA ARG A 40 16.234 -2.779 -7.525 1.00 0.02 C ATOM 613 C ARG A 40 15.605 -3.690 -6.474 1.00 0.01 C ATOM 614 O ARG A 40 16.089 -3.783 -5.365 1.00 0.02 O ATOM 615 CB ARG A 40 17.644 -3.286 -7.841 1.00 0.01 C ATOM 616 CG ARG A 40 17.557 -4.637 -8.551 1.00 0.02 C ATOM 617 CD ARG A 40 18.953 -5.061 -9.012 1.00 0.02 C ATOM 618 NE ARG A 40 19.556 -3.975 -9.838 1.00 0.02 N ATOM 619 CZ ARG A 40 20.838 -3.980 -10.085 1.00 0.02 C ATOM 620 NH1 ARG A 40 21.590 -4.934 -9.610 1.00 0.02 N ATOM 621 NH2 ARG A 40 21.367 -3.031 -10.810 1.00 0.02 N ATOM 0 H ARG A 40 16.751 -1.298 -6.083 1.00 0.02 H new ATOM 0 HA ARG A 40 15.658 -2.781 -8.450 1.00 0.02 H new ATOM 0 HB2 ARG A 40 18.167 -2.566 -8.470 1.00 0.01 H new ATOM 0 HB3 ARG A 40 18.221 -3.384 -6.921 1.00 0.01 H new ATOM 0 HG2 ARG A 40 17.141 -5.387 -7.879 1.00 0.02 H new ATOM 0 HG3 ARG A 40 16.885 -4.568 -9.406 1.00 0.02 H new ATOM 0 HD2 ARG A 40 19.585 -5.269 -8.149 1.00 0.02 H new ATOM 0 HD3 ARG A 40 18.892 -5.982 -9.592 1.00 0.02 H new ATOM 0 HE ARG A 40 18.967 -3.229 -10.209 1.00 0.02 H new ATOM 0 HH11 ARG A 40 21.176 -5.676 -9.046 1.00 0.02 H new ATOM 0 HH12 ARG A 40 22.592 -4.938 -9.803 1.00 0.02 H new ATOM 0 HH21 ARG A 40 20.779 -2.286 -11.183 1.00 0.02 H new ATOM 0 HH22 ARG A 40 22.369 -3.035 -11.003 1.00 0.02 H new ATOM 635 N VAL A 41 14.566 -4.403 -6.821 1.00 0.02 N ATOM 636 CA VAL A 41 13.946 -5.357 -5.856 1.00 0.01 C ATOM 637 C VAL A 41 14.358 -6.756 -6.299 1.00 0.02 C ATOM 638 O VAL A 41 13.995 -7.204 -7.368 1.00 0.02 O ATOM 639 CB VAL A 41 12.426 -5.204 -5.861 1.00 0.01 C ATOM 640 CG1 VAL A 41 11.831 -6.090 -4.764 1.00 0.02 C ATOM 641 CG2 VAL A 41 12.068 -3.745 -5.563 1.00 0.00 C ATOM 0 H VAL A 41 14.118 -4.365 -7.737 1.00 0.02 H new ATOM 0 HA VAL A 41 14.281 -5.164 -4.837 1.00 0.01 H new ATOM 0 HB VAL A 41 12.030 -5.495 -6.834 1.00 0.01 H new ATOM 0 HG11 VAL A 41 10.746 -5.986 -4.761 1.00 0.02 H new ATOM 0 HG12 VAL A 41 12.096 -7.130 -4.953 1.00 0.02 H new ATOM 0 HG13 VAL A 41 12.227 -5.785 -3.795 1.00 0.02 H new ATOM 0 HG21 VAL A 41 10.984 -3.629 -5.565 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.461 -3.466 -4.585 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.504 -3.100 -6.326 1.00 0.00 H new ATOM 651 N GLU A 42 15.144 -7.434 -5.500 1.00 0.01 N ATOM 652 CA GLU A 42 15.621 -8.790 -5.895 1.00 0.01 C ATOM 653 C GLU A 42 14.595 -9.842 -5.505 1.00 0.02 C ATOM 654 O GLU A 42 14.424 -10.827 -6.197 1.00 0.01 O ATOM 655 CB GLU A 42 16.950 -9.083 -5.197 1.00 0.99 C ATOM 656 CG GLU A 42 18.066 -8.272 -5.860 1.00 1.86 C ATOM 657 CD GLU A 42 18.413 -8.888 -7.217 1.00 3.10 C ATOM 658 OE1 GLU A 42 18.466 -10.104 -7.297 1.00 3.67 O ATOM 659 OE2 GLU A 42 18.618 -8.133 -8.153 1.00 3.81 O ATOM 0 H GLU A 42 15.474 -7.105 -4.593 1.00 0.01 H new ATOM 0 HA GLU A 42 15.760 -8.819 -6.976 1.00 0.01 H new ATOM 0 HB2 GLU A 42 16.881 -8.829 -4.139 1.00 0.99 H new ATOM 0 HB3 GLU A 42 17.176 -10.148 -5.255 1.00 0.99 H new ATOM 0 HG2 GLU A 42 17.749 -7.237 -5.990 1.00 1.86 H new ATOM 0 HG3 GLU A 42 18.948 -8.258 -5.220 1.00 1.86 H new ATOM 666 N GLY A 43 13.910 -9.673 -4.409 1.00 0.01 N ATOM 667 CA GLY A 43 12.919 -10.714 -4.024 1.00 0.02 C ATOM 668 C GLY A 43 11.936 -10.170 -2.996 1.00 0.02 C ATOM 669 O GLY A 43 12.287 -9.339 -2.179 1.00 0.02 O ATOM 0 H GLY A 43 13.990 -8.877 -3.776 1.00 0.01 H new ATOM 0 HA2 GLY A 43 12.378 -11.052 -4.908 1.00 0.02 H new ATOM 0 HA3 GLY A 43 13.437 -11.582 -3.615 1.00 0.02 H new ATOM 673 N GLY A 44 10.723 -10.658 -3.012 1.00 0.00 N ATOM 674 CA GLY A 44 9.716 -10.188 -2.020 1.00 0.01 C ATOM 675 C GLY A 44 9.027 -8.918 -2.531 1.00 0.01 C ATOM 676 O GLY A 44 9.428 -8.332 -3.516 1.00 0.01 O ATOM 0 H GLY A 44 10.388 -11.362 -3.670 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.975 -10.968 -1.845 1.00 0.01 H new ATOM 0 HA3 GLY A 44 10.201 -9.989 -1.064 1.00 0.01 H new ATOM 680 N THR A 45 8.008 -8.481 -1.836 1.00 0.01 N ATOM 681 CA THR A 45 7.283 -7.229 -2.224 1.00 0.00 C ATOM 682 C THR A 45 7.432 -6.239 -1.072 1.00 0.01 C ATOM 683 O THR A 45 7.332 -6.617 0.077 1.00 0.01 O ATOM 684 CB THR A 45 5.800 -7.553 -2.443 1.00 0.73 C ATOM 685 OG1 THR A 45 5.664 -8.365 -3.599 1.00 0.88 O ATOM 686 CG2 THR A 45 4.998 -6.260 -2.627 1.00 1.48 C ATOM 0 H THR A 45 7.641 -8.944 -1.004 1.00 0.01 H new ATOM 0 HA THR A 45 7.690 -6.808 -3.144 1.00 0.00 H new ATOM 0 HB THR A 45 5.417 -8.084 -1.572 1.00 0.73 H new ATOM 0 HG1 THR A 45 4.718 -8.576 -3.741 1.00 0.88 H new ATOM 0 HG21 THR A 45 3.947 -6.503 -2.782 1.00 1.48 H new ATOM 0 HG22 THR A 45 5.100 -5.639 -1.737 1.00 1.48 H new ATOM 0 HG23 THR A 45 5.376 -5.717 -3.493 1.00 1.48 H new ATOM 694 N TRP A 46 7.750 -4.994 -1.348 1.00 0.02 N ATOM 695 CA TRP A 46 7.982 -4.015 -0.231 1.00 0.01 C ATOM 696 C TRP A 46 7.136 -2.751 -0.379 1.00 0.01 C ATOM 697 O TRP A 46 6.782 -2.322 -1.457 1.00 0.01 O ATOM 698 CB TRP A 46 9.458 -3.613 -0.238 1.00 0.00 C ATOM 699 CG TRP A 46 10.305 -4.812 0.040 1.00 0.01 C ATOM 700 CD1 TRP A 46 10.495 -5.844 -0.814 1.00 0.01 C ATOM 701 CD2 TRP A 46 11.077 -5.123 1.235 1.00 0.01 C ATOM 702 NE1 TRP A 46 11.333 -6.768 -0.219 1.00 0.00 N ATOM 703 CE2 TRP A 46 11.719 -6.369 1.045 1.00 0.01 C ATOM 704 CE3 TRP A 46 11.279 -4.450 2.453 1.00 0.01 C ATOM 705 CZ2 TRP A 46 12.534 -6.929 2.029 1.00 0.01 C ATOM 706 CZ3 TRP A 46 12.099 -5.010 3.445 1.00 0.02 C ATOM 707 CH2 TRP A 46 12.725 -6.247 3.233 1.00 0.01 C ATOM 0 H TRP A 46 7.858 -4.615 -2.289 1.00 0.02 H new ATOM 0 HA TRP A 46 7.698 -4.500 0.703 1.00 0.01 H new ATOM 0 HB2 TRP A 46 9.724 -3.183 -1.204 1.00 0.00 H new ATOM 0 HB3 TRP A 46 9.640 -2.845 0.513 1.00 0.00 H new ATOM 0 HD1 TRP A 46 10.062 -5.931 -1.800 1.00 0.01 H new ATOM 0 HE1 TRP A 46 11.630 -7.638 -0.660 1.00 0.00 H new ATOM 0 HE3 TRP A 46 10.801 -3.497 2.626 1.00 0.01 H new ATOM 0 HZ2 TRP A 46 13.013 -7.882 1.861 1.00 0.01 H new ATOM 0 HZ3 TRP A 46 12.249 -4.485 4.377 1.00 0.02 H new ATOM 0 HH2 TRP A 46 13.355 -6.672 4.001 1.00 0.01 H new ATOM 718 N ALA A 47 6.879 -2.125 0.738 1.00 0.01 N ATOM 719 CA ALA A 47 6.131 -0.836 0.766 1.00 0.01 C ATOM 720 C ALA A 47 7.167 0.219 1.142 1.00 0.01 C ATOM 721 O ALA A 47 7.932 0.038 2.068 1.00 0.01 O ATOM 722 CB ALA A 47 5.017 -0.893 1.817 1.00 0.24 C ATOM 0 H ALA A 47 7.165 -2.464 1.657 1.00 0.01 H new ATOM 0 HA ALA A 47 5.656 -0.616 -0.190 1.00 0.01 H new ATOM 0 HB1 ALA A 47 4.478 0.054 1.828 1.00 0.24 H new ATOM 0 HB2 ALA A 47 4.327 -1.700 1.572 1.00 0.24 H new ATOM 0 HB3 ALA A 47 5.453 -1.074 2.800 1.00 0.24 H new ATOM 728 N VAL A 48 7.186 1.329 0.445 1.00 0.01 N ATOM 729 CA VAL A 48 8.163 2.416 0.771 1.00 0.02 C ATOM 730 C VAL A 48 7.400 3.663 1.216 1.00 0.01 C ATOM 731 O VAL A 48 6.352 3.970 0.684 1.00 0.01 O ATOM 732 CB VAL A 48 9.017 2.741 -0.457 1.00 0.09 C ATOM 733 CG1 VAL A 48 9.817 1.499 -0.862 1.00 0.48 C ATOM 734 CG2 VAL A 48 8.109 3.159 -1.616 1.00 0.65 C ATOM 0 H VAL A 48 6.565 1.530 -0.339 1.00 0.01 H new ATOM 0 HA VAL A 48 8.818 2.082 1.575 1.00 0.02 H new ATOM 0 HB VAL A 48 9.700 3.556 -0.219 1.00 0.09 H new ATOM 0 HG11 VAL A 48 10.426 1.728 -1.736 1.00 0.48 H new ATOM 0 HG12 VAL A 48 10.464 1.198 -0.038 1.00 0.48 H new ATOM 0 HG13 VAL A 48 9.131 0.686 -1.100 1.00 0.48 H new ATOM 0 HG21 VAL A 48 8.718 3.390 -2.490 1.00 0.65 H new ATOM 0 HG22 VAL A 48 7.426 2.344 -1.855 1.00 0.65 H new ATOM 0 HG23 VAL A 48 7.536 4.041 -1.329 1.00 0.65 H new ATOM 744 N TYR A 49 7.916 4.377 2.191 1.00 0.01 N ATOM 745 CA TYR A 49 7.222 5.608 2.686 1.00 0.01 C ATOM 746 C TYR A 49 8.142 6.816 2.522 1.00 0.01 C ATOM 747 O TYR A 49 9.350 6.735 2.667 1.00 0.02 O ATOM 748 CB TYR A 49 6.860 5.430 4.160 1.00 0.01 C ATOM 749 CG TYR A 49 5.790 4.369 4.287 1.00 0.00 C ATOM 750 CD1 TYR A 49 6.119 3.020 4.102 1.00 0.01 C ATOM 751 CD2 TYR A 49 4.471 4.734 4.587 1.00 0.01 C ATOM 752 CE1 TYR A 49 5.128 2.037 4.218 1.00 0.01 C ATOM 753 CE2 TYR A 49 3.482 3.750 4.702 1.00 0.01 C ATOM 754 CZ TYR A 49 3.811 2.403 4.519 1.00 0.02 C ATOM 755 OH TYR A 49 2.835 1.434 4.634 1.00 0.01 O ATOM 0 H TYR A 49 8.792 4.158 2.666 1.00 0.01 H new ATOM 0 HA TYR A 49 6.312 5.770 2.108 1.00 0.01 H new ATOM 0 HB2 TYR A 49 7.743 5.143 4.731 1.00 0.01 H new ATOM 0 HB3 TYR A 49 6.505 6.373 4.576 1.00 0.01 H new ATOM 0 HD1 TYR A 49 7.136 2.738 3.870 1.00 0.01 H new ATOM 0 HD2 TYR A 49 4.217 5.774 4.729 1.00 0.01 H new ATOM 0 HE1 TYR A 49 5.380 0.997 4.075 1.00 0.01 H new ATOM 0 HE2 TYR A 49 2.465 4.031 4.932 1.00 0.01 H new ATOM 0 HH TYR A 49 1.977 1.857 4.847 1.00 0.01 H new ATOM 765 N GLU A 50 7.552 7.931 2.180 1.00 0.01 N ATOM 766 CA GLU A 50 8.328 9.179 1.932 1.00 0.01 C ATOM 767 C GLU A 50 9.019 9.679 3.202 1.00 0.01 C ATOM 768 O GLU A 50 10.087 10.252 3.129 1.00 0.02 O ATOM 769 CB GLU A 50 7.363 10.255 1.432 1.00 0.02 C ATOM 770 CG GLU A 50 8.157 11.476 0.962 1.00 0.01 C ATOM 771 CD GLU A 50 7.197 12.515 0.378 1.00 0.02 C ATOM 772 OE1 GLU A 50 6.280 12.117 -0.323 1.00 0.01 O ATOM 773 OE2 GLU A 50 7.395 13.690 0.641 1.00 0.02 O ATOM 0 H GLU A 50 6.544 8.030 2.060 1.00 0.01 H new ATOM 0 HA GLU A 50 9.100 8.966 1.193 1.00 0.01 H new ATOM 0 HB2 GLU A 50 6.759 9.864 0.613 1.00 0.02 H new ATOM 0 HB3 GLU A 50 6.675 10.540 2.228 1.00 0.02 H new ATOM 0 HG2 GLU A 50 8.711 11.906 1.796 1.00 0.01 H new ATOM 0 HG3 GLU A 50 8.890 11.180 0.211 1.00 0.01 H new ATOM 780 N ARG A 51 8.424 9.499 4.364 1.00 0.02 N ATOM 781 CA ARG A 51 9.068 10.007 5.624 1.00 0.02 C ATOM 782 C ARG A 51 9.219 8.843 6.627 1.00 0.01 C ATOM 783 O ARG A 51 8.514 7.854 6.535 1.00 0.02 O ATOM 784 CB ARG A 51 8.152 11.101 6.221 1.00 0.02 C ATOM 785 CG ARG A 51 8.621 12.491 5.771 1.00 0.01 C ATOM 786 CD ARG A 51 7.737 13.561 6.416 1.00 0.02 C ATOM 787 NE ARG A 51 8.099 14.901 5.872 1.00 0.02 N ATOM 788 CZ ARG A 51 7.292 15.913 6.041 1.00 0.02 C ATOM 789 NH1 ARG A 51 6.168 15.749 6.685 1.00 0.02 N ATOM 790 NH2 ARG A 51 7.609 17.088 5.567 1.00 0.01 N ATOM 0 H ARG A 51 7.529 9.027 4.493 1.00 0.02 H new ATOM 0 HA ARG A 51 10.055 10.418 5.413 1.00 0.02 H new ATOM 0 HB2 ARG A 51 7.122 10.936 5.903 1.00 0.02 H new ATOM 0 HB3 ARG A 51 8.163 11.040 7.309 1.00 0.02 H new ATOM 0 HG2 ARG A 51 9.662 12.645 6.055 1.00 0.01 H new ATOM 0 HG3 ARG A 51 8.572 12.569 4.685 1.00 0.01 H new ATOM 0 HD2 ARG A 51 6.687 13.348 6.217 1.00 0.02 H new ATOM 0 HD3 ARG A 51 7.865 13.550 7.498 1.00 0.02 H new ATOM 0 HE ARG A 51 8.977 15.027 5.368 1.00 0.02 H new ATOM 0 HH11 ARG A 51 5.922 14.831 7.055 1.00 0.02 H new ATOM 0 HH12 ARG A 51 5.536 16.539 6.818 1.00 0.02 H new ATOM 0 HH21 ARG A 51 8.487 17.215 5.064 1.00 0.01 H new ATOM 0 HH22 ARG A 51 6.978 17.878 5.699 1.00 0.01 H new ATOM 804 N PRO A 52 10.133 8.967 7.579 1.00 0.02 N ATOM 805 CA PRO A 52 10.358 7.892 8.591 1.00 0.02 C ATOM 806 C PRO A 52 9.072 7.477 9.310 1.00 0.01 C ATOM 807 O PRO A 52 8.058 8.144 9.260 1.00 0.02 O ATOM 808 CB PRO A 52 11.372 8.542 9.561 1.00 0.02 C ATOM 809 CG PRO A 52 11.613 9.995 9.112 1.00 0.01 C ATOM 810 CD PRO A 52 11.005 10.172 7.713 1.00 0.01 C ATOM 0 HA PRO A 52 10.716 6.965 8.144 1.00 0.02 H new ATOM 0 HB2 PRO A 52 10.989 8.519 10.581 1.00 0.02 H new ATOM 0 HB3 PRO A 52 12.309 7.985 9.560 1.00 0.02 H new ATOM 0 HG2 PRO A 52 11.156 10.691 9.816 1.00 0.01 H new ATOM 0 HG3 PRO A 52 12.680 10.215 9.093 1.00 0.01 H new ATOM 0 HD2 PRO A 52 10.433 11.096 7.634 1.00 0.01 H new ATOM 0 HD3 PRO A 52 11.772 10.205 6.939 1.00 0.01 H new ATOM 818 N ASN A 53 9.154 6.377 10.006 1.00 0.02 N ATOM 819 CA ASN A 53 7.994 5.871 10.789 1.00 0.02 C ATOM 820 C ASN A 53 6.823 5.517 9.872 1.00 0.01 C ATOM 821 O ASN A 53 5.669 5.694 10.211 1.00 0.01 O ATOM 822 CB ASN A 53 7.565 6.940 11.801 1.00 0.01 C ATOM 823 CG ASN A 53 6.708 6.300 12.896 1.00 0.02 C ATOM 824 OD1 ASN A 53 5.655 5.757 12.623 1.00 0.02 O ATOM 825 ND2 ASN A 53 7.119 6.340 14.135 1.00 0.01 N ATOM 0 H ASN A 53 9.992 5.798 10.065 1.00 0.02 H new ATOM 0 HA ASN A 53 8.294 4.964 11.314 1.00 0.02 H new ATOM 0 HB2 ASN A 53 8.444 7.410 12.242 1.00 0.01 H new ATOM 0 HB3 ASN A 53 7.002 7.726 11.298 1.00 0.01 H new ATOM 0 HD21 ASN A 53 6.557 5.916 14.873 1.00 0.01 H new ATOM 0 HD22 ASN A 53 8.002 6.795 14.365 1.00 0.01 H new ATOM 832 N PHE A 54 7.124 4.990 8.715 1.00 0.02 N ATOM 833 CA PHE A 54 6.056 4.584 7.762 1.00 0.01 C ATOM 834 C PHE A 54 4.986 5.670 7.656 1.00 0.01 C ATOM 835 O PHE A 54 3.804 5.417 7.796 1.00 0.02 O ATOM 836 CB PHE A 54 5.433 3.266 8.245 1.00 1.78 C ATOM 837 CG PHE A 54 6.511 2.398 8.861 1.00 2.32 C ATOM 838 CD1 PHE A 54 7.640 2.049 8.109 1.00 2.53 C ATOM 839 CD2 PHE A 54 6.385 1.946 10.183 1.00 2.77 C ATOM 840 CE1 PHE A 54 8.640 1.250 8.676 1.00 3.03 C ATOM 841 CE2 PHE A 54 7.386 1.146 10.748 1.00 3.32 C ATOM 842 CZ PHE A 54 8.513 0.799 9.995 1.00 3.39 C ATOM 0 H PHE A 54 8.076 4.823 8.388 1.00 0.02 H new ATOM 0 HA PHE A 54 6.490 4.444 6.772 1.00 0.01 H new ATOM 0 HB2 PHE A 54 4.650 3.467 8.976 1.00 1.78 H new ATOM 0 HB3 PHE A 54 4.964 2.745 7.410 1.00 1.78 H new ATOM 0 HD1 PHE A 54 7.739 2.396 7.091 1.00 2.53 H new ATOM 0 HD2 PHE A 54 5.516 2.215 10.765 1.00 2.77 H new ATOM 0 HE1 PHE A 54 9.510 0.981 8.095 1.00 3.03 H new ATOM 0 HE2 PHE A 54 7.288 0.797 11.765 1.00 3.32 H new ATOM 0 HZ PHE A 54 9.285 0.183 10.432 1.00 3.39 H new ATOM 852 N SER A 55 5.411 6.887 7.406 1.00 0.02 N ATOM 853 CA SER A 55 4.451 8.032 7.281 1.00 0.02 C ATOM 854 C SER A 55 4.665 8.751 5.944 1.00 0.01 C ATOM 855 O SER A 55 5.677 8.578 5.289 1.00 0.01 O ATOM 856 CB SER A 55 4.690 9.018 8.425 1.00 1.90 C ATOM 857 OG SER A 55 5.916 9.704 8.207 1.00 2.33 O ATOM 0 H SER A 55 6.392 7.138 7.282 1.00 0.02 H new ATOM 0 HA SER A 55 3.431 7.650 7.325 1.00 0.02 H new ATOM 0 HB2 SER A 55 3.867 9.730 8.484 1.00 1.90 H new ATOM 0 HB3 SER A 55 4.721 8.488 9.377 1.00 1.90 H new ATOM 0 HG SER A 55 6.655 9.181 8.582 1.00 2.33 H new ATOM 863 N GLY A 56 3.712 9.547 5.527 1.00 0.02 N ATOM 864 CA GLY A 56 3.842 10.269 4.226 1.00 0.02 C ATOM 865 C GLY A 56 3.291 9.393 3.095 1.00 0.02 C ATOM 866 O GLY A 56 2.533 8.471 3.328 1.00 0.00 O ATOM 0 H GLY A 56 2.846 9.728 6.035 1.00 0.02 H new ATOM 0 HA2 GLY A 56 3.298 11.213 4.266 1.00 0.02 H new ATOM 0 HA3 GLY A 56 4.888 10.511 4.036 1.00 0.02 H new ATOM 870 N HIS A 57 3.642 9.681 1.871 1.00 0.02 N ATOM 871 CA HIS A 57 3.110 8.873 0.732 1.00 0.02 C ATOM 872 C HIS A 57 3.629 7.437 0.817 1.00 0.01 C ATOM 873 O HIS A 57 4.784 7.209 1.120 1.00 0.01 O ATOM 874 CB HIS A 57 3.555 9.501 -0.589 1.00 0.00 C ATOM 875 CG HIS A 57 3.110 10.938 -0.640 1.00 0.01 C ATOM 876 ND1 HIS A 57 3.733 11.932 0.098 1.00 0.01 N ATOM 877 CD2 HIS A 57 2.103 11.561 -1.333 1.00 0.01 C ATOM 878 CE1 HIS A 57 3.098 13.089 -0.164 1.00 0.02 C ATOM 879 NE2 HIS A 57 2.097 12.920 -1.032 1.00 0.01 N ATOM 0 H HIS A 57 4.273 10.439 1.609 1.00 0.02 H new ATOM 0 HA HIS A 57 2.021 8.859 0.783 1.00 0.02 H new ATOM 0 HB2 HIS A 57 4.639 9.442 -0.684 1.00 0.00 H new ATOM 0 HB3 HIS A 57 3.131 8.948 -1.427 1.00 0.00 H new ATOM 0 HD2 HIS A 57 1.419 11.071 -2.010 1.00 0.01 H new ATOM 0 HE1 HIS A 57 3.365 14.039 0.274 1.00 0.02 H new ATOM 0 HE2 HIS A 57 1.465 13.633 -1.396 1.00 0.01 H new ATOM 887 N MET A 58 2.779 6.470 0.541 1.00 0.02 N ATOM 888 CA MET A 58 3.201 5.029 0.590 1.00 0.02 C ATOM 889 C MET A 58 3.035 4.393 -0.798 1.00 0.01 C ATOM 890 O MET A 58 2.053 4.611 -1.479 1.00 0.01 O ATOM 891 CB MET A 58 2.320 4.283 1.595 1.00 2.61 C ATOM 892 CG MET A 58 0.869 4.304 1.114 1.00 3.46 C ATOM 893 SD MET A 58 -0.221 3.805 2.470 1.00 4.50 S ATOM 894 CE MET A 58 -0.117 2.018 2.193 1.00 5.01 C ATOM 0 H MET A 58 1.804 6.620 0.282 1.00 0.02 H new ATOM 0 HA MET A 58 4.246 4.967 0.893 1.00 0.02 H new ATOM 0 HB2 MET A 58 2.664 3.254 1.703 1.00 2.61 H new ATOM 0 HB3 MET A 58 2.396 4.749 2.577 1.00 2.61 H new ATOM 0 HG2 MET A 58 0.603 5.303 0.768 1.00 3.46 H new ATOM 0 HG3 MET A 58 0.745 3.630 0.266 1.00 3.46 H new ATOM 0 HE1 MET A 58 -0.727 1.499 2.932 1.00 5.01 H new ATOM 0 HE2 MET A 58 -0.481 1.783 1.193 1.00 5.01 H new ATOM 0 HE3 MET A 58 0.920 1.695 2.287 1.00 5.01 H new ATOM 904 N TYR A 59 3.998 3.610 -1.216 1.00 0.02 N ATOM 905 CA TYR A 59 3.930 2.944 -2.562 1.00 0.01 C ATOM 906 C TYR A 59 4.324 1.467 -2.432 1.00 0.01 C ATOM 907 O TYR A 59 5.248 1.117 -1.726 1.00 0.02 O ATOM 908 CB TYR A 59 4.909 3.627 -3.518 1.00 0.01 C ATOM 909 CG TYR A 59 4.467 5.048 -3.773 1.00 0.01 C ATOM 910 CD1 TYR A 59 3.557 5.323 -4.799 1.00 0.01 C ATOM 911 CD2 TYR A 59 4.973 6.088 -2.987 1.00 0.01 C ATOM 912 CE1 TYR A 59 3.152 6.641 -5.041 1.00 0.02 C ATOM 913 CE2 TYR A 59 4.569 7.406 -3.229 1.00 0.01 C ATOM 914 CZ TYR A 59 3.660 7.683 -4.256 1.00 0.01 C ATOM 915 OH TYR A 59 3.262 8.982 -4.493 1.00 0.01 O ATOM 0 H TYR A 59 4.839 3.399 -0.679 1.00 0.02 H new ATOM 0 HA TYR A 59 2.913 3.023 -2.945 1.00 0.01 H new ATOM 0 HB2 TYR A 59 5.912 3.619 -3.092 1.00 0.01 H new ATOM 0 HB3 TYR A 59 4.957 3.077 -4.458 1.00 0.01 H new ATOM 0 HD1 TYR A 59 3.167 4.518 -5.405 1.00 0.01 H new ATOM 0 HD2 TYR A 59 5.675 5.874 -2.194 1.00 0.01 H new ATOM 0 HE1 TYR A 59 2.448 6.854 -5.832 1.00 0.02 H new ATOM 0 HE2 TYR A 59 4.959 8.210 -2.622 1.00 0.01 H new ATOM 0 HH TYR A 59 3.708 9.582 -3.859 1.00 0.01 H new ATOM 925 N ILE A 60 3.623 0.601 -3.126 1.00 0.02 N ATOM 926 CA ILE A 60 3.933 -0.864 -3.082 1.00 0.01 C ATOM 927 C ILE A 60 4.858 -1.212 -4.256 1.00 0.01 C ATOM 928 O ILE A 60 4.606 -0.825 -5.379 1.00 0.01 O ATOM 929 CB ILE A 60 2.630 -1.664 -3.215 1.00 0.45 C ATOM 930 CG1 ILE A 60 1.539 -1.067 -2.307 1.00 1.35 C ATOM 931 CG2 ILE A 60 2.881 -3.126 -2.837 1.00 1.21 C ATOM 932 CD1 ILE A 60 1.963 -1.117 -0.831 1.00 1.72 C ATOM 0 H ILE A 60 2.839 0.851 -3.729 1.00 0.02 H new ATOM 0 HA ILE A 60 4.419 -1.110 -2.138 1.00 0.01 H new ATOM 0 HB ILE A 60 2.289 -1.612 -4.249 1.00 0.45 H new ATOM 0 HG12 ILE A 60 1.343 -0.035 -2.598 1.00 1.35 H new ATOM 0 HG13 ILE A 60 0.608 -1.618 -2.441 1.00 1.35 H new ATOM 0 HG21 ILE A 60 1.954 -3.691 -2.933 1.00 1.21 H new ATOM 0 HG22 ILE A 60 3.634 -3.550 -3.502 1.00 1.21 H new ATOM 0 HG23 ILE A 60 3.234 -3.180 -1.807 1.00 1.21 H new ATOM 0 HD11 ILE A 60 1.175 -0.689 -0.211 1.00 1.72 H new ATOM 0 HD12 ILE A 60 2.134 -2.152 -0.537 1.00 1.72 H new ATOM 0 HD13 ILE A 60 2.881 -0.545 -0.697 1.00 1.72 H new ATOM 944 N LEU A 61 5.945 -1.910 -3.998 1.00 0.01 N ATOM 945 CA LEU A 61 6.915 -2.253 -5.098 1.00 0.01 C ATOM 946 C LEU A 61 7.074 -3.795 -5.233 1.00 0.01 C ATOM 947 O LEU A 61 7.665 -4.419 -4.369 1.00 0.00 O ATOM 948 CB LEU A 61 8.290 -1.621 -4.736 1.00 0.01 C ATOM 949 CG LEU A 61 8.680 -0.525 -5.745 1.00 0.02 C ATOM 950 CD1 LEU A 61 9.824 0.312 -5.174 1.00 0.01 C ATOM 951 CD2 LEU A 61 9.144 -1.171 -7.053 1.00 0.01 C ATOM 0 H LEU A 61 6.203 -2.257 -3.074 1.00 0.01 H new ATOM 0 HA LEU A 61 6.545 -1.866 -6.047 1.00 0.01 H new ATOM 0 HB2 LEU A 61 8.246 -1.197 -3.733 1.00 0.01 H new ATOM 0 HB3 LEU A 61 9.057 -2.395 -4.721 1.00 0.01 H new ATOM 0 HG LEU A 61 7.815 0.110 -5.934 1.00 0.02 H new ATOM 0 HD11 LEU A 61 10.099 1.087 -5.889 1.00 0.01 H new ATOM 0 HD12 LEU A 61 9.505 0.776 -4.241 1.00 0.01 H new ATOM 0 HD13 LEU A 61 10.685 -0.329 -4.985 1.00 0.01 H new ATOM 0 HD21 LEU A 61 9.419 -0.393 -7.765 1.00 0.01 H new ATOM 0 HD22 LEU A 61 10.008 -1.807 -6.858 1.00 0.01 H new ATOM 0 HD23 LEU A 61 8.336 -1.773 -7.468 1.00 0.01 H new ATOM 963 N PRO A 62 6.597 -4.418 -6.306 1.00 0.02 N ATOM 964 CA PRO A 62 6.786 -5.888 -6.477 1.00 0.01 C ATOM 965 C PRO A 62 8.217 -6.194 -6.956 1.00 0.00 C ATOM 966 O PRO A 62 8.957 -5.300 -7.319 1.00 0.02 O ATOM 967 CB PRO A 62 5.745 -6.229 -7.553 1.00 1.47 C ATOM 968 CG PRO A 62 5.368 -4.922 -8.273 1.00 1.29 C ATOM 969 CD PRO A 62 5.839 -3.739 -7.401 1.00 0.82 C ATOM 0 HA PRO A 62 6.659 -6.464 -5.561 1.00 0.01 H new ATOM 0 HB2 PRO A 62 6.150 -6.952 -8.261 1.00 1.47 H new ATOM 0 HB3 PRO A 62 4.864 -6.684 -7.101 1.00 1.47 H new ATOM 0 HG2 PRO A 62 5.837 -4.880 -9.256 1.00 1.29 H new ATOM 0 HG3 PRO A 62 4.291 -4.872 -8.432 1.00 1.29 H new ATOM 0 HD2 PRO A 62 6.469 -3.049 -7.962 1.00 0.82 H new ATOM 0 HD3 PRO A 62 4.999 -3.162 -7.014 1.00 0.82 H new ATOM 977 N GLN A 63 8.615 -7.439 -6.958 1.00 0.02 N ATOM 978 CA GLN A 63 9.997 -7.785 -7.407 1.00 0.00 C ATOM 979 C GLN A 63 10.271 -7.209 -8.801 1.00 0.00 C ATOM 980 O GLN A 63 9.412 -7.218 -9.660 1.00 0.02 O ATOM 981 CB GLN A 63 10.139 -9.305 -7.458 1.00 1.27 C ATOM 982 CG GLN A 63 9.036 -9.891 -8.342 1.00 1.67 C ATOM 983 CD GLN A 63 9.113 -11.419 -8.313 1.00 2.43 C ATOM 984 OE1 GLN A 63 9.336 -12.008 -7.273 1.00 4.25 O ATOM 985 NE2 GLN A 63 8.938 -12.090 -9.418 1.00 3.04 N ATOM 0 H GLN A 63 8.043 -8.232 -6.668 1.00 0.02 H new ATOM 0 HA GLN A 63 10.713 -7.360 -6.703 1.00 0.00 H new ATOM 0 HB2 GLN A 63 11.118 -9.576 -7.852 1.00 1.27 H new ATOM 0 HB3 GLN A 63 10.074 -9.721 -6.453 1.00 1.27 H new ATOM 0 HG2 GLN A 63 8.059 -9.559 -7.990 1.00 1.67 H new ATOM 0 HG3 GLN A 63 9.146 -9.531 -9.365 1.00 1.67 H new ATOM 0 HE21 GLN A 63 8.751 -11.596 -10.291 1.00 3.04 H new ATOM 0 HE22 GLN A 63 8.988 -13.109 -9.409 1.00 3.04 H new ATOM 994 N GLY A 64 11.463 -6.716 -9.045 1.00 0.02 N ATOM 995 CA GLY A 64 11.766 -6.158 -10.400 1.00 0.01 C ATOM 996 C GLY A 64 12.889 -5.115 -10.325 1.00 0.02 C ATOM 997 O GLY A 64 13.455 -4.857 -9.280 1.00 0.02 O ATOM 0 H GLY A 64 12.230 -6.676 -8.373 1.00 0.02 H new ATOM 0 HA2 GLY A 64 12.058 -6.964 -11.073 1.00 0.01 H new ATOM 0 HA3 GLY A 64 10.869 -5.702 -10.819 1.00 0.01 H new ATOM 1001 N GLU A 65 13.215 -4.515 -11.444 1.00 0.02 N ATOM 1002 CA GLU A 65 14.302 -3.485 -11.485 1.00 0.02 C ATOM 1003 C GLU A 65 13.732 -2.149 -11.969 1.00 0.02 C ATOM 1004 O GLU A 65 13.048 -2.077 -12.972 1.00 0.02 O ATOM 1005 CB GLU A 65 15.386 -3.948 -12.462 1.00 0.77 C ATOM 1006 CG GLU A 65 16.627 -3.067 -12.304 1.00 0.49 C ATOM 1007 CD GLU A 65 17.558 -3.273 -13.502 1.00 0.67 C ATOM 1008 OE1 GLU A 65 17.071 -3.239 -14.621 1.00 0.96 O ATOM 1009 OE2 GLU A 65 18.743 -3.461 -13.278 1.00 0.71 O ATOM 0 H GLU A 65 12.768 -4.697 -12.343 1.00 0.02 H new ATOM 0 HA GLU A 65 14.722 -3.359 -10.487 1.00 0.02 H new ATOM 0 HB2 GLU A 65 15.641 -4.991 -12.271 1.00 0.77 H new ATOM 0 HB3 GLU A 65 15.016 -3.892 -13.486 1.00 0.77 H new ATOM 0 HG2 GLU A 65 16.335 -2.019 -12.233 1.00 0.49 H new ATOM 0 HG3 GLU A 65 17.147 -3.316 -11.379 1.00 0.49 H new ATOM 1016 N TYR A 66 14.032 -1.087 -11.260 1.00 0.02 N ATOM 1017 CA TYR A 66 13.547 0.271 -11.647 1.00 0.02 C ATOM 1018 C TYR A 66 14.780 1.174 -11.859 1.00 0.02 C ATOM 1019 O TYR A 66 15.337 1.676 -10.899 1.00 0.02 O ATOM 1020 CB TYR A 66 12.703 0.818 -10.495 1.00 0.01 C ATOM 1021 CG TYR A 66 11.521 -0.097 -10.286 1.00 0.02 C ATOM 1022 CD1 TYR A 66 11.672 -1.280 -9.551 1.00 0.02 C ATOM 1023 CD2 TYR A 66 10.277 0.229 -10.838 1.00 0.01 C ATOM 1024 CE1 TYR A 66 10.578 -2.133 -9.365 1.00 0.02 C ATOM 1025 CE2 TYR A 66 9.183 -0.626 -10.654 1.00 0.02 C ATOM 1026 CZ TYR A 66 9.334 -1.806 -9.917 1.00 0.02 C ATOM 1027 OH TYR A 66 8.256 -2.649 -9.736 1.00 0.01 O ATOM 0 H TYR A 66 14.603 -1.107 -10.415 1.00 0.02 H new ATOM 0 HA TYR A 66 12.951 0.236 -12.559 1.00 0.02 H new ATOM 0 HB2 TYR A 66 13.300 0.879 -9.585 1.00 0.01 H new ATOM 0 HB3 TYR A 66 12.363 1.829 -10.722 1.00 0.01 H new ATOM 0 HD1 TYR A 66 12.633 -1.534 -9.128 1.00 0.02 H new ATOM 0 HD2 TYR A 66 10.161 1.140 -11.406 1.00 0.01 H new ATOM 0 HE1 TYR A 66 10.694 -3.043 -8.796 1.00 0.02 H new ATOM 0 HE2 TYR A 66 8.223 -0.375 -11.081 1.00 0.02 H new ATOM 0 HH TYR A 66 7.469 -2.274 -10.183 1.00 0.01 H new ATOM 1037 N PRO A 67 15.235 1.368 -13.089 1.00 0.01 N ATOM 1038 CA PRO A 67 16.444 2.208 -13.331 1.00 0.02 C ATOM 1039 C PRO A 67 16.223 3.703 -13.059 1.00 0.02 C ATOM 1040 O PRO A 67 17.153 4.483 -13.118 1.00 0.02 O ATOM 1041 CB PRO A 67 16.754 1.946 -14.821 1.00 0.02 C ATOM 1042 CG PRO A 67 15.603 1.113 -15.422 1.00 0.02 C ATOM 1043 CD PRO A 67 14.600 0.772 -14.301 1.00 0.01 C ATOM 0 HA PRO A 67 17.258 1.948 -12.655 1.00 0.02 H new ATOM 0 HB2 PRO A 67 16.859 2.889 -15.357 1.00 0.02 H new ATOM 0 HB3 PRO A 67 17.700 1.414 -14.923 1.00 0.02 H new ATOM 0 HG2 PRO A 67 15.107 1.672 -16.216 1.00 0.02 H new ATOM 0 HG3 PRO A 67 15.993 0.199 -15.871 1.00 0.02 H new ATOM 0 HD2 PRO A 67 13.617 1.202 -14.494 1.00 0.01 H new ATOM 0 HD3 PRO A 67 14.462 -0.304 -14.196 1.00 0.01 H new ATOM 1051 N GLU A 68 15.026 4.116 -12.741 1.00 0.01 N ATOM 1052 CA GLU A 68 14.799 5.562 -12.451 1.00 0.01 C ATOM 1053 C GLU A 68 13.538 5.679 -11.594 1.00 0.03 C ATOM 1054 O GLU A 68 12.684 4.815 -11.588 1.00 0.02 O ATOM 1055 CB GLU A 68 14.601 6.344 -13.756 1.00 0.69 C ATOM 1056 CG GLU A 68 15.919 6.418 -14.529 1.00 1.09 C ATOM 1057 CD GLU A 68 15.812 7.486 -15.619 1.00 1.35 C ATOM 1058 OE1 GLU A 68 14.782 8.136 -15.685 1.00 1.55 O ATOM 1059 OE2 GLU A 68 16.762 7.635 -16.369 1.00 2.02 O ATOM 0 H GLU A 68 14.201 3.521 -12.670 1.00 0.01 H new ATOM 0 HA GLU A 68 15.662 5.974 -11.929 1.00 0.01 H new ATOM 0 HB2 GLU A 68 13.839 5.860 -14.367 1.00 0.69 H new ATOM 0 HB3 GLU A 68 14.242 7.350 -13.536 1.00 0.69 H new ATOM 0 HG2 GLU A 68 16.738 6.657 -13.850 1.00 1.09 H new ATOM 0 HG3 GLU A 68 16.146 5.450 -14.975 1.00 1.09 H new ATOM 1066 N TYR A 69 13.447 6.730 -10.831 1.00 0.02 N ATOM 1067 CA TYR A 69 12.284 6.894 -9.918 1.00 0.02 C ATOM 1068 C TYR A 69 10.956 6.917 -10.680 1.00 0.01 C ATOM 1069 O TYR A 69 9.965 6.371 -10.234 1.00 0.01 O ATOM 1070 CB TYR A 69 12.460 8.172 -9.090 1.00 0.02 C ATOM 1071 CG TYR A 69 12.592 9.364 -10.007 1.00 0.02 C ATOM 1072 CD1 TYR A 69 13.834 9.675 -10.575 1.00 0.02 C ATOM 1073 CD2 TYR A 69 11.476 10.161 -10.285 1.00 0.02 C ATOM 1074 CE1 TYR A 69 13.957 10.782 -11.423 1.00 0.02 C ATOM 1075 CE2 TYR A 69 11.600 11.269 -11.132 1.00 0.02 C ATOM 1076 CZ TYR A 69 12.840 11.579 -11.701 1.00 0.02 C ATOM 1077 OH TYR A 69 12.962 12.672 -12.536 1.00 0.01 O ATOM 0 H TYR A 69 14.131 7.486 -10.800 1.00 0.02 H new ATOM 0 HA TYR A 69 12.250 6.032 -9.251 1.00 0.02 H new ATOM 0 HB2 TYR A 69 11.606 8.306 -8.426 1.00 0.02 H new ATOM 0 HB3 TYR A 69 13.345 8.088 -8.459 1.00 0.02 H new ATOM 0 HD1 TYR A 69 14.696 9.061 -10.359 1.00 0.02 H new ATOM 0 HD2 TYR A 69 10.519 9.921 -9.846 1.00 0.02 H new ATOM 0 HE1 TYR A 69 14.914 11.021 -11.863 1.00 0.02 H new ATOM 0 HE2 TYR A 69 10.739 11.884 -11.346 1.00 0.02 H new ATOM 0 HH TYR A 69 12.092 13.115 -12.624 1.00 0.01 H new ATOM 1087 N GLN A 70 10.925 7.542 -11.825 1.00 0.01 N ATOM 1088 CA GLN A 70 9.664 7.599 -12.620 1.00 0.02 C ATOM 1089 C GLN A 70 9.197 6.186 -12.991 1.00 0.01 C ATOM 1090 O GLN A 70 8.032 5.948 -13.239 1.00 0.02 O ATOM 1091 CB GLN A 70 9.916 8.393 -13.902 1.00 0.01 C ATOM 1092 CG GLN A 70 10.515 9.757 -13.552 1.00 0.01 C ATOM 1093 CD GLN A 70 10.595 10.621 -14.812 1.00 0.02 C ATOM 1094 OE1 GLN A 70 11.662 10.827 -15.355 1.00 0.01 O ATOM 1095 NE2 GLN A 70 9.503 11.142 -15.302 1.00 0.02 N ATOM 0 H GLN A 70 11.722 8.018 -12.247 1.00 0.01 H new ATOM 0 HA GLN A 70 8.892 8.081 -12.021 1.00 0.02 H new ATOM 0 HB2 GLN A 70 10.594 7.843 -14.555 1.00 0.01 H new ATOM 0 HB3 GLN A 70 8.983 8.524 -14.450 1.00 0.01 H new ATOM 0 HG2 GLN A 70 9.903 10.252 -12.798 1.00 0.01 H new ATOM 0 HG3 GLN A 70 11.509 9.630 -13.122 1.00 0.01 H new ATOM 0 HE21 GLN A 70 8.607 10.969 -14.847 1.00 0.02 H new ATOM 0 HE22 GLN A 70 9.546 11.722 -16.140 1.00 0.02 H new ATOM 1104 N ARG A 71 10.108 5.245 -13.026 1.00 0.01 N ATOM 1105 CA ARG A 71 9.722 3.847 -13.377 1.00 0.02 C ATOM 1106 C ARG A 71 8.898 3.257 -12.232 1.00 0.01 C ATOM 1107 O ARG A 71 8.191 2.282 -12.390 1.00 0.02 O ATOM 1108 CB ARG A 71 10.979 2.998 -13.602 1.00 0.34 C ATOM 1109 CG ARG A 71 10.614 1.694 -14.339 1.00 0.72 C ATOM 1110 CD ARG A 71 10.604 1.924 -15.857 1.00 1.04 C ATOM 1111 NE ARG A 71 10.365 0.629 -16.553 1.00 1.67 N ATOM 1112 CZ ARG A 71 10.025 0.615 -17.813 1.00 2.47 C ATOM 1113 NH1 ARG A 71 9.896 1.737 -18.468 1.00 2.54 N ATOM 1114 NH2 ARG A 71 9.818 -0.522 -18.419 1.00 3.42 N ATOM 0 H ARG A 71 11.099 5.385 -12.827 1.00 0.01 H new ATOM 0 HA ARG A 71 9.132 3.850 -14.293 1.00 0.02 H new ATOM 0 HB2 ARG A 71 11.708 3.562 -14.184 1.00 0.34 H new ATOM 0 HB3 ARG A 71 11.446 2.765 -12.645 1.00 0.34 H new ATOM 0 HG2 ARG A 71 11.332 0.913 -14.087 1.00 0.72 H new ATOM 0 HG3 ARG A 71 9.635 1.345 -14.011 1.00 0.72 H new ATOM 0 HD2 ARG A 71 9.827 2.641 -16.122 1.00 1.04 H new ATOM 0 HD3 ARG A 71 11.554 2.351 -16.177 1.00 1.04 H new ATOM 0 HE ARG A 71 10.467 -0.249 -16.044 1.00 1.67 H new ATOM 0 HH11 ARG A 71 10.061 2.626 -17.995 1.00 2.54 H new ATOM 0 HH12 ARG A 71 9.630 1.725 -19.453 1.00 2.54 H new ATOM 0 HH21 ARG A 71 9.922 -1.399 -17.908 1.00 3.42 H new ATOM 0 HH22 ARG A 71 9.552 -0.534 -19.404 1.00 3.42 H new ATOM 1128 N TRP A 72 8.999 3.856 -11.076 1.00 0.02 N ATOM 1129 CA TRP A 72 8.248 3.374 -9.879 1.00 0.01 C ATOM 1130 C TRP A 72 7.140 4.394 -9.586 1.00 0.01 C ATOM 1131 O TRP A 72 6.482 4.357 -8.567 1.00 0.02 O ATOM 1132 CB TRP A 72 9.261 3.253 -8.716 1.00 0.02 C ATOM 1133 CG TRP A 72 8.636 3.531 -7.383 1.00 0.01 C ATOM 1134 CD1 TRP A 72 7.646 2.807 -6.814 1.00 0.01 C ATOM 1135 CD2 TRP A 72 8.962 4.593 -6.443 1.00 0.02 C ATOM 1136 NE1 TRP A 72 7.340 3.362 -5.584 1.00 0.02 N ATOM 1137 CE2 TRP A 72 8.126 4.465 -5.311 1.00 0.02 C ATOM 1138 CE3 TRP A 72 9.894 5.647 -6.465 1.00 0.01 C ATOM 1139 CZ2 TRP A 72 8.212 5.351 -4.236 1.00 0.02 C ATOM 1140 CZ3 TRP A 72 9.982 6.541 -5.386 1.00 0.02 C ATOM 1141 CH2 TRP A 72 9.143 6.393 -4.273 1.00 0.02 C ATOM 0 H TRP A 72 9.582 4.676 -10.907 1.00 0.02 H new ATOM 0 HA TRP A 72 7.782 2.400 -10.030 1.00 0.01 H new ATOM 0 HB2 TRP A 72 9.688 2.250 -8.712 1.00 0.02 H new ATOM 0 HB3 TRP A 72 10.084 3.949 -8.881 1.00 0.02 H new ATOM 0 HD1 TRP A 72 7.172 1.939 -7.248 1.00 0.01 H new ATOM 0 HE1 TRP A 72 6.622 3.001 -4.956 1.00 0.02 H new ATOM 0 HE3 TRP A 72 10.546 5.769 -7.317 1.00 0.01 H new ATOM 0 HZ2 TRP A 72 7.563 5.232 -3.381 1.00 0.02 H new ATOM 0 HZ3 TRP A 72 10.700 7.347 -5.414 1.00 0.02 H new ATOM 0 HH2 TRP A 72 9.216 7.083 -3.445 1.00 0.02 H new ATOM 1152 N MET A 73 6.934 5.303 -10.498 1.00 0.02 N ATOM 1153 CA MET A 73 5.878 6.340 -10.316 1.00 0.02 C ATOM 1154 C MET A 73 6.168 7.188 -9.070 1.00 0.01 C ATOM 1155 O MET A 73 5.285 7.799 -8.500 1.00 0.02 O ATOM 1156 CB MET A 73 4.511 5.662 -10.172 1.00 0.02 C ATOM 1157 CG MET A 73 4.393 4.520 -11.187 1.00 0.01 C ATOM 1158 SD MET A 73 2.656 4.038 -11.354 1.00 0.01 S ATOM 1159 CE MET A 73 2.914 2.643 -12.476 1.00 0.01 C ATOM 0 H MET A 73 7.457 5.373 -11.371 1.00 0.02 H new ATOM 0 HA MET A 73 5.872 6.992 -11.189 1.00 0.02 H new ATOM 0 HB2 MET A 73 4.390 5.276 -9.160 1.00 0.02 H new ATOM 0 HB3 MET A 73 3.715 6.389 -10.333 1.00 0.02 H new ATOM 0 HG2 MET A 73 4.788 4.835 -12.153 1.00 0.01 H new ATOM 0 HG3 MET A 73 4.989 3.667 -10.862 1.00 0.01 H new ATOM 0 HE1 MET A 73 1.954 2.187 -12.716 1.00 0.01 H new ATOM 0 HE2 MET A 73 3.388 2.996 -13.392 1.00 0.01 H new ATOM 0 HE3 MET A 73 3.556 1.904 -11.996 1.00 0.01 H new ATOM 1169 N GLY A 74 7.405 7.222 -8.647 1.00 0.02 N ATOM 1170 CA GLY A 74 7.758 8.021 -7.440 1.00 0.02 C ATOM 1171 C GLY A 74 7.395 9.484 -7.677 1.00 0.01 C ATOM 1172 O GLY A 74 7.549 10.000 -8.767 1.00 0.01 O ATOM 0 H GLY A 74 8.184 6.731 -9.086 1.00 0.02 H new ATOM 0 HA2 GLY A 74 7.225 7.639 -6.569 1.00 0.02 H new ATOM 0 HA3 GLY A 74 8.823 7.929 -7.228 1.00 0.02 H new ATOM 1176 N LEU A 75 6.953 10.175 -6.661 1.00 0.02 N ATOM 1177 CA LEU A 75 6.634 11.621 -6.838 1.00 0.02 C ATOM 1178 C LEU A 75 7.959 12.393 -6.804 1.00 0.01 C ATOM 1179 O LEU A 75 8.123 13.402 -7.461 1.00 0.02 O ATOM 1180 CB LEU A 75 5.703 12.083 -5.709 1.00 0.55 C ATOM 1181 CG LEU A 75 5.524 13.606 -5.752 1.00 0.58 C ATOM 1182 CD1 LEU A 75 5.051 14.040 -7.146 1.00 0.98 C ATOM 1183 CD2 LEU A 75 4.482 14.018 -4.707 1.00 0.42 C ATOM 0 H LEU A 75 6.800 9.805 -5.723 1.00 0.02 H new ATOM 0 HA LEU A 75 6.125 11.800 -7.785 1.00 0.02 H new ATOM 0 HB2 LEU A 75 4.734 11.594 -5.805 1.00 0.55 H new ATOM 0 HB3 LEU A 75 6.115 11.786 -4.745 1.00 0.55 H new ATOM 0 HG LEU A 75 6.477 14.088 -5.535 1.00 0.58 H new ATOM 0 HD11 LEU A 75 4.927 15.123 -7.167 1.00 0.98 H new ATOM 0 HD12 LEU A 75 5.791 13.745 -7.890 1.00 0.98 H new ATOM 0 HD13 LEU A 75 4.099 13.561 -7.373 1.00 0.98 H new ATOM 0 HD21 LEU A 75 4.350 15.100 -4.732 1.00 0.42 H new ATOM 0 HD22 LEU A 75 3.532 13.531 -4.928 1.00 0.42 H new ATOM 0 HD23 LEU A 75 4.822 13.717 -3.716 1.00 0.42 H new ATOM 1195 N ASN A 76 8.916 11.898 -6.061 1.00 0.01 N ATOM 1196 CA ASN A 76 10.255 12.535 -5.976 1.00 0.02 C ATOM 1197 C ASN A 76 11.228 11.438 -5.533 1.00 0.02 C ATOM 1198 O ASN A 76 10.863 10.279 -5.486 1.00 0.02 O ATOM 1199 CB ASN A 76 10.232 13.674 -4.953 1.00 0.02 C ATOM 1200 CG ASN A 76 11.492 14.527 -5.107 1.00 0.02 C ATOM 1201 OD1 ASN A 76 12.437 14.378 -4.360 1.00 0.01 O ATOM 1202 ND2 ASN A 76 11.544 15.422 -6.055 1.00 0.02 N ATOM 0 H ASN A 76 8.817 11.055 -5.496 1.00 0.01 H new ATOM 0 HA ASN A 76 10.554 12.962 -6.933 1.00 0.02 H new ATOM 0 HB2 ASN A 76 9.344 14.289 -5.099 1.00 0.02 H new ATOM 0 HB3 ASN A 76 10.177 13.268 -3.943 1.00 0.02 H new ATOM 0 HD21 ASN A 76 12.379 15.997 -6.169 1.00 0.02 H new ATOM 0 HD22 ASN A 76 10.750 15.547 -6.683 1.00 0.02 H new ATOM 1209 N ASP A 77 12.454 11.766 -5.223 1.00 0.01 N ATOM 1210 CA ASP A 77 13.428 10.704 -4.807 1.00 0.01 C ATOM 1211 C ASP A 77 13.542 10.641 -3.280 1.00 0.01 C ATOM 1212 O ASP A 77 14.577 10.281 -2.753 1.00 0.01 O ATOM 1213 CB ASP A 77 14.802 11.035 -5.389 1.00 0.01 C ATOM 1214 CG ASP A 77 14.773 10.840 -6.906 1.00 0.01 C ATOM 1215 OD1 ASP A 77 13.925 10.095 -7.370 1.00 0.02 O ATOM 1216 OD2 ASP A 77 15.597 11.439 -7.576 1.00 0.01 O ATOM 0 H ASP A 77 12.825 12.716 -5.238 1.00 0.01 H new ATOM 0 HA ASP A 77 13.075 9.741 -5.176 1.00 0.01 H new ATOM 0 HB2 ASP A 77 15.073 12.063 -5.149 1.00 0.01 H new ATOM 0 HB3 ASP A 77 15.562 10.393 -4.943 1.00 0.01 H new ATOM 1221 N ARG A 78 12.507 11.006 -2.561 1.00 0.01 N ATOM 1222 CA ARG A 78 12.587 10.988 -1.062 1.00 0.01 C ATOM 1223 C ARG A 78 11.972 9.706 -0.483 1.00 0.02 C ATOM 1224 O ARG A 78 10.811 9.416 -0.684 1.00 0.02 O ATOM 1225 CB ARG A 78 11.848 12.206 -0.503 1.00 0.43 C ATOM 1226 CG ARG A 78 11.871 12.161 1.025 1.00 0.80 C ATOM 1227 CD ARG A 78 11.450 13.521 1.583 1.00 1.00 C ATOM 1228 NE ARG A 78 12.538 14.511 1.351 1.00 1.30 N ATOM 1229 CZ ARG A 78 12.294 15.787 1.473 1.00 2.30 C ATOM 1230 NH1 ARG A 78 11.098 16.195 1.800 1.00 2.72 N ATOM 1231 NH2 ARG A 78 13.246 16.655 1.269 1.00 3.20 N ATOM 0 H ARG A 78 11.613 11.315 -2.944 1.00 0.01 H new ATOM 0 HA ARG A 78 13.638 11.018 -0.775 1.00 0.01 H new ATOM 0 HB2 ARG A 78 12.318 13.124 -0.857 1.00 0.43 H new ATOM 0 HB3 ARG A 78 10.819 12.216 -0.861 1.00 0.43 H new ATOM 0 HG2 ARG A 78 11.198 11.384 1.386 1.00 0.80 H new ATOM 0 HG3 ARG A 78 12.871 11.906 1.377 1.00 0.80 H new ATOM 0 HD2 ARG A 78 10.531 13.855 1.101 1.00 1.00 H new ATOM 0 HD3 ARG A 78 11.239 13.439 2.649 1.00 1.00 H new ATOM 0 HE ARG A 78 13.473 14.192 1.097 1.00 1.30 H new ATOM 0 HH11 ARG A 78 10.354 15.516 1.960 1.00 2.72 H new ATOM 0 HH12 ARG A 78 10.908 17.193 1.895 1.00 2.72 H new ATOM 0 HH21 ARG A 78 14.181 16.336 1.014 1.00 3.20 H new ATOM 0 HH22 ARG A 78 13.056 17.653 1.364 1.00 3.20 H new ATOM 1245 N LEU A 79 12.736 8.968 0.279 1.00 0.01 N ATOM 1246 CA LEU A 79 12.211 7.727 0.937 1.00 0.01 C ATOM 1247 C LEU A 79 12.837 7.654 2.331 1.00 0.01 C ATOM 1248 O LEU A 79 14.043 7.628 2.471 1.00 0.02 O ATOM 1249 CB LEU A 79 12.611 6.478 0.141 1.00 1.04 C ATOM 1250 CG LEU A 79 11.806 6.386 -1.169 1.00 1.85 C ATOM 1251 CD1 LEU A 79 12.255 5.141 -1.949 1.00 2.40 C ATOM 1252 CD2 LEU A 79 10.292 6.287 -0.869 1.00 2.61 C ATOM 0 H LEU A 79 13.715 9.173 0.478 1.00 0.01 H new ATOM 0 HA LEU A 79 11.123 7.764 0.987 1.00 0.01 H new ATOM 0 HB2 LEU A 79 13.677 6.510 -0.083 1.00 1.04 H new ATOM 0 HB3 LEU A 79 12.438 5.586 0.743 1.00 1.04 H new ATOM 0 HG LEU A 79 11.987 7.284 -1.760 1.00 1.85 H new ATOM 0 HD11 LEU A 79 11.689 5.070 -2.878 1.00 2.40 H new ATOM 0 HD12 LEU A 79 13.318 5.218 -2.177 1.00 2.40 H new ATOM 0 HD13 LEU A 79 12.077 4.250 -1.346 1.00 2.40 H new ATOM 0 HD21 LEU A 79 9.739 6.223 -1.806 1.00 2.61 H new ATOM 0 HD22 LEU A 79 10.097 5.397 -0.271 1.00 2.61 H new ATOM 0 HD23 LEU A 79 9.972 7.171 -0.318 1.00 2.61 H new ATOM 1264 N GLY A 80 12.032 7.664 3.367 1.00 0.02 N ATOM 1265 CA GLY A 80 12.583 7.648 4.761 1.00 0.02 C ATOM 1266 C GLY A 80 12.380 6.292 5.447 1.00 0.02 C ATOM 1267 O GLY A 80 13.040 5.998 6.425 1.00 0.01 O ATOM 0 H GLY A 80 11.014 7.683 3.307 1.00 0.02 H new ATOM 0 HA2 GLY A 80 13.647 7.883 4.732 1.00 0.02 H new ATOM 0 HA3 GLY A 80 12.100 8.428 5.350 1.00 0.02 H new ATOM 1271 N SER A 81 11.490 5.455 4.972 1.00 0.01 N ATOM 1272 CA SER A 81 11.298 4.135 5.659 1.00 0.01 C ATOM 1273 C SER A 81 10.718 3.105 4.691 1.00 0.02 C ATOM 1274 O SER A 81 10.077 3.434 3.713 1.00 0.01 O ATOM 1275 CB SER A 81 10.349 4.319 6.844 1.00 0.01 C ATOM 1276 OG SER A 81 9.288 5.184 6.468 1.00 0.01 O ATOM 0 H SER A 81 10.899 5.620 4.157 1.00 0.01 H new ATOM 0 HA SER A 81 12.265 3.774 6.010 1.00 0.01 H new ATOM 0 HB2 SER A 81 9.952 3.354 7.159 1.00 0.01 H new ATOM 0 HB3 SER A 81 10.888 4.735 7.695 1.00 0.01 H new ATOM 0 HG SER A 81 9.569 6.116 6.583 1.00 0.01 H new ATOM 1282 N CYS A 82 10.942 1.843 4.971 1.00 0.02 N ATOM 1283 CA CYS A 82 10.409 0.768 4.077 1.00 0.01 C ATOM 1284 C CYS A 82 10.020 -0.461 4.906 1.00 0.01 C ATOM 1285 O CYS A 82 10.623 -0.763 5.918 1.00 0.01 O ATOM 1286 CB CYS A 82 11.475 0.376 3.052 1.00 0.01 C ATOM 1287 SG CYS A 82 12.932 -0.260 3.916 1.00 0.02 S ATOM 0 H CYS A 82 11.470 1.512 5.779 1.00 0.02 H new ATOM 0 HA CYS A 82 9.526 1.143 3.560 1.00 0.01 H new ATOM 0 HB2 CYS A 82 11.082 -0.381 2.373 1.00 0.01 H new ATOM 0 HB3 CYS A 82 11.746 1.239 2.445 1.00 0.01 H new ATOM 0 HG CYS A 82 12.583 -0.700 5.089 1.00 0.02 H new ATOM 1293 N ARG A 83 9.017 -1.180 4.470 1.00 0.01 N ATOM 1294 CA ARG A 83 8.572 -2.405 5.209 1.00 0.01 C ATOM 1295 C ARG A 83 8.282 -3.517 4.203 1.00 0.01 C ATOM 1296 O ARG A 83 7.761 -3.281 3.131 1.00 0.01 O ATOM 1297 CB ARG A 83 7.276 -2.108 5.968 1.00 0.01 C ATOM 1298 CG ARG A 83 7.542 -1.082 7.071 1.00 0.01 C ATOM 1299 CD ARG A 83 6.313 -0.984 7.977 1.00 0.01 C ATOM 1300 NE ARG A 83 6.098 -2.287 8.667 1.00 0.01 N ATOM 1301 CZ ARG A 83 5.304 -2.356 9.700 1.00 0.01 C ATOM 1302 NH1 ARG A 83 4.703 -1.281 10.134 1.00 0.01 N ATOM 1303 NH2 ARG A 83 5.111 -3.499 10.299 1.00 0.01 N ATOM 0 H ARG A 83 8.482 -0.971 3.627 1.00 0.01 H new ATOM 0 HA ARG A 83 9.356 -2.706 5.904 1.00 0.01 H new ATOM 0 HB2 ARG A 83 6.521 -1.728 5.280 1.00 0.01 H new ATOM 0 HB3 ARG A 83 6.880 -3.026 6.401 1.00 0.01 H new ATOM 0 HG2 ARG A 83 8.415 -1.375 7.654 1.00 0.01 H new ATOM 0 HG3 ARG A 83 7.764 -0.109 6.633 1.00 0.01 H new ATOM 0 HD2 ARG A 83 6.452 -0.190 8.711 1.00 0.01 H new ATOM 0 HD3 ARG A 83 5.434 -0.723 7.388 1.00 0.01 H new ATOM 0 HE ARG A 83 6.572 -3.126 8.332 1.00 0.01 H new ATOM 0 HH11 ARG A 83 4.854 -0.388 9.665 1.00 0.01 H new ATOM 0 HH12 ARG A 83 4.082 -1.335 10.942 1.00 0.01 H new ATOM 0 HH21 ARG A 83 5.581 -4.338 9.960 1.00 0.01 H new ATOM 0 HH22 ARG A 83 4.490 -3.553 11.107 1.00 0.01 H new ATOM 1317 N ALA A 84 8.619 -4.734 4.540 1.00 0.01 N ATOM 1318 CA ALA A 84 8.366 -5.862 3.605 1.00 0.01 C ATOM 1319 C ALA A 84 6.892 -6.262 3.679 1.00 0.01 C ATOM 1320 O ALA A 84 6.334 -6.450 4.742 1.00 0.00 O ATOM 1321 CB ALA A 84 9.228 -7.063 4.003 1.00 0.43 C ATOM 0 H ALA A 84 9.059 -4.993 5.423 1.00 0.01 H new ATOM 0 HA ALA A 84 8.616 -5.551 2.591 1.00 0.01 H new ATOM 0 HB1 ALA A 84 9.041 -7.889 3.316 1.00 0.43 H new ATOM 0 HB2 ALA A 84 10.281 -6.786 3.959 1.00 0.43 H new ATOM 0 HB3 ALA A 84 8.976 -7.371 5.018 1.00 0.43 H new ATOM 1327 N VAL A 85 6.268 -6.414 2.544 1.00 0.01 N ATOM 1328 CA VAL A 85 4.839 -6.829 2.513 1.00 0.01 C ATOM 1329 C VAL A 85 4.780 -8.353 2.479 1.00 0.01 C ATOM 1330 O VAL A 85 5.342 -8.980 1.603 1.00 0.01 O ATOM 1331 CB VAL A 85 4.159 -6.260 1.262 1.00 0.98 C ATOM 1332 CG1 VAL A 85 2.650 -6.504 1.339 1.00 1.25 C ATOM 1333 CG2 VAL A 85 4.424 -4.755 1.180 1.00 1.12 C ATOM 0 H VAL A 85 6.692 -6.267 1.628 1.00 0.01 H new ATOM 0 HA VAL A 85 4.323 -6.452 3.396 1.00 0.01 H new ATOM 0 HB VAL A 85 4.561 -6.753 0.377 1.00 0.98 H new ATOM 0 HG11 VAL A 85 2.170 -6.098 0.448 1.00 1.25 H new ATOM 0 HG12 VAL A 85 2.457 -7.575 1.399 1.00 1.25 H new ATOM 0 HG13 VAL A 85 2.247 -6.012 2.224 1.00 1.25 H new ATOM 0 HG21 VAL A 85 3.941 -4.348 0.291 1.00 1.12 H new ATOM 0 HG22 VAL A 85 4.022 -4.266 2.067 1.00 1.12 H new ATOM 0 HG23 VAL A 85 5.498 -4.577 1.123 1.00 1.12 H new ATOM 1343 N HIS A 86 4.103 -8.964 3.412 1.00 0.01 N ATOM 1344 CA HIS A 86 4.013 -10.451 3.408 1.00 0.01 C ATOM 1345 C HIS A 86 2.766 -10.852 2.629 1.00 0.01 C ATOM 1346 O HIS A 86 1.691 -10.327 2.842 1.00 0.00 O ATOM 1347 CB HIS A 86 3.895 -10.961 4.845 1.00 0.21 C ATOM 1348 CG HIS A 86 5.224 -10.826 5.534 1.00 0.71 C ATOM 1349 ND1 HIS A 86 6.397 -11.310 4.975 1.00 1.26 N ATOM 1350 CD2 HIS A 86 5.584 -10.265 6.734 1.00 1.20 C ATOM 1351 CE1 HIS A 86 7.397 -11.031 5.831 1.00 1.77 C ATOM 1352 NE2 HIS A 86 6.956 -10.394 6.919 1.00 1.71 N ATOM 0 H HIS A 86 3.610 -8.500 4.175 1.00 0.01 H new ATOM 0 HA HIS A 86 4.904 -10.879 2.948 1.00 0.01 H new ATOM 0 HB2 HIS A 86 3.135 -10.394 5.383 1.00 0.21 H new ATOM 0 HB3 HIS A 86 3.576 -12.003 4.848 1.00 0.21 H new ATOM 0 HD2 HIS A 86 4.904 -9.795 7.429 1.00 1.20 H new ATOM 0 HE1 HIS A 86 8.431 -11.291 5.659 1.00 1.77 H new ATOM 0 HE2 HIS A 86 7.507 -10.072 7.714 1.00 1.71 H new ATOM 1360 N LEU A 87 2.902 -11.783 1.723 1.00 0.01 N ATOM 1361 CA LEU A 87 1.728 -12.231 0.918 1.00 0.01 C ATOM 1362 C LEU A 87 1.161 -13.496 1.565 1.00 0.01 C ATOM 1363 O LEU A 87 1.896 -14.380 1.960 1.00 0.01 O ATOM 1364 CB LEU A 87 2.191 -12.541 -0.523 1.00 0.67 C ATOM 1365 CG LEU A 87 3.401 -11.672 -0.896 1.00 1.25 C ATOM 1366 CD1 LEU A 87 3.760 -11.925 -2.364 1.00 1.63 C ATOM 1367 CD2 LEU A 87 3.076 -10.179 -0.688 1.00 1.34 C ATOM 0 H LEU A 87 3.780 -12.255 1.505 1.00 0.01 H new ATOM 0 HA LEU A 87 0.964 -11.454 0.886 1.00 0.01 H new ATOM 0 HB2 LEU A 87 2.453 -13.596 -0.609 1.00 0.67 H new ATOM 0 HB3 LEU A 87 1.374 -12.357 -1.221 1.00 0.67 H new ATOM 0 HG LEU A 87 4.244 -11.934 -0.256 1.00 1.25 H new ATOM 0 HD11 LEU A 87 4.619 -11.312 -2.639 1.00 1.63 H new ATOM 0 HD12 LEU A 87 4.006 -12.978 -2.502 1.00 1.63 H new ATOM 0 HD13 LEU A 87 2.911 -11.665 -2.996 1.00 1.63 H new ATOM 0 HD21 LEU A 87 3.944 -9.577 -0.957 1.00 1.34 H new ATOM 0 HD22 LEU A 87 2.231 -9.899 -1.318 1.00 1.34 H new ATOM 0 HD23 LEU A 87 2.823 -10.004 0.358 1.00 1.34 H new ATOM 1379 N SER A 88 -0.139 -13.600 1.652 1.00 0.01 N ATOM 1380 CA SER A 88 -0.777 -14.816 2.242 1.00 0.01 C ATOM 1381 C SER A 88 -1.469 -15.595 1.126 1.00 0.01 C ATOM 1382 O SER A 88 -2.306 -15.047 0.436 1.00 0.01 O ATOM 1383 CB SER A 88 -1.815 -14.399 3.286 1.00 0.81 C ATOM 1384 OG SER A 88 -1.225 -13.470 4.188 1.00 1.08 O ATOM 0 H SER A 88 -0.795 -12.886 1.336 1.00 0.01 H new ATOM 0 HA SER A 88 -0.018 -15.436 2.719 1.00 0.01 H new ATOM 0 HB2 SER A 88 -2.680 -13.950 2.797 1.00 0.81 H new ATOM 0 HB3 SER A 88 -2.174 -15.273 3.829 1.00 0.81 H new ATOM 0 HG SER A 88 -1.887 -13.199 4.858 1.00 1.08 H new ATOM 1390 N SER A 89 -1.198 -16.864 0.962 1.00 0.01 N ATOM 1391 CA SER A 89 -1.923 -17.648 -0.086 1.00 0.01 C ATOM 1392 C SER A 89 -2.961 -18.484 0.651 1.00 0.01 C ATOM 1393 O SER A 89 -3.354 -18.127 1.744 1.00 0.01 O ATOM 1394 CB SER A 89 -0.942 -18.565 -0.821 1.00 0.43 C ATOM 1395 OG SER A 89 -0.017 -17.773 -1.553 1.00 1.26 O ATOM 0 H SER A 89 -0.512 -17.390 1.503 1.00 0.01 H new ATOM 0 HA SER A 89 -2.388 -16.994 -0.824 1.00 0.01 H new ATOM 0 HB2 SER A 89 -0.413 -19.197 -0.108 1.00 0.43 H new ATOM 0 HB3 SER A 89 -1.483 -19.229 -1.495 1.00 0.43 H new ATOM 0 HG SER A 89 0.614 -18.357 -2.023 1.00 1.26 H new ATOM 1401 N GLY A 90 -3.393 -19.602 0.121 1.00 0.01 N ATOM 1402 CA GLY A 90 -4.379 -20.446 0.866 1.00 0.00 C ATOM 1403 C GLY A 90 -5.505 -20.940 -0.040 1.00 0.00 C ATOM 1404 O GLY A 90 -5.809 -22.115 -0.065 1.00 0.01 O ATOM 0 H GLY A 90 -3.108 -19.965 -0.789 1.00 0.01 H new ATOM 0 HA2 GLY A 90 -3.866 -21.301 1.306 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -4.802 -19.870 1.689 1.00 0.00 H new ATOM 1408 N GLY A 91 -6.132 -20.074 -0.794 1.00 0.00 N ATOM 1409 CA GLY A 91 -7.224 -20.557 -1.681 1.00 0.00 C ATOM 1410 C GLY A 91 -7.876 -19.408 -2.460 1.00 0.00 C ATOM 1411 O GLY A 91 -7.351 -18.970 -3.464 1.00 0.01 O ATOM 0 H GLY A 91 -5.938 -19.073 -0.833 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -6.825 -21.291 -2.382 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -7.980 -21.065 -1.083 1.00 0.00 H new ATOM 1415 N GLN A 92 -9.015 -18.923 -2.019 1.00 1.80 N ATOM 1416 CA GLN A 92 -9.705 -17.805 -2.752 1.00 2.31 C ATOM 1417 C GLN A 92 -9.852 -16.578 -1.843 1.00 1.91 C ATOM 1418 O GLN A 92 -10.460 -16.627 -0.793 1.00 2.31 O ATOM 1419 CB GLN A 92 -11.077 -18.296 -3.221 1.00 2.11 C ATOM 1420 CG GLN A 92 -11.821 -17.152 -3.912 1.00 2.86 C ATOM 1421 CD GLN A 92 -13.050 -17.704 -4.639 1.00 3.70 C ATOM 1422 OE1 GLN A 92 -13.692 -18.618 -4.162 1.00 3.99 O ATOM 1423 NE2 GLN A 92 -13.404 -17.185 -5.782 1.00 4.43 N ATOM 0 H GLN A 92 -9.498 -19.252 -1.183 1.00 1.80 H new ATOM 0 HA GLN A 92 -9.109 -17.510 -3.616 1.00 2.31 H new ATOM 0 HB2 GLN A 92 -10.960 -19.134 -3.908 1.00 2.11 H new ATOM 0 HB3 GLN A 92 -11.655 -18.659 -2.371 1.00 2.11 H new ATOM 0 HG2 GLN A 92 -12.125 -16.406 -3.177 1.00 2.86 H new ATOM 0 HG3 GLN A 92 -11.161 -16.651 -4.621 1.00 2.86 H new ATOM 0 HE21 GLN A 92 -12.865 -16.417 -6.182 1.00 4.43 H new ATOM 0 HE22 GLN A 92 -14.220 -17.547 -6.275 1.00 4.43 H new ATOM 1432 N ALA A 93 -9.261 -15.479 -2.249 1.00 0.01 N ATOM 1433 CA ALA A 93 -9.321 -14.239 -1.418 1.00 0.01 C ATOM 1434 C ALA A 93 -10.772 -13.736 -1.360 1.00 0.01 C ATOM 1435 O ALA A 93 -11.469 -13.744 -2.357 1.00 0.01 O ATOM 1436 CB ALA A 93 -8.429 -13.171 -2.056 1.00 2.99 C ATOM 0 H ALA A 93 -8.740 -15.389 -3.121 1.00 0.01 H new ATOM 0 HA ALA A 93 -8.974 -14.450 -0.407 1.00 0.01 H new ATOM 0 HB1 ALA A 93 -8.466 -12.261 -1.457 1.00 2.99 H new ATOM 0 HB2 ALA A 93 -7.402 -13.534 -2.102 1.00 2.99 H new ATOM 0 HB3 ALA A 93 -8.783 -12.956 -3.064 1.00 2.99 H new ATOM 1442 N LYS A 94 -11.258 -13.345 -0.189 1.00 0.00 N ATOM 1443 CA LYS A 94 -12.706 -12.898 -0.079 1.00 0.01 C ATOM 1444 C LYS A 94 -12.878 -11.602 0.738 1.00 0.01 C ATOM 1445 O LYS A 94 -12.370 -11.454 1.866 1.00 0.01 O ATOM 1446 CB LYS A 94 -13.528 -14.008 0.582 1.00 2.49 C ATOM 1447 CG LYS A 94 -15.022 -13.733 0.385 1.00 3.43 C ATOM 1448 CD LYS A 94 -15.837 -14.931 0.884 1.00 4.11 C ATOM 1449 CE LYS A 94 -15.649 -15.104 2.396 1.00 5.23 C ATOM 1450 NZ LYS A 94 -16.790 -15.886 2.950 1.00 6.36 N ATOM 0 H LYS A 94 -10.727 -13.315 0.681 1.00 0.00 H new ATOM 0 HA LYS A 94 -13.053 -12.695 -1.092 1.00 0.01 H new ATOM 0 HB2 LYS A 94 -13.266 -14.974 0.150 1.00 2.49 H new ATOM 0 HB3 LYS A 94 -13.296 -14.061 1.646 1.00 2.49 H new ATOM 0 HG2 LYS A 94 -15.311 -12.833 0.928 1.00 3.43 H new ATOM 0 HG3 LYS A 94 -15.232 -13.551 -0.669 1.00 3.43 H new ATOM 0 HD2 LYS A 94 -16.892 -14.783 0.656 1.00 4.11 H new ATOM 0 HD3 LYS A 94 -15.522 -15.836 0.365 1.00 4.11 H new ATOM 0 HE2 LYS A 94 -14.709 -15.617 2.600 1.00 5.23 H new ATOM 0 HE3 LYS A 94 -15.592 -14.129 2.881 1.00 5.23 H new ATOM 0 HZ1 LYS A 94 -16.664 -16.004 3.976 1.00 6.36 H new ATOM 0 HZ2 LYS A 94 -17.680 -15.380 2.766 1.00 6.36 H new ATOM 0 HZ3 LYS A 94 -16.824 -16.821 2.495 1.00 6.36 H new ATOM 1464 N ILE A 95 -13.629 -10.661 0.168 1.00 0.00 N ATOM 1465 CA ILE A 95 -13.899 -9.354 0.845 1.00 0.01 C ATOM 1466 C ILE A 95 -15.408 -9.024 0.796 1.00 0.01 C ATOM 1467 O ILE A 95 -16.073 -9.220 -0.205 1.00 0.01 O ATOM 1468 CB ILE A 95 -13.095 -8.259 0.116 1.00 0.34 C ATOM 1469 CG1 ILE A 95 -13.677 -6.862 0.408 1.00 0.30 C ATOM 1470 CG2 ILE A 95 -13.151 -8.513 -1.390 1.00 0.36 C ATOM 1471 CD1 ILE A 95 -12.695 -5.781 -0.055 1.00 1.09 C ATOM 0 H ILE A 95 -14.065 -10.758 -0.749 1.00 0.00 H new ATOM 0 HA ILE A 95 -13.599 -9.409 1.891 1.00 0.01 H new ATOM 0 HB ILE A 95 -12.065 -8.292 0.472 1.00 0.34 H new ATOM 0 HG12 ILE A 95 -14.632 -6.742 -0.104 1.00 0.30 H new ATOM 0 HG13 ILE A 95 -13.872 -6.755 1.475 1.00 0.30 H new ATOM 0 HG21 ILE A 95 -12.584 -7.741 -1.910 1.00 0.36 H new ATOM 0 HG22 ILE A 95 -12.721 -9.490 -1.610 1.00 0.36 H new ATOM 0 HG23 ILE A 95 -14.188 -8.489 -1.725 1.00 0.36 H new ATOM 0 HD11 ILE A 95 -13.113 -4.796 0.154 1.00 1.09 H new ATOM 0 HD12 ILE A 95 -11.751 -5.895 0.477 1.00 1.09 H new ATOM 0 HD13 ILE A 95 -12.522 -5.881 -1.126 1.00 1.09 H new ATOM 1483 N GLN A 96 -15.923 -8.452 1.866 1.00 0.01 N ATOM 1484 CA GLN A 96 -17.364 -8.011 1.912 1.00 0.01 C ATOM 1485 C GLN A 96 -17.373 -6.520 2.271 1.00 0.01 C ATOM 1486 O GLN A 96 -16.619 -6.103 3.121 1.00 0.00 O ATOM 1487 CB GLN A 96 -18.163 -8.824 2.946 1.00 0.53 C ATOM 1488 CG GLN A 96 -17.298 -9.142 4.161 1.00 0.82 C ATOM 1489 CD GLN A 96 -18.177 -9.703 5.281 1.00 1.25 C ATOM 1490 OE1 GLN A 96 -19.224 -9.161 5.576 1.00 1.75 O ATOM 1491 NE2 GLN A 96 -17.794 -10.773 5.922 1.00 2.05 N ATOM 0 H GLN A 96 -15.399 -8.269 2.722 1.00 0.01 H new ATOM 0 HA GLN A 96 -17.840 -8.178 0.946 1.00 0.01 H new ATOM 0 HB2 GLN A 96 -19.044 -8.262 3.257 1.00 0.53 H new ATOM 0 HB3 GLN A 96 -18.518 -9.750 2.493 1.00 0.53 H new ATOM 0 HG2 GLN A 96 -16.527 -9.865 3.893 1.00 0.82 H new ATOM 0 HG3 GLN A 96 -16.786 -8.242 4.502 1.00 0.82 H new ATOM 0 HE21 GLN A 96 -16.915 -11.228 5.675 1.00 2.05 H new ATOM 0 HE22 GLN A 96 -18.373 -11.154 6.670 1.00 2.05 H new ATOM 1500 N VAL A 97 -18.202 -5.704 1.651 1.00 0.01 N ATOM 1501 CA VAL A 97 -18.212 -4.231 1.981 1.00 0.01 C ATOM 1502 C VAL A 97 -19.617 -3.763 2.389 1.00 0.01 C ATOM 1503 O VAL A 97 -20.618 -4.278 1.925 1.00 0.01 O ATOM 1504 CB VAL A 97 -17.755 -3.447 0.748 1.00 0.77 C ATOM 1505 CG1 VAL A 97 -16.399 -3.979 0.274 1.00 1.10 C ATOM 1506 CG2 VAL A 97 -18.786 -3.616 -0.371 1.00 1.03 C ATOM 0 H VAL A 97 -18.869 -5.990 0.935 1.00 0.01 H new ATOM 0 HA VAL A 97 -17.538 -4.055 2.819 1.00 0.01 H new ATOM 0 HB VAL A 97 -17.661 -2.392 1.004 1.00 0.77 H new ATOM 0 HG11 VAL A 97 -16.075 -3.420 -0.604 1.00 1.10 H new ATOM 0 HG12 VAL A 97 -15.664 -3.862 1.070 1.00 1.10 H new ATOM 0 HG13 VAL A 97 -16.492 -5.034 0.018 1.00 1.10 H new ATOM 0 HG21 VAL A 97 -18.463 -3.059 -1.250 1.00 1.03 H new ATOM 0 HG22 VAL A 97 -18.878 -4.672 -0.624 1.00 1.03 H new ATOM 0 HG23 VAL A 97 -19.752 -3.238 -0.036 1.00 1.03 H new ATOM 1516 N PHE A 98 -19.683 -2.798 3.286 1.00 0.01 N ATOM 1517 CA PHE A 98 -21.008 -2.287 3.781 1.00 0.01 C ATOM 1518 C PHE A 98 -21.184 -0.787 3.482 1.00 0.01 C ATOM 1519 O PHE A 98 -20.257 0.013 3.565 1.00 0.01 O ATOM 1520 CB PHE A 98 -21.087 -2.499 5.291 1.00 0.25 C ATOM 1521 CG PHE A 98 -21.182 -3.975 5.604 1.00 0.36 C ATOM 1522 CD1 PHE A 98 -20.074 -4.805 5.398 1.00 0.42 C ATOM 1523 CD2 PHE A 98 -22.374 -4.512 6.110 1.00 0.58 C ATOM 1524 CE1 PHE A 98 -20.157 -6.170 5.696 1.00 0.56 C ATOM 1525 CE2 PHE A 98 -22.456 -5.876 6.409 1.00 0.73 C ATOM 1526 CZ PHE A 98 -21.348 -6.706 6.201 1.00 0.69 C ATOM 0 H PHE A 98 -18.870 -2.341 3.698 1.00 0.01 H new ATOM 0 HA PHE A 98 -21.798 -2.835 3.267 1.00 0.01 H new ATOM 0 HB2 PHE A 98 -20.207 -2.073 5.772 1.00 0.25 H new ATOM 0 HB3 PHE A 98 -21.955 -1.977 5.694 1.00 0.25 H new ATOM 0 HD1 PHE A 98 -19.155 -4.392 5.009 1.00 0.42 H new ATOM 0 HD2 PHE A 98 -23.229 -3.872 6.269 1.00 0.58 H new ATOM 0 HE1 PHE A 98 -19.302 -6.810 5.536 1.00 0.56 H new ATOM 0 HE2 PHE A 98 -23.374 -6.289 6.800 1.00 0.73 H new ATOM 0 HZ PHE A 98 -21.412 -7.760 6.430 1.00 0.69 H new ATOM 1536 N GLU A 99 -22.388 -0.416 3.122 1.00 0.01 N ATOM 1537 CA GLU A 99 -22.679 1.008 2.792 1.00 0.01 C ATOM 1538 C GLU A 99 -22.622 1.889 4.046 1.00 0.01 C ATOM 1539 O GLU A 99 -22.240 3.041 3.974 1.00 0.01 O ATOM 1540 CB GLU A 99 -24.074 1.110 2.169 1.00 0.01 C ATOM 1541 CG GLU A 99 -24.274 2.509 1.583 1.00 0.01 C ATOM 1542 CD GLU A 99 -25.570 2.545 0.771 1.00 0.01 C ATOM 1543 OE1 GLU A 99 -26.134 1.486 0.546 1.00 0.01 O ATOM 1544 OE2 GLU A 99 -25.977 3.630 0.389 1.00 0.02 O ATOM 0 H GLU A 99 -23.186 -1.046 3.043 1.00 0.01 H new ATOM 0 HA GLU A 99 -21.924 1.358 2.088 1.00 0.01 H new ATOM 0 HB2 GLU A 99 -24.191 0.358 1.389 1.00 0.01 H new ATOM 0 HB3 GLU A 99 -24.835 0.908 2.922 1.00 0.01 H new ATOM 0 HG2 GLU A 99 -24.314 3.247 2.384 1.00 0.01 H new ATOM 0 HG3 GLU A 99 -23.428 2.773 0.948 1.00 0.01 H new ATOM 1551 N LYS A 100 -23.000 1.366 5.195 1.00 0.01 N ATOM 1552 CA LYS A 100 -22.971 2.185 6.456 1.00 0.01 C ATOM 1553 C LYS A 100 -21.921 1.611 7.417 1.00 0.01 C ATOM 1554 O LYS A 100 -21.400 0.534 7.218 1.00 0.01 O ATOM 1555 CB LYS A 100 -24.364 2.173 7.126 1.00 0.94 C ATOM 1556 CG LYS A 100 -25.208 3.356 6.629 1.00 1.63 C ATOM 1557 CD LYS A 100 -25.304 3.320 5.099 1.00 2.19 C ATOM 1558 CE LYS A 100 -26.476 4.189 4.635 1.00 2.84 C ATOM 1559 NZ LYS A 100 -26.545 4.174 3.147 1.00 3.18 N ATOM 0 H LYS A 100 -23.327 0.407 5.313 1.00 0.01 H new ATOM 0 HA LYS A 100 -22.709 3.214 6.210 1.00 0.01 H new ATOM 0 HB2 LYS A 100 -24.874 1.236 6.903 1.00 0.94 H new ATOM 0 HB3 LYS A 100 -24.254 2.226 8.209 1.00 0.94 H new ATOM 0 HG2 LYS A 100 -26.206 3.312 7.066 1.00 1.63 H new ATOM 0 HG3 LYS A 100 -24.760 4.295 6.952 1.00 1.63 H new ATOM 0 HD2 LYS A 100 -24.375 3.680 4.658 1.00 2.19 H new ATOM 0 HD3 LYS A 100 -25.442 2.294 4.758 1.00 2.19 H new ATOM 0 HE2 LYS A 100 -27.409 3.816 5.057 1.00 2.84 H new ATOM 0 HE3 LYS A 100 -26.350 5.210 4.994 1.00 2.84 H new ATOM 0 HZ1 LYS A 100 -27.361 4.736 2.832 1.00 3.18 H new ATOM 0 HZ2 LYS A 100 -25.672 4.581 2.755 1.00 3.18 H new ATOM 0 HZ3 LYS A 100 -26.650 3.194 2.814 1.00 3.18 H new ATOM 1573 N GLY A 101 -21.600 2.345 8.443 1.00 0.01 N ATOM 1574 CA GLY A 101 -20.570 1.888 9.421 1.00 0.01 C ATOM 1575 C GLY A 101 -21.083 0.714 10.263 1.00 0.00 C ATOM 1576 O GLY A 101 -22.254 0.381 10.261 1.00 0.01 O ATOM 0 H GLY A 101 -22.012 3.255 8.650 1.00 0.01 H new ATOM 0 HA2 GLY A 101 -19.667 1.589 8.888 1.00 0.01 H new ATOM 0 HA3 GLY A 101 -20.295 2.715 10.076 1.00 0.01 H new ATOM 1580 N ASP A 102 -20.184 0.109 11.000 1.00 0.01 N ATOM 1581 CA ASP A 102 -20.538 -1.028 11.900 1.00 0.00 C ATOM 1582 C ASP A 102 -21.282 -2.130 11.148 1.00 0.00 C ATOM 1583 O ASP A 102 -22.206 -2.736 11.655 1.00 0.01 O ATOM 1584 CB ASP A 102 -21.404 -0.508 13.049 1.00 0.01 C ATOM 1585 CG ASP A 102 -20.617 0.526 13.855 1.00 0.01 C ATOM 1586 OD1 ASP A 102 -20.672 1.693 13.501 1.00 0.01 O ATOM 1587 OD2 ASP A 102 -19.973 0.135 14.815 1.00 0.01 O ATOM 0 H ASP A 102 -19.196 0.364 11.014 1.00 0.01 H new ATOM 0 HA ASP A 102 -19.615 -1.458 12.289 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -22.317 -0.060 12.656 1.00 0.01 H new ATOM 0 HB3 ASP A 102 -21.706 -1.334 13.693 1.00 0.01 H new ATOM 1592 N PHE A 103 -20.861 -2.410 9.948 1.00 0.01 N ATOM 1593 CA PHE A 103 -21.499 -3.488 9.150 1.00 0.01 C ATOM 1594 C PHE A 103 -23.009 -3.288 9.080 1.00 0.00 C ATOM 1595 O PHE A 103 -23.774 -4.211 9.276 1.00 0.01 O ATOM 1596 CB PHE A 103 -21.206 -4.844 9.796 1.00 0.01 C ATOM 1597 CG PHE A 103 -19.728 -4.956 10.111 1.00 0.00 C ATOM 1598 CD1 PHE A 103 -18.783 -4.862 9.080 1.00 0.01 C ATOM 1599 CD2 PHE A 103 -19.302 -5.159 11.431 1.00 0.01 C ATOM 1600 CE1 PHE A 103 -17.418 -4.969 9.369 1.00 0.01 C ATOM 1601 CE2 PHE A 103 -17.937 -5.266 11.719 1.00 0.01 C ATOM 1602 CZ PHE A 103 -16.994 -5.171 10.688 1.00 0.01 C ATOM 0 H PHE A 103 -20.091 -1.930 9.481 1.00 0.01 H new ATOM 0 HA PHE A 103 -21.091 -3.456 8.140 1.00 0.01 H new ATOM 0 HB2 PHE A 103 -21.791 -4.956 10.709 1.00 0.01 H new ATOM 0 HB3 PHE A 103 -21.506 -5.649 9.125 1.00 0.01 H new ATOM 0 HD1 PHE A 103 -19.109 -4.707 8.062 1.00 0.01 H new ATOM 0 HD2 PHE A 103 -20.028 -5.233 12.227 1.00 0.01 H new ATOM 0 HE1 PHE A 103 -16.691 -4.896 8.574 1.00 0.01 H new ATOM 0 HE2 PHE A 103 -17.611 -5.422 12.737 1.00 0.01 H new ATOM 0 HZ PHE A 103 -15.940 -5.254 10.910 1.00 0.01 H new ATOM 1612 N ASN A 104 -23.444 -2.092 8.775 1.00 0.00 N ATOM 1613 CA ASN A 104 -24.909 -1.811 8.655 1.00 0.01 C ATOM 1614 C ASN A 104 -25.179 -1.290 7.244 1.00 0.01 C ATOM 1615 O ASN A 104 -24.270 -0.936 6.520 1.00 0.01 O ATOM 1616 CB ASN A 104 -25.320 -0.746 9.675 1.00 1.68 C ATOM 1617 CG ASN A 104 -26.843 -0.611 9.687 1.00 2.31 C ATOM 1618 OD1 ASN A 104 -27.411 0.062 8.852 1.00 3.15 O ATOM 1619 ND2 ASN A 104 -27.533 -1.230 10.606 1.00 2.38 N ATOM 0 H ASN A 104 -22.840 -1.288 8.602 1.00 0.00 H new ATOM 0 HA ASN A 104 -25.480 -2.720 8.844 1.00 0.01 H new ATOM 0 HB2 ASN A 104 -24.961 -1.020 10.667 1.00 1.68 H new ATOM 0 HB3 ASN A 104 -24.862 0.210 9.423 1.00 1.68 H new ATOM 0 HD21 ASN A 104 -28.550 -1.148 10.622 1.00 2.38 H new ATOM 0 HD22 ASN A 104 -27.056 -1.796 11.308 1.00 2.38 H new ATOM 1626 N GLY A 105 -26.419 -1.262 6.834 1.00 0.01 N ATOM 1627 CA GLY A 105 -26.742 -0.777 5.458 1.00 0.01 C ATOM 1628 C GLY A 105 -26.720 -1.960 4.491 1.00 0.01 C ATOM 1629 O GLY A 105 -26.762 -3.103 4.902 1.00 0.01 O ATOM 0 H GLY A 105 -27.222 -1.553 7.391 1.00 0.01 H new ATOM 0 HA2 GLY A 105 -27.723 -0.302 5.448 1.00 0.01 H new ATOM 0 HA3 GLY A 105 -26.019 -0.023 5.146 1.00 0.01 H new ATOM 1633 N GLN A 106 -26.640 -1.710 3.213 1.00 0.01 N ATOM 1634 CA GLN A 106 -26.600 -2.836 2.240 1.00 0.01 C ATOM 1635 C GLN A 106 -25.204 -3.461 2.260 1.00 0.01 C ATOM 1636 O GLN A 106 -24.201 -2.782 2.379 1.00 0.01 O ATOM 1637 CB GLN A 106 -26.906 -2.309 0.837 1.00 0.01 C ATOM 1638 CG GLN A 106 -27.194 -3.486 -0.098 1.00 0.01 C ATOM 1639 CD GLN A 106 -27.633 -2.958 -1.463 1.00 0.01 C ATOM 1640 OE1 GLN A 106 -28.319 -3.639 -2.199 1.00 0.01 O ATOM 1641 NE2 GLN A 106 -27.263 -1.764 -1.835 1.00 0.01 N ATOM 0 H GLN A 106 -26.601 -0.777 2.802 1.00 0.01 H new ATOM 0 HA GLN A 106 -27.343 -3.586 2.511 1.00 0.01 H new ATOM 0 HB2 GLN A 106 -27.764 -1.637 0.868 1.00 0.01 H new ATOM 0 HB3 GLN A 106 -26.062 -1.731 0.462 1.00 0.01 H new ATOM 0 HG2 GLN A 106 -26.303 -4.105 -0.205 1.00 0.01 H new ATOM 0 HG3 GLN A 106 -27.973 -4.119 0.327 1.00 0.01 H new ATOM 0 HE21 GLN A 106 -26.687 -1.193 -1.217 1.00 0.01 H new ATOM 0 HE22 GLN A 106 -27.550 -1.401 -2.744 1.00 0.01 H new ATOM 1650 N MET A 107 -25.146 -4.766 2.146 1.00 0.01 N ATOM 1651 CA MET A 107 -23.834 -5.488 2.160 1.00 0.01 C ATOM 1652 C MET A 107 -23.610 -6.172 0.809 1.00 0.01 C ATOM 1653 O MET A 107 -24.525 -6.689 0.200 1.00 0.01 O ATOM 1654 CB MET A 107 -23.857 -6.555 3.263 1.00 0.00 C ATOM 1655 CG MET A 107 -22.612 -7.451 3.166 1.00 0.01 C ATOM 1656 SD MET A 107 -22.913 -8.782 1.976 1.00 0.01 S ATOM 1657 CE MET A 107 -23.666 -9.956 3.129 1.00 0.01 C ATOM 0 H MET A 107 -25.962 -5.369 2.043 1.00 0.01 H new ATOM 0 HA MET A 107 -23.030 -4.776 2.347 1.00 0.01 H new ATOM 0 HB2 MET A 107 -23.893 -6.076 4.241 1.00 0.00 H new ATOM 0 HB3 MET A 107 -24.758 -7.162 3.172 1.00 0.00 H new ATOM 0 HG2 MET A 107 -21.750 -6.861 2.856 1.00 0.01 H new ATOM 0 HG3 MET A 107 -22.376 -7.870 4.144 1.00 0.01 H new ATOM 0 HE1 MET A 107 -23.935 -10.868 2.596 1.00 0.01 H new ATOM 0 HE2 MET A 107 -22.956 -10.194 3.921 1.00 0.01 H new ATOM 0 HE3 MET A 107 -24.561 -9.514 3.566 1.00 0.01 H new ATOM 1667 N TYR A 108 -22.383 -6.192 0.353 1.00 0.01 N ATOM 1668 CA TYR A 108 -22.045 -6.856 -0.945 1.00 0.00 C ATOM 1669 C TYR A 108 -20.817 -7.750 -0.727 1.00 0.01 C ATOM 1670 O TYR A 108 -19.870 -7.374 -0.062 1.00 0.01 O ATOM 1671 CB TYR A 108 -21.722 -5.795 -2.001 1.00 0.54 C ATOM 1672 CG TYR A 108 -23.001 -5.149 -2.480 1.00 0.60 C ATOM 1673 CD1 TYR A 108 -23.805 -5.804 -3.418 1.00 1.24 C ATOM 1674 CD2 TYR A 108 -23.379 -3.895 -1.986 1.00 0.93 C ATOM 1675 CE1 TYR A 108 -24.989 -5.204 -3.866 1.00 1.76 C ATOM 1676 CE2 TYR A 108 -24.563 -3.296 -2.432 1.00 1.51 C ATOM 1677 CZ TYR A 108 -25.368 -3.950 -3.373 1.00 1.82 C ATOM 1678 OH TYR A 108 -26.535 -3.360 -3.814 1.00 2.48 O ATOM 0 H TYR A 108 -21.588 -5.770 0.832 1.00 0.01 H new ATOM 0 HA TYR A 108 -22.890 -7.452 -1.289 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -21.057 -5.040 -1.581 1.00 0.54 H new ATOM 0 HB3 TYR A 108 -21.197 -6.251 -2.840 1.00 0.54 H new ATOM 0 HD1 TYR A 108 -23.513 -6.772 -3.797 1.00 1.24 H new ATOM 0 HD2 TYR A 108 -22.758 -3.390 -1.261 1.00 0.93 H new ATOM 0 HE1 TYR A 108 -25.609 -5.709 -4.592 1.00 1.76 H new ATOM 0 HE2 TYR A 108 -24.856 -2.329 -2.050 1.00 1.51 H new ATOM 0 HH TYR A 108 -27.304 -3.866 -3.479 1.00 2.48 H new ATOM 1688 N GLU A 109 -20.849 -8.945 -1.267 1.00 0.01 N ATOM 1689 CA GLU A 109 -19.718 -9.914 -1.088 1.00 0.01 C ATOM 1690 C GLU A 109 -19.080 -10.223 -2.441 1.00 0.01 C ATOM 1691 O GLU A 109 -19.761 -10.468 -3.417 1.00 0.01 O ATOM 1692 CB GLU A 109 -20.288 -11.196 -0.475 1.00 0.01 C ATOM 1693 CG GLU A 109 -19.142 -12.128 -0.079 1.00 0.01 C ATOM 1694 CD GLU A 109 -19.707 -13.372 0.613 1.00 0.00 C ATOM 1695 OE1 GLU A 109 -20.183 -14.250 -0.086 1.00 0.00 O ATOM 1696 OE2 GLU A 109 -19.655 -13.424 1.830 1.00 0.00 O ATOM 0 H GLU A 109 -21.622 -9.296 -1.833 1.00 0.01 H new ATOM 0 HA GLU A 109 -18.954 -9.490 -0.436 1.00 0.01 H new ATOM 0 HB2 GLU A 109 -20.893 -10.955 0.399 1.00 0.01 H new ATOM 0 HB3 GLU A 109 -20.944 -11.693 -1.190 1.00 0.01 H new ATOM 0 HG2 GLU A 109 -18.574 -12.418 -0.963 1.00 0.01 H new ATOM 0 HG3 GLU A 109 -18.453 -11.610 0.588 1.00 0.01 H new ATOM 1703 N THR A 110 -17.768 -10.208 -2.517 1.00 0.01 N ATOM 1704 CA THR A 110 -17.106 -10.496 -3.825 1.00 0.00 C ATOM 1705 C THR A 110 -15.742 -11.168 -3.627 1.00 0.01 C ATOM 1706 O THR A 110 -15.029 -10.936 -2.658 1.00 0.01 O ATOM 1707 CB THR A 110 -16.909 -9.193 -4.601 1.00 1.21 C ATOM 1708 OG1 THR A 110 -16.378 -9.484 -5.888 1.00 1.65 O ATOM 1709 CG2 THR A 110 -15.944 -8.283 -3.840 1.00 1.69 C ATOM 0 H THR A 110 -17.137 -10.011 -1.740 1.00 0.01 H new ATOM 0 HA THR A 110 -17.751 -11.176 -4.382 1.00 0.00 H new ATOM 0 HB THR A 110 -17.868 -8.687 -4.711 1.00 1.21 H new ATOM 0 HG1 THR A 110 -16.253 -8.650 -6.387 1.00 1.65 H new ATOM 0 HG21 THR A 110 -15.805 -7.355 -4.395 1.00 1.69 H new ATOM 0 HG22 THR A 110 -16.355 -8.059 -2.856 1.00 1.69 H new ATOM 0 HG23 THR A 110 -14.983 -8.785 -3.727 1.00 1.69 H new ATOM 1717 N THR A 111 -15.392 -12.003 -4.574 1.00 0.00 N ATOM 1718 CA THR A 111 -14.090 -12.738 -4.540 1.00 0.01 C ATOM 1719 C THR A 111 -13.198 -12.285 -5.704 1.00 0.01 C ATOM 1720 O THR A 111 -12.171 -12.879 -5.968 1.00 0.01 O ATOM 1721 CB THR A 111 -14.354 -14.240 -4.663 1.00 0.01 C ATOM 1722 OG1 THR A 111 -15.263 -14.476 -5.731 1.00 0.01 O ATOM 1723 CG2 THR A 111 -14.952 -14.767 -3.358 1.00 0.01 C ATOM 0 H THR A 111 -15.969 -12.210 -5.389 1.00 0.00 H new ATOM 0 HA THR A 111 -13.585 -12.525 -3.598 1.00 0.01 H new ATOM 0 HB THR A 111 -13.415 -14.756 -4.863 1.00 0.01 H new ATOM 0 HG1 THR A 111 -15.431 -15.438 -5.811 1.00 0.01 H new ATOM 0 HG21 THR A 111 -15.139 -15.837 -3.449 1.00 0.01 H new ATOM 0 HG22 THR A 111 -14.254 -14.589 -2.540 1.00 0.01 H new ATOM 0 HG23 THR A 111 -15.890 -14.251 -3.153 1.00 0.01 H new ATOM 1731 N GLU A 112 -13.606 -11.264 -6.428 1.00 0.01 N ATOM 1732 CA GLU A 112 -12.808 -10.795 -7.614 1.00 0.01 C ATOM 1733 C GLU A 112 -12.402 -9.324 -7.465 1.00 0.01 C ATOM 1734 O GLU A 112 -12.961 -8.590 -6.676 1.00 0.01 O ATOM 1735 CB GLU A 112 -13.659 -10.949 -8.877 1.00 0.85 C ATOM 1736 CG GLU A 112 -14.006 -12.425 -9.079 1.00 1.61 C ATOM 1737 CD GLU A 112 -15.063 -12.553 -10.177 1.00 2.51 C ATOM 1738 OE1 GLU A 112 -16.087 -11.901 -10.065 1.00 3.21 O ATOM 1739 OE2 GLU A 112 -14.830 -13.302 -11.113 1.00 3.07 O ATOM 0 H GLU A 112 -14.459 -10.734 -6.249 1.00 0.01 H new ATOM 0 HA GLU A 112 -11.902 -11.398 -7.681 1.00 0.01 H new ATOM 0 HB2 GLU A 112 -14.571 -10.358 -8.789 1.00 0.85 H new ATOM 0 HB3 GLU A 112 -13.116 -10.570 -9.743 1.00 0.85 H new ATOM 0 HG2 GLU A 112 -13.112 -12.986 -9.352 1.00 1.61 H new ATOM 0 HG3 GLU A 112 -14.379 -12.853 -8.148 1.00 1.61 H new ATOM 1746 N ASP A 113 -11.441 -8.889 -8.242 1.00 0.01 N ATOM 1747 CA ASP A 113 -10.999 -7.465 -8.183 1.00 0.01 C ATOM 1748 C ASP A 113 -12.110 -6.564 -8.736 1.00 0.00 C ATOM 1749 O ASP A 113 -12.908 -6.981 -9.552 1.00 0.01 O ATOM 1750 CB ASP A 113 -9.738 -7.303 -9.039 1.00 0.01 C ATOM 1751 CG ASP A 113 -9.846 -8.193 -10.279 1.00 0.01 C ATOM 1752 OD1 ASP A 113 -9.473 -9.351 -10.186 1.00 0.00 O ATOM 1753 OD2 ASP A 113 -10.299 -7.702 -11.299 1.00 0.00 O ATOM 0 H ASP A 113 -10.941 -9.465 -8.919 1.00 0.01 H new ATOM 0 HA ASP A 113 -10.786 -7.184 -7.152 1.00 0.01 H new ATOM 0 HB2 ASP A 113 -9.618 -6.261 -9.335 1.00 0.01 H new ATOM 0 HB3 ASP A 113 -8.855 -7.573 -8.460 1.00 0.01 H new ATOM 1758 N CYS A 114 -12.143 -5.320 -8.312 1.00 0.01 N ATOM 1759 CA CYS A 114 -13.174 -4.358 -8.822 1.00 0.01 C ATOM 1760 C CYS A 114 -12.465 -3.099 -9.376 1.00 0.01 C ATOM 1761 O CYS A 114 -11.866 -2.365 -8.611 1.00 0.01 O ATOM 1762 CB CYS A 114 -14.075 -3.938 -7.661 1.00 0.01 C ATOM 1763 SG CYS A 114 -15.204 -2.638 -8.219 1.00 0.01 S ATOM 0 H CYS A 114 -11.494 -4.928 -7.629 1.00 0.01 H new ATOM 0 HA CYS A 114 -13.763 -4.831 -9.608 1.00 0.01 H new ATOM 0 HB2 CYS A 114 -14.641 -4.795 -7.297 1.00 0.01 H new ATOM 0 HB3 CYS A 114 -13.471 -3.578 -6.829 1.00 0.01 H new ATOM 0 HG CYS A 114 -16.382 -2.838 -7.708 1.00 0.01 H new ATOM 1769 N PRO A 115 -12.529 -2.811 -10.671 1.00 0.01 N ATOM 1770 CA PRO A 115 -11.868 -1.584 -11.201 1.00 0.01 C ATOM 1771 C PRO A 115 -12.668 -0.321 -10.856 1.00 0.01 C ATOM 1772 O PRO A 115 -12.104 0.736 -10.640 1.00 0.01 O ATOM 1773 CB PRO A 115 -11.852 -1.847 -12.715 1.00 0.01 C ATOM 1774 CG PRO A 115 -12.891 -2.945 -13.011 1.00 0.01 C ATOM 1775 CD PRO A 115 -13.230 -3.656 -11.686 1.00 0.01 C ATOM 0 HA PRO A 115 -10.878 -1.407 -10.781 1.00 0.01 H new ATOM 0 HB2 PRO A 115 -12.091 -0.936 -13.264 1.00 0.01 H new ATOM 0 HB3 PRO A 115 -10.860 -2.162 -13.038 1.00 0.01 H new ATOM 0 HG2 PRO A 115 -13.789 -2.510 -13.450 1.00 0.01 H new ATOM 0 HG3 PRO A 115 -12.495 -3.658 -13.735 1.00 0.01 H new ATOM 0 HD2 PRO A 115 -14.305 -3.693 -11.510 1.00 0.01 H new ATOM 0 HD3 PRO A 115 -12.870 -4.685 -11.675 1.00 0.01 H new ATOM 1783 N SER A 116 -13.973 -0.418 -10.816 1.00 0.01 N ATOM 1784 CA SER A 116 -14.816 0.774 -10.490 1.00 0.02 C ATOM 1785 C SER A 116 -15.987 0.326 -9.611 1.00 0.01 C ATOM 1786 O SER A 116 -16.902 -0.347 -10.051 1.00 0.00 O ATOM 1787 CB SER A 116 -15.344 1.391 -11.786 1.00 0.01 C ATOM 1788 OG SER A 116 -14.245 1.795 -12.594 1.00 0.01 O ATOM 0 H SER A 116 -14.494 -1.276 -10.996 1.00 0.01 H new ATOM 0 HA SER A 116 -14.223 1.518 -9.957 1.00 0.02 H new ATOM 0 HB2 SER A 116 -15.959 0.668 -12.323 1.00 0.01 H new ATOM 0 HB3 SER A 116 -15.980 2.247 -11.562 1.00 0.01 H new ATOM 0 HG SER A 116 -14.579 2.190 -13.427 1.00 0.01 H new ATOM 1794 N ILE A 117 -15.933 0.674 -8.354 1.00 0.01 N ATOM 1795 CA ILE A 117 -16.998 0.258 -7.398 1.00 0.01 C ATOM 1796 C ILE A 117 -18.339 0.891 -7.757 1.00 0.01 C ATOM 1797 O ILE A 117 -19.370 0.260 -7.629 1.00 0.00 O ATOM 1798 CB ILE A 117 -16.583 0.687 -5.994 1.00 0.57 C ATOM 1799 CG1 ILE A 117 -15.284 -0.029 -5.628 1.00 1.44 C ATOM 1800 CG2 ILE A 117 -17.675 0.314 -4.989 1.00 0.93 C ATOM 1801 CD1 ILE A 117 -14.673 0.619 -4.390 1.00 1.83 C ATOM 0 H ILE A 117 -15.187 1.236 -7.944 1.00 0.01 H new ATOM 0 HA ILE A 117 -17.118 -0.824 -7.446 1.00 0.01 H new ATOM 0 HB ILE A 117 -16.436 1.767 -5.968 1.00 0.57 H new ATOM 0 HG12 ILE A 117 -15.480 -1.085 -5.439 1.00 1.44 H new ATOM 0 HG13 ILE A 117 -14.582 0.021 -6.461 1.00 1.44 H new ATOM 0 HG21 ILE A 117 -17.371 0.624 -3.989 1.00 0.93 H new ATOM 0 HG22 ILE A 117 -18.604 0.817 -5.258 1.00 0.93 H new ATOM 0 HG23 ILE A 117 -17.829 -0.765 -5.003 1.00 0.93 H new ATOM 0 HD11 ILE A 117 -13.747 0.107 -4.131 1.00 1.83 H new ATOM 0 HD12 ILE A 117 -14.462 1.669 -4.595 1.00 1.83 H new ATOM 0 HD13 ILE A 117 -15.373 0.546 -3.558 1.00 1.83 H new ATOM 1813 N MET A 118 -18.348 2.128 -8.178 1.00 0.02 N ATOM 1814 CA MET A 118 -19.652 2.768 -8.506 1.00 0.01 C ATOM 1815 C MET A 118 -20.263 2.087 -9.728 1.00 0.01 C ATOM 1816 O MET A 118 -21.458 1.901 -9.809 1.00 0.02 O ATOM 1817 CB MET A 118 -19.461 4.261 -8.784 1.00 0.24 C ATOM 1818 CG MET A 118 -20.821 4.959 -8.785 1.00 0.63 C ATOM 1819 SD MET A 118 -20.599 6.717 -9.152 1.00 1.20 S ATOM 1820 CE MET A 118 -22.287 7.243 -8.766 1.00 1.34 C ATOM 0 H MET A 118 -17.523 2.714 -8.307 1.00 0.02 H new ATOM 0 HA MET A 118 -20.323 2.657 -7.654 1.00 0.01 H new ATOM 0 HB2 MET A 118 -18.814 4.703 -8.026 1.00 0.24 H new ATOM 0 HB3 MET A 118 -18.967 4.402 -9.746 1.00 0.24 H new ATOM 0 HG2 MET A 118 -21.475 4.502 -9.527 1.00 0.63 H new ATOM 0 HG3 MET A 118 -21.304 4.837 -7.816 1.00 0.63 H new ATOM 0 HE1 MET A 118 -22.379 8.317 -8.926 1.00 1.34 H new ATOM 0 HE2 MET A 118 -22.989 6.718 -9.414 1.00 1.34 H new ATOM 0 HE3 MET A 118 -22.511 7.011 -7.725 1.00 1.34 H new ATOM 1830 N GLU A 119 -19.469 1.705 -10.681 1.00 0.01 N ATOM 1831 CA GLU A 119 -20.043 1.041 -11.880 1.00 0.02 C ATOM 1832 C GLU A 119 -20.558 -0.350 -11.504 1.00 0.02 C ATOM 1833 O GLU A 119 -21.559 -0.809 -12.019 1.00 0.01 O ATOM 1834 CB GLU A 119 -18.960 0.907 -12.954 1.00 0.30 C ATOM 1835 CG GLU A 119 -19.609 0.550 -14.292 1.00 0.99 C ATOM 1836 CD GLU A 119 -18.520 0.275 -15.331 1.00 1.69 C ATOM 1837 OE1 GLU A 119 -17.837 1.214 -15.705 1.00 2.11 O ATOM 1838 OE2 GLU A 119 -18.388 -0.868 -15.733 1.00 2.07 O ATOM 0 H GLU A 119 -18.456 1.821 -10.685 1.00 0.01 H new ATOM 0 HA GLU A 119 -20.869 1.641 -12.263 1.00 0.02 H new ATOM 0 HB2 GLU A 119 -18.405 1.841 -13.045 1.00 0.30 H new ATOM 0 HB3 GLU A 119 -18.243 0.137 -12.669 1.00 0.30 H new ATOM 0 HG2 GLU A 119 -20.246 -0.327 -14.177 1.00 0.99 H new ATOM 0 HG3 GLU A 119 -20.248 1.367 -14.627 1.00 0.99 H new ATOM 1845 N GLN A 120 -19.852 -1.046 -10.653 1.00 0.00 N ATOM 1846 CA GLN A 120 -20.267 -2.435 -10.295 1.00 0.01 C ATOM 1847 C GLN A 120 -21.392 -2.461 -9.253 1.00 0.01 C ATOM 1848 O GLN A 120 -22.335 -3.216 -9.379 1.00 0.01 O ATOM 1849 CB GLN A 120 -19.053 -3.185 -9.743 1.00 0.52 C ATOM 1850 CG GLN A 120 -19.354 -4.685 -9.692 1.00 1.07 C ATOM 1851 CD GLN A 120 -19.348 -5.255 -11.111 1.00 1.08 C ATOM 1852 OE1 GLN A 120 -20.359 -5.248 -11.784 1.00 0.98 O ATOM 1853 NE2 GLN A 120 -18.244 -5.752 -11.599 1.00 2.08 N ATOM 0 H GLN A 120 -19.006 -0.713 -10.190 1.00 0.00 H new ATOM 0 HA GLN A 120 -20.648 -2.912 -11.198 1.00 0.01 H new ATOM 0 HB2 GLN A 120 -18.182 -3.000 -10.372 1.00 0.52 H new ATOM 0 HB3 GLN A 120 -18.810 -2.819 -8.746 1.00 0.52 H new ATOM 0 HG2 GLN A 120 -18.610 -5.195 -9.081 1.00 1.07 H new ATOM 0 HG3 GLN A 120 -20.323 -4.857 -9.224 1.00 1.07 H new ATOM 0 HE21 GLN A 120 -17.394 -5.758 -11.035 1.00 2.08 H new ATOM 0 HE22 GLN A 120 -18.231 -6.134 -12.545 1.00 2.08 H new ATOM 1862 N PHE A 121 -21.262 -1.701 -8.191 1.00 0.02 N ATOM 1863 CA PHE A 121 -22.287 -1.747 -7.091 1.00 0.01 C ATOM 1864 C PHE A 121 -23.107 -0.459 -6.993 1.00 0.01 C ATOM 1865 O PHE A 121 -23.978 -0.343 -6.155 1.00 0.01 O ATOM 1866 CB PHE A 121 -21.568 -1.978 -5.764 1.00 0.01 C ATOM 1867 CG PHE A 121 -20.780 -3.263 -5.838 1.00 0.01 C ATOM 1868 CD1 PHE A 121 -21.395 -4.480 -5.517 1.00 0.01 C ATOM 1869 CD2 PHE A 121 -19.437 -3.240 -6.228 1.00 0.01 C ATOM 1870 CE1 PHE A 121 -20.665 -5.671 -5.586 1.00 0.01 C ATOM 1871 CE2 PHE A 121 -18.707 -4.431 -6.298 1.00 0.01 C ATOM 1872 CZ PHE A 121 -19.320 -5.648 -5.976 1.00 0.01 C ATOM 0 H PHE A 121 -20.492 -1.050 -8.036 1.00 0.02 H new ATOM 0 HA PHE A 121 -22.980 -2.557 -7.318 1.00 0.01 H new ATOM 0 HB2 PHE A 121 -20.902 -1.142 -5.548 1.00 0.01 H new ATOM 0 HB3 PHE A 121 -22.291 -2.028 -4.950 1.00 0.01 H new ATOM 0 HD1 PHE A 121 -22.432 -4.499 -5.216 1.00 0.01 H new ATOM 0 HD2 PHE A 121 -18.963 -2.302 -6.475 1.00 0.01 H new ATOM 0 HE1 PHE A 121 -21.139 -6.609 -5.338 1.00 0.01 H new ATOM 0 HE2 PHE A 121 -17.670 -4.412 -6.600 1.00 0.01 H new ATOM 0 HZ PHE A 121 -18.756 -6.568 -6.028 1.00 0.01 H new ATOM 1882 N HIS A 122 -22.845 0.512 -7.820 1.00 0.01 N ATOM 1883 CA HIS A 122 -23.620 1.779 -7.738 1.00 0.01 C ATOM 1884 C HIS A 122 -23.436 2.402 -6.351 1.00 0.01 C ATOM 1885 O HIS A 122 -24.333 3.028 -5.819 1.00 0.02 O ATOM 1886 CB HIS A 122 -25.102 1.483 -7.999 1.00 0.01 C ATOM 1887 CG HIS A 122 -25.222 0.451 -9.087 1.00 0.01 C ATOM 1888 ND1 HIS A 122 -26.137 -0.588 -9.025 1.00 0.01 N ATOM 1889 CD2 HIS A 122 -24.551 0.288 -10.274 1.00 0.01 C ATOM 1890 CE1 HIS A 122 -25.995 -1.323 -10.143 1.00 0.00 C ATOM 1891 NE2 HIS A 122 -25.041 -0.833 -10.939 1.00 0.01 N ATOM 0 H HIS A 122 -22.130 0.484 -8.547 1.00 0.01 H new ATOM 0 HA HIS A 122 -23.261 2.483 -8.489 1.00 0.01 H new ATOM 0 HB2 HIS A 122 -25.578 1.123 -7.087 1.00 0.01 H new ATOM 0 HB3 HIS A 122 -25.621 2.396 -8.290 1.00 0.01 H new ATOM 0 HD2 HIS A 122 -23.763 0.931 -10.637 1.00 0.01 H new ATOM 0 HE1 HIS A 122 -26.581 -2.202 -10.369 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -24.737 -1.201 -11.840 1.00 0.01 H new ATOM 1899 N LEU A 123 -22.269 2.236 -5.766 1.00 0.01 N ATOM 1900 CA LEU A 123 -21.997 2.816 -4.404 1.00 0.01 C ATOM 1901 C LEU A 123 -20.951 3.928 -4.545 1.00 0.02 C ATOM 1902 O LEU A 123 -19.962 3.782 -5.233 1.00 0.01 O ATOM 1903 CB LEU A 123 -21.452 1.710 -3.471 1.00 0.01 C ATOM 1904 CG LEU A 123 -22.603 1.021 -2.707 1.00 0.01 C ATOM 1905 CD1 LEU A 123 -22.143 -0.353 -2.204 1.00 0.01 C ATOM 1906 CD2 LEU A 123 -23.013 1.866 -1.493 1.00 0.01 C ATOM 0 H LEU A 123 -21.489 1.721 -6.175 1.00 0.01 H new ATOM 0 HA LEU A 123 -22.916 3.220 -3.980 1.00 0.01 H new ATOM 0 HB2 LEU A 123 -20.905 0.971 -4.056 1.00 0.01 H new ATOM 0 HB3 LEU A 123 -20.746 2.142 -2.762 1.00 0.01 H new ATOM 0 HG LEU A 123 -23.449 0.911 -3.385 1.00 0.01 H new ATOM 0 HD11 LEU A 123 -22.959 -0.835 -1.665 1.00 0.01 H new ATOM 0 HD12 LEU A 123 -21.852 -0.972 -3.052 1.00 0.01 H new ATOM 0 HD13 LEU A 123 -21.291 -0.229 -1.536 1.00 0.01 H new ATOM 0 HD21 LEU A 123 -23.826 1.370 -0.962 1.00 0.01 H new ATOM 0 HD22 LEU A 123 -22.160 1.981 -0.825 1.00 0.01 H new ATOM 0 HD23 LEU A 123 -23.345 2.848 -1.829 1.00 0.01 H new ATOM 1918 N ARG A 124 -21.171 5.046 -3.899 1.00 0.01 N ATOM 1919 CA ARG A 124 -20.201 6.176 -3.996 1.00 0.00 C ATOM 1920 C ARG A 124 -19.173 6.105 -2.862 1.00 0.01 C ATOM 1921 O ARG A 124 -18.092 6.652 -2.961 1.00 0.01 O ATOM 1922 CB ARG A 124 -20.959 7.503 -3.902 1.00 1.67 C ATOM 1923 CG ARG A 124 -20.027 8.651 -4.289 1.00 1.98 C ATOM 1924 CD ARG A 124 -20.813 9.964 -4.303 1.00 2.92 C ATOM 1925 NE ARG A 124 -19.957 11.050 -4.859 1.00 3.54 N ATOM 1926 CZ ARG A 124 -20.496 12.174 -5.241 1.00 4.57 C ATOM 1927 NH1 ARG A 124 -21.787 12.348 -5.138 1.00 5.25 N ATOM 1928 NH2 ARG A 124 -19.747 13.125 -5.730 1.00 5.32 N ATOM 0 H ARG A 124 -21.983 5.224 -3.308 1.00 0.01 H new ATOM 0 HA ARG A 124 -19.679 6.106 -4.950 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -21.826 7.486 -4.562 1.00 1.67 H new ATOM 0 HB3 ARG A 124 -21.333 7.650 -2.889 1.00 1.67 H new ATOM 0 HG2 ARG A 124 -19.201 8.717 -3.581 1.00 1.98 H new ATOM 0 HG3 ARG A 124 -19.592 8.465 -5.271 1.00 1.98 H new ATOM 0 HD2 ARG A 124 -21.715 9.854 -4.905 1.00 2.92 H new ATOM 0 HD3 ARG A 124 -21.133 10.220 -3.293 1.00 2.92 H new ATOM 0 HE ARG A 124 -18.949 10.914 -4.941 1.00 3.54 H new ATOM 0 HH11 ARG A 124 -22.373 11.604 -4.759 1.00 5.25 H new ATOM 0 HH12 ARG A 124 -22.209 13.227 -5.437 1.00 5.25 H new ATOM 0 HH21 ARG A 124 -18.740 12.989 -5.813 1.00 5.32 H new ATOM 0 HH22 ARG A 124 -20.169 14.004 -6.029 1.00 5.32 H new ATOM 1942 N GLU A 125 -19.509 5.455 -1.773 1.00 0.01 N ATOM 1943 CA GLU A 125 -18.559 5.374 -0.618 1.00 0.01 C ATOM 1944 C GLU A 125 -18.764 4.059 0.142 1.00 0.01 C ATOM 1945 O GLU A 125 -19.781 3.408 0.015 1.00 0.01 O ATOM 1946 CB GLU A 125 -18.830 6.535 0.341 1.00 0.01 C ATOM 1947 CG GLU A 125 -18.478 7.858 -0.343 1.00 0.01 C ATOM 1948 CD GLU A 125 -18.489 8.987 0.688 1.00 0.02 C ATOM 1949 OE1 GLU A 125 -19.498 9.145 1.355 1.00 0.01 O ATOM 1950 OE2 GLU A 125 -17.487 9.677 0.792 1.00 0.02 O ATOM 0 H GLU A 125 -20.400 4.977 -1.634 1.00 0.01 H new ATOM 0 HA GLU A 125 -17.538 5.423 -0.998 1.00 0.01 H new ATOM 0 HB2 GLU A 125 -19.878 6.536 0.640 1.00 0.01 H new ATOM 0 HB3 GLU A 125 -18.240 6.415 1.249 1.00 0.01 H new ATOM 0 HG2 GLU A 125 -17.495 7.788 -0.810 1.00 0.01 H new ATOM 0 HG3 GLU A 125 -19.194 8.070 -1.137 1.00 0.01 H new ATOM 1957 N ILE A 126 -17.811 3.686 0.962 1.00 0.01 N ATOM 1958 CA ILE A 126 -17.937 2.436 1.782 1.00 0.01 C ATOM 1959 C ILE A 126 -17.561 2.798 3.222 1.00 0.01 C ATOM 1960 O ILE A 126 -16.560 3.449 3.445 1.00 0.01 O ATOM 1961 CB ILE A 126 -16.979 1.369 1.238 1.00 1.33 C ATOM 1962 CG1 ILE A 126 -17.549 0.826 -0.073 1.00 1.49 C ATOM 1963 CG2 ILE A 126 -16.840 0.223 2.248 1.00 2.17 C ATOM 1964 CD1 ILE A 126 -16.519 -0.074 -0.753 1.00 1.70 C ATOM 0 H ILE A 126 -16.941 4.199 1.101 1.00 0.01 H new ATOM 0 HA ILE A 126 -18.951 2.039 1.741 1.00 0.01 H new ATOM 0 HB ILE A 126 -15.996 1.810 1.069 1.00 1.33 H new ATOM 0 HG12 ILE A 126 -18.463 0.265 0.122 1.00 1.49 H new ATOM 0 HG13 ILE A 126 -17.816 1.651 -0.733 1.00 1.49 H new ATOM 0 HG21 ILE A 126 -16.158 -0.530 1.853 1.00 2.17 H new ATOM 0 HG22 ILE A 126 -16.447 0.612 3.187 1.00 2.17 H new ATOM 0 HG23 ILE A 126 -17.817 -0.229 2.423 1.00 2.17 H new ATOM 0 HD11 ILE A 126 -16.931 -0.458 -1.686 1.00 1.70 H new ATOM 0 HD12 ILE A 126 -15.617 0.500 -0.964 1.00 1.70 H new ATOM 0 HD13 ILE A 126 -16.273 -0.908 -0.095 1.00 1.70 H new ATOM 1976 N HIS A 127 -18.380 2.451 4.197 1.00 0.01 N ATOM 1977 CA HIS A 127 -18.064 2.874 5.614 1.00 0.01 C ATOM 1978 C HIS A 127 -17.564 1.719 6.488 1.00 0.01 C ATOM 1979 O HIS A 127 -17.022 1.939 7.554 1.00 0.01 O ATOM 1980 CB HIS A 127 -19.310 3.505 6.249 1.00 0.02 C ATOM 1981 CG HIS A 127 -19.530 4.884 5.682 1.00 0.01 C ATOM 1982 ND1 HIS A 127 -19.096 5.239 4.415 1.00 0.01 N ATOM 1983 CD2 HIS A 127 -20.136 6.004 6.198 1.00 0.01 C ATOM 1984 CE1 HIS A 127 -19.444 6.524 4.212 1.00 0.01 C ATOM 1985 NE2 HIS A 127 -20.080 7.038 5.268 1.00 0.02 N ATOM 0 H HIS A 127 -19.234 1.906 4.081 1.00 0.01 H new ATOM 0 HA HIS A 127 -17.253 3.600 5.559 1.00 0.01 H new ATOM 0 HB2 HIS A 127 -20.183 2.880 6.058 1.00 0.02 H new ATOM 0 HB3 HIS A 127 -19.189 3.562 7.331 1.00 0.02 H new ATOM 0 HD2 HIS A 127 -20.587 6.072 7.177 1.00 0.01 H new ATOM 0 HE1 HIS A 127 -19.234 7.072 3.305 1.00 0.01 H new ATOM 0 HE2 HIS A 127 -20.446 7.985 5.371 1.00 0.02 H new ATOM 1993 N SER A 128 -17.690 0.506 6.049 1.00 0.01 N ATOM 1994 CA SER A 128 -17.166 -0.632 6.856 1.00 0.01 C ATOM 1995 C SER A 128 -16.968 -1.812 5.911 1.00 0.01 C ATOM 1996 O SER A 128 -17.574 -1.878 4.860 1.00 0.01 O ATOM 1997 CB SER A 128 -18.156 -0.992 7.970 1.00 0.01 C ATOM 1998 OG SER A 128 -19.478 -0.764 7.515 1.00 0.01 O ATOM 0 H SER A 128 -18.132 0.248 5.167 1.00 0.01 H new ATOM 0 HA SER A 128 -16.221 -0.365 7.329 1.00 0.01 H new ATOM 0 HB2 SER A 128 -18.033 -2.036 8.257 1.00 0.01 H new ATOM 0 HB3 SER A 128 -17.956 -0.392 8.857 1.00 0.01 H new ATOM 0 HG SER A 128 -19.656 0.199 7.497 1.00 0.01 H new ATOM 2004 N CYS A 129 -16.112 -2.731 6.248 1.00 0.01 N ATOM 2005 CA CYS A 129 -15.877 -3.876 5.332 1.00 0.01 C ATOM 2006 C CYS A 129 -15.184 -5.001 6.090 1.00 0.00 C ATOM 2007 O CYS A 129 -14.400 -4.770 6.991 1.00 0.01 O ATOM 2008 CB CYS A 129 -15.000 -3.416 4.163 1.00 0.69 C ATOM 2009 SG CYS A 129 -14.281 -4.846 3.311 1.00 1.22 S ATOM 0 H CYS A 129 -15.569 -2.740 7.111 1.00 0.01 H new ATOM 0 HA CYS A 129 -16.829 -4.241 4.947 1.00 0.01 H new ATOM 0 HB2 CYS A 129 -15.595 -2.829 3.463 1.00 0.69 H new ATOM 0 HB3 CYS A 129 -14.206 -2.766 4.530 1.00 0.69 H new ATOM 0 HG CYS A 129 -15.207 -5.731 3.092 1.00 1.22 H new ATOM 2015 N LYS A 130 -15.471 -6.227 5.727 1.00 0.01 N ATOM 2016 CA LYS A 130 -14.841 -7.390 6.416 1.00 0.01 C ATOM 2017 C LYS A 130 -14.048 -8.201 5.388 1.00 0.01 C ATOM 2018 O LYS A 130 -14.591 -8.882 4.548 1.00 0.01 O ATOM 2019 CB LYS A 130 -15.956 -8.262 7.056 1.00 0.55 C ATOM 2020 CG LYS A 130 -15.725 -8.409 8.573 1.00 0.80 C ATOM 2021 CD LYS A 130 -16.895 -9.174 9.216 1.00 0.29 C ATOM 2022 CE LYS A 130 -16.682 -10.686 9.076 1.00 0.33 C ATOM 2023 NZ LYS A 130 -15.399 -11.072 9.726 1.00 1.41 N ATOM 0 H LYS A 130 -16.119 -6.471 4.978 1.00 0.01 H new ATOM 0 HA LYS A 130 -14.164 -7.051 7.201 1.00 0.01 H new ATOM 0 HB2 LYS A 130 -16.930 -7.808 6.873 1.00 0.55 H new ATOM 0 HB3 LYS A 130 -15.970 -9.246 6.588 1.00 0.55 H new ATOM 0 HG2 LYS A 130 -14.790 -8.938 8.756 1.00 0.80 H new ATOM 0 HG3 LYS A 130 -15.629 -7.425 9.031 1.00 0.80 H new ATOM 0 HD2 LYS A 130 -16.978 -8.907 10.270 1.00 0.29 H new ATOM 0 HD3 LYS A 130 -17.832 -8.886 8.740 1.00 0.29 H new ATOM 0 HE2 LYS A 130 -17.511 -11.224 9.536 1.00 0.33 H new ATOM 0 HE3 LYS A 130 -16.666 -10.965 8.022 1.00 0.33 H new ATOM 0 HZ1 LYS A 130 -15.422 -12.084 9.965 1.00 1.41 H new ATOM 0 HZ2 LYS A 130 -14.610 -10.888 9.074 1.00 1.41 H new ATOM 0 HZ3 LYS A 130 -15.268 -10.514 10.594 1.00 1.41 H new ATOM 2037 N VAL A 131 -12.756 -8.138 5.485 1.00 0.01 N ATOM 2038 CA VAL A 131 -11.869 -8.910 4.571 1.00 0.01 C ATOM 2039 C VAL A 131 -11.269 -10.008 5.409 1.00 0.01 C ATOM 2040 O VAL A 131 -10.562 -9.729 6.363 1.00 0.01 O ATOM 2041 CB VAL A 131 -10.750 -8.006 4.049 1.00 0.01 C ATOM 2042 CG1 VAL A 131 -9.895 -8.776 3.041 1.00 0.01 C ATOM 2043 CG2 VAL A 131 -11.353 -6.777 3.367 1.00 0.01 C ATOM 0 H VAL A 131 -12.262 -7.571 6.175 1.00 0.01 H new ATOM 0 HA VAL A 131 -12.420 -9.302 3.716 1.00 0.01 H new ATOM 0 HB VAL A 131 -10.129 -7.688 4.886 1.00 0.01 H new ATOM 0 HG11 VAL A 131 -9.099 -8.130 2.671 1.00 0.01 H new ATOM 0 HG12 VAL A 131 -9.458 -9.649 3.526 1.00 0.01 H new ATOM 0 HG13 VAL A 131 -10.518 -9.099 2.207 1.00 0.01 H new ATOM 0 HG21 VAL A 131 -10.552 -6.137 2.997 1.00 0.01 H new ATOM 0 HG22 VAL A 131 -11.979 -7.094 2.533 1.00 0.01 H new ATOM 0 HG23 VAL A 131 -11.958 -6.223 4.084 1.00 0.01 H new ATOM 2053 N VAL A 132 -11.462 -11.264 5.048 1.00 0.01 N ATOM 2054 CA VAL A 132 -10.788 -12.337 5.844 1.00 0.01 C ATOM 2055 C VAL A 132 -10.445 -13.481 4.907 1.00 0.00 C ATOM 2056 O VAL A 132 -11.017 -14.548 4.989 1.00 0.01 O ATOM 2057 CB VAL A 132 -11.738 -12.845 6.934 1.00 1.22 C ATOM 2058 CG1 VAL A 132 -10.981 -13.778 7.880 1.00 1.00 C ATOM 2059 CG2 VAL A 132 -12.294 -11.661 7.729 1.00 1.98 C ATOM 0 H VAL A 132 -12.036 -11.579 4.266 1.00 0.01 H new ATOM 0 HA VAL A 132 -9.886 -11.944 6.312 1.00 0.01 H new ATOM 0 HB VAL A 132 -12.561 -13.387 6.467 1.00 1.22 H new ATOM 0 HG11 VAL A 132 -11.658 -14.138 8.655 1.00 1.00 H new ATOM 0 HG12 VAL A 132 -10.588 -14.626 7.318 1.00 1.00 H new ATOM 0 HG13 VAL A 132 -10.156 -13.236 8.343 1.00 1.00 H new ATOM 0 HG21 VAL A 132 -12.969 -12.027 8.503 1.00 1.98 H new ATOM 0 HG22 VAL A 132 -11.472 -11.116 8.193 1.00 1.98 H new ATOM 0 HG23 VAL A 132 -12.838 -10.996 7.058 1.00 1.98 H new ATOM 2069 N GLU A 133 -9.513 -13.282 4.037 1.00 0.01 N ATOM 2070 CA GLU A 133 -9.111 -14.364 3.101 1.00 0.01 C ATOM 2071 C GLU A 133 -8.135 -13.731 2.110 1.00 0.01 C ATOM 2072 O GLU A 133 -8.545 -12.951 1.269 1.00 0.01 O ATOM 2073 CB GLU A 133 -10.364 -14.954 2.390 1.00 0.00 C ATOM 2074 CG GLU A 133 -10.593 -16.416 2.816 1.00 0.00 C ATOM 2075 CD GLU A 133 -9.596 -17.325 2.092 1.00 0.00 C ATOM 2076 OE1 GLU A 133 -8.441 -16.944 1.992 1.00 0.00 O ATOM 2077 OE2 GLU A 133 -10.006 -18.385 1.649 1.00 0.00 O ATOM 0 H GLU A 133 -9.002 -12.406 3.928 1.00 0.01 H new ATOM 0 HA GLU A 133 -8.635 -15.196 3.619 1.00 0.01 H new ATOM 0 HB2 GLU A 133 -11.242 -14.357 2.635 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -10.234 -14.901 1.309 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -10.473 -16.514 3.895 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -11.613 -16.718 2.580 1.00 0.00 H new ATOM 2084 N GLY A 134 -6.870 -14.039 2.206 1.00 0.01 N ATOM 2085 CA GLY A 134 -5.879 -13.431 1.266 1.00 0.01 C ATOM 2086 C GLY A 134 -5.675 -11.952 1.619 1.00 0.01 C ATOM 2087 O GLY A 134 -6.229 -11.457 2.579 1.00 0.01 O ATOM 0 H GLY A 134 -6.478 -14.684 2.892 1.00 0.01 H new ATOM 0 HA2 GLY A 134 -4.930 -13.964 1.327 1.00 0.01 H new ATOM 0 HA3 GLY A 134 -6.232 -13.525 0.239 1.00 0.01 H new ATOM 2091 N THR A 135 -4.885 -11.244 0.844 1.00 0.01 N ATOM 2092 CA THR A 135 -4.637 -9.786 1.122 1.00 0.01 C ATOM 2093 C THR A 135 -5.304 -8.946 0.027 1.00 0.01 C ATOM 2094 O THR A 135 -5.397 -9.363 -1.111 1.00 0.01 O ATOM 2095 CB THR A 135 -3.129 -9.519 1.125 1.00 1.43 C ATOM 2096 OG1 THR A 135 -2.476 -10.528 1.882 1.00 1.92 O ATOM 2097 CG2 THR A 135 -2.849 -8.150 1.750 1.00 2.30 C ATOM 0 H THR A 135 -4.398 -11.613 0.027 1.00 0.01 H new ATOM 0 HA THR A 135 -5.054 -9.519 2.093 1.00 0.01 H new ATOM 0 HB THR A 135 -2.756 -9.529 0.101 1.00 1.43 H new ATOM 0 HG1 THR A 135 -1.510 -10.361 1.885 1.00 1.92 H new ATOM 0 HG21 THR A 135 -1.775 -7.963 1.751 1.00 2.30 H new ATOM 0 HG22 THR A 135 -3.352 -7.376 1.170 1.00 2.30 H new ATOM 0 HG23 THR A 135 -3.220 -8.135 2.775 1.00 2.30 H new ATOM 2105 N TRP A 136 -5.787 -7.772 0.370 1.00 0.01 N ATOM 2106 CA TRP A 136 -6.477 -6.898 -0.636 1.00 0.01 C ATOM 2107 C TRP A 136 -5.932 -5.466 -0.574 1.00 0.01 C ATOM 2108 O TRP A 136 -5.541 -4.987 0.467 1.00 0.00 O ATOM 2109 CB TRP A 136 -7.976 -6.865 -0.333 1.00 0.01 C ATOM 2110 CG TRP A 136 -8.603 -8.173 -0.699 1.00 0.01 C ATOM 2111 CD1 TRP A 136 -8.559 -9.296 0.055 1.00 0.01 C ATOM 2112 CD2 TRP A 136 -9.371 -8.512 -1.891 1.00 0.01 C ATOM 2113 NE1 TRP A 136 -9.253 -10.299 -0.597 1.00 0.00 N ATOM 2114 CE2 TRP A 136 -9.771 -9.866 -1.800 1.00 0.01 C ATOM 2115 CE3 TRP A 136 -9.756 -7.783 -3.030 1.00 0.01 C ATOM 2116 CZ2 TRP A 136 -10.525 -10.474 -2.804 1.00 0.01 C ATOM 2117 CZ3 TRP A 136 -10.516 -8.394 -4.042 1.00 0.01 C ATOM 2118 CH2 TRP A 136 -10.900 -9.736 -3.927 1.00 0.01 C ATOM 0 H TRP A 136 -5.732 -7.380 1.310 1.00 0.01 H new ATOM 0 HA TRP A 136 -6.297 -7.306 -1.630 1.00 0.01 H new ATOM 0 HB2 TRP A 136 -8.137 -6.659 0.725 1.00 0.01 H new ATOM 0 HB3 TRP A 136 -8.450 -6.057 -0.890 1.00 0.01 H new ATOM 0 HD1 TRP A 136 -8.063 -9.393 1.010 1.00 0.01 H new ATOM 0 HE1 TRP A 136 -9.368 -11.245 -0.232 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -9.466 -6.747 -3.128 1.00 0.01 H new ATOM 0 HZ2 TRP A 136 -10.817 -11.510 -2.712 1.00 0.01 H new ATOM 0 HZ3 TRP A 136 -10.806 -7.825 -4.913 1.00 0.01 H new ATOM 0 HH2 TRP A 136 -11.486 -10.199 -4.707 1.00 0.01 H new ATOM 2129 N ILE A 137 -5.928 -4.774 -1.688 1.00 0.01 N ATOM 2130 CA ILE A 137 -5.451 -3.350 -1.718 1.00 0.00 C ATOM 2131 C ILE A 137 -6.625 -2.476 -2.171 1.00 0.01 C ATOM 2132 O ILE A 137 -7.357 -2.845 -3.062 1.00 0.01 O ATOM 2133 CB ILE A 137 -4.315 -3.200 -2.735 1.00 0.60 C ATOM 2134 CG1 ILE A 137 -3.204 -4.202 -2.422 1.00 1.32 C ATOM 2135 CG2 ILE A 137 -3.748 -1.780 -2.661 1.00 1.37 C ATOM 2136 CD1 ILE A 137 -2.111 -4.095 -3.489 1.00 1.69 C ATOM 0 H ILE A 137 -6.238 -5.137 -2.589 1.00 0.01 H new ATOM 0 HA ILE A 137 -5.092 -3.056 -0.732 1.00 0.00 H new ATOM 0 HB ILE A 137 -4.703 -3.390 -3.736 1.00 0.60 H new ATOM 0 HG12 ILE A 137 -2.786 -4.002 -1.435 1.00 1.32 H new ATOM 0 HG13 ILE A 137 -3.607 -5.214 -2.398 1.00 1.32 H new ATOM 0 HG21 ILE A 137 -2.940 -1.673 -3.384 1.00 1.37 H new ATOM 0 HG22 ILE A 137 -4.536 -1.061 -2.888 1.00 1.37 H new ATOM 0 HG23 ILE A 137 -3.364 -1.593 -1.658 1.00 1.37 H new ATOM 0 HD11 ILE A 137 -1.317 -4.808 -3.269 1.00 1.69 H new ATOM 0 HD12 ILE A 137 -2.536 -4.315 -4.468 1.00 1.69 H new ATOM 0 HD13 ILE A 137 -1.701 -3.085 -3.490 1.00 1.69 H new ATOM 2148 N PHE A 138 -6.785 -1.309 -1.583 1.00 0.01 N ATOM 2149 CA PHE A 138 -7.894 -0.373 -1.994 1.00 0.01 C ATOM 2150 C PHE A 138 -7.237 0.863 -2.632 1.00 0.01 C ATOM 2151 O PHE A 138 -6.211 1.326 -2.179 1.00 0.00 O ATOM 2152 CB PHE A 138 -8.770 -0.038 -0.740 1.00 1.11 C ATOM 2153 CG PHE A 138 -8.789 1.442 -0.353 1.00 1.11 C ATOM 2154 CD1 PHE A 138 -9.176 2.429 -1.274 1.00 1.54 C ATOM 2155 CD2 PHE A 138 -8.433 1.819 0.952 1.00 1.46 C ATOM 2156 CE1 PHE A 138 -9.196 3.776 -0.891 1.00 2.35 C ATOM 2157 CE2 PHE A 138 -8.452 3.166 1.327 1.00 2.01 C ATOM 2158 CZ PHE A 138 -8.830 4.144 0.406 1.00 2.49 C ATOM 0 H PHE A 138 -6.192 -0.960 -0.830 1.00 0.01 H new ATOM 0 HA PHE A 138 -8.567 -0.816 -2.729 1.00 0.01 H new ATOM 0 HB2 PHE A 138 -9.793 -0.363 -0.930 1.00 1.11 H new ATOM 0 HB3 PHE A 138 -8.404 -0.617 0.108 1.00 1.11 H new ATOM 0 HD1 PHE A 138 -9.458 2.149 -2.278 1.00 1.54 H new ATOM 0 HD2 PHE A 138 -8.143 1.065 1.669 1.00 1.46 H new ATOM 0 HE1 PHE A 138 -9.495 4.533 -1.601 1.00 2.35 H new ATOM 0 HE2 PHE A 138 -8.174 3.450 2.331 1.00 2.01 H new ATOM 0 HZ PHE A 138 -8.840 5.184 0.696 1.00 2.49 H new ATOM 2168 N TYR A 139 -7.829 1.400 -3.682 1.00 0.01 N ATOM 2169 CA TYR A 139 -7.257 2.610 -4.360 1.00 0.01 C ATOM 2170 C TYR A 139 -8.304 3.731 -4.366 1.00 0.01 C ATOM 2171 O TYR A 139 -9.501 3.483 -4.423 1.00 0.01 O ATOM 2172 CB TYR A 139 -6.878 2.263 -5.804 1.00 0.01 C ATOM 2173 CG TYR A 139 -6.074 0.982 -5.829 1.00 0.01 C ATOM 2174 CD1 TYR A 139 -6.710 -0.242 -5.600 1.00 0.01 C ATOM 2175 CD2 TYR A 139 -4.697 1.018 -6.084 1.00 0.01 C ATOM 2176 CE1 TYR A 139 -5.972 -1.431 -5.625 1.00 0.01 C ATOM 2177 CE2 TYR A 139 -3.959 -0.173 -6.109 1.00 0.02 C ATOM 2178 CZ TYR A 139 -4.596 -1.397 -5.878 1.00 0.02 C ATOM 2179 OH TYR A 139 -3.868 -2.569 -5.902 1.00 0.00 O ATOM 0 H TYR A 139 -8.690 1.046 -4.098 1.00 0.01 H new ATOM 0 HA TYR A 139 -6.368 2.939 -3.822 1.00 0.01 H new ATOM 0 HB2 TYR A 139 -7.778 2.150 -6.409 1.00 0.01 H new ATOM 0 HB3 TYR A 139 -6.299 3.075 -6.243 1.00 0.01 H new ATOM 0 HD1 TYR A 139 -7.772 -0.270 -5.404 1.00 0.01 H new ATOM 0 HD2 TYR A 139 -4.205 1.963 -6.261 1.00 0.01 H new ATOM 0 HE1 TYR A 139 -6.465 -2.376 -5.449 1.00 0.01 H new ATOM 0 HE2 TYR A 139 -2.898 -0.146 -6.307 1.00 0.02 H new ATOM 0 HH TYR A 139 -2.928 -2.367 -6.093 1.00 0.00 H new ATOM 2189 N GLU A 140 -7.863 4.959 -4.246 1.00 0.01 N ATOM 2190 CA GLU A 140 -8.810 6.113 -4.166 1.00 0.02 C ATOM 2191 C GLU A 140 -9.432 6.447 -5.527 1.00 0.01 C ATOM 2192 O GLU A 140 -10.544 6.935 -5.575 1.00 0.01 O ATOM 2193 CB GLU A 140 -8.021 7.324 -3.669 1.00 0.01 C ATOM 2194 CG GLU A 140 -8.990 8.436 -3.262 1.00 0.02 C ATOM 2195 CD GLU A 140 -8.203 9.718 -2.977 1.00 0.02 C ATOM 2196 OE1 GLU A 140 -7.179 9.626 -2.320 1.00 0.02 O ATOM 2197 OE2 GLU A 140 -8.639 10.768 -3.419 1.00 0.01 O ATOM 0 H GLU A 140 -6.876 5.213 -4.200 1.00 0.01 H new ATOM 0 HA GLU A 140 -9.625 5.852 -3.491 1.00 0.02 H new ATOM 0 HB2 GLU A 140 -7.398 7.042 -2.820 1.00 0.01 H new ATOM 0 HB3 GLU A 140 -7.351 7.680 -4.451 1.00 0.01 H new ATOM 0 HG2 GLU A 140 -9.715 8.611 -4.057 1.00 0.02 H new ATOM 0 HG3 GLU A 140 -9.553 8.137 -2.377 1.00 0.02 H new ATOM 2204 N LEU A 141 -8.753 6.213 -6.630 1.00 0.01 N ATOM 2205 CA LEU A 141 -9.354 6.550 -7.969 1.00 0.02 C ATOM 2206 C LEU A 141 -9.563 5.249 -8.769 1.00 0.01 C ATOM 2207 O LEU A 141 -8.855 4.277 -8.563 1.00 0.01 O ATOM 2208 CB LEU A 141 -8.377 7.474 -8.726 1.00 0.57 C ATOM 2209 CG LEU A 141 -8.570 8.938 -8.277 1.00 0.81 C ATOM 2210 CD1 LEU A 141 -7.291 9.735 -8.555 1.00 1.48 C ATOM 2211 CD2 LEU A 141 -9.734 9.585 -9.044 1.00 1.24 C ATOM 0 H LEU A 141 -7.818 5.807 -6.663 1.00 0.01 H new ATOM 0 HA LEU A 141 -10.313 7.052 -7.840 1.00 0.02 H new ATOM 0 HB2 LEU A 141 -7.350 7.161 -8.538 1.00 0.57 H new ATOM 0 HB3 LEU A 141 -8.544 7.390 -9.800 1.00 0.57 H new ATOM 0 HG LEU A 141 -8.792 8.946 -7.210 1.00 0.81 H new ATOM 0 HD11 LEU A 141 -7.430 10.768 -8.237 1.00 1.48 H new ATOM 0 HD12 LEU A 141 -6.461 9.294 -8.004 1.00 1.48 H new ATOM 0 HD13 LEU A 141 -7.072 9.710 -9.622 1.00 1.48 H new ATOM 0 HD21 LEU A 141 -9.857 10.617 -8.716 1.00 1.24 H new ATOM 0 HD22 LEU A 141 -9.520 9.567 -10.113 1.00 1.24 H new ATOM 0 HD23 LEU A 141 -10.652 9.030 -8.848 1.00 1.24 H new ATOM 2223 N PRO A 142 -10.520 5.223 -9.685 1.00 0.01 N ATOM 2224 CA PRO A 142 -10.785 3.997 -10.494 1.00 0.01 C ATOM 2225 C PRO A 142 -9.530 3.482 -11.205 1.00 0.01 C ATOM 2226 O PRO A 142 -8.521 4.151 -11.315 1.00 0.01 O ATOM 2227 CB PRO A 142 -11.851 4.476 -11.507 1.00 0.01 C ATOM 2228 CG PRO A 142 -12.084 5.983 -11.292 1.00 0.02 C ATOM 2229 CD PRO A 142 -11.397 6.396 -9.980 1.00 0.01 C ATOM 0 HA PRO A 142 -11.111 3.155 -9.883 1.00 0.01 H new ATOM 0 HB2 PRO A 142 -11.517 4.286 -12.527 1.00 0.01 H new ATOM 0 HB3 PRO A 142 -12.781 3.925 -11.368 1.00 0.01 H new ATOM 0 HG2 PRO A 142 -11.679 6.553 -12.128 1.00 0.02 H new ATOM 0 HG3 PRO A 142 -13.151 6.199 -11.246 1.00 0.02 H new ATOM 0 HD2 PRO A 142 -10.820 7.314 -10.096 1.00 0.01 H new ATOM 0 HD3 PRO A 142 -12.119 6.572 -9.183 1.00 0.01 H new ATOM 2237 N ASN A 143 -9.632 2.284 -11.705 1.00 0.01 N ATOM 2238 CA ASN A 143 -8.506 1.657 -12.450 1.00 0.01 C ATOM 2239 C ASN A 143 -7.258 1.552 -11.572 1.00 0.01 C ATOM 2240 O ASN A 143 -6.141 1.580 -12.049 1.00 0.01 O ATOM 2241 CB ASN A 143 -8.185 2.504 -13.683 1.00 0.23 C ATOM 2242 CG ASN A 143 -7.314 1.699 -14.649 1.00 0.11 C ATOM 2243 OD1 ASN A 143 -7.810 0.865 -15.381 1.00 0.75 O ATOM 2244 ND2 ASN A 143 -6.028 1.916 -14.684 1.00 0.56 N ATOM 0 H ASN A 143 -10.465 1.701 -11.627 1.00 0.01 H new ATOM 0 HA ASN A 143 -8.805 0.652 -12.748 1.00 0.01 H new ATOM 0 HB2 ASN A 143 -9.108 2.808 -14.177 1.00 0.23 H new ATOM 0 HB3 ASN A 143 -7.667 3.416 -13.385 1.00 0.23 H new ATOM 0 HD21 ASN A 143 -5.439 1.386 -15.326 1.00 0.56 H new ATOM 0 HD22 ASN A 143 -5.612 2.616 -14.070 1.00 0.56 H new ATOM 2251 N TYR A 144 -7.450 1.392 -10.291 1.00 0.01 N ATOM 2252 CA TYR A 144 -6.295 1.236 -9.361 1.00 0.02 C ATOM 2253 C TYR A 144 -5.346 2.438 -9.454 1.00 0.01 C ATOM 2254 O TYR A 144 -4.153 2.280 -9.623 1.00 0.01 O ATOM 2255 CB TYR A 144 -5.540 -0.056 -9.717 1.00 0.01 C ATOM 2256 CG TYR A 144 -6.520 -1.068 -10.274 1.00 0.01 C ATOM 2257 CD1 TYR A 144 -7.629 -1.459 -9.508 1.00 0.01 C ATOM 2258 CD2 TYR A 144 -6.332 -1.607 -11.554 1.00 0.01 C ATOM 2259 CE1 TYR A 144 -8.543 -2.386 -10.020 1.00 0.01 C ATOM 2260 CE2 TYR A 144 -7.250 -2.533 -12.066 1.00 0.01 C ATOM 2261 CZ TYR A 144 -8.354 -2.923 -11.299 1.00 0.01 C ATOM 2262 OH TYR A 144 -9.257 -3.835 -11.804 1.00 0.01 O ATOM 0 H TYR A 144 -8.367 1.362 -9.845 1.00 0.01 H new ATOM 0 HA TYR A 144 -6.669 1.182 -8.338 1.00 0.02 H new ATOM 0 HB2 TYR A 144 -4.760 0.154 -10.449 1.00 0.01 H new ATOM 0 HB3 TYR A 144 -5.046 -0.459 -8.832 1.00 0.01 H new ATOM 0 HD1 TYR A 144 -7.777 -1.044 -8.522 1.00 0.01 H new ATOM 0 HD2 TYR A 144 -5.479 -1.308 -12.146 1.00 0.01 H new ATOM 0 HE1 TYR A 144 -9.395 -2.688 -9.428 1.00 0.01 H new ATOM 0 HE2 TYR A 144 -7.106 -2.946 -13.053 1.00 0.01 H new ATOM 0 HH TYR A 144 -8.979 -4.107 -12.703 1.00 0.01 H new ATOM 2272 N ARG A 145 -5.871 3.637 -9.340 1.00 0.02 N ATOM 2273 CA ARG A 145 -5.001 4.860 -9.415 1.00 0.01 C ATOM 2274 C ARG A 145 -5.191 5.707 -8.155 1.00 0.01 C ATOM 2275 O ARG A 145 -6.137 5.525 -7.414 1.00 0.01 O ATOM 2276 CB ARG A 145 -5.405 5.694 -10.631 1.00 0.01 C ATOM 2277 CG ARG A 145 -5.256 4.850 -11.900 1.00 0.02 C ATOM 2278 CD ARG A 145 -5.644 5.688 -13.118 1.00 0.01 C ATOM 2279 NE ARG A 145 -4.588 6.706 -13.377 1.00 0.01 N ATOM 2280 CZ ARG A 145 -4.549 7.330 -14.524 1.00 0.01 C ATOM 2281 NH1 ARG A 145 -5.434 7.060 -15.442 1.00 0.02 N ATOM 2282 NH2 ARG A 145 -3.624 8.222 -14.750 1.00 0.01 N ATOM 0 H ARG A 145 -6.864 3.823 -9.198 1.00 0.02 H new ATOM 0 HA ARG A 145 -3.959 4.553 -9.499 1.00 0.01 H new ATOM 0 HB2 ARG A 145 -6.435 6.034 -10.526 1.00 0.01 H new ATOM 0 HB3 ARG A 145 -4.781 6.585 -10.698 1.00 0.01 H new ATOM 0 HG2 ARG A 145 -4.228 4.500 -11.998 1.00 0.02 H new ATOM 0 HG3 ARG A 145 -5.889 3.965 -11.837 1.00 0.02 H new ATOM 0 HD2 ARG A 145 -5.767 5.046 -13.990 1.00 0.01 H new ATOM 0 HD3 ARG A 145 -6.602 6.178 -12.945 1.00 0.01 H new ATOM 0 HE ARG A 145 -3.895 6.916 -12.659 1.00 0.01 H new ATOM 0 HH11 ARG A 145 -6.156 6.362 -15.264 1.00 0.02 H new ATOM 0 HH12 ARG A 145 -5.404 7.547 -16.338 1.00 0.02 H new ATOM 0 HH21 ARG A 145 -2.931 8.432 -14.031 1.00 0.01 H new ATOM 0 HH22 ARG A 145 -3.593 8.709 -15.646 1.00 0.01 H new ATOM 2296 N GLY A 146 -4.289 6.621 -7.885 1.00 0.01 N ATOM 2297 CA GLY A 146 -4.412 7.468 -6.662 1.00 0.02 C ATOM 2298 C GLY A 146 -3.708 6.790 -5.487 1.00 0.01 C ATOM 2299 O GLY A 146 -2.931 5.870 -5.655 1.00 0.02 O ATOM 0 H GLY A 146 -3.471 6.815 -8.463 1.00 0.01 H new ATOM 0 HA2 GLY A 146 -3.973 8.449 -6.843 1.00 0.02 H new ATOM 0 HA3 GLY A 146 -5.464 7.628 -6.424 1.00 0.02 H new ATOM 2303 N ARG A 147 -3.975 7.246 -4.295 1.00 0.01 N ATOM 2304 CA ARG A 147 -3.325 6.643 -3.096 1.00 0.01 C ATOM 2305 C ARG A 147 -3.850 5.222 -2.912 1.00 0.01 C ATOM 2306 O ARG A 147 -5.008 4.929 -3.151 1.00 0.01 O ATOM 2307 CB ARG A 147 -3.668 7.481 -1.865 1.00 0.01 C ATOM 2308 CG ARG A 147 -2.883 6.964 -0.656 1.00 0.01 C ATOM 2309 CD ARG A 147 -2.983 7.975 0.488 1.00 0.01 C ATOM 2310 NE ARG A 147 -2.370 7.398 1.716 1.00 0.02 N ATOM 2311 CZ ARG A 147 -2.074 8.172 2.723 1.00 0.02 C ATOM 2312 NH1 ARG A 147 -2.317 9.454 2.654 1.00 0.01 N ATOM 2313 NH2 ARG A 147 -1.537 7.667 3.799 1.00 0.02 N ATOM 0 H ARG A 147 -4.618 8.013 -4.098 1.00 0.01 H new ATOM 0 HA ARG A 147 -2.243 6.620 -3.227 1.00 0.01 H new ATOM 0 HB2 ARG A 147 -3.427 8.528 -2.047 1.00 0.01 H new ATOM 0 HB3 ARG A 147 -4.738 7.430 -1.665 1.00 0.01 H new ATOM 0 HG2 ARG A 147 -3.278 5.999 -0.338 1.00 0.01 H new ATOM 0 HG3 ARG A 147 -1.839 6.807 -0.927 1.00 0.01 H new ATOM 0 HD2 ARG A 147 -2.475 8.900 0.215 1.00 0.01 H new ATOM 0 HD3 ARG A 147 -4.027 8.228 0.674 1.00 0.01 H new ATOM 0 HE ARG A 147 -2.181 6.397 1.770 1.00 0.02 H new ATOM 0 HH11 ARG A 147 -2.738 9.849 1.813 1.00 0.01 H new ATOM 0 HH12 ARG A 147 -2.086 10.060 3.441 1.00 0.01 H new ATOM 0 HH21 ARG A 147 -1.348 6.666 3.853 1.00 0.02 H new ATOM 0 HH22 ARG A 147 -1.306 8.273 4.586 1.00 0.02 H new ATOM 2327 N GLN A 148 -2.974 4.329 -2.517 1.00 0.01 N ATOM 2328 CA GLN A 148 -3.345 2.894 -2.332 1.00 0.01 C ATOM 2329 C GLN A 148 -3.149 2.508 -0.860 1.00 0.01 C ATOM 2330 O GLN A 148 -2.288 3.031 -0.181 1.00 0.01 O ATOM 2331 CB GLN A 148 -2.399 2.051 -3.212 1.00 0.00 C ATOM 2332 CG GLN A 148 -2.033 2.835 -4.478 1.00 0.02 C ATOM 2333 CD GLN A 148 -1.456 1.883 -5.527 1.00 0.02 C ATOM 2334 OE1 GLN A 148 -1.581 2.119 -6.712 1.00 0.02 O ATOM 2335 NE2 GLN A 148 -0.826 0.808 -5.140 1.00 0.01 N ATOM 0 H GLN A 148 -1.998 4.541 -2.311 1.00 0.01 H new ATOM 0 HA GLN A 148 -4.385 2.723 -2.611 1.00 0.01 H new ATOM 0 HB2 GLN A 148 -1.496 1.800 -2.655 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -2.880 1.110 -3.482 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -2.916 3.336 -4.875 1.00 0.02 H new ATOM 0 HG3 GLN A 148 -1.306 3.611 -4.239 1.00 0.02 H new ATOM 0 HE21 GLN A 148 -0.721 0.609 -4.145 1.00 0.01 H new ATOM 0 HE22 GLN A 148 -0.439 0.167 -5.832 1.00 0.01 H new ATOM 2344 N TYR A 149 -3.941 1.592 -0.371 1.00 0.01 N ATOM 2345 CA TYR A 149 -3.822 1.143 1.053 1.00 0.01 C ATOM 2346 C TYR A 149 -3.729 -0.383 1.097 1.00 0.01 C ATOM 2347 O TYR A 149 -4.387 -1.066 0.334 1.00 0.01 O ATOM 2348 CB TYR A 149 -5.058 1.591 1.820 1.00 0.01 C ATOM 2349 CG TYR A 149 -4.985 3.077 2.080 1.00 0.01 C ATOM 2350 CD1 TYR A 149 -5.384 3.983 1.088 1.00 0.01 C ATOM 2351 CD2 TYR A 149 -4.519 3.549 3.312 1.00 0.01 C ATOM 2352 CE1 TYR A 149 -5.314 5.360 1.329 1.00 0.01 C ATOM 2353 CE2 TYR A 149 -4.449 4.926 3.553 1.00 0.01 C ATOM 2354 CZ TYR A 149 -4.847 5.831 2.561 1.00 0.01 C ATOM 2355 OH TYR A 149 -4.779 7.189 2.799 1.00 0.01 O ATOM 0 H TYR A 149 -4.677 1.127 -0.903 1.00 0.01 H new ATOM 0 HA TYR A 149 -2.929 1.577 1.502 1.00 0.01 H new ATOM 0 HB2 TYR A 149 -5.957 1.356 1.250 1.00 0.01 H new ATOM 0 HB3 TYR A 149 -5.128 1.050 2.764 1.00 0.01 H new ATOM 0 HD1 TYR A 149 -5.745 3.619 0.138 1.00 0.01 H new ATOM 0 HD2 TYR A 149 -4.213 2.851 4.077 1.00 0.01 H new ATOM 0 HE1 TYR A 149 -5.620 6.059 0.564 1.00 0.01 H new ATOM 0 HE2 TYR A 149 -4.088 5.290 4.503 1.00 0.01 H new ATOM 0 HH TYR A 149 -4.434 7.346 3.703 1.00 0.01 H new ATOM 2365 N LEU A 150 -2.925 -0.927 1.973 1.00 0.01 N ATOM 2366 CA LEU A 150 -2.797 -2.416 2.052 1.00 0.01 C ATOM 2367 C LEU A 150 -3.746 -2.937 3.137 1.00 0.01 C ATOM 2368 O LEU A 150 -3.616 -2.604 4.299 1.00 0.01 O ATOM 2369 CB LEU A 150 -1.344 -2.751 2.416 1.00 0.01 C ATOM 2370 CG LEU A 150 -1.041 -4.242 2.108 1.00 0.01 C ATOM 2371 CD1 LEU A 150 -0.361 -4.368 0.739 1.00 0.01 C ATOM 2372 CD2 LEU A 150 -0.106 -4.820 3.177 1.00 0.01 C ATOM 0 H LEU A 150 -2.351 -0.407 2.637 1.00 0.01 H new ATOM 0 HA LEU A 150 -3.055 -2.882 1.101 1.00 0.01 H new ATOM 0 HB2 LEU A 150 -0.664 -2.111 1.853 1.00 0.01 H new ATOM 0 HB3 LEU A 150 -1.171 -2.549 3.473 1.00 0.01 H new ATOM 0 HG LEU A 150 -1.982 -4.792 2.105 1.00 0.01 H new ATOM 0 HD11 LEU A 150 -0.152 -5.418 0.532 1.00 0.01 H new ATOM 0 HD12 LEU A 150 -1.020 -3.970 -0.033 1.00 0.01 H new ATOM 0 HD13 LEU A 150 0.573 -3.806 0.744 1.00 0.01 H new ATOM 0 HD21 LEU A 150 0.101 -5.866 2.952 1.00 0.01 H new ATOM 0 HD22 LEU A 150 0.829 -4.259 3.185 1.00 0.01 H new ATOM 0 HD23 LEU A 150 -0.582 -4.746 4.155 1.00 0.01 H new ATOM 2384 N LEU A 151 -4.700 -3.758 2.762 1.00 0.01 N ATOM 2385 CA LEU A 151 -5.673 -4.319 3.754 1.00 0.01 C ATOM 2386 C LEU A 151 -5.351 -5.799 4.008 1.00 0.01 C ATOM 2387 O LEU A 151 -5.115 -6.558 3.086 1.00 0.01 O ATOM 2388 CB LEU A 151 -7.118 -4.179 3.212 1.00 0.01 C ATOM 2389 CG LEU A 151 -7.230 -3.018 2.195 1.00 0.01 C ATOM 2390 CD1 LEU A 151 -8.646 -3.000 1.563 1.00 0.01 C ATOM 2391 CD2 LEU A 151 -6.937 -1.668 2.884 1.00 0.01 C ATOM 0 H LEU A 151 -4.847 -4.066 1.801 1.00 0.01 H new ATOM 0 HA LEU A 151 -5.592 -3.767 4.690 1.00 0.01 H new ATOM 0 HB2 LEU A 151 -7.422 -5.112 2.737 1.00 0.01 H new ATOM 0 HB3 LEU A 151 -7.804 -4.006 4.041 1.00 0.01 H new ATOM 0 HG LEU A 151 -6.493 -3.172 1.407 1.00 0.01 H new ATOM 0 HD11 LEU A 151 -8.715 -2.180 0.849 1.00 0.01 H new ATOM 0 HD12 LEU A 151 -8.827 -3.944 1.050 1.00 0.01 H new ATOM 0 HD13 LEU A 151 -9.392 -2.863 2.346 1.00 0.01 H new ATOM 0 HD21 LEU A 151 -7.020 -0.862 2.155 1.00 0.01 H new ATOM 0 HD22 LEU A 151 -7.656 -1.506 3.687 1.00 0.01 H new ATOM 0 HD23 LEU A 151 -5.928 -1.682 3.297 1.00 0.01 H new ATOM 2403 N ASP A 152 -5.359 -6.220 5.251 1.00 0.01 N ATOM 2404 CA ASP A 152 -5.071 -7.653 5.582 1.00 0.01 C ATOM 2405 C ASP A 152 -6.361 -8.328 6.058 1.00 0.00 C ATOM 2406 O ASP A 152 -7.371 -7.682 6.248 1.00 0.01 O ATOM 2407 CB ASP A 152 -4.027 -7.711 6.699 1.00 1.04 C ATOM 2408 CG ASP A 152 -4.422 -6.746 7.819 1.00 1.54 C ATOM 2409 OD1 ASP A 152 -5.526 -6.228 7.769 1.00 1.57 O ATOM 2410 OD2 ASP A 152 -3.613 -6.542 8.709 1.00 2.27 O ATOM 0 H ASP A 152 -5.554 -5.627 6.057 1.00 0.01 H new ATOM 0 HA ASP A 152 -4.692 -8.167 4.699 1.00 0.01 H new ATOM 0 HB2 ASP A 152 -3.952 -8.726 7.089 1.00 1.04 H new ATOM 0 HB3 ASP A 152 -3.045 -7.447 6.307 1.00 1.04 H new ATOM 2415 N LYS A 153 -6.338 -9.624 6.255 1.00 0.01 N ATOM 2416 CA LYS A 153 -7.567 -10.332 6.726 1.00 0.01 C ATOM 2417 C LYS A 153 -8.033 -9.690 8.037 1.00 0.01 C ATOM 2418 O LYS A 153 -7.707 -10.154 9.113 1.00 0.01 O ATOM 2419 CB LYS A 153 -7.244 -11.816 6.959 1.00 0.38 C ATOM 2420 CG LYS A 153 -5.848 -11.951 7.573 1.00 0.71 C ATOM 2421 CD LYS A 153 -5.613 -13.401 8.029 1.00 0.72 C ATOM 2422 CE LYS A 153 -6.549 -13.764 9.198 1.00 1.09 C ATOM 2423 NZ LYS A 153 -7.788 -14.396 8.661 1.00 1.84 N ATOM 0 H LYS A 153 -5.523 -10.220 6.110 1.00 0.01 H new ATOM 0 HA LYS A 153 -8.355 -10.253 5.977 1.00 0.01 H new ATOM 0 HB2 LYS A 153 -7.987 -12.260 7.621 1.00 0.38 H new ATOM 0 HB3 LYS A 153 -7.291 -12.361 6.016 1.00 0.38 H new ATOM 0 HG2 LYS A 153 -5.091 -11.663 6.843 1.00 0.71 H new ATOM 0 HG3 LYS A 153 -5.747 -11.273 8.421 1.00 0.71 H new ATOM 0 HD2 LYS A 153 -5.784 -14.082 7.195 1.00 0.72 H new ATOM 0 HD3 LYS A 153 -4.575 -13.527 8.336 1.00 0.72 H new ATOM 0 HE2 LYS A 153 -6.046 -14.447 9.883 1.00 1.09 H new ATOM 0 HE3 LYS A 153 -6.801 -12.870 9.768 1.00 1.09 H new ATOM 0 HZ1 LYS A 153 -8.618 -14.001 9.148 1.00 1.84 H new ATOM 0 HZ2 LYS A 153 -7.861 -14.205 7.641 1.00 1.84 H new ATOM 0 HZ3 LYS A 153 -7.750 -15.423 8.819 1.00 1.84 H new ATOM 2437 N LYS A 154 -8.777 -8.610 7.959 1.00 0.00 N ATOM 2438 CA LYS A 154 -9.246 -7.914 9.204 1.00 0.01 C ATOM 2439 C LYS A 154 -10.721 -7.512 9.096 1.00 0.01 C ATOM 2440 O LYS A 154 -11.305 -7.490 8.026 1.00 0.00 O ATOM 2441 CB LYS A 154 -8.394 -6.658 9.418 1.00 0.39 C ATOM 2442 CG LYS A 154 -8.802 -5.967 10.725 1.00 0.48 C ATOM 2443 CD LYS A 154 -7.687 -5.024 11.179 1.00 0.97 C ATOM 2444 CE LYS A 154 -8.128 -4.284 12.444 1.00 1.44 C ATOM 2445 NZ LYS A 154 -9.378 -3.521 12.162 1.00 2.28 N ATOM 0 H LYS A 154 -9.080 -8.179 7.086 1.00 0.00 H new ATOM 0 HA LYS A 154 -9.142 -8.599 10.046 1.00 0.01 H new ATOM 0 HB2 LYS A 154 -7.338 -6.926 9.452 1.00 0.39 H new ATOM 0 HB3 LYS A 154 -8.522 -5.974 8.579 1.00 0.39 H new ATOM 0 HG2 LYS A 154 -9.727 -5.409 10.579 1.00 0.48 H new ATOM 0 HG3 LYS A 154 -8.998 -6.712 11.496 1.00 0.48 H new ATOM 0 HD2 LYS A 154 -6.776 -5.589 11.374 1.00 0.97 H new ATOM 0 HD3 LYS A 154 -7.456 -4.310 10.389 1.00 0.97 H new ATOM 0 HE2 LYS A 154 -8.297 -4.994 13.253 1.00 1.44 H new ATOM 0 HE3 LYS A 154 -7.342 -3.605 12.774 1.00 1.44 H new ATOM 0 HZ1 LYS A 154 -9.469 -2.740 12.843 1.00 2.28 H new ATOM 0 HZ2 LYS A 154 -9.340 -3.136 11.197 1.00 2.28 H new ATOM 0 HZ3 LYS A 154 -10.198 -4.154 12.250 1.00 2.28 H new ATOM 2459 N GLU A 155 -11.309 -7.150 10.211 1.00 0.01 N ATOM 2460 CA GLU A 155 -12.731 -6.693 10.231 1.00 0.01 C ATOM 2461 C GLU A 155 -12.736 -5.189 10.530 1.00 0.01 C ATOM 2462 O GLU A 155 -12.434 -4.769 11.629 1.00 0.01 O ATOM 2463 CB GLU A 155 -13.496 -7.450 11.328 1.00 0.01 C ATOM 2464 CG GLU A 155 -12.574 -7.693 12.530 1.00 0.01 C ATOM 2465 CD GLU A 155 -11.633 -8.864 12.235 1.00 0.01 C ATOM 2466 OE1 GLU A 155 -11.692 -9.385 11.134 1.00 0.01 O ATOM 2467 OE2 GLU A 155 -10.869 -9.219 13.118 1.00 0.01 O ATOM 0 H GLU A 155 -10.853 -7.153 11.123 1.00 0.01 H new ATOM 0 HA GLU A 155 -13.213 -6.888 9.273 1.00 0.01 H new ATOM 0 HB2 GLU A 155 -14.369 -6.876 11.638 1.00 0.01 H new ATOM 0 HB3 GLU A 155 -13.861 -8.401 10.940 1.00 0.01 H new ATOM 0 HG2 GLU A 155 -11.995 -6.794 12.743 1.00 0.01 H new ATOM 0 HG3 GLU A 155 -13.168 -7.907 13.418 1.00 0.01 H new ATOM 2474 N TYR A 156 -13.051 -4.369 9.556 1.00 0.00 N ATOM 2475 CA TYR A 156 -13.043 -2.889 9.780 1.00 0.01 C ATOM 2476 C TYR A 156 -14.462 -2.384 10.040 1.00 0.01 C ATOM 2477 O TYR A 156 -15.319 -2.472 9.182 1.00 0.01 O ATOM 2478 CB TYR A 156 -12.471 -2.202 8.538 1.00 0.01 C ATOM 2479 CG TYR A 156 -11.039 -2.639 8.331 1.00 0.00 C ATOM 2480 CD1 TYR A 156 -10.022 -2.103 9.128 1.00 0.01 C ATOM 2481 CD2 TYR A 156 -10.729 -3.580 7.339 1.00 0.01 C ATOM 2482 CE1 TYR A 156 -8.695 -2.505 8.936 1.00 0.01 C ATOM 2483 CE2 TYR A 156 -9.402 -3.981 7.146 1.00 0.01 C ATOM 2484 CZ TYR A 156 -8.384 -3.444 7.944 1.00 0.01 C ATOM 2485 OH TYR A 156 -7.074 -3.840 7.755 1.00 0.01 O ATOM 0 H TYR A 156 -13.314 -4.661 8.615 1.00 0.00 H new ATOM 0 HA TYR A 156 -12.428 -2.659 10.650 1.00 0.01 H new ATOM 0 HB2 TYR A 156 -13.069 -2.455 7.662 1.00 0.01 H new ATOM 0 HB3 TYR A 156 -12.518 -1.119 8.655 1.00 0.01 H new ATOM 0 HD1 TYR A 156 -10.261 -1.378 9.892 1.00 0.01 H new ATOM 0 HD2 TYR A 156 -11.514 -3.995 6.724 1.00 0.01 H new ATOM 0 HE1 TYR A 156 -7.911 -2.091 9.553 1.00 0.01 H new ATOM 0 HE2 TYR A 156 -9.163 -4.705 6.381 1.00 0.01 H new ATOM 0 HH TYR A 156 -7.032 -4.818 7.705 1.00 0.01 H new ATOM 2495 N ARG A 157 -14.730 -1.895 11.227 1.00 0.01 N ATOM 2496 CA ARG A 157 -16.112 -1.429 11.553 1.00 0.01 C ATOM 2497 C ARG A 157 -16.278 0.065 11.255 1.00 0.00 C ATOM 2498 O ARG A 157 -17.367 0.512 10.953 1.00 0.01 O ATOM 2499 CB ARG A 157 -16.382 -1.680 13.041 1.00 0.01 C ATOM 2500 CG ARG A 157 -15.749 -3.010 13.457 1.00 0.01 C ATOM 2501 CD ARG A 157 -16.314 -3.443 14.810 1.00 0.00 C ATOM 2502 NE ARG A 157 -16.059 -2.376 15.817 1.00 0.01 N ATOM 2503 CZ ARG A 157 -16.696 -2.389 16.954 1.00 0.01 C ATOM 2504 NH1 ARG A 157 -17.552 -3.341 17.210 1.00 0.01 N ATOM 2505 NH2 ARG A 157 -16.478 -1.452 17.836 1.00 0.01 N ATOM 0 H ARG A 157 -14.051 -1.799 11.982 1.00 0.01 H new ATOM 0 HA ARG A 157 -16.820 -1.981 10.936 1.00 0.01 H new ATOM 0 HB2 ARG A 157 -15.971 -0.867 13.639 1.00 0.01 H new ATOM 0 HB3 ARG A 157 -17.456 -1.702 13.228 1.00 0.01 H new ATOM 0 HG2 ARG A 157 -15.952 -3.773 12.705 1.00 0.01 H new ATOM 0 HG3 ARG A 157 -14.666 -2.905 13.520 1.00 0.01 H new ATOM 0 HD2 ARG A 157 -17.384 -3.631 14.726 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -15.850 -4.377 15.128 1.00 0.00 H new ATOM 0 HE ARG A 157 -15.386 -1.636 15.617 1.00 0.01 H new ATOM 0 HH11 ARG A 157 -17.722 -4.073 16.521 1.00 0.01 H new ATOM 0 HH12 ARG A 157 -18.051 -3.352 18.099 1.00 0.01 H new ATOM 0 HH21 ARG A 157 -15.809 -0.709 17.636 1.00 0.01 H new ATOM 0 HH22 ARG A 157 -16.977 -1.463 18.726 1.00 0.01 H new ATOM 2519 N LYS A 158 -15.222 0.843 11.317 1.00 0.01 N ATOM 2520 CA LYS A 158 -15.331 2.308 11.015 1.00 0.01 C ATOM 2521 C LYS A 158 -14.293 2.655 9.933 1.00 0.01 C ATOM 2522 O LYS A 158 -13.264 2.016 9.852 1.00 0.01 O ATOM 2523 CB LYS A 158 -15.027 3.102 12.292 1.00 0.58 C ATOM 2524 CG LYS A 158 -16.262 3.124 13.194 1.00 0.97 C ATOM 2525 CD LYS A 158 -15.889 3.711 14.557 1.00 1.44 C ATOM 2526 CE LYS A 158 -17.090 3.624 15.500 1.00 2.13 C ATOM 2527 NZ LYS A 158 -16.822 4.432 16.724 1.00 2.54 N ATOM 0 H LYS A 158 -14.285 0.525 11.565 1.00 0.01 H new ATOM 0 HA LYS A 158 -16.333 2.556 10.664 1.00 0.01 H new ATOM 0 HB2 LYS A 158 -14.187 2.651 12.821 1.00 0.58 H new ATOM 0 HB3 LYS A 158 -14.733 4.120 12.037 1.00 0.58 H new ATOM 0 HG2 LYS A 158 -17.051 3.719 12.734 1.00 0.97 H new ATOM 0 HG3 LYS A 158 -16.654 2.114 13.316 1.00 0.97 H new ATOM 0 HD2 LYS A 158 -15.043 3.168 14.979 1.00 1.44 H new ATOM 0 HD3 LYS A 158 -15.577 4.749 14.444 1.00 1.44 H new ATOM 0 HE2 LYS A 158 -17.986 3.990 14.999 1.00 2.13 H new ATOM 0 HE3 LYS A 158 -17.278 2.585 15.771 1.00 2.13 H new ATOM 0 HZ1 LYS A 158 -17.639 4.373 17.365 1.00 2.54 H new ATOM 0 HZ2 LYS A 158 -15.977 4.063 17.205 1.00 2.54 H new ATOM 0 HZ3 LYS A 158 -16.663 5.424 16.457 1.00 2.54 H new ATOM 2541 N PRO A 159 -14.523 3.663 9.121 1.00 0.01 N ATOM 2542 CA PRO A 159 -13.524 4.031 8.077 1.00 0.02 C ATOM 2543 C PRO A 159 -12.173 4.399 8.707 1.00 0.01 C ATOM 2544 O PRO A 159 -11.133 3.989 8.233 1.00 0.01 O ATOM 2545 CB PRO A 159 -14.194 5.234 7.385 1.00 0.41 C ATOM 2546 CG PRO A 159 -15.417 5.652 8.222 1.00 0.70 C ATOM 2547 CD PRO A 159 -15.757 4.497 9.178 1.00 0.28 C ATOM 0 HA PRO A 159 -13.289 3.222 7.385 1.00 0.02 H new ATOM 0 HB2 PRO A 159 -13.491 6.063 7.299 1.00 0.41 H new ATOM 0 HB3 PRO A 159 -14.499 4.969 6.373 1.00 0.41 H new ATOM 0 HG2 PRO A 159 -15.201 6.561 8.784 1.00 0.70 H new ATOM 0 HG3 PRO A 159 -16.265 5.872 7.574 1.00 0.70 H new ATOM 0 HD2 PRO A 159 -15.961 4.852 10.188 1.00 0.28 H new ATOM 0 HD3 PRO A 159 -16.637 3.944 8.850 1.00 0.28 H new ATOM 2555 N VAL A 160 -12.169 5.170 9.756 1.00 0.01 N ATOM 2556 CA VAL A 160 -10.871 5.549 10.381 1.00 0.02 C ATOM 2557 C VAL A 160 -10.149 4.290 10.862 1.00 0.02 C ATOM 2558 O VAL A 160 -8.948 4.290 11.043 1.00 0.02 O ATOM 2559 CB VAL A 160 -11.135 6.475 11.569 1.00 0.14 C ATOM 2560 CG1 VAL A 160 -9.809 6.846 12.236 1.00 0.86 C ATOM 2561 CG2 VAL A 160 -11.829 7.746 11.077 1.00 0.74 C ATOM 0 H VAL A 160 -13.001 5.552 10.206 1.00 0.01 H new ATOM 0 HA VAL A 160 -10.248 6.063 9.649 1.00 0.02 H new ATOM 0 HB VAL A 160 -11.773 5.965 12.291 1.00 0.14 H new ATOM 0 HG11 VAL A 160 -10.000 7.506 13.082 1.00 0.86 H new ATOM 0 HG12 VAL A 160 -9.312 5.941 12.586 1.00 0.86 H new ATOM 0 HG13 VAL A 160 -9.169 7.356 11.515 1.00 0.86 H new ATOM 0 HG21 VAL A 160 -12.018 8.408 11.922 1.00 0.74 H new ATOM 0 HG22 VAL A 160 -11.189 8.254 10.355 1.00 0.74 H new ATOM 0 HG23 VAL A 160 -12.775 7.484 10.603 1.00 0.74 H new ATOM 2571 N ASP A 161 -10.857 3.213 11.077 1.00 0.00 N ATOM 2572 CA ASP A 161 -10.172 1.980 11.550 1.00 0.01 C ATOM 2573 C ASP A 161 -9.227 1.455 10.465 1.00 0.01 C ATOM 2574 O ASP A 161 -8.354 0.651 10.726 1.00 0.01 O ATOM 2575 CB ASP A 161 -11.211 0.903 11.872 1.00 0.00 C ATOM 2576 CG ASP A 161 -10.550 -0.218 12.678 1.00 0.02 C ATOM 2577 OD1 ASP A 161 -9.366 -0.104 12.951 1.00 0.00 O ATOM 2578 OD2 ASP A 161 -11.238 -1.168 13.011 1.00 0.00 O ATOM 0 H ASP A 161 -11.866 3.135 10.947 1.00 0.00 H new ATOM 0 HA ASP A 161 -9.599 2.219 12.446 1.00 0.01 H new ATOM 0 HB2 ASP A 161 -12.035 1.336 12.439 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -11.633 0.503 10.950 1.00 0.00 H new ATOM 2583 N TRP A 162 -9.386 1.919 9.248 1.00 0.01 N ATOM 2584 CA TRP A 162 -8.485 1.460 8.141 1.00 0.01 C ATOM 2585 C TRP A 162 -7.372 2.502 7.953 1.00 0.01 C ATOM 2586 O TRP A 162 -6.625 2.448 6.996 1.00 0.01 O ATOM 2587 CB TRP A 162 -9.298 1.343 6.820 1.00 0.01 C ATOM 2588 CG TRP A 162 -9.209 -0.025 6.190 1.00 0.02 C ATOM 2589 CD1 TRP A 162 -8.159 -0.890 6.249 1.00 0.01 C ATOM 2590 CD2 TRP A 162 -10.214 -0.670 5.361 1.00 0.01 C ATOM 2591 NE1 TRP A 162 -8.483 -2.030 5.537 1.00 0.01 N ATOM 2592 CE2 TRP A 162 -9.736 -1.940 4.967 1.00 0.01 C ATOM 2593 CE3 TRP A 162 -11.491 -0.277 4.926 1.00 0.01 C ATOM 2594 CZ2 TRP A 162 -10.499 -2.790 4.168 1.00 0.01 C ATOM 2595 CZ3 TRP A 162 -12.258 -1.126 4.119 1.00 0.01 C ATOM 2596 CH2 TRP A 162 -11.763 -2.381 3.741 1.00 0.01 C ATOM 0 H TRP A 162 -10.099 2.594 8.973 1.00 0.01 H new ATOM 0 HA TRP A 162 -8.059 0.488 8.390 1.00 0.01 H new ATOM 0 HB2 TRP A 162 -10.343 1.576 7.022 1.00 0.01 H new ATOM 0 HB3 TRP A 162 -8.936 2.087 6.111 1.00 0.01 H new ATOM 0 HD1 TRP A 162 -7.227 -0.715 6.766 1.00 0.01 H new ATOM 0 HE1 TRP A 162 -7.870 -2.840 5.444 1.00 0.01 H new ATOM 0 HE3 TRP A 162 -11.884 0.686 5.216 1.00 0.01 H new ATOM 0 HZ2 TRP A 162 -10.115 -3.758 3.882 1.00 0.01 H new ATOM 0 HZ3 TRP A 162 -13.236 -0.812 3.786 1.00 0.01 H new ATOM 0 HH2 TRP A 162 -12.360 -3.032 3.119 1.00 0.01 H new ATOM 2607 N GLY A 163 -7.235 3.432 8.853 1.00 0.02 N ATOM 2608 CA GLY A 163 -6.150 4.440 8.710 1.00 0.01 C ATOM 2609 C GLY A 163 -6.544 5.504 7.682 1.00 0.01 C ATOM 2610 O GLY A 163 -5.733 6.304 7.256 1.00 0.01 O ATOM 0 H GLY A 163 -7.824 3.538 9.679 1.00 0.02 H new ATOM 0 HA2 GLY A 163 -5.953 4.911 9.673 1.00 0.01 H new ATOM 0 HA3 GLY A 163 -5.227 3.949 8.400 1.00 0.01 H new ATOM 2614 N ALA A 164 -7.784 5.500 7.257 1.00 0.01 N ATOM 2615 CA ALA A 164 -8.241 6.486 6.228 1.00 0.02 C ATOM 2616 C ALA A 164 -8.978 7.643 6.899 1.00 0.01 C ATOM 2617 O ALA A 164 -9.711 7.467 7.850 1.00 0.02 O ATOM 2618 CB ALA A 164 -9.220 5.787 5.282 1.00 0.01 C ATOM 0 H ALA A 164 -8.503 4.853 7.580 1.00 0.01 H new ATOM 0 HA ALA A 164 -7.374 6.866 5.688 1.00 0.02 H new ATOM 0 HB1 ALA A 164 -9.562 6.493 4.526 1.00 0.01 H new ATOM 0 HB2 ALA A 164 -8.721 4.949 4.796 1.00 0.01 H new ATOM 0 HB3 ALA A 164 -10.075 5.420 5.850 1.00 0.01 H new ATOM 2624 N ALA A 165 -8.782 8.831 6.395 1.00 0.02 N ATOM 2625 CA ALA A 165 -9.457 10.023 6.977 1.00 0.01 C ATOM 2626 C ALA A 165 -10.858 10.185 6.380 1.00 0.02 C ATOM 2627 O ALA A 165 -11.645 10.980 6.853 1.00 0.01 O ATOM 2628 CB ALA A 165 -8.638 11.278 6.667 1.00 0.59 C ATOM 0 H ALA A 165 -8.177 9.027 5.597 1.00 0.02 H new ATOM 0 HA ALA A 165 -9.538 9.886 8.055 1.00 0.01 H new ATOM 0 HB1 ALA A 165 -9.133 12.150 7.094 1.00 0.59 H new ATOM 0 HB2 ALA A 165 -7.642 11.179 7.099 1.00 0.59 H new ATOM 0 HB3 ALA A 165 -8.554 11.400 5.587 1.00 0.59 H new ATOM 2634 N SER A 166 -11.197 9.433 5.358 1.00 0.01 N ATOM 2635 CA SER A 166 -12.564 9.541 4.756 1.00 0.01 C ATOM 2636 C SER A 166 -13.011 8.143 4.271 1.00 0.02 C ATOM 2637 O SER A 166 -12.180 7.340 3.895 1.00 0.01 O ATOM 2638 CB SER A 166 -12.516 10.499 3.564 1.00 0.72 C ATOM 2639 OG SER A 166 -13.599 10.216 2.687 1.00 0.87 O ATOM 0 H SER A 166 -10.584 8.748 4.915 1.00 0.01 H new ATOM 0 HA SER A 166 -13.268 9.917 5.498 1.00 0.01 H new ATOM 0 HB2 SER A 166 -12.574 11.531 3.910 1.00 0.72 H new ATOM 0 HB3 SER A 166 -11.568 10.393 3.036 1.00 0.72 H new ATOM 0 HG SER A 166 -13.571 10.830 1.924 1.00 0.87 H new ATOM 2645 N PRO A 167 -14.297 7.839 4.256 1.00 0.02 N ATOM 2646 CA PRO A 167 -14.765 6.500 3.775 1.00 0.01 C ATOM 2647 C PRO A 167 -14.730 6.381 2.243 1.00 0.01 C ATOM 2648 O PRO A 167 -15.441 5.580 1.661 1.00 0.01 O ATOM 2649 CB PRO A 167 -16.216 6.479 4.282 1.00 0.38 C ATOM 2650 CG PRO A 167 -16.649 7.938 4.478 1.00 0.35 C ATOM 2651 CD PRO A 167 -15.377 8.769 4.716 1.00 0.22 C ATOM 0 HA PRO A 167 -14.142 5.678 4.129 1.00 0.01 H new ATOM 0 HB2 PRO A 167 -16.867 5.977 3.566 1.00 0.38 H new ATOM 0 HB3 PRO A 167 -16.288 5.927 5.219 1.00 0.38 H new ATOM 0 HG2 PRO A 167 -17.185 8.300 3.601 1.00 0.35 H new ATOM 0 HG3 PRO A 167 -17.329 8.026 5.326 1.00 0.35 H new ATOM 0 HD2 PRO A 167 -15.385 9.697 4.145 1.00 0.22 H new ATOM 0 HD3 PRO A 167 -15.260 9.041 5.765 1.00 0.22 H new ATOM 2659 N ALA A 168 -13.951 7.195 1.581 1.00 0.01 N ATOM 2660 CA ALA A 168 -13.933 7.141 0.089 1.00 0.01 C ATOM 2661 C ALA A 168 -13.011 6.029 -0.429 1.00 0.01 C ATOM 2662 O ALA A 168 -11.837 5.962 -0.126 1.00 0.02 O ATOM 2663 CB ALA A 168 -13.435 8.481 -0.455 1.00 0.18 C ATOM 0 H ALA A 168 -13.333 7.888 2.003 1.00 0.01 H new ATOM 0 HA ALA A 168 -14.948 6.933 -0.251 1.00 0.01 H new ATOM 0 HB1 ALA A 168 -13.419 8.448 -1.544 1.00 0.18 H new ATOM 0 HB2 ALA A 168 -14.102 9.278 -0.125 1.00 0.18 H new ATOM 0 HB3 ALA A 168 -12.428 8.673 -0.083 1.00 0.18 H new ATOM 2669 N ILE A 169 -13.581 5.174 -1.235 1.00 0.01 N ATOM 2670 CA ILE A 169 -12.834 4.037 -1.852 1.00 0.01 C ATOM 2671 C ILE A 169 -13.431 3.829 -3.245 1.00 0.01 C ATOM 2672 O ILE A 169 -14.630 3.702 -3.383 1.00 0.01 O ATOM 2673 CB ILE A 169 -13.042 2.770 -1.000 1.00 1.81 C ATOM 2674 CG1 ILE A 169 -12.543 3.038 0.430 1.00 2.75 C ATOM 2675 CG2 ILE A 169 -12.290 1.557 -1.616 1.00 2.24 C ATOM 2676 CD1 ILE A 169 -12.647 1.754 1.257 1.00 3.99 C ATOM 0 H ILE A 169 -14.565 5.218 -1.500 1.00 0.01 H new ATOM 0 HA ILE A 169 -11.765 4.242 -1.910 1.00 0.01 H new ATOM 0 HB ILE A 169 -14.104 2.527 -0.978 1.00 1.81 H new ATOM 0 HG12 ILE A 169 -11.510 3.385 0.407 1.00 2.75 H new ATOM 0 HG13 ILE A 169 -13.135 3.829 0.891 1.00 2.75 H new ATOM 0 HG21 ILE A 169 -12.453 0.675 -0.996 1.00 2.24 H new ATOM 0 HG22 ILE A 169 -12.666 1.368 -2.621 1.00 2.24 H new ATOM 0 HG23 ILE A 169 -11.223 1.776 -1.663 1.00 2.24 H new ATOM 0 HD11 ILE A 169 -12.293 1.944 2.270 1.00 3.99 H new ATOM 0 HD12 ILE A 169 -13.686 1.426 1.291 1.00 3.99 H new ATOM 0 HD13 ILE A 169 -12.036 0.976 0.799 1.00 3.99 H new ATOM 2688 N GLN A 170 -12.623 3.834 -4.289 1.00 0.01 N ATOM 2689 CA GLN A 170 -13.172 3.681 -5.680 1.00 0.01 C ATOM 2690 C GLN A 170 -12.767 2.353 -6.330 1.00 0.02 C ATOM 2691 O GLN A 170 -13.416 1.919 -7.260 1.00 0.01 O ATOM 2692 CB GLN A 170 -12.669 4.835 -6.552 1.00 2.62 C ATOM 2693 CG GLN A 170 -13.325 6.142 -6.098 1.00 3.39 C ATOM 2694 CD GLN A 170 -14.788 6.160 -6.542 1.00 4.36 C ATOM 2695 OE1 GLN A 170 -15.657 6.568 -5.796 1.00 4.83 O ATOM 2696 NE2 GLN A 170 -15.102 5.732 -7.735 1.00 5.17 N ATOM 0 H GLN A 170 -11.610 3.937 -4.235 1.00 0.01 H new ATOM 0 HA GLN A 170 -14.259 3.693 -5.603 1.00 0.01 H new ATOM 0 HB2 GLN A 170 -11.584 4.915 -6.478 1.00 2.62 H new ATOM 0 HB3 GLN A 170 -12.903 4.643 -7.599 1.00 2.62 H new ATOM 0 HG2 GLN A 170 -13.262 6.235 -5.014 1.00 3.39 H new ATOM 0 HG3 GLN A 170 -12.795 6.994 -6.523 1.00 3.39 H new ATOM 0 HE21 GLN A 170 -14.374 5.389 -8.362 1.00 5.17 H new ATOM 0 HE22 GLN A 170 -16.075 5.740 -8.040 1.00 5.17 H new ATOM 2705 N SER A 171 -11.730 1.678 -5.894 1.00 0.01 N ATOM 2706 CA SER A 171 -11.386 0.385 -6.570 1.00 0.01 C ATOM 2707 C SER A 171 -10.583 -0.500 -5.614 1.00 0.01 C ATOM 2708 O SER A 171 -9.983 -0.028 -4.670 1.00 0.01 O ATOM 2709 CB SER A 171 -10.552 0.676 -7.819 1.00 0.01 C ATOM 2710 OG SER A 171 -10.218 -0.549 -8.458 1.00 0.02 O ATOM 0 H SER A 171 -11.122 1.954 -5.123 1.00 0.01 H new ATOM 0 HA SER A 171 -12.303 -0.133 -6.853 1.00 0.01 H new ATOM 0 HB2 SER A 171 -11.111 1.315 -8.502 1.00 0.01 H new ATOM 0 HB3 SER A 171 -9.645 1.216 -7.547 1.00 0.01 H new ATOM 0 HG SER A 171 -11.018 -1.111 -8.526 1.00 0.02 H new ATOM 2716 N PHE A 172 -10.546 -1.788 -5.863 1.00 0.01 N ATOM 2717 CA PHE A 172 -9.751 -2.690 -4.972 1.00 0.01 C ATOM 2718 C PHE A 172 -9.287 -3.935 -5.738 1.00 0.01 C ATOM 2719 O PHE A 172 -9.891 -4.344 -6.709 1.00 0.01 O ATOM 2720 CB PHE A 172 -10.564 -3.091 -3.730 1.00 1.06 C ATOM 2721 CG PHE A 172 -11.916 -3.664 -4.106 1.00 0.75 C ATOM 2722 CD1 PHE A 172 -12.012 -4.945 -4.665 1.00 0.75 C ATOM 2723 CD2 PHE A 172 -13.080 -2.921 -3.862 1.00 1.29 C ATOM 2724 CE1 PHE A 172 -13.266 -5.478 -4.986 1.00 1.16 C ATOM 2725 CE2 PHE A 172 -14.335 -3.457 -4.181 1.00 2.02 C ATOM 2726 CZ PHE A 172 -14.428 -4.734 -4.742 1.00 1.92 C ATOM 0 H PHE A 172 -11.026 -2.249 -6.636 1.00 0.01 H new ATOM 0 HA PHE A 172 -8.869 -2.143 -4.638 1.00 0.01 H new ATOM 0 HB2 PHE A 172 -10.005 -3.826 -3.151 1.00 1.06 H new ATOM 0 HB3 PHE A 172 -10.703 -2.220 -3.089 1.00 1.06 H new ATOM 0 HD1 PHE A 172 -11.118 -5.522 -4.848 1.00 0.75 H new ATOM 0 HD2 PHE A 172 -13.009 -1.935 -3.428 1.00 1.29 H new ATOM 0 HE1 PHE A 172 -13.338 -6.463 -5.422 1.00 1.16 H new ATOM 0 HE2 PHE A 172 -15.231 -2.883 -3.993 1.00 2.02 H new ATOM 0 HZ PHE A 172 -15.395 -5.147 -4.987 1.00 1.92 H new ATOM 2736 N ARG A 173 -8.201 -4.536 -5.311 1.00 0.01 N ATOM 2737 CA ARG A 173 -7.675 -5.748 -6.020 1.00 0.01 C ATOM 2738 C ARG A 173 -7.070 -6.735 -5.020 1.00 0.01 C ATOM 2739 O ARG A 173 -6.567 -6.362 -3.978 1.00 0.01 O ATOM 2740 CB ARG A 173 -6.565 -5.342 -6.995 1.00 0.01 C ATOM 2741 CG ARG A 173 -7.123 -4.461 -8.122 1.00 0.01 C ATOM 2742 CD ARG A 173 -6.197 -4.547 -9.346 1.00 0.01 C ATOM 2743 NE ARG A 173 -4.790 -4.743 -8.895 1.00 0.01 N ATOM 2744 CZ ARG A 173 -3.882 -5.146 -9.743 1.00 0.01 C ATOM 2745 NH1 ARG A 173 -4.207 -5.387 -10.983 1.00 0.01 N ATOM 2746 NH2 ARG A 173 -2.649 -5.311 -9.347 1.00 0.01 N ATOM 0 H ARG A 173 -7.656 -4.240 -4.502 1.00 0.01 H new ATOM 0 HA ARG A 173 -8.507 -6.211 -6.550 1.00 0.01 H new ATOM 0 HB2 ARG A 173 -5.784 -4.803 -6.459 1.00 0.01 H new ATOM 0 HB3 ARG A 173 -6.104 -6.234 -7.419 1.00 0.01 H new ATOM 0 HG2 ARG A 173 -8.128 -4.787 -8.389 1.00 0.01 H new ATOM 0 HG3 ARG A 173 -7.203 -3.428 -7.785 1.00 0.01 H new ATOM 0 HD2 ARG A 173 -6.502 -5.373 -9.988 1.00 0.01 H new ATOM 0 HD3 ARG A 173 -6.276 -3.636 -9.939 1.00 0.01 H new ATOM 0 HE ARG A 173 -4.536 -4.562 -7.924 1.00 0.01 H new ATOM 0 HH11 ARG A 173 -5.171 -5.261 -11.291 1.00 0.01 H new ATOM 0 HH12 ARG A 173 -3.497 -5.702 -11.644 1.00 0.01 H new ATOM 0 HH21 ARG A 173 -2.396 -5.125 -8.377 1.00 0.01 H new ATOM 0 HH22 ARG A 173 -1.939 -5.626 -10.008 1.00 0.01 H new ATOM 2760 N ARG A 174 -7.101 -7.997 -5.354 1.00 0.01 N ATOM 2761 CA ARG A 174 -6.516 -9.037 -4.460 1.00 0.01 C ATOM 2762 C ARG A 174 -5.026 -9.196 -4.789 1.00 0.01 C ATOM 2763 O ARG A 174 -4.628 -9.149 -5.936 1.00 0.01 O ATOM 2764 CB ARG A 174 -7.225 -10.374 -4.692 1.00 0.01 C ATOM 2765 CG ARG A 174 -7.387 -10.615 -6.196 1.00 0.01 C ATOM 2766 CD ARG A 174 -7.839 -12.057 -6.436 1.00 0.01 C ATOM 2767 NE ARG A 174 -8.307 -12.202 -7.843 1.00 0.01 N ATOM 2768 CZ ARG A 174 -8.456 -13.390 -8.362 1.00 0.01 C ATOM 2769 NH1 ARG A 174 -8.193 -14.451 -7.649 1.00 0.01 N ATOM 2770 NH2 ARG A 174 -8.868 -13.516 -9.594 1.00 0.01 N ATOM 0 H ARG A 174 -7.511 -8.355 -6.217 1.00 0.01 H new ATOM 0 HA ARG A 174 -6.641 -8.736 -3.420 1.00 0.01 H new ATOM 0 HB2 ARG A 174 -6.651 -11.184 -4.243 1.00 0.01 H new ATOM 0 HB3 ARG A 174 -8.201 -10.369 -4.207 1.00 0.01 H new ATOM 0 HG2 ARG A 174 -8.118 -9.920 -6.610 1.00 0.01 H new ATOM 0 HG3 ARG A 174 -6.443 -10.428 -6.709 1.00 0.01 H new ATOM 0 HD2 ARG A 174 -7.016 -12.745 -6.242 1.00 0.01 H new ATOM 0 HD3 ARG A 174 -8.641 -12.318 -5.746 1.00 0.01 H new ATOM 0 HE ARG A 174 -8.511 -11.373 -8.401 1.00 0.01 H new ATOM 0 HH11 ARG A 174 -7.871 -14.352 -6.686 1.00 0.01 H new ATOM 0 HH12 ARG A 174 -8.309 -15.380 -8.054 1.00 0.01 H new ATOM 0 HH21 ARG A 174 -9.073 -12.686 -10.150 1.00 0.01 H new ATOM 0 HH22 ARG A 174 -8.985 -14.444 -10.000 1.00 0.01 H new ATOM 2784 N ILE A 175 -4.201 -9.404 -3.794 1.00 0.01 N ATOM 2785 CA ILE A 175 -2.739 -9.589 -4.067 1.00 0.01 C ATOM 2786 C ILE A 175 -2.440 -11.086 -4.189 1.00 0.00 C ATOM 2787 O ILE A 175 -2.805 -11.868 -3.332 1.00 0.01 O ATOM 2788 CB ILE A 175 -1.886 -9.009 -2.933 1.00 1.52 C ATOM 2789 CG1 ILE A 175 -2.369 -7.599 -2.577 1.00 2.51 C ATOM 2790 CG2 ILE A 175 -0.427 -8.941 -3.393 1.00 1.75 C ATOM 2791 CD1 ILE A 175 -1.420 -6.983 -1.540 1.00 3.04 C ATOM 0 H ILE A 175 -4.471 -9.454 -2.812 1.00 0.01 H new ATOM 0 HA ILE A 175 -2.493 -9.067 -4.992 1.00 0.01 H new ATOM 0 HB ILE A 175 -1.974 -9.647 -2.054 1.00 1.52 H new ATOM 0 HG12 ILE A 175 -2.402 -6.977 -3.471 1.00 2.51 H new ATOM 0 HG13 ILE A 175 -3.383 -7.639 -2.180 1.00 2.51 H new ATOM 0 HG21 ILE A 175 0.188 -8.529 -2.593 1.00 1.75 H new ATOM 0 HG22 ILE A 175 -0.077 -9.943 -3.641 1.00 1.75 H new ATOM 0 HG23 ILE A 175 -0.352 -8.302 -4.273 1.00 1.75 H new ATOM 0 HD11 ILE A 175 -1.761 -5.980 -1.285 1.00 3.04 H new ATOM 0 HD12 ILE A 175 -1.410 -7.602 -0.643 1.00 3.04 H new ATOM 0 HD13 ILE A 175 -0.413 -6.929 -1.955 1.00 3.04 H new ATOM 2803 N VAL A 176 -1.781 -11.495 -5.245 1.00 0.01 N ATOM 2804 CA VAL A 176 -1.457 -12.945 -5.427 1.00 0.00 C ATOM 2805 C VAL A 176 -0.011 -13.088 -5.904 1.00 0.01 C ATOM 2806 O VAL A 176 0.502 -12.253 -6.625 1.00 0.00 O ATOM 2807 CB VAL A 176 -2.385 -13.550 -6.481 1.00 1.38 C ATOM 2808 CG1 VAL A 176 -2.197 -15.068 -6.516 1.00 1.88 C ATOM 2809 CG2 VAL A 176 -3.838 -13.227 -6.127 1.00 1.89 C ATOM 0 H VAL A 176 -1.452 -10.884 -5.993 1.00 0.01 H new ATOM 0 HA VAL A 176 -1.589 -13.463 -4.477 1.00 0.00 H new ATOM 0 HB VAL A 176 -2.146 -13.131 -7.458 1.00 1.38 H new ATOM 0 HG11 VAL A 176 -2.859 -15.499 -7.267 1.00 1.88 H new ATOM 0 HG12 VAL A 176 -1.162 -15.301 -6.767 1.00 1.88 H new ATOM 0 HG13 VAL A 176 -2.436 -15.487 -5.539 1.00 1.88 H new ATOM 0 HG21 VAL A 176 -4.500 -13.658 -6.878 1.00 1.89 H new ATOM 0 HG22 VAL A 176 -4.076 -13.647 -5.150 1.00 1.89 H new ATOM 0 HG23 VAL A 176 -3.974 -12.146 -6.101 1.00 1.89 H new ATOM 2819 N GLU A 177 0.650 -14.140 -5.509 1.00 0.01 N ATOM 2820 CA GLU A 177 2.062 -14.346 -5.937 1.00 0.01 C ATOM 2821 C GLU A 177 2.877 -13.090 -5.629 1.00 0.01 C ATOM 2822 CB GLU A 177 2.103 -14.625 -7.442 1.00 2.15 C ATOM 2823 CG GLU A 177 3.531 -14.979 -7.857 1.00 3.19 C ATOM 2824 CD GLU A 177 3.524 -15.536 -9.282 1.00 4.20 C ATOM 2825 OE1 GLU A 177 3.490 -14.743 -10.210 1.00 4.89 O ATOM 2826 OE2 GLU A 177 3.552 -16.747 -9.423 1.00 4.77 O ATOM 0 H GLU A 177 0.271 -14.870 -4.905 1.00 0.01 H new ATOM 0 HA GLU A 177 2.485 -15.194 -5.398 1.00 0.01 H new ATOM 0 HB2 GLU A 177 1.428 -15.444 -7.689 1.00 2.15 H new ATOM 0 HB3 GLU A 177 1.759 -13.750 -7.994 1.00 2.15 H new ATOM 0 HG2 GLU A 177 4.166 -14.095 -7.804 1.00 3.19 H new ATOM 0 HG3 GLU A 177 3.949 -15.714 -7.170 1.00 3.19 H new TER 2833 GLU A 177