USER MOD reduce.3.24.130724 H: found=0, std=0, add=1286, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1286 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 15 THR OG1 : rot -83:sc= 0.0411 USER MOD Set 1.2: A 117 THR OG1 : rot 180:sc= -0.246 USER MOD Set 2.1: A 38 HIS : no HE2:sc= 0.51 K(o=0.82,f=-0.94) USER MOD Set 2.2: A 148 GLN :FLIP amide:sc= 0.313 F(o=0.23,f=0.82) USER MOD Set 3.1: A 13 THR OG1 : rot 163:sc= 0.361 USER MOD Set 3.2: A 119 THR OG1 : rot -156:sc= 0.0929 USER MOD Set 4.1: A 9 LYS NZ :NH3+ 150:sc= 0.444 (180deg=0) USER MOD Set 4.2: A 123 THR OG1 : rot 180:sc= 0.585 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc= 0.442 (180deg=0.134) USER MOD Single : A 2 THR OG1 : rot 84:sc= 0.0196 USER MOD Single : A 5 LYS NZ :NH3+ 146:sc= 1.26 (180deg=0.937) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= 0.239 X(o=0.24,f=0) USER MOD Single : A 17 SER OG : rot 180:sc= -0.139 USER MOD Single : A 21 ASN : amide:sc= -0.0372 K(o=-0.037,f=-1.1) USER MOD Single : A 22 LYS NZ :NH3+ -162:sc= 1.23 (180deg=1.07) USER MOD Single : A 27 TYR OH : rot 180:sc=-0.00108 USER MOD Single : A 28 THR OG1 : rot 81:sc= 0.963 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0.133 X(o=0.13,f=0) USER MOD Single : A 40 GLN : amide:sc= -1.22 K(o=-1.2,f=-2.4) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0268 USER MOD Single : A 47 TYR OH : rot -148:sc= 0.153 USER MOD Single : A 50 ASN : amide:sc= -0.0279 K(o=-0.028,f=-2!) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.118 USER MOD Single : A 53 LYS NZ :NH3+ -173:sc= 0.555 (180deg=0.49) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -140:sc= 0.494 USER MOD Single : A 62 GLN :FLIP amide:sc= -0.133 F(o=-0.72,f=-0.13) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 75:sc= 1.21 USER MOD Single : A 76 GLN :FLIP amide:sc= 0 F(o=-0.67,f=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot -159:sc= 0.194 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.283 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.071) USER MOD Single : A 96 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.763) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl -114:sc= -0.118 (180deg=-0.473) USER MOD Single : A 103 MET CE :methyl 176:sc= -0.116 (180deg=-0.178) USER MOD Single : A 104 HIS : no HD1:sc=-0.00509 X(o=-0.0051,f=-0.37) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0991 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 87:sc= 0.0569 USER MOD Single : A 120 SER OG : rot 28:sc= 0.219 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.269 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= 0.131 X(o=0.13,f=0) USER MOD Single : A 132 GLN : amide:sc= -0.245 X(o=-0.25,f=-0.13) USER MOD Single : A 136 MET CE :methyl 165:sc= -0.0901 (180deg=-0.402) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 MET CE :methyl 179:sc= 0 (180deg=-0.0029) USER MOD Single : A 143 ASN : amide:sc= -0.49 K(o=-0.49,f=-1.8) USER MOD Single : A 144 SER OG : rot 74:sc= 0.432 USER MOD Single : A 145 THR OG1 : rot 73:sc= 0.285 USER MOD Single : A 147 ASN : amide:sc= -0.623 X(o=-0.62,f=-0.32) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 ASN : amide:sc= 0.713 K(o=0.71,f=0) USER MOD Single : A 155 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 156 LYS NZ :NH3+ 171:sc=-0.00947 (180deg=-0.113) USER MOD Single : A 159 HIS : no HD1:sc= -0.0111 X(o=-0.011,f=0) USER MOD Single : A 160 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 161 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 162 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 163 HIS : no HD1:sc= -0.0212 X(o=-0.021,f=-0.15) USER MOD Single : A 164 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.367 -19.547 -0.909 1.00 32.14 N ATOM 2 CA MET A 1 2.121 -19.861 -2.356 1.00 13.32 C ATOM 3 C MET A 1 1.595 -18.628 -3.156 1.00 11.14 C ATOM 4 O MET A 1 1.319 -18.734 -4.355 1.00 2.43 O ATOM 5 CB MET A 1 1.119 -21.043 -2.473 1.00 52.14 C ATOM 6 CG MET A 1 1.542 -22.308 -1.713 1.00 32.21 C ATOM 7 SD MET A 1 3.148 -22.936 -2.248 1.00 34.41 S ATOM 8 CE MET A 1 3.336 -24.386 -1.204 1.00 21.23 C ATOM 0 H1 MET A 1 2.915 -20.317 -0.475 1.00 32.14 H new ATOM 0 H2 MET A 1 2.900 -18.657 -0.833 1.00 32.14 H new ATOM 0 H3 MET A 1 1.457 -19.449 -0.415 1.00 32.14 H new ATOM 0 HA MET A 1 3.078 -20.140 -2.796 1.00 13.32 H new ATOM 0 HB2 MET A 1 0.147 -20.718 -2.101 1.00 52.14 H new ATOM 0 HB3 MET A 1 0.991 -21.292 -3.526 1.00 52.14 H new ATOM 0 HG2 MET A 1 1.578 -22.091 -0.645 1.00 32.21 H new ATOM 0 HG3 MET A 1 0.788 -23.082 -1.855 1.00 32.21 H new ATOM 0 HE1 MET A 1 4.285 -24.874 -1.426 1.00 21.23 H new ATOM 0 HE2 MET A 1 3.319 -24.085 -0.157 1.00 21.23 H new ATOM 0 HE3 MET A 1 2.518 -25.080 -1.395 1.00 21.23 H new ATOM 20 N THR A 2 1.460 -17.469 -2.483 1.00 43.15 N ATOM 21 CA THR A 2 0.917 -16.214 -3.080 1.00 4.02 C ATOM 22 C THR A 2 2.047 -15.173 -3.324 1.00 54.34 C ATOM 23 O THR A 2 1.960 -14.348 -4.240 1.00 71.52 O ATOM 24 CB THR A 2 -0.186 -15.602 -2.141 1.00 1.03 C ATOM 25 OG1 THR A 2 -1.145 -16.624 -1.797 1.00 41.04 O ATOM 26 CG2 THR A 2 -0.929 -14.415 -2.775 1.00 12.30 C ATOM 0 H THR A 2 1.724 -17.367 -1.503 1.00 43.15 H new ATOM 0 HA THR A 2 0.471 -16.463 -4.043 1.00 4.02 H new ATOM 0 HB THR A 2 0.327 -15.228 -1.255 1.00 1.03 H new ATOM 0 HG1 THR A 2 -0.813 -17.140 -1.033 1.00 41.04 H new ATOM 0 HG21 THR A 2 -1.676 -14.039 -2.077 1.00 12.30 H new ATOM 0 HG22 THR A 2 -0.218 -13.623 -3.007 1.00 12.30 H new ATOM 0 HG23 THR A 2 -1.421 -14.741 -3.691 1.00 12.30 H new ATOM 34 N ILE A 3 3.105 -15.215 -2.484 1.00 22.33 N ATOM 35 CA ILE A 3 4.307 -14.350 -2.655 1.00 75.03 C ATOM 36 C ILE A 3 5.263 -14.899 -3.746 1.00 55.54 C ATOM 37 O ILE A 3 5.101 -16.030 -4.225 1.00 15.34 O ATOM 38 CB ILE A 3 5.112 -14.180 -1.304 1.00 2.12 C ATOM 39 CG1 ILE A 3 5.575 -15.571 -0.747 1.00 13.10 C ATOM 40 CG2 ILE A 3 4.279 -13.400 -0.265 1.00 55.41 C ATOM 41 CD1 ILE A 3 6.398 -15.519 0.533 1.00 21.43 C ATOM 0 H ILE A 3 3.156 -15.838 -1.678 1.00 22.33 H new ATOM 0 HA ILE A 3 3.931 -13.376 -2.968 1.00 75.03 H new ATOM 0 HB ILE A 3 6.010 -13.597 -1.512 1.00 2.12 H new ATOM 0 HG12 ILE A 3 4.692 -16.184 -0.567 1.00 13.10 H new ATOM 0 HG13 ILE A 3 6.161 -16.075 -1.516 1.00 13.10 H new ATOM 0 HG21 ILE A 3 4.852 -13.295 0.656 1.00 55.41 H new ATOM 0 HG22 ILE A 3 4.040 -12.412 -0.658 1.00 55.41 H new ATOM 0 HG23 ILE A 3 3.356 -13.941 -0.058 1.00 55.41 H new ATOM 0 HD11 ILE A 3 6.667 -16.531 0.834 1.00 21.43 H new ATOM 0 HD12 ILE A 3 7.304 -14.939 0.360 1.00 21.43 H new ATOM 0 HD13 ILE A 3 5.812 -15.049 1.323 1.00 21.43 H new ATOM 53 N GLU A 4 6.269 -14.088 -4.112 1.00 40.32 N ATOM 54 CA GLU A 4 7.322 -14.470 -5.074 1.00 1.33 C ATOM 55 C GLU A 4 8.630 -13.761 -4.670 1.00 72.40 C ATOM 56 O GLU A 4 8.800 -12.554 -4.888 1.00 54.03 O ATOM 57 CB GLU A 4 6.882 -14.109 -6.521 1.00 2.22 C ATOM 58 CG GLU A 4 7.843 -14.576 -7.634 1.00 60.31 C ATOM 59 CD GLU A 4 7.348 -14.204 -9.048 1.00 62.20 C ATOM 60 OE1 GLU A 4 6.531 -14.961 -9.631 1.00 42.34 O ATOM 61 OE2 GLU A 4 7.785 -13.164 -9.585 1.00 73.51 O ATOM 0 H GLU A 4 6.377 -13.142 -3.747 1.00 40.32 H new ATOM 0 HA GLU A 4 7.489 -15.547 -5.055 1.00 1.33 H new ATOM 0 HB2 GLU A 4 5.900 -14.544 -6.705 1.00 2.22 H new ATOM 0 HB3 GLU A 4 6.769 -13.027 -6.590 1.00 2.22 H new ATOM 0 HG2 GLU A 4 8.825 -14.132 -7.470 1.00 60.31 H new ATOM 0 HG3 GLU A 4 7.967 -15.657 -7.570 1.00 60.31 H new ATOM 68 N LYS A 5 9.544 -14.514 -4.038 1.00 60.33 N ATOM 69 CA LYS A 5 10.697 -13.937 -3.322 1.00 31.33 C ATOM 70 C LYS A 5 11.991 -13.909 -4.172 1.00 41.02 C ATOM 71 O LYS A 5 12.381 -14.908 -4.773 1.00 13.45 O ATOM 72 CB LYS A 5 10.930 -14.725 -1.999 1.00 62.22 C ATOM 73 CG LYS A 5 11.935 -14.068 -1.025 1.00 0.25 C ATOM 74 CD LYS A 5 11.519 -12.626 -0.658 1.00 55.45 C ATOM 75 CE LYS A 5 12.417 -11.998 0.429 1.00 12.12 C ATOM 76 NZ LYS A 5 13.862 -11.928 0.057 1.00 72.43 N ATOM 0 H LYS A 5 9.507 -15.533 -4.008 1.00 60.33 H new ATOM 0 HA LYS A 5 10.456 -12.897 -3.103 1.00 31.33 H new ATOM 0 HB2 LYS A 5 9.974 -14.843 -1.489 1.00 62.22 H new ATOM 0 HB3 LYS A 5 11.285 -15.726 -2.246 1.00 62.22 H new ATOM 0 HG2 LYS A 5 12.007 -14.668 -0.118 1.00 0.25 H new ATOM 0 HG3 LYS A 5 12.926 -14.056 -1.479 1.00 0.25 H new ATOM 0 HD2 LYS A 5 11.553 -12.005 -1.553 1.00 55.45 H new ATOM 0 HD3 LYS A 5 10.486 -12.629 -0.311 1.00 55.45 H new ATOM 0 HE2 LYS A 5 12.059 -10.991 0.645 1.00 12.12 H new ATOM 0 HE3 LYS A 5 12.316 -12.576 1.348 1.00 12.12 H new ATOM 0 HZ1 LYS A 5 14.285 -11.071 0.467 1.00 72.43 H new ATOM 0 HZ2 LYS A 5 14.356 -12.767 0.423 1.00 72.43 H new ATOM 0 HZ3 LYS A 5 13.953 -11.897 -0.979 1.00 72.43 H new ATOM 90 N LYS A 6 12.639 -12.731 -4.199 1.00 13.23 N ATOM 91 CA LYS A 6 14.008 -12.535 -4.737 1.00 33.41 C ATOM 92 C LYS A 6 14.884 -11.822 -3.672 1.00 71.31 C ATOM 93 O LYS A 6 14.359 -11.442 -2.621 1.00 73.13 O ATOM 94 CB LYS A 6 13.950 -11.750 -6.082 1.00 74.33 C ATOM 95 CG LYS A 6 13.325 -12.569 -7.242 1.00 23.22 C ATOM 96 CD LYS A 6 13.397 -11.870 -8.617 1.00 61.22 C ATOM 97 CE LYS A 6 12.492 -10.632 -8.720 1.00 41.14 C ATOM 98 NZ LYS A 6 12.486 -10.064 -10.092 1.00 2.13 N ATOM 0 H LYS A 6 12.224 -11.870 -3.843 1.00 13.23 H new ATOM 0 HA LYS A 6 14.467 -13.500 -4.952 1.00 33.41 H new ATOM 0 HB2 LYS A 6 13.372 -10.837 -5.938 1.00 74.33 H new ATOM 0 HB3 LYS A 6 14.959 -11.447 -6.362 1.00 74.33 H new ATOM 0 HG2 LYS A 6 13.833 -13.531 -7.308 1.00 23.22 H new ATOM 0 HG3 LYS A 6 12.281 -12.776 -7.006 1.00 23.22 H new ATOM 0 HD2 LYS A 6 14.428 -11.575 -8.813 1.00 61.22 H new ATOM 0 HD3 LYS A 6 13.116 -12.582 -9.393 1.00 61.22 H new ATOM 0 HE2 LYS A 6 11.475 -10.901 -8.434 1.00 41.14 H new ATOM 0 HE3 LYS A 6 12.832 -9.874 -8.015 1.00 41.14 H new ATOM 0 HZ1 LYS A 6 11.864 -9.231 -10.120 1.00 2.13 H new ATOM 0 HZ2 LYS A 6 13.452 -9.784 -10.356 1.00 2.13 H new ATOM 0 HZ3 LYS A 6 12.137 -10.779 -10.762 1.00 2.13 H new ATOM 112 N LYS A 7 16.193 -11.636 -3.979 1.00 14.35 N ATOM 113 CA LYS A 7 17.267 -11.194 -3.012 1.00 33.00 C ATOM 114 C LYS A 7 16.786 -10.255 -1.860 1.00 24.52 C ATOM 115 O LYS A 7 16.791 -10.645 -0.687 1.00 11.22 O ATOM 116 CB LYS A 7 18.437 -10.520 -3.791 1.00 13.43 C ATOM 117 CG LYS A 7 19.192 -11.464 -4.750 1.00 24.10 C ATOM 118 CD LYS A 7 20.311 -10.760 -5.561 1.00 22.21 C ATOM 119 CE LYS A 7 21.442 -10.182 -4.683 1.00 50.21 C ATOM 120 NZ LYS A 7 22.504 -9.541 -5.504 1.00 42.42 N ATOM 0 H LYS A 7 16.553 -11.788 -4.921 1.00 14.35 H new ATOM 0 HA LYS A 7 17.597 -12.107 -2.517 1.00 33.00 H new ATOM 0 HB2 LYS A 7 18.041 -9.681 -4.364 1.00 13.43 H new ATOM 0 HB3 LYS A 7 19.146 -10.109 -3.073 1.00 13.43 H new ATOM 0 HG2 LYS A 7 19.630 -12.279 -4.174 1.00 24.10 H new ATOM 0 HG3 LYS A 7 18.479 -11.911 -5.443 1.00 24.10 H new ATOM 0 HD2 LYS A 7 20.739 -11.472 -6.267 1.00 22.21 H new ATOM 0 HD3 LYS A 7 19.870 -9.954 -6.148 1.00 22.21 H new ATOM 0 HE2 LYS A 7 21.027 -9.450 -3.990 1.00 50.21 H new ATOM 0 HE3 LYS A 7 21.879 -10.979 -4.081 1.00 50.21 H new ATOM 0 HZ1 LYS A 7 23.246 -9.165 -4.880 1.00 42.42 H new ATOM 0 HZ2 LYS A 7 22.918 -10.245 -6.148 1.00 42.42 H new ATOM 0 HZ3 LYS A 7 22.092 -8.764 -6.059 1.00 42.42 H new ATOM 134 N ASN A 8 16.350 -9.035 -2.212 1.00 33.12 N ATOM 135 CA ASN A 8 15.830 -8.038 -1.239 1.00 55.01 C ATOM 136 C ASN A 8 14.477 -7.473 -1.718 1.00 34.14 C ATOM 137 O ASN A 8 14.176 -6.293 -1.542 1.00 23.25 O ATOM 138 CB ASN A 8 16.882 -6.913 -1.033 1.00 14.43 C ATOM 139 CG ASN A 8 17.323 -6.230 -2.335 1.00 14.40 C ATOM 140 OD1 ASN A 8 18.240 -6.686 -3.009 1.00 74.20 O ATOM 141 ND2 ASN A 8 16.677 -5.137 -2.694 1.00 51.15 N ATOM 0 H ASN A 8 16.345 -8.704 -3.177 1.00 33.12 H new ATOM 0 HA ASN A 8 15.657 -8.523 -0.278 1.00 55.01 H new ATOM 0 HB2 ASN A 8 16.469 -6.161 -0.361 1.00 14.43 H new ATOM 0 HB3 ASN A 8 17.758 -7.334 -0.540 1.00 14.43 H new ATOM 0 HD21 ASN A 8 16.937 -4.649 -3.551 1.00 51.15 H new ATOM 0 HD22 ASN A 8 15.918 -4.780 -2.114 1.00 51.15 H new ATOM 148 N LYS A 9 13.636 -8.358 -2.267 1.00 52.24 N ATOM 149 CA LYS A 9 12.366 -7.965 -2.910 1.00 0.34 C ATOM 150 C LYS A 9 11.267 -9.022 -2.678 1.00 50.44 C ATOM 151 O LYS A 9 11.508 -10.217 -2.845 1.00 5.44 O ATOM 152 CB LYS A 9 12.609 -7.797 -4.427 1.00 34.41 C ATOM 153 CG LYS A 9 11.400 -7.278 -5.240 1.00 31.24 C ATOM 154 CD LYS A 9 11.557 -7.540 -6.756 1.00 25.22 C ATOM 155 CE LYS A 9 12.892 -7.034 -7.330 1.00 23.54 C ATOM 156 NZ LYS A 9 13.061 -5.570 -7.180 1.00 21.11 N ATOM 0 H LYS A 9 13.811 -9.363 -2.281 1.00 52.24 H new ATOM 0 HA LYS A 9 12.027 -7.027 -2.470 1.00 0.34 H new ATOM 0 HB2 LYS A 9 13.443 -7.110 -4.570 1.00 34.41 H new ATOM 0 HB3 LYS A 9 12.915 -8.759 -4.837 1.00 34.41 H new ATOM 0 HG2 LYS A 9 10.490 -7.760 -4.882 1.00 31.24 H new ATOM 0 HG3 LYS A 9 11.282 -6.208 -5.069 1.00 31.24 H new ATOM 0 HD2 LYS A 9 11.473 -8.611 -6.943 1.00 25.22 H new ATOM 0 HD3 LYS A 9 10.736 -7.058 -7.287 1.00 25.22 H new ATOM 0 HE2 LYS A 9 13.715 -7.544 -6.829 1.00 23.54 H new ATOM 0 HE3 LYS A 9 12.951 -7.296 -8.386 1.00 23.54 H new ATOM 0 HZ1 LYS A 9 14.072 -5.345 -7.088 1.00 21.11 H new ATOM 0 HZ2 LYS A 9 12.673 -5.088 -8.016 1.00 21.11 H new ATOM 0 HZ3 LYS A 9 12.556 -5.248 -6.330 1.00 21.11 H new ATOM 170 N ILE A 10 10.058 -8.563 -2.315 1.00 45.33 N ATOM 171 CA ILE A 10 8.861 -9.416 -2.195 1.00 72.31 C ATOM 172 C ILE A 10 7.809 -8.973 -3.237 1.00 14.20 C ATOM 173 O ILE A 10 7.247 -7.876 -3.150 1.00 23.54 O ATOM 174 CB ILE A 10 8.238 -9.352 -0.750 1.00 42.24 C ATOM 175 CG1 ILE A 10 9.303 -9.752 0.321 1.00 51.35 C ATOM 176 CG2 ILE A 10 6.973 -10.253 -0.640 1.00 70.20 C ATOM 177 CD1 ILE A 10 8.835 -9.656 1.759 1.00 75.52 C ATOM 0 H ILE A 10 9.881 -7.583 -2.095 1.00 45.33 H new ATOM 0 HA ILE A 10 9.162 -10.447 -2.379 1.00 72.31 H new ATOM 0 HB ILE A 10 7.927 -8.325 -0.561 1.00 42.24 H new ATOM 0 HG12 ILE A 10 9.624 -10.775 0.127 1.00 51.35 H new ATOM 0 HG13 ILE A 10 10.178 -9.114 0.197 1.00 51.35 H new ATOM 0 HG21 ILE A 10 6.566 -10.187 0.369 1.00 70.20 H new ATOM 0 HG22 ILE A 10 6.223 -9.917 -1.356 1.00 70.20 H new ATOM 0 HG23 ILE A 10 7.243 -11.287 -0.856 1.00 70.20 H new ATOM 0 HD11 ILE A 10 9.644 -9.954 2.426 1.00 75.52 H new ATOM 0 HD12 ILE A 10 8.543 -8.629 1.979 1.00 75.52 H new ATOM 0 HD13 ILE A 10 7.980 -10.316 1.908 1.00 75.52 H new ATOM 189 N ILE A 11 7.594 -9.829 -4.238 1.00 4.22 N ATOM 190 CA ILE A 11 6.556 -9.644 -5.261 1.00 34.23 C ATOM 191 C ILE A 11 5.230 -10.295 -4.776 1.00 2.44 C ATOM 192 O ILE A 11 5.127 -11.525 -4.695 1.00 0.11 O ATOM 193 CB ILE A 11 7.063 -10.257 -6.628 1.00 33.02 C ATOM 194 CG1 ILE A 11 8.266 -9.419 -7.183 1.00 71.14 C ATOM 195 CG2 ILE A 11 5.943 -10.385 -7.678 1.00 41.14 C ATOM 196 CD1 ILE A 11 8.831 -9.896 -8.517 1.00 21.25 C ATOM 0 H ILE A 11 8.141 -10.681 -4.365 1.00 4.22 H new ATOM 0 HA ILE A 11 6.358 -8.585 -5.425 1.00 34.23 H new ATOM 0 HB ILE A 11 7.402 -11.272 -6.421 1.00 33.02 H new ATOM 0 HG12 ILE A 11 7.946 -8.383 -7.292 1.00 71.14 H new ATOM 0 HG13 ILE A 11 9.067 -9.429 -6.443 1.00 71.14 H new ATOM 0 HG21 ILE A 11 6.351 -10.811 -8.595 1.00 41.14 H new ATOM 0 HG22 ILE A 11 5.157 -11.035 -7.294 1.00 41.14 H new ATOM 0 HG23 ILE A 11 5.528 -9.399 -7.889 1.00 41.14 H new ATOM 0 HD11 ILE A 11 9.658 -9.251 -8.813 1.00 21.25 H new ATOM 0 HD12 ILE A 11 9.189 -10.921 -8.415 1.00 21.25 H new ATOM 0 HD13 ILE A 11 8.051 -9.858 -9.277 1.00 21.25 H new ATOM 208 N PHE A 12 4.235 -9.460 -4.400 1.00 75.43 N ATOM 209 CA PHE A 12 2.931 -9.940 -3.884 1.00 74.14 C ATOM 210 C PHE A 12 1.807 -9.741 -4.921 1.00 4.01 C ATOM 211 O PHE A 12 1.351 -8.621 -5.143 1.00 74.04 O ATOM 212 CB PHE A 12 2.546 -9.211 -2.565 1.00 22.42 C ATOM 213 CG PHE A 12 1.414 -9.920 -1.813 1.00 12.42 C ATOM 214 CD1 PHE A 12 1.672 -11.064 -1.064 1.00 43.41 C ATOM 215 CD2 PHE A 12 0.097 -9.471 -1.887 1.00 71.40 C ATOM 216 CE1 PHE A 12 0.656 -11.733 -0.410 1.00 10.51 C ATOM 217 CE2 PHE A 12 -0.918 -10.143 -1.242 1.00 43.32 C ATOM 218 CZ PHE A 12 -0.640 -11.273 -0.502 1.00 64.52 C ATOM 0 H PHE A 12 4.311 -8.444 -4.445 1.00 75.43 H new ATOM 0 HA PHE A 12 3.043 -11.006 -3.684 1.00 74.14 H new ATOM 0 HB2 PHE A 12 3.422 -9.147 -1.920 1.00 22.42 H new ATOM 0 HB3 PHE A 12 2.242 -8.189 -2.793 1.00 22.42 H new ATOM 0 HD1 PHE A 12 2.684 -11.435 -0.993 1.00 43.41 H new ATOM 0 HD2 PHE A 12 -0.131 -8.583 -2.458 1.00 71.40 H new ATOM 0 HE1 PHE A 12 0.877 -12.615 0.173 1.00 10.51 H new ATOM 0 HE2 PHE A 12 -1.934 -9.784 -1.316 1.00 43.32 H new ATOM 0 HZ PHE A 12 -1.437 -11.797 0.005 1.00 64.52 H new ATOM 228 N THR A 13 1.319 -10.835 -5.491 1.00 35.25 N ATOM 229 CA THR A 13 0.211 -10.816 -6.477 1.00 14.42 C ATOM 230 C THR A 13 -1.116 -11.206 -5.792 1.00 13.32 C ATOM 231 O THR A 13 -1.143 -12.126 -4.974 1.00 64.23 O ATOM 232 CB THR A 13 0.507 -11.787 -7.672 1.00 2.42 C ATOM 233 OG1 THR A 13 -0.640 -11.878 -8.535 1.00 64.12 O ATOM 234 CG2 THR A 13 0.921 -13.197 -7.198 1.00 41.23 C ATOM 0 H THR A 13 1.672 -11.771 -5.292 1.00 35.25 H new ATOM 0 HA THR A 13 0.124 -9.804 -6.873 1.00 14.42 H new ATOM 0 HB THR A 13 1.349 -11.368 -8.222 1.00 2.42 H new ATOM 0 HG1 THR A 13 -0.370 -12.254 -9.399 1.00 64.12 H new ATOM 0 HG21 THR A 13 1.115 -13.830 -8.064 1.00 41.23 H new ATOM 0 HG22 THR A 13 1.824 -13.126 -6.591 1.00 41.23 H new ATOM 0 HG23 THR A 13 0.117 -13.632 -6.604 1.00 41.23 H new ATOM 242 N ARG A 14 -2.216 -10.487 -6.104 1.00 1.23 N ATOM 243 CA ARG A 14 -3.544 -10.785 -5.509 1.00 22.12 C ATOM 244 C ARG A 14 -4.702 -10.312 -6.422 1.00 52.31 C ATOM 245 O ARG A 14 -4.512 -9.449 -7.286 1.00 35.34 O ATOM 246 CB ARG A 14 -3.665 -10.176 -4.064 1.00 53.35 C ATOM 247 CG ARG A 14 -4.206 -8.722 -3.945 1.00 45.30 C ATOM 248 CD ARG A 14 -3.341 -7.646 -4.632 1.00 43.14 C ATOM 249 NE ARG A 14 -1.955 -7.599 -4.120 1.00 75.21 N ATOM 250 CZ ARG A 14 -1.281 -6.501 -3.832 1.00 0.51 C ATOM 251 NH1 ARG A 14 -1.835 -5.324 -3.888 1.00 44.24 N ATOM 252 NH2 ARG A 14 -0.041 -6.593 -3.487 1.00 25.52 N ATOM 0 H ARG A 14 -2.215 -9.703 -6.757 1.00 1.23 H new ATOM 0 HA ARG A 14 -3.628 -11.868 -5.422 1.00 22.12 H new ATOM 0 HB2 ARG A 14 -4.314 -10.826 -3.477 1.00 53.35 H new ATOM 0 HB3 ARG A 14 -2.679 -10.208 -3.601 1.00 53.35 H new ATOM 0 HG2 ARG A 14 -5.209 -8.687 -4.371 1.00 45.30 H new ATOM 0 HG3 ARG A 14 -4.300 -8.471 -2.889 1.00 45.30 H new ATOM 0 HD2 ARG A 14 -3.319 -7.837 -5.705 1.00 43.14 H new ATOM 0 HD3 ARG A 14 -3.807 -6.671 -4.492 1.00 43.14 H new ATOM 0 HE ARG A 14 -1.479 -8.490 -3.977 1.00 75.21 H new ATOM 0 HH11 ARG A 14 -2.814 -5.234 -4.160 1.00 44.24 H new ATOM 0 HH12 ARG A 14 -1.290 -4.492 -3.660 1.00 44.24 H new ATOM 0 HH21 ARG A 14 0.409 -7.507 -3.439 1.00 25.52 H new ATOM 0 HH22 ARG A 14 0.490 -5.751 -3.262 1.00 25.52 H new ATOM 266 N THR A 15 -5.907 -10.867 -6.191 1.00 43.44 N ATOM 267 CA THR A 15 -7.115 -10.567 -7.003 1.00 42.23 C ATOM 268 C THR A 15 -8.288 -10.148 -6.087 1.00 5.23 C ATOM 269 O THR A 15 -8.487 -10.745 -5.023 1.00 72.14 O ATOM 270 CB THR A 15 -7.540 -11.814 -7.862 1.00 62.03 C ATOM 271 OG1 THR A 15 -6.378 -12.383 -8.493 1.00 70.41 O ATOM 272 CG2 THR A 15 -8.550 -11.453 -8.955 1.00 61.22 C ATOM 0 H THR A 15 -6.077 -11.535 -5.439 1.00 43.44 H new ATOM 0 HA THR A 15 -6.870 -9.745 -7.676 1.00 42.23 H new ATOM 0 HB THR A 15 -8.009 -12.525 -7.182 1.00 62.03 H new ATOM 0 HG1 THR A 15 -6.183 -11.895 -9.320 1.00 70.41 H new ATOM 0 HG21 THR A 15 -8.811 -12.348 -9.519 1.00 61.22 H new ATOM 0 HG22 THR A 15 -9.448 -11.038 -8.498 1.00 61.22 H new ATOM 0 HG23 THR A 15 -8.111 -10.716 -9.627 1.00 61.22 H new ATOM 280 N PHE A 16 -9.049 -9.119 -6.498 1.00 0.04 N ATOM 281 CA PHE A 16 -10.247 -8.635 -5.763 1.00 44.23 C ATOM 282 C PHE A 16 -11.506 -8.766 -6.642 1.00 31.14 C ATOM 283 O PHE A 16 -11.478 -8.389 -7.824 1.00 70.45 O ATOM 284 CB PHE A 16 -10.076 -7.146 -5.337 1.00 72.22 C ATOM 285 CG PHE A 16 -8.934 -6.898 -4.355 1.00 70.14 C ATOM 286 CD1 PHE A 16 -9.027 -7.340 -3.033 1.00 1.23 C ATOM 287 CD2 PHE A 16 -7.769 -6.234 -4.749 1.00 61.30 C ATOM 288 CE1 PHE A 16 -7.998 -7.123 -2.140 1.00 75.11 C ATOM 289 CE2 PHE A 16 -6.742 -6.017 -3.851 1.00 10.13 C ATOM 290 CZ PHE A 16 -6.857 -6.464 -2.549 1.00 4.13 C ATOM 0 H PHE A 16 -8.856 -8.593 -7.351 1.00 0.04 H new ATOM 0 HA PHE A 16 -10.358 -9.250 -4.870 1.00 44.23 H new ATOM 0 HB2 PHE A 16 -9.909 -6.542 -6.229 1.00 72.22 H new ATOM 0 HB3 PHE A 16 -11.007 -6.800 -4.888 1.00 72.22 H new ATOM 0 HD1 PHE A 16 -9.916 -7.858 -2.706 1.00 1.23 H new ATOM 0 HD2 PHE A 16 -7.671 -5.887 -5.767 1.00 61.30 H new ATOM 0 HE1 PHE A 16 -8.086 -7.469 -1.121 1.00 75.11 H new ATOM 0 HE2 PHE A 16 -5.849 -5.498 -4.167 1.00 10.13 H new ATOM 0 HZ PHE A 16 -6.051 -6.297 -1.849 1.00 4.13 H new ATOM 300 N SER A 17 -12.605 -9.293 -6.062 1.00 60.21 N ATOM 301 CA SER A 17 -13.927 -9.277 -6.723 1.00 5.33 C ATOM 302 C SER A 17 -14.531 -7.858 -6.575 1.00 43.43 C ATOM 303 O SER A 17 -15.206 -7.557 -5.575 1.00 10.02 O ATOM 304 CB SER A 17 -14.861 -10.344 -6.091 1.00 14.31 C ATOM 305 OG SER A 17 -14.271 -11.638 -6.113 1.00 22.20 O ATOM 0 H SER A 17 -12.603 -9.733 -5.142 1.00 60.21 H new ATOM 0 HA SER A 17 -13.819 -9.519 -7.780 1.00 5.33 H new ATOM 0 HB2 SER A 17 -15.089 -10.065 -5.062 1.00 14.31 H new ATOM 0 HB3 SER A 17 -15.807 -10.366 -6.632 1.00 14.31 H new ATOM 0 HG SER A 17 -14.885 -12.284 -5.706 1.00 22.20 H new ATOM 311 N ALA A 18 -14.262 -7.008 -7.589 1.00 31.20 N ATOM 312 CA ALA A 18 -14.601 -5.562 -7.600 1.00 23.13 C ATOM 313 C ALA A 18 -14.035 -4.903 -8.888 1.00 73.22 C ATOM 314 O ALA A 18 -12.966 -5.316 -9.373 1.00 23.32 O ATOM 315 CB ALA A 18 -14.029 -4.824 -6.354 1.00 43.01 C ATOM 0 H ALA A 18 -13.793 -7.311 -8.443 1.00 31.20 H new ATOM 0 HA ALA A 18 -15.687 -5.477 -7.576 1.00 23.13 H new ATOM 0 HB1 ALA A 18 -14.299 -3.769 -6.400 1.00 43.01 H new ATOM 0 HB2 ALA A 18 -14.444 -5.265 -5.448 1.00 43.01 H new ATOM 0 HB3 ALA A 18 -12.943 -4.920 -6.341 1.00 43.01 H new ATOM 321 N PRO A 19 -14.730 -3.870 -9.470 1.00 12.35 N ATOM 322 CA PRO A 19 -14.175 -3.080 -10.603 1.00 13.52 C ATOM 323 C PRO A 19 -12.930 -2.240 -10.194 1.00 42.24 C ATOM 324 O PRO A 19 -12.787 -1.831 -9.030 1.00 55.54 O ATOM 325 CB PRO A 19 -15.361 -2.170 -11.030 1.00 60.24 C ATOM 326 CG PRO A 19 -16.227 -2.075 -9.808 1.00 50.10 C ATOM 327 CD PRO A 19 -16.109 -3.417 -9.113 1.00 11.12 C ATOM 0 HA PRO A 19 -13.814 -3.719 -11.409 1.00 13.52 H new ATOM 0 HB2 PRO A 19 -15.012 -1.187 -11.346 1.00 60.24 H new ATOM 0 HB3 PRO A 19 -15.907 -2.599 -11.870 1.00 60.24 H new ATOM 0 HG2 PRO A 19 -15.896 -1.267 -9.156 1.00 50.10 H new ATOM 0 HG3 PRO A 19 -17.262 -1.864 -10.078 1.00 50.10 H new ATOM 0 HD2 PRO A 19 -16.235 -3.324 -8.034 1.00 11.12 H new ATOM 0 HD3 PRO A 19 -16.866 -4.119 -9.463 1.00 11.12 H new ATOM 335 N ILE A 20 -12.054 -1.989 -11.183 1.00 32.42 N ATOM 336 CA ILE A 20 -10.795 -1.211 -11.023 1.00 24.12 C ATOM 337 C ILE A 20 -11.025 0.225 -10.443 1.00 14.02 C ATOM 338 O ILE A 20 -10.151 0.787 -9.778 1.00 70.21 O ATOM 339 CB ILE A 20 -10.036 -1.140 -12.411 1.00 73.31 C ATOM 340 CG1 ILE A 20 -8.688 -0.355 -12.314 1.00 72.12 C ATOM 341 CG2 ILE A 20 -10.945 -0.537 -13.513 1.00 14.53 C ATOM 342 CD1 ILE A 20 -7.718 -0.866 -11.265 1.00 23.43 C ATOM 0 H ILE A 20 -12.196 -2.324 -12.136 1.00 32.42 H new ATOM 0 HA ILE A 20 -10.182 -1.736 -10.290 1.00 24.12 H new ATOM 0 HB ILE A 20 -9.790 -2.165 -12.687 1.00 73.31 H new ATOM 0 HG12 ILE A 20 -8.197 -0.387 -13.286 1.00 72.12 H new ATOM 0 HG13 ILE A 20 -8.909 0.691 -12.102 1.00 72.12 H new ATOM 0 HG21 ILE A 20 -10.399 -0.500 -14.455 1.00 14.53 H new ATOM 0 HG22 ILE A 20 -11.833 -1.158 -13.632 1.00 14.53 H new ATOM 0 HG23 ILE A 20 -11.244 0.472 -13.227 1.00 14.53 H new ATOM 0 HD11 ILE A 20 -6.815 -0.256 -11.277 1.00 23.43 H new ATOM 0 HD12 ILE A 20 -8.183 -0.808 -10.281 1.00 23.43 H new ATOM 0 HD13 ILE A 20 -7.459 -1.902 -11.483 1.00 23.43 H new ATOM 354 N ASN A 21 -12.226 0.774 -10.668 1.00 33.43 N ATOM 355 CA ASN A 21 -12.618 2.135 -10.201 1.00 52.54 C ATOM 356 C ASN A 21 -12.559 2.244 -8.659 1.00 72.44 C ATOM 357 O ASN A 21 -12.258 3.299 -8.105 1.00 72.43 O ATOM 358 CB ASN A 21 -14.042 2.475 -10.703 1.00 33.02 C ATOM 359 CG ASN A 21 -14.183 2.312 -12.212 1.00 53.13 C ATOM 360 OD1 ASN A 21 -14.522 1.241 -12.700 1.00 73.32 O ATOM 361 ND2 ASN A 21 -13.884 3.352 -12.969 1.00 2.33 N ATOM 0 H ASN A 21 -12.966 0.294 -11.181 1.00 33.43 H new ATOM 0 HA ASN A 21 -11.907 2.850 -10.614 1.00 52.54 H new ATOM 0 HB2 ASN A 21 -14.764 1.830 -10.202 1.00 33.02 H new ATOM 0 HB3 ASN A 21 -14.286 3.501 -10.427 1.00 33.02 H new ATOM 0 HD21 ASN A 21 -13.933 3.274 -13.985 1.00 2.33 H new ATOM 0 HD22 ASN A 21 -13.604 4.233 -12.538 1.00 2.33 H new ATOM 368 N LYS A 22 -12.885 1.134 -7.991 1.00 44.12 N ATOM 369 CA LYS A 22 -12.821 1.017 -6.520 1.00 32.53 C ATOM 370 C LYS A 22 -11.378 0.699 -6.052 1.00 55.34 C ATOM 371 O LYS A 22 -10.841 1.323 -5.127 1.00 53.24 O ATOM 372 CB LYS A 22 -13.800 -0.096 -6.040 1.00 74.14 C ATOM 373 CG LYS A 22 -15.150 -0.137 -6.800 1.00 34.31 C ATOM 374 CD LYS A 22 -16.265 -0.874 -6.026 1.00 40.14 C ATOM 375 CE LYS A 22 -16.607 -0.168 -4.700 1.00 71.02 C ATOM 376 NZ LYS A 22 -17.773 -0.776 -4.024 1.00 51.34 N ATOM 0 H LYS A 22 -13.204 0.282 -8.453 1.00 44.12 H new ATOM 0 HA LYS A 22 -13.115 1.971 -6.082 1.00 32.53 H new ATOM 0 HB2 LYS A 22 -13.309 -1.064 -6.145 1.00 74.14 H new ATOM 0 HB3 LYS A 22 -14.000 0.047 -4.978 1.00 74.14 H new ATOM 0 HG2 LYS A 22 -15.474 0.883 -7.006 1.00 34.31 H new ATOM 0 HG3 LYS A 22 -15.002 -0.625 -7.763 1.00 34.31 H new ATOM 0 HD2 LYS A 22 -17.159 -0.934 -6.647 1.00 40.14 H new ATOM 0 HD3 LYS A 22 -15.950 -1.897 -5.822 1.00 40.14 H new ATOM 0 HE2 LYS A 22 -15.743 -0.209 -4.036 1.00 71.02 H new ATOM 0 HE3 LYS A 22 -16.811 0.885 -4.894 1.00 71.02 H new ATOM 0 HZ1 LYS A 22 -18.153 -0.110 -3.321 1.00 51.34 H new ATOM 0 HZ2 LYS A 22 -18.508 -0.994 -4.727 1.00 51.34 H new ATOM 0 HZ3 LYS A 22 -17.480 -1.653 -3.547 1.00 51.34 H new ATOM 390 N VAL A 23 -10.783 -0.289 -6.739 1.00 34.21 N ATOM 391 CA VAL A 23 -9.491 -0.907 -6.376 1.00 63.03 C ATOM 392 C VAL A 23 -8.297 0.086 -6.480 1.00 71.04 C ATOM 393 O VAL A 23 -7.550 0.274 -5.513 1.00 3.04 O ATOM 394 CB VAL A 23 -9.240 -2.170 -7.284 1.00 35.42 C ATOM 395 CG1 VAL A 23 -7.842 -2.797 -7.018 1.00 21.03 C ATOM 396 CG2 VAL A 23 -10.358 -3.233 -7.092 1.00 52.10 C ATOM 0 H VAL A 23 -11.193 -0.692 -7.582 1.00 34.21 H new ATOM 0 HA VAL A 23 -9.552 -1.207 -5.330 1.00 63.03 H new ATOM 0 HB VAL A 23 -9.264 -1.831 -8.320 1.00 35.42 H new ATOM 0 HG11 VAL A 23 -7.704 -3.666 -7.662 1.00 21.03 H new ATOM 0 HG12 VAL A 23 -7.067 -2.061 -7.231 1.00 21.03 H new ATOM 0 HG13 VAL A 23 -7.774 -3.105 -5.975 1.00 21.03 H new ATOM 0 HG21 VAL A 23 -10.157 -4.092 -7.732 1.00 52.10 H new ATOM 0 HG22 VAL A 23 -10.380 -3.553 -6.050 1.00 52.10 H new ATOM 0 HG23 VAL A 23 -11.322 -2.800 -7.359 1.00 52.10 H new ATOM 406 N PHE A 24 -8.130 0.698 -7.666 1.00 14.22 N ATOM 407 CA PHE A 24 -7.056 1.691 -7.933 1.00 24.31 C ATOM 408 C PHE A 24 -7.156 2.910 -6.992 1.00 41.54 C ATOM 409 O PHE A 24 -6.178 3.285 -6.349 1.00 40.12 O ATOM 410 CB PHE A 24 -7.123 2.148 -9.412 1.00 34.01 C ATOM 411 CG PHE A 24 -6.209 3.317 -9.780 1.00 74.22 C ATOM 412 CD1 PHE A 24 -4.821 3.170 -9.787 1.00 11.20 C ATOM 413 CD2 PHE A 24 -6.743 4.564 -10.122 1.00 34.31 C ATOM 414 CE1 PHE A 24 -4.005 4.231 -10.125 1.00 65.43 C ATOM 415 CE2 PHE A 24 -5.924 5.616 -10.461 1.00 32.23 C ATOM 416 CZ PHE A 24 -4.557 5.451 -10.463 1.00 44.25 C ATOM 0 H PHE A 24 -8.732 0.523 -8.471 1.00 14.22 H new ATOM 0 HA PHE A 24 -6.097 1.209 -7.742 1.00 24.31 H new ATOM 0 HB2 PHE A 24 -6.873 1.299 -10.048 1.00 34.01 H new ATOM 0 HB3 PHE A 24 -8.151 2.427 -9.642 1.00 34.01 H new ATOM 0 HD1 PHE A 24 -4.382 2.219 -9.526 1.00 11.20 H new ATOM 0 HD2 PHE A 24 -7.814 4.703 -10.120 1.00 34.31 H new ATOM 0 HE1 PHE A 24 -2.932 4.107 -10.125 1.00 65.43 H new ATOM 0 HE2 PHE A 24 -6.353 6.571 -10.726 1.00 32.23 H new ATOM 0 HZ PHE A 24 -3.915 6.278 -10.730 1.00 44.25 H new ATOM 426 N ASP A 25 -8.354 3.509 -6.922 1.00 40.02 N ATOM 427 CA ASP A 25 -8.620 4.712 -6.098 1.00 13.01 C ATOM 428 C ASP A 25 -8.449 4.463 -4.577 1.00 72.04 C ATOM 429 O ASP A 25 -8.398 5.409 -3.796 1.00 44.31 O ATOM 430 CB ASP A 25 -10.025 5.259 -6.429 1.00 10.33 C ATOM 431 CG ASP A 25 -10.097 5.834 -7.856 1.00 14.25 C ATOM 432 OD1 ASP A 25 -10.002 5.051 -8.833 1.00 72.10 O ATOM 433 OD2 ASP A 25 -10.235 7.070 -8.015 1.00 35.02 O ATOM 0 H ASP A 25 -9.172 3.177 -7.434 1.00 40.02 H new ATOM 0 HA ASP A 25 -7.869 5.460 -6.353 1.00 13.01 H new ATOM 0 HB2 ASP A 25 -10.760 4.461 -6.322 1.00 10.33 H new ATOM 0 HB3 ASP A 25 -10.291 6.035 -5.711 1.00 10.33 H new ATOM 438 N ALA A 26 -8.352 3.190 -4.167 1.00 24.12 N ATOM 439 CA ALA A 26 -7.985 2.818 -2.780 1.00 40.33 C ATOM 440 C ALA A 26 -6.497 3.141 -2.469 1.00 45.30 C ATOM 441 O ALA A 26 -6.137 3.441 -1.329 1.00 74.22 O ATOM 442 CB ALA A 26 -8.288 1.340 -2.552 1.00 2.40 C ATOM 0 H ALA A 26 -8.523 2.390 -4.777 1.00 24.12 H new ATOM 0 HA ALA A 26 -8.584 3.415 -2.093 1.00 40.33 H new ATOM 0 HB1 ALA A 26 -8.018 1.066 -1.532 1.00 2.40 H new ATOM 0 HB2 ALA A 26 -9.352 1.158 -2.707 1.00 2.40 H new ATOM 0 HB3 ALA A 26 -7.711 0.738 -3.254 1.00 2.40 H new ATOM 448 N TYR A 27 -5.657 3.081 -3.513 1.00 45.31 N ATOM 449 CA TYR A 27 -4.218 3.437 -3.454 1.00 74.11 C ATOM 450 C TYR A 27 -4.002 4.933 -3.773 1.00 63.11 C ATOM 451 O TYR A 27 -2.955 5.507 -3.459 1.00 42.14 O ATOM 452 CB TYR A 27 -3.442 2.581 -4.494 1.00 4.11 C ATOM 453 CG TYR A 27 -3.489 1.063 -4.227 1.00 24.14 C ATOM 454 CD1 TYR A 27 -2.666 0.468 -3.265 1.00 31.44 C ATOM 455 CD2 TYR A 27 -4.372 0.228 -4.925 1.00 35.04 C ATOM 456 CE1 TYR A 27 -2.718 -0.894 -3.019 1.00 40.32 C ATOM 457 CE2 TYR A 27 -4.428 -1.134 -4.676 1.00 70.22 C ATOM 458 CZ TYR A 27 -3.600 -1.689 -3.723 1.00 23.13 C ATOM 459 OH TYR A 27 -3.655 -3.047 -3.466 1.00 42.14 O ATOM 0 H TYR A 27 -5.956 2.780 -4.440 1.00 45.31 H new ATOM 0 HA TYR A 27 -3.853 3.241 -2.446 1.00 74.11 H new ATOM 0 HB2 TYR A 27 -3.850 2.777 -5.486 1.00 4.11 H new ATOM 0 HB3 TYR A 27 -2.401 2.904 -4.509 1.00 4.11 H new ATOM 0 HD1 TYR A 27 -1.977 1.082 -2.704 1.00 31.44 H new ATOM 0 HD2 TYR A 27 -5.023 0.655 -5.673 1.00 35.04 H new ATOM 0 HE1 TYR A 27 -2.069 -1.334 -2.277 1.00 40.32 H new ATOM 0 HE2 TYR A 27 -5.117 -1.758 -5.226 1.00 70.22 H new ATOM 0 HH TYR A 27 -4.328 -3.463 -4.045 1.00 42.14 H new ATOM 469 N THR A 28 -5.014 5.545 -4.414 1.00 12.22 N ATOM 470 CA THR A 28 -4.889 6.866 -5.069 1.00 52.11 C ATOM 471 C THR A 28 -5.678 7.980 -4.325 1.00 42.14 C ATOM 472 O THR A 28 -5.427 9.176 -4.531 1.00 22.11 O ATOM 473 CB THR A 28 -5.358 6.741 -6.559 1.00 55.51 C ATOM 474 OG1 THR A 28 -4.736 5.593 -7.156 1.00 63.25 O ATOM 475 CG2 THR A 28 -4.997 7.960 -7.409 1.00 32.34 C ATOM 0 H THR A 28 -5.946 5.138 -4.494 1.00 12.22 H new ATOM 0 HA THR A 28 -3.842 7.167 -5.034 1.00 52.11 H new ATOM 0 HB THR A 28 -6.444 6.654 -6.536 1.00 55.51 H new ATOM 0 HG1 THR A 28 -5.228 4.785 -6.901 1.00 63.25 H new ATOM 0 HG21 THR A 28 -5.350 7.809 -8.429 1.00 32.34 H new ATOM 0 HG22 THR A 28 -5.469 8.849 -6.989 1.00 32.34 H new ATOM 0 HG23 THR A 28 -3.915 8.092 -7.415 1.00 32.34 H new ATOM 483 N LYS A 29 -6.617 7.585 -3.439 1.00 60.53 N ATOM 484 CA LYS A 29 -7.433 8.525 -2.609 1.00 2.43 C ATOM 485 C LYS A 29 -7.309 8.136 -1.113 1.00 45.40 C ATOM 486 O LYS A 29 -7.434 6.946 -0.779 1.00 44.12 O ATOM 487 CB LYS A 29 -8.937 8.484 -3.045 1.00 74.22 C ATOM 488 CG LYS A 29 -9.190 8.657 -4.566 1.00 64.00 C ATOM 489 CD LYS A 29 -8.674 10.003 -5.127 1.00 31.13 C ATOM 490 CE LYS A 29 -8.742 10.069 -6.662 1.00 41.43 C ATOM 491 NZ LYS A 29 -8.262 11.378 -7.164 1.00 10.41 N ATOM 0 H LYS A 29 -6.839 6.604 -3.272 1.00 60.53 H new ATOM 0 HA LYS A 29 -7.058 9.538 -2.756 1.00 2.43 H new ATOM 0 HB2 LYS A 29 -9.365 7.533 -2.728 1.00 74.22 H new ATOM 0 HB3 LYS A 29 -9.474 9.268 -2.512 1.00 74.22 H new ATOM 0 HG2 LYS A 29 -8.707 7.840 -5.102 1.00 64.00 H new ATOM 0 HG3 LYS A 29 -10.260 8.578 -4.760 1.00 64.00 H new ATOM 0 HD2 LYS A 29 -9.263 10.818 -4.706 1.00 31.13 H new ATOM 0 HD3 LYS A 29 -7.644 10.155 -4.806 1.00 31.13 H new ATOM 0 HE2 LYS A 29 -8.138 9.269 -7.090 1.00 41.43 H new ATOM 0 HE3 LYS A 29 -9.768 9.905 -6.991 1.00 41.43 H new ATOM 0 HZ1 LYS A 29 -8.319 11.394 -8.202 1.00 10.41 H new ATOM 0 HZ2 LYS A 29 -8.854 12.138 -6.773 1.00 10.41 H new ATOM 0 HZ3 LYS A 29 -7.275 11.522 -6.870 1.00 10.41 H new ATOM 505 N ARG A 30 -7.083 9.130 -0.206 1.00 30.43 N ATOM 506 CA ARG A 30 -6.857 8.838 1.240 1.00 30.44 C ATOM 507 C ARG A 30 -8.108 8.269 1.908 1.00 14.42 C ATOM 508 O ARG A 30 -7.996 7.371 2.721 1.00 31.12 O ATOM 509 CB ARG A 30 -6.353 10.074 2.051 1.00 51.35 C ATOM 510 CG ARG A 30 -7.426 11.106 2.456 1.00 64.11 C ATOM 511 CD ARG A 30 -6.854 12.321 3.209 1.00 31.23 C ATOM 512 NE ARG A 30 -7.920 13.268 3.592 1.00 63.33 N ATOM 513 CZ ARG A 30 -7.891 14.092 4.620 1.00 71.31 C ATOM 514 NH1 ARG A 30 -6.906 14.102 5.467 1.00 22.24 N ATOM 515 NH2 ARG A 30 -8.881 14.893 4.805 1.00 62.44 N ATOM 0 H ARG A 30 -7.053 10.121 -0.445 1.00 30.43 H new ATOM 0 HA ARG A 30 -6.067 8.088 1.255 1.00 30.44 H new ATOM 0 HB2 ARG A 30 -5.865 9.714 2.957 1.00 51.35 H new ATOM 0 HB3 ARG A 30 -5.592 10.584 1.460 1.00 51.35 H new ATOM 0 HG2 ARG A 30 -7.942 11.453 1.561 1.00 64.11 H new ATOM 0 HG3 ARG A 30 -8.171 10.617 3.084 1.00 64.11 H new ATOM 0 HD2 ARG A 30 -6.328 11.983 4.102 1.00 31.23 H new ATOM 0 HD3 ARG A 30 -6.122 12.829 2.581 1.00 31.23 H new ATOM 0 HE ARG A 30 -8.756 13.286 3.007 1.00 63.33 H new ATOM 0 HH11 ARG A 30 -6.124 13.459 5.347 1.00 22.24 H new ATOM 0 HH12 ARG A 30 -6.915 14.753 6.252 1.00 22.24 H new ATOM 0 HH21 ARG A 30 -9.672 14.884 4.161 1.00 62.44 H new ATOM 0 HH22 ARG A 30 -8.875 15.537 5.596 1.00 62.44 H new ATOM 529 N GLU A 31 -9.292 8.776 1.503 1.00 24.25 N ATOM 530 CA GLU A 31 -10.612 8.387 2.068 1.00 22.22 C ATOM 531 C GLU A 31 -10.805 6.849 2.132 1.00 5.13 C ATOM 532 O GLU A 31 -11.507 6.340 3.001 1.00 70.22 O ATOM 533 CB GLU A 31 -11.736 9.039 1.220 1.00 60.12 C ATOM 534 CG GLU A 31 -11.721 8.616 -0.266 1.00 5.33 C ATOM 535 CD GLU A 31 -12.885 9.200 -1.077 1.00 42.52 C ATOM 536 OE1 GLU A 31 -14.004 8.637 -1.011 1.00 11.51 O ATOM 537 OE2 GLU A 31 -12.695 10.227 -1.764 1.00 2.20 O ATOM 0 H GLU A 31 -9.364 9.476 0.765 1.00 24.25 H new ATOM 0 HA GLU A 31 -10.657 8.747 3.096 1.00 22.22 H new ATOM 0 HB2 GLU A 31 -12.702 8.779 1.652 1.00 60.12 H new ATOM 0 HB3 GLU A 31 -11.641 10.123 1.280 1.00 60.12 H new ATOM 0 HG2 GLU A 31 -10.780 8.931 -0.716 1.00 5.33 H new ATOM 0 HG3 GLU A 31 -11.755 7.528 -0.327 1.00 5.33 H new ATOM 544 N LEU A 32 -10.140 6.135 1.207 1.00 20.11 N ATOM 545 CA LEU A 32 -10.162 4.666 1.132 1.00 41.34 C ATOM 546 C LEU A 32 -8.883 4.067 1.764 1.00 2.22 C ATOM 547 O LEU A 32 -8.954 3.050 2.459 1.00 44.00 O ATOM 548 CB LEU A 32 -10.289 4.245 -0.346 1.00 54.53 C ATOM 549 CG LEU A 32 -11.578 4.748 -1.072 1.00 25.14 C ATOM 550 CD1 LEU A 32 -11.481 4.536 -2.594 1.00 73.44 C ATOM 551 CD2 LEU A 32 -12.841 4.078 -0.490 1.00 22.23 C ATOM 0 H LEU A 32 -9.566 6.568 0.483 1.00 20.11 H new ATOM 0 HA LEU A 32 -11.016 4.286 1.693 1.00 41.34 H new ATOM 0 HB2 LEU A 32 -9.418 4.614 -0.888 1.00 54.53 H new ATOM 0 HB3 LEU A 32 -10.261 3.157 -0.401 1.00 54.53 H new ATOM 0 HG LEU A 32 -11.662 5.820 -0.896 1.00 25.14 H new ATOM 0 HD11 LEU A 32 -12.393 4.896 -3.070 1.00 73.44 H new ATOM 0 HD12 LEU A 32 -10.626 5.087 -2.984 1.00 73.44 H new ATOM 0 HD13 LEU A 32 -11.356 3.474 -2.806 1.00 73.44 H new ATOM 0 HD21 LEU A 32 -13.723 4.447 -1.014 1.00 22.23 H new ATOM 0 HD22 LEU A 32 -12.770 2.998 -0.615 1.00 22.23 H new ATOM 0 HD23 LEU A 32 -12.923 4.316 0.571 1.00 22.23 H new ATOM 563 N PHE A 33 -7.726 4.729 1.516 1.00 52.53 N ATOM 564 CA PHE A 33 -6.390 4.311 2.022 1.00 10.41 C ATOM 565 C PHE A 33 -6.377 4.132 3.568 1.00 74.41 C ATOM 566 O PHE A 33 -5.942 3.100 4.074 1.00 13.23 O ATOM 567 CB PHE A 33 -5.327 5.348 1.569 1.00 24.34 C ATOM 568 CG PHE A 33 -3.877 4.997 1.920 1.00 41.02 C ATOM 569 CD1 PHE A 33 -3.154 4.085 1.146 1.00 51.11 C ATOM 570 CD2 PHE A 33 -3.235 5.586 3.014 1.00 25.41 C ATOM 571 CE1 PHE A 33 -1.839 3.778 1.454 1.00 24.51 C ATOM 572 CE2 PHE A 33 -1.922 5.277 3.320 1.00 21.45 C ATOM 573 CZ PHE A 33 -1.225 4.372 2.541 1.00 24.45 C ATOM 0 H PHE A 33 -7.691 5.579 0.953 1.00 52.53 H new ATOM 0 HA PHE A 33 -6.151 3.335 1.599 1.00 10.41 H new ATOM 0 HB2 PHE A 33 -5.402 5.472 0.489 1.00 24.34 H new ATOM 0 HB3 PHE A 33 -5.569 6.311 2.018 1.00 24.34 H new ATOM 0 HD1 PHE A 33 -3.627 3.614 0.297 1.00 51.11 H new ATOM 0 HD2 PHE A 33 -3.772 6.293 3.629 1.00 25.41 H new ATOM 0 HE1 PHE A 33 -1.293 3.074 0.844 1.00 24.51 H new ATOM 0 HE2 PHE A 33 -1.441 5.743 4.168 1.00 21.45 H new ATOM 0 HZ PHE A 33 -0.201 4.129 2.782 1.00 24.45 H new ATOM 583 N GLU A 34 -6.883 5.142 4.294 1.00 4.01 N ATOM 584 CA GLU A 34 -7.000 5.103 5.778 1.00 1.40 C ATOM 585 C GLU A 34 -8.119 4.149 6.306 1.00 20.32 C ATOM 586 O GLU A 34 -8.320 4.047 7.520 1.00 32.21 O ATOM 587 CB GLU A 34 -7.196 6.539 6.346 1.00 70.20 C ATOM 588 CG GLU A 34 -8.391 7.313 5.759 1.00 64.43 C ATOM 589 CD GLU A 34 -8.534 8.731 6.329 1.00 20.23 C ATOM 590 OE1 GLU A 34 -7.925 9.678 5.777 1.00 65.31 O ATOM 591 OE2 GLU A 34 -9.255 8.902 7.334 1.00 62.11 O ATOM 0 H GLU A 34 -7.224 6.010 3.880 1.00 4.01 H new ATOM 0 HA GLU A 34 -6.060 4.687 6.140 1.00 1.40 H new ATOM 0 HB2 GLU A 34 -7.321 6.472 7.427 1.00 70.20 H new ATOM 0 HB3 GLU A 34 -6.287 7.112 6.165 1.00 70.20 H new ATOM 0 HG2 GLU A 34 -8.280 7.373 4.676 1.00 64.43 H new ATOM 0 HG3 GLU A 34 -9.307 6.756 5.955 1.00 64.43 H new ATOM 598 N GLN A 35 -8.848 3.461 5.406 1.00 23.32 N ATOM 599 CA GLN A 35 -9.840 2.420 5.798 1.00 12.40 C ATOM 600 C GLN A 35 -9.247 0.991 5.709 1.00 71.34 C ATOM 601 O GLN A 35 -9.703 0.084 6.420 1.00 60.13 O ATOM 602 CB GLN A 35 -11.140 2.540 4.942 1.00 74.10 C ATOM 603 CG GLN A 35 -11.925 3.854 5.184 1.00 12.10 C ATOM 604 CD GLN A 35 -13.323 3.868 4.552 1.00 13.55 C ATOM 605 OE1 GLN A 35 -14.301 3.465 5.169 1.00 22.42 O ATOM 606 NE2 GLN A 35 -13.432 4.309 3.313 1.00 3.13 N ATOM 0 H GLN A 35 -8.774 3.602 4.399 1.00 23.32 H new ATOM 0 HA GLN A 35 -10.099 2.596 6.842 1.00 12.40 H new ATOM 0 HB2 GLN A 35 -10.877 2.473 3.886 1.00 74.10 H new ATOM 0 HB3 GLN A 35 -11.790 1.693 5.163 1.00 74.10 H new ATOM 0 HG2 GLN A 35 -12.021 4.016 6.258 1.00 12.10 H new ATOM 0 HG3 GLN A 35 -11.348 4.689 4.786 1.00 12.10 H new ATOM 0 HE21 GLN A 35 -12.606 4.641 2.815 1.00 3.13 H new ATOM 0 HE22 GLN A 35 -14.342 4.318 2.853 1.00 3.13 H new ATOM 615 N TRP A 36 -8.216 0.781 4.855 1.00 51.22 N ATOM 616 CA TRP A 36 -7.609 -0.568 4.672 1.00 31.11 C ATOM 617 C TRP A 36 -6.158 -0.657 5.215 1.00 51.45 C ATOM 618 O TRP A 36 -5.808 -1.634 5.892 1.00 14.41 O ATOM 619 CB TRP A 36 -7.684 -1.020 3.183 1.00 60.21 C ATOM 620 CG TRP A 36 -6.781 -0.293 2.205 1.00 43.34 C ATOM 621 CD1 TRP A 36 -7.062 0.838 1.501 1.00 1.24 C ATOM 622 CD2 TRP A 36 -5.458 -0.684 1.805 1.00 20.21 C ATOM 623 NE1 TRP A 36 -5.987 1.199 0.733 1.00 64.34 N ATOM 624 CE2 TRP A 36 -4.992 0.282 0.903 1.00 21.33 C ATOM 625 CE3 TRP A 36 -4.621 -1.748 2.149 1.00 23.42 C ATOM 626 CZ2 TRP A 36 -3.726 0.217 0.334 1.00 62.14 C ATOM 627 CZ3 TRP A 36 -3.365 -1.816 1.585 1.00 63.34 C ATOM 628 CH2 TRP A 36 -2.925 -0.836 0.690 1.00 20.23 C ATOM 0 H TRP A 36 -7.790 1.514 4.288 1.00 51.22 H new ATOM 0 HA TRP A 36 -8.203 -1.259 5.270 1.00 31.11 H new ATOM 0 HB2 TRP A 36 -7.449 -2.083 3.138 1.00 60.21 H new ATOM 0 HB3 TRP A 36 -8.714 -0.907 2.844 1.00 60.21 H new ATOM 0 HD1 TRP A 36 -7.999 1.374 1.542 1.00 1.24 H new ATOM 0 HE1 TRP A 36 -5.938 2.021 0.131 1.00 64.34 H new ATOM 0 HE3 TRP A 36 -4.952 -2.505 2.845 1.00 23.42 H new ATOM 0 HZ2 TRP A 36 -3.386 0.969 -0.363 1.00 62.14 H new ATOM 0 HZ3 TRP A 36 -2.712 -2.638 1.838 1.00 63.34 H new ATOM 0 HH2 TRP A 36 -1.933 -0.911 0.270 1.00 20.23 H new ATOM 639 N PHE A 37 -5.318 0.354 4.910 1.00 31.11 N ATOM 640 CA PHE A 37 -3.873 0.322 5.236 1.00 0.22 C ATOM 641 C PHE A 37 -3.626 0.614 6.741 1.00 44.23 C ATOM 642 O PHE A 37 -3.438 1.766 7.140 1.00 42.43 O ATOM 643 CB PHE A 37 -3.085 1.317 4.334 1.00 25.43 C ATOM 644 CG PHE A 37 -1.563 1.166 4.448 1.00 35.02 C ATOM 645 CD1 PHE A 37 -0.886 0.202 3.698 1.00 4.20 C ATOM 646 CD2 PHE A 37 -0.814 1.964 5.317 1.00 43.53 C ATOM 647 CE1 PHE A 37 0.482 0.039 3.818 1.00 54.22 C ATOM 648 CE2 PHE A 37 0.552 1.800 5.431 1.00 0.25 C ATOM 649 CZ PHE A 37 1.199 0.840 4.682 1.00 1.11 C ATOM 0 H PHE A 37 -5.615 1.207 4.436 1.00 31.11 H new ATOM 0 HA PHE A 37 -3.505 -0.684 5.035 1.00 0.22 H new ATOM 0 HB2 PHE A 37 -3.381 1.168 3.296 1.00 25.43 H new ATOM 0 HB3 PHE A 37 -3.363 2.337 4.601 1.00 25.43 H new ATOM 0 HD1 PHE A 37 -1.439 -0.425 3.014 1.00 4.20 H new ATOM 0 HD2 PHE A 37 -1.311 2.720 5.908 1.00 43.53 H new ATOM 0 HE1 PHE A 37 0.989 -0.716 3.235 1.00 54.22 H new ATOM 0 HE2 PHE A 37 1.115 2.425 6.108 1.00 0.25 H new ATOM 0 HZ PHE A 37 2.268 0.715 4.772 1.00 1.11 H new ATOM 659 N HIS A 38 -3.666 -0.448 7.564 1.00 51.01 N ATOM 660 CA HIS A 38 -3.379 -0.367 9.017 1.00 11.13 C ATOM 661 C HIS A 38 -3.086 -1.783 9.586 1.00 45.52 C ATOM 662 O HIS A 38 -3.618 -2.774 9.069 1.00 12.52 O ATOM 663 CB HIS A 38 -4.558 0.306 9.792 1.00 75.13 C ATOM 664 CG HIS A 38 -5.850 -0.470 9.783 1.00 60.41 C ATOM 665 ND1 HIS A 38 -6.191 -1.367 10.774 1.00 74.32 N ATOM 666 CD2 HIS A 38 -6.876 -0.489 8.897 1.00 11.21 C ATOM 667 CE1 HIS A 38 -7.357 -1.907 10.499 1.00 35.43 C ATOM 668 NE2 HIS A 38 -7.799 -1.396 9.366 1.00 20.33 N ATOM 0 H HIS A 38 -3.898 -1.389 7.246 1.00 51.01 H new ATOM 0 HA HIS A 38 -2.495 0.256 9.154 1.00 11.13 H new ATOM 0 HB2 HIS A 38 -4.252 0.461 10.827 1.00 75.13 H new ATOM 0 HB3 HIS A 38 -4.740 1.291 9.363 1.00 75.13 H new ATOM 0 HD1 HIS A 38 -5.624 -1.579 11.595 1.00 74.32 H new ATOM 0 HD2 HIS A 38 -6.954 0.097 7.993 1.00 11.21 H new ATOM 0 HE1 HIS A 38 -7.868 -2.645 11.100 1.00 35.43 H new ATOM 677 N PRO A 39 -2.247 -1.899 10.671 1.00 2.35 N ATOM 678 CA PRO A 39 -1.979 -3.202 11.346 1.00 14.40 C ATOM 679 C PRO A 39 -3.155 -3.677 12.245 1.00 25.50 C ATOM 680 O PRO A 39 -4.231 -3.057 12.270 1.00 21.22 O ATOM 681 CB PRO A 39 -0.706 -2.893 12.176 1.00 11.55 C ATOM 682 CG PRO A 39 -0.834 -1.442 12.518 1.00 64.03 C ATOM 683 CD PRO A 39 -1.472 -0.790 11.306 1.00 2.22 C ATOM 0 HA PRO A 39 -1.856 -4.022 10.639 1.00 14.40 H new ATOM 0 HB2 PRO A 39 -0.656 -3.511 13.073 1.00 11.55 H new ATOM 0 HB3 PRO A 39 0.200 -3.089 11.603 1.00 11.55 H new ATOM 0 HG2 PRO A 39 -1.449 -1.302 13.407 1.00 64.03 H new ATOM 0 HG3 PRO A 39 0.140 -1.003 12.732 1.00 64.03 H new ATOM 0 HD2 PRO A 39 -2.120 0.038 11.592 1.00 2.22 H new ATOM 0 HD3 PRO A 39 -0.721 -0.387 10.627 1.00 2.22 H new ATOM 691 N GLN A 40 -2.929 -4.791 12.973 1.00 11.52 N ATOM 692 CA GLN A 40 -3.937 -5.391 13.877 1.00 51.44 C ATOM 693 C GLN A 40 -4.339 -4.412 15.024 1.00 10.52 C ATOM 694 O GLN A 40 -3.470 -3.875 15.725 1.00 21.32 O ATOM 695 CB GLN A 40 -3.444 -6.761 14.455 1.00 21.42 C ATOM 696 CG GLN A 40 -2.208 -6.726 15.403 1.00 34.51 C ATOM 697 CD GLN A 40 -0.872 -6.434 14.709 1.00 63.22 C ATOM 698 OE1 GLN A 40 -0.447 -5.290 14.593 1.00 75.12 O ATOM 699 NE2 GLN A 40 -0.220 -7.470 14.216 1.00 13.33 N ATOM 0 H GLN A 40 -2.045 -5.300 12.952 1.00 11.52 H new ATOM 0 HA GLN A 40 -4.829 -5.582 13.280 1.00 51.44 H new ATOM 0 HB2 GLN A 40 -4.273 -7.218 14.996 1.00 21.42 H new ATOM 0 HB3 GLN A 40 -3.209 -7.417 13.617 1.00 21.42 H new ATOM 0 HG2 GLN A 40 -2.377 -5.969 16.169 1.00 34.51 H new ATOM 0 HG3 GLN A 40 -2.133 -7.685 15.915 1.00 34.51 H new ATOM 0 HE21 GLN A 40 -0.598 -8.411 14.328 1.00 13.33 H new ATOM 0 HE22 GLN A 40 0.662 -7.330 13.723 1.00 13.33 H new ATOM 708 N ASP A 41 -5.667 -4.164 15.147 1.00 5.15 N ATOM 709 CA ASP A 41 -6.304 -3.247 16.144 1.00 61.11 C ATOM 710 C ASP A 41 -6.082 -1.732 15.831 1.00 42.40 C ATOM 711 O ASP A 41 -7.036 -0.942 15.868 1.00 13.22 O ATOM 712 CB ASP A 41 -5.870 -3.578 17.606 1.00 52.32 C ATOM 713 CG ASP A 41 -6.568 -2.708 18.672 1.00 33.45 C ATOM 714 OD1 ASP A 41 -7.767 -2.940 18.942 1.00 10.43 O ATOM 715 OD2 ASP A 41 -5.922 -1.803 19.255 1.00 44.41 O ATOM 0 H ASP A 41 -6.353 -4.609 14.537 1.00 5.15 H new ATOM 0 HA ASP A 41 -7.375 -3.430 16.055 1.00 61.11 H new ATOM 0 HB2 ASP A 41 -6.083 -4.627 17.810 1.00 52.32 H new ATOM 0 HB3 ASP A 41 -4.791 -3.449 17.694 1.00 52.32 H new ATOM 720 N ALA A 42 -4.826 -1.344 15.537 1.00 51.24 N ATOM 721 CA ALA A 42 -4.401 0.067 15.414 1.00 12.12 C ATOM 722 C ALA A 42 -5.046 0.808 14.212 1.00 74.31 C ATOM 723 O ALA A 42 -5.246 0.234 13.134 1.00 73.33 O ATOM 724 CB ALA A 42 -2.867 0.134 15.321 1.00 74.14 C ATOM 0 H ALA A 42 -4.068 -2.008 15.376 1.00 51.24 H new ATOM 0 HA ALA A 42 -4.751 0.583 16.308 1.00 12.12 H new ATOM 0 HB1 ALA A 42 -2.553 1.174 15.230 1.00 74.14 H new ATOM 0 HB2 ALA A 42 -2.429 -0.300 16.220 1.00 74.14 H new ATOM 0 HB3 ALA A 42 -2.531 -0.424 14.447 1.00 74.14 H new ATOM 730 N SER A 43 -5.348 2.097 14.435 1.00 54.14 N ATOM 731 CA SER A 43 -5.938 3.015 13.431 1.00 65.43 C ATOM 732 C SER A 43 -4.845 3.666 12.538 1.00 22.45 C ATOM 733 O SER A 43 -3.647 3.407 12.700 1.00 23.30 O ATOM 734 CB SER A 43 -6.742 4.130 14.159 1.00 24.22 C ATOM 735 OG SER A 43 -7.736 3.600 15.023 1.00 54.34 O ATOM 0 H SER A 43 -5.188 2.546 15.337 1.00 54.14 H new ATOM 0 HA SER A 43 -6.597 2.432 12.787 1.00 65.43 H new ATOM 0 HB2 SER A 43 -6.057 4.752 14.735 1.00 24.22 H new ATOM 0 HB3 SER A 43 -7.214 4.777 13.419 1.00 24.22 H new ATOM 0 HG SER A 43 -8.215 4.335 15.460 1.00 54.34 H new ATOM 741 N VAL A 44 -5.283 4.520 11.594 1.00 24.45 N ATOM 742 CA VAL A 44 -4.386 5.305 10.714 1.00 72.10 C ATOM 743 C VAL A 44 -5.046 6.660 10.327 1.00 21.53 C ATOM 744 O VAL A 44 -6.159 6.694 9.784 1.00 74.04 O ATOM 745 CB VAL A 44 -3.971 4.473 9.434 1.00 54.03 C ATOM 746 CG1 VAL A 44 -5.205 3.886 8.707 1.00 2.13 C ATOM 747 CG2 VAL A 44 -3.084 5.295 8.461 1.00 51.30 C ATOM 0 H VAL A 44 -6.273 4.688 11.417 1.00 24.45 H new ATOM 0 HA VAL A 44 -3.472 5.525 11.266 1.00 72.10 H new ATOM 0 HB VAL A 44 -3.368 3.637 9.789 1.00 54.03 H new ATOM 0 HG11 VAL A 44 -4.878 3.322 7.834 1.00 2.13 H new ATOM 0 HG12 VAL A 44 -5.746 3.225 9.384 1.00 2.13 H new ATOM 0 HG13 VAL A 44 -5.861 4.697 8.390 1.00 2.13 H new ATOM 0 HG21 VAL A 44 -2.825 4.681 7.598 1.00 51.30 H new ATOM 0 HG22 VAL A 44 -3.630 6.177 8.128 1.00 51.30 H new ATOM 0 HG23 VAL A 44 -2.173 5.604 8.973 1.00 51.30 H new ATOM 757 N THR A 45 -4.362 7.773 10.647 1.00 75.01 N ATOM 758 CA THR A 45 -4.803 9.141 10.283 1.00 13.42 C ATOM 759 C THR A 45 -3.917 9.707 9.162 1.00 65.53 C ATOM 760 O THR A 45 -2.723 9.944 9.374 1.00 12.31 O ATOM 761 CB THR A 45 -4.772 10.108 11.523 1.00 14.11 C ATOM 762 OG1 THR A 45 -5.691 9.639 12.521 1.00 73.43 O ATOM 763 CG2 THR A 45 -5.128 11.570 11.161 1.00 61.42 C ATOM 0 H THR A 45 -3.485 7.754 11.167 1.00 75.01 H new ATOM 0 HA THR A 45 -5.833 9.071 9.932 1.00 13.42 H new ATOM 0 HB THR A 45 -3.749 10.104 11.899 1.00 14.11 H new ATOM 0 HG1 THR A 45 -5.670 10.241 13.294 1.00 73.43 H new ATOM 0 HG21 THR A 45 -5.089 12.187 12.059 1.00 61.42 H new ATOM 0 HG22 THR A 45 -4.414 11.948 10.430 1.00 61.42 H new ATOM 0 HG23 THR A 45 -6.132 11.606 10.739 1.00 61.42 H new ATOM 771 N VAL A 46 -4.500 9.902 7.964 1.00 23.44 N ATOM 772 CA VAL A 46 -3.804 10.561 6.843 1.00 31.11 C ATOM 773 C VAL A 46 -3.986 12.092 6.936 1.00 23.40 C ATOM 774 O VAL A 46 -5.105 12.597 6.846 1.00 51.42 O ATOM 775 CB VAL A 46 -4.291 10.038 5.440 1.00 44.53 C ATOM 776 CG1 VAL A 46 -3.461 10.667 4.290 1.00 13.55 C ATOM 777 CG2 VAL A 46 -4.239 8.492 5.368 1.00 3.43 C ATOM 0 H VAL A 46 -5.454 9.612 7.748 1.00 23.44 H new ATOM 0 HA VAL A 46 -2.746 10.311 6.926 1.00 31.11 H new ATOM 0 HB VAL A 46 -5.329 10.346 5.318 1.00 44.53 H new ATOM 0 HG11 VAL A 46 -3.819 10.288 3.333 1.00 13.55 H new ATOM 0 HG12 VAL A 46 -3.569 11.751 4.314 1.00 13.55 H new ATOM 0 HG13 VAL A 46 -2.410 10.404 4.414 1.00 13.55 H new ATOM 0 HG21 VAL A 46 -4.581 8.162 4.387 1.00 3.43 H new ATOM 0 HG22 VAL A 46 -3.215 8.155 5.528 1.00 3.43 H new ATOM 0 HG23 VAL A 46 -4.884 8.070 6.138 1.00 3.43 H new ATOM 787 N TYR A 47 -2.868 12.809 7.144 1.00 60.42 N ATOM 788 CA TYR A 47 -2.844 14.284 7.253 1.00 43.15 C ATOM 789 C TYR A 47 -2.995 14.947 5.863 1.00 11.33 C ATOM 790 O TYR A 47 -3.804 15.863 5.674 1.00 24.32 O ATOM 791 CB TYR A 47 -1.510 14.734 7.893 1.00 52.01 C ATOM 792 CG TYR A 47 -1.213 14.108 9.264 1.00 51.41 C ATOM 793 CD1 TYR A 47 -1.699 14.675 10.444 1.00 34.24 C ATOM 794 CD2 TYR A 47 -0.430 12.956 9.375 1.00 24.50 C ATOM 795 CE1 TYR A 47 -1.413 14.115 11.677 1.00 10.45 C ATOM 796 CE2 TYR A 47 -0.141 12.403 10.601 1.00 54.44 C ATOM 797 CZ TYR A 47 -0.631 12.982 11.749 1.00 11.52 C ATOM 798 OH TYR A 47 -0.329 12.431 12.975 1.00 21.23 O ATOM 0 H TYR A 47 -1.947 12.381 7.242 1.00 60.42 H new ATOM 0 HA TYR A 47 -3.682 14.595 7.877 1.00 43.15 H new ATOM 0 HB2 TYR A 47 -0.695 14.488 7.212 1.00 52.01 H new ATOM 0 HB3 TYR A 47 -1.521 15.819 7.999 1.00 52.01 H new ATOM 0 HD1 TYR A 47 -2.308 15.565 10.394 1.00 34.24 H new ATOM 0 HD2 TYR A 47 -0.044 12.490 8.480 1.00 24.50 H new ATOM 0 HE1 TYR A 47 -1.801 14.564 12.579 1.00 10.45 H new ATOM 0 HE2 TYR A 47 0.470 11.515 10.662 1.00 54.44 H new ATOM 0 HH TYR A 47 0.561 12.023 12.940 1.00 21.23 H new ATOM 808 N ASP A 48 -2.191 14.464 4.900 1.00 21.55 N ATOM 809 CA ASP A 48 -2.140 14.992 3.520 1.00 73.01 C ATOM 810 C ASP A 48 -2.012 13.825 2.514 1.00 62.22 C ATOM 811 O ASP A 48 -1.463 12.773 2.855 1.00 22.22 O ATOM 812 CB ASP A 48 -0.941 15.969 3.385 1.00 73.43 C ATOM 813 CG ASP A 48 -0.888 16.677 2.018 1.00 40.35 C ATOM 814 OD1 ASP A 48 -1.614 17.679 1.835 1.00 12.04 O ATOM 815 OD2 ASP A 48 -0.151 16.222 1.114 1.00 60.32 O ATOM 0 H ASP A 48 -1.550 13.687 5.057 1.00 21.55 H new ATOM 0 HA ASP A 48 -3.060 15.533 3.300 1.00 73.01 H new ATOM 0 HB2 ASP A 48 -1.001 16.719 4.174 1.00 73.43 H new ATOM 0 HB3 ASP A 48 -0.013 15.419 3.538 1.00 73.43 H new ATOM 820 N PHE A 49 -2.513 14.015 1.277 1.00 4.21 N ATOM 821 CA PHE A 49 -2.467 12.964 0.237 1.00 51.40 C ATOM 822 C PHE A 49 -2.491 13.586 -1.179 1.00 1.42 C ATOM 823 O PHE A 49 -3.308 14.470 -1.459 1.00 50.11 O ATOM 824 CB PHE A 49 -3.667 11.990 0.424 1.00 43.14 C ATOM 825 CG PHE A 49 -3.463 10.572 -0.127 1.00 61.04 C ATOM 826 CD1 PHE A 49 -3.576 10.299 -1.487 1.00 55.02 C ATOM 827 CD2 PHE A 49 -3.195 9.501 0.732 1.00 11.21 C ATOM 828 CE1 PHE A 49 -3.427 9.012 -1.963 1.00 63.11 C ATOM 829 CE2 PHE A 49 -3.058 8.217 0.251 1.00 35.54 C ATOM 830 CZ PHE A 49 -3.172 7.973 -1.096 1.00 61.24 C ATOM 0 H PHE A 49 -2.953 14.883 0.973 1.00 4.21 H new ATOM 0 HA PHE A 49 -1.535 12.409 0.342 1.00 51.40 H new ATOM 0 HB2 PHE A 49 -3.891 11.918 1.488 1.00 43.14 H new ATOM 0 HB3 PHE A 49 -4.543 12.425 -0.057 1.00 43.14 H new ATOM 0 HD1 PHE A 49 -3.783 11.103 -2.178 1.00 55.02 H new ATOM 0 HD2 PHE A 49 -3.094 9.684 1.792 1.00 11.21 H new ATOM 0 HE1 PHE A 49 -3.511 8.819 -3.022 1.00 63.11 H new ATOM 0 HE2 PHE A 49 -2.861 7.403 0.933 1.00 35.54 H new ATOM 0 HZ PHE A 49 -3.062 6.968 -1.475 1.00 61.24 H new ATOM 840 N ASN A 50 -1.591 13.109 -2.054 1.00 34.00 N ATOM 841 CA ASN A 50 -1.563 13.478 -3.487 1.00 31.32 C ATOM 842 C ASN A 50 -0.915 12.320 -4.285 1.00 35.30 C ATOM 843 O ASN A 50 0.304 12.139 -4.240 1.00 4.15 O ATOM 844 CB ASN A 50 -0.775 14.814 -3.685 1.00 24.25 C ATOM 845 CG ASN A 50 -0.930 15.446 -5.074 1.00 54.42 C ATOM 846 OD1 ASN A 50 -1.172 14.774 -6.071 1.00 23.32 O ATOM 847 ND2 ASN A 50 -0.772 16.754 -5.155 1.00 23.54 N ATOM 0 H ASN A 50 -0.856 12.453 -1.790 1.00 34.00 H new ATOM 0 HA ASN A 50 -2.577 13.638 -3.853 1.00 31.32 H new ATOM 0 HB2 ASN A 50 -1.107 15.531 -2.935 1.00 24.25 H new ATOM 0 HB3 ASN A 50 0.283 14.627 -3.501 1.00 24.25 H new ATOM 0 HD21 ASN A 50 -0.851 17.222 -6.058 1.00 23.54 H new ATOM 0 HD22 ASN A 50 -0.571 17.296 -4.315 1.00 23.54 H new ATOM 854 N ALA A 51 -1.738 11.522 -4.991 1.00 63.13 N ATOM 855 CA ALA A 51 -1.253 10.395 -5.818 1.00 74.43 C ATOM 856 C ALA A 51 -1.371 10.719 -7.323 1.00 53.35 C ATOM 857 O ALA A 51 -2.453 10.616 -7.915 1.00 32.12 O ATOM 858 CB ALA A 51 -2.005 9.105 -5.459 1.00 2.03 C ATOM 0 H ALA A 51 -2.751 11.637 -5.006 1.00 63.13 H new ATOM 0 HA ALA A 51 -0.196 10.239 -5.603 1.00 74.43 H new ATOM 0 HB1 ALA A 51 -1.637 8.285 -6.076 1.00 2.03 H new ATOM 0 HB2 ALA A 51 -1.842 8.869 -4.407 1.00 2.03 H new ATOM 0 HB3 ALA A 51 -3.071 9.243 -5.638 1.00 2.03 H new ATOM 864 N THR A 52 -0.240 11.124 -7.924 1.00 34.33 N ATOM 865 CA THR A 52 -0.158 11.503 -9.356 1.00 64.12 C ATOM 866 C THR A 52 1.278 11.258 -9.889 1.00 63.03 C ATOM 867 O THR A 52 2.132 10.705 -9.173 1.00 52.40 O ATOM 868 CB THR A 52 -0.580 13.010 -9.566 1.00 20.12 C ATOM 869 OG1 THR A 52 -0.662 13.325 -10.964 1.00 52.30 O ATOM 870 CG2 THR A 52 0.389 13.998 -8.885 1.00 34.23 C ATOM 0 H THR A 52 0.651 11.200 -7.433 1.00 34.33 H new ATOM 0 HA THR A 52 -0.853 10.880 -9.919 1.00 64.12 H new ATOM 0 HB THR A 52 -1.559 13.120 -9.100 1.00 20.12 H new ATOM 0 HG1 THR A 52 -0.926 14.262 -11.073 1.00 52.30 H new ATOM 0 HG21 THR A 52 0.051 15.019 -9.062 1.00 34.23 H new ATOM 0 HG22 THR A 52 0.413 13.804 -7.813 1.00 34.23 H new ATOM 0 HG23 THR A 52 1.389 13.870 -9.299 1.00 34.23 H new ATOM 878 N LYS A 53 1.534 11.628 -11.159 1.00 64.14 N ATOM 879 CA LYS A 53 2.895 11.628 -11.739 1.00 60.21 C ATOM 880 C LYS A 53 3.757 12.750 -11.082 1.00 70.33 C ATOM 881 O LYS A 53 3.900 13.841 -11.641 1.00 65.31 O ATOM 882 CB LYS A 53 2.825 11.831 -13.285 1.00 3.25 C ATOM 883 CG LYS A 53 1.970 10.795 -14.051 1.00 51.41 C ATOM 884 CD LYS A 53 2.590 9.382 -14.079 1.00 25.22 C ATOM 885 CE LYS A 53 3.845 9.275 -14.961 1.00 64.13 C ATOM 886 NZ LYS A 53 3.554 9.548 -16.392 1.00 51.22 N ATOM 0 H LYS A 53 0.810 11.934 -11.809 1.00 64.14 H new ATOM 0 HA LYS A 53 3.363 10.664 -11.538 1.00 60.21 H new ATOM 0 HB2 LYS A 53 2.427 12.826 -13.486 1.00 3.25 H new ATOM 0 HB3 LYS A 53 3.839 11.807 -13.684 1.00 3.25 H new ATOM 0 HG2 LYS A 53 0.983 10.740 -13.592 1.00 51.41 H new ATOM 0 HG3 LYS A 53 1.827 11.140 -15.075 1.00 51.41 H new ATOM 0 HD2 LYS A 53 2.846 9.087 -13.061 1.00 25.22 H new ATOM 0 HD3 LYS A 53 1.843 8.674 -14.438 1.00 25.22 H new ATOM 0 HE2 LYS A 53 4.597 9.979 -14.605 1.00 64.13 H new ATOM 0 HE3 LYS A 53 4.271 8.276 -14.863 1.00 64.13 H new ATOM 0 HZ1 LYS A 53 4.400 9.349 -16.962 1.00 51.22 H new ATOM 0 HZ2 LYS A 53 2.772 8.940 -16.709 1.00 51.22 H new ATOM 0 HZ3 LYS A 53 3.286 10.546 -16.507 1.00 51.22 H new ATOM 900 N GLY A 54 4.285 12.477 -9.874 1.00 23.02 N ATOM 901 CA GLY A 54 5.040 13.476 -9.089 1.00 40.24 C ATOM 902 C GLY A 54 4.226 14.105 -7.946 1.00 64.12 C ATOM 903 O GLY A 54 4.238 15.328 -7.764 1.00 62.22 O ATOM 0 H GLY A 54 4.203 11.569 -9.417 1.00 23.02 H new ATOM 0 HA2 GLY A 54 5.929 13.002 -8.673 1.00 40.24 H new ATOM 0 HA3 GLY A 54 5.383 14.266 -9.757 1.00 40.24 H new ATOM 907 N GLY A 55 3.505 13.256 -7.183 1.00 13.45 N ATOM 908 CA GLY A 55 2.767 13.682 -5.970 1.00 22.43 C ATOM 909 C GLY A 55 3.450 13.265 -4.657 1.00 53.40 C ATOM 910 O GLY A 55 4.572 12.743 -4.671 1.00 65.44 O ATOM 0 H GLY A 55 3.417 12.261 -7.387 1.00 13.45 H new ATOM 0 HA2 GLY A 55 2.656 14.766 -5.984 1.00 22.43 H new ATOM 0 HA3 GLY A 55 1.763 13.259 -5.998 1.00 22.43 H new ATOM 914 N SER A 56 2.760 13.486 -3.515 1.00 63.34 N ATOM 915 CA SER A 56 3.297 13.169 -2.161 1.00 32.34 C ATOM 916 C SER A 56 2.167 13.078 -1.101 1.00 54.12 C ATOM 917 O SER A 56 1.091 13.642 -1.280 1.00 31.11 O ATOM 918 CB SER A 56 4.344 14.226 -1.737 1.00 71.12 C ATOM 919 OG SER A 56 3.808 15.539 -1.727 1.00 43.44 O ATOM 0 H SER A 56 1.822 13.886 -3.499 1.00 63.34 H new ATOM 0 HA SER A 56 3.777 12.192 -2.218 1.00 32.34 H new ATOM 0 HB2 SER A 56 4.722 13.982 -0.744 1.00 71.12 H new ATOM 0 HB3 SER A 56 5.193 14.188 -2.419 1.00 71.12 H new ATOM 0 HG SER A 56 4.502 16.174 -1.452 1.00 43.44 H new ATOM 925 N ALA A 57 2.438 12.379 0.019 1.00 62.40 N ATOM 926 CA ALA A 57 1.433 12.118 1.083 1.00 22.45 C ATOM 927 C ALA A 57 2.102 11.938 2.462 1.00 40.42 C ATOM 928 O ALA A 57 3.252 11.521 2.548 1.00 75.23 O ATOM 929 CB ALA A 57 0.602 10.864 0.736 1.00 51.14 C ATOM 0 H ALA A 57 3.355 11.978 0.217 1.00 62.40 H new ATOM 0 HA ALA A 57 0.775 12.985 1.137 1.00 22.45 H new ATOM 0 HB1 ALA A 57 -0.130 10.684 1.523 1.00 51.14 H new ATOM 0 HB2 ALA A 57 0.086 11.020 -0.211 1.00 51.14 H new ATOM 0 HB3 ALA A 57 1.263 10.002 0.651 1.00 51.14 H new ATOM 935 N PHE A 58 1.355 12.239 3.539 1.00 25.32 N ATOM 936 CA PHE A 58 1.806 12.027 4.934 1.00 21.22 C ATOM 937 C PHE A 58 0.642 11.472 5.788 1.00 33.24 C ATOM 938 O PHE A 58 -0.479 11.977 5.736 1.00 1.33 O ATOM 939 CB PHE A 58 2.370 13.352 5.537 1.00 72.11 C ATOM 940 CG PHE A 58 2.796 13.295 7.018 1.00 1.14 C ATOM 941 CD1 PHE A 58 3.472 12.189 7.543 1.00 32.13 C ATOM 942 CD2 PHE A 58 2.527 14.360 7.882 1.00 43.23 C ATOM 943 CE1 PHE A 58 3.853 12.148 8.870 1.00 42.40 C ATOM 944 CE2 PHE A 58 2.912 14.315 9.210 1.00 30.32 C ATOM 945 CZ PHE A 58 3.572 13.210 9.702 1.00 53.24 C ATOM 0 H PHE A 58 0.418 12.637 3.471 1.00 25.32 H new ATOM 0 HA PHE A 58 2.612 11.293 4.938 1.00 21.22 H new ATOM 0 HB2 PHE A 58 3.231 13.660 4.944 1.00 72.11 H new ATOM 0 HB3 PHE A 58 1.613 14.129 5.427 1.00 72.11 H new ATOM 0 HD1 PHE A 58 3.700 11.352 6.899 1.00 32.13 H new ATOM 0 HD2 PHE A 58 2.011 15.231 7.507 1.00 43.23 H new ATOM 0 HE1 PHE A 58 4.372 11.283 9.256 1.00 42.40 H new ATOM 0 HE2 PHE A 58 2.695 15.148 9.863 1.00 30.32 H new ATOM 0 HZ PHE A 58 3.869 13.176 10.740 1.00 53.24 H new ATOM 955 N TYR A 59 0.943 10.427 6.575 1.00 70.33 N ATOM 956 CA TYR A 59 -0.011 9.768 7.493 1.00 30.43 C ATOM 957 C TYR A 59 0.706 9.276 8.773 1.00 3.34 C ATOM 958 O TYR A 59 1.916 9.451 8.922 1.00 5.33 O ATOM 959 CB TYR A 59 -0.754 8.604 6.773 1.00 34.34 C ATOM 960 CG TYR A 59 0.130 7.487 6.192 1.00 24.13 C ATOM 961 CD1 TYR A 59 0.753 7.625 4.944 1.00 53.41 C ATOM 962 CD2 TYR A 59 0.320 6.282 6.881 1.00 64.31 C ATOM 963 CE1 TYR A 59 1.531 6.610 4.414 1.00 70.00 C ATOM 964 CE2 TYR A 59 1.093 5.269 6.351 1.00 33.35 C ATOM 965 CZ TYR A 59 1.695 5.437 5.119 1.00 42.42 C ATOM 966 OH TYR A 59 2.459 4.419 4.595 1.00 64.11 O ATOM 0 H TYR A 59 1.872 10.006 6.595 1.00 70.33 H new ATOM 0 HA TYR A 59 -0.758 10.502 7.796 1.00 30.43 H new ATOM 0 HB2 TYR A 59 -1.452 8.155 7.479 1.00 34.34 H new ATOM 0 HB3 TYR A 59 -1.348 9.027 5.963 1.00 34.34 H new ATOM 0 HD1 TYR A 59 0.624 8.540 4.385 1.00 53.41 H new ATOM 0 HD2 TYR A 59 -0.147 6.143 7.845 1.00 64.31 H new ATOM 0 HE1 TYR A 59 2.007 6.737 3.453 1.00 70.00 H new ATOM 0 HE2 TYR A 59 1.227 4.347 6.898 1.00 33.35 H new ATOM 0 HH TYR A 59 2.028 3.558 4.779 1.00 64.11 H new ATOM 976 N ALA A 60 -0.055 8.686 9.708 1.00 53.14 N ATOM 977 CA ALA A 60 0.503 8.122 10.957 1.00 34.01 C ATOM 978 C ALA A 60 -0.383 6.985 11.494 1.00 15.01 C ATOM 979 O ALA A 60 -1.612 7.102 11.509 1.00 53.12 O ATOM 980 CB ALA A 60 0.668 9.214 12.027 1.00 11.01 C ATOM 0 H ALA A 60 -1.067 8.585 9.625 1.00 53.14 H new ATOM 0 HA ALA A 60 1.486 7.713 10.724 1.00 34.01 H new ATOM 0 HB1 ALA A 60 1.080 8.774 12.935 1.00 11.01 H new ATOM 0 HB2 ALA A 60 1.344 9.985 11.658 1.00 11.01 H new ATOM 0 HB3 ALA A 60 -0.303 9.658 12.247 1.00 11.01 H new ATOM 986 N ILE A 61 0.253 5.898 11.950 1.00 43.11 N ATOM 987 CA ILE A 61 -0.440 4.758 12.574 1.00 23.01 C ATOM 988 C ILE A 61 -0.808 5.112 14.035 1.00 31.44 C ATOM 989 O ILE A 61 0.063 5.186 14.912 1.00 3.02 O ATOM 990 CB ILE A 61 0.454 3.461 12.527 1.00 41.35 C ATOM 991 CG1 ILE A 61 0.860 3.111 11.055 1.00 72.42 C ATOM 992 CG2 ILE A 61 -0.236 2.258 13.227 1.00 2.15 C ATOM 993 CD1 ILE A 61 -0.298 2.827 10.101 1.00 71.24 C ATOM 0 H ILE A 61 1.265 5.782 11.897 1.00 43.11 H new ATOM 0 HA ILE A 61 -1.353 4.553 12.014 1.00 23.01 H new ATOM 0 HB ILE A 61 1.367 3.673 13.084 1.00 41.35 H new ATOM 0 HG12 ILE A 61 1.445 3.938 10.652 1.00 72.42 H new ATOM 0 HG13 ILE A 61 1.513 2.239 11.075 1.00 72.42 H new ATOM 0 HG21 ILE A 61 0.413 1.384 13.172 1.00 2.15 H new ATOM 0 HG22 ILE A 61 -0.425 2.505 14.272 1.00 2.15 H new ATOM 0 HG23 ILE A 61 -1.181 2.040 12.729 1.00 2.15 H new ATOM 0 HD11 ILE A 61 0.095 2.596 9.111 1.00 71.24 H new ATOM 0 HD12 ILE A 61 -0.874 1.978 10.470 1.00 71.24 H new ATOM 0 HD13 ILE A 61 -0.943 3.704 10.040 1.00 71.24 H new ATOM 1005 N GLN A 62 -2.106 5.386 14.264 1.00 2.31 N ATOM 1006 CA GLN A 62 -2.632 5.732 15.597 1.00 1.24 C ATOM 1007 C GLN A 62 -2.919 4.440 16.399 1.00 73.24 C ATOM 1008 O GLN A 62 -3.962 3.806 16.225 1.00 42.30 O ATOM 1009 CB GLN A 62 -3.938 6.564 15.458 1.00 42.44 C ATOM 1010 CG GLN A 62 -3.871 7.764 14.494 1.00 54.11 C ATOM 1011 CD GLN A 62 -2.864 8.839 14.895 1.00 65.42 C ATOM 1012 OE1 GLN A 62 -1.663 8.764 14.363 1.00 41.33 O flip ATOM 1013 NE2 GLN A 62 -3.173 9.743 15.663 1.00 15.12 N flip ATOM 0 H GLN A 62 -2.817 5.374 13.533 1.00 2.31 H new ATOM 0 HA GLN A 62 -1.888 6.327 16.126 1.00 1.24 H new ATOM 0 HB2 GLN A 62 -4.736 5.900 15.126 1.00 42.44 H new ATOM 0 HB3 GLN A 62 -4.219 6.931 16.445 1.00 42.44 H new ATOM 0 HG2 GLN A 62 -3.619 7.401 13.498 1.00 54.11 H new ATOM 0 HG3 GLN A 62 -4.860 8.217 14.427 1.00 54.11 H new ATOM 0 HE21 GLN A 62 -4.112 9.776 16.060 1.00 15.12 H new ATOM 0 HE22 GLN A 62 -2.491 10.462 15.905 1.00 15.12 H new ATOM 1022 N ALA A 63 -1.985 4.061 17.267 1.00 10.35 N ATOM 1023 CA ALA A 63 -2.088 2.834 18.092 1.00 72.04 C ATOM 1024 C ALA A 63 -2.291 3.208 19.588 1.00 32.51 C ATOM 1025 O ALA A 63 -1.917 4.316 19.990 1.00 73.33 O ATOM 1026 CB ALA A 63 -0.830 1.976 17.863 1.00 2.14 C ATOM 0 H ALA A 63 -1.128 4.590 17.428 1.00 10.35 H new ATOM 0 HA ALA A 63 -2.957 2.246 17.797 1.00 72.04 H new ATOM 0 HB1 ALA A 63 -0.893 1.069 18.465 1.00 2.14 H new ATOM 0 HB2 ALA A 63 -0.760 1.708 16.809 1.00 2.14 H new ATOM 0 HB3 ALA A 63 0.055 2.543 18.153 1.00 2.14 H new ATOM 1032 N PRO A 64 -2.892 2.302 20.440 1.00 1.44 N ATOM 1033 CA PRO A 64 -3.248 2.635 21.854 1.00 30.14 C ATOM 1034 C PRO A 64 -2.038 3.062 22.738 1.00 74.12 C ATOM 1035 O PRO A 64 -2.155 3.984 23.553 1.00 74.04 O ATOM 1036 CB PRO A 64 -3.905 1.324 22.382 1.00 55.31 C ATOM 1037 CG PRO A 64 -3.417 0.249 21.458 1.00 11.22 C ATOM 1038 CD PRO A 64 -3.298 0.904 20.104 1.00 33.44 C ATOM 0 HA PRO A 64 -3.902 3.506 21.897 1.00 30.14 H new ATOM 0 HB2 PRO A 64 -3.612 1.122 23.412 1.00 55.31 H new ATOM 0 HB3 PRO A 64 -4.993 1.394 22.368 1.00 55.31 H new ATOM 0 HG2 PRO A 64 -2.456 -0.146 21.788 1.00 11.22 H new ATOM 0 HG3 PRO A 64 -4.113 -0.589 21.429 1.00 11.22 H new ATOM 0 HD2 PRO A 64 -2.555 0.407 19.480 1.00 33.44 H new ATOM 0 HD3 PRO A 64 -4.242 0.878 19.559 1.00 33.44 H new ATOM 1046 N GLN A 65 -0.878 2.398 22.557 1.00 71.42 N ATOM 1047 CA GLN A 65 0.336 2.642 23.387 1.00 33.24 C ATOM 1048 C GLN A 65 1.460 3.388 22.616 1.00 54.13 C ATOM 1049 O GLN A 65 2.486 3.730 23.212 1.00 42.21 O ATOM 1050 CB GLN A 65 0.874 1.289 23.934 1.00 22.23 C ATOM 1051 CG GLN A 65 -0.130 0.513 24.805 1.00 71.31 C ATOM 1052 CD GLN A 65 0.452 -0.773 25.391 1.00 21.12 C ATOM 1053 OE1 GLN A 65 0.359 -1.847 24.801 1.00 25.12 O ATOM 1054 NE2 GLN A 65 1.078 -0.667 26.546 1.00 44.11 N ATOM 0 H GLN A 65 -0.749 1.683 21.841 1.00 71.42 H new ATOM 0 HA GLN A 65 0.037 3.291 24.210 1.00 33.24 H new ATOM 0 HB2 GLN A 65 1.168 0.662 23.093 1.00 22.23 H new ATOM 0 HB3 GLN A 65 1.774 1.479 24.519 1.00 22.23 H new ATOM 0 HG2 GLN A 65 -0.468 1.155 25.618 1.00 71.31 H new ATOM 0 HG3 GLN A 65 -1.007 0.268 24.206 1.00 71.31 H new ATOM 0 HE21 GLN A 65 1.139 0.238 27.012 1.00 44.11 H new ATOM 0 HE22 GLN A 65 1.502 -1.490 26.974 1.00 44.11 H new ATOM 1063 N MET A 66 1.262 3.653 21.306 1.00 73.45 N ATOM 1064 CA MET A 66 2.304 4.277 20.441 1.00 21.54 C ATOM 1065 C MET A 66 1.669 5.005 19.233 1.00 12.03 C ATOM 1066 O MET A 66 0.584 4.646 18.790 1.00 15.45 O ATOM 1067 CB MET A 66 3.308 3.193 19.943 1.00 32.33 C ATOM 1068 CG MET A 66 2.672 2.093 19.084 1.00 33.15 C ATOM 1069 SD MET A 66 3.834 0.810 18.578 1.00 4.32 S ATOM 1070 CE MET A 66 2.754 -0.251 17.622 1.00 14.24 C ATOM 0 H MET A 66 0.391 3.446 20.818 1.00 73.45 H new ATOM 0 HA MET A 66 2.839 5.016 21.038 1.00 21.54 H new ATOM 0 HB2 MET A 66 4.094 3.680 19.366 1.00 32.33 H new ATOM 0 HB3 MET A 66 3.786 2.732 20.807 1.00 32.33 H new ATOM 0 HG2 MET A 66 1.857 1.633 19.642 1.00 33.15 H new ATOM 0 HG3 MET A 66 2.234 2.546 18.195 1.00 33.15 H new ATOM 0 HE1 MET A 66 3.323 -1.097 17.236 1.00 14.24 H new ATOM 0 HE2 MET A 66 1.947 -0.616 18.257 1.00 14.24 H new ATOM 0 HE3 MET A 66 2.334 0.313 16.789 1.00 14.24 H new ATOM 1080 N ILE A 67 2.345 6.043 18.710 1.00 41.45 N ATOM 1081 CA ILE A 67 1.964 6.698 17.435 1.00 21.40 C ATOM 1082 C ILE A 67 3.226 6.874 16.564 1.00 44.12 C ATOM 1083 O ILE A 67 4.116 7.666 16.893 1.00 1.22 O ATOM 1084 CB ILE A 67 1.244 8.096 17.650 1.00 15.13 C ATOM 1085 CG1 ILE A 67 -0.077 7.926 18.482 1.00 3.41 C ATOM 1086 CG2 ILE A 67 0.948 8.783 16.288 1.00 74.45 C ATOM 1087 CD1 ILE A 67 -0.836 9.212 18.771 1.00 12.45 C ATOM 0 H ILE A 67 3.167 6.454 19.152 1.00 41.45 H new ATOM 0 HA ILE A 67 1.241 6.054 16.934 1.00 21.40 H new ATOM 0 HB ILE A 67 1.921 8.737 18.215 1.00 15.13 H new ATOM 0 HG12 ILE A 67 -0.739 7.246 17.946 1.00 3.41 H new ATOM 0 HG13 ILE A 67 0.170 7.449 19.430 1.00 3.41 H new ATOM 0 HG21 ILE A 67 0.454 9.739 16.462 1.00 74.45 H new ATOM 0 HG22 ILE A 67 1.883 8.950 15.754 1.00 74.45 H new ATOM 0 HG23 ILE A 67 0.298 8.143 15.691 1.00 74.45 H new ATOM 0 HD11 ILE A 67 -1.731 8.984 19.350 1.00 12.45 H new ATOM 0 HD12 ILE A 67 -0.199 9.890 19.339 1.00 12.45 H new ATOM 0 HD13 ILE A 67 -1.122 9.684 17.831 1.00 12.45 H new ATOM 1099 N SER A 68 3.304 6.103 15.465 1.00 53.42 N ATOM 1100 CA SER A 68 4.442 6.146 14.517 1.00 70.22 C ATOM 1101 C SER A 68 4.027 6.870 13.219 1.00 52.11 C ATOM 1102 O SER A 68 2.939 6.642 12.694 1.00 71.34 O ATOM 1103 CB SER A 68 4.931 4.709 14.204 1.00 74.33 C ATOM 1104 OG SER A 68 3.894 3.911 13.645 1.00 41.12 O ATOM 0 H SER A 68 2.582 5.431 15.205 1.00 53.42 H new ATOM 0 HA SER A 68 5.262 6.699 14.975 1.00 70.22 H new ATOM 0 HB2 SER A 68 5.771 4.753 13.510 1.00 74.33 H new ATOM 0 HB3 SER A 68 5.297 4.242 15.118 1.00 74.33 H new ATOM 0 HG SER A 68 4.237 3.012 13.458 1.00 41.12 H new ATOM 1110 N TYR A 69 4.912 7.738 12.708 1.00 64.12 N ATOM 1111 CA TYR A 69 4.626 8.629 11.556 1.00 11.42 C ATOM 1112 C TYR A 69 5.301 8.101 10.273 1.00 34.43 C ATOM 1113 O TYR A 69 6.475 7.726 10.296 1.00 62.51 O ATOM 1114 CB TYR A 69 5.117 10.063 11.890 1.00 70.02 C ATOM 1115 CG TYR A 69 4.456 10.646 13.144 1.00 74.33 C ATOM 1116 CD1 TYR A 69 4.920 10.312 14.420 1.00 52.31 C ATOM 1117 CD2 TYR A 69 3.347 11.489 13.057 1.00 20.13 C ATOM 1118 CE1 TYR A 69 4.308 10.797 15.553 1.00 73.34 C ATOM 1119 CE2 TYR A 69 2.730 11.974 14.190 1.00 54.23 C ATOM 1120 CZ TYR A 69 3.211 11.627 15.434 1.00 72.32 C ATOM 1121 OH TYR A 69 2.582 12.108 16.565 1.00 33.03 O ATOM 0 H TYR A 69 5.855 7.848 13.080 1.00 64.12 H new ATOM 0 HA TYR A 69 3.551 8.650 11.375 1.00 11.42 H new ATOM 0 HB2 TYR A 69 6.198 10.048 12.030 1.00 70.02 H new ATOM 0 HB3 TYR A 69 4.915 10.717 11.042 1.00 70.02 H new ATOM 0 HD1 TYR A 69 5.776 9.660 14.518 1.00 52.31 H new ATOM 0 HD2 TYR A 69 2.966 11.766 12.085 1.00 20.13 H new ATOM 0 HE1 TYR A 69 4.684 10.530 16.530 1.00 73.34 H new ATOM 0 HE2 TYR A 69 1.872 12.624 14.103 1.00 54.23 H new ATOM 0 HH TYR A 69 1.829 12.678 16.303 1.00 33.03 H new ATOM 1131 N THR A 70 4.565 8.106 9.146 1.00 14.33 N ATOM 1132 CA THR A 70 5.025 7.499 7.874 1.00 71.34 C ATOM 1133 C THR A 70 4.536 8.325 6.657 1.00 12.12 C ATOM 1134 O THR A 70 3.417 8.818 6.635 1.00 22.34 O ATOM 1135 CB THR A 70 4.532 6.012 7.732 1.00 72.35 C ATOM 1136 OG1 THR A 70 4.843 5.257 8.916 1.00 54.14 O ATOM 1137 CG2 THR A 70 5.171 5.310 6.524 1.00 22.14 C ATOM 0 H THR A 70 3.638 8.528 9.087 1.00 14.33 H new ATOM 0 HA THR A 70 6.115 7.502 7.894 1.00 71.34 H new ATOM 0 HB THR A 70 3.453 6.054 7.587 1.00 72.35 H new ATOM 0 HG1 THR A 70 4.527 4.336 8.809 1.00 54.14 H new ATOM 0 HG21 THR A 70 4.804 4.286 6.462 1.00 22.14 H new ATOM 0 HG22 THR A 70 4.909 5.845 5.611 1.00 22.14 H new ATOM 0 HG23 THR A 70 6.255 5.301 6.640 1.00 22.14 H new ATOM 1145 N ILE A 71 5.394 8.439 5.641 1.00 33.45 N ATOM 1146 CA ILE A 71 5.175 9.255 4.428 1.00 14.05 C ATOM 1147 C ILE A 71 5.167 8.350 3.170 1.00 5.33 C ATOM 1148 O ILE A 71 5.854 7.333 3.138 1.00 72.30 O ATOM 1149 CB ILE A 71 6.332 10.324 4.335 1.00 21.50 C ATOM 1150 CG1 ILE A 71 6.244 11.323 5.527 1.00 50.45 C ATOM 1151 CG2 ILE A 71 6.361 11.069 2.982 1.00 40.32 C ATOM 1152 CD1 ILE A 71 7.371 12.329 5.604 1.00 10.45 C ATOM 0 H ILE A 71 6.291 7.954 5.632 1.00 33.45 H new ATOM 0 HA ILE A 71 4.210 9.760 4.483 1.00 14.05 H new ATOM 0 HB ILE A 71 7.274 9.779 4.398 1.00 21.50 H new ATOM 0 HG12 ILE A 71 5.299 11.863 5.460 1.00 50.45 H new ATOM 0 HG13 ILE A 71 6.221 10.754 6.457 1.00 50.45 H new ATOM 0 HG21 ILE A 71 7.179 11.790 2.981 1.00 40.32 H new ATOM 0 HG22 ILE A 71 6.509 10.352 2.175 1.00 40.32 H new ATOM 0 HG23 ILE A 71 5.416 11.592 2.834 1.00 40.32 H new ATOM 0 HD11 ILE A 71 7.220 12.979 6.466 1.00 10.45 H new ATOM 0 HD12 ILE A 71 8.321 11.804 5.707 1.00 10.45 H new ATOM 0 HD13 ILE A 71 7.385 12.930 4.695 1.00 10.45 H new ATOM 1164 N ALA A 72 4.375 8.723 2.146 1.00 62.34 N ATOM 1165 CA ALA A 72 4.394 8.055 0.822 1.00 35.42 C ATOM 1166 C ALA A 72 4.614 9.105 -0.294 1.00 53.10 C ATOM 1167 O ALA A 72 3.777 9.980 -0.502 1.00 50.30 O ATOM 1168 CB ALA A 72 3.077 7.282 0.614 1.00 43.43 C ATOM 0 H ALA A 72 3.706 9.491 2.208 1.00 62.34 H new ATOM 0 HA ALA A 72 5.218 7.343 0.780 1.00 35.42 H new ATOM 0 HB1 ALA A 72 3.093 6.792 -0.359 1.00 43.43 H new ATOM 0 HB2 ALA A 72 2.968 6.531 1.397 1.00 43.43 H new ATOM 0 HB3 ALA A 72 2.237 7.976 0.657 1.00 43.43 H new ATOM 1174 N GLU A 73 5.738 8.999 -1.018 1.00 14.43 N ATOM 1175 CA GLU A 73 6.114 9.952 -2.089 1.00 30.01 C ATOM 1176 C GLU A 73 5.831 9.333 -3.467 1.00 43.35 C ATOM 1177 O GLU A 73 6.562 8.451 -3.913 1.00 1.12 O ATOM 1178 CB GLU A 73 7.626 10.281 -1.957 1.00 61.11 C ATOM 1179 CG GLU A 73 8.017 11.020 -0.663 1.00 43.50 C ATOM 1180 CD GLU A 73 7.454 12.447 -0.587 1.00 30.42 C ATOM 1181 OE1 GLU A 73 7.969 13.328 -1.305 1.00 25.10 O ATOM 1182 OE2 GLU A 73 6.500 12.693 0.179 1.00 43.04 O ATOM 0 H GLU A 73 6.418 8.251 -0.882 1.00 14.43 H new ATOM 0 HA GLU A 73 5.527 10.865 -1.992 1.00 30.01 H new ATOM 0 HB2 GLU A 73 8.192 9.351 -2.012 1.00 61.11 H new ATOM 0 HB3 GLU A 73 7.927 10.889 -2.811 1.00 61.11 H new ATOM 0 HG2 GLU A 73 7.661 10.450 0.195 1.00 43.50 H new ATOM 0 HG3 GLU A 73 9.104 11.061 -0.590 1.00 43.50 H new ATOM 1189 N TYR A 74 4.821 9.856 -4.169 1.00 3.40 N ATOM 1190 CA TYR A 74 4.332 9.256 -5.430 1.00 35.43 C ATOM 1191 C TYR A 74 5.148 9.759 -6.630 1.00 13.44 C ATOM 1192 O TYR A 74 4.925 10.854 -7.133 1.00 33.03 O ATOM 1193 CB TYR A 74 2.814 9.525 -5.598 1.00 22.43 C ATOM 1194 CG TYR A 74 1.966 8.835 -4.513 1.00 33.44 C ATOM 1195 CD1 TYR A 74 1.713 9.457 -3.289 1.00 33.10 C ATOM 1196 CD2 TYR A 74 1.451 7.546 -4.703 1.00 65.45 C ATOM 1197 CE1 TYR A 74 0.982 8.824 -2.303 1.00 50.01 C ATOM 1198 CE2 TYR A 74 0.712 6.915 -3.718 1.00 64.24 C ATOM 1199 CZ TYR A 74 0.484 7.556 -2.522 1.00 2.43 C ATOM 1200 OH TYR A 74 -0.232 6.923 -1.531 1.00 34.21 O ATOM 0 H TYR A 74 4.319 10.699 -3.889 1.00 3.40 H new ATOM 0 HA TYR A 74 4.471 8.176 -5.385 1.00 35.43 H new ATOM 0 HB2 TYR A 74 2.634 10.599 -5.566 1.00 22.43 H new ATOM 0 HB3 TYR A 74 2.494 9.177 -6.580 1.00 22.43 H new ATOM 0 HD1 TYR A 74 2.096 10.451 -3.110 1.00 33.10 H new ATOM 0 HD2 TYR A 74 1.634 7.035 -5.637 1.00 65.45 H new ATOM 0 HE1 TYR A 74 0.800 9.321 -1.361 1.00 50.01 H new ATOM 0 HE2 TYR A 74 0.316 5.924 -3.887 1.00 64.24 H new ATOM 0 HH TYR A 74 -1.127 7.317 -1.471 1.00 34.21 H new ATOM 1210 N LEU A 75 6.128 8.942 -7.048 1.00 61.01 N ATOM 1211 CA LEU A 75 7.047 9.262 -8.158 1.00 51.13 C ATOM 1212 C LEU A 75 6.254 9.275 -9.496 1.00 3.34 C ATOM 1213 O LEU A 75 6.239 10.278 -10.220 1.00 10.43 O ATOM 1214 CB LEU A 75 8.222 8.217 -8.172 1.00 73.24 C ATOM 1215 CG LEU A 75 9.608 8.660 -8.765 1.00 32.11 C ATOM 1216 CD1 LEU A 75 9.548 8.980 -10.273 1.00 3.35 C ATOM 1217 CD2 LEU A 75 10.202 9.839 -7.964 1.00 72.31 C ATOM 0 H LEU A 75 6.308 8.032 -6.623 1.00 61.01 H new ATOM 0 HA LEU A 75 7.484 10.252 -8.025 1.00 51.13 H new ATOM 0 HB2 LEU A 75 8.389 7.891 -7.145 1.00 73.24 H new ATOM 0 HB3 LEU A 75 7.884 7.345 -8.732 1.00 73.24 H new ATOM 0 HG LEU A 75 10.275 7.804 -8.664 1.00 32.11 H new ATOM 0 HD11 LEU A 75 10.537 9.279 -10.621 1.00 3.35 H new ATOM 0 HD12 LEU A 75 9.223 8.095 -10.820 1.00 3.35 H new ATOM 0 HD13 LEU A 75 8.842 9.792 -10.445 1.00 3.35 H new ATOM 0 HD21 LEU A 75 11.161 10.126 -8.396 1.00 72.31 H new ATOM 0 HD22 LEU A 75 9.518 10.687 -8.004 1.00 72.31 H new ATOM 0 HD23 LEU A 75 10.347 9.538 -6.926 1.00 72.31 H new ATOM 1229 N GLN A 76 5.580 8.145 -9.793 1.00 52.42 N ATOM 1230 CA GLN A 76 4.724 7.995 -10.994 1.00 32.00 C ATOM 1231 C GLN A 76 3.433 7.219 -10.648 1.00 11.33 C ATOM 1232 O GLN A 76 3.491 6.050 -10.283 1.00 32.10 O ATOM 1233 CB GLN A 76 5.487 7.222 -12.114 1.00 2.14 C ATOM 1234 CG GLN A 76 6.696 7.964 -12.720 1.00 71.02 C ATOM 1235 CD GLN A 76 7.507 7.116 -13.710 1.00 2.24 C ATOM 1236 OE1 GLN A 76 7.667 5.832 -13.434 1.00 12.44 O flip ATOM 1237 NE2 GLN A 76 8.043 7.626 -14.683 1.00 42.34 N flip ATOM 0 H GLN A 76 5.612 7.309 -9.209 1.00 52.42 H new ATOM 0 HA GLN A 76 4.466 8.994 -11.346 1.00 32.00 H new ATOM 0 HB2 GLN A 76 5.832 6.272 -11.707 1.00 2.14 H new ATOM 0 HB3 GLN A 76 4.785 6.990 -12.915 1.00 2.14 H new ATOM 0 HG2 GLN A 76 6.343 8.861 -13.228 1.00 71.02 H new ATOM 0 HG3 GLN A 76 7.352 8.291 -11.913 1.00 71.02 H new ATOM 0 HE21 GLN A 76 7.907 8.618 -14.879 1.00 42.34 H new ATOM 0 HE22 GLN A 76 8.626 7.060 -15.299 1.00 42.34 H new ATOM 1246 N VAL A 77 2.264 7.861 -10.776 1.00 62.41 N ATOM 1247 CA VAL A 77 0.970 7.134 -10.793 1.00 23.23 C ATOM 1248 C VAL A 77 0.348 7.357 -12.182 1.00 34.45 C ATOM 1249 O VAL A 77 -0.145 8.453 -12.487 1.00 5.13 O ATOM 1250 CB VAL A 77 0.003 7.607 -9.641 1.00 10.44 C ATOM 1251 CG1 VAL A 77 -1.319 6.796 -9.643 1.00 72.35 C ATOM 1252 CG2 VAL A 77 0.706 7.515 -8.265 1.00 51.40 C ATOM 0 H VAL A 77 2.179 8.873 -10.869 1.00 62.41 H new ATOM 0 HA VAL A 77 1.136 6.072 -10.610 1.00 23.23 H new ATOM 0 HB VAL A 77 -0.251 8.651 -9.827 1.00 10.44 H new ATOM 0 HG11 VAL A 77 -1.963 7.147 -8.837 1.00 72.35 H new ATOM 0 HG12 VAL A 77 -1.827 6.931 -10.598 1.00 72.35 H new ATOM 0 HG13 VAL A 77 -1.098 5.739 -9.496 1.00 72.35 H new ATOM 0 HG21 VAL A 77 0.022 7.846 -7.484 1.00 51.40 H new ATOM 0 HG22 VAL A 77 1.001 6.483 -8.076 1.00 51.40 H new ATOM 0 HG23 VAL A 77 1.591 8.151 -8.265 1.00 51.40 H new ATOM 1262 N ASP A 78 0.377 6.308 -13.016 1.00 0.12 N ATOM 1263 CA ASP A 78 0.081 6.401 -14.460 1.00 14.35 C ATOM 1264 C ASP A 78 -1.114 5.494 -14.808 1.00 24.43 C ATOM 1265 O ASP A 78 -0.985 4.259 -14.760 1.00 12.24 O ATOM 1266 CB ASP A 78 1.347 5.988 -15.268 1.00 22.15 C ATOM 1267 CG ASP A 78 1.234 6.294 -16.772 1.00 74.43 C ATOM 1268 OD1 ASP A 78 1.571 7.430 -17.183 1.00 22.22 O ATOM 1269 OD2 ASP A 78 0.801 5.412 -17.547 1.00 14.25 O ATOM 0 H ASP A 78 0.608 5.363 -12.709 1.00 0.12 H new ATOM 0 HA ASP A 78 -0.184 7.426 -14.720 1.00 14.35 H new ATOM 0 HB2 ASP A 78 2.215 6.508 -14.862 1.00 22.15 H new ATOM 0 HB3 ASP A 78 1.524 4.921 -15.133 1.00 22.15 H new ATOM 1274 N ALA A 79 -2.281 6.119 -15.106 1.00 22.22 N ATOM 1275 CA ALA A 79 -3.541 5.411 -15.452 1.00 33.42 C ATOM 1276 C ALA A 79 -4.072 4.540 -14.262 1.00 20.25 C ATOM 1277 O ALA A 79 -3.378 4.380 -13.255 1.00 4.42 O ATOM 1278 CB ALA A 79 -3.345 4.582 -16.752 1.00 45.41 C ATOM 0 H ALA A 79 -2.375 7.135 -15.113 1.00 22.22 H new ATOM 0 HA ALA A 79 -4.314 6.156 -15.641 1.00 33.42 H new ATOM 0 HB1 ALA A 79 -4.273 4.066 -16.998 1.00 45.41 H new ATOM 0 HB2 ALA A 79 -3.072 5.248 -17.570 1.00 45.41 H new ATOM 0 HB3 ALA A 79 -2.552 3.849 -16.600 1.00 45.41 H new ATOM 1284 N PRO A 80 -5.326 3.986 -14.325 1.00 11.25 N ATOM 1285 CA PRO A 80 -5.788 2.911 -13.385 1.00 24.33 C ATOM 1286 C PRO A 80 -5.008 1.554 -13.478 1.00 20.30 C ATOM 1287 O PRO A 80 -5.579 0.500 -13.196 1.00 74.53 O ATOM 1288 CB PRO A 80 -7.281 2.721 -13.781 1.00 42.20 C ATOM 1289 CG PRO A 80 -7.667 4.003 -14.444 1.00 55.41 C ATOM 1290 CD PRO A 80 -6.437 4.445 -15.199 1.00 41.14 C ATOM 0 HA PRO A 80 -5.618 3.210 -12.350 1.00 24.33 H new ATOM 0 HB2 PRO A 80 -7.407 1.874 -14.455 1.00 42.20 H new ATOM 0 HB3 PRO A 80 -7.901 2.526 -12.906 1.00 42.20 H new ATOM 0 HG2 PRO A 80 -8.512 3.859 -15.118 1.00 55.41 H new ATOM 0 HG3 PRO A 80 -7.968 4.751 -13.710 1.00 55.41 H new ATOM 0 HD2 PRO A 80 -6.386 3.991 -16.189 1.00 41.14 H new ATOM 0 HD3 PRO A 80 -6.418 5.525 -15.342 1.00 41.14 H new ATOM 1298 N TYR A 81 -3.704 1.573 -13.844 1.00 13.14 N ATOM 1299 CA TYR A 81 -2.926 0.335 -14.123 1.00 11.11 C ATOM 1300 C TYR A 81 -1.538 0.324 -13.441 1.00 24.24 C ATOM 1301 O TYR A 81 -1.021 -0.753 -13.112 1.00 73.21 O ATOM 1302 CB TYR A 81 -2.787 0.131 -15.656 1.00 1.43 C ATOM 1303 CG TYR A 81 -4.151 0.032 -16.366 1.00 70.33 C ATOM 1304 CD1 TYR A 81 -4.937 -1.122 -16.244 1.00 74.53 C ATOM 1305 CD2 TYR A 81 -4.673 1.096 -17.109 1.00 0.04 C ATOM 1306 CE1 TYR A 81 -6.178 -1.209 -16.841 1.00 5.10 C ATOM 1307 CE2 TYR A 81 -5.917 1.008 -17.709 1.00 53.22 C ATOM 1308 CZ TYR A 81 -6.662 -0.143 -17.573 1.00 34.23 C ATOM 1309 OH TYR A 81 -7.904 -0.230 -18.167 1.00 2.30 O ATOM 0 H TYR A 81 -3.165 2.432 -13.954 1.00 13.14 H new ATOM 0 HA TYR A 81 -3.483 -0.497 -13.692 1.00 11.11 H new ATOM 0 HB2 TYR A 81 -2.220 0.960 -16.079 1.00 1.43 H new ATOM 0 HB3 TYR A 81 -2.215 -0.777 -15.848 1.00 1.43 H new ATOM 0 HD1 TYR A 81 -4.564 -1.959 -15.672 1.00 74.53 H new ATOM 0 HD2 TYR A 81 -4.095 2.002 -17.216 1.00 0.04 H new ATOM 0 HE1 TYR A 81 -6.768 -2.107 -16.736 1.00 5.10 H new ATOM 0 HE2 TYR A 81 -6.302 1.839 -18.282 1.00 53.22 H new ATOM 0 HH TYR A 81 -8.098 0.604 -18.644 1.00 2.30 H new ATOM 1319 N TYR A 82 -0.926 1.508 -13.228 1.00 4.21 N ATOM 1320 CA TYR A 82 0.419 1.599 -12.601 1.00 13.44 C ATOM 1321 C TYR A 82 0.449 2.618 -11.442 1.00 41.14 C ATOM 1322 O TYR A 82 0.018 3.761 -11.593 1.00 55.22 O ATOM 1323 CB TYR A 82 1.498 1.961 -13.659 1.00 1.01 C ATOM 1324 CG TYR A 82 2.943 1.930 -13.115 1.00 23.12 C ATOM 1325 CD1 TYR A 82 3.491 0.739 -12.626 1.00 4.52 C ATOM 1326 CD2 TYR A 82 3.751 3.077 -13.080 1.00 74.25 C ATOM 1327 CE1 TYR A 82 4.781 0.690 -12.132 1.00 21.41 C ATOM 1328 CE2 TYR A 82 5.046 3.028 -12.584 1.00 34.01 C ATOM 1329 CZ TYR A 82 5.553 1.834 -12.111 1.00 15.25 C ATOM 1330 OH TYR A 82 6.846 1.773 -11.631 1.00 4.34 O ATOM 0 H TYR A 82 -1.334 2.409 -13.477 1.00 4.21 H new ATOM 0 HA TYR A 82 0.644 0.617 -12.186 1.00 13.44 H new ATOM 0 HB2 TYR A 82 1.420 1.266 -14.495 1.00 1.01 H new ATOM 0 HB3 TYR A 82 1.289 2.956 -14.051 1.00 1.01 H new ATOM 0 HD1 TYR A 82 2.894 -0.161 -12.635 1.00 4.52 H new ATOM 0 HD2 TYR A 82 3.358 4.014 -13.446 1.00 74.25 H new ATOM 0 HE1 TYR A 82 5.184 -0.242 -11.763 1.00 21.41 H new ATOM 0 HE2 TYR A 82 5.655 3.920 -12.568 1.00 34.01 H new ATOM 0 HH TYR A 82 7.140 2.670 -11.368 1.00 4.34 H new ATOM 1340 N ILE A 83 0.961 2.169 -10.276 1.00 34.22 N ATOM 1341 CA ILE A 83 1.236 3.033 -9.107 1.00 11.10 C ATOM 1342 C ILE A 83 2.730 2.877 -8.722 1.00 2.41 C ATOM 1343 O ILE A 83 3.264 1.767 -8.746 1.00 64.50 O ATOM 1344 CB ILE A 83 0.342 2.682 -7.839 1.00 54.22 C ATOM 1345 CG1 ILE A 83 -1.198 2.632 -8.161 1.00 15.31 C ATOM 1346 CG2 ILE A 83 0.627 3.673 -6.673 1.00 22.15 C ATOM 1347 CD1 ILE A 83 -1.686 1.329 -8.795 1.00 61.03 C ATOM 0 H ILE A 83 1.197 1.189 -10.118 1.00 34.22 H new ATOM 0 HA ILE A 83 0.993 4.056 -9.395 1.00 11.10 H new ATOM 0 HB ILE A 83 0.626 1.676 -7.531 1.00 54.22 H new ATOM 0 HG12 ILE A 83 -1.752 2.798 -7.237 1.00 15.31 H new ATOM 0 HG13 ILE A 83 -1.440 3.457 -8.831 1.00 15.31 H new ATOM 0 HG21 ILE A 83 0.005 3.415 -5.816 1.00 22.15 H new ATOM 0 HG22 ILE A 83 1.678 3.610 -6.391 1.00 22.15 H new ATOM 0 HG23 ILE A 83 0.398 4.689 -6.995 1.00 22.15 H new ATOM 0 HD11 ILE A 83 -2.759 1.393 -8.978 1.00 61.03 H new ATOM 0 HD12 ILE A 83 -1.166 1.166 -9.739 1.00 61.03 H new ATOM 0 HD13 ILE A 83 -1.482 0.497 -8.120 1.00 61.03 H new ATOM 1359 N GLU A 84 3.399 3.988 -8.386 1.00 30.23 N ATOM 1360 CA GLU A 84 4.803 3.985 -7.909 1.00 10.23 C ATOM 1361 C GLU A 84 4.985 5.036 -6.802 1.00 25.35 C ATOM 1362 O GLU A 84 4.719 6.228 -7.023 1.00 34.42 O ATOM 1363 CB GLU A 84 5.770 4.260 -9.098 1.00 14.11 C ATOM 1364 CG GLU A 84 7.255 4.467 -8.730 1.00 11.34 C ATOM 1365 CD GLU A 84 8.157 4.622 -9.969 1.00 34.41 C ATOM 1366 OE1 GLU A 84 8.214 5.729 -10.532 1.00 31.54 O ATOM 1367 OE2 GLU A 84 8.784 3.629 -10.403 1.00 43.41 O ATOM 0 H GLU A 84 2.988 4.920 -8.435 1.00 30.23 H new ATOM 0 HA GLU A 84 5.039 3.005 -7.494 1.00 10.23 H new ATOM 0 HB2 GLU A 84 5.702 3.425 -9.796 1.00 14.11 H new ATOM 0 HB3 GLU A 84 5.420 5.147 -9.627 1.00 14.11 H new ATOM 0 HG2 GLU A 84 7.350 5.354 -8.103 1.00 11.34 H new ATOM 0 HG3 GLU A 84 7.600 3.620 -8.138 1.00 11.34 H new ATOM 1374 N TYR A 85 5.427 4.595 -5.604 1.00 32.23 N ATOM 1375 CA TYR A 85 5.730 5.503 -4.482 1.00 31.33 C ATOM 1376 C TYR A 85 6.896 4.990 -3.609 1.00 50.31 C ATOM 1377 O TYR A 85 7.238 3.798 -3.612 1.00 53.52 O ATOM 1378 CB TYR A 85 4.465 5.778 -3.613 1.00 44.23 C ATOM 1379 CG TYR A 85 3.881 4.569 -2.850 1.00 71.45 C ATOM 1380 CD1 TYR A 85 2.899 3.751 -3.422 1.00 64.34 C ATOM 1381 CD2 TYR A 85 4.299 4.266 -1.547 1.00 20.24 C ATOM 1382 CE1 TYR A 85 2.363 2.681 -2.725 1.00 32.00 C ATOM 1383 CE2 TYR A 85 3.766 3.200 -0.852 1.00 52.04 C ATOM 1384 CZ TYR A 85 2.801 2.409 -1.441 1.00 13.45 C ATOM 1385 OH TYR A 85 2.264 1.343 -0.745 1.00 31.44 O ATOM 0 H TYR A 85 5.582 3.610 -5.391 1.00 32.23 H new ATOM 0 HA TYR A 85 6.050 6.446 -4.925 1.00 31.33 H new ATOM 0 HB2 TYR A 85 4.711 6.554 -2.888 1.00 44.23 H new ATOM 0 HB3 TYR A 85 3.687 6.182 -4.260 1.00 44.23 H new ATOM 0 HD1 TYR A 85 2.554 3.958 -4.424 1.00 64.34 H new ATOM 0 HD2 TYR A 85 5.054 4.879 -1.077 1.00 20.24 H new ATOM 0 HE1 TYR A 85 1.606 2.061 -3.182 1.00 32.00 H new ATOM 0 HE2 TYR A 85 4.103 2.985 0.151 1.00 52.04 H new ATOM 0 HH TYR A 85 2.680 1.288 0.141 1.00 31.44 H new ATOM 1395 N LEU A 86 7.492 5.926 -2.857 1.00 23.21 N ATOM 1396 CA LEU A 86 8.588 5.664 -1.914 1.00 21.05 C ATOM 1397 C LEU A 86 8.070 5.884 -0.481 1.00 60.00 C ATOM 1398 O LEU A 86 7.636 6.987 -0.149 1.00 74.45 O ATOM 1399 CB LEU A 86 9.748 6.645 -2.219 1.00 32.44 C ATOM 1400 CG LEU A 86 10.251 6.678 -3.699 1.00 74.42 C ATOM 1401 CD1 LEU A 86 11.233 7.847 -3.932 1.00 31.55 C ATOM 1402 CD2 LEU A 86 10.879 5.326 -4.105 1.00 1.44 C ATOM 0 H LEU A 86 7.219 6.908 -2.888 1.00 23.21 H new ATOM 0 HA LEU A 86 8.946 4.639 -2.013 1.00 21.05 H new ATOM 0 HB2 LEU A 86 9.429 7.650 -1.943 1.00 32.44 H new ATOM 0 HB3 LEU A 86 10.591 6.390 -1.576 1.00 32.44 H new ATOM 0 HG LEU A 86 9.385 6.845 -4.339 1.00 74.42 H new ATOM 0 HD11 LEU A 86 11.564 7.842 -4.970 1.00 31.55 H new ATOM 0 HD12 LEU A 86 10.733 8.791 -3.715 1.00 31.55 H new ATOM 0 HD13 LEU A 86 12.096 7.734 -3.275 1.00 31.55 H new ATOM 0 HD21 LEU A 86 11.220 5.379 -5.139 1.00 1.44 H new ATOM 0 HD22 LEU A 86 11.726 5.108 -3.455 1.00 1.44 H new ATOM 0 HD23 LEU A 86 10.135 4.535 -4.008 1.00 1.44 H new ATOM 1414 N ASP A 87 8.149 4.865 0.371 1.00 61.04 N ATOM 1415 CA ASP A 87 7.607 4.925 1.727 1.00 31.23 C ATOM 1416 C ASP A 87 8.709 5.417 2.694 1.00 73.14 C ATOM 1417 O ASP A 87 9.590 4.653 3.108 1.00 41.51 O ATOM 1418 CB ASP A 87 7.074 3.521 2.117 1.00 52.54 C ATOM 1419 CG ASP A 87 6.234 3.529 3.397 1.00 72.45 C ATOM 1420 OD1 ASP A 87 5.066 3.967 3.334 1.00 65.44 O ATOM 1421 OD2 ASP A 87 6.724 3.085 4.463 1.00 72.10 O ATOM 0 H ASP A 87 8.590 3.974 0.142 1.00 61.04 H new ATOM 0 HA ASP A 87 6.777 5.629 1.784 1.00 31.23 H new ATOM 0 HB2 ASP A 87 6.472 3.127 1.298 1.00 52.54 H new ATOM 0 HB3 ASP A 87 7.917 2.843 2.248 1.00 52.54 H new ATOM 1426 N TYR A 88 8.641 6.706 3.041 1.00 63.41 N ATOM 1427 CA TYR A 88 9.578 7.344 3.981 1.00 15.33 C ATOM 1428 C TYR A 88 9.100 7.127 5.419 1.00 12.20 C ATOM 1429 O TYR A 88 7.912 6.957 5.675 1.00 33.44 O ATOM 1430 CB TYR A 88 9.700 8.871 3.697 1.00 72.53 C ATOM 1431 CG TYR A 88 10.563 9.253 2.482 1.00 2.43 C ATOM 1432 CD1 TYR A 88 10.249 8.809 1.196 1.00 14.44 C ATOM 1433 CD2 TYR A 88 11.697 10.062 2.628 1.00 73.40 C ATOM 1434 CE1 TYR A 88 11.030 9.157 0.107 1.00 25.25 C ATOM 1435 CE2 TYR A 88 12.474 10.410 1.543 1.00 20.03 C ATOM 1436 CZ TYR A 88 12.139 9.955 0.284 1.00 4.40 C ATOM 1437 OH TYR A 88 12.912 10.307 -0.805 1.00 20.33 O ATOM 0 H TYR A 88 7.932 7.343 2.678 1.00 63.41 H new ATOM 0 HA TYR A 88 10.559 6.887 3.847 1.00 15.33 H new ATOM 0 HB2 TYR A 88 8.699 9.277 3.551 1.00 72.53 H new ATOM 0 HB3 TYR A 88 10.114 9.355 4.581 1.00 72.53 H new ATOM 0 HD1 TYR A 88 9.381 8.183 1.048 1.00 14.44 H new ATOM 0 HD2 TYR A 88 11.968 10.420 3.610 1.00 73.40 H new ATOM 0 HE1 TYR A 88 10.770 8.803 -0.880 1.00 25.25 H new ATOM 0 HE2 TYR A 88 13.343 11.037 1.678 1.00 20.03 H new ATOM 0 HH TYR A 88 13.655 10.873 -0.509 1.00 20.33 H new ATOM 1447 N PHE A 89 10.041 7.127 6.350 1.00 24.21 N ATOM 1448 CA PHE A 89 9.737 7.145 7.787 1.00 23.33 C ATOM 1449 C PHE A 89 9.846 8.596 8.284 1.00 44.32 C ATOM 1450 O PHE A 89 10.804 9.293 7.956 1.00 71.33 O ATOM 1451 CB PHE A 89 10.689 6.181 8.533 1.00 13.22 C ATOM 1452 CG PHE A 89 10.492 4.729 8.087 1.00 54.14 C ATOM 1453 CD1 PHE A 89 11.181 4.214 6.984 1.00 23.53 C ATOM 1454 CD2 PHE A 89 9.581 3.897 8.738 1.00 54.50 C ATOM 1455 CE1 PHE A 89 10.976 2.916 6.560 1.00 51.14 C ATOM 1456 CE2 PHE A 89 9.374 2.599 8.307 1.00 14.45 C ATOM 1457 CZ PHE A 89 10.072 2.110 7.220 1.00 62.11 C ATOM 0 H PHE A 89 11.039 7.115 6.139 1.00 24.21 H new ATOM 0 HA PHE A 89 8.723 6.795 7.983 1.00 23.33 H new ATOM 0 HB2 PHE A 89 11.722 6.479 8.354 1.00 13.22 H new ATOM 0 HB3 PHE A 89 10.516 6.258 9.606 1.00 13.22 H new ATOM 0 HD1 PHE A 89 11.884 4.841 6.456 1.00 23.53 H new ATOM 0 HD2 PHE A 89 9.031 4.271 9.589 1.00 54.50 H new ATOM 0 HE1 PHE A 89 11.523 2.532 5.712 1.00 51.14 H new ATOM 0 HE2 PHE A 89 8.665 1.967 8.821 1.00 14.45 H new ATOM 0 HZ PHE A 89 9.910 1.096 6.887 1.00 62.11 H new ATOM 1467 N ALA A 90 8.825 9.060 9.012 1.00 73.30 N ATOM 1468 CA ALA A 90 8.709 10.465 9.461 1.00 0.45 C ATOM 1469 C ALA A 90 9.012 10.617 10.968 1.00 15.41 C ATOM 1470 O ALA A 90 9.283 9.634 11.666 1.00 62.35 O ATOM 1471 CB ALA A 90 7.304 10.978 9.115 1.00 71.35 C ATOM 0 H ALA A 90 8.047 8.473 9.312 1.00 73.30 H new ATOM 0 HA ALA A 90 9.454 11.067 8.941 1.00 0.45 H new ATOM 0 HB1 ALA A 90 7.204 12.013 9.441 1.00 71.35 H new ATOM 0 HB2 ALA A 90 7.151 10.920 8.037 1.00 71.35 H new ATOM 0 HB3 ALA A 90 6.558 10.365 9.621 1.00 71.35 H new ATOM 1477 N THR A 91 8.962 11.869 11.459 1.00 0.23 N ATOM 1478 CA THR A 91 9.249 12.209 12.881 1.00 73.54 C ATOM 1479 C THR A 91 8.027 12.907 13.543 1.00 21.33 C ATOM 1480 O THR A 91 6.974 13.057 12.907 1.00 33.32 O ATOM 1481 CB THR A 91 10.549 13.100 12.973 1.00 41.31 C ATOM 1482 OG1 THR A 91 10.773 13.574 14.312 1.00 25.44 O ATOM 1483 CG2 THR A 91 10.506 14.293 12.006 1.00 54.11 C ATOM 0 H THR A 91 8.722 12.679 10.888 1.00 0.23 H new ATOM 0 HA THR A 91 9.431 11.287 13.433 1.00 73.54 H new ATOM 0 HB THR A 91 11.378 12.454 12.683 1.00 41.31 H new ATOM 0 HG1 THR A 91 11.586 14.121 14.334 1.00 25.44 H new ATOM 0 HG21 THR A 91 11.422 14.876 12.106 1.00 54.11 H new ATOM 0 HG22 THR A 91 10.418 13.929 10.982 1.00 54.11 H new ATOM 0 HG23 THR A 91 9.648 14.922 12.242 1.00 54.11 H new ATOM 1491 N SER A 92 8.153 13.287 14.835 1.00 33.40 N ATOM 1492 CA SER A 92 7.121 14.084 15.565 1.00 14.00 C ATOM 1493 C SER A 92 6.917 15.491 14.939 1.00 32.33 C ATOM 1494 O SER A 92 5.848 16.094 15.078 1.00 32.53 O ATOM 1495 CB SER A 92 7.504 14.222 17.059 1.00 42.53 C ATOM 1496 OG SER A 92 8.735 14.915 17.226 1.00 72.33 O ATOM 0 H SER A 92 8.966 13.055 15.405 1.00 33.40 H new ATOM 0 HA SER A 92 6.178 13.544 15.479 1.00 14.00 H new ATOM 0 HB2 SER A 92 6.713 14.752 17.590 1.00 42.53 H new ATOM 0 HB3 SER A 92 7.580 13.232 17.508 1.00 42.53 H new ATOM 0 HG SER A 92 8.944 14.985 18.181 1.00 72.33 H new ATOM 1502 N LYS A 93 7.957 15.987 14.238 1.00 31.25 N ATOM 1503 CA LYS A 93 7.896 17.245 13.444 1.00 1.50 C ATOM 1504 C LYS A 93 7.193 17.017 12.074 1.00 51.22 C ATOM 1505 O LYS A 93 7.001 17.961 11.296 1.00 63.43 O ATOM 1506 CB LYS A 93 9.337 17.767 13.178 1.00 2.05 C ATOM 1507 CG LYS A 93 10.220 17.966 14.431 1.00 35.24 C ATOM 1508 CD LYS A 93 11.671 18.380 14.065 1.00 23.53 C ATOM 1509 CE LYS A 93 12.553 18.648 15.300 1.00 5.44 C ATOM 1510 NZ LYS A 93 12.045 19.785 16.114 1.00 12.10 N ATOM 0 H LYS A 93 8.868 15.530 14.202 1.00 31.25 H new ATOM 0 HA LYS A 93 7.324 17.973 14.019 1.00 1.50 H new ATOM 0 HB2 LYS A 93 9.839 17.068 12.510 1.00 2.05 H new ATOM 0 HB3 LYS A 93 9.267 18.718 12.650 1.00 2.05 H new ATOM 0 HG2 LYS A 93 9.776 18.730 15.069 1.00 35.24 H new ATOM 0 HG3 LYS A 93 10.242 17.042 15.009 1.00 35.24 H new ATOM 0 HD2 LYS A 93 12.127 17.593 13.465 1.00 23.53 H new ATOM 0 HD3 LYS A 93 11.641 19.276 13.446 1.00 23.53 H new ATOM 0 HE2 LYS A 93 12.594 17.751 15.917 1.00 5.44 H new ATOM 0 HE3 LYS A 93 13.572 18.860 14.978 1.00 5.44 H new ATOM 0 HZ1 LYS A 93 12.744 20.029 16.844 1.00 12.10 H new ATOM 0 HZ2 LYS A 93 11.885 20.608 15.499 1.00 12.10 H new ATOM 0 HZ3 LYS A 93 11.150 19.514 16.569 1.00 12.10 H new ATOM 1524 N GLY A 94 6.824 15.752 11.797 1.00 13.40 N ATOM 1525 CA GLY A 94 6.426 15.317 10.461 1.00 23.52 C ATOM 1526 C GLY A 94 7.649 15.101 9.577 1.00 74.13 C ATOM 1527 O GLY A 94 8.166 13.994 9.509 1.00 53.40 O ATOM 0 H GLY A 94 6.796 15.011 12.497 1.00 13.40 H new ATOM 0 HA2 GLY A 94 5.853 14.392 10.530 1.00 23.52 H new ATOM 0 HA3 GLY A 94 5.773 16.064 10.010 1.00 23.52 H new ATOM 1531 N GLU A 95 8.118 16.212 8.978 1.00 2.34 N ATOM 1532 CA GLU A 95 9.313 16.324 8.089 1.00 5.21 C ATOM 1533 C GLU A 95 9.774 14.997 7.423 1.00 20.55 C ATOM 1534 O GLU A 95 9.329 14.668 6.325 1.00 4.42 O ATOM 1535 CB GLU A 95 10.491 17.001 8.862 1.00 34.34 C ATOM 1536 CG GLU A 95 10.195 18.426 9.372 1.00 54.32 C ATOM 1537 CD GLU A 95 9.868 19.405 8.231 1.00 71.30 C ATOM 1538 OE1 GLU A 95 10.790 19.753 7.456 1.00 74.15 O ATOM 1539 OE2 GLU A 95 8.686 19.791 8.076 1.00 34.13 O ATOM 0 H GLU A 95 7.654 17.112 9.102 1.00 2.34 H new ATOM 0 HA GLU A 95 8.997 16.950 7.254 1.00 5.21 H new ATOM 0 HB2 GLU A 95 10.757 16.374 9.713 1.00 34.34 H new ATOM 0 HB3 GLU A 95 11.362 17.038 8.208 1.00 34.34 H new ATOM 0 HG2 GLU A 95 9.357 18.392 10.068 1.00 54.32 H new ATOM 0 HG3 GLU A 95 11.057 18.796 9.928 1.00 54.32 H new ATOM 1546 N LYS A 96 10.674 14.263 8.127 1.00 53.43 N ATOM 1547 CA LYS A 96 11.269 12.985 7.679 1.00 40.32 C ATOM 1548 C LYS A 96 12.282 12.487 8.739 1.00 2.42 C ATOM 1549 O LYS A 96 12.648 13.225 9.666 1.00 64.53 O ATOM 1550 CB LYS A 96 11.972 13.093 6.272 1.00 53.01 C ATOM 1551 CG LYS A 96 13.353 13.813 6.228 1.00 12.43 C ATOM 1552 CD LYS A 96 13.292 15.341 6.494 1.00 51.44 C ATOM 1553 CE LYS A 96 12.524 16.117 5.407 1.00 31.32 C ATOM 1554 NZ LYS A 96 12.474 17.573 5.704 1.00 50.42 N ATOM 0 H LYS A 96 11.012 14.554 9.044 1.00 53.43 H new ATOM 0 HA LYS A 96 10.453 12.271 7.568 1.00 40.32 H new ATOM 0 HB2 LYS A 96 12.102 12.085 5.880 1.00 53.01 H new ATOM 0 HB3 LYS A 96 11.296 13.614 5.594 1.00 53.01 H new ATOM 0 HG2 LYS A 96 14.011 13.355 6.966 1.00 12.43 H new ATOM 0 HG3 LYS A 96 13.805 13.645 5.250 1.00 12.43 H new ATOM 0 HD2 LYS A 96 12.818 15.516 7.460 1.00 51.44 H new ATOM 0 HD3 LYS A 96 14.307 15.732 6.562 1.00 51.44 H new ATOM 0 HE2 LYS A 96 13.002 15.959 4.440 1.00 31.32 H new ATOM 0 HE3 LYS A 96 11.509 15.726 5.329 1.00 31.32 H new ATOM 0 HZ1 LYS A 96 11.506 17.924 5.560 1.00 50.42 H new ATOM 0 HZ2 LYS A 96 12.758 17.736 6.691 1.00 50.42 H new ATOM 0 HZ3 LYS A 96 13.123 18.079 5.069 1.00 50.42 H new ATOM 1568 N ASP A 97 12.721 11.235 8.595 1.00 14.12 N ATOM 1569 CA ASP A 97 13.770 10.624 9.436 1.00 3.24 C ATOM 1570 C ASP A 97 15.066 10.429 8.605 1.00 33.20 C ATOM 1571 O ASP A 97 15.019 9.994 7.450 1.00 21.00 O ATOM 1572 CB ASP A 97 13.242 9.286 10.026 1.00 21.21 C ATOM 1573 CG ASP A 97 14.325 8.450 10.720 1.00 22.11 C ATOM 1574 OD1 ASP A 97 14.780 8.848 11.814 1.00 11.32 O ATOM 1575 OD2 ASP A 97 14.738 7.406 10.170 1.00 52.24 O ATOM 0 H ASP A 97 12.357 10.602 7.883 1.00 14.12 H new ATOM 0 HA ASP A 97 14.017 11.282 10.269 1.00 3.24 H new ATOM 0 HB2 ASP A 97 12.448 9.502 10.741 1.00 21.21 H new ATOM 0 HB3 ASP A 97 12.797 8.696 9.225 1.00 21.21 H new ATOM 1580 N THR A 98 16.215 10.765 9.217 1.00 31.14 N ATOM 1581 CA THR A 98 17.542 10.723 8.553 1.00 15.45 C ATOM 1582 C THR A 98 18.043 9.271 8.324 1.00 74.42 C ATOM 1583 O THR A 98 18.719 8.994 7.328 1.00 22.20 O ATOM 1584 CB THR A 98 18.617 11.511 9.395 1.00 72.32 C ATOM 1585 OG1 THR A 98 18.126 12.822 9.730 1.00 73.14 O ATOM 1586 CG2 THR A 98 19.960 11.666 8.647 1.00 24.31 C ATOM 0 H THR A 98 16.256 11.075 10.188 1.00 31.14 H new ATOM 0 HA THR A 98 17.413 11.198 7.580 1.00 15.45 H new ATOM 0 HB THR A 98 18.793 10.924 10.296 1.00 72.32 H new ATOM 0 HG1 THR A 98 18.802 13.300 10.254 1.00 73.14 H new ATOM 0 HG21 THR A 98 20.663 12.216 9.272 1.00 24.31 H new ATOM 0 HG22 THR A 98 20.368 10.680 8.423 1.00 24.31 H new ATOM 0 HG23 THR A 98 19.798 12.211 7.717 1.00 24.31 H new ATOM 1594 N SER A 99 17.672 8.348 9.234 1.00 14.22 N ATOM 1595 CA SER A 99 18.257 6.990 9.289 1.00 4.22 C ATOM 1596 C SER A 99 17.751 6.088 8.139 1.00 23.34 C ATOM 1597 O SER A 99 18.548 5.569 7.350 1.00 50.21 O ATOM 1598 CB SER A 99 17.959 6.336 10.657 1.00 71.11 C ATOM 1599 OG SER A 99 18.506 5.028 10.746 1.00 3.21 O ATOM 0 H SER A 99 16.964 8.519 9.948 1.00 14.22 H new ATOM 0 HA SER A 99 19.335 7.094 9.166 1.00 4.22 H new ATOM 0 HB2 SER A 99 18.369 6.957 11.454 1.00 71.11 H new ATOM 0 HB3 SER A 99 16.881 6.291 10.811 1.00 71.11 H new ATOM 0 HG SER A 99 18.300 4.646 11.625 1.00 3.21 H new ATOM 1605 N MET A 100 16.420 5.920 8.034 1.00 31.12 N ATOM 1606 CA MET A 100 15.808 4.978 7.067 1.00 2.12 C ATOM 1607 C MET A 100 15.294 5.707 5.795 1.00 33.14 C ATOM 1608 O MET A 100 14.720 6.795 5.889 1.00 71.32 O ATOM 1609 CB MET A 100 14.669 4.180 7.741 1.00 33.24 C ATOM 1610 CG MET A 100 15.091 3.465 9.029 1.00 1.30 C ATOM 1611 SD MET A 100 13.819 2.346 9.664 1.00 62.42 S ATOM 1612 CE MET A 100 13.762 1.084 8.387 1.00 75.24 C ATOM 0 H MET A 100 15.743 6.424 8.607 1.00 31.12 H new ATOM 0 HA MET A 100 16.583 4.282 6.748 1.00 2.12 H new ATOM 0 HB2 MET A 100 13.847 4.859 7.966 1.00 33.24 H new ATOM 0 HB3 MET A 100 14.288 3.442 7.035 1.00 33.24 H new ATOM 0 HG2 MET A 100 16.004 2.900 8.842 1.00 1.30 H new ATOM 0 HG3 MET A 100 15.326 4.208 9.791 1.00 1.30 H new ATOM 0 HE1 MET A 100 12.794 1.117 7.886 1.00 75.24 H new ATOM 0 HE2 MET A 100 14.553 1.266 7.660 1.00 75.24 H new ATOM 0 HE3 MET A 100 13.903 0.102 8.839 1.00 75.24 H new ATOM 1622 N PRO A 101 15.486 5.092 4.583 1.00 72.34 N ATOM 1623 CA PRO A 101 15.192 5.736 3.272 1.00 2.11 C ATOM 1624 C PRO A 101 13.730 5.540 2.768 1.00 45.44 C ATOM 1625 O PRO A 101 12.848 5.089 3.509 1.00 61.32 O ATOM 1626 CB PRO A 101 16.209 5.009 2.359 1.00 23.30 C ATOM 1627 CG PRO A 101 16.220 3.595 2.884 1.00 62.31 C ATOM 1628 CD PRO A 101 15.999 3.705 4.390 1.00 25.30 C ATOM 0 HA PRO A 101 15.280 6.822 3.307 1.00 2.11 H new ATOM 0 HB2 PRO A 101 15.904 5.045 1.313 1.00 23.30 H new ATOM 0 HB3 PRO A 101 17.197 5.465 2.419 1.00 23.30 H new ATOM 0 HG2 PRO A 101 15.436 2.999 2.417 1.00 62.31 H new ATOM 0 HG3 PRO A 101 17.168 3.104 2.663 1.00 62.31 H new ATOM 0 HD2 PRO A 101 15.283 2.963 4.743 1.00 25.30 H new ATOM 0 HD3 PRO A 101 16.925 3.542 4.942 1.00 25.30 H new ATOM 1636 N GLY A 102 13.504 5.907 1.485 1.00 20.01 N ATOM 1637 CA GLY A 102 12.208 5.729 0.815 1.00 60.35 C ATOM 1638 C GLY A 102 12.000 4.309 0.275 1.00 24.33 C ATOM 1639 O GLY A 102 12.453 3.983 -0.831 1.00 0.34 O ATOM 0 H GLY A 102 14.217 6.333 0.892 1.00 20.01 H new ATOM 0 HA2 GLY A 102 11.408 5.965 1.516 1.00 60.35 H new ATOM 0 HA3 GLY A 102 12.131 6.439 -0.008 1.00 60.35 H new ATOM 1643 N MET A 103 11.317 3.478 1.079 1.00 33.04 N ATOM 1644 CA MET A 103 10.985 2.069 0.755 1.00 72.21 C ATOM 1645 C MET A 103 10.214 1.929 -0.598 1.00 1.44 C ATOM 1646 O MET A 103 9.116 2.446 -0.765 1.00 11.22 O ATOM 1647 CB MET A 103 10.178 1.471 1.939 1.00 1.04 C ATOM 1648 CG MET A 103 9.585 0.089 1.673 1.00 75.45 C ATOM 1649 SD MET A 103 10.805 -1.106 1.095 1.00 71.25 S ATOM 1650 CE MET A 103 9.727 -2.386 0.457 1.00 44.54 C ATOM 0 H MET A 103 10.970 3.767 1.994 1.00 33.04 H new ATOM 0 HA MET A 103 11.911 1.511 0.619 1.00 72.21 H new ATOM 0 HB2 MET A 103 10.829 1.410 2.811 1.00 1.04 H new ATOM 0 HB3 MET A 103 9.369 2.156 2.192 1.00 1.04 H new ATOM 0 HG2 MET A 103 9.125 -0.284 2.588 1.00 75.45 H new ATOM 0 HG3 MET A 103 8.792 0.177 0.930 1.00 75.45 H new ATOM 0 HE1 MET A 103 10.327 -3.171 -0.004 1.00 44.54 H new ATOM 0 HE2 MET A 103 9.142 -2.809 1.273 1.00 44.54 H new ATOM 0 HE3 MET A 103 9.055 -1.958 -0.287 1.00 44.54 H new ATOM 1660 N HIS A 104 10.800 1.181 -1.535 1.00 73.24 N ATOM 1661 CA HIS A 104 10.363 1.153 -2.950 1.00 63.20 C ATOM 1662 C HIS A 104 9.170 0.183 -3.185 1.00 42.13 C ATOM 1663 O HIS A 104 9.352 -1.028 -3.177 1.00 43.33 O ATOM 1664 CB HIS A 104 11.569 0.743 -3.833 1.00 54.43 C ATOM 1665 CG HIS A 104 12.793 1.592 -3.620 1.00 0.35 C ATOM 1666 ND1 HIS A 104 13.682 1.374 -2.588 1.00 61.43 N ATOM 1667 CD2 HIS A 104 13.263 2.672 -4.286 1.00 11.12 C ATOM 1668 CE1 HIS A 104 14.632 2.278 -2.627 1.00 2.31 C ATOM 1669 NE2 HIS A 104 14.408 3.079 -3.648 1.00 52.31 N ATOM 0 H HIS A 104 11.595 0.572 -1.342 1.00 73.24 H new ATOM 0 HA HIS A 104 10.012 2.149 -3.219 1.00 63.20 H new ATOM 0 HB2 HIS A 104 11.820 -0.298 -3.629 1.00 54.43 H new ATOM 0 HB3 HIS A 104 11.276 0.800 -4.881 1.00 54.43 H new ATOM 0 HD2 HIS A 104 12.819 3.129 -5.158 1.00 11.12 H new ATOM 0 HE1 HIS A 104 15.460 2.353 -1.937 1.00 2.31 H new ATOM 0 HE2 HIS A 104 14.990 3.871 -3.920 1.00 52.31 H new ATOM 1678 N ILE A 105 7.938 0.728 -3.339 1.00 75.20 N ATOM 1679 CA ILE A 105 6.744 -0.062 -3.770 1.00 12.14 C ATOM 1680 C ILE A 105 6.278 0.418 -5.168 1.00 45.45 C ATOM 1681 O ILE A 105 5.938 1.596 -5.351 1.00 30.43 O ATOM 1682 CB ILE A 105 5.513 0.012 -2.754 1.00 42.32 C ATOM 1683 CG1 ILE A 105 5.759 -0.787 -1.436 1.00 41.21 C ATOM 1684 CG2 ILE A 105 4.213 -0.519 -3.404 1.00 33.12 C ATOM 1685 CD1 ILE A 105 6.806 -0.218 -0.515 1.00 74.44 C ATOM 0 H ILE A 105 7.739 1.714 -3.172 1.00 75.20 H new ATOM 0 HA ILE A 105 7.065 -1.103 -3.796 1.00 12.14 H new ATOM 0 HB ILE A 105 5.410 1.068 -2.506 1.00 42.32 H new ATOM 0 HG12 ILE A 105 4.818 -0.852 -0.891 1.00 41.21 H new ATOM 0 HG13 ILE A 105 6.046 -1.805 -1.698 1.00 41.21 H new ATOM 0 HG21 ILE A 105 3.395 -0.455 -2.686 1.00 33.12 H new ATOM 0 HG22 ILE A 105 3.974 0.081 -4.282 1.00 33.12 H new ATOM 0 HG23 ILE A 105 4.353 -1.558 -3.702 1.00 33.12 H new ATOM 0 HD11 ILE A 105 6.896 -0.850 0.368 1.00 74.44 H new ATOM 0 HD12 ILE A 105 7.764 -0.180 -1.033 1.00 74.44 H new ATOM 0 HD13 ILE A 105 6.517 0.789 -0.213 1.00 74.44 H new ATOM 1697 N THR A 106 6.278 -0.504 -6.145 1.00 23.15 N ATOM 1698 CA THR A 106 5.708 -0.275 -7.492 1.00 53.40 C ATOM 1699 C THR A 106 4.700 -1.391 -7.820 1.00 60.25 C ATOM 1700 O THR A 106 5.074 -2.559 -7.926 1.00 42.43 O ATOM 1701 CB THR A 106 6.826 -0.245 -8.589 1.00 61.13 C ATOM 1702 OG1 THR A 106 7.567 -1.481 -8.593 1.00 41.11 O ATOM 1703 CG2 THR A 106 7.798 0.920 -8.366 1.00 70.21 C ATOM 0 H THR A 106 6.675 -1.436 -6.026 1.00 23.15 H new ATOM 0 HA THR A 106 5.208 0.694 -7.488 1.00 53.40 H new ATOM 0 HB THR A 106 6.330 -0.111 -9.551 1.00 61.13 H new ATOM 0 HG1 THR A 106 8.260 -1.445 -9.285 1.00 41.11 H new ATOM 0 HG21 THR A 106 8.561 0.911 -9.144 1.00 70.21 H new ATOM 0 HG22 THR A 106 7.251 1.862 -8.404 1.00 70.21 H new ATOM 0 HG23 THR A 106 8.274 0.815 -7.391 1.00 70.21 H new ATOM 1711 N LEU A 107 3.417 -1.034 -7.988 1.00 63.14 N ATOM 1712 CA LEU A 107 2.343 -2.019 -8.230 1.00 5.14 C ATOM 1713 C LEU A 107 1.941 -2.029 -9.729 1.00 32.13 C ATOM 1714 O LEU A 107 1.758 -0.974 -10.345 1.00 64.41 O ATOM 1715 CB LEU A 107 1.104 -1.753 -7.327 1.00 74.22 C ATOM 1716 CG LEU A 107 1.375 -1.413 -5.809 1.00 10.33 C ATOM 1717 CD1 LEU A 107 1.579 0.101 -5.599 1.00 1.13 C ATOM 1718 CD2 LEU A 107 0.241 -1.949 -4.902 1.00 15.14 C ATOM 0 H LEU A 107 3.094 -0.067 -7.961 1.00 63.14 H new ATOM 0 HA LEU A 107 2.732 -3.003 -7.968 1.00 5.14 H new ATOM 0 HB2 LEU A 107 0.540 -0.928 -7.762 1.00 74.22 H new ATOM 0 HB3 LEU A 107 0.462 -2.633 -7.366 1.00 74.22 H new ATOM 0 HG LEU A 107 2.299 -1.916 -5.523 1.00 10.33 H new ATOM 0 HD11 LEU A 107 1.763 0.300 -4.543 1.00 1.13 H new ATOM 0 HD12 LEU A 107 2.433 0.438 -6.186 1.00 1.13 H new ATOM 0 HD13 LEU A 107 0.685 0.636 -5.919 1.00 1.13 H new ATOM 0 HD21 LEU A 107 0.457 -1.699 -3.863 1.00 15.14 H new ATOM 0 HD22 LEU A 107 -0.705 -1.494 -5.195 1.00 15.14 H new ATOM 0 HD23 LEU A 107 0.172 -3.032 -5.008 1.00 15.14 H new ATOM 1730 N ASN A 108 1.791 -3.242 -10.277 1.00 33.14 N ATOM 1731 CA ASN A 108 1.605 -3.516 -11.725 1.00 44.44 C ATOM 1732 C ASN A 108 0.452 -4.526 -11.924 1.00 52.23 C ATOM 1733 O ASN A 108 0.073 -5.212 -10.988 1.00 61.40 O ATOM 1734 CB ASN A 108 2.913 -4.101 -12.326 1.00 21.14 C ATOM 1735 CG ASN A 108 4.070 -3.106 -12.336 1.00 2.32 C ATOM 1736 OD1 ASN A 108 4.799 -2.967 -11.360 1.00 33.35 O ATOM 1737 ND2 ASN A 108 4.261 -2.413 -13.442 1.00 41.10 N ATOM 0 H ASN A 108 1.795 -4.093 -9.715 1.00 33.14 H new ATOM 0 HA ASN A 108 1.361 -2.583 -12.232 1.00 44.44 H new ATOM 0 HB2 ASN A 108 3.205 -4.982 -11.754 1.00 21.14 H new ATOM 0 HB3 ASN A 108 2.719 -4.433 -13.346 1.00 21.14 H new ATOM 0 HD21 ASN A 108 5.029 -1.744 -13.498 1.00 41.10 H new ATOM 0 HD22 ASN A 108 3.641 -2.546 -14.241 1.00 41.10 H new ATOM 1744 N PHE A 109 -0.120 -4.596 -13.134 1.00 40.14 N ATOM 1745 CA PHE A 109 -1.143 -5.622 -13.477 1.00 42.24 C ATOM 1746 C PHE A 109 -0.512 -6.955 -13.944 1.00 34.13 C ATOM 1747 O PHE A 109 0.577 -6.980 -14.528 1.00 10.42 O ATOM 1748 CB PHE A 109 -2.131 -5.072 -14.547 1.00 34.52 C ATOM 1749 CG PHE A 109 -3.341 -4.369 -13.953 1.00 54.21 C ATOM 1750 CD1 PHE A 109 -3.186 -3.272 -13.116 1.00 2.42 C ATOM 1751 CD2 PHE A 109 -4.633 -4.828 -14.211 1.00 64.24 C ATOM 1752 CE1 PHE A 109 -4.281 -2.651 -12.563 1.00 23.23 C ATOM 1753 CE2 PHE A 109 -5.724 -4.207 -13.656 1.00 32.00 C ATOM 1754 CZ PHE A 109 -5.548 -3.119 -12.835 1.00 44.34 C ATOM 0 H PHE A 109 0.101 -3.959 -13.899 1.00 40.14 H new ATOM 0 HA PHE A 109 -1.697 -5.839 -12.564 1.00 42.24 H new ATOM 0 HB2 PHE A 109 -1.600 -4.377 -15.197 1.00 34.52 H new ATOM 0 HB3 PHE A 109 -2.471 -5.897 -15.173 1.00 34.52 H new ATOM 0 HD1 PHE A 109 -2.195 -2.903 -12.897 1.00 2.42 H new ATOM 0 HD2 PHE A 109 -4.776 -5.683 -14.855 1.00 64.24 H new ATOM 0 HE1 PHE A 109 -4.148 -1.797 -11.916 1.00 23.23 H new ATOM 0 HE2 PHE A 109 -6.719 -4.573 -13.864 1.00 32.00 H new ATOM 0 HZ PHE A 109 -6.407 -2.629 -12.401 1.00 44.34 H new ATOM 1764 N GLU A 110 -1.233 -8.058 -13.669 1.00 23.40 N ATOM 1765 CA GLU A 110 -0.829 -9.428 -14.051 1.00 73.43 C ATOM 1766 C GLU A 110 -2.052 -10.207 -14.589 1.00 72.32 C ATOM 1767 O GLU A 110 -2.941 -10.563 -13.811 1.00 13.32 O ATOM 1768 CB GLU A 110 -0.217 -10.153 -12.818 1.00 42.42 C ATOM 1769 CG GLU A 110 0.277 -11.592 -13.078 1.00 50.52 C ATOM 1770 CD GLU A 110 0.877 -12.252 -11.824 1.00 71.10 C ATOM 1771 OE1 GLU A 110 2.031 -11.914 -11.456 1.00 52.21 O ATOM 1772 OE2 GLU A 110 0.201 -13.101 -11.202 1.00 34.45 O ATOM 0 H GLU A 110 -2.122 -8.025 -13.170 1.00 23.40 H new ATOM 0 HA GLU A 110 -0.077 -9.380 -14.839 1.00 73.43 H new ATOM 0 HB2 GLU A 110 0.619 -9.561 -12.447 1.00 42.42 H new ATOM 0 HB3 GLU A 110 -0.965 -10.181 -12.025 1.00 42.42 H new ATOM 0 HG2 GLU A 110 -0.555 -12.197 -13.439 1.00 50.52 H new ATOM 0 HG3 GLU A 110 1.027 -11.577 -13.869 1.00 50.52 H new ATOM 1779 N GLU A 111 -2.091 -10.421 -15.928 1.00 43.34 N ATOM 1780 CA GLU A 111 -3.114 -11.245 -16.634 1.00 53.35 C ATOM 1781 C GLU A 111 -4.527 -10.573 -16.617 1.00 72.03 C ATOM 1782 O GLU A 111 -5.100 -10.310 -15.554 1.00 61.05 O ATOM 1783 CB GLU A 111 -3.139 -12.705 -16.057 1.00 42.24 C ATOM 1784 CG GLU A 111 -3.499 -13.829 -17.059 1.00 72.31 C ATOM 1785 CD GLU A 111 -4.957 -13.829 -17.554 1.00 40.30 C ATOM 1786 OE1 GLU A 111 -5.812 -14.464 -16.903 1.00 12.35 O ATOM 1787 OE2 GLU A 111 -5.249 -13.219 -18.606 1.00 73.04 O ATOM 0 H GLU A 111 -1.401 -10.020 -16.563 1.00 43.34 H new ATOM 0 HA GLU A 111 -2.827 -11.309 -17.684 1.00 53.35 H new ATOM 0 HB2 GLU A 111 -2.158 -12.923 -15.635 1.00 42.24 H new ATOM 0 HB3 GLU A 111 -3.854 -12.737 -15.235 1.00 42.24 H new ATOM 0 HG2 GLU A 111 -2.840 -13.747 -17.923 1.00 72.31 H new ATOM 0 HG3 GLU A 111 -3.292 -14.791 -16.590 1.00 72.31 H new ATOM 1794 N VAL A 112 -5.078 -10.325 -17.818 1.00 63.21 N ATOM 1795 CA VAL A 112 -6.376 -9.628 -17.995 1.00 33.20 C ATOM 1796 C VAL A 112 -7.609 -10.546 -17.681 1.00 23.31 C ATOM 1797 O VAL A 112 -7.870 -11.535 -18.371 1.00 1.42 O ATOM 1798 CB VAL A 112 -6.484 -9.007 -19.447 1.00 32.13 C ATOM 1799 CG1 VAL A 112 -5.468 -7.851 -19.639 1.00 20.31 C ATOM 1800 CG2 VAL A 112 -6.295 -10.081 -20.556 1.00 34.03 C ATOM 0 H VAL A 112 -4.640 -10.600 -18.697 1.00 63.21 H new ATOM 0 HA VAL A 112 -6.401 -8.819 -17.265 1.00 33.20 H new ATOM 0 HB VAL A 112 -7.492 -8.604 -19.543 1.00 32.13 H new ATOM 0 HG11 VAL A 112 -5.566 -7.444 -20.646 1.00 20.31 H new ATOM 0 HG12 VAL A 112 -5.668 -7.066 -18.909 1.00 20.31 H new ATOM 0 HG13 VAL A 112 -4.456 -8.229 -19.497 1.00 20.31 H new ATOM 0 HG21 VAL A 112 -6.377 -9.611 -21.536 1.00 34.03 H new ATOM 0 HG22 VAL A 112 -5.311 -10.539 -20.455 1.00 34.03 H new ATOM 0 HG23 VAL A 112 -7.064 -10.847 -20.456 1.00 34.03 H new ATOM 1810 N LYS A 113 -8.361 -10.198 -16.608 1.00 1.43 N ATOM 1811 CA LYS A 113 -9.603 -10.922 -16.188 1.00 65.35 C ATOM 1812 C LYS A 113 -10.791 -9.945 -15.971 1.00 4.52 C ATOM 1813 O LYS A 113 -10.689 -8.751 -16.264 1.00 22.21 O ATOM 1814 CB LYS A 113 -9.351 -11.735 -14.877 1.00 63.24 C ATOM 1815 CG LYS A 113 -8.317 -12.870 -15.002 1.00 64.05 C ATOM 1816 CD LYS A 113 -8.196 -13.711 -13.708 1.00 64.52 C ATOM 1817 CE LYS A 113 -7.165 -14.844 -13.840 1.00 11.41 C ATOM 1818 NZ LYS A 113 -7.082 -15.672 -12.619 1.00 3.33 N ATOM 0 H LYS A 113 -8.130 -9.409 -16.005 1.00 1.43 H new ATOM 0 HA LYS A 113 -9.864 -11.607 -16.995 1.00 65.35 H new ATOM 0 HB2 LYS A 113 -9.020 -11.047 -14.099 1.00 63.24 H new ATOM 0 HB3 LYS A 113 -10.297 -12.161 -14.544 1.00 63.24 H new ATOM 0 HG2 LYS A 113 -8.597 -13.522 -15.830 1.00 64.05 H new ATOM 0 HG3 LYS A 113 -7.344 -12.444 -15.247 1.00 64.05 H new ATOM 0 HD2 LYS A 113 -7.913 -13.061 -12.880 1.00 64.52 H new ATOM 0 HD3 LYS A 113 -9.169 -14.136 -13.462 1.00 64.52 H new ATOM 0 HE2 LYS A 113 -7.430 -15.476 -14.688 1.00 11.41 H new ATOM 0 HE3 LYS A 113 -6.185 -14.417 -14.054 1.00 11.41 H new ATOM 0 HZ1 LYS A 113 -6.375 -16.422 -12.756 1.00 3.33 H new ATOM 0 HZ2 LYS A 113 -6.804 -15.076 -11.814 1.00 3.33 H new ATOM 0 HZ3 LYS A 113 -8.009 -16.102 -12.427 1.00 3.33 H new ATOM 1832 N GLY A 114 -11.931 -10.482 -15.475 1.00 64.55 N ATOM 1833 CA GLY A 114 -13.075 -9.650 -15.057 1.00 3.25 C ATOM 1834 C GLY A 114 -12.822 -8.964 -13.708 1.00 1.34 C ATOM 1835 O GLY A 114 -13.200 -7.803 -13.494 1.00 40.40 O ATOM 0 H GLY A 114 -12.079 -11.484 -15.356 1.00 64.55 H new ATOM 0 HA2 GLY A 114 -13.271 -8.894 -15.817 1.00 3.25 H new ATOM 0 HA3 GLY A 114 -13.968 -10.270 -14.987 1.00 3.25 H new ATOM 1839 N LYS A 115 -12.181 -9.715 -12.797 1.00 63.53 N ATOM 1840 CA LYS A 115 -11.683 -9.200 -11.508 1.00 72.51 C ATOM 1841 C LYS A 115 -10.348 -8.438 -11.699 1.00 1.13 C ATOM 1842 O LYS A 115 -9.555 -8.766 -12.593 1.00 34.34 O ATOM 1843 CB LYS A 115 -11.443 -10.363 -10.521 1.00 73.42 C ATOM 1844 CG LYS A 115 -12.671 -11.205 -10.146 1.00 75.13 C ATOM 1845 CD LYS A 115 -12.287 -12.341 -9.163 1.00 53.51 C ATOM 1846 CE LYS A 115 -13.466 -13.245 -8.804 1.00 0.31 C ATOM 1847 NZ LYS A 115 -13.073 -14.345 -7.887 1.00 40.40 N ATOM 0 H LYS A 115 -11.991 -10.708 -12.935 1.00 63.53 H new ATOM 0 HA LYS A 115 -12.438 -8.522 -11.110 1.00 72.51 H new ATOM 0 HB2 LYS A 115 -10.692 -11.026 -10.951 1.00 73.42 H new ATOM 0 HB3 LYS A 115 -11.018 -9.952 -9.605 1.00 73.42 H new ATOM 0 HG2 LYS A 115 -13.429 -10.567 -9.692 1.00 75.13 H new ATOM 0 HG3 LYS A 115 -13.112 -11.632 -11.047 1.00 75.13 H new ATOM 0 HD2 LYS A 115 -11.495 -12.945 -9.606 1.00 53.51 H new ATOM 0 HD3 LYS A 115 -11.881 -11.903 -8.251 1.00 53.51 H new ATOM 0 HE2 LYS A 115 -14.250 -12.648 -8.337 1.00 0.31 H new ATOM 0 HE3 LYS A 115 -13.888 -13.668 -9.716 1.00 0.31 H new ATOM 0 HZ1 LYS A 115 -13.905 -14.931 -7.672 1.00 40.40 H new ATOM 0 HZ2 LYS A 115 -12.344 -14.932 -8.341 1.00 40.40 H new ATOM 0 HZ3 LYS A 115 -12.695 -13.944 -7.005 1.00 40.40 H new ATOM 1861 N THR A 116 -10.100 -7.442 -10.835 1.00 25.15 N ATOM 1862 CA THR A 116 -8.840 -6.666 -10.851 1.00 71.04 C ATOM 1863 C THR A 116 -7.699 -7.447 -10.142 1.00 5.42 C ATOM 1864 O THR A 116 -7.881 -7.928 -9.019 1.00 72.42 O ATOM 1865 CB THR A 116 -9.027 -5.275 -10.162 1.00 25.55 C ATOM 1866 OG1 THR A 116 -10.126 -4.569 -10.768 1.00 63.02 O ATOM 1867 CG2 THR A 116 -7.760 -4.410 -10.266 1.00 31.52 C ATOM 0 H THR A 116 -10.756 -7.150 -10.111 1.00 25.15 H new ATOM 0 HA THR A 116 -8.568 -6.508 -11.895 1.00 71.04 H new ATOM 0 HB THR A 116 -9.232 -5.460 -9.108 1.00 25.55 H new ATOM 0 HG1 THR A 116 -10.962 -4.821 -10.323 1.00 63.02 H new ATOM 0 HG21 THR A 116 -7.932 -3.452 -9.775 1.00 31.52 H new ATOM 0 HG22 THR A 116 -6.929 -4.922 -9.781 1.00 31.52 H new ATOM 0 HG23 THR A 116 -7.520 -4.242 -11.316 1.00 31.52 H new ATOM 1875 N THR A 117 -6.513 -7.526 -10.786 1.00 3.42 N ATOM 1876 CA THR A 117 -5.343 -8.279 -10.266 1.00 14.35 C ATOM 1877 C THR A 117 -4.102 -7.372 -10.285 1.00 30.43 C ATOM 1878 O THR A 117 -3.658 -6.930 -11.353 1.00 5.30 O ATOM 1879 CB THR A 117 -5.060 -9.584 -11.089 1.00 62.51 C ATOM 1880 OG1 THR A 117 -6.226 -10.428 -11.075 1.00 24.44 O ATOM 1881 CG2 THR A 117 -3.858 -10.381 -10.530 1.00 23.41 C ATOM 0 H THR A 117 -6.337 -7.070 -11.681 1.00 3.42 H new ATOM 0 HA THR A 117 -5.573 -8.584 -9.245 1.00 14.35 H new ATOM 0 HB THR A 117 -4.818 -9.278 -12.107 1.00 62.51 H new ATOM 0 HG1 THR A 117 -6.047 -11.242 -11.591 1.00 24.44 H new ATOM 0 HG21 THR A 117 -3.702 -11.275 -11.133 1.00 23.41 H new ATOM 0 HG22 THR A 117 -2.963 -9.760 -10.563 1.00 23.41 H new ATOM 0 HG23 THR A 117 -4.061 -10.670 -9.499 1.00 23.41 H new ATOM 1889 N VAL A 118 -3.552 -7.096 -9.091 1.00 13.44 N ATOM 1890 CA VAL A 118 -2.443 -6.142 -8.896 1.00 43.45 C ATOM 1891 C VAL A 118 -1.256 -6.817 -8.156 1.00 72.55 C ATOM 1892 O VAL A 118 -1.366 -7.226 -7.004 1.00 71.52 O ATOM 1893 CB VAL A 118 -2.962 -4.858 -8.131 1.00 2.52 C ATOM 1894 CG1 VAL A 118 -1.807 -3.953 -7.626 1.00 41.41 C ATOM 1895 CG2 VAL A 118 -3.925 -4.040 -9.029 1.00 43.12 C ATOM 0 H VAL A 118 -3.866 -7.532 -8.224 1.00 13.44 H new ATOM 0 HA VAL A 118 -2.072 -5.825 -9.871 1.00 43.45 H new ATOM 0 HB VAL A 118 -3.499 -5.215 -7.252 1.00 2.52 H new ATOM 0 HG11 VAL A 118 -2.222 -3.088 -7.109 1.00 41.41 H new ATOM 0 HG12 VAL A 118 -1.176 -4.518 -6.940 1.00 41.41 H new ATOM 0 HG13 VAL A 118 -1.210 -3.617 -8.474 1.00 41.41 H new ATOM 0 HG21 VAL A 118 -4.271 -3.161 -8.485 1.00 43.12 H new ATOM 0 HG22 VAL A 118 -3.402 -3.725 -9.932 1.00 43.12 H new ATOM 0 HG23 VAL A 118 -4.780 -4.658 -9.302 1.00 43.12 H new ATOM 1905 N THR A 119 -0.144 -6.960 -8.873 1.00 0.32 N ATOM 1906 CA THR A 119 1.129 -7.484 -8.351 1.00 64.23 C ATOM 1907 C THR A 119 2.039 -6.339 -7.821 1.00 11.13 C ATOM 1908 O THR A 119 2.548 -5.533 -8.601 1.00 74.51 O ATOM 1909 CB THR A 119 1.865 -8.271 -9.487 1.00 23.55 C ATOM 1910 OG1 THR A 119 1.021 -9.330 -9.959 1.00 63.21 O ATOM 1911 CG2 THR A 119 3.200 -8.862 -9.029 1.00 71.02 C ATOM 0 H THR A 119 -0.096 -6.710 -9.861 1.00 0.32 H new ATOM 0 HA THR A 119 0.914 -8.150 -7.515 1.00 64.23 H new ATOM 0 HB THR A 119 2.078 -7.559 -10.284 1.00 23.55 H new ATOM 0 HG1 THR A 119 1.572 -10.033 -10.362 1.00 63.21 H new ATOM 0 HG21 THR A 119 3.665 -9.396 -9.858 1.00 71.02 H new ATOM 0 HG22 THR A 119 3.859 -8.059 -8.699 1.00 71.02 H new ATOM 0 HG23 THR A 119 3.028 -9.552 -8.203 1.00 71.02 H new ATOM 1919 N SER A 120 2.228 -6.268 -6.488 1.00 51.14 N ATOM 1920 CA SER A 120 3.106 -5.262 -5.845 1.00 45.22 C ATOM 1921 C SER A 120 4.585 -5.732 -5.809 1.00 45.40 C ATOM 1922 O SER A 120 4.934 -6.669 -5.093 1.00 34.31 O ATOM 1923 CB SER A 120 2.618 -4.956 -4.402 1.00 21.04 C ATOM 1924 OG SER A 120 2.817 -6.046 -3.513 1.00 74.43 O ATOM 0 H SER A 120 1.780 -6.902 -5.827 1.00 51.14 H new ATOM 0 HA SER A 120 3.052 -4.353 -6.445 1.00 45.22 H new ATOM 0 HB2 SER A 120 3.146 -4.082 -4.022 1.00 21.04 H new ATOM 0 HB3 SER A 120 1.558 -4.702 -4.427 1.00 21.04 H new ATOM 0 HG SER A 120 3.585 -6.576 -3.812 1.00 74.43 H new ATOM 1930 N THR A 121 5.437 -5.080 -6.598 1.00 32.52 N ATOM 1931 CA THR A 121 6.902 -5.271 -6.544 1.00 51.43 C ATOM 1932 C THR A 121 7.499 -4.379 -5.426 1.00 4.22 C ATOM 1933 O THR A 121 7.673 -3.167 -5.607 1.00 25.03 O ATOM 1934 CB THR A 121 7.549 -4.937 -7.933 1.00 15.31 C ATOM 1935 OG1 THR A 121 7.002 -5.802 -8.942 1.00 43.41 O ATOM 1936 CG2 THR A 121 9.083 -5.075 -7.931 1.00 34.41 C ATOM 0 H THR A 121 5.139 -4.400 -7.298 1.00 32.52 H new ATOM 0 HA THR A 121 7.122 -6.314 -6.316 1.00 51.43 H new ATOM 0 HB THR A 121 7.315 -3.894 -8.146 1.00 15.31 H new ATOM 0 HG1 THR A 121 7.407 -5.590 -9.809 1.00 43.41 H new ATOM 0 HG21 THR A 121 9.472 -4.831 -8.920 1.00 34.41 H new ATOM 0 HG22 THR A 121 9.509 -4.393 -7.195 1.00 34.41 H new ATOM 0 HG23 THR A 121 9.356 -6.099 -7.677 1.00 34.41 H new ATOM 1944 N SER A 122 7.767 -4.987 -4.256 1.00 72.45 N ATOM 1945 CA SER A 122 8.266 -4.260 -3.062 1.00 55.44 C ATOM 1946 C SER A 122 9.765 -4.545 -2.831 1.00 21.12 C ATOM 1947 O SER A 122 10.133 -5.616 -2.351 1.00 62.12 O ATOM 1948 CB SER A 122 7.440 -4.662 -1.813 1.00 12.25 C ATOM 1949 OG SER A 122 6.062 -4.347 -1.977 1.00 41.44 O ATOM 0 H SER A 122 7.647 -5.989 -4.106 1.00 72.45 H new ATOM 0 HA SER A 122 8.149 -3.190 -3.235 1.00 55.44 H new ATOM 0 HB2 SER A 122 7.551 -5.731 -1.630 1.00 12.25 H new ATOM 0 HB3 SER A 122 7.830 -4.146 -0.936 1.00 12.25 H new ATOM 0 HG SER A 122 5.568 -4.614 -1.174 1.00 41.44 H new ATOM 1955 N THR A 123 10.623 -3.572 -3.173 1.00 51.20 N ATOM 1956 CA THR A 123 12.091 -3.692 -3.031 1.00 24.40 C ATOM 1957 C THR A 123 12.567 -3.097 -1.679 1.00 30.02 C ATOM 1958 O THR A 123 12.625 -1.870 -1.503 1.00 30.30 O ATOM 1959 CB THR A 123 12.835 -3.000 -4.224 1.00 40.54 C ATOM 1960 OG1 THR A 123 12.359 -3.543 -5.471 1.00 74.42 O ATOM 1961 CG2 THR A 123 14.360 -3.195 -4.144 1.00 43.25 C ATOM 0 H THR A 123 10.323 -2.676 -3.557 1.00 51.20 H new ATOM 0 HA THR A 123 12.338 -4.754 -3.047 1.00 24.40 H new ATOM 0 HB THR A 123 12.625 -1.932 -4.165 1.00 40.54 H new ATOM 0 HG1 THR A 123 12.824 -3.108 -6.216 1.00 74.42 H new ATOM 0 HG21 THR A 123 14.835 -2.699 -4.990 1.00 43.25 H new ATOM 0 HG22 THR A 123 14.734 -2.765 -3.215 1.00 43.25 H new ATOM 0 HG23 THR A 123 14.593 -4.260 -4.170 1.00 43.25 H new ATOM 1969 N PHE A 124 12.865 -4.000 -0.733 1.00 3.44 N ATOM 1970 CA PHE A 124 13.376 -3.677 0.622 1.00 25.40 C ATOM 1971 C PHE A 124 14.887 -3.281 0.597 1.00 52.10 C ATOM 1972 O PHE A 124 15.592 -3.594 -0.372 1.00 50.02 O ATOM 1973 CB PHE A 124 13.137 -4.901 1.557 1.00 25.40 C ATOM 1974 CG PHE A 124 11.661 -5.193 1.864 1.00 11.43 C ATOM 1975 CD1 PHE A 124 10.834 -5.809 0.919 1.00 13.14 C ATOM 1976 CD2 PHE A 124 11.107 -4.864 3.104 1.00 0.25 C ATOM 1977 CE1 PHE A 124 9.509 -6.083 1.206 1.00 74.23 C ATOM 1978 CE2 PHE A 124 9.780 -5.139 3.388 1.00 64.41 C ATOM 1979 CZ PHE A 124 8.981 -5.746 2.440 1.00 61.41 C ATOM 0 H PHE A 124 12.757 -5.003 -0.886 1.00 3.44 H new ATOM 0 HA PHE A 124 12.834 -2.811 1.002 1.00 25.40 H new ATOM 0 HB2 PHE A 124 13.580 -5.784 1.098 1.00 25.40 H new ATOM 0 HB3 PHE A 124 13.663 -4.732 2.496 1.00 25.40 H new ATOM 0 HD1 PHE A 124 11.235 -6.074 -0.048 1.00 13.14 H new ATOM 0 HD2 PHE A 124 11.723 -4.388 3.852 1.00 0.25 H new ATOM 0 HE1 PHE A 124 8.885 -6.561 0.465 1.00 74.23 H new ATOM 0 HE2 PHE A 124 9.370 -4.878 4.352 1.00 64.41 H new ATOM 0 HZ PHE A 124 7.945 -5.958 2.661 1.00 61.41 H new ATOM 1989 N PRO A 125 15.398 -2.567 1.666 1.00 52.22 N ATOM 1990 CA PRO A 125 16.815 -2.113 1.745 1.00 15.44 C ATOM 1991 C PRO A 125 17.841 -3.258 2.054 1.00 31.21 C ATOM 1992 O PRO A 125 18.286 -3.447 3.193 1.00 73.35 O ATOM 1993 CB PRO A 125 16.765 -1.029 2.857 1.00 31.25 C ATOM 1994 CG PRO A 125 15.658 -1.475 3.767 1.00 32.21 C ATOM 1995 CD PRO A 125 14.625 -2.135 2.868 1.00 23.44 C ATOM 0 HA PRO A 125 17.181 -1.738 0.789 1.00 15.44 H new ATOM 0 HB2 PRO A 125 17.714 -0.962 3.389 1.00 31.25 H new ATOM 0 HB3 PRO A 125 16.563 -0.042 2.441 1.00 31.25 H new ATOM 0 HG2 PRO A 125 16.027 -2.174 4.518 1.00 32.21 H new ATOM 0 HG3 PRO A 125 15.227 -0.629 4.303 1.00 32.21 H new ATOM 0 HD2 PRO A 125 14.153 -2.984 3.362 1.00 23.44 H new ATOM 0 HD3 PRO A 125 13.830 -1.439 2.600 1.00 23.44 H new ATOM 2003 N THR A 126 18.143 -4.034 1.001 1.00 41.50 N ATOM 2004 CA THR A 126 19.265 -5.011 0.922 1.00 3.41 C ATOM 2005 C THR A 126 19.309 -6.107 2.037 1.00 20.24 C ATOM 2006 O THR A 126 18.439 -6.990 2.050 1.00 20.03 O ATOM 2007 CB THR A 126 20.658 -4.298 0.729 1.00 71.24 C ATOM 2008 OG1 THR A 126 21.030 -3.553 1.903 1.00 72.12 O ATOM 2009 CG2 THR A 126 20.629 -3.339 -0.476 1.00 51.21 C ATOM 0 H THR A 126 17.596 -4.004 0.141 1.00 41.50 H new ATOM 0 HA THR A 126 19.043 -5.582 0.020 1.00 3.41 H new ATOM 0 HB THR A 126 21.393 -5.083 0.551 1.00 71.24 H new ATOM 0 HG1 THR A 126 21.898 -3.123 1.756 1.00 72.12 H new ATOM 0 HG21 THR A 126 21.603 -2.862 -0.585 1.00 51.21 H new ATOM 0 HG22 THR A 126 20.397 -3.899 -1.382 1.00 51.21 H new ATOM 0 HG23 THR A 126 19.867 -2.576 -0.316 1.00 51.21 H new ATOM 2017 N GLU A 127 20.289 -6.029 2.980 1.00 41.43 N ATOM 2018 CA GLU A 127 20.718 -7.194 3.805 1.00 12.52 C ATOM 2019 C GLU A 127 19.611 -7.702 4.758 1.00 71.54 C ATOM 2020 O GLU A 127 19.355 -7.109 5.819 1.00 21.41 O ATOM 2021 CB GLU A 127 22.013 -6.865 4.603 1.00 54.04 C ATOM 2022 CG GLU A 127 22.545 -8.024 5.476 1.00 15.35 C ATOM 2023 CD GLU A 127 23.872 -7.702 6.174 1.00 75.31 C ATOM 2024 OE1 GLU A 127 23.851 -7.061 7.249 1.00 30.12 O ATOM 2025 OE2 GLU A 127 24.944 -8.087 5.651 1.00 71.25 O ATOM 0 H GLU A 127 20.797 -5.169 3.188 1.00 41.43 H new ATOM 0 HA GLU A 127 20.927 -8.003 3.105 1.00 12.52 H new ATOM 0 HB2 GLU A 127 22.792 -6.571 3.900 1.00 54.04 H new ATOM 0 HB3 GLU A 127 21.820 -6.004 5.244 1.00 54.04 H new ATOM 0 HG2 GLU A 127 21.798 -8.274 6.230 1.00 15.35 H new ATOM 0 HG3 GLU A 127 22.676 -8.908 4.852 1.00 15.35 H new ATOM 2032 N SER A 128 18.930 -8.777 4.311 1.00 30.40 N ATOM 2033 CA SER A 128 17.910 -9.523 5.087 1.00 23.44 C ATOM 2034 C SER A 128 16.672 -8.674 5.473 1.00 62.42 C ATOM 2035 O SER A 128 15.813 -9.139 6.212 1.00 41.32 O ATOM 2036 CB SER A 128 18.540 -10.190 6.340 1.00 15.15 C ATOM 2037 OG SER A 128 19.521 -11.159 5.982 1.00 62.32 O ATOM 0 H SER A 128 19.075 -9.162 3.378 1.00 30.40 H new ATOM 0 HA SER A 128 17.541 -10.302 4.420 1.00 23.44 H new ATOM 0 HB2 SER A 128 18.996 -9.426 6.969 1.00 15.15 H new ATOM 0 HB3 SER A 128 17.758 -10.665 6.932 1.00 15.15 H new ATOM 0 HG SER A 128 19.898 -11.558 6.794 1.00 62.32 H new ATOM 2043 N ALA A 129 16.563 -7.453 4.924 1.00 40.11 N ATOM 2044 CA ALA A 129 15.449 -6.523 5.225 1.00 20.34 C ATOM 2045 C ALA A 129 14.090 -7.084 4.741 1.00 12.42 C ATOM 2046 O ALA A 129 13.060 -6.951 5.416 1.00 71.14 O ATOM 2047 CB ALA A 129 15.744 -5.160 4.593 1.00 2.51 C ATOM 0 H ALA A 129 17.240 -7.078 4.260 1.00 40.11 H new ATOM 0 HA ALA A 129 15.372 -6.407 6.306 1.00 20.34 H new ATOM 0 HB1 ALA A 129 14.927 -4.473 4.812 1.00 2.51 H new ATOM 0 HB2 ALA A 129 16.672 -4.762 5.003 1.00 2.51 H new ATOM 0 HB3 ALA A 129 15.843 -5.273 3.513 1.00 2.51 H new ATOM 2053 N ALA A 130 14.117 -7.715 3.557 1.00 54.23 N ATOM 2054 CA ALA A 130 12.948 -8.429 2.988 1.00 75.20 C ATOM 2055 C ALA A 130 12.750 -9.822 3.632 1.00 30.14 C ATOM 2056 O ALA A 130 11.635 -10.356 3.659 1.00 51.02 O ATOM 2057 CB ALA A 130 13.119 -8.543 1.472 1.00 34.21 C ATOM 0 H ALA A 130 14.945 -7.749 2.963 1.00 54.23 H new ATOM 0 HA ALA A 130 12.049 -7.854 3.211 1.00 75.20 H new ATOM 0 HB1 ALA A 130 12.263 -9.067 1.048 1.00 34.21 H new ATOM 0 HB2 ALA A 130 13.186 -7.546 1.037 1.00 34.21 H new ATOM 0 HB3 ALA A 130 14.031 -9.098 1.249 1.00 34.21 H new ATOM 2063 N GLN A 131 13.858 -10.409 4.116 1.00 64.10 N ATOM 2064 CA GLN A 131 13.859 -11.703 4.844 1.00 23.42 C ATOM 2065 C GLN A 131 13.056 -11.618 6.158 1.00 63.53 C ATOM 2066 O GLN A 131 12.258 -12.504 6.455 1.00 22.34 O ATOM 2067 CB GLN A 131 15.311 -12.152 5.152 1.00 64.44 C ATOM 2068 CG GLN A 131 15.447 -13.439 5.994 1.00 43.41 C ATOM 2069 CD GLN A 131 14.941 -14.685 5.264 1.00 25.12 C ATOM 2070 OE1 GLN A 131 15.674 -15.316 4.508 1.00 62.23 O ATOM 2071 NE2 GLN A 131 13.693 -15.056 5.494 1.00 65.44 N ATOM 0 H GLN A 131 14.788 -10.001 4.016 1.00 64.10 H new ATOM 0 HA GLN A 131 13.380 -12.438 4.197 1.00 23.42 H new ATOM 0 HB2 GLN A 131 15.834 -12.300 4.207 1.00 64.44 H new ATOM 0 HB3 GLN A 131 15.820 -11.342 5.675 1.00 64.44 H new ATOM 0 HG2 GLN A 131 16.493 -13.582 6.263 1.00 43.41 H new ATOM 0 HG3 GLN A 131 14.892 -13.319 6.924 1.00 43.41 H new ATOM 0 HE21 GLN A 131 13.108 -14.512 6.127 1.00 65.44 H new ATOM 0 HE22 GLN A 131 13.316 -15.887 5.038 1.00 65.44 H new ATOM 2080 N GLN A 132 13.286 -10.543 6.935 1.00 73.42 N ATOM 2081 CA GLN A 132 12.586 -10.315 8.221 1.00 72.20 C ATOM 2082 C GLN A 132 11.044 -10.258 8.036 1.00 64.41 C ATOM 2083 O GLN A 132 10.295 -10.642 8.939 1.00 41.44 O ATOM 2084 CB GLN A 132 13.101 -9.013 8.925 1.00 20.32 C ATOM 2085 CG GLN A 132 14.285 -9.210 9.902 1.00 11.54 C ATOM 2086 CD GLN A 132 15.592 -9.662 9.247 1.00 62.12 C ATOM 2087 OE1 GLN A 132 15.839 -10.849 9.060 1.00 11.13 O ATOM 2088 NE2 GLN A 132 16.447 -8.714 8.906 1.00 23.11 N ATOM 0 H GLN A 132 13.956 -9.812 6.695 1.00 73.42 H new ATOM 0 HA GLN A 132 12.814 -11.166 8.862 1.00 72.20 H new ATOM 0 HB2 GLN A 132 13.400 -8.300 8.157 1.00 20.32 H new ATOM 0 HB3 GLN A 132 12.272 -8.564 9.472 1.00 20.32 H new ATOM 0 HG2 GLN A 132 14.464 -8.272 10.427 1.00 11.54 H new ATOM 0 HG3 GLN A 132 13.999 -9.946 10.653 1.00 11.54 H new ATOM 0 HE21 GLN A 132 16.216 -7.735 9.073 1.00 23.11 H new ATOM 0 HE22 GLN A 132 17.338 -8.962 8.476 1.00 23.11 H new ATOM 2097 N ALA A 133 10.595 -9.768 6.862 1.00 15.14 N ATOM 2098 CA ALA A 133 9.167 -9.757 6.479 1.00 23.15 C ATOM 2099 C ALA A 133 8.629 -11.193 6.218 1.00 53.21 C ATOM 2100 O ALA A 133 7.484 -11.502 6.561 1.00 20.44 O ATOM 2101 CB ALA A 133 8.957 -8.855 5.256 1.00 34.05 C ATOM 0 H ALA A 133 11.211 -9.369 6.153 1.00 15.14 H new ATOM 0 HA ALA A 133 8.596 -9.352 7.314 1.00 23.15 H new ATOM 0 HB1 ALA A 133 7.902 -8.854 4.982 1.00 34.05 H new ATOM 0 HB2 ALA A 133 9.271 -7.839 5.495 1.00 34.05 H new ATOM 0 HB3 ALA A 133 9.548 -9.231 4.421 1.00 34.05 H new ATOM 2107 N ILE A 134 9.469 -12.065 5.617 1.00 74.12 N ATOM 2108 CA ILE A 134 9.145 -13.510 5.429 1.00 1.35 C ATOM 2109 C ILE A 134 8.960 -14.203 6.806 1.00 51.31 C ATOM 2110 O ILE A 134 7.985 -14.936 7.026 1.00 71.43 O ATOM 2111 CB ILE A 134 10.266 -14.266 4.611 1.00 64.34 C ATOM 2112 CG1 ILE A 134 10.524 -13.581 3.231 1.00 73.32 C ATOM 2113 CG2 ILE A 134 9.928 -15.771 4.425 1.00 14.31 C ATOM 2114 CD1 ILE A 134 9.355 -13.611 2.260 1.00 52.53 C ATOM 0 H ILE A 134 10.382 -11.798 5.250 1.00 74.12 H new ATOM 0 HA ILE A 134 8.217 -13.560 4.860 1.00 1.35 H new ATOM 0 HB ILE A 134 11.184 -14.204 5.196 1.00 64.34 H new ATOM 0 HG12 ILE A 134 10.802 -12.542 3.407 1.00 73.32 H new ATOM 0 HG13 ILE A 134 11.379 -14.064 2.759 1.00 73.32 H new ATOM 0 HG21 ILE A 134 10.723 -16.255 3.858 1.00 14.31 H new ATOM 0 HG22 ILE A 134 9.837 -16.247 5.401 1.00 14.31 H new ATOM 0 HG23 ILE A 134 8.986 -15.868 3.885 1.00 14.31 H new ATOM 0 HD11 ILE A 134 9.638 -13.110 1.334 1.00 52.53 H new ATOM 0 HD12 ILE A 134 9.087 -14.645 2.045 1.00 52.53 H new ATOM 0 HD13 ILE A 134 8.501 -13.099 2.703 1.00 52.53 H new ATOM 2126 N ASP A 135 9.903 -13.929 7.729 1.00 3.13 N ATOM 2127 CA ASP A 135 9.844 -14.401 9.132 1.00 53.51 C ATOM 2128 C ASP A 135 8.655 -13.775 9.910 1.00 21.32 C ATOM 2129 O ASP A 135 8.147 -14.370 10.865 1.00 33.33 O ATOM 2130 CB ASP A 135 11.182 -14.087 9.843 1.00 64.24 C ATOM 2131 CG ASP A 135 12.339 -14.950 9.319 1.00 73.55 C ATOM 2132 OD1 ASP A 135 12.468 -16.108 9.777 1.00 70.01 O ATOM 2133 OD2 ASP A 135 13.103 -14.497 8.441 1.00 12.30 O ATOM 0 H ASP A 135 10.732 -13.371 7.524 1.00 3.13 H new ATOM 0 HA ASP A 135 9.682 -15.479 9.116 1.00 53.51 H new ATOM 0 HB2 ASP A 135 11.426 -13.034 9.704 1.00 64.24 H new ATOM 0 HB3 ASP A 135 11.068 -14.249 10.915 1.00 64.24 H new ATOM 2138 N MET A 136 8.227 -12.571 9.490 1.00 23.24 N ATOM 2139 CA MET A 136 7.039 -11.875 10.052 1.00 4.32 C ATOM 2140 C MET A 136 5.720 -12.502 9.510 1.00 10.14 C ATOM 2141 O MET A 136 4.638 -12.290 10.068 1.00 13.10 O ATOM 2142 CB MET A 136 7.119 -10.359 9.693 1.00 65.25 C ATOM 2143 CG MET A 136 6.110 -9.450 10.407 1.00 62.31 C ATOM 2144 SD MET A 136 6.299 -9.479 12.203 1.00 44.34 S ATOM 2145 CE MET A 136 7.972 -8.856 12.421 1.00 62.21 C ATOM 0 H MET A 136 8.692 -12.046 8.749 1.00 23.24 H new ATOM 0 HA MET A 136 7.035 -11.990 11.136 1.00 4.32 H new ATOM 0 HB2 MET A 136 8.124 -10.004 9.920 1.00 65.25 H new ATOM 0 HB3 MET A 136 6.979 -10.252 8.617 1.00 65.25 H new ATOM 0 HG2 MET A 136 6.231 -8.428 10.049 1.00 62.31 H new ATOM 0 HG3 MET A 136 5.098 -9.761 10.147 1.00 62.31 H new ATOM 0 HE1 MET A 136 8.122 -8.573 13.463 1.00 62.21 H new ATOM 0 HE2 MET A 136 8.688 -9.632 12.149 1.00 62.21 H new ATOM 0 HE3 MET A 136 8.122 -7.985 11.783 1.00 62.21 H new ATOM 2155 N GLY A 137 5.837 -13.302 8.431 1.00 71.05 N ATOM 2156 CA GLY A 137 4.679 -13.906 7.765 1.00 54.12 C ATOM 2157 C GLY A 137 4.023 -12.945 6.776 1.00 34.24 C ATOM 2158 O GLY A 137 2.817 -12.697 6.853 1.00 64.33 O ATOM 0 H GLY A 137 6.732 -13.542 8.004 1.00 71.05 H new ATOM 0 HA2 GLY A 137 4.992 -14.808 7.240 1.00 54.12 H new ATOM 0 HA3 GLY A 137 3.948 -14.211 8.514 1.00 54.12 H new ATOM 2162 N VAL A 138 4.843 -12.412 5.842 1.00 44.33 N ATOM 2163 CA VAL A 138 4.434 -11.358 4.877 1.00 13.31 C ATOM 2164 C VAL A 138 3.196 -11.743 4.032 1.00 54.41 C ATOM 2165 O VAL A 138 2.369 -10.891 3.741 1.00 0.24 O ATOM 2166 CB VAL A 138 5.626 -10.966 3.923 1.00 72.45 C ATOM 2167 CG1 VAL A 138 6.090 -12.169 3.062 1.00 65.14 C ATOM 2168 CG2 VAL A 138 5.278 -9.737 3.040 1.00 72.43 C ATOM 0 H VAL A 138 5.815 -12.701 5.733 1.00 44.33 H new ATOM 0 HA VAL A 138 4.153 -10.498 5.486 1.00 13.31 H new ATOM 0 HB VAL A 138 6.463 -10.680 4.560 1.00 72.45 H new ATOM 0 HG11 VAL A 138 6.913 -11.859 2.418 1.00 65.14 H new ATOM 0 HG12 VAL A 138 6.424 -12.976 3.714 1.00 65.14 H new ATOM 0 HG13 VAL A 138 5.260 -12.519 2.448 1.00 65.14 H new ATOM 0 HG21 VAL A 138 6.126 -9.499 2.397 1.00 72.43 H new ATOM 0 HG22 VAL A 138 4.408 -9.966 2.424 1.00 72.43 H new ATOM 0 HG23 VAL A 138 5.056 -8.882 3.678 1.00 72.43 H new ATOM 2178 N GLU A 139 3.066 -13.028 3.670 1.00 12.41 N ATOM 2179 CA GLU A 139 1.950 -13.499 2.832 1.00 74.31 C ATOM 2180 C GLU A 139 0.598 -13.332 3.563 1.00 24.50 C ATOM 2181 O GLU A 139 -0.315 -12.685 3.053 1.00 45.45 O ATOM 2182 CB GLU A 139 2.173 -14.969 2.414 1.00 23.21 C ATOM 2183 CG GLU A 139 1.141 -15.483 1.387 1.00 71.55 C ATOM 2184 CD GLU A 139 1.492 -16.847 0.781 1.00 71.12 C ATOM 2185 OE1 GLU A 139 2.632 -17.011 0.290 1.00 45.21 O ATOM 2186 OE2 GLU A 139 0.614 -17.733 0.702 1.00 3.11 O ATOM 0 H GLU A 139 3.720 -13.761 3.944 1.00 12.41 H new ATOM 0 HA GLU A 139 1.918 -12.887 1.931 1.00 74.31 H new ATOM 0 HB2 GLU A 139 3.173 -15.071 1.993 1.00 23.21 H new ATOM 0 HB3 GLU A 139 2.135 -15.600 3.302 1.00 23.21 H new ATOM 0 HG2 GLU A 139 0.166 -15.551 1.870 1.00 71.55 H new ATOM 0 HG3 GLU A 139 1.048 -14.753 0.583 1.00 71.55 H new ATOM 2193 N THR A 140 0.522 -13.870 4.791 1.00 70.32 N ATOM 2194 CA THR A 140 -0.676 -13.764 5.653 1.00 75.01 C ATOM 2195 C THR A 140 -0.937 -12.289 6.084 1.00 22.24 C ATOM 2196 O THR A 140 -2.091 -11.848 6.143 1.00 55.21 O ATOM 2197 CB THR A 140 -0.522 -14.669 6.924 1.00 52.23 C ATOM 2198 OG1 THR A 140 -0.207 -16.019 6.531 1.00 42.23 O ATOM 2199 CG2 THR A 140 -1.795 -14.686 7.794 1.00 5.32 C ATOM 0 H THR A 140 1.287 -14.392 5.218 1.00 70.32 H new ATOM 0 HA THR A 140 -1.531 -14.107 5.070 1.00 75.01 H new ATOM 0 HB THR A 140 0.286 -14.244 7.519 1.00 52.23 H new ATOM 0 HG1 THR A 140 -0.111 -16.578 7.330 1.00 42.23 H new ATOM 0 HG21 THR A 140 -1.635 -15.327 8.661 1.00 5.32 H new ATOM 0 HG22 THR A 140 -2.021 -13.673 8.129 1.00 5.32 H new ATOM 0 HG23 THR A 140 -2.631 -15.069 7.209 1.00 5.32 H new ATOM 2207 N GLY A 141 0.157 -11.540 6.344 1.00 54.42 N ATOM 2208 CA GLY A 141 0.084 -10.130 6.774 1.00 62.14 C ATOM 2209 C GLY A 141 -0.509 -9.199 5.713 1.00 64.10 C ATOM 2210 O GLY A 141 -1.428 -8.422 5.997 1.00 61.32 O ATOM 0 H GLY A 141 1.110 -11.895 6.262 1.00 54.42 H new ATOM 0 HA2 GLY A 141 -0.518 -10.065 7.680 1.00 62.14 H new ATOM 0 HA3 GLY A 141 1.085 -9.784 7.031 1.00 62.14 H new ATOM 2214 N MET A 142 0.019 -9.300 4.477 1.00 42.15 N ATOM 2215 CA MET A 142 -0.515 -8.571 3.306 1.00 33.12 C ATOM 2216 C MET A 142 -1.971 -8.997 3.021 1.00 0.23 C ATOM 2217 O MET A 142 -2.814 -8.152 2.782 1.00 14.14 O ATOM 2218 CB MET A 142 0.349 -8.808 2.042 1.00 41.22 C ATOM 2219 CG MET A 142 1.787 -8.284 2.121 1.00 61.15 C ATOM 2220 SD MET A 142 1.891 -6.496 2.358 1.00 35.32 S ATOM 2221 CE MET A 142 3.672 -6.240 2.358 1.00 3.34 C ATOM 0 H MET A 142 0.825 -9.887 4.261 1.00 42.15 H new ATOM 0 HA MET A 142 -0.487 -7.508 3.547 1.00 33.12 H new ATOM 0 HB2 MET A 142 0.381 -9.879 1.840 1.00 41.22 H new ATOM 0 HB3 MET A 142 -0.145 -8.338 1.192 1.00 41.22 H new ATOM 0 HG2 MET A 142 2.302 -8.782 2.943 1.00 61.15 H new ATOM 0 HG3 MET A 142 2.314 -8.552 1.205 1.00 61.15 H new ATOM 0 HE1 MET A 142 3.887 -5.178 2.478 1.00 3.34 H new ATOM 0 HE2 MET A 142 4.119 -6.796 3.182 1.00 3.34 H new ATOM 0 HE3 MET A 142 4.090 -6.591 1.414 1.00 3.34 H new ATOM 2231 N ASN A 143 -2.251 -10.321 3.077 1.00 61.44 N ATOM 2232 CA ASN A 143 -3.622 -10.871 2.893 1.00 62.33 C ATOM 2233 C ASN A 143 -4.638 -10.282 3.905 1.00 53.51 C ATOM 2234 O ASN A 143 -5.802 -10.121 3.564 1.00 34.50 O ATOM 2235 CB ASN A 143 -3.627 -12.430 2.991 1.00 42.02 C ATOM 2236 CG ASN A 143 -3.114 -13.131 1.727 1.00 0.34 C ATOM 2237 OD1 ASN A 143 -3.328 -12.666 0.612 1.00 14.14 O ATOM 2238 ND2 ASN A 143 -2.434 -14.255 1.886 1.00 21.11 N ATOM 0 H ASN A 143 -1.543 -11.035 3.249 1.00 61.44 H new ATOM 0 HA ASN A 143 -3.935 -10.574 1.892 1.00 62.33 H new ATOM 0 HB2 ASN A 143 -3.012 -12.733 3.838 1.00 42.02 H new ATOM 0 HB3 ASN A 143 -4.643 -12.769 3.196 1.00 42.02 H new ATOM 0 HD21 ASN A 143 -2.075 -14.754 1.072 1.00 21.11 H new ATOM 0 HD22 ASN A 143 -2.268 -14.623 2.823 1.00 21.11 H new ATOM 2245 N SER A 144 -4.193 -9.979 5.143 1.00 31.55 N ATOM 2246 CA SER A 144 -5.072 -9.399 6.206 1.00 33.40 C ATOM 2247 C SER A 144 -5.304 -7.874 6.020 1.00 13.32 C ATOM 2248 O SER A 144 -6.405 -7.374 6.280 1.00 12.43 O ATOM 2249 CB SER A 144 -4.480 -9.671 7.608 1.00 44.24 C ATOM 2250 OG SER A 144 -4.403 -11.063 7.885 1.00 14.11 O ATOM 0 H SER A 144 -3.228 -10.123 5.441 1.00 31.55 H new ATOM 0 HA SER A 144 -6.040 -9.892 6.116 1.00 33.40 H new ATOM 0 HB2 SER A 144 -3.485 -9.231 7.674 1.00 44.24 H new ATOM 0 HB3 SER A 144 -5.095 -9.183 8.364 1.00 44.24 H new ATOM 0 HG SER A 144 -3.671 -11.460 7.368 1.00 14.11 H new ATOM 2256 N THR A 145 -4.261 -7.141 5.588 1.00 3.05 N ATOM 2257 CA THR A 145 -4.361 -5.683 5.295 1.00 22.43 C ATOM 2258 C THR A 145 -5.227 -5.437 4.025 1.00 20.31 C ATOM 2259 O THR A 145 -6.013 -4.486 3.944 1.00 71.12 O ATOM 2260 CB THR A 145 -2.934 -5.060 5.108 1.00 23.43 C ATOM 2261 OG1 THR A 145 -2.104 -5.418 6.227 1.00 75.44 O ATOM 2262 CG2 THR A 145 -2.968 -3.525 4.987 1.00 22.12 C ATOM 0 H THR A 145 -3.331 -7.529 5.431 1.00 3.05 H new ATOM 0 HA THR A 145 -4.844 -5.197 6.143 1.00 22.43 H new ATOM 0 HB THR A 145 -2.530 -5.459 4.177 1.00 23.43 H new ATOM 0 HG1 THR A 145 -1.865 -6.366 6.167 1.00 75.44 H new ATOM 0 HG21 THR A 145 -1.953 -3.148 4.859 1.00 22.12 H new ATOM 0 HG22 THR A 145 -3.572 -3.241 4.125 1.00 22.12 H new ATOM 0 HG23 THR A 145 -3.403 -3.098 5.891 1.00 22.12 H new ATOM 2270 N LEU A 146 -5.059 -6.333 3.046 1.00 14.32 N ATOM 2271 CA LEU A 146 -5.872 -6.387 1.812 1.00 41.50 C ATOM 2272 C LEU A 146 -7.261 -7.015 2.073 1.00 41.21 C ATOM 2273 O LEU A 146 -8.179 -6.834 1.276 1.00 75.31 O ATOM 2274 CB LEU A 146 -5.110 -7.158 0.710 1.00 14.02 C ATOM 2275 CG LEU A 146 -3.751 -6.517 0.264 1.00 4.01 C ATOM 2276 CD1 LEU A 146 -2.965 -7.463 -0.648 1.00 22.40 C ATOM 2277 CD2 LEU A 146 -3.957 -5.149 -0.420 1.00 31.10 C ATOM 0 H LEU A 146 -4.342 -7.058 3.084 1.00 14.32 H new ATOM 0 HA LEU A 146 -6.042 -5.366 1.471 1.00 41.50 H new ATOM 0 HB2 LEU A 146 -4.917 -8.170 1.065 1.00 14.02 H new ATOM 0 HB3 LEU A 146 -5.756 -7.245 -0.163 1.00 14.02 H new ATOM 0 HG LEU A 146 -3.167 -6.349 1.169 1.00 4.01 H new ATOM 0 HD11 LEU A 146 -2.027 -6.991 -0.941 1.00 22.40 H new ATOM 0 HD12 LEU A 146 -2.753 -8.390 -0.115 1.00 22.40 H new ATOM 0 HD13 LEU A 146 -3.554 -7.683 -1.538 1.00 22.40 H new ATOM 0 HD21 LEU A 146 -2.990 -4.740 -0.713 1.00 31.10 H new ATOM 0 HD22 LEU A 146 -4.581 -5.275 -1.305 1.00 31.10 H new ATOM 0 HD23 LEU A 146 -4.445 -4.465 0.274 1.00 31.10 H new ATOM 2289 N ASN A 147 -7.387 -7.809 3.158 1.00 62.10 N ATOM 2290 CA ASN A 147 -8.703 -8.308 3.649 1.00 1.50 C ATOM 2291 C ASN A 147 -9.566 -7.128 4.149 1.00 1.51 C ATOM 2292 O ASN A 147 -10.781 -7.120 3.966 1.00 73.24 O ATOM 2293 CB ASN A 147 -8.507 -9.347 4.789 1.00 34.31 C ATOM 2294 CG ASN A 147 -9.740 -10.186 5.113 1.00 61.13 C ATOM 2295 OD1 ASN A 147 -10.018 -10.489 6.271 1.00 43.45 O ATOM 2296 ND2 ASN A 147 -10.460 -10.622 4.104 1.00 61.42 N ATOM 0 H ASN A 147 -6.594 -8.123 3.717 1.00 62.10 H new ATOM 0 HA ASN A 147 -9.216 -8.798 2.821 1.00 1.50 H new ATOM 0 HB2 ASN A 147 -7.692 -10.017 4.514 1.00 34.31 H new ATOM 0 HB3 ASN A 147 -8.197 -8.820 5.691 1.00 34.31 H new ATOM 0 HD21 ASN A 147 -11.266 -11.223 4.275 1.00 61.42 H new ATOM 0 HD22 ASN A 147 -10.213 -10.359 3.150 1.00 61.42 H new ATOM 2303 N GLN A 148 -8.906 -6.134 4.783 1.00 63.32 N ATOM 2304 CA GLN A 148 -9.542 -4.843 5.147 1.00 31.22 C ATOM 2305 C GLN A 148 -10.006 -4.089 3.874 1.00 34.41 C ATOM 2306 O GLN A 148 -11.080 -3.481 3.856 1.00 71.34 O ATOM 2307 CB GLN A 148 -8.551 -3.953 5.951 1.00 23.25 C ATOM 2308 CG GLN A 148 -7.994 -4.577 7.247 1.00 23.33 C ATOM 2309 CD GLN A 148 -9.072 -4.890 8.287 1.00 72.42 C ATOM 2310 OE1 GLN A 148 -9.610 -6.094 8.252 1.00 41.12 O flip ATOM 2311 NE2 GLN A 148 -9.414 -4.054 9.118 1.00 14.00 N flip ATOM 0 H GLN A 148 -7.925 -6.200 5.056 1.00 63.32 H new ATOM 0 HA GLN A 148 -10.411 -5.057 5.770 1.00 31.22 H new ATOM 0 HB2 GLN A 148 -7.713 -3.697 5.303 1.00 23.25 H new ATOM 0 HB3 GLN A 148 -9.053 -3.020 6.205 1.00 23.25 H new ATOM 0 HG2 GLN A 148 -7.462 -5.496 6.999 1.00 23.33 H new ATOM 0 HG3 GLN A 148 -7.265 -3.895 7.685 1.00 23.33 H new ATOM 0 HE21 GLN A 148 -8.980 -3.131 9.121 1.00 14.00 H new ATOM 0 HE22 GLN A 148 -10.132 -4.282 9.806 1.00 14.00 H new ATOM 2320 N LEU A 149 -9.170 -4.155 2.811 1.00 60.11 N ATOM 2321 CA LEU A 149 -9.469 -3.575 1.484 1.00 3.24 C ATOM 2322 C LEU A 149 -10.636 -4.315 0.800 1.00 4.44 C ATOM 2323 O LEU A 149 -11.457 -3.704 0.122 1.00 64.42 O ATOM 2324 CB LEU A 149 -8.179 -3.606 0.607 1.00 2.55 C ATOM 2325 CG LEU A 149 -8.263 -2.940 -0.801 1.00 75.22 C ATOM 2326 CD1 LEU A 149 -8.819 -1.511 -0.702 1.00 0.13 C ATOM 2327 CD2 LEU A 149 -6.887 -2.941 -1.507 1.00 70.14 C ATOM 0 H LEU A 149 -8.262 -4.617 2.853 1.00 60.11 H new ATOM 0 HA LEU A 149 -9.785 -2.539 1.610 1.00 3.24 H new ATOM 0 HB2 LEU A 149 -7.379 -3.119 1.165 1.00 2.55 H new ATOM 0 HB3 LEU A 149 -7.886 -4.647 0.472 1.00 2.55 H new ATOM 0 HG LEU A 149 -8.950 -3.533 -1.404 1.00 75.22 H new ATOM 0 HD11 LEU A 149 -8.867 -1.070 -1.697 1.00 0.13 H new ATOM 0 HD12 LEU A 149 -9.819 -1.539 -0.269 1.00 0.13 H new ATOM 0 HD13 LEU A 149 -8.166 -0.910 -0.070 1.00 0.13 H new ATOM 0 HD21 LEU A 149 -6.980 -2.470 -2.486 1.00 70.14 H new ATOM 0 HD22 LEU A 149 -6.168 -2.386 -0.904 1.00 70.14 H new ATOM 0 HD23 LEU A 149 -6.542 -3.968 -1.630 1.00 70.14 H new ATOM 2339 N GLU A 150 -10.715 -5.627 1.020 1.00 20.54 N ATOM 2340 CA GLU A 150 -11.797 -6.469 0.487 1.00 53.32 C ATOM 2341 C GLU A 150 -13.159 -6.084 1.118 1.00 4.30 C ATOM 2342 O GLU A 150 -14.117 -5.793 0.403 1.00 73.23 O ATOM 2343 CB GLU A 150 -11.460 -7.954 0.740 1.00 44.35 C ATOM 2344 CG GLU A 150 -12.548 -8.952 0.309 1.00 0.42 C ATOM 2345 CD GLU A 150 -12.088 -10.413 0.398 1.00 50.34 C ATOM 2346 OE1 GLU A 150 -11.943 -10.932 1.526 1.00 65.24 O ATOM 2347 OE2 GLU A 150 -11.863 -11.048 -0.659 1.00 21.34 O ATOM 0 H GLU A 150 -10.031 -6.142 1.574 1.00 20.54 H new ATOM 0 HA GLU A 150 -11.883 -6.307 -0.587 1.00 53.32 H new ATOM 0 HB2 GLU A 150 -10.537 -8.196 0.213 1.00 44.35 H new ATOM 0 HB3 GLU A 150 -11.265 -8.090 1.804 1.00 44.35 H new ATOM 0 HG2 GLU A 150 -13.429 -8.815 0.937 1.00 0.42 H new ATOM 0 HG3 GLU A 150 -12.849 -8.733 -0.715 1.00 0.42 H new ATOM 2354 N LYS A 151 -13.210 -6.034 2.463 1.00 43.24 N ATOM 2355 CA LYS A 151 -14.439 -5.657 3.211 1.00 73.04 C ATOM 2356 C LYS A 151 -14.850 -4.187 2.916 1.00 51.20 C ATOM 2357 O LYS A 151 -16.042 -3.861 2.895 1.00 21.40 O ATOM 2358 CB LYS A 151 -14.237 -5.865 4.736 1.00 72.12 C ATOM 2359 CG LYS A 151 -13.772 -7.283 5.147 1.00 11.51 C ATOM 2360 CD LYS A 151 -13.529 -7.409 6.672 1.00 13.42 C ATOM 2361 CE LYS A 151 -12.939 -8.775 7.067 1.00 52.11 C ATOM 2362 NZ LYS A 151 -12.802 -8.931 8.539 1.00 61.34 N ATOM 0 H LYS A 151 -12.413 -6.250 3.062 1.00 43.24 H new ATOM 0 HA LYS A 151 -15.246 -6.308 2.873 1.00 73.04 H new ATOM 0 HB2 LYS A 151 -13.504 -5.141 5.092 1.00 72.12 H new ATOM 0 HB3 LYS A 151 -15.175 -5.645 5.245 1.00 72.12 H new ATOM 0 HG2 LYS A 151 -14.523 -8.011 4.841 1.00 11.51 H new ATOM 0 HG3 LYS A 151 -12.853 -7.529 4.614 1.00 11.51 H new ATOM 0 HD2 LYS A 151 -12.852 -6.618 6.995 1.00 13.42 H new ATOM 0 HD3 LYS A 151 -14.471 -7.258 7.200 1.00 13.42 H new ATOM 0 HE2 LYS A 151 -13.577 -9.569 6.678 1.00 52.11 H new ATOM 0 HE3 LYS A 151 -11.962 -8.894 6.600 1.00 52.11 H new ATOM 0 HZ1 LYS A 151 -12.401 -9.866 8.753 1.00 61.34 H new ATOM 0 HZ2 LYS A 151 -12.172 -8.191 8.909 1.00 61.34 H new ATOM 0 HZ3 LYS A 151 -13.737 -8.845 8.986 1.00 61.34 H new ATOM 2376 N LEU A 152 -13.838 -3.323 2.684 1.00 52.12 N ATOM 2377 CA LEU A 152 -14.029 -1.921 2.237 1.00 44.21 C ATOM 2378 C LEU A 152 -14.789 -1.853 0.880 1.00 42.22 C ATOM 2379 O LEU A 152 -15.864 -1.247 0.791 1.00 71.51 O ATOM 2380 CB LEU A 152 -12.639 -1.215 2.124 1.00 21.33 C ATOM 2381 CG LEU A 152 -12.594 0.173 1.395 1.00 43.35 C ATOM 2382 CD1 LEU A 152 -13.526 1.202 2.064 1.00 51.52 C ATOM 2383 CD2 LEU A 152 -11.146 0.707 1.301 1.00 13.34 C ATOM 0 H LEU A 152 -12.857 -3.578 2.802 1.00 52.12 H new ATOM 0 HA LEU A 152 -14.639 -1.403 2.977 1.00 44.21 H new ATOM 0 HB2 LEU A 152 -12.247 -1.079 3.132 1.00 21.33 H new ATOM 0 HB3 LEU A 152 -11.959 -1.891 1.605 1.00 21.33 H new ATOM 0 HG LEU A 152 -12.961 0.018 0.380 1.00 43.35 H new ATOM 0 HD11 LEU A 152 -13.465 2.150 1.529 1.00 51.52 H new ATOM 0 HD12 LEU A 152 -14.552 0.835 2.037 1.00 51.52 H new ATOM 0 HD13 LEU A 152 -13.221 1.350 3.100 1.00 51.52 H new ATOM 0 HD21 LEU A 152 -11.146 1.670 0.791 1.00 13.34 H new ATOM 0 HD22 LEU A 152 -10.737 0.827 2.304 1.00 13.34 H new ATOM 0 HD23 LEU A 152 -10.533 0.000 0.742 1.00 13.34 H new ATOM 2395 N LEU A 153 -14.226 -2.507 -0.151 1.00 21.25 N ATOM 2396 CA LEU A 153 -14.715 -2.405 -1.549 1.00 20.54 C ATOM 2397 C LEU A 153 -15.990 -3.249 -1.802 1.00 73.12 C ATOM 2398 O LEU A 153 -16.720 -3.001 -2.763 1.00 71.22 O ATOM 2399 CB LEU A 153 -13.578 -2.800 -2.526 1.00 11.40 C ATOM 2400 CG LEU A 153 -12.254 -1.985 -2.364 1.00 41.44 C ATOM 2401 CD1 LEU A 153 -11.151 -2.511 -3.296 1.00 53.34 C ATOM 2402 CD2 LEU A 153 -12.483 -0.465 -2.545 1.00 62.24 C ATOM 0 H LEU A 153 -13.419 -3.122 -0.045 1.00 21.25 H new ATOM 0 HA LEU A 153 -15.002 -1.368 -1.726 1.00 20.54 H new ATOM 0 HB2 LEU A 153 -13.354 -3.858 -2.390 1.00 11.40 H new ATOM 0 HB3 LEU A 153 -13.939 -2.679 -3.547 1.00 11.40 H new ATOM 0 HG LEU A 153 -11.911 -2.132 -1.340 1.00 41.44 H new ATOM 0 HD11 LEU A 153 -10.245 -1.921 -3.157 1.00 53.34 H new ATOM 0 HD12 LEU A 153 -10.944 -3.555 -3.062 1.00 53.34 H new ATOM 0 HD13 LEU A 153 -11.481 -2.430 -4.332 1.00 53.34 H new ATOM 0 HD21 LEU A 153 -11.537 0.062 -2.424 1.00 62.24 H new ATOM 0 HD22 LEU A 153 -12.881 -0.273 -3.542 1.00 62.24 H new ATOM 0 HD23 LEU A 153 -13.193 -0.112 -1.797 1.00 62.24 H new ATOM 2414 N ASN A 154 -16.238 -4.252 -0.949 1.00 51.31 N ATOM 2415 CA ASN A 154 -17.487 -5.047 -0.977 1.00 62.05 C ATOM 2416 C ASN A 154 -18.643 -4.317 -0.245 1.00 64.11 C ATOM 2417 O ASN A 154 -19.784 -4.329 -0.730 1.00 21.22 O ATOM 2418 CB ASN A 154 -17.237 -6.453 -0.374 1.00 52.34 C ATOM 2419 CG ASN A 154 -16.682 -7.425 -1.413 1.00 12.22 C ATOM 2420 OD1 ASN A 154 -17.428 -8.170 -2.031 1.00 12.02 O ATOM 2421 ND2 ASN A 154 -15.391 -7.389 -1.661 1.00 21.24 N ATOM 0 H ASN A 154 -15.585 -4.539 -0.220 1.00 51.31 H new ATOM 0 HA ASN A 154 -17.793 -5.166 -2.016 1.00 62.05 H new ATOM 0 HB2 ASN A 154 -16.538 -6.372 0.458 1.00 52.34 H new ATOM 0 HB3 ASN A 154 -18.170 -6.846 0.030 1.00 52.34 H new ATOM 0 HD21 ASN A 154 -14.993 -7.991 -2.382 1.00 21.24 H new ATOM 0 HD22 ASN A 154 -14.788 -6.759 -1.132 1.00 21.24 H new ATOM 2428 N GLN A 155 -18.317 -3.692 0.921 1.00 72.23 N ATOM 2429 CA GLN A 155 -19.280 -2.992 1.830 1.00 51.23 C ATOM 2430 C GLN A 155 -20.217 -3.979 2.587 1.00 31.00 C ATOM 2431 O GLN A 155 -20.225 -4.026 3.820 1.00 25.52 O ATOM 2432 CB GLN A 155 -20.131 -1.918 1.089 1.00 54.12 C ATOM 2433 CG GLN A 155 -19.341 -0.729 0.503 1.00 54.42 C ATOM 2434 CD GLN A 155 -20.236 0.285 -0.223 1.00 14.03 C ATOM 2435 OE1 GLN A 155 -21.410 0.440 0.094 1.00 15.43 O ATOM 2436 NE2 GLN A 155 -19.680 1.014 -1.167 1.00 65.44 N ATOM 0 H GLN A 155 -17.358 -3.658 1.266 1.00 72.23 H new ATOM 0 HA GLN A 155 -18.657 -2.484 2.566 1.00 51.23 H new ATOM 0 HB2 GLN A 155 -20.673 -2.406 0.279 1.00 54.12 H new ATOM 0 HB3 GLN A 155 -20.877 -1.529 1.783 1.00 54.12 H new ATOM 0 HG2 GLN A 155 -18.806 -0.223 1.307 1.00 54.42 H new ATOM 0 HG3 GLN A 155 -18.590 -1.106 -0.192 1.00 54.42 H new ATOM 0 HE21 GLN A 155 -18.701 0.868 -1.414 1.00 65.44 H new ATOM 0 HE22 GLN A 155 -20.228 1.725 -1.651 1.00 65.44 H new ATOM 2445 N LYS A 156 -21.001 -4.762 1.822 1.00 4.00 N ATOM 2446 CA LYS A 156 -22.009 -5.717 2.352 1.00 12.05 C ATOM 2447 C LYS A 156 -21.378 -7.067 2.802 1.00 50.02 C ATOM 2448 O LYS A 156 -22.094 -8.051 3.010 1.00 53.21 O ATOM 2449 CB LYS A 156 -23.085 -5.971 1.252 1.00 61.51 C ATOM 2450 CG LYS A 156 -23.728 -4.688 0.682 1.00 61.32 C ATOM 2451 CD LYS A 156 -24.790 -4.967 -0.414 1.00 22.10 C ATOM 2452 CE LYS A 156 -26.035 -5.703 0.122 1.00 23.24 C ATOM 2453 NZ LYS A 156 -26.741 -4.919 1.171 1.00 52.24 N ATOM 0 H LYS A 156 -20.956 -4.753 0.803 1.00 4.00 H new ATOM 0 HA LYS A 156 -22.461 -5.272 3.239 1.00 12.05 H new ATOM 0 HB2 LYS A 156 -22.627 -6.528 0.434 1.00 61.51 H new ATOM 0 HB3 LYS A 156 -23.870 -6.603 1.668 1.00 61.51 H new ATOM 0 HG2 LYS A 156 -24.193 -4.131 1.495 1.00 61.32 H new ATOM 0 HG3 LYS A 156 -22.946 -4.052 0.267 1.00 61.32 H new ATOM 0 HD2 LYS A 156 -25.099 -4.022 -0.861 1.00 22.10 H new ATOM 0 HD3 LYS A 156 -24.337 -5.562 -1.207 1.00 22.10 H new ATOM 0 HE2 LYS A 156 -26.720 -5.904 -0.702 1.00 23.24 H new ATOM 0 HE3 LYS A 156 -25.737 -6.668 0.531 1.00 23.24 H new ATOM 0 HZ1 LYS A 156 -27.649 -5.375 1.394 1.00 52.24 H new ATOM 0 HZ2 LYS A 156 -26.154 -4.879 2.029 1.00 52.24 H new ATOM 0 HZ3 LYS A 156 -26.915 -3.954 0.825 1.00 52.24 H new ATOM 2467 N LEU A 157 -20.048 -7.098 2.985 1.00 73.12 N ATOM 2468 CA LEU A 157 -19.297 -8.330 3.304 1.00 73.20 C ATOM 2469 C LEU A 157 -18.248 -8.051 4.401 1.00 31.12 C ATOM 2470 O LEU A 157 -17.348 -7.228 4.216 1.00 74.23 O ATOM 2471 CB LEU A 157 -18.623 -8.862 1.994 1.00 22.53 C ATOM 2472 CG LEU A 157 -17.857 -10.241 2.023 1.00 43.40 C ATOM 2473 CD1 LEU A 157 -16.399 -10.098 2.510 1.00 34.53 C ATOM 2474 CD2 LEU A 157 -18.622 -11.308 2.843 1.00 14.10 C ATOM 0 H LEU A 157 -19.459 -6.268 2.916 1.00 73.12 H new ATOM 0 HA LEU A 157 -19.976 -9.091 3.689 1.00 73.20 H new ATOM 0 HB2 LEU A 157 -19.400 -8.935 1.233 1.00 22.53 H new ATOM 0 HB3 LEU A 157 -17.917 -8.103 1.657 1.00 22.53 H new ATOM 0 HG LEU A 157 -17.813 -10.587 0.990 1.00 43.40 H new ATOM 0 HD11 LEU A 157 -15.918 -11.076 2.511 1.00 34.53 H new ATOM 0 HD12 LEU A 157 -15.857 -9.428 1.843 1.00 34.53 H new ATOM 0 HD13 LEU A 157 -16.391 -9.689 3.520 1.00 34.53 H new ATOM 0 HD21 LEU A 157 -18.061 -12.242 2.838 1.00 14.10 H new ATOM 0 HD22 LEU A 157 -18.741 -10.962 3.870 1.00 14.10 H new ATOM 0 HD23 LEU A 157 -19.604 -11.472 2.400 1.00 14.10 H new ATOM 2486 N GLU A 158 -18.393 -8.736 5.546 1.00 14.41 N ATOM 2487 CA GLU A 158 -17.341 -8.834 6.571 1.00 22.11 C ATOM 2488 C GLU A 158 -16.705 -10.242 6.496 1.00 2.24 C ATOM 2489 O GLU A 158 -15.521 -10.396 6.195 1.00 0.42 O ATOM 2490 CB GLU A 158 -17.922 -8.588 7.987 1.00 53.24 C ATOM 2491 CG GLU A 158 -16.849 -8.513 9.103 1.00 61.54 C ATOM 2492 CD GLU A 158 -17.409 -8.557 10.538 1.00 64.13 C ATOM 2493 OE1 GLU A 158 -18.541 -8.088 10.774 1.00 53.22 O ATOM 2494 OE2 GLU A 158 -16.704 -9.068 11.439 1.00 34.14 O ATOM 0 H GLU A 158 -19.246 -9.240 5.788 1.00 14.41 H new ATOM 0 HA GLU A 158 -16.586 -8.071 6.383 1.00 22.11 H new ATOM 0 HB2 GLU A 158 -18.489 -7.657 7.979 1.00 53.24 H new ATOM 0 HB3 GLU A 158 -18.624 -9.387 8.225 1.00 53.24 H new ATOM 0 HG2 GLU A 158 -16.152 -9.341 8.974 1.00 61.54 H new ATOM 0 HG3 GLU A 158 -16.278 -7.593 8.978 1.00 61.54 H new ATOM 2501 N HIS A 159 -17.530 -11.272 6.767 1.00 33.41 N ATOM 2502 CA HIS A 159 -17.117 -12.692 6.701 1.00 42.52 C ATOM 2503 C HIS A 159 -18.296 -13.570 6.215 1.00 54.32 C ATOM 2504 O HIS A 159 -19.436 -13.384 6.651 1.00 53.11 O ATOM 2505 CB HIS A 159 -16.561 -13.176 8.077 1.00 5.35 C ATOM 2506 CG HIS A 159 -17.459 -12.945 9.279 1.00 15.20 C ATOM 2507 ND1 HIS A 159 -17.195 -11.996 10.244 1.00 14.44 N ATOM 2508 CD2 HIS A 159 -18.597 -13.565 9.685 1.00 41.34 C ATOM 2509 CE1 HIS A 159 -18.121 -12.045 11.179 1.00 13.11 C ATOM 2510 NE2 HIS A 159 -18.983 -12.983 10.867 1.00 23.43 N ATOM 0 H HIS A 159 -18.505 -11.145 7.039 1.00 33.41 H new ATOM 0 HA HIS A 159 -16.308 -12.789 5.977 1.00 42.52 H new ATOM 0 HB2 HIS A 159 -16.351 -14.243 8.006 1.00 5.35 H new ATOM 0 HB3 HIS A 159 -15.610 -12.675 8.258 1.00 5.35 H new ATOM 0 HD2 HIS A 159 -19.105 -14.368 9.172 1.00 41.34 H new ATOM 0 HE1 HIS A 159 -18.164 -11.417 12.057 1.00 13.11 H new ATOM 0 HE2 HIS A 159 -19.806 -13.238 11.413 1.00 23.43 H new ATOM 2519 N HIS A 160 -18.010 -14.520 5.304 1.00 73.32 N ATOM 2520 CA HIS A 160 -19.048 -15.396 4.699 1.00 33.11 C ATOM 2521 C HIS A 160 -19.376 -16.619 5.608 1.00 14.00 C ATOM 2522 O HIS A 160 -20.453 -17.217 5.491 1.00 15.24 O ATOM 2523 CB HIS A 160 -18.576 -15.849 3.290 1.00 1.22 C ATOM 2524 CG HIS A 160 -19.640 -16.501 2.435 1.00 42.03 C ATOM 2525 ND1 HIS A 160 -20.497 -15.784 1.627 1.00 41.11 N ATOM 2526 CD2 HIS A 160 -19.976 -17.805 2.254 1.00 2.32 C ATOM 2527 CE1 HIS A 160 -21.308 -16.607 0.998 1.00 12.35 C ATOM 2528 NE2 HIS A 160 -21.017 -17.835 1.361 1.00 25.11 N ATOM 0 H HIS A 160 -17.066 -14.706 4.966 1.00 73.32 H new ATOM 0 HA HIS A 160 -19.973 -14.827 4.602 1.00 33.11 H new ATOM 0 HB2 HIS A 160 -18.186 -14.981 2.758 1.00 1.22 H new ATOM 0 HB3 HIS A 160 -17.748 -16.548 3.409 1.00 1.22 H new ATOM 0 HD2 HIS A 160 -19.511 -18.658 2.725 1.00 2.32 H new ATOM 0 HE1 HIS A 160 -22.082 -16.321 0.301 1.00 12.35 H new ATOM 0 HE2 HIS A 160 -21.490 -18.677 1.032 1.00 25.11 H new ATOM 2537 N HIS A 161 -18.443 -16.983 6.507 1.00 70.03 N ATOM 2538 CA HIS A 161 -18.625 -18.110 7.458 1.00 34.13 C ATOM 2539 C HIS A 161 -19.053 -17.602 8.859 1.00 12.11 C ATOM 2540 O HIS A 161 -18.479 -16.643 9.380 1.00 0.24 O ATOM 2541 CB HIS A 161 -17.315 -18.925 7.581 1.00 13.20 C ATOM 2542 CG HIS A 161 -16.861 -19.570 6.299 1.00 72.13 C ATOM 2543 ND1 HIS A 161 -15.708 -19.204 5.638 1.00 74.31 N ATOM 2544 CD2 HIS A 161 -17.397 -20.580 5.572 1.00 11.23 C ATOM 2545 CE1 HIS A 161 -15.559 -19.949 4.568 1.00 3.30 C ATOM 2546 NE2 HIS A 161 -16.565 -20.786 4.502 1.00 71.21 N ATOM 0 H HIS A 161 -17.544 -16.511 6.600 1.00 70.03 H new ATOM 0 HA HIS A 161 -19.416 -18.749 7.066 1.00 34.13 H new ATOM 0 HB2 HIS A 161 -16.525 -18.267 7.942 1.00 13.20 H new ATOM 0 HB3 HIS A 161 -17.453 -19.700 8.334 1.00 13.20 H new ATOM 0 HD2 HIS A 161 -18.306 -21.120 5.793 1.00 11.23 H new ATOM 0 HE1 HIS A 161 -14.745 -19.883 3.861 1.00 3.30 H new ATOM 0 HE2 HIS A 161 -16.707 -21.482 3.770 1.00 71.21 H new ATOM 2555 N HIS A 162 -20.046 -18.281 9.466 1.00 62.44 N ATOM 2556 CA HIS A 162 -20.544 -17.963 10.823 1.00 34.13 C ATOM 2557 C HIS A 162 -20.976 -19.265 11.551 1.00 2.44 C ATOM 2558 O HIS A 162 -22.071 -19.786 11.313 1.00 54.51 O ATOM 2559 CB HIS A 162 -21.725 -16.949 10.745 1.00 31.34 C ATOM 2560 CG HIS A 162 -22.264 -16.517 12.090 1.00 51.03 C ATOM 2561 ND1 HIS A 162 -23.308 -17.155 12.729 1.00 12.53 N ATOM 2562 CD2 HIS A 162 -21.886 -15.513 12.919 1.00 3.55 C ATOM 2563 CE1 HIS A 162 -23.547 -16.565 13.882 1.00 23.31 C ATOM 2564 NE2 HIS A 162 -22.701 -15.570 14.023 1.00 35.31 N ATOM 0 H HIS A 162 -20.528 -19.067 9.030 1.00 62.44 H new ATOM 0 HA HIS A 162 -19.740 -17.500 11.395 1.00 34.13 H new ATOM 0 HB2 HIS A 162 -21.395 -16.066 10.198 1.00 31.34 H new ATOM 0 HB3 HIS A 162 -22.535 -17.396 10.169 1.00 31.34 H new ATOM 0 HD2 HIS A 162 -21.093 -14.802 12.744 1.00 3.55 H new ATOM 0 HE1 HIS A 162 -24.309 -16.851 14.591 1.00 23.31 H new ATOM 0 HE2 HIS A 162 -22.656 -14.940 14.824 1.00 35.31 H new ATOM 2573 N HIS A 163 -20.090 -19.804 12.411 1.00 63.41 N ATOM 2574 CA HIS A 163 -20.392 -20.991 13.245 1.00 73.43 C ATOM 2575 C HIS A 163 -21.218 -20.590 14.497 1.00 70.23 C ATOM 2576 O HIS A 163 -21.023 -19.490 15.038 1.00 74.21 O ATOM 2577 CB HIS A 163 -19.081 -21.723 13.653 1.00 22.33 C ATOM 2578 CG HIS A 163 -18.104 -20.895 14.467 1.00 20.20 C ATOM 2579 ND1 HIS A 163 -17.081 -20.164 13.902 1.00 2.04 N ATOM 2580 CD2 HIS A 163 -17.995 -20.697 15.807 1.00 64.23 C ATOM 2581 CE1 HIS A 163 -16.395 -19.556 14.844 1.00 34.21 C ATOM 2582 NE2 HIS A 163 -16.923 -19.863 16.008 1.00 23.22 N ATOM 0 H HIS A 163 -19.150 -19.434 12.549 1.00 63.41 H new ATOM 0 HA HIS A 163 -20.994 -21.680 12.653 1.00 73.43 H new ATOM 0 HB2 HIS A 163 -19.344 -22.612 14.226 1.00 22.33 H new ATOM 0 HB3 HIS A 163 -18.578 -22.064 12.748 1.00 22.33 H new ATOM 0 HD2 HIS A 163 -18.632 -21.117 16.571 1.00 64.23 H new ATOM 0 HE1 HIS A 163 -15.542 -18.913 14.688 1.00 34.21 H new ATOM 0 HE2 HIS A 163 -16.590 -19.535 16.914 1.00 23.22 H new ATOM 2591 N HIS A 164 -22.129 -21.492 14.934 1.00 74.52 N ATOM 2592 CA HIS A 164 -23.013 -21.293 16.116 1.00 63.21 C ATOM 2593 C HIS A 164 -23.994 -20.112 15.918 1.00 24.13 C ATOM 2594 O HIS A 164 -23.636 -18.941 16.073 1.00 10.02 O ATOM 2595 CB HIS A 164 -22.175 -21.142 17.427 1.00 64.12 C ATOM 2596 CG HIS A 164 -22.982 -20.991 18.695 1.00 10.15 C ATOM 2597 ND1 HIS A 164 -23.592 -22.053 19.330 1.00 13.43 N ATOM 2598 CD2 HIS A 164 -23.272 -19.900 19.448 1.00 50.03 C ATOM 2599 CE1 HIS A 164 -24.216 -21.626 20.408 1.00 22.12 C ATOM 2600 NE2 HIS A 164 -24.035 -20.327 20.503 1.00 53.32 N ATOM 0 H HIS A 164 -22.275 -22.390 14.473 1.00 74.52 H new ATOM 0 HA HIS A 164 -23.625 -22.189 16.218 1.00 63.21 H new ATOM 0 HB2 HIS A 164 -21.529 -22.014 17.528 1.00 64.12 H new ATOM 0 HB3 HIS A 164 -21.524 -20.274 17.325 1.00 64.12 H new ATOM 0 HD2 HIS A 164 -22.960 -18.885 19.252 1.00 50.03 H new ATOM 0 HE1 HIS A 164 -24.780 -22.238 21.096 1.00 22.12 H new ATOM 0 HE2 HIS A 164 -24.404 -19.732 21.244 1.00 53.32 H new TER 2609 HIS A 164