USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1209 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 145 CYS SG : rot -86:sc= 0.0572! USER MOD Set 1.2: A 146 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 117 HIS : no HE2:sc= 0.783 K(o=1.6,f=-1.2) USER MOD Set 2.2: A 128 SER OG : rot -144:sc= 0.806 USER MOD Set 3.1: A 41 THR OG1 : rot 70:sc= 0.479 USER MOD Set 3.2: A 87 HIS : no HD1:sc= -6.77! C(o=-6.3!,f=-9.2!) USER MOD Set 4.1: A 66 CYS SG : rot -140:sc= -0.578 USER MOD Set 4.2: A 141 HIS : no HD1:sc= -2.2 X(o=-2.8,f=-2.8) USER MOD Set 5.1: A 46 MET CE :methyl -118:sc= -0.543 (180deg=-2.64!) USER MOD Set 5.2: A 61 THR OG1 : rot 71:sc= 0.713 USER MOD Set 6.1: A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 93 GLN :FLIP amide:sc= -0.98 F(o=-2.5!,f=-0.98) USER MOD Set 7.1: A 13 ASN : amide:sc= -4.75! C(o=-4.8!,f=-11!) USER MOD Set 7.2: A 21 TYR OH : rot 100:sc= -0.0669 USER MOD Set 8.1: A 11 ASN : amide:sc= -0.821 X(o=-0.21,f=-0.23) USER MOD Set 8.2: A 24 LYS NZ :NH3+ -161:sc= 0.614 (180deg=0.276) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -41:sc= 0.409 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -5.13! C(o=-5.1!,f=-10!) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ -130:sc= -0.384 (180deg=-2.04!) USER MOD Single : A 45 ASN : amide:sc= -1.75 K(o=-1.7,f=-3.3!) USER MOD Single : A 51 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0363) USER MOD Single : A 54 ASN : amide:sc= -0.552 K(o=-0.55,f=-3.1!) USER MOD Single : A 58 THR OG1 : rot 180:sc=-0.00227 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.0916 X(o=-0.092,f=-0.092) USER MOD Single : A 72 THR OG1 : rot -160:sc= -0.146 USER MOD Single : A 73 GLN : amide:sc=-0.00216 X(o=-0.0022,f=-0.24) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 81 TYR OH : rot -15:sc= -1.05 USER MOD Single : A 84 ASN : amide:sc= -0.784 K(o=-0.78,f=-4.3!) USER MOD Single : A 86 SER OG : rot 29:sc= 0.225 USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 MET CE :methyl -136:sc= -6.18! (180deg=-13.6!) USER MOD Single : A 101 LYS NZ :NH3+ 160:sc= -0.701 (180deg=-1.3) USER MOD Single : A 102 LYS NZ :NH3+ -170:sc= -0.428 (180deg=-0.625) USER MOD Single : A 111 ASN : amide:sc= -1.96 K(o=-2,f=-6.7!) USER MOD Single : A 114 THR OG1 : rot -104:sc= 1.26 USER MOD Single : A 119 ASN : amide:sc= -0.18 K(o=-0.18,f=-1.6!) USER MOD Single : A 121 LYS NZ :NH3+ -136:sc= -0.696 (180deg=-2.49!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 GLN :FLIP amide:sc= -1.73 F(o=-5.6!,f=-1.7) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -0.554 K(o=-0.55,f=-3.3!) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 HIS :FLIP no HD1:sc= -0.687 F(o=-1.7!,f=-0.69) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 163:sc=-0.00278 (180deg=-0.245) USER MOD Single : A 151 ASN :FLIP amide:sc= 0.173 F(o=-1.8,f=0.17) USER MOD Single : A 155 ASN : amide:sc= -0.306 X(o=-0.31,f=-0.31) USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 31.312 15.742 -23.991 1.00 0.00 N ATOM 2 CA GLY A 1 31.012 16.356 -22.711 1.00 0.00 C ATOM 3 C GLY A 1 31.028 15.357 -21.570 1.00 0.00 C ATOM 4 O GLY A 1 32.035 14.690 -21.335 1.00 0.00 O ATOM 0 H1 GLY A 1 31.289 16.466 -24.737 1.00 0.00 H new ATOM 0 H2 GLY A 1 32.258 15.311 -23.956 1.00 0.00 H new ATOM 0 H3 GLY A 1 30.605 15.008 -24.198 1.00 0.00 H new ATOM 0 HA2 GLY A 1 31.738 17.144 -22.510 1.00 0.00 H new ATOM 0 HA3 GLY A 1 30.032 16.831 -22.760 1.00 0.00 H new ATOM 8 N SER A 2 29.909 15.255 -20.860 1.00 0.00 N ATOM 9 CA SER A 2 29.800 14.335 -19.734 1.00 0.00 C ATOM 10 C SER A 2 28.723 13.286 -19.993 1.00 0.00 C ATOM 11 O SER A 2 27.579 13.618 -20.305 1.00 0.00 O ATOM 12 CB SER A 2 29.483 15.102 -18.449 1.00 0.00 C ATOM 13 OG SER A 2 29.291 14.216 -17.360 1.00 0.00 O ATOM 0 H SER A 2 29.065 15.798 -21.044 1.00 0.00 H new ATOM 0 HA SER A 2 30.757 13.827 -19.618 1.00 0.00 H new ATOM 0 HB2 SER A 2 30.297 15.790 -18.223 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.587 15.705 -18.594 1.00 0.00 H new ATOM 0 HG SER A 2 29.092 14.731 -16.550 1.00 0.00 H new ATOM 19 N SER A 3 29.097 12.017 -19.860 1.00 0.00 N ATOM 20 CA SER A 3 28.165 10.918 -20.083 1.00 0.00 C ATOM 21 C SER A 3 28.196 9.935 -18.917 1.00 0.00 C ATOM 22 O SER A 3 29.230 9.744 -18.278 1.00 0.00 O ATOM 23 CB SER A 3 28.503 10.191 -21.387 1.00 0.00 C ATOM 24 OG SER A 3 28.263 11.021 -22.510 1.00 0.00 O ATOM 0 H SER A 3 30.039 11.725 -19.599 1.00 0.00 H new ATOM 0 HA SER A 3 27.161 11.335 -20.158 1.00 0.00 H new ATOM 0 HB2 SER A 3 29.549 9.883 -21.375 1.00 0.00 H new ATOM 0 HB3 SER A 3 27.904 9.284 -21.467 1.00 0.00 H new ATOM 0 HG SER A 3 28.488 10.535 -23.330 1.00 0.00 H new ATOM 30 N GLY A 4 27.053 9.312 -18.645 1.00 0.00 N ATOM 31 CA GLY A 4 26.969 8.356 -17.557 1.00 0.00 C ATOM 32 C GLY A 4 25.613 7.683 -17.479 1.00 0.00 C ATOM 33 O GLY A 4 25.135 7.120 -18.463 1.00 0.00 O ATOM 0 H GLY A 4 26.184 9.453 -19.159 1.00 0.00 H new ATOM 0 HA2 GLY A 4 27.741 7.597 -17.684 1.00 0.00 H new ATOM 0 HA3 GLY A 4 27.174 8.864 -16.615 1.00 0.00 H new ATOM 37 N SER A 5 24.993 7.741 -16.305 1.00 0.00 N ATOM 38 CA SER A 5 23.686 7.127 -16.100 1.00 0.00 C ATOM 39 C SER A 5 22.977 7.746 -14.900 1.00 0.00 C ATOM 40 O SER A 5 23.564 8.529 -14.154 1.00 0.00 O ATOM 41 CB SER A 5 23.834 5.618 -15.898 1.00 0.00 C ATOM 42 OG SER A 5 24.773 5.330 -14.877 1.00 0.00 O ATOM 0 H SER A 5 25.374 8.207 -15.481 1.00 0.00 H new ATOM 0 HA SER A 5 23.083 7.309 -16.989 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.867 5.186 -15.640 1.00 0.00 H new ATOM 0 HB3 SER A 5 24.152 5.153 -16.831 1.00 0.00 H new ATOM 0 HG SER A 5 24.848 4.359 -14.766 1.00 0.00 H new ATOM 48 N SER A 6 21.709 7.388 -14.720 1.00 0.00 N ATOM 49 CA SER A 6 20.917 7.910 -13.612 1.00 0.00 C ATOM 50 C SER A 6 19.697 7.032 -13.355 1.00 0.00 C ATOM 51 O SER A 6 19.055 6.553 -14.289 1.00 0.00 O ATOM 52 CB SER A 6 20.474 9.345 -13.906 1.00 0.00 C ATOM 53 OG SER A 6 19.691 9.864 -12.846 1.00 0.00 O ATOM 0 H SER A 6 21.209 6.739 -15.327 1.00 0.00 H new ATOM 0 HA SER A 6 21.541 7.905 -12.718 1.00 0.00 H new ATOM 0 HB2 SER A 6 21.350 9.976 -14.058 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.900 9.369 -14.832 1.00 0.00 H new ATOM 0 HG SER A 6 19.422 10.782 -13.057 1.00 0.00 H new ATOM 59 N GLY A 7 19.383 6.824 -12.080 1.00 0.00 N ATOM 60 CA GLY A 7 18.241 6.004 -11.721 1.00 0.00 C ATOM 61 C GLY A 7 17.723 6.307 -10.329 1.00 0.00 C ATOM 62 O GLY A 7 18.065 5.617 -9.369 1.00 0.00 O ATOM 0 H GLY A 7 19.899 7.209 -11.289 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.442 6.163 -12.445 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.520 4.952 -11.780 1.00 0.00 H new ATOM 66 N MET A 8 16.898 7.343 -10.219 1.00 0.00 N ATOM 67 CA MET A 8 16.333 7.735 -8.933 1.00 0.00 C ATOM 68 C MET A 8 15.281 6.732 -8.472 1.00 0.00 C ATOM 69 O MET A 8 14.323 6.448 -9.191 1.00 0.00 O ATOM 70 CB MET A 8 15.715 9.132 -9.028 1.00 0.00 C ATOM 71 CG MET A 8 16.710 10.254 -8.780 1.00 0.00 C ATOM 72 SD MET A 8 16.205 11.810 -9.540 1.00 0.00 S ATOM 73 CE MET A 8 17.772 12.399 -10.178 1.00 0.00 C ATOM 0 H MET A 8 16.606 7.926 -11.004 1.00 0.00 H new ATOM 0 HA MET A 8 17.140 7.751 -8.200 1.00 0.00 H new ATOM 0 HB2 MET A 8 15.275 9.259 -10.017 1.00 0.00 H new ATOM 0 HB3 MET A 8 14.903 9.211 -8.305 1.00 0.00 H new ATOM 0 HG2 MET A 8 16.827 10.400 -7.706 1.00 0.00 H new ATOM 0 HG3 MET A 8 17.685 9.963 -9.171 1.00 0.00 H new ATOM 0 HE1 MET A 8 17.625 13.356 -10.678 1.00 0.00 H new ATOM 0 HE2 MET A 8 18.476 12.524 -9.355 1.00 0.00 H new ATOM 0 HE3 MET A 8 18.170 11.676 -10.889 1.00 0.00 H new ATOM 83 N SER A 9 15.466 6.198 -7.269 1.00 0.00 N ATOM 84 CA SER A 9 14.535 5.223 -6.714 1.00 0.00 C ATOM 85 C SER A 9 14.820 4.979 -5.235 1.00 0.00 C ATOM 86 O SER A 9 15.960 5.090 -4.784 1.00 0.00 O ATOM 87 CB SER A 9 14.624 3.904 -7.485 1.00 0.00 C ATOM 88 OG SER A 9 15.970 3.581 -7.789 1.00 0.00 O ATOM 0 H SER A 9 16.252 6.424 -6.660 1.00 0.00 H new ATOM 0 HA SER A 9 13.527 5.626 -6.811 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.179 3.103 -6.894 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.047 3.978 -8.407 1.00 0.00 H new ATOM 0 HG SER A 9 16.000 2.734 -8.280 1.00 0.00 H new ATOM 94 N VAL A 10 13.775 4.647 -4.484 1.00 0.00 N ATOM 95 CA VAL A 10 13.911 4.387 -3.056 1.00 0.00 C ATOM 96 C VAL A 10 13.410 2.992 -2.701 1.00 0.00 C ATOM 97 O VAL A 10 12.636 2.392 -3.445 1.00 0.00 O ATOM 98 CB VAL A 10 13.140 5.426 -2.220 1.00 0.00 C ATOM 99 CG1 VAL A 10 13.683 6.824 -2.472 1.00 0.00 C ATOM 100 CG2 VAL A 10 11.652 5.359 -2.528 1.00 0.00 C ATOM 0 H VAL A 10 12.824 4.552 -4.841 1.00 0.00 H new ATOM 0 HA VAL A 10 14.973 4.459 -2.821 1.00 0.00 H new ATOM 0 HB VAL A 10 13.280 5.193 -1.164 1.00 0.00 H new ATOM 0 HG11 VAL A 10 13.126 7.544 -1.873 1.00 0.00 H new ATOM 0 HG12 VAL A 10 14.737 6.860 -2.196 1.00 0.00 H new ATOM 0 HG13 VAL A 10 13.576 7.071 -3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 10 11.123 6.100 -1.929 1.00 0.00 H new ATOM 0 HG22 VAL A 10 11.490 5.565 -3.586 1.00 0.00 H new ATOM 0 HG23 VAL A 10 11.276 4.364 -2.290 1.00 0.00 H new ATOM 110 N ASN A 11 13.856 2.481 -1.558 1.00 0.00 N ATOM 111 CA ASN A 11 13.452 1.156 -1.103 1.00 0.00 C ATOM 112 C ASN A 11 11.955 0.944 -1.306 1.00 0.00 C ATOM 113 O ASN A 11 11.159 1.869 -1.146 1.00 0.00 O ATOM 114 CB ASN A 11 13.810 0.969 0.372 1.00 0.00 C ATOM 115 CG ASN A 11 15.290 0.706 0.579 1.00 0.00 C ATOM 116 OD1 ASN A 11 16.121 1.594 0.392 1.00 0.00 O ATOM 117 ND2 ASN A 11 15.624 -0.519 0.967 1.00 0.00 N ATOM 0 H ASN A 11 14.498 2.965 -0.930 1.00 0.00 H new ATOM 0 HA ASN A 11 13.989 0.416 -1.696 1.00 0.00 H new ATOM 0 HB2 ASN A 11 13.521 1.860 0.929 1.00 0.00 H new ATOM 0 HB3 ASN A 11 13.235 0.137 0.780 1.00 0.00 H new ATOM 0 HD21 ASN A 11 16.604 -0.755 1.122 1.00 0.00 H new ATOM 0 HD22 ASN A 11 14.901 -1.224 1.110 1.00 0.00 H new ATOM 124 N VAL A 12 11.578 -0.281 -1.658 1.00 0.00 N ATOM 125 CA VAL A 12 10.177 -0.616 -1.880 1.00 0.00 C ATOM 126 C VAL A 12 9.305 -0.125 -0.730 1.00 0.00 C ATOM 127 O VAL A 12 8.152 0.255 -0.929 1.00 0.00 O ATOM 128 CB VAL A 12 9.981 -2.134 -2.046 1.00 0.00 C ATOM 129 CG1 VAL A 12 8.510 -2.465 -2.247 1.00 0.00 C ATOM 130 CG2 VAL A 12 10.817 -2.655 -3.206 1.00 0.00 C ATOM 0 H VAL A 12 12.224 -1.058 -1.796 1.00 0.00 H new ATOM 0 HA VAL A 12 9.875 -0.116 -2.800 1.00 0.00 H new ATOM 0 HB VAL A 12 10.318 -2.628 -1.134 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.392 -3.542 -2.362 1.00 0.00 H new ATOM 0 HG12 VAL A 12 7.940 -2.128 -1.381 1.00 0.00 H new ATOM 0 HG13 VAL A 12 8.143 -1.962 -3.142 1.00 0.00 H new ATOM 0 HG21 VAL A 12 10.667 -3.730 -3.309 1.00 0.00 H new ATOM 0 HG22 VAL A 12 10.513 -2.156 -4.126 1.00 0.00 H new ATOM 0 HG23 VAL A 12 11.871 -2.453 -3.015 1.00 0.00 H new ATOM 140 N ASN A 13 9.865 -0.135 0.475 1.00 0.00 N ATOM 141 CA ASN A 13 9.139 0.310 1.659 1.00 0.00 C ATOM 142 C ASN A 13 9.876 1.450 2.354 1.00 0.00 C ATOM 143 O ASN A 13 11.105 1.525 2.313 1.00 0.00 O ATOM 144 CB ASN A 13 8.946 -0.855 2.632 1.00 0.00 C ATOM 145 CG ASN A 13 8.940 -2.200 1.931 1.00 0.00 C ATOM 146 OD1 ASN A 13 8.379 -2.342 0.844 1.00 0.00 O ATOM 147 ND2 ASN A 13 9.565 -3.194 2.551 1.00 0.00 N ATOM 0 H ASN A 13 10.819 -0.446 0.657 1.00 0.00 H new ATOM 0 HA ASN A 13 8.163 0.674 1.339 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.743 -0.840 3.375 1.00 0.00 H new ATOM 0 HB3 ASN A 13 8.007 -0.724 3.169 1.00 0.00 H new ATOM 0 HD21 ASN A 13 9.594 -4.121 2.127 1.00 0.00 H new ATOM 0 HD22 ASN A 13 10.016 -3.030 3.451 1.00 0.00 H new ATOM 154 N ARG A 14 9.119 2.336 2.992 1.00 0.00 N ATOM 155 CA ARG A 14 9.700 3.473 3.695 1.00 0.00 C ATOM 156 C ARG A 14 10.081 3.093 5.123 1.00 0.00 C ATOM 157 O ARG A 14 10.680 3.886 5.849 1.00 0.00 O ATOM 158 CB ARG A 14 8.717 4.645 3.714 1.00 0.00 C ATOM 159 CG ARG A 14 8.320 5.129 2.329 1.00 0.00 C ATOM 160 CD ARG A 14 9.373 6.053 1.738 1.00 0.00 C ATOM 161 NE ARG A 14 9.464 7.316 2.465 1.00 0.00 N ATOM 162 CZ ARG A 14 10.488 8.156 2.355 1.00 0.00 C ATOM 163 NH1 ARG A 14 11.502 7.868 1.550 1.00 0.00 N ATOM 164 NH2 ARG A 14 10.498 9.286 3.050 1.00 0.00 N ATOM 0 H ARG A 14 8.101 2.288 3.037 1.00 0.00 H new ATOM 0 HA ARG A 14 10.603 3.773 3.163 1.00 0.00 H new ATOM 0 HB2 ARG A 14 7.820 4.347 4.257 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.163 5.473 4.265 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.176 4.272 1.671 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.366 5.652 2.385 1.00 0.00 H new ATOM 0 HD2 ARG A 14 10.342 5.555 1.754 1.00 0.00 H new ATOM 0 HD3 ARG A 14 9.135 6.253 0.693 1.00 0.00 H new ATOM 0 HE ARG A 14 8.700 7.567 3.092 1.00 0.00 H new ATOM 0 HH11 ARG A 14 11.497 7.000 1.014 1.00 0.00 H new ATOM 0 HH12 ARG A 14 12.287 8.514 1.467 1.00 0.00 H new ATOM 0 HH21 ARG A 14 9.719 9.511 3.669 1.00 0.00 H new ATOM 0 HH22 ARG A 14 11.284 9.930 2.965 1.00 0.00 H new ATOM 178 N SER A 15 9.730 1.873 5.518 1.00 0.00 N ATOM 179 CA SER A 15 10.032 1.389 6.860 1.00 0.00 C ATOM 180 C SER A 15 10.668 0.003 6.807 1.00 0.00 C ATOM 181 O SER A 15 10.431 -0.835 7.678 1.00 0.00 O ATOM 182 CB SER A 15 8.759 1.346 7.708 1.00 0.00 C ATOM 183 OG SER A 15 9.062 1.107 9.071 1.00 0.00 O ATOM 0 H SER A 15 9.237 1.203 4.928 1.00 0.00 H new ATOM 0 HA SER A 15 10.742 2.079 7.317 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.222 2.290 7.612 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.097 0.563 7.337 1.00 0.00 H new ATOM 0 HG SER A 15 9.768 0.430 9.135 1.00 0.00 H new ATOM 189 N VAL A 16 11.476 -0.232 5.779 1.00 0.00 N ATOM 190 CA VAL A 16 12.148 -1.515 5.611 1.00 0.00 C ATOM 191 C VAL A 16 13.344 -1.636 6.549 1.00 0.00 C ATOM 192 O VAL A 16 14.087 -0.675 6.751 1.00 0.00 O ATOM 193 CB VAL A 16 12.625 -1.713 4.160 1.00 0.00 C ATOM 194 CG1 VAL A 16 13.640 -0.645 3.781 1.00 0.00 C ATOM 195 CG2 VAL A 16 13.211 -3.105 3.978 1.00 0.00 C ATOM 0 H VAL A 16 11.682 0.450 5.049 1.00 0.00 H new ATOM 0 HA VAL A 16 11.419 -2.288 5.855 1.00 0.00 H new ATOM 0 HB VAL A 16 11.766 -1.615 3.497 1.00 0.00 H new ATOM 0 HG11 VAL A 16 13.966 -0.801 2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 16 13.182 0.340 3.871 1.00 0.00 H new ATOM 0 HG13 VAL A 16 14.500 -0.708 4.447 1.00 0.00 H new ATOM 0 HG21 VAL A 16 13.543 -3.228 2.947 1.00 0.00 H new ATOM 0 HG22 VAL A 16 14.059 -3.233 4.650 1.00 0.00 H new ATOM 0 HG23 VAL A 16 12.451 -3.852 4.206 1.00 0.00 H new ATOM 205 N SER A 17 13.524 -2.823 7.119 1.00 0.00 N ATOM 206 CA SER A 17 14.628 -3.069 8.039 1.00 0.00 C ATOM 207 C SER A 17 15.870 -3.534 7.285 1.00 0.00 C ATOM 208 O SER A 17 16.991 -3.139 7.608 1.00 0.00 O ATOM 209 CB SER A 17 14.229 -4.117 9.080 1.00 0.00 C ATOM 210 OG SER A 17 15.259 -4.307 10.033 1.00 0.00 O ATOM 0 H SER A 17 12.920 -3.629 6.960 1.00 0.00 H new ATOM 0 HA SER A 17 14.860 -2.133 8.546 1.00 0.00 H new ATOM 0 HB2 SER A 17 13.316 -3.803 9.585 1.00 0.00 H new ATOM 0 HB3 SER A 17 14.010 -5.062 8.583 1.00 0.00 H new ATOM 0 HG SER A 17 14.979 -4.980 10.688 1.00 0.00 H new ATOM 216 N ASP A 18 15.663 -4.374 6.277 1.00 0.00 N ATOM 217 CA ASP A 18 16.765 -4.893 5.475 1.00 0.00 C ATOM 218 C ASP A 18 17.266 -3.838 4.494 1.00 0.00 C ATOM 219 O ASP A 18 16.492 -3.289 3.709 1.00 0.00 O ATOM 220 CB ASP A 18 16.325 -6.146 4.715 1.00 0.00 C ATOM 221 CG ASP A 18 16.566 -7.416 5.506 1.00 0.00 C ATOM 222 OD1 ASP A 18 15.851 -7.638 6.506 1.00 0.00 O ATOM 223 OD2 ASP A 18 17.470 -8.190 5.125 1.00 0.00 O ATOM 0 H ASP A 18 14.742 -4.710 5.996 1.00 0.00 H new ATOM 0 HA ASP A 18 17.581 -5.154 6.149 1.00 0.00 H new ATOM 0 HB2 ASP A 18 15.265 -6.067 4.473 1.00 0.00 H new ATOM 0 HB3 ASP A 18 16.864 -6.202 3.769 1.00 0.00 H new ATOM 228 N GLN A 19 18.564 -3.558 4.545 1.00 0.00 N ATOM 229 CA GLN A 19 19.168 -2.567 3.662 1.00 0.00 C ATOM 230 C GLN A 19 19.550 -3.192 2.324 1.00 0.00 C ATOM 231 O GLN A 19 19.747 -2.488 1.333 1.00 0.00 O ATOM 232 CB GLN A 19 20.402 -1.950 4.321 1.00 0.00 C ATOM 233 CG GLN A 19 21.661 -2.786 4.158 1.00 0.00 C ATOM 234 CD GLN A 19 22.482 -2.375 2.952 1.00 0.00 C ATOM 235 OE1 GLN A 19 22.082 -2.598 1.809 1.00 0.00 O ATOM 236 NE2 GLN A 19 23.638 -1.771 3.200 1.00 0.00 N ATOM 0 H GLN A 19 19.218 -4.003 5.189 1.00 0.00 H new ATOM 0 HA GLN A 19 18.433 -1.783 3.480 1.00 0.00 H new ATOM 0 HB2 GLN A 19 20.575 -0.961 3.896 1.00 0.00 H new ATOM 0 HB3 GLN A 19 20.204 -1.810 5.384 1.00 0.00 H new ATOM 0 HG2 GLN A 19 22.272 -2.695 5.056 1.00 0.00 H new ATOM 0 HG3 GLN A 19 21.385 -3.836 4.064 1.00 0.00 H new ATOM 0 HE21 GLN A 19 23.931 -1.606 4.163 1.00 0.00 H new ATOM 0 HE22 GLN A 19 24.233 -1.472 2.428 1.00 0.00 H new ATOM 245 N PHE A 20 19.652 -4.516 2.302 1.00 0.00 N ATOM 246 CA PHE A 20 20.012 -5.236 1.086 1.00 0.00 C ATOM 247 C PHE A 20 18.785 -5.474 0.211 1.00 0.00 C ATOM 248 O PHE A 20 18.701 -6.475 -0.500 1.00 0.00 O ATOM 249 CB PHE A 20 20.671 -6.572 1.435 1.00 0.00 C ATOM 250 CG PHE A 20 21.593 -6.496 2.618 1.00 0.00 C ATOM 251 CD1 PHE A 20 22.522 -5.474 2.724 1.00 0.00 C ATOM 252 CD2 PHE A 20 21.529 -7.446 3.624 1.00 0.00 C ATOM 253 CE1 PHE A 20 23.372 -5.401 3.812 1.00 0.00 C ATOM 254 CE2 PHE A 20 22.376 -7.377 4.715 1.00 0.00 C ATOM 255 CZ PHE A 20 23.299 -6.354 4.808 1.00 0.00 C ATOM 0 H PHE A 20 19.490 -5.113 3.113 1.00 0.00 H new ATOM 0 HA PHE A 20 20.721 -4.624 0.528 1.00 0.00 H new ATOM 0 HB2 PHE A 20 19.894 -7.309 1.637 1.00 0.00 H new ATOM 0 HB3 PHE A 20 21.231 -6.928 0.570 1.00 0.00 H new ATOM 0 HD1 PHE A 20 22.583 -4.726 1.948 1.00 0.00 H new ATOM 0 HD2 PHE A 20 20.810 -8.249 3.556 1.00 0.00 H new ATOM 0 HE1 PHE A 20 24.092 -4.599 3.883 1.00 0.00 H new ATOM 0 HE2 PHE A 20 22.316 -8.123 5.494 1.00 0.00 H new ATOM 0 HZ PHE A 20 23.963 -6.300 5.658 1.00 0.00 H new ATOM 265 N TYR A 21 17.835 -4.547 0.271 1.00 0.00 N ATOM 266 CA TYR A 21 16.611 -4.656 -0.513 1.00 0.00 C ATOM 267 C TYR A 21 16.911 -4.576 -2.007 1.00 0.00 C ATOM 268 O TYR A 21 16.923 -3.493 -2.592 1.00 0.00 O ATOM 269 CB TYR A 21 15.628 -3.552 -0.119 1.00 0.00 C ATOM 270 CG TYR A 21 14.178 -3.941 -0.295 1.00 0.00 C ATOM 271 CD1 TYR A 21 13.805 -4.910 -1.217 1.00 0.00 C ATOM 272 CD2 TYR A 21 13.180 -3.340 0.463 1.00 0.00 C ATOM 273 CE1 TYR A 21 12.481 -5.268 -1.381 1.00 0.00 C ATOM 274 CE2 TYR A 21 11.854 -3.692 0.307 1.00 0.00 C ATOM 275 CZ TYR A 21 11.509 -4.657 -0.617 1.00 0.00 C ATOM 276 OH TYR A 21 10.189 -5.012 -0.776 1.00 0.00 O ATOM 0 H TYR A 21 17.889 -3.712 0.854 1.00 0.00 H new ATOM 0 HA TYR A 21 16.161 -5.626 -0.303 1.00 0.00 H new ATOM 0 HB2 TYR A 21 15.799 -3.280 0.923 1.00 0.00 H new ATOM 0 HB3 TYR A 21 15.833 -2.664 -0.718 1.00 0.00 H new ATOM 0 HD1 TYR A 21 14.563 -5.392 -1.816 1.00 0.00 H new ATOM 0 HD2 TYR A 21 13.446 -2.584 1.187 1.00 0.00 H new ATOM 0 HE1 TYR A 21 12.208 -6.023 -2.104 1.00 0.00 H new ATOM 0 HE2 TYR A 21 11.091 -3.215 0.905 1.00 0.00 H new ATOM 0 HH TYR A 21 9.930 -5.634 -0.065 1.00 0.00 H new ATOM 286 N ARG A 22 17.152 -5.732 -2.618 1.00 0.00 N ATOM 287 CA ARG A 22 17.453 -5.794 -4.043 1.00 0.00 C ATOM 288 C ARG A 22 16.399 -5.046 -4.854 1.00 0.00 C ATOM 289 O ARG A 22 16.719 -4.131 -5.613 1.00 0.00 O ATOM 290 CB ARG A 22 17.530 -7.250 -4.506 1.00 0.00 C ATOM 291 CG ARG A 22 18.298 -7.436 -5.805 1.00 0.00 C ATOM 292 CD ARG A 22 17.427 -7.134 -7.014 1.00 0.00 C ATOM 293 NE ARG A 22 18.214 -7.011 -8.238 1.00 0.00 N ATOM 294 CZ ARG A 22 17.775 -6.408 -9.337 1.00 0.00 C ATOM 295 NH1 ARG A 22 16.561 -5.875 -9.365 1.00 0.00 N ATOM 296 NH2 ARG A 22 18.551 -6.336 -10.411 1.00 0.00 N ATOM 0 H ARG A 22 17.145 -6.637 -2.148 1.00 0.00 H new ATOM 0 HA ARG A 22 18.419 -5.316 -4.206 1.00 0.00 H new ATOM 0 HB2 ARG A 22 18.003 -7.846 -3.726 1.00 0.00 H new ATOM 0 HB3 ARG A 22 16.519 -7.636 -4.633 1.00 0.00 H new ATOM 0 HG2 ARG A 22 19.170 -6.782 -5.811 1.00 0.00 H new ATOM 0 HG3 ARG A 22 18.667 -8.460 -5.868 1.00 0.00 H new ATOM 0 HD2 ARG A 22 16.689 -7.926 -7.136 1.00 0.00 H new ATOM 0 HD3 ARG A 22 16.877 -6.209 -6.842 1.00 0.00 H new ATOM 0 HE ARG A 22 19.153 -7.410 -8.250 1.00 0.00 H new ATOM 0 HH11 ARG A 22 15.962 -5.928 -8.541 1.00 0.00 H new ATOM 0 HH12 ARG A 22 16.226 -5.413 -10.210 1.00 0.00 H new ATOM 0 HH21 ARG A 22 19.486 -6.744 -10.393 1.00 0.00 H new ATOM 0 HH22 ARG A 22 18.213 -5.873 -11.254 1.00 0.00 H new ATOM 310 N TYR A 23 15.142 -5.443 -4.690 1.00 0.00 N ATOM 311 CA TYR A 23 14.041 -4.813 -5.409 1.00 0.00 C ATOM 312 C TYR A 23 13.965 -3.323 -5.091 1.00 0.00 C ATOM 313 O TYR A 23 14.096 -2.914 -3.937 1.00 0.00 O ATOM 314 CB TYR A 23 12.717 -5.490 -5.051 1.00 0.00 C ATOM 315 CG TYR A 23 12.790 -7.000 -5.051 1.00 0.00 C ATOM 316 CD1 TYR A 23 13.657 -7.674 -5.902 1.00 0.00 C ATOM 317 CD2 TYR A 23 11.992 -7.754 -4.198 1.00 0.00 C ATOM 318 CE1 TYR A 23 13.726 -9.054 -5.905 1.00 0.00 C ATOM 319 CE2 TYR A 23 12.055 -9.134 -4.194 1.00 0.00 C ATOM 320 CZ TYR A 23 12.924 -9.779 -5.049 1.00 0.00 C ATOM 321 OH TYR A 23 12.991 -11.153 -5.049 1.00 0.00 O ATOM 0 H TYR A 23 14.860 -6.198 -4.065 1.00 0.00 H new ATOM 0 HA TYR A 23 14.224 -4.930 -6.477 1.00 0.00 H new ATOM 0 HB2 TYR A 23 12.400 -5.150 -4.065 1.00 0.00 H new ATOM 0 HB3 TYR A 23 11.952 -5.172 -5.760 1.00 0.00 H new ATOM 0 HD1 TYR A 23 14.288 -7.110 -6.573 1.00 0.00 H new ATOM 0 HD2 TYR A 23 11.311 -7.252 -3.527 1.00 0.00 H new ATOM 0 HE1 TYR A 23 14.404 -9.562 -6.574 1.00 0.00 H new ATOM 0 HE2 TYR A 23 11.427 -9.704 -3.525 1.00 0.00 H new ATOM 0 HH TYR A 23 12.363 -11.511 -4.387 1.00 0.00 H new ATOM 331 N LYS A 24 13.751 -2.515 -6.124 1.00 0.00 N ATOM 332 CA LYS A 24 13.655 -1.069 -5.958 1.00 0.00 C ATOM 333 C LYS A 24 12.510 -0.501 -6.790 1.00 0.00 C ATOM 334 O LYS A 24 12.174 -1.035 -7.847 1.00 0.00 O ATOM 335 CB LYS A 24 14.972 -0.400 -6.359 1.00 0.00 C ATOM 336 CG LYS A 24 16.122 -0.709 -5.416 1.00 0.00 C ATOM 337 CD LYS A 24 16.201 0.300 -4.283 1.00 0.00 C ATOM 338 CE LYS A 24 17.305 -0.054 -3.298 1.00 0.00 C ATOM 339 NZ LYS A 24 16.822 -0.973 -2.230 1.00 0.00 N ATOM 0 H LYS A 24 13.641 -2.837 -7.086 1.00 0.00 H new ATOM 0 HA LYS A 24 13.455 -0.862 -4.907 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.242 -0.721 -7.365 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.825 0.679 -6.398 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.997 -1.711 -5.004 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.060 -0.708 -5.972 1.00 0.00 H new ATOM 0 HD2 LYS A 24 16.381 1.294 -4.692 1.00 0.00 H new ATOM 0 HD3 LYS A 24 15.245 0.339 -3.761 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.132 -0.521 -3.832 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.693 0.858 -2.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 17.475 -0.939 -1.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 15.873 -0.679 -1.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 16.780 -1.944 -2.600 1.00 0.00 H new ATOM 353 N MET A 25 11.916 0.586 -6.307 1.00 0.00 N ATOM 354 CA MET A 25 10.811 1.227 -7.009 1.00 0.00 C ATOM 355 C MET A 25 11.080 2.717 -7.201 1.00 0.00 C ATOM 356 O MET A 25 11.734 3.364 -6.383 1.00 0.00 O ATOM 357 CB MET A 25 9.505 1.028 -6.238 1.00 0.00 C ATOM 358 CG MET A 25 9.564 1.526 -4.804 1.00 0.00 C ATOM 359 SD MET A 25 9.263 3.299 -4.671 1.00 0.00 S ATOM 360 CE MET A 25 7.996 3.334 -3.406 1.00 0.00 C ATOM 0 H MET A 25 12.181 1.040 -5.433 1.00 0.00 H new ATOM 0 HA MET A 25 10.719 0.763 -7.991 1.00 0.00 H new ATOM 0 HB2 MET A 25 8.701 1.546 -6.761 1.00 0.00 H new ATOM 0 HB3 MET A 25 9.252 -0.032 -6.236 1.00 0.00 H new ATOM 0 HG2 MET A 25 8.826 0.990 -4.207 1.00 0.00 H new ATOM 0 HG3 MET A 25 10.543 1.295 -4.383 1.00 0.00 H new ATOM 0 HE1 MET A 25 7.704 4.366 -3.212 1.00 0.00 H new ATOM 0 HE2 MET A 25 7.128 2.769 -3.745 1.00 0.00 H new ATOM 0 HE3 MET A 25 8.384 2.888 -2.490 1.00 0.00 H new ATOM 370 N PRO A 26 10.564 3.275 -8.306 1.00 0.00 N ATOM 371 CA PRO A 26 10.735 4.694 -8.629 1.00 0.00 C ATOM 372 C PRO A 26 9.953 5.603 -7.687 1.00 0.00 C ATOM 373 O PRO A 26 8.764 5.390 -7.450 1.00 0.00 O ATOM 374 CB PRO A 26 10.186 4.802 -10.054 1.00 0.00 C ATOM 375 CG PRO A 26 9.220 3.674 -10.174 1.00 0.00 C ATOM 376 CD PRO A 26 9.773 2.564 -9.324 1.00 0.00 C ATOM 0 HA PRO A 26 11.773 5.011 -8.532 1.00 0.00 H new ATOM 0 HB2 PRO A 26 9.696 5.762 -10.218 1.00 0.00 H new ATOM 0 HB3 PRO A 26 10.983 4.721 -10.793 1.00 0.00 H new ATOM 0 HG2 PRO A 26 8.229 3.971 -9.832 1.00 0.00 H new ATOM 0 HG3 PRO A 26 9.117 3.357 -11.212 1.00 0.00 H new ATOM 0 HD2 PRO A 26 8.979 1.970 -8.873 1.00 0.00 H new ATOM 0 HD3 PRO A 26 10.390 1.881 -9.907 1.00 0.00 H new ATOM 384 N ARG A 27 10.628 6.615 -7.152 1.00 0.00 N ATOM 385 CA ARG A 27 9.995 7.555 -6.235 1.00 0.00 C ATOM 386 C ARG A 27 8.806 8.245 -6.897 1.00 0.00 C ATOM 387 O ARG A 27 8.956 8.924 -7.914 1.00 0.00 O ATOM 388 CB ARG A 27 11.008 8.601 -5.765 1.00 0.00 C ATOM 389 CG ARG A 27 12.366 8.018 -5.411 1.00 0.00 C ATOM 390 CD ARG A 27 13.260 9.052 -4.745 1.00 0.00 C ATOM 391 NE ARG A 27 13.373 10.272 -5.540 1.00 0.00 N ATOM 392 CZ ARG A 27 13.760 11.441 -5.041 1.00 0.00 C ATOM 393 NH1 ARG A 27 14.069 11.548 -3.757 1.00 0.00 N ATOM 394 NH2 ARG A 27 13.839 12.506 -5.829 1.00 0.00 N ATOM 0 H ARG A 27 11.613 6.805 -7.338 1.00 0.00 H new ATOM 0 HA ARG A 27 9.633 6.995 -5.373 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.136 9.348 -6.548 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.606 9.118 -4.894 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.235 7.166 -4.744 1.00 0.00 H new ATOM 0 HG3 ARG A 27 12.850 7.645 -6.314 1.00 0.00 H new ATOM 0 HD2 ARG A 27 12.860 9.297 -3.761 1.00 0.00 H new ATOM 0 HD3 ARG A 27 14.252 8.627 -4.590 1.00 0.00 H new ATOM 0 HE ARG A 27 13.142 10.224 -6.532 1.00 0.00 H new ATOM 0 HH11 ARG A 27 14.010 10.731 -3.149 1.00 0.00 H new ATOM 0 HH12 ARG A 27 14.366 12.447 -3.377 1.00 0.00 H new ATOM 0 HH21 ARG A 27 13.603 12.427 -6.818 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.136 13.403 -5.446 1.00 0.00 H new ATOM 408 N LEU A 28 7.625 8.064 -6.316 1.00 0.00 N ATOM 409 CA LEU A 28 6.409 8.669 -6.849 1.00 0.00 C ATOM 410 C LEU A 28 6.499 10.191 -6.818 1.00 0.00 C ATOM 411 O LEU A 28 6.998 10.774 -5.855 1.00 0.00 O ATOM 412 CB LEU A 28 5.191 8.202 -6.050 1.00 0.00 C ATOM 413 CG LEU A 28 4.747 9.116 -4.908 1.00 0.00 C ATOM 414 CD1 LEU A 28 4.010 10.330 -5.453 1.00 0.00 C ATOM 415 CD2 LEU A 28 3.870 8.354 -3.925 1.00 0.00 C ATOM 0 H LEU A 28 7.483 7.503 -5.476 1.00 0.00 H new ATOM 0 HA LEU A 28 6.299 8.351 -7.886 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.354 8.081 -6.738 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.408 7.217 -5.637 1.00 0.00 H new ATOM 0 HG LEU A 28 5.635 9.462 -4.379 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.701 10.970 -4.626 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.670 10.888 -6.117 1.00 0.00 H new ATOM 0 HD13 LEU A 28 3.130 10.003 -6.007 1.00 0.00 H new ATOM 0 HD21 LEU A 28 3.563 9.020 -3.119 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.987 7.978 -4.441 1.00 0.00 H new ATOM 0 HD23 LEU A 28 4.431 7.517 -3.510 1.00 0.00 H new ATOM 427 N ILE A 29 6.011 10.829 -7.877 1.00 0.00 N ATOM 428 CA ILE A 29 6.033 12.283 -7.969 1.00 0.00 C ATOM 429 C ILE A 29 4.637 12.867 -7.784 1.00 0.00 C ATOM 430 O ILE A 29 3.635 12.182 -7.987 1.00 0.00 O ATOM 431 CB ILE A 29 6.599 12.753 -9.323 1.00 0.00 C ATOM 432 CG1 ILE A 29 8.014 12.209 -9.525 1.00 0.00 C ATOM 433 CG2 ILE A 29 6.593 14.272 -9.400 1.00 0.00 C ATOM 434 CD1 ILE A 29 8.397 12.048 -10.980 1.00 0.00 C ATOM 0 H ILE A 29 5.596 10.361 -8.683 1.00 0.00 H new ATOM 0 HA ILE A 29 6.682 12.640 -7.169 1.00 0.00 H new ATOM 0 HB ILE A 29 5.964 12.366 -10.120 1.00 0.00 H new ATOM 0 HG12 ILE A 29 8.725 12.880 -9.043 1.00 0.00 H new ATOM 0 HG13 ILE A 29 8.098 11.243 -9.026 1.00 0.00 H new ATOM 0 HG21 ILE A 29 6.996 14.589 -10.362 1.00 0.00 H new ATOM 0 HG22 ILE A 29 5.571 14.638 -9.296 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.208 14.679 -8.597 1.00 0.00 H new ATOM 0 HD11 ILE A 29 9.413 11.658 -11.048 1.00 0.00 H new ATOM 0 HD12 ILE A 29 7.709 11.354 -11.463 1.00 0.00 H new ATOM 0 HD13 ILE A 29 8.346 13.016 -11.479 1.00 0.00 H new ATOM 446 N ALA A 30 4.579 14.138 -7.400 1.00 0.00 N ATOM 447 CA ALA A 30 3.305 14.816 -7.191 1.00 0.00 C ATOM 448 C ALA A 30 3.352 16.246 -7.719 1.00 0.00 C ATOM 449 O ALA A 30 4.211 17.036 -7.327 1.00 0.00 O ATOM 450 CB ALA A 30 2.938 14.807 -5.715 1.00 0.00 C ATOM 0 H ALA A 30 5.399 14.719 -7.227 1.00 0.00 H new ATOM 0 HA ALA A 30 2.538 14.276 -7.747 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.985 15.317 -5.574 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.854 13.777 -5.367 1.00 0.00 H new ATOM 0 HB3 ALA A 30 3.712 15.321 -5.145 1.00 0.00 H new ATOM 456 N LYS A 31 2.422 16.573 -8.610 1.00 0.00 N ATOM 457 CA LYS A 31 2.356 17.908 -9.192 1.00 0.00 C ATOM 458 C LYS A 31 1.271 18.742 -8.518 1.00 0.00 C ATOM 459 O LYS A 31 0.134 18.294 -8.366 1.00 0.00 O ATOM 460 CB LYS A 31 2.085 17.819 -10.695 1.00 0.00 C ATOM 461 CG LYS A 31 2.675 18.973 -11.489 1.00 0.00 C ATOM 462 CD LYS A 31 2.299 18.887 -12.959 1.00 0.00 C ATOM 463 CE LYS A 31 3.101 17.812 -13.677 1.00 0.00 C ATOM 464 NZ LYS A 31 3.008 17.947 -15.157 1.00 0.00 N ATOM 0 H LYS A 31 1.703 15.931 -8.945 1.00 0.00 H new ATOM 0 HA LYS A 31 3.318 18.395 -9.031 1.00 0.00 H new ATOM 0 HB2 LYS A 31 2.493 16.882 -11.074 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.008 17.788 -10.860 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.322 19.918 -11.077 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.760 18.968 -11.389 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.235 18.671 -13.051 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.471 19.851 -13.437 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.146 17.873 -13.372 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.739 16.828 -13.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.568 17.197 -15.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.014 17.863 -15.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.377 18.876 -15.445 1.00 0.00 H new ATOM 478 N VAL A 32 1.628 19.958 -8.116 1.00 0.00 N ATOM 479 CA VAL A 32 0.684 20.855 -7.461 1.00 0.00 C ATOM 480 C VAL A 32 0.761 22.259 -8.050 1.00 0.00 C ATOM 481 O VAL A 32 1.819 22.695 -8.503 1.00 0.00 O ATOM 482 CB VAL A 32 0.943 20.932 -5.944 1.00 0.00 C ATOM 483 CG1 VAL A 32 -0.158 21.721 -5.254 1.00 0.00 C ATOM 484 CG2 VAL A 32 1.060 19.535 -5.353 1.00 0.00 C ATOM 0 H VAL A 32 2.565 20.344 -8.233 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.312 20.446 -7.632 1.00 0.00 H new ATOM 0 HB VAL A 32 1.887 21.452 -5.779 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.042 21.765 -4.183 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.189 22.733 -5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.117 21.232 -5.424 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.243 19.608 -4.281 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.134 18.988 -5.527 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.888 19.007 -5.827 1.00 0.00 H new ATOM 494 N GLU A 33 -0.367 22.962 -8.039 1.00 0.00 N ATOM 495 CA GLU A 33 -0.427 24.318 -8.573 1.00 0.00 C ATOM 496 C GLU A 33 -1.189 25.242 -7.628 1.00 0.00 C ATOM 497 O GLU A 33 -2.005 24.790 -6.826 1.00 0.00 O ATOM 498 CB GLU A 33 -1.092 24.318 -9.951 1.00 0.00 C ATOM 499 CG GLU A 33 -0.248 23.666 -11.034 1.00 0.00 C ATOM 500 CD GLU A 33 -0.902 23.732 -12.401 1.00 0.00 C ATOM 501 OE1 GLU A 33 -0.815 24.796 -13.049 1.00 0.00 O ATOM 502 OE2 GLU A 33 -1.500 22.720 -12.823 1.00 0.00 O ATOM 0 H GLU A 33 -1.251 22.616 -7.667 1.00 0.00 H new ATOM 0 HA GLU A 33 0.594 24.688 -8.670 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.047 23.798 -9.884 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.309 25.346 -10.241 1.00 0.00 H new ATOM 0 HG2 GLU A 33 0.724 24.156 -11.076 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -0.068 22.624 -10.771 1.00 0.00 H new ATOM 509 N GLY A 34 -0.917 26.539 -7.730 1.00 0.00 N ATOM 510 CA GLY A 34 -1.584 27.506 -6.879 1.00 0.00 C ATOM 511 C GLY A 34 -1.634 27.066 -5.429 1.00 0.00 C ATOM 512 O GLY A 34 -0.941 26.129 -5.033 1.00 0.00 O ATOM 0 H GLY A 34 -0.246 26.937 -8.387 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -1.067 28.463 -6.947 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -2.599 27.666 -7.242 1.00 0.00 H new ATOM 516 N LYS A 35 -2.454 27.746 -4.634 1.00 0.00 N ATOM 517 CA LYS A 35 -2.592 27.421 -3.220 1.00 0.00 C ATOM 518 C LYS A 35 -3.963 27.837 -2.697 1.00 0.00 C ATOM 519 O LYS A 35 -4.225 29.021 -2.489 1.00 0.00 O ATOM 520 CB LYS A 35 -1.493 28.111 -2.407 1.00 0.00 C ATOM 521 CG LYS A 35 -1.314 29.579 -2.751 1.00 0.00 C ATOM 522 CD LYS A 35 -0.301 29.771 -3.868 1.00 0.00 C ATOM 523 CE LYS A 35 -0.313 31.198 -4.393 1.00 0.00 C ATOM 524 NZ LYS A 35 0.278 32.154 -3.416 1.00 0.00 N ATOM 0 H LYS A 35 -3.033 28.526 -4.946 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.493 26.341 -3.110 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -1.726 28.021 -1.346 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -0.550 27.590 -2.571 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -2.272 30.003 -3.051 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -0.988 30.124 -1.865 1.00 0.00 H new ATOM 0 HD2 LYS A 35 0.696 29.525 -3.502 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.521 29.081 -4.682 1.00 0.00 H new ATOM 0 HE2 LYS A 35 0.243 31.245 -5.329 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -1.338 31.494 -4.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 0.251 33.116 -3.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -0.268 32.128 -2.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 1.264 31.887 -3.222 1.00 0.00 H new ATOM 538 N GLY A 36 -4.834 26.855 -2.485 1.00 0.00 N ATOM 539 CA GLY A 36 -6.167 27.141 -1.987 1.00 0.00 C ATOM 540 C GLY A 36 -7.113 27.587 -3.085 1.00 0.00 C ATOM 541 O GLY A 36 -8.295 27.248 -3.070 1.00 0.00 O ATOM 0 H GLY A 36 -4.640 25.867 -2.649 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.570 26.251 -1.504 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.108 27.918 -1.225 1.00 0.00 H new ATOM 545 N ASN A 37 -6.591 28.351 -4.039 1.00 0.00 N ATOM 546 CA ASN A 37 -7.398 28.846 -5.148 1.00 0.00 C ATOM 547 C ASN A 37 -7.505 27.799 -6.253 1.00 0.00 C ATOM 548 O ASN A 37 -7.525 28.131 -7.437 1.00 0.00 O ATOM 549 CB ASN A 37 -6.795 30.136 -5.709 1.00 0.00 C ATOM 550 CG ASN A 37 -7.209 31.360 -4.916 1.00 0.00 C ATOM 551 OD1 ASN A 37 -6.578 31.711 -3.919 1.00 0.00 O ATOM 552 ND2 ASN A 37 -8.276 32.017 -5.357 1.00 0.00 N ATOM 0 H ASN A 37 -5.613 28.641 -4.066 1.00 0.00 H new ATOM 0 HA ASN A 37 -8.399 29.055 -4.771 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -5.708 30.056 -5.708 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -7.105 30.257 -6.747 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.603 32.848 -4.865 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.769 31.690 -6.188 1.00 0.00 H new ATOM 559 N GLY A 38 -7.576 26.532 -5.855 1.00 0.00 N ATOM 560 CA GLY A 38 -7.681 25.456 -6.823 1.00 0.00 C ATOM 561 C GLY A 38 -6.482 24.529 -6.792 1.00 0.00 C ATOM 562 O GLY A 38 -6.124 23.932 -7.807 1.00 0.00 O ATOM 0 H GLY A 38 -7.563 26.232 -4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.586 24.881 -6.626 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -7.783 25.879 -7.822 1.00 0.00 H new ATOM 566 N ILE A 39 -5.860 24.409 -5.624 1.00 0.00 N ATOM 567 CA ILE A 39 -4.694 23.548 -5.465 1.00 0.00 C ATOM 568 C ILE A 39 -5.096 22.078 -5.438 1.00 0.00 C ATOM 569 O ILE A 39 -6.000 21.683 -4.700 1.00 0.00 O ATOM 570 CB ILE A 39 -3.920 23.881 -4.176 1.00 0.00 C ATOM 571 CG1 ILE A 39 -2.604 23.102 -4.130 1.00 0.00 C ATOM 572 CG2 ILE A 39 -4.769 23.570 -2.953 1.00 0.00 C ATOM 573 CD1 ILE A 39 -1.622 23.635 -3.110 1.00 0.00 C ATOM 0 H ILE A 39 -6.144 24.897 -4.774 1.00 0.00 H new ATOM 0 HA ILE A 39 -4.048 23.730 -6.324 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.690 24.946 -4.173 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.817 22.057 -3.905 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.141 23.128 -5.116 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.208 23.811 -2.050 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.682 24.165 -2.983 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -5.027 22.511 -2.949 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.712 23.035 -3.133 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.379 24.671 -3.346 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.066 23.583 -2.116 1.00 0.00 H new ATOM 585 N LYS A 40 -4.418 21.269 -6.245 1.00 0.00 N ATOM 586 CA LYS A 40 -4.701 19.841 -6.313 1.00 0.00 C ATOM 587 C LYS A 40 -3.414 19.037 -6.467 1.00 0.00 C ATOM 588 O LYS A 40 -2.439 19.513 -7.050 1.00 0.00 O ATOM 589 CB LYS A 40 -5.645 19.541 -7.479 1.00 0.00 C ATOM 590 CG LYS A 40 -5.091 19.955 -8.832 1.00 0.00 C ATOM 591 CD LYS A 40 -5.978 19.475 -9.968 1.00 0.00 C ATOM 592 CE LYS A 40 -7.282 20.255 -10.026 1.00 0.00 C ATOM 593 NZ LYS A 40 -8.317 19.673 -9.128 1.00 0.00 N ATOM 0 H LYS A 40 -3.667 21.579 -6.862 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.182 19.548 -5.380 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.861 18.473 -7.495 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -6.592 20.055 -7.311 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.001 21.041 -8.873 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -4.088 19.548 -8.955 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -5.448 19.580 -10.914 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -6.193 18.414 -9.840 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -7.098 21.292 -9.744 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.654 20.265 -11.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -9.203 19.544 -9.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -7.990 18.752 -8.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -8.482 20.315 -8.327 1.00 0.00 H new ATOM 607 N THR A 41 -3.417 17.815 -5.944 1.00 0.00 N ATOM 608 CA THR A 41 -2.250 16.946 -6.024 1.00 0.00 C ATOM 609 C THR A 41 -2.415 15.904 -7.125 1.00 0.00 C ATOM 610 O THR A 41 -3.275 15.027 -7.039 1.00 0.00 O ATOM 611 CB THR A 41 -1.992 16.227 -4.687 1.00 0.00 C ATOM 612 OG1 THR A 41 -1.936 17.181 -3.621 1.00 0.00 O ATOM 613 CG2 THR A 41 -0.692 15.439 -4.738 1.00 0.00 C ATOM 0 H THR A 41 -4.216 17.405 -5.460 1.00 0.00 H new ATOM 0 HA THR A 41 -1.397 17.583 -6.255 1.00 0.00 H new ATOM 0 HB THR A 41 -2.813 15.532 -4.509 1.00 0.00 H new ATOM 0 HG1 THR A 41 -2.829 17.554 -3.468 1.00 0.00 H new ATOM 0 HG21 THR A 41 -0.531 14.940 -3.782 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.749 14.694 -5.531 1.00 0.00 H new ATOM 0 HG23 THR A 41 0.137 16.118 -4.937 1.00 0.00 H new ATOM 621 N VAL A 42 -1.586 16.006 -8.159 1.00 0.00 N ATOM 622 CA VAL A 42 -1.639 15.071 -9.276 1.00 0.00 C ATOM 623 C VAL A 42 -0.444 14.125 -9.258 1.00 0.00 C ATOM 624 O VAL A 42 0.697 14.546 -9.453 1.00 0.00 O ATOM 625 CB VAL A 42 -1.673 15.811 -10.626 1.00 0.00 C ATOM 626 CG1 VAL A 42 -1.946 14.837 -11.763 1.00 0.00 C ATOM 627 CG2 VAL A 42 -2.717 16.918 -10.600 1.00 0.00 C ATOM 0 H VAL A 42 -0.870 16.727 -8.246 1.00 0.00 H new ATOM 0 HA VAL A 42 -2.557 14.494 -9.163 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.697 16.266 -10.796 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -1.966 15.378 -12.709 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -1.159 14.083 -11.793 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.908 14.351 -11.602 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.728 17.431 -11.562 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.700 16.487 -10.408 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.473 17.630 -9.812 1.00 0.00 H new ATOM 637 N ILE A 43 -0.713 12.845 -9.024 1.00 0.00 N ATOM 638 CA ILE A 43 0.340 11.838 -8.982 1.00 0.00 C ATOM 639 C ILE A 43 0.736 11.398 -10.387 1.00 0.00 C ATOM 640 O ILE A 43 0.306 10.348 -10.865 1.00 0.00 O ATOM 641 CB ILE A 43 -0.094 10.602 -8.172 1.00 0.00 C ATOM 642 CG1 ILE A 43 -0.771 11.031 -6.869 1.00 0.00 C ATOM 643 CG2 ILE A 43 1.104 9.710 -7.884 1.00 0.00 C ATOM 644 CD1 ILE A 43 -1.703 9.984 -6.299 1.00 0.00 C ATOM 0 H ILE A 43 -1.652 12.481 -8.861 1.00 0.00 H new ATOM 0 HA ILE A 43 1.198 12.299 -8.493 1.00 0.00 H new ATOM 0 HB ILE A 43 -0.812 10.033 -8.762 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.004 11.264 -6.130 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.333 11.948 -7.046 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.781 8.841 -7.311 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.547 9.381 -8.824 1.00 0.00 H new ATOM 0 HG23 ILE A 43 1.844 10.268 -7.310 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.147 10.356 -5.376 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.491 9.768 -7.020 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -1.142 9.073 -6.090 1.00 0.00 H new ATOM 656 N VAL A 44 1.560 12.208 -11.045 1.00 0.00 N ATOM 657 CA VAL A 44 2.017 11.901 -12.395 1.00 0.00 C ATOM 658 C VAL A 44 2.621 10.503 -12.466 1.00 0.00 C ATOM 659 O VAL A 44 2.217 9.683 -13.290 1.00 0.00 O ATOM 660 CB VAL A 44 3.061 12.924 -12.880 1.00 0.00 C ATOM 661 CG1 VAL A 44 3.519 12.592 -14.292 1.00 0.00 C ATOM 662 CG2 VAL A 44 2.496 14.335 -12.812 1.00 0.00 C ATOM 0 H VAL A 44 1.924 13.082 -10.665 1.00 0.00 H new ATOM 0 HA VAL A 44 1.143 11.949 -13.044 1.00 0.00 H new ATOM 0 HB VAL A 44 3.928 12.872 -12.221 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.256 13.326 -14.617 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.966 11.598 -14.305 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.663 12.614 -14.967 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.247 15.045 -13.158 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.612 14.404 -13.446 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.223 14.569 -11.783 1.00 0.00 H new ATOM 672 N ASN A 45 3.591 10.238 -11.597 1.00 0.00 N ATOM 673 CA ASN A 45 4.251 8.938 -11.562 1.00 0.00 C ATOM 674 C ASN A 45 3.392 7.911 -10.829 1.00 0.00 C ATOM 675 O ASN A 45 3.896 7.122 -10.031 1.00 0.00 O ATOM 676 CB ASN A 45 5.617 9.055 -10.882 1.00 0.00 C ATOM 677 CG ASN A 45 6.630 8.078 -11.447 1.00 0.00 C ATOM 678 OD1 ASN A 45 6.678 7.846 -12.655 1.00 0.00 O ATOM 679 ND2 ASN A 45 7.445 7.499 -10.573 1.00 0.00 N ATOM 0 H ASN A 45 3.937 10.906 -10.908 1.00 0.00 H new ATOM 0 HA ASN A 45 4.391 8.601 -12.589 1.00 0.00 H new ATOM 0 HB2 ASN A 45 5.992 10.072 -10.999 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.504 8.879 -9.812 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.147 6.832 -10.894 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.369 7.721 -9.580 1.00 0.00 H new ATOM 686 N MET A 46 2.093 7.929 -11.107 1.00 0.00 N ATOM 687 CA MET A 46 1.164 6.999 -10.476 1.00 0.00 C ATOM 688 C MET A 46 1.162 5.657 -11.201 1.00 0.00 C ATOM 689 O MET A 46 1.335 4.606 -10.583 1.00 0.00 O ATOM 690 CB MET A 46 -0.249 7.586 -10.462 1.00 0.00 C ATOM 691 CG MET A 46 -1.326 6.569 -10.123 1.00 0.00 C ATOM 692 SD MET A 46 -0.833 5.451 -8.797 1.00 0.00 S ATOM 693 CE MET A 46 -0.976 6.529 -7.374 1.00 0.00 C ATOM 0 H MET A 46 1.660 8.577 -11.765 1.00 0.00 H new ATOM 0 HA MET A 46 1.493 6.837 -9.449 1.00 0.00 H new ATOM 0 HB2 MET A 46 -0.288 8.400 -9.738 1.00 0.00 H new ATOM 0 HB3 MET A 46 -0.464 8.018 -11.439 1.00 0.00 H new ATOM 0 HG2 MET A 46 -2.236 7.093 -9.832 1.00 0.00 H new ATOM 0 HG3 MET A 46 -1.564 5.987 -11.014 1.00 0.00 H new ATOM 0 HE1 MET A 46 0.001 6.642 -6.904 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.341 7.505 -7.692 1.00 0.00 H new ATOM 0 HE3 MET A 46 -1.675 6.096 -6.658 1.00 0.00 H new ATOM 703 N VAL A 47 0.966 5.699 -12.515 1.00 0.00 N ATOM 704 CA VAL A 47 0.942 4.487 -13.324 1.00 0.00 C ATOM 705 C VAL A 47 2.293 3.781 -13.296 1.00 0.00 C ATOM 706 O VAL A 47 2.364 2.553 -13.339 1.00 0.00 O ATOM 707 CB VAL A 47 0.567 4.794 -14.786 1.00 0.00 C ATOM 708 CG1 VAL A 47 0.595 3.525 -15.623 1.00 0.00 C ATOM 709 CG2 VAL A 47 -0.800 5.459 -14.856 1.00 0.00 C ATOM 0 H VAL A 47 0.821 6.560 -13.042 1.00 0.00 H new ATOM 0 HA VAL A 47 0.184 3.834 -12.892 1.00 0.00 H new ATOM 0 HB VAL A 47 1.304 5.485 -15.194 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.327 3.762 -16.653 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.596 3.095 -15.598 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.118 2.807 -15.219 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -1.050 5.669 -15.896 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -1.551 4.793 -14.430 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -0.780 6.392 -14.292 1.00 0.00 H new ATOM 719 N ASP A 48 3.363 4.565 -13.222 1.00 0.00 N ATOM 720 CA ASP A 48 4.713 4.016 -13.186 1.00 0.00 C ATOM 721 C ASP A 48 4.942 3.219 -11.905 1.00 0.00 C ATOM 722 O ASP A 48 5.068 1.995 -11.937 1.00 0.00 O ATOM 723 CB ASP A 48 5.747 5.138 -13.295 1.00 0.00 C ATOM 724 CG ASP A 48 5.980 5.574 -14.728 1.00 0.00 C ATOM 725 OD1 ASP A 48 5.040 5.459 -15.543 1.00 0.00 O ATOM 726 OD2 ASP A 48 7.102 6.028 -15.035 1.00 0.00 O ATOM 0 H ASP A 48 3.321 5.584 -13.186 1.00 0.00 H new ATOM 0 HA ASP A 48 4.827 3.344 -14.036 1.00 0.00 H new ATOM 0 HB2 ASP A 48 5.414 5.994 -12.708 1.00 0.00 H new ATOM 0 HB3 ASP A 48 6.690 4.803 -12.863 1.00 0.00 H new ATOM 731 N VAL A 49 4.995 3.922 -10.779 1.00 0.00 N ATOM 732 CA VAL A 49 5.208 3.281 -9.487 1.00 0.00 C ATOM 733 C VAL A 49 4.317 2.055 -9.328 1.00 0.00 C ATOM 734 O VAL A 49 4.715 1.060 -8.722 1.00 0.00 O ATOM 735 CB VAL A 49 4.934 4.255 -8.325 1.00 0.00 C ATOM 736 CG1 VAL A 49 5.946 5.390 -8.329 1.00 0.00 C ATOM 737 CG2 VAL A 49 3.514 4.796 -8.407 1.00 0.00 C ATOM 0 H VAL A 49 4.893 4.936 -10.735 1.00 0.00 H new ATOM 0 HA VAL A 49 6.253 2.974 -9.455 1.00 0.00 H new ATOM 0 HB VAL A 49 5.038 3.711 -7.386 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.736 6.067 -7.501 1.00 0.00 H new ATOM 0 HG12 VAL A 49 6.951 4.982 -8.218 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.877 5.935 -9.270 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.338 5.482 -7.579 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.380 5.324 -9.351 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.806 3.969 -8.350 1.00 0.00 H new ATOM 747 N ALA A 50 3.109 2.132 -9.877 1.00 0.00 N ATOM 748 CA ALA A 50 2.162 1.027 -9.799 1.00 0.00 C ATOM 749 C ALA A 50 2.588 -0.126 -10.701 1.00 0.00 C ATOM 750 O ALA A 50 2.609 -1.283 -10.280 1.00 0.00 O ATOM 751 CB ALA A 50 0.765 1.502 -10.171 1.00 0.00 C ATOM 0 H ALA A 50 2.763 2.949 -10.381 1.00 0.00 H new ATOM 0 HA ALA A 50 2.149 0.664 -8.771 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.068 0.666 -10.108 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.453 2.288 -9.483 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.773 1.893 -11.188 1.00 0.00 H new ATOM 757 N LYS A 51 2.928 0.196 -11.944 1.00 0.00 N ATOM 758 CA LYS A 51 3.355 -0.813 -12.907 1.00 0.00 C ATOM 759 C LYS A 51 4.503 -1.646 -12.348 1.00 0.00 C ATOM 760 O LYS A 51 4.643 -2.825 -12.675 1.00 0.00 O ATOM 761 CB LYS A 51 3.783 -0.148 -14.217 1.00 0.00 C ATOM 762 CG LYS A 51 3.498 -0.990 -15.449 1.00 0.00 C ATOM 763 CD LYS A 51 4.056 -0.345 -16.707 1.00 0.00 C ATOM 764 CE LYS A 51 3.206 -0.674 -17.925 1.00 0.00 C ATOM 765 NZ LYS A 51 3.158 -2.139 -18.188 1.00 0.00 N ATOM 0 H LYS A 51 2.916 1.148 -12.309 1.00 0.00 H new ATOM 0 HA LYS A 51 2.511 -1.475 -13.102 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.269 0.808 -14.314 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.851 0.067 -14.173 1.00 0.00 H new ATOM 0 HG2 LYS A 51 3.935 -1.981 -15.323 1.00 0.00 H new ATOM 0 HG3 LYS A 51 2.422 -1.127 -15.556 1.00 0.00 H new ATOM 0 HD2 LYS A 51 4.101 0.736 -16.574 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.077 -0.688 -16.871 1.00 0.00 H new ATOM 0 HE2 LYS A 51 2.194 -0.299 -17.774 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.609 -0.161 -18.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.612 -2.318 -19.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.125 -2.502 -18.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 2.704 -2.621 -17.386 1.00 0.00 H new ATOM 779 N ALA A 52 5.322 -1.027 -11.504 1.00 0.00 N ATOM 780 CA ALA A 52 6.456 -1.714 -10.898 1.00 0.00 C ATOM 781 C ALA A 52 5.989 -2.791 -9.925 1.00 0.00 C ATOM 782 O ALA A 52 6.565 -3.878 -9.863 1.00 0.00 O ATOM 783 CB ALA A 52 7.360 -0.716 -10.189 1.00 0.00 C ATOM 0 H ALA A 52 5.221 -0.051 -11.224 1.00 0.00 H new ATOM 0 HA ALA A 52 7.022 -2.200 -11.693 1.00 0.00 H new ATOM 0 HB1 ALA A 52 8.203 -1.243 -9.741 1.00 0.00 H new ATOM 0 HB2 ALA A 52 7.730 0.015 -10.908 1.00 0.00 H new ATOM 0 HB3 ALA A 52 6.796 -0.204 -9.409 1.00 0.00 H new ATOM 789 N LEU A 53 4.943 -2.483 -9.166 1.00 0.00 N ATOM 790 CA LEU A 53 4.399 -3.425 -8.194 1.00 0.00 C ATOM 791 C LEU A 53 3.454 -4.416 -8.866 1.00 0.00 C ATOM 792 O LEU A 53 2.727 -5.148 -8.196 1.00 0.00 O ATOM 793 CB LEU A 53 3.662 -2.674 -7.083 1.00 0.00 C ATOM 794 CG LEU A 53 4.367 -1.435 -6.529 1.00 0.00 C ATOM 795 CD1 LEU A 53 3.356 -0.463 -5.942 1.00 0.00 C ATOM 796 CD2 LEU A 53 5.398 -1.832 -5.482 1.00 0.00 C ATOM 0 H LEU A 53 4.455 -1.588 -9.205 1.00 0.00 H new ATOM 0 HA LEU A 53 5.230 -3.981 -7.759 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.685 -2.373 -7.461 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.485 -3.366 -6.259 1.00 0.00 H new ATOM 0 HG LEU A 53 4.884 -0.937 -7.349 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.876 0.412 -5.553 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.656 -0.154 -6.718 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.810 -0.950 -5.134 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.890 -0.938 -5.099 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.903 -2.353 -4.663 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.141 -2.489 -5.934 1.00 0.00 H new ATOM 808 N ASN A 54 3.471 -4.433 -10.195 1.00 0.00 N ATOM 809 CA ASN A 54 2.617 -5.336 -10.959 1.00 0.00 C ATOM 810 C ASN A 54 1.157 -5.183 -10.544 1.00 0.00 C ATOM 811 O ASN A 54 0.385 -6.142 -10.588 1.00 0.00 O ATOM 812 CB ASN A 54 3.066 -6.785 -10.762 1.00 0.00 C ATOM 813 CG ASN A 54 4.502 -7.009 -11.196 1.00 0.00 C ATOM 814 OD1 ASN A 54 5.375 -6.179 -10.944 1.00 0.00 O ATOM 815 ND2 ASN A 54 4.752 -8.136 -11.853 1.00 0.00 N ATOM 0 H ASN A 54 4.066 -3.832 -10.765 1.00 0.00 H new ATOM 0 HA ASN A 54 2.706 -5.076 -12.014 1.00 0.00 H new ATOM 0 HB2 ASN A 54 2.960 -7.056 -9.711 1.00 0.00 H new ATOM 0 HB3 ASN A 54 2.411 -7.446 -11.329 1.00 0.00 H new ATOM 0 HD21 ASN A 54 5.699 -8.342 -12.171 1.00 0.00 H new ATOM 0 HD22 ASN A 54 3.997 -8.796 -12.040 1.00 0.00 H new ATOM 822 N ARG A 55 0.785 -3.972 -10.143 1.00 0.00 N ATOM 823 CA ARG A 55 -0.582 -3.694 -9.720 1.00 0.00 C ATOM 824 C ARG A 55 -1.060 -2.354 -10.271 1.00 0.00 C ATOM 825 O ARG A 55 -0.275 -1.434 -10.500 1.00 0.00 O ATOM 826 CB ARG A 55 -0.676 -3.692 -8.193 1.00 0.00 C ATOM 827 CG ARG A 55 -0.416 -5.051 -7.565 1.00 0.00 C ATOM 828 CD ARG A 55 -0.504 -4.990 -6.048 1.00 0.00 C ATOM 829 NE ARG A 55 0.340 -5.996 -5.409 1.00 0.00 N ATOM 830 CZ ARG A 55 -0.047 -7.247 -5.187 1.00 0.00 C ATOM 831 NH1 ARG A 55 -1.259 -7.644 -5.550 1.00 0.00 N ATOM 832 NH2 ARG A 55 0.779 -8.104 -4.601 1.00 0.00 N ATOM 0 H ARG A 55 1.411 -3.168 -10.102 1.00 0.00 H new ATOM 0 HA ARG A 55 -1.225 -4.480 -10.116 1.00 0.00 H new ATOM 0 HB2 ARG A 55 0.041 -2.974 -7.794 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.668 -3.349 -7.899 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -1.140 -5.772 -7.944 1.00 0.00 H new ATOM 0 HG3 ARG A 55 0.572 -5.406 -7.859 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -0.207 -3.998 -5.707 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -1.539 -5.136 -5.739 1.00 0.00 H new ATOM 0 HE ARG A 55 1.278 -5.723 -5.117 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -1.897 -6.988 -6.001 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -1.554 -8.605 -5.378 1.00 0.00 H new ATOM 0 HH21 ARG A 55 1.712 -7.802 -4.321 1.00 0.00 H new ATOM 0 HH22 ARG A 55 0.481 -9.065 -4.431 1.00 0.00 H new ATOM 846 N PRO A 56 -2.378 -2.241 -10.491 1.00 0.00 N ATOM 847 CA PRO A 56 -2.991 -1.017 -11.018 1.00 0.00 C ATOM 848 C PRO A 56 -2.961 0.127 -10.011 1.00 0.00 C ATOM 849 O PRO A 56 -2.969 -0.082 -8.797 1.00 0.00 O ATOM 850 CB PRO A 56 -4.434 -1.439 -11.307 1.00 0.00 C ATOM 851 CG PRO A 56 -4.687 -2.580 -10.383 1.00 0.00 C ATOM 852 CD PRO A 56 -3.373 -3.297 -10.241 1.00 0.00 C ATOM 0 HA PRO A 56 -2.460 -0.639 -11.892 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -5.130 -0.620 -11.125 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -4.558 -1.737 -12.348 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -5.045 -2.227 -9.416 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -5.453 -3.244 -10.784 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -3.257 -3.731 -9.248 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.281 -4.113 -10.958 1.00 0.00 H new ATOM 860 N PRO A 57 -2.926 1.366 -10.522 1.00 0.00 N ATOM 861 CA PRO A 57 -2.895 2.568 -9.683 1.00 0.00 C ATOM 862 C PRO A 57 -4.215 2.800 -8.955 1.00 0.00 C ATOM 863 O PRO A 57 -4.293 3.614 -8.034 1.00 0.00 O ATOM 864 CB PRO A 57 -2.633 3.694 -10.687 1.00 0.00 C ATOM 865 CG PRO A 57 -3.151 3.175 -11.983 1.00 0.00 C ATOM 866 CD PRO A 57 -2.914 1.690 -11.959 1.00 0.00 C ATOM 0 HA PRO A 57 -2.145 2.497 -8.896 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -3.144 4.611 -10.395 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.570 3.928 -10.751 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -4.212 3.399 -12.097 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.635 3.639 -12.823 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.692 1.150 -12.499 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.963 1.427 -12.422 1.00 0.00 H new ATOM 874 N THR A 58 -5.251 2.080 -9.372 1.00 0.00 N ATOM 875 CA THR A 58 -6.567 2.208 -8.760 1.00 0.00 C ATOM 876 C THR A 58 -6.529 1.816 -7.287 1.00 0.00 C ATOM 877 O THR A 58 -7.304 2.328 -6.479 1.00 0.00 O ATOM 878 CB THR A 58 -7.611 1.336 -9.484 1.00 0.00 C ATOM 879 OG1 THR A 58 -7.110 0.004 -9.644 1.00 0.00 O ATOM 880 CG2 THR A 58 -7.954 1.922 -10.845 1.00 0.00 C ATOM 0 H THR A 58 -5.204 1.401 -10.132 1.00 0.00 H new ATOM 0 HA THR A 58 -6.855 3.256 -8.848 1.00 0.00 H new ATOM 0 HB THR A 58 -8.517 1.312 -8.878 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.780 -0.544 -10.103 1.00 0.00 H new ATOM 0 HG21 THR A 58 -8.693 1.290 -11.338 1.00 0.00 H new ATOM 0 HG22 THR A 58 -8.362 2.925 -10.717 1.00 0.00 H new ATOM 0 HG23 THR A 58 -7.053 1.972 -11.457 1.00 0.00 H new ATOM 888 N TYR A 59 -5.622 0.907 -6.945 1.00 0.00 N ATOM 889 CA TYR A 59 -5.485 0.446 -5.569 1.00 0.00 C ATOM 890 C TYR A 59 -4.881 1.535 -4.687 1.00 0.00 C ATOM 891 O TYR A 59 -5.474 1.970 -3.700 1.00 0.00 O ATOM 892 CB TYR A 59 -4.613 -0.810 -5.515 1.00 0.00 C ATOM 893 CG TYR A 59 -5.398 -2.097 -5.642 1.00 0.00 C ATOM 894 CD1 TYR A 59 -6.595 -2.274 -4.960 1.00 0.00 C ATOM 895 CD2 TYR A 59 -4.941 -3.134 -6.446 1.00 0.00 C ATOM 896 CE1 TYR A 59 -7.314 -3.448 -5.074 1.00 0.00 C ATOM 897 CE2 TYR A 59 -5.654 -4.311 -6.566 1.00 0.00 C ATOM 898 CZ TYR A 59 -6.840 -4.464 -5.878 1.00 0.00 C ATOM 899 OH TYR A 59 -7.554 -5.634 -5.994 1.00 0.00 O ATOM 0 H TYR A 59 -4.971 0.475 -7.602 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.479 0.208 -5.192 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -3.874 -0.764 -6.315 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.063 -0.821 -4.574 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.970 -1.481 -4.330 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -4.013 -3.018 -6.986 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.243 -3.570 -4.536 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -5.285 -5.107 -7.195 1.00 0.00 H new ATOM 0 HH TYR A 59 -7.084 -6.246 -6.598 1.00 0.00 H new ATOM 909 N PRO A 60 -3.672 1.988 -5.052 1.00 0.00 N ATOM 910 CA PRO A 60 -2.961 3.033 -4.309 1.00 0.00 C ATOM 911 C PRO A 60 -3.624 4.399 -4.452 1.00 0.00 C ATOM 912 O PRO A 60 -3.903 5.072 -3.459 1.00 0.00 O ATOM 913 CB PRO A 60 -1.572 3.043 -4.952 1.00 0.00 C ATOM 914 CG PRO A 60 -1.789 2.514 -6.328 1.00 0.00 C ATOM 915 CD PRO A 60 -2.907 1.515 -6.217 1.00 0.00 C ATOM 0 HA PRO A 60 -2.948 2.834 -3.237 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -1.154 4.049 -4.976 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -0.873 2.420 -4.394 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -2.050 3.317 -7.018 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -0.884 2.045 -6.713 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -3.519 1.495 -7.119 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -2.529 0.504 -6.066 1.00 0.00 H new ATOM 923 N THR A 61 -3.875 4.803 -5.693 1.00 0.00 N ATOM 924 CA THR A 61 -4.505 6.089 -5.965 1.00 0.00 C ATOM 925 C THR A 61 -5.717 6.309 -5.068 1.00 0.00 C ATOM 926 O THR A 61 -5.870 7.370 -4.462 1.00 0.00 O ATOM 927 CB THR A 61 -4.944 6.199 -7.438 1.00 0.00 C ATOM 928 OG1 THR A 61 -3.808 6.065 -8.299 1.00 0.00 O ATOM 929 CG2 THR A 61 -5.631 7.530 -7.700 1.00 0.00 C ATOM 0 H THR A 61 -3.652 4.258 -6.526 1.00 0.00 H new ATOM 0 HA THR A 61 -3.759 6.856 -5.757 1.00 0.00 H new ATOM 0 HB THR A 61 -5.652 5.396 -7.644 1.00 0.00 H new ATOM 0 HG1 THR A 61 -3.488 5.139 -8.277 1.00 0.00 H new ATOM 0 HG21 THR A 61 -5.932 7.584 -8.746 1.00 0.00 H new ATOM 0 HG22 THR A 61 -6.512 7.616 -7.064 1.00 0.00 H new ATOM 0 HG23 THR A 61 -4.942 8.345 -7.478 1.00 0.00 H new ATOM 937 N LYS A 62 -6.577 5.299 -4.984 1.00 0.00 N ATOM 938 CA LYS A 62 -7.775 5.381 -4.158 1.00 0.00 C ATOM 939 C LYS A 62 -7.412 5.464 -2.679 1.00 0.00 C ATOM 940 O LYS A 62 -8.066 6.167 -1.908 1.00 0.00 O ATOM 941 CB LYS A 62 -8.674 4.167 -4.406 1.00 0.00 C ATOM 942 CG LYS A 62 -10.104 4.363 -3.935 1.00 0.00 C ATOM 943 CD LYS A 62 -10.940 5.088 -4.976 1.00 0.00 C ATOM 944 CE LYS A 62 -12.428 4.887 -4.735 1.00 0.00 C ATOM 945 NZ LYS A 62 -12.978 5.896 -3.787 1.00 0.00 N ATOM 0 H LYS A 62 -6.466 4.414 -5.478 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.314 6.288 -4.433 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.679 3.941 -5.472 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.249 3.301 -3.899 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.552 3.394 -3.718 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -10.107 4.931 -3.005 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.707 6.153 -4.954 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.679 4.725 -5.970 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.961 4.951 -5.683 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.600 3.886 -4.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -13.995 5.725 -3.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.487 5.818 -2.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.837 6.850 -4.176 1.00 0.00 H new ATOM 959 N TYR A 63 -6.366 4.744 -2.290 1.00 0.00 N ATOM 960 CA TYR A 63 -5.917 4.736 -0.903 1.00 0.00 C ATOM 961 C TYR A 63 -5.728 6.158 -0.384 1.00 0.00 C ATOM 962 O TYR A 63 -6.391 6.579 0.565 1.00 0.00 O ATOM 963 CB TYR A 63 -4.608 3.956 -0.773 1.00 0.00 C ATOM 964 CG TYR A 63 -4.365 3.407 0.615 1.00 0.00 C ATOM 965 CD1 TYR A 63 -5.070 2.304 1.080 1.00 0.00 C ATOM 966 CD2 TYR A 63 -3.431 3.992 1.461 1.00 0.00 C ATOM 967 CE1 TYR A 63 -4.852 1.799 2.347 1.00 0.00 C ATOM 968 CE2 TYR A 63 -3.206 3.494 2.729 1.00 0.00 C ATOM 969 CZ TYR A 63 -3.919 2.397 3.168 1.00 0.00 C ATOM 970 OH TYR A 63 -3.698 1.899 4.431 1.00 0.00 O ATOM 0 H TYR A 63 -5.813 4.158 -2.916 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.684 4.248 -0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -4.614 3.131 -1.485 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -3.778 4.607 -1.047 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.801 1.833 0.440 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -2.871 4.851 1.121 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.409 0.941 2.693 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -2.476 3.960 3.374 1.00 0.00 H new ATOM 0 HH TYR A 63 -3.009 2.434 4.878 1.00 0.00 H new ATOM 980 N PHE A 64 -4.818 6.895 -1.013 1.00 0.00 N ATOM 981 CA PHE A 64 -4.540 8.270 -0.615 1.00 0.00 C ATOM 982 C PHE A 64 -5.828 9.000 -0.245 1.00 0.00 C ATOM 983 O PHE A 64 -5.985 9.471 0.881 1.00 0.00 O ATOM 984 CB PHE A 64 -3.825 9.015 -1.744 1.00 0.00 C ATOM 985 CG PHE A 64 -2.553 8.351 -2.189 1.00 0.00 C ATOM 986 CD1 PHE A 64 -1.561 8.039 -1.272 1.00 0.00 C ATOM 987 CD2 PHE A 64 -2.349 8.038 -3.523 1.00 0.00 C ATOM 988 CE1 PHE A 64 -0.390 7.429 -1.679 1.00 0.00 C ATOM 989 CE2 PHE A 64 -1.179 7.427 -3.936 1.00 0.00 C ATOM 990 CZ PHE A 64 -0.199 7.122 -3.012 1.00 0.00 C ATOM 0 H PHE A 64 -4.261 6.563 -1.800 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.893 8.245 0.262 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.499 9.100 -2.597 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.600 10.029 -1.414 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.705 8.275 -0.228 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -3.113 8.274 -4.249 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.376 7.192 -0.955 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.032 7.189 -4.979 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.715 6.644 -3.331 1.00 0.00 H new ATOM 1000 N GLY A 65 -6.746 9.090 -1.202 1.00 0.00 N ATOM 1001 CA GLY A 65 -8.008 9.764 -0.958 1.00 0.00 C ATOM 1002 C GLY A 65 -8.610 9.400 0.385 1.00 0.00 C ATOM 1003 O GLY A 65 -9.112 10.266 1.103 1.00 0.00 O ATOM 0 H GLY A 65 -6.639 8.708 -2.142 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.855 10.842 -1.004 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.712 9.508 -1.750 1.00 0.00 H new ATOM 1007 N CYS A 66 -8.561 8.117 0.725 1.00 0.00 N ATOM 1008 CA CYS A 66 -9.109 7.639 1.990 1.00 0.00 C ATOM 1009 C CYS A 66 -8.454 8.352 3.169 1.00 0.00 C ATOM 1010 O CYS A 66 -9.107 9.105 3.890 1.00 0.00 O ATOM 1011 CB CYS A 66 -8.910 6.128 2.118 1.00 0.00 C ATOM 1012 SG CYS A 66 -9.941 5.353 3.384 1.00 0.00 S ATOM 0 H CYS A 66 -8.148 7.389 0.143 1.00 0.00 H new ATOM 0 HA CYS A 66 -10.176 7.859 2.002 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -9.122 5.662 1.156 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -7.863 5.928 2.345 1.00 0.00 H new ATOM 0 HG CYS A 66 -9.250 4.449 4.013 1.00 0.00 H new ATOM 1018 N GLU A 67 -7.162 8.108 3.358 1.00 0.00 N ATOM 1019 CA GLU A 67 -6.420 8.725 4.451 1.00 0.00 C ATOM 1020 C GLU A 67 -6.580 10.242 4.429 1.00 0.00 C ATOM 1021 O GLU A 67 -6.804 10.870 5.464 1.00 0.00 O ATOM 1022 CB GLU A 67 -4.938 8.356 4.364 1.00 0.00 C ATOM 1023 CG GLU A 67 -4.637 6.934 4.809 1.00 0.00 C ATOM 1024 CD GLU A 67 -3.171 6.721 5.131 1.00 0.00 C ATOM 1025 OE1 GLU A 67 -2.778 6.955 6.292 1.00 0.00 O ATOM 1026 OE2 GLU A 67 -2.417 6.319 4.220 1.00 0.00 O ATOM 0 H GLU A 67 -6.607 7.487 2.769 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.826 8.348 5.390 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.600 8.485 3.336 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.363 9.049 4.978 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.236 6.698 5.688 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.937 6.240 4.024 1.00 0.00 H new ATOM 1033 N LEU A 68 -6.462 10.826 3.241 1.00 0.00 N ATOM 1034 CA LEU A 68 -6.592 12.270 3.082 1.00 0.00 C ATOM 1035 C LEU A 68 -8.041 12.710 3.268 1.00 0.00 C ATOM 1036 O LEU A 68 -8.311 13.853 3.632 1.00 0.00 O ATOM 1037 CB LEU A 68 -6.091 12.698 1.701 1.00 0.00 C ATOM 1038 CG LEU A 68 -4.652 12.310 1.360 1.00 0.00 C ATOM 1039 CD1 LEU A 68 -4.392 12.481 -0.129 1.00 0.00 C ATOM 1040 CD2 LEU A 68 -3.669 13.139 2.174 1.00 0.00 C ATOM 0 H LEU A 68 -6.277 10.321 2.374 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.984 12.751 3.848 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.751 12.267 0.948 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.182 13.781 1.623 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.509 11.260 1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.363 12.200 -0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.073 11.844 -0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.553 13.522 -0.409 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.650 12.849 1.918 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.813 14.196 1.951 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -3.840 12.966 3.237 1.00 0.00 H new ATOM 1052 N GLY A 69 -8.970 11.792 3.018 1.00 0.00 N ATOM 1053 CA GLY A 69 -10.379 12.103 3.166 1.00 0.00 C ATOM 1054 C GLY A 69 -10.858 13.119 2.148 1.00 0.00 C ATOM 1055 O GLY A 69 -11.673 13.986 2.462 1.00 0.00 O ATOM 0 H GLY A 69 -8.771 10.838 2.716 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -10.963 11.188 3.064 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -10.560 12.486 4.170 1.00 0.00 H new ATOM 1059 N ALA A 70 -10.351 13.012 0.924 1.00 0.00 N ATOM 1060 CA ALA A 70 -10.732 13.929 -0.144 1.00 0.00 C ATOM 1061 C ALA A 70 -11.241 13.168 -1.364 1.00 0.00 C ATOM 1062 O ALA A 70 -11.367 11.945 -1.335 1.00 0.00 O ATOM 1063 CB ALA A 70 -9.556 14.815 -0.524 1.00 0.00 C ATOM 0 H ALA A 70 -9.676 12.300 0.647 1.00 0.00 H new ATOM 0 HA ALA A 70 -11.542 14.559 0.223 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -9.855 15.494 -1.322 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -9.240 15.393 0.345 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -8.729 14.194 -0.867 1.00 0.00 H new ATOM 1069 N GLN A 71 -11.531 13.902 -2.433 1.00 0.00 N ATOM 1070 CA GLN A 71 -12.027 13.295 -3.663 1.00 0.00 C ATOM 1071 C GLN A 71 -10.890 13.063 -4.653 1.00 0.00 C ATOM 1072 O GLN A 71 -9.824 13.668 -4.543 1.00 0.00 O ATOM 1073 CB GLN A 71 -13.099 14.184 -4.299 1.00 0.00 C ATOM 1074 CG GLN A 71 -14.501 13.912 -3.778 1.00 0.00 C ATOM 1075 CD GLN A 71 -14.643 14.213 -2.299 1.00 0.00 C ATOM 1076 OE1 GLN A 71 -14.874 15.356 -1.905 1.00 0.00 O ATOM 1077 NE2 GLN A 71 -14.504 13.185 -1.470 1.00 0.00 N ATOM 0 H GLN A 71 -11.431 14.916 -2.473 1.00 0.00 H new ATOM 0 HA GLN A 71 -12.467 12.330 -3.410 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -12.848 15.229 -4.116 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -13.087 14.038 -5.379 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -15.216 14.515 -4.338 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -14.755 12.867 -3.958 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.313 12.254 -1.840 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -14.588 13.327 -0.463 1.00 0.00 H new ATOM 1086 N THR A 72 -11.125 12.181 -5.620 1.00 0.00 N ATOM 1087 CA THR A 72 -10.121 11.867 -6.628 1.00 0.00 C ATOM 1088 C THR A 72 -10.743 11.782 -8.017 1.00 0.00 C ATOM 1089 O THR A 72 -11.957 11.631 -8.154 1.00 0.00 O ATOM 1090 CB THR A 72 -9.408 10.537 -6.316 1.00 0.00 C ATOM 1091 OG1 THR A 72 -10.350 9.459 -6.340 1.00 0.00 O ATOM 1092 CG2 THR A 72 -8.729 10.594 -4.956 1.00 0.00 C ATOM 0 H THR A 72 -12.002 11.672 -5.726 1.00 0.00 H new ATOM 0 HA THR A 72 -9.391 12.676 -6.609 1.00 0.00 H new ATOM 0 HB THR A 72 -8.647 10.370 -7.078 1.00 0.00 H new ATOM 0 HG1 THR A 72 -9.985 8.695 -5.847 1.00 0.00 H new ATOM 0 HG21 THR A 72 -8.232 9.644 -4.757 1.00 0.00 H new ATOM 0 HG22 THR A 72 -7.992 11.397 -4.951 1.00 0.00 H new ATOM 0 HG23 THR A 72 -9.476 10.782 -4.184 1.00 0.00 H new ATOM 1100 N GLN A 73 -9.905 11.880 -9.043 1.00 0.00 N ATOM 1101 CA GLN A 73 -10.375 11.815 -10.422 1.00 0.00 C ATOM 1102 C GLN A 73 -9.575 10.791 -11.221 1.00 0.00 C ATOM 1103 O GLN A 73 -8.348 10.858 -11.283 1.00 0.00 O ATOM 1104 CB GLN A 73 -10.272 13.190 -11.084 1.00 0.00 C ATOM 1105 CG GLN A 73 -10.954 13.265 -12.440 1.00 0.00 C ATOM 1106 CD GLN A 73 -10.902 14.654 -13.044 1.00 0.00 C ATOM 1107 OE1 GLN A 73 -10.141 14.910 -13.978 1.00 0.00 O ATOM 1108 NE2 GLN A 73 -11.713 15.562 -12.513 1.00 0.00 N ATOM 0 H GLN A 73 -8.897 12.005 -8.946 1.00 0.00 H new ATOM 0 HA GLN A 73 -11.420 11.504 -10.409 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.713 13.936 -10.423 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.220 13.450 -11.201 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.479 12.559 -13.121 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -11.994 12.957 -12.337 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -12.328 15.307 -11.740 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.721 16.514 -12.878 1.00 0.00 H new ATOM 1117 N PHE A 74 -10.280 9.844 -11.832 1.00 0.00 N ATOM 1118 CA PHE A 74 -9.635 8.805 -12.627 1.00 0.00 C ATOM 1119 C PHE A 74 -9.973 8.964 -14.107 1.00 0.00 C ATOM 1120 O PHE A 74 -11.143 8.980 -14.489 1.00 0.00 O ATOM 1121 CB PHE A 74 -10.067 7.420 -12.141 1.00 0.00 C ATOM 1122 CG PHE A 74 -9.459 7.031 -10.823 1.00 0.00 C ATOM 1123 CD1 PHE A 74 -9.962 7.541 -9.636 1.00 0.00 C ATOM 1124 CD2 PHE A 74 -8.387 6.156 -10.771 1.00 0.00 C ATOM 1125 CE1 PHE A 74 -9.404 7.186 -8.423 1.00 0.00 C ATOM 1126 CE2 PHE A 74 -7.825 5.796 -9.560 1.00 0.00 C ATOM 1127 CZ PHE A 74 -8.335 6.311 -8.384 1.00 0.00 C ATOM 0 H PHE A 74 -11.297 9.775 -11.792 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.557 8.906 -12.505 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.153 7.397 -12.052 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.793 6.678 -12.892 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -10.799 8.223 -9.660 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.985 5.750 -11.687 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -9.803 7.592 -7.505 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -6.989 5.113 -9.534 1.00 0.00 H new ATOM 0 HZ PHE A 74 -7.899 6.031 -7.436 1.00 0.00 H new ATOM 1137 N ASP A 75 -8.939 9.083 -14.933 1.00 0.00 N ATOM 1138 CA ASP A 75 -9.125 9.242 -16.371 1.00 0.00 C ATOM 1139 C ASP A 75 -8.256 8.253 -17.142 1.00 0.00 C ATOM 1140 O ASP A 75 -7.237 8.627 -17.723 1.00 0.00 O ATOM 1141 CB ASP A 75 -8.790 10.672 -16.795 1.00 0.00 C ATOM 1142 CG ASP A 75 -10.017 11.561 -16.851 1.00 0.00 C ATOM 1143 OD1 ASP A 75 -10.516 11.952 -15.775 1.00 0.00 O ATOM 1144 OD2 ASP A 75 -10.478 11.867 -17.971 1.00 0.00 O ATOM 0 H ASP A 75 -7.964 9.072 -14.632 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.170 9.039 -16.603 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.069 11.096 -16.096 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -8.312 10.655 -17.774 1.00 0.00 H new ATOM 1149 N VAL A 76 -8.666 6.988 -17.143 1.00 0.00 N ATOM 1150 CA VAL A 76 -7.926 5.945 -17.843 1.00 0.00 C ATOM 1151 C VAL A 76 -7.544 6.392 -19.250 1.00 0.00 C ATOM 1152 O VAL A 76 -6.430 6.145 -19.711 1.00 0.00 O ATOM 1153 CB VAL A 76 -8.742 4.642 -17.934 1.00 0.00 C ATOM 1154 CG1 VAL A 76 -7.962 3.574 -18.684 1.00 0.00 C ATOM 1155 CG2 VAL A 76 -9.126 4.157 -16.544 1.00 0.00 C ATOM 0 H VAL A 76 -9.507 6.661 -16.667 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.020 5.758 -17.266 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.658 4.845 -18.489 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.555 2.661 -18.738 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.743 3.924 -19.693 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.028 3.370 -18.160 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -9.702 3.235 -16.626 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -8.224 3.970 -15.962 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -9.728 4.918 -16.047 1.00 0.00 H new ATOM 1165 N LYS A 77 -8.477 7.051 -19.929 1.00 0.00 N ATOM 1166 CA LYS A 77 -8.240 7.535 -21.283 1.00 0.00 C ATOM 1167 C LYS A 77 -6.902 8.262 -21.375 1.00 0.00 C ATOM 1168 O LYS A 77 -6.085 7.970 -22.247 1.00 0.00 O ATOM 1169 CB LYS A 77 -9.371 8.470 -21.719 1.00 0.00 C ATOM 1170 CG LYS A 77 -10.630 7.740 -22.152 1.00 0.00 C ATOM 1171 CD LYS A 77 -11.694 8.707 -22.643 1.00 0.00 C ATOM 1172 CE LYS A 77 -12.459 9.329 -21.484 1.00 0.00 C ATOM 1173 NZ LYS A 77 -13.811 9.795 -21.899 1.00 0.00 N ATOM 0 H LYS A 77 -9.405 7.262 -19.563 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.212 6.673 -21.950 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -9.615 9.140 -20.895 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -9.020 9.092 -22.543 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -10.387 7.032 -22.944 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -11.022 7.161 -21.316 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -11.227 9.493 -23.236 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.389 8.183 -23.299 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -12.557 8.599 -20.680 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.892 10.170 -21.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -14.300 10.212 -21.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -13.717 10.510 -22.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -14.361 8.989 -22.257 1.00 0.00 H new ATOM 1187 N ASN A 78 -6.684 9.209 -20.468 1.00 0.00 N ATOM 1188 CA ASN A 78 -5.445 9.976 -20.446 1.00 0.00 C ATOM 1189 C ASN A 78 -4.491 9.440 -19.383 1.00 0.00 C ATOM 1190 O ASN A 78 -3.466 10.055 -19.086 1.00 0.00 O ATOM 1191 CB ASN A 78 -5.740 11.454 -20.184 1.00 0.00 C ATOM 1192 CG ASN A 78 -6.653 12.057 -21.234 1.00 0.00 C ATOM 1193 OD1 ASN A 78 -6.419 11.706 -22.493 1.00 0.00 O flip ATOM 1194 ND2 ASN A 78 -7.558 12.829 -20.916 1.00 0.00 N flip ATOM 0 H ASN A 78 -7.350 9.463 -19.739 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.968 9.875 -21.421 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.200 11.561 -19.202 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -4.803 12.010 -20.159 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -7.701 13.071 -19.935 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -8.165 13.227 -21.633 1.00 0.00 H new ATOM 1201 N ASP A 79 -4.835 8.290 -18.813 1.00 0.00 N ATOM 1202 CA ASP A 79 -4.010 7.669 -17.784 1.00 0.00 C ATOM 1203 C ASP A 79 -3.549 8.703 -16.761 1.00 0.00 C ATOM 1204 O ASP A 79 -2.437 8.620 -16.238 1.00 0.00 O ATOM 1205 CB ASP A 79 -2.798 6.984 -18.417 1.00 0.00 C ATOM 1206 CG ASP A 79 -2.323 5.789 -17.613 1.00 0.00 C ATOM 1207 OD1 ASP A 79 -3.126 5.248 -16.823 1.00 0.00 O ATOM 1208 OD2 ASP A 79 -1.150 5.395 -17.774 1.00 0.00 O ATOM 0 H ASP A 79 -5.680 7.769 -19.047 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.614 6.920 -17.271 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -3.053 6.661 -19.426 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -1.984 7.703 -18.508 1.00 0.00 H new ATOM 1213 N ARG A 80 -4.410 9.675 -16.480 1.00 0.00 N ATOM 1214 CA ARG A 80 -4.090 10.726 -15.521 1.00 0.00 C ATOM 1215 C ARG A 80 -4.869 10.533 -14.224 1.00 0.00 C ATOM 1216 O ARG A 80 -6.089 10.367 -14.239 1.00 0.00 O ATOM 1217 CB ARG A 80 -4.401 12.101 -16.116 1.00 0.00 C ATOM 1218 CG ARG A 80 -5.861 12.283 -16.499 1.00 0.00 C ATOM 1219 CD ARG A 80 -6.124 13.678 -17.042 1.00 0.00 C ATOM 1220 NE ARG A 80 -7.546 14.010 -17.031 1.00 0.00 N ATOM 1221 CZ ARG A 80 -8.042 15.136 -17.533 1.00 0.00 C ATOM 1222 NH1 ARG A 80 -7.235 16.032 -18.084 1.00 0.00 N ATOM 1223 NH2 ARG A 80 -9.348 15.366 -17.486 1.00 0.00 N ATOM 0 H ARG A 80 -5.335 9.757 -16.903 1.00 0.00 H new ATOM 0 HA ARG A 80 -3.025 10.667 -15.297 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -4.125 12.870 -15.395 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -3.781 12.254 -16.999 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -6.137 11.541 -17.249 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -6.492 12.105 -15.628 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -5.577 14.408 -16.446 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -5.743 13.748 -18.061 1.00 0.00 H new ATOM 0 HE ARG A 80 -8.194 13.341 -16.615 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -6.231 15.858 -18.123 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -7.618 16.895 -18.469 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -9.972 14.678 -17.064 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -9.728 16.231 -17.872 1.00 0.00 H new ATOM 1237 N TYR A 81 -4.157 10.557 -13.103 1.00 0.00 N ATOM 1238 CA TYR A 81 -4.780 10.382 -11.797 1.00 0.00 C ATOM 1239 C TYR A 81 -4.604 11.630 -10.938 1.00 0.00 C ATOM 1240 O TYR A 81 -3.483 12.013 -10.601 1.00 0.00 O ATOM 1241 CB TYR A 81 -4.184 9.169 -11.082 1.00 0.00 C ATOM 1242 CG TYR A 81 -4.238 7.898 -11.898 1.00 0.00 C ATOM 1243 CD1 TYR A 81 -3.488 7.763 -13.061 1.00 0.00 C ATOM 1244 CD2 TYR A 81 -5.039 6.831 -11.508 1.00 0.00 C ATOM 1245 CE1 TYR A 81 -3.535 6.604 -13.810 1.00 0.00 C ATOM 1246 CE2 TYR A 81 -5.090 5.668 -12.251 1.00 0.00 C ATOM 1247 CZ TYR A 81 -4.337 5.559 -13.401 1.00 0.00 C ATOM 1248 OH TYR A 81 -4.387 4.402 -14.145 1.00 0.00 O ATOM 0 H TYR A 81 -3.147 10.696 -13.073 1.00 0.00 H new ATOM 0 HA TYR A 81 -5.846 10.216 -11.951 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -3.146 9.383 -10.826 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -4.718 9.012 -10.145 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -2.858 8.579 -13.384 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -5.631 6.913 -10.609 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -2.947 6.516 -14.711 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -5.717 4.848 -11.933 1.00 0.00 H new ATOM 0 HH TYR A 81 -4.002 4.566 -15.031 1.00 0.00 H new ATOM 1258 N ILE A 82 -5.720 12.261 -10.586 1.00 0.00 N ATOM 1259 CA ILE A 82 -5.691 13.464 -9.765 1.00 0.00 C ATOM 1260 C ILE A 82 -6.226 13.188 -8.364 1.00 0.00 C ATOM 1261 O ILE A 82 -6.996 12.250 -8.156 1.00 0.00 O ATOM 1262 CB ILE A 82 -6.513 14.601 -10.401 1.00 0.00 C ATOM 1263 CG1 ILE A 82 -5.986 14.919 -11.802 1.00 0.00 C ATOM 1264 CG2 ILE A 82 -6.474 15.840 -9.520 1.00 0.00 C ATOM 1265 CD1 ILE A 82 -7.035 15.494 -12.726 1.00 0.00 C ATOM 0 H ILE A 82 -6.655 11.958 -10.857 1.00 0.00 H new ATOM 0 HA ILE A 82 -4.648 13.774 -9.698 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.549 14.275 -10.489 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.160 15.625 -11.719 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.583 14.008 -12.245 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.059 16.634 -9.983 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -6.893 15.604 -8.542 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.442 16.171 -9.403 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -6.591 15.695 -13.701 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.851 14.780 -12.839 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -7.421 16.422 -12.305 1.00 0.00 H new ATOM 1277 N VAL A 83 -5.814 14.011 -7.405 1.00 0.00 N ATOM 1278 CA VAL A 83 -6.254 13.857 -6.024 1.00 0.00 C ATOM 1279 C VAL A 83 -6.601 15.206 -5.404 1.00 0.00 C ATOM 1280 O VAL A 83 -5.718 16.002 -5.089 1.00 0.00 O ATOM 1281 CB VAL A 83 -5.174 13.173 -5.164 1.00 0.00 C ATOM 1282 CG1 VAL A 83 -5.651 13.025 -3.727 1.00 0.00 C ATOM 1283 CG2 VAL A 83 -4.803 11.820 -5.753 1.00 0.00 C ATOM 0 H VAL A 83 -5.176 14.792 -7.560 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.145 13.229 -6.044 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.283 13.800 -5.163 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.875 12.540 -3.134 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.863 14.010 -3.311 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -6.557 12.419 -3.705 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -4.039 11.351 -5.133 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.687 11.182 -5.785 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.417 11.956 -6.763 1.00 0.00 H new ATOM 1293 N ASN A 84 -7.895 15.457 -5.233 1.00 0.00 N ATOM 1294 CA ASN A 84 -8.361 16.710 -4.651 1.00 0.00 C ATOM 1295 C ASN A 84 -7.624 17.012 -3.350 1.00 0.00 C ATOM 1296 O ASN A 84 -7.358 16.114 -2.552 1.00 0.00 O ATOM 1297 CB ASN A 84 -9.868 16.649 -4.395 1.00 0.00 C ATOM 1298 CG ASN A 84 -10.664 16.448 -5.670 1.00 0.00 C ATOM 1299 OD1 ASN A 84 -10.163 15.888 -6.645 1.00 0.00 O ATOM 1300 ND2 ASN A 84 -11.910 16.906 -5.668 1.00 0.00 N ATOM 0 H ASN A 84 -8.640 14.809 -5.489 1.00 0.00 H new ATOM 0 HA ASN A 84 -8.153 17.511 -5.360 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -10.083 15.835 -3.703 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -10.189 17.571 -3.911 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -12.494 16.800 -6.498 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -12.284 17.364 -4.837 1.00 0.00 H new ATOM 1307 N GLY A 85 -7.298 18.284 -3.142 1.00 0.00 N ATOM 1308 CA GLY A 85 -6.596 18.683 -1.936 1.00 0.00 C ATOM 1309 C GLY A 85 -5.109 18.864 -2.164 1.00 0.00 C ATOM 1310 O GLY A 85 -4.558 18.360 -3.143 1.00 0.00 O ATOM 0 H GLY A 85 -7.508 19.046 -3.787 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.020 19.616 -1.565 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.753 17.931 -1.162 1.00 0.00 H new ATOM 1314 N SER A 86 -4.456 19.586 -1.258 1.00 0.00 N ATOM 1315 CA SER A 86 -3.024 19.836 -1.369 1.00 0.00 C ATOM 1316 C SER A 86 -2.229 18.804 -0.575 1.00 0.00 C ATOM 1317 O SER A 86 -2.478 18.590 0.612 1.00 0.00 O ATOM 1318 CB SER A 86 -2.692 21.244 -0.871 1.00 0.00 C ATOM 1319 OG SER A 86 -2.945 21.368 0.518 1.00 0.00 O ATOM 0 H SER A 86 -4.896 20.007 -0.440 1.00 0.00 H new ATOM 0 HA SER A 86 -2.746 19.754 -2.420 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.645 21.467 -1.074 1.00 0.00 H new ATOM 0 HB3 SER A 86 -3.286 21.976 -1.419 1.00 0.00 H new ATOM 0 HG SER A 86 -2.834 20.495 0.950 1.00 0.00 H new ATOM 1325 N HIS A 87 -1.271 18.166 -1.240 1.00 0.00 N ATOM 1326 CA HIS A 87 -0.438 17.155 -0.597 1.00 0.00 C ATOM 1327 C HIS A 87 0.980 17.180 -1.162 1.00 0.00 C ATOM 1328 O HIS A 87 1.185 17.499 -2.332 1.00 0.00 O ATOM 1329 CB HIS A 87 -1.049 15.766 -0.784 1.00 0.00 C ATOM 1330 CG HIS A 87 -2.541 15.746 -0.652 1.00 0.00 C ATOM 1331 ND1 HIS A 87 -3.196 16.032 0.527 1.00 0.00 N ATOM 1332 CD2 HIS A 87 -3.506 15.472 -1.561 1.00 0.00 C ATOM 1333 CE1 HIS A 87 -4.500 15.934 0.338 1.00 0.00 C ATOM 1334 NE2 HIS A 87 -4.715 15.596 -0.920 1.00 0.00 N ATOM 0 H HIS A 87 -1.052 18.331 -2.223 1.00 0.00 H new ATOM 0 HA HIS A 87 -0.391 17.382 0.468 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -0.774 15.387 -1.768 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -0.618 15.086 -0.049 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -3.354 15.206 -2.597 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -5.261 16.102 1.086 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -5.630 15.451 -1.347 1.00 0.00 H new ATOM 1342 N GLU A 88 1.953 16.843 -0.321 1.00 0.00 N ATOM 1343 CA GLU A 88 3.350 16.829 -0.737 1.00 0.00 C ATOM 1344 C GLU A 88 3.803 15.412 -1.074 1.00 0.00 C ATOM 1345 O GLU A 88 3.362 14.444 -0.455 1.00 0.00 O ATOM 1346 CB GLU A 88 4.239 17.412 0.364 1.00 0.00 C ATOM 1347 CG GLU A 88 4.237 16.595 1.644 1.00 0.00 C ATOM 1348 CD GLU A 88 4.464 17.445 2.879 1.00 0.00 C ATOM 1349 OE1 GLU A 88 5.061 18.534 2.749 1.00 0.00 O ATOM 1350 OE2 GLU A 88 4.044 17.021 3.976 1.00 0.00 O ATOM 0 H GLU A 88 1.799 16.576 0.651 1.00 0.00 H new ATOM 0 HA GLU A 88 3.442 17.444 -1.632 1.00 0.00 H new ATOM 0 HB2 GLU A 88 5.261 17.487 -0.008 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.907 18.425 0.589 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.284 16.074 1.736 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.013 15.832 1.585 1.00 0.00 H new ATOM 1357 N ALA A 89 4.686 15.298 -2.061 1.00 0.00 N ATOM 1358 CA ALA A 89 5.200 14.000 -2.480 1.00 0.00 C ATOM 1359 C ALA A 89 5.711 13.201 -1.287 1.00 0.00 C ATOM 1360 O ALA A 89 5.459 12.001 -1.177 1.00 0.00 O ATOM 1361 CB ALA A 89 6.306 14.178 -3.510 1.00 0.00 C ATOM 0 H ALA A 89 5.060 16.089 -2.585 1.00 0.00 H new ATOM 0 HA ALA A 89 4.381 13.442 -2.934 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.681 13.201 -3.814 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.912 14.702 -4.380 1.00 0.00 H new ATOM 0 HB3 ALA A 89 7.119 14.759 -3.074 1.00 0.00 H new ATOM 1367 N ASN A 90 6.431 13.873 -0.394 1.00 0.00 N ATOM 1368 CA ASN A 90 6.978 13.223 0.792 1.00 0.00 C ATOM 1369 C ASN A 90 5.898 12.439 1.530 1.00 0.00 C ATOM 1370 O ASN A 90 6.126 11.314 1.975 1.00 0.00 O ATOM 1371 CB ASN A 90 7.599 14.263 1.727 1.00 0.00 C ATOM 1372 CG ASN A 90 8.081 13.654 3.029 1.00 0.00 C ATOM 1373 OD1 ASN A 90 8.744 12.617 3.034 1.00 0.00 O ATOM 1374 ND2 ASN A 90 7.749 14.298 4.142 1.00 0.00 N ATOM 0 H ASN A 90 6.649 14.867 -0.469 1.00 0.00 H new ATOM 0 HA ASN A 90 7.751 12.525 0.470 1.00 0.00 H new ATOM 0 HB2 ASN A 90 8.436 14.747 1.223 1.00 0.00 H new ATOM 0 HB3 ASN A 90 6.865 15.039 1.942 1.00 0.00 H new ATOM 0 HD21 ASN A 90 8.045 13.936 5.048 1.00 0.00 H new ATOM 0 HD22 ASN A 90 7.198 15.155 4.090 1.00 0.00 H new ATOM 1381 N LYS A 91 4.720 13.040 1.656 1.00 0.00 N ATOM 1382 CA LYS A 91 3.602 12.399 2.338 1.00 0.00 C ATOM 1383 C LYS A 91 3.126 11.172 1.568 1.00 0.00 C ATOM 1384 O LYS A 91 3.083 10.065 2.108 1.00 0.00 O ATOM 1385 CB LYS A 91 2.446 13.388 2.508 1.00 0.00 C ATOM 1386 CG LYS A 91 1.379 12.915 3.480 1.00 0.00 C ATOM 1387 CD LYS A 91 0.634 14.084 4.101 1.00 0.00 C ATOM 1388 CE LYS A 91 -0.088 13.672 5.375 1.00 0.00 C ATOM 1389 NZ LYS A 91 -1.159 14.638 5.744 1.00 0.00 N ATOM 0 H LYS A 91 4.515 13.971 1.294 1.00 0.00 H new ATOM 0 HA LYS A 91 3.945 12.078 3.322 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.843 14.342 2.854 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.986 13.567 1.536 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.673 12.267 2.960 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.841 12.317 4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.336 14.887 4.323 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.086 14.479 3.385 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.523 12.681 5.242 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.630 13.597 6.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -1.627 14.321 6.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.741 15.578 5.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -1.859 14.691 4.976 1.00 0.00 H new ATOM 1403 N LEU A 92 2.771 11.373 0.304 1.00 0.00 N ATOM 1404 CA LEU A 92 2.300 10.282 -0.542 1.00 0.00 C ATOM 1405 C LEU A 92 3.167 9.041 -0.363 1.00 0.00 C ATOM 1406 O LEU A 92 2.656 7.930 -0.225 1.00 0.00 O ATOM 1407 CB LEU A 92 2.300 10.712 -2.010 1.00 0.00 C ATOM 1408 CG LEU A 92 1.213 11.706 -2.419 1.00 0.00 C ATOM 1409 CD1 LEU A 92 1.460 12.217 -3.830 1.00 0.00 C ATOM 1410 CD2 LEU A 92 -0.163 11.065 -2.315 1.00 0.00 C ATOM 0 H LEU A 92 2.800 12.282 -0.158 1.00 0.00 H new ATOM 0 HA LEU A 92 1.281 10.036 -0.242 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.271 11.152 -2.239 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.200 9.820 -2.629 1.00 0.00 H new ATOM 0 HG LEU A 92 1.249 12.555 -1.736 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.676 12.923 -4.104 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.428 12.715 -3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.453 11.379 -4.527 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.924 11.787 -2.610 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.211 10.198 -2.974 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.341 10.750 -1.287 1.00 0.00 H new ATOM 1422 N GLN A 93 4.482 9.238 -0.365 1.00 0.00 N ATOM 1423 CA GLN A 93 5.420 8.134 -0.202 1.00 0.00 C ATOM 1424 C GLN A 93 5.249 7.472 1.161 1.00 0.00 C ATOM 1425 O GLN A 93 5.511 6.280 1.321 1.00 0.00 O ATOM 1426 CB GLN A 93 6.858 8.631 -0.365 1.00 0.00 C ATOM 1427 CG GLN A 93 7.174 9.130 -1.765 1.00 0.00 C ATOM 1428 CD GLN A 93 7.711 8.036 -2.667 1.00 0.00 C ATOM 1429 OE1 GLN A 93 6.841 7.115 -3.063 1.00 0.00 O flip ATOM 1430 NE2 GLN A 93 8.895 8.018 -3.004 1.00 0.00 N flip ATOM 0 H GLN A 93 4.921 10.152 -0.478 1.00 0.00 H new ATOM 0 HA GLN A 93 5.210 7.394 -0.974 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.038 9.436 0.348 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.544 7.822 -0.113 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.272 9.551 -2.209 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.905 9.936 -1.703 1.00 0.00 H new ATOM 0 HE21 GLN A 93 9.530 8.746 -2.676 1.00 0.00 H new ATOM 0 HE22 GLN A 93 9.241 7.275 -3.611 1.00 0.00 H new ATOM 1439 N ASP A 94 4.810 8.254 2.142 1.00 0.00 N ATOM 1440 CA ASP A 94 4.604 7.743 3.492 1.00 0.00 C ATOM 1441 C ASP A 94 3.250 7.050 3.610 1.00 0.00 C ATOM 1442 O ASP A 94 3.168 5.892 4.020 1.00 0.00 O ATOM 1443 CB ASP A 94 4.698 8.880 4.511 1.00 0.00 C ATOM 1444 CG ASP A 94 6.130 9.303 4.774 1.00 0.00 C ATOM 1445 OD1 ASP A 94 6.951 8.431 5.129 1.00 0.00 O ATOM 1446 OD2 ASP A 94 6.430 10.506 4.626 1.00 0.00 O ATOM 0 H ASP A 94 4.590 9.243 2.027 1.00 0.00 H new ATOM 0 HA ASP A 94 5.386 7.013 3.700 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.130 9.737 4.149 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.237 8.564 5.447 1.00 0.00 H new ATOM 1451 N MET A 95 2.190 7.766 3.249 1.00 0.00 N ATOM 1452 CA MET A 95 0.840 7.219 3.314 1.00 0.00 C ATOM 1453 C MET A 95 0.723 5.958 2.463 1.00 0.00 C ATOM 1454 O MET A 95 -0.046 5.050 2.783 1.00 0.00 O ATOM 1455 CB MET A 95 -0.178 8.260 2.847 1.00 0.00 C ATOM 1456 CG MET A 95 0.155 8.873 1.496 1.00 0.00 C ATOM 1457 SD MET A 95 -0.844 10.327 1.127 1.00 0.00 S ATOM 1458 CE MET A 95 -2.483 9.721 1.523 1.00 0.00 C ATOM 0 H MET A 95 2.240 8.726 2.909 1.00 0.00 H new ATOM 0 HA MET A 95 0.630 6.957 4.351 1.00 0.00 H new ATOM 0 HB2 MET A 95 -1.162 7.795 2.793 1.00 0.00 H new ATOM 0 HB3 MET A 95 -0.241 9.054 3.591 1.00 0.00 H new ATOM 0 HG2 MET A 95 1.210 9.147 1.476 1.00 0.00 H new ATOM 0 HG3 MET A 95 0.005 8.127 0.716 1.00 0.00 H new ATOM 0 HE1 MET A 95 -3.182 10.028 0.745 1.00 0.00 H new ATOM 0 HE2 MET A 95 -2.464 8.633 1.585 1.00 0.00 H new ATOM 0 HE3 MET A 95 -2.802 10.133 2.481 1.00 0.00 H new ATOM 1468 N LEU A 96 1.488 5.908 1.379 1.00 0.00 N ATOM 1469 CA LEU A 96 1.469 4.758 0.481 1.00 0.00 C ATOM 1470 C LEU A 96 2.027 3.519 1.173 1.00 0.00 C ATOM 1471 O LEU A 96 1.455 2.432 1.077 1.00 0.00 O ATOM 1472 CB LEU A 96 2.279 5.059 -0.782 1.00 0.00 C ATOM 1473 CG LEU A 96 2.094 4.084 -1.945 1.00 0.00 C ATOM 1474 CD1 LEU A 96 0.616 3.881 -2.241 1.00 0.00 C ATOM 1475 CD2 LEU A 96 2.824 4.586 -3.183 1.00 0.00 C ATOM 0 H LEU A 96 2.130 6.650 1.100 1.00 0.00 H new ATOM 0 HA LEU A 96 0.434 4.562 0.203 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.018 6.059 -1.127 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.336 5.080 -0.516 1.00 0.00 H new ATOM 0 HG LEU A 96 2.522 3.123 -1.660 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.504 3.184 -3.072 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.120 3.477 -1.358 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.163 4.837 -2.505 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.681 3.880 -4.001 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.426 5.559 -3.470 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.888 4.679 -2.965 1.00 0.00 H new ATOM 1487 N ASP A 97 3.144 3.689 1.872 1.00 0.00 N ATOM 1488 CA ASP A 97 3.777 2.585 2.583 1.00 0.00 C ATOM 1489 C ASP A 97 2.730 1.613 3.119 1.00 0.00 C ATOM 1490 O ASP A 97 2.715 0.438 2.756 1.00 0.00 O ATOM 1491 CB ASP A 97 4.634 3.115 3.733 1.00 0.00 C ATOM 1492 CG ASP A 97 5.686 2.119 4.178 1.00 0.00 C ATOM 1493 OD1 ASP A 97 5.972 1.175 3.412 1.00 0.00 O ATOM 1494 OD2 ASP A 97 6.223 2.281 5.294 1.00 0.00 O ATOM 0 H ASP A 97 3.630 4.581 1.961 1.00 0.00 H new ATOM 0 HA ASP A 97 4.417 2.052 1.880 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.121 4.039 3.423 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.991 3.361 4.578 1.00 0.00 H new ATOM 1499 N GLY A 98 1.856 2.112 3.988 1.00 0.00 N ATOM 1500 CA GLY A 98 0.819 1.275 4.562 1.00 0.00 C ATOM 1501 C GLY A 98 0.276 0.264 3.571 1.00 0.00 C ATOM 1502 O GLY A 98 0.224 -0.932 3.858 1.00 0.00 O ATOM 0 H GLY A 98 1.848 3.082 4.305 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.219 0.750 5.430 1.00 0.00 H new ATOM 0 HA3 GLY A 98 0.004 1.905 4.918 1.00 0.00 H new ATOM 1506 N PHE A 99 -0.132 0.745 2.401 1.00 0.00 N ATOM 1507 CA PHE A 99 -0.676 -0.125 1.365 1.00 0.00 C ATOM 1508 C PHE A 99 0.331 -1.202 0.974 1.00 0.00 C ATOM 1509 O PHE A 99 0.126 -2.386 1.242 1.00 0.00 O ATOM 1510 CB PHE A 99 -1.067 0.695 0.134 1.00 0.00 C ATOM 1511 CG PHE A 99 -1.399 -0.145 -1.066 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -2.626 -0.781 -1.164 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -0.485 -0.299 -2.095 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -2.936 -1.555 -2.266 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -0.789 -1.071 -3.200 1.00 0.00 C ATOM 1516 CZ PHE A 99 -2.015 -1.701 -3.286 1.00 0.00 C ATOM 0 H PHE A 99 -0.096 1.732 2.147 1.00 0.00 H new ATOM 0 HA PHE A 99 -1.565 -0.613 1.766 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.927 1.318 0.381 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.248 1.368 -0.119 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.349 -0.670 -0.369 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.476 0.190 -2.033 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -3.896 -2.045 -2.330 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -0.068 -1.182 -3.996 1.00 0.00 H new ATOM 0 HZ PHE A 99 -2.253 -2.306 -4.148 1.00 0.00 H new ATOM 1526 N ILE A 100 1.420 -0.782 0.338 1.00 0.00 N ATOM 1527 CA ILE A 100 2.460 -1.710 -0.089 1.00 0.00 C ATOM 1528 C ILE A 100 2.927 -2.584 1.069 1.00 0.00 C ATOM 1529 O ILE A 100 3.487 -3.661 0.863 1.00 0.00 O ATOM 1530 CB ILE A 100 3.673 -0.964 -0.676 1.00 0.00 C ATOM 1531 CG1 ILE A 100 3.216 0.048 -1.730 1.00 0.00 C ATOM 1532 CG2 ILE A 100 4.662 -1.952 -1.276 1.00 0.00 C ATOM 1533 CD1 ILE A 100 4.356 0.806 -2.373 1.00 0.00 C ATOM 0 H ILE A 100 1.605 0.194 0.107 1.00 0.00 H new ATOM 0 HA ILE A 100 2.022 -2.341 -0.863 1.00 0.00 H new ATOM 0 HB ILE A 100 4.172 -0.423 0.128 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.655 -0.475 -2.505 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.533 0.760 -1.267 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.514 -1.410 -1.687 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.007 -2.637 -0.502 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.175 -2.518 -2.070 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.959 1.505 -3.109 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.904 1.357 -1.608 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.028 0.103 -2.866 1.00 0.00 H new ATOM 1545 N LYS A 101 2.692 -2.114 2.290 1.00 0.00 N ATOM 1546 CA LYS A 101 3.085 -2.854 3.483 1.00 0.00 C ATOM 1547 C LYS A 101 2.390 -4.210 3.537 1.00 0.00 C ATOM 1548 O LYS A 101 2.920 -5.170 4.098 1.00 0.00 O ATOM 1549 CB LYS A 101 2.751 -2.048 4.741 1.00 0.00 C ATOM 1550 CG LYS A 101 3.715 -2.286 5.890 1.00 0.00 C ATOM 1551 CD LYS A 101 3.316 -3.502 6.710 1.00 0.00 C ATOM 1552 CE LYS A 101 2.390 -3.122 7.855 1.00 0.00 C ATOM 1553 NZ LYS A 101 1.039 -2.727 7.367 1.00 0.00 N ATOM 0 H LYS A 101 2.231 -1.224 2.479 1.00 0.00 H new ATOM 0 HA LYS A 101 4.162 -3.019 3.439 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.750 -0.987 4.493 1.00 0.00 H new ATOM 0 HB3 LYS A 101 1.742 -2.300 5.066 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.723 -2.425 5.498 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.742 -1.406 6.532 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.821 -4.230 6.067 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.210 -3.983 7.108 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.297 -3.964 8.541 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.828 -2.298 8.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.353 -2.803 8.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 1.067 -1.745 7.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 0.753 -3.356 6.590 1.00 0.00 H new ATOM 1567 N LYS A 102 1.201 -4.284 2.948 1.00 0.00 N ATOM 1568 CA LYS A 102 0.434 -5.524 2.925 1.00 0.00 C ATOM 1569 C LYS A 102 -0.057 -5.835 1.515 1.00 0.00 C ATOM 1570 O LYS A 102 0.325 -6.845 0.923 1.00 0.00 O ATOM 1571 CB LYS A 102 -0.758 -5.427 3.881 1.00 0.00 C ATOM 1572 CG LYS A 102 -1.527 -4.123 3.764 1.00 0.00 C ATOM 1573 CD LYS A 102 -2.166 -3.732 5.087 1.00 0.00 C ATOM 1574 CE LYS A 102 -3.351 -4.626 5.419 1.00 0.00 C ATOM 1575 NZ LYS A 102 -4.532 -4.321 4.566 1.00 0.00 N ATOM 0 H LYS A 102 0.748 -3.499 2.480 1.00 0.00 H new ATOM 0 HA LYS A 102 1.089 -6.333 3.249 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.437 -6.258 3.688 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -0.402 -5.538 4.905 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.854 -3.331 3.436 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.299 -4.222 3.001 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -1.425 -3.797 5.884 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.494 -2.693 5.041 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -3.067 -5.670 5.286 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.618 -4.500 6.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.364 -4.827 4.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.715 -3.297 4.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -4.343 -4.625 3.590 1.00 0.00 H new ATOM 1589 N PHE A 103 -0.902 -4.960 0.981 1.00 0.00 N ATOM 1590 CA PHE A 103 -1.444 -5.141 -0.361 1.00 0.00 C ATOM 1591 C PHE A 103 -0.363 -5.624 -1.323 1.00 0.00 C ATOM 1592 O PHE A 103 -0.657 -6.244 -2.345 1.00 0.00 O ATOM 1593 CB PHE A 103 -2.048 -3.831 -0.871 1.00 0.00 C ATOM 1594 CG PHE A 103 -3.233 -3.367 -0.073 1.00 0.00 C ATOM 1595 CD1 PHE A 103 -3.057 -2.698 1.127 1.00 0.00 C ATOM 1596 CD2 PHE A 103 -4.523 -3.599 -0.524 1.00 0.00 C ATOM 1597 CE1 PHE A 103 -4.146 -2.270 1.864 1.00 0.00 C ATOM 1598 CE2 PHE A 103 -5.615 -3.173 0.208 1.00 0.00 C ATOM 1599 CZ PHE A 103 -5.426 -2.507 1.403 1.00 0.00 C ATOM 0 H PHE A 103 -1.227 -4.118 1.457 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.226 -5.898 -0.311 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -1.282 -3.056 -0.853 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.348 -3.959 -1.911 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -2.058 -2.509 1.491 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -4.676 -4.119 -1.458 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -3.996 -1.751 2.799 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.615 -3.361 -0.154 1.00 0.00 H new ATOM 0 HZ PHE A 103 -6.278 -2.172 1.976 1.00 0.00 H new ATOM 1609 N VAL A 104 0.891 -5.336 -0.988 1.00 0.00 N ATOM 1610 CA VAL A 104 2.017 -5.740 -1.821 1.00 0.00 C ATOM 1611 C VAL A 104 2.912 -6.735 -1.090 1.00 0.00 C ATOM 1612 O VAL A 104 2.988 -7.907 -1.460 1.00 0.00 O ATOM 1613 CB VAL A 104 2.862 -4.526 -2.252 1.00 0.00 C ATOM 1614 CG1 VAL A 104 4.133 -4.982 -2.952 1.00 0.00 C ATOM 1615 CG2 VAL A 104 2.050 -3.604 -3.148 1.00 0.00 C ATOM 0 H VAL A 104 1.152 -4.824 -0.145 1.00 0.00 H new ATOM 0 HA VAL A 104 1.599 -6.215 -2.709 1.00 0.00 H new ATOM 0 HB VAL A 104 3.148 -3.968 -1.360 1.00 0.00 H new ATOM 0 HG11 VAL A 104 4.717 -4.111 -3.249 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.721 -5.599 -2.273 1.00 0.00 H new ATOM 0 HG13 VAL A 104 3.873 -5.563 -3.837 1.00 0.00 H new ATOM 0 HG21 VAL A 104 2.662 -2.752 -3.443 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.732 -4.148 -4.037 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.173 -3.250 -2.606 1.00 0.00 H new ATOM 1625 N LEU A 105 3.588 -6.260 -0.050 1.00 0.00 N ATOM 1626 CA LEU A 105 4.478 -7.108 0.735 1.00 0.00 C ATOM 1627 C LEU A 105 3.707 -8.250 1.388 1.00 0.00 C ATOM 1628 O LEU A 105 2.496 -8.378 1.209 1.00 0.00 O ATOM 1629 CB LEU A 105 5.189 -6.279 1.807 1.00 0.00 C ATOM 1630 CG LEU A 105 5.986 -5.074 1.305 1.00 0.00 C ATOM 1631 CD1 LEU A 105 6.130 -4.035 2.406 1.00 0.00 C ATOM 1632 CD2 LEU A 105 7.353 -5.512 0.799 1.00 0.00 C ATOM 0 H LEU A 105 3.537 -5.293 0.269 1.00 0.00 H new ATOM 0 HA LEU A 105 5.221 -7.535 0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 105 4.443 -5.925 2.518 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.866 -6.934 2.355 1.00 0.00 H new ATOM 0 HG LEU A 105 5.442 -4.622 0.475 1.00 0.00 H new ATOM 0 HD11 LEU A 105 6.700 -3.185 2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.142 -3.699 2.721 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.652 -4.475 3.256 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.906 -4.642 0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.905 -5.989 1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.228 -6.220 -0.021 1.00 0.00 H new ATOM 1644 N CYS A 106 4.417 -9.078 2.148 1.00 0.00 N ATOM 1645 CA CYS A 106 3.800 -10.209 2.830 1.00 0.00 C ATOM 1646 C CYS A 106 4.011 -10.117 4.338 1.00 0.00 C ATOM 1647 O CYS A 106 5.101 -9.806 4.819 1.00 0.00 O ATOM 1648 CB CYS A 106 4.376 -11.525 2.303 1.00 0.00 C ATOM 1649 SG CYS A 106 3.699 -13.010 3.112 1.00 0.00 S ATOM 0 H CYS A 106 5.420 -8.986 2.307 1.00 0.00 H new ATOM 0 HA CYS A 106 2.729 -10.182 2.629 1.00 0.00 H new ATOM 0 HB2 CYS A 106 4.186 -11.589 1.232 1.00 0.00 H new ATOM 0 HB3 CYS A 106 5.458 -11.514 2.434 1.00 0.00 H new ATOM 1654 N PRO A 107 2.945 -10.393 5.103 1.00 0.00 N ATOM 1655 CA PRO A 107 2.988 -10.348 6.568 1.00 0.00 C ATOM 1656 C PRO A 107 3.826 -11.478 7.157 1.00 0.00 C ATOM 1657 O PRO A 107 3.887 -11.646 8.375 1.00 0.00 O ATOM 1658 CB PRO A 107 1.520 -10.505 6.971 1.00 0.00 C ATOM 1659 CG PRO A 107 0.889 -11.229 5.832 1.00 0.00 C ATOM 1660 CD PRO A 107 1.614 -10.770 4.597 1.00 0.00 C ATOM 0 HA PRO A 107 3.449 -9.431 6.935 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.423 -11.067 7.900 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.048 -9.536 7.134 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.978 -12.308 5.958 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -0.175 -11.002 5.767 1.00 0.00 H new ATOM 0 HD2 PRO A 107 1.677 -11.562 3.851 1.00 0.00 H new ATOM 0 HD3 PRO A 107 1.110 -9.927 4.125 1.00 0.00 H new ATOM 1668 N GLU A 108 4.470 -12.248 6.286 1.00 0.00 N ATOM 1669 CA GLU A 108 5.304 -13.361 6.722 1.00 0.00 C ATOM 1670 C GLU A 108 6.741 -13.188 6.238 1.00 0.00 C ATOM 1671 O GLU A 108 7.666 -13.051 7.039 1.00 0.00 O ATOM 1672 CB GLU A 108 4.737 -14.685 6.206 1.00 0.00 C ATOM 1673 CG GLU A 108 3.639 -15.261 7.085 1.00 0.00 C ATOM 1674 CD GLU A 108 4.133 -15.622 8.473 1.00 0.00 C ATOM 1675 OE1 GLU A 108 5.221 -16.226 8.577 1.00 0.00 O ATOM 1676 OE2 GLU A 108 3.431 -15.302 9.455 1.00 0.00 O ATOM 0 H GLU A 108 4.430 -12.121 5.275 1.00 0.00 H new ATOM 0 HA GLU A 108 5.305 -13.374 7.812 1.00 0.00 H new ATOM 0 HB2 GLU A 108 4.344 -14.535 5.200 1.00 0.00 H new ATOM 0 HB3 GLU A 108 5.546 -15.411 6.127 1.00 0.00 H new ATOM 0 HG2 GLU A 108 2.828 -14.537 7.169 1.00 0.00 H new ATOM 0 HG3 GLU A 108 3.225 -16.149 6.608 1.00 0.00 H new ATOM 1683 N CYS A 109 6.920 -13.195 4.921 1.00 0.00 N ATOM 1684 CA CYS A 109 8.242 -13.039 4.328 1.00 0.00 C ATOM 1685 C CYS A 109 8.533 -11.573 4.023 1.00 0.00 C ATOM 1686 O CYS A 109 9.690 -11.163 3.944 1.00 0.00 O ATOM 1687 CB CYS A 109 8.350 -13.869 3.047 1.00 0.00 C ATOM 1688 SG CYS A 109 7.042 -13.527 1.827 1.00 0.00 S ATOM 0 H CYS A 109 6.165 -13.307 4.244 1.00 0.00 H new ATOM 0 HA CYS A 109 8.979 -13.395 5.048 1.00 0.00 H new ATOM 0 HB2 CYS A 109 9.320 -13.682 2.586 1.00 0.00 H new ATOM 0 HB3 CYS A 109 8.320 -14.927 3.309 1.00 0.00 H new ATOM 1693 N GLU A 110 7.473 -10.788 3.852 1.00 0.00 N ATOM 1694 CA GLU A 110 7.615 -9.368 3.555 1.00 0.00 C ATOM 1695 C GLU A 110 8.102 -9.157 2.124 1.00 0.00 C ATOM 1696 O GLU A 110 8.825 -8.204 1.838 1.00 0.00 O ATOM 1697 CB GLU A 110 8.587 -8.713 4.538 1.00 0.00 C ATOM 1698 CG GLU A 110 8.335 -7.229 4.747 1.00 0.00 C ATOM 1699 CD GLU A 110 9.161 -6.651 5.880 1.00 0.00 C ATOM 1700 OE1 GLU A 110 10.383 -6.476 5.693 1.00 0.00 O ATOM 1701 OE2 GLU A 110 8.585 -6.373 6.952 1.00 0.00 O ATOM 0 H GLU A 110 6.508 -11.112 3.914 1.00 0.00 H new ATOM 0 HA GLU A 110 6.635 -8.902 3.659 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.518 -9.223 5.499 1.00 0.00 H new ATOM 0 HB3 GLU A 110 9.606 -8.852 4.176 1.00 0.00 H new ATOM 0 HG2 GLU A 110 8.563 -6.692 3.826 1.00 0.00 H new ATOM 0 HG3 GLU A 110 7.277 -7.070 4.956 1.00 0.00 H new ATOM 1708 N ASN A 111 7.701 -10.055 1.231 1.00 0.00 N ATOM 1709 CA ASN A 111 8.097 -9.969 -0.170 1.00 0.00 C ATOM 1710 C ASN A 111 6.993 -9.334 -1.010 1.00 0.00 C ATOM 1711 O ASN A 111 5.811 -9.649 -0.866 1.00 0.00 O ATOM 1712 CB ASN A 111 8.431 -11.360 -0.714 1.00 0.00 C ATOM 1713 CG ASN A 111 9.460 -11.314 -1.827 1.00 0.00 C ATOM 1714 OD1 ASN A 111 9.151 -10.938 -2.958 1.00 0.00 O ATOM 1715 ND2 ASN A 111 10.691 -11.699 -1.511 1.00 0.00 N ATOM 0 H ASN A 111 7.102 -10.851 1.452 1.00 0.00 H new ATOM 0 HA ASN A 111 8.984 -9.339 -0.232 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.805 -11.984 0.097 1.00 0.00 H new ATOM 0 HB3 ASN A 111 7.520 -11.831 -1.084 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.425 -11.691 -2.219 1.00 0.00 H new ATOM 0 HD22 ASN A 111 10.902 -12.003 -0.561 1.00 0.00 H new ATOM 1722 N PRO A 112 7.385 -8.420 -1.909 1.00 0.00 N ATOM 1723 CA PRO A 112 6.444 -7.722 -2.791 1.00 0.00 C ATOM 1724 C PRO A 112 5.845 -8.646 -3.846 1.00 0.00 C ATOM 1725 O PRO A 112 5.023 -8.223 -4.658 1.00 0.00 O ATOM 1726 CB PRO A 112 7.308 -6.645 -3.451 1.00 0.00 C ATOM 1727 CG PRO A 112 8.694 -7.189 -3.401 1.00 0.00 C ATOM 1728 CD PRO A 112 8.777 -7.996 -2.135 1.00 0.00 C ATOM 0 HA PRO A 112 5.590 -7.325 -2.243 1.00 0.00 H new ATOM 0 HB2 PRO A 112 6.993 -6.458 -4.478 1.00 0.00 H new ATOM 0 HB3 PRO A 112 7.235 -5.697 -2.918 1.00 0.00 H new ATOM 0 HG2 PRO A 112 8.902 -7.809 -4.273 1.00 0.00 H new ATOM 0 HG3 PRO A 112 9.429 -6.384 -3.400 1.00 0.00 H new ATOM 0 HD2 PRO A 112 9.444 -8.851 -2.246 1.00 0.00 H new ATOM 0 HD3 PRO A 112 9.156 -7.402 -1.304 1.00 0.00 H new ATOM 1736 N GLU A 113 6.262 -9.908 -3.827 1.00 0.00 N ATOM 1737 CA GLU A 113 5.766 -10.890 -4.784 1.00 0.00 C ATOM 1738 C GLU A 113 4.628 -11.709 -4.182 1.00 0.00 C ATOM 1739 O GLU A 113 4.843 -12.804 -3.660 1.00 0.00 O ATOM 1740 CB GLU A 113 6.898 -11.819 -5.228 1.00 0.00 C ATOM 1741 CG GLU A 113 8.118 -11.083 -5.754 1.00 0.00 C ATOM 1742 CD GLU A 113 8.000 -10.735 -7.225 1.00 0.00 C ATOM 1743 OE1 GLU A 113 8.009 -11.666 -8.058 1.00 0.00 O ATOM 1744 OE2 GLU A 113 7.899 -9.532 -7.544 1.00 0.00 O ATOM 0 H GLU A 113 6.941 -10.274 -3.160 1.00 0.00 H new ATOM 0 HA GLU A 113 5.385 -10.353 -5.652 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.196 -12.443 -4.386 1.00 0.00 H new ATOM 0 HB3 GLU A 113 6.525 -12.488 -6.004 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.262 -10.169 -5.179 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.004 -11.699 -5.600 1.00 0.00 H new ATOM 1751 N THR A 114 3.415 -11.170 -4.256 1.00 0.00 N ATOM 1752 CA THR A 114 2.242 -11.848 -3.718 1.00 0.00 C ATOM 1753 C THR A 114 1.049 -11.712 -4.657 1.00 0.00 C ATOM 1754 O THR A 114 1.143 -11.078 -5.708 1.00 0.00 O ATOM 1755 CB THR A 114 1.858 -11.292 -2.334 1.00 0.00 C ATOM 1756 OG1 THR A 114 1.655 -9.877 -2.414 1.00 0.00 O ATOM 1757 CG2 THR A 114 2.939 -11.598 -1.309 1.00 0.00 C ATOM 0 H THR A 114 3.219 -10.265 -4.684 1.00 0.00 H new ATOM 0 HA THR A 114 2.504 -12.901 -3.618 1.00 0.00 H new ATOM 0 HB THR A 114 0.933 -11.774 -2.017 1.00 0.00 H new ATOM 0 HG1 THR A 114 2.425 -9.413 -2.022 1.00 0.00 H new ATOM 0 HG21 THR A 114 2.645 -11.196 -0.339 1.00 0.00 H new ATOM 0 HG22 THR A 114 3.070 -12.677 -1.229 1.00 0.00 H new ATOM 0 HG23 THR A 114 3.878 -11.141 -1.622 1.00 0.00 H new ATOM 1765 N ASP A 115 -0.072 -12.311 -4.271 1.00 0.00 N ATOM 1766 CA ASP A 115 -1.286 -12.255 -5.078 1.00 0.00 C ATOM 1767 C ASP A 115 -2.488 -11.865 -4.225 1.00 0.00 C ATOM 1768 O ASP A 115 -2.468 -12.007 -3.002 1.00 0.00 O ATOM 1769 CB ASP A 115 -1.538 -13.605 -5.751 1.00 0.00 C ATOM 1770 CG ASP A 115 -2.443 -13.488 -6.963 1.00 0.00 C ATOM 1771 OD1 ASP A 115 -2.443 -12.414 -7.601 1.00 0.00 O ATOM 1772 OD2 ASP A 115 -3.151 -14.469 -7.272 1.00 0.00 O ATOM 0 H ASP A 115 -0.166 -12.841 -3.405 1.00 0.00 H new ATOM 0 HA ASP A 115 -1.148 -11.495 -5.847 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -0.586 -14.041 -6.053 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -1.987 -14.289 -5.031 1.00 0.00 H new ATOM 1777 N LEU A 116 -3.535 -11.371 -4.878 1.00 0.00 N ATOM 1778 CA LEU A 116 -4.747 -10.959 -4.179 1.00 0.00 C ATOM 1779 C LEU A 116 -5.982 -11.600 -4.806 1.00 0.00 C ATOM 1780 O LEU A 116 -6.099 -11.680 -6.029 1.00 0.00 O ATOM 1781 CB LEU A 116 -4.881 -9.436 -4.205 1.00 0.00 C ATOM 1782 CG LEU A 116 -3.761 -8.652 -3.520 1.00 0.00 C ATOM 1783 CD1 LEU A 116 -3.869 -7.171 -3.847 1.00 0.00 C ATOM 1784 CD2 LEU A 116 -3.799 -8.871 -2.015 1.00 0.00 C ATOM 0 H LEU A 116 -3.569 -11.246 -5.890 1.00 0.00 H new ATOM 0 HA LEU A 116 -4.672 -11.294 -3.144 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.939 -9.114 -5.245 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.826 -9.166 -3.734 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.806 -9.018 -3.896 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -3.064 -6.629 -3.351 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -3.791 -7.030 -4.925 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.830 -6.791 -3.500 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -2.995 -8.305 -1.545 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.758 -8.533 -1.622 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.671 -9.932 -1.798 1.00 0.00 H new ATOM 1796 N HIS A 117 -6.901 -12.053 -3.959 1.00 0.00 N ATOM 1797 CA HIS A 117 -8.129 -12.685 -4.430 1.00 0.00 C ATOM 1798 C HIS A 117 -9.356 -11.941 -3.913 1.00 0.00 C ATOM 1799 O HIS A 117 -9.377 -11.475 -2.773 1.00 0.00 O ATOM 1800 CB HIS A 117 -8.179 -14.147 -3.985 1.00 0.00 C ATOM 1801 CG HIS A 117 -7.054 -14.976 -4.524 1.00 0.00 C ATOM 1802 ND1 HIS A 117 -7.117 -15.634 -5.734 1.00 0.00 N ATOM 1803 CD2 HIS A 117 -5.832 -15.251 -4.011 1.00 0.00 C ATOM 1804 CE1 HIS A 117 -5.983 -16.279 -5.941 1.00 0.00 C ATOM 1805 NE2 HIS A 117 -5.186 -16.063 -4.911 1.00 0.00 N ATOM 0 H HIS A 117 -6.819 -11.994 -2.944 1.00 0.00 H new ATOM 0 HA HIS A 117 -8.134 -12.645 -5.519 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -8.160 -14.188 -2.896 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -9.126 -14.583 -4.304 1.00 0.00 H new ATOM 0 HD1 HIS A 117 -7.915 -15.624 -6.370 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -5.438 -14.898 -3.069 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -5.748 -16.881 -6.806 1.00 0.00 H new ATOM 1813 N VAL A 118 -10.376 -11.831 -4.758 1.00 0.00 N ATOM 1814 CA VAL A 118 -11.607 -11.144 -4.386 1.00 0.00 C ATOM 1815 C VAL A 118 -12.819 -12.049 -4.571 1.00 0.00 C ATOM 1816 O VAL A 118 -12.841 -12.899 -5.460 1.00 0.00 O ATOM 1817 CB VAL A 118 -11.806 -9.861 -5.214 1.00 0.00 C ATOM 1818 CG1 VAL A 118 -12.061 -10.203 -6.674 1.00 0.00 C ATOM 1819 CG2 VAL A 118 -12.946 -9.031 -4.645 1.00 0.00 C ATOM 0 H VAL A 118 -10.374 -12.209 -5.705 1.00 0.00 H new ATOM 0 HA VAL A 118 -11.515 -10.877 -3.333 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.893 -9.268 -5.158 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -12.199 -9.284 -7.244 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -11.209 -10.753 -7.073 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -12.958 -10.817 -6.753 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -13.072 -8.128 -5.243 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -13.867 -9.613 -4.668 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -12.717 -8.756 -3.616 1.00 0.00 H new ATOM 1829 N ASN A 119 -13.827 -11.859 -3.726 1.00 0.00 N ATOM 1830 CA ASN A 119 -15.045 -12.659 -3.796 1.00 0.00 C ATOM 1831 C ASN A 119 -16.283 -11.769 -3.757 1.00 0.00 C ATOM 1832 O ASN A 119 -16.643 -11.209 -2.722 1.00 0.00 O ATOM 1833 CB ASN A 119 -15.088 -13.663 -2.643 1.00 0.00 C ATOM 1834 CG ASN A 119 -14.419 -14.978 -2.996 1.00 0.00 C ATOM 1835 OD1 ASN A 119 -13.933 -15.160 -4.112 1.00 0.00 O ATOM 1836 ND2 ASN A 119 -14.391 -15.902 -2.042 1.00 0.00 N ATOM 0 H ASN A 119 -13.825 -11.158 -2.985 1.00 0.00 H new ATOM 0 HA ASN A 119 -15.039 -13.202 -4.741 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.597 -13.232 -1.771 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -16.125 -13.849 -2.366 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -13.954 -16.806 -2.220 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -14.807 -15.707 -1.131 1.00 0.00 H new ATOM 1843 N PRO A 120 -16.953 -11.636 -4.912 1.00 0.00 N ATOM 1844 CA PRO A 120 -18.162 -10.816 -5.035 1.00 0.00 C ATOM 1845 C PRO A 120 -19.352 -11.425 -4.302 1.00 0.00 C ATOM 1846 O PRO A 120 -20.409 -10.803 -4.189 1.00 0.00 O ATOM 1847 CB PRO A 120 -18.420 -10.790 -6.544 1.00 0.00 C ATOM 1848 CG PRO A 120 -17.781 -12.033 -7.059 1.00 0.00 C ATOM 1849 CD PRO A 120 -16.581 -12.275 -6.185 1.00 0.00 C ATOM 0 HA PRO A 120 -18.032 -9.828 -4.594 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -19.488 -10.774 -6.763 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -17.987 -9.902 -7.004 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.472 -12.874 -7.014 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -17.487 -11.917 -8.102 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.384 -13.340 -6.058 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -15.679 -11.833 -6.609 1.00 0.00 H new ATOM 1857 N LYS A 121 -19.174 -12.644 -3.805 1.00 0.00 N ATOM 1858 CA LYS A 121 -20.233 -13.337 -3.080 1.00 0.00 C ATOM 1859 C LYS A 121 -20.024 -13.226 -1.573 1.00 0.00 C ATOM 1860 O LYS A 121 -20.958 -12.938 -0.826 1.00 0.00 O ATOM 1861 CB LYS A 121 -20.281 -14.810 -3.492 1.00 0.00 C ATOM 1862 CG LYS A 121 -21.282 -15.632 -2.698 1.00 0.00 C ATOM 1863 CD LYS A 121 -22.707 -15.369 -3.158 1.00 0.00 C ATOM 1864 CE LYS A 121 -23.048 -16.175 -4.401 1.00 0.00 C ATOM 1865 NZ LYS A 121 -22.629 -15.477 -5.648 1.00 0.00 N ATOM 0 H LYS A 121 -18.306 -13.173 -3.891 1.00 0.00 H new ATOM 0 HA LYS A 121 -21.182 -12.864 -3.333 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -20.530 -14.874 -4.551 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -19.289 -15.245 -3.371 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -21.053 -16.692 -2.808 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -21.191 -15.394 -1.638 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -23.402 -15.622 -2.357 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -22.833 -14.306 -3.366 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -22.560 -17.148 -4.348 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -24.122 -16.359 -4.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -23.389 -15.543 -6.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -22.438 -14.477 -5.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -21.767 -15.923 -6.023 1.00 0.00 H new ATOM 1879 N LYS A 122 -18.791 -13.455 -1.133 1.00 0.00 N ATOM 1880 CA LYS A 122 -18.457 -13.378 0.284 1.00 0.00 C ATOM 1881 C LYS A 122 -18.079 -11.954 0.677 1.00 0.00 C ATOM 1882 O LYS A 122 -18.054 -11.614 1.860 1.00 0.00 O ATOM 1883 CB LYS A 122 -17.306 -14.332 0.611 1.00 0.00 C ATOM 1884 CG LYS A 122 -17.740 -15.780 0.763 1.00 0.00 C ATOM 1885 CD LYS A 122 -18.162 -16.088 2.190 1.00 0.00 C ATOM 1886 CE LYS A 122 -18.228 -17.587 2.441 1.00 0.00 C ATOM 1887 NZ LYS A 122 -18.478 -17.899 3.875 1.00 0.00 N ATOM 0 H LYS A 122 -18.006 -13.696 -1.738 1.00 0.00 H new ATOM 0 HA LYS A 122 -19.337 -13.672 0.856 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -16.556 -14.267 -0.178 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -16.827 -14.006 1.534 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -18.568 -15.986 0.085 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -16.921 -16.439 0.474 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -17.457 -15.632 2.885 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.137 -15.642 2.386 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -19.020 -18.023 1.831 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.292 -18.049 2.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.516 -18.930 4.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.710 -17.505 4.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -19.383 -17.480 4.169 1.00 0.00 H new ATOM 1901 N GLN A 123 -17.787 -11.127 -0.321 1.00 0.00 N ATOM 1902 CA GLN A 123 -17.410 -9.739 -0.078 1.00 0.00 C ATOM 1903 C GLN A 123 -16.180 -9.658 0.820 1.00 0.00 C ATOM 1904 O GLN A 123 -16.162 -8.915 1.801 1.00 0.00 O ATOM 1905 CB GLN A 123 -18.573 -8.978 0.560 1.00 0.00 C ATOM 1906 CG GLN A 123 -19.581 -8.449 -0.448 1.00 0.00 C ATOM 1907 CD GLN A 123 -20.632 -9.477 -0.817 1.00 0.00 C ATOM 1908 OE1 GLN A 123 -20.270 -10.403 -1.697 1.00 0.00 O flip ATOM 1909 NE2 GLN A 123 -21.756 -9.439 -0.318 1.00 0.00 N flip ATOM 0 H GLN A 123 -17.804 -11.393 -1.305 1.00 0.00 H new ATOM 0 HA GLN A 123 -17.167 -9.281 -1.037 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -19.085 -9.636 1.262 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -18.176 -8.143 1.137 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -20.071 -7.566 -0.037 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -19.056 -8.132 -1.349 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -21.991 -8.709 0.355 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -22.453 -10.137 -0.577 1.00 0.00 H new ATOM 1918 N THR A 124 -15.152 -10.428 0.477 1.00 0.00 N ATOM 1919 CA THR A 124 -13.918 -10.445 1.253 1.00 0.00 C ATOM 1920 C THR A 124 -12.700 -10.567 0.345 1.00 0.00 C ATOM 1921 O THR A 124 -12.749 -11.233 -0.690 1.00 0.00 O ATOM 1922 CB THR A 124 -13.907 -11.605 2.266 1.00 0.00 C ATOM 1923 OG1 THR A 124 -14.149 -12.846 1.593 1.00 0.00 O ATOM 1924 CG2 THR A 124 -14.960 -11.393 3.343 1.00 0.00 C ATOM 0 H THR A 124 -15.150 -11.048 -0.333 1.00 0.00 H new ATOM 0 HA THR A 124 -13.872 -9.500 1.794 1.00 0.00 H new ATOM 0 HB THR A 124 -12.926 -11.635 2.740 1.00 0.00 H new ATOM 0 HG1 THR A 124 -14.139 -13.579 2.244 1.00 0.00 H new ATOM 0 HG21 THR A 124 -14.933 -12.225 4.047 1.00 0.00 H new ATOM 0 HG22 THR A 124 -14.756 -10.463 3.873 1.00 0.00 H new ATOM 0 HG23 THR A 124 -15.946 -11.339 2.882 1.00 0.00 H new ATOM 1932 N ILE A 125 -11.607 -9.920 0.738 1.00 0.00 N ATOM 1933 CA ILE A 125 -10.376 -9.958 -0.040 1.00 0.00 C ATOM 1934 C ILE A 125 -9.307 -10.788 0.663 1.00 0.00 C ATOM 1935 O ILE A 125 -8.818 -10.415 1.729 1.00 0.00 O ATOM 1936 CB ILE A 125 -9.826 -8.542 -0.294 1.00 0.00 C ATOM 1937 CG1 ILE A 125 -10.901 -7.663 -0.938 1.00 0.00 C ATOM 1938 CG2 ILE A 125 -8.588 -8.605 -1.176 1.00 0.00 C ATOM 1939 CD1 ILE A 125 -10.626 -6.181 -0.809 1.00 0.00 C ATOM 0 H ILE A 125 -11.550 -9.363 1.591 1.00 0.00 H new ATOM 0 HA ILE A 125 -10.621 -10.420 -0.996 1.00 0.00 H new ATOM 0 HB ILE A 125 -9.545 -8.100 0.662 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -10.983 -7.919 -1.994 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -11.864 -7.887 -0.480 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.211 -7.597 -1.347 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -7.820 -9.201 -0.683 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -8.845 -9.063 -2.131 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -11.428 -5.619 -1.288 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -10.573 -5.911 0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -9.678 -5.943 -1.292 1.00 0.00 H new ATOM 1951 N GLY A 126 -8.946 -11.915 0.057 1.00 0.00 N ATOM 1952 CA GLY A 126 -7.935 -12.779 0.639 1.00 0.00 C ATOM 1953 C GLY A 126 -6.633 -12.751 -0.136 1.00 0.00 C ATOM 1954 O GLY A 126 -6.633 -12.797 -1.366 1.00 0.00 O ATOM 0 H GLY A 126 -9.335 -12.245 -0.826 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -7.748 -12.473 1.668 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.312 -13.801 0.674 1.00 0.00 H new ATOM 1958 N ASN A 127 -5.519 -12.673 0.585 1.00 0.00 N ATOM 1959 CA ASN A 127 -4.203 -12.636 -0.043 1.00 0.00 C ATOM 1960 C ASN A 127 -3.541 -14.010 -0.001 1.00 0.00 C ATOM 1961 O ASN A 127 -3.797 -14.806 0.902 1.00 0.00 O ATOM 1962 CB ASN A 127 -3.311 -11.606 0.653 1.00 0.00 C ATOM 1963 CG ASN A 127 -3.171 -11.874 2.140 1.00 0.00 C ATOM 1964 OD1 ASN A 127 -3.658 -12.884 2.648 1.00 0.00 O ATOM 1965 ND2 ASN A 127 -2.504 -10.968 2.844 1.00 0.00 N ATOM 0 H ASN A 127 -5.501 -12.634 1.604 1.00 0.00 H new ATOM 0 HA ASN A 127 -4.334 -12.347 -1.086 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -2.324 -11.613 0.191 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -3.726 -10.609 0.504 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -2.378 -11.094 3.848 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -2.117 -10.146 2.381 1.00 0.00 H new ATOM 1972 N SER A 128 -2.689 -14.280 -0.985 1.00 0.00 N ATOM 1973 CA SER A 128 -1.992 -15.559 -1.062 1.00 0.00 C ATOM 1974 C SER A 128 -0.552 -15.366 -1.526 1.00 0.00 C ATOM 1975 O SER A 128 -0.301 -14.966 -2.664 1.00 0.00 O ATOM 1976 CB SER A 128 -2.724 -16.505 -2.016 1.00 0.00 C ATOM 1977 OG SER A 128 -2.728 -15.995 -3.338 1.00 0.00 O ATOM 0 H SER A 128 -2.465 -13.631 -1.739 1.00 0.00 H new ATOM 0 HA SER A 128 -1.978 -15.998 -0.064 1.00 0.00 H new ATOM 0 HB2 SER A 128 -2.244 -17.483 -2.002 1.00 0.00 H new ATOM 0 HB3 SER A 128 -3.749 -16.648 -1.675 1.00 0.00 H new ATOM 0 HG SER A 128 -3.576 -16.221 -3.773 1.00 0.00 H new ATOM 1983 N CYS A 129 0.393 -15.652 -0.636 1.00 0.00 N ATOM 1984 CA CYS A 129 1.809 -15.509 -0.951 1.00 0.00 C ATOM 1985 C CYS A 129 2.395 -16.834 -1.431 1.00 0.00 C ATOM 1986 O CYS A 129 1.919 -17.907 -1.061 1.00 0.00 O ATOM 1987 CB CYS A 129 2.579 -15.013 0.274 1.00 0.00 C ATOM 1988 SG CYS A 129 4.387 -15.190 0.140 1.00 0.00 S ATOM 0 H CYS A 129 0.203 -15.984 0.309 1.00 0.00 H new ATOM 0 HA CYS A 129 1.905 -14.777 -1.753 1.00 0.00 H new ATOM 0 HB2 CYS A 129 2.339 -13.963 0.439 1.00 0.00 H new ATOM 0 HB3 CYS A 129 2.235 -15.561 1.152 1.00 0.00 H new ATOM 1993 N LYS A 130 3.433 -16.751 -2.257 1.00 0.00 N ATOM 1994 CA LYS A 130 4.086 -17.942 -2.787 1.00 0.00 C ATOM 1995 C LYS A 130 5.510 -18.065 -2.252 1.00 0.00 C ATOM 1996 O LYS A 130 5.987 -19.166 -1.979 1.00 0.00 O ATOM 1997 CB LYS A 130 4.107 -17.899 -4.317 1.00 0.00 C ATOM 1998 CG LYS A 130 5.230 -17.049 -4.886 1.00 0.00 C ATOM 1999 CD LYS A 130 5.429 -17.310 -6.370 1.00 0.00 C ATOM 2000 CE LYS A 130 6.152 -16.156 -7.047 1.00 0.00 C ATOM 2001 NZ LYS A 130 6.363 -16.409 -8.499 1.00 0.00 N ATOM 0 H LYS A 130 3.840 -15.871 -2.574 1.00 0.00 H new ATOM 0 HA LYS A 130 3.517 -18.813 -2.462 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.202 -18.915 -4.699 1.00 0.00 H new ATOM 0 HB3 LYS A 130 3.153 -17.512 -4.674 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.005 -15.994 -4.728 1.00 0.00 H new ATOM 0 HG3 LYS A 130 6.156 -17.261 -4.351 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.000 -18.228 -6.506 1.00 0.00 H new ATOM 0 HD3 LYS A 130 4.461 -17.464 -6.846 1.00 0.00 H new ATOM 0 HE2 LYS A 130 5.575 -15.240 -6.918 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.115 -15.997 -6.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.859 -15.599 -8.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.935 -17.269 -8.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 5.443 -16.536 -8.967 1.00 0.00 H new ATOM 2015 N ALA A 131 6.182 -16.928 -2.105 1.00 0.00 N ATOM 2016 CA ALA A 131 7.549 -16.909 -1.599 1.00 0.00 C ATOM 2017 C ALA A 131 7.705 -17.843 -0.404 1.00 0.00 C ATOM 2018 O ALA A 131 8.547 -18.742 -0.412 1.00 0.00 O ATOM 2019 CB ALA A 131 7.951 -15.492 -1.220 1.00 0.00 C ATOM 0 H ALA A 131 5.802 -16.008 -2.329 1.00 0.00 H new ATOM 0 HA ALA A 131 8.209 -17.263 -2.391 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.974 -15.492 -0.844 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.887 -14.849 -2.098 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.280 -15.118 -0.447 1.00 0.00 H new ATOM 2025 N CYS A 132 6.891 -17.625 0.623 1.00 0.00 N ATOM 2026 CA CYS A 132 6.939 -18.446 1.826 1.00 0.00 C ATOM 2027 C CYS A 132 5.779 -19.438 1.855 1.00 0.00 C ATOM 2028 O CYS A 132 5.964 -20.617 2.153 1.00 0.00 O ATOM 2029 CB CYS A 132 6.899 -17.562 3.074 1.00 0.00 C ATOM 2030 SG CYS A 132 5.361 -16.603 3.258 1.00 0.00 S ATOM 0 H CYS A 132 6.189 -16.885 0.646 1.00 0.00 H new ATOM 0 HA CYS A 132 7.874 -19.007 1.815 1.00 0.00 H new ATOM 0 HB2 CYS A 132 7.030 -18.190 3.955 1.00 0.00 H new ATOM 0 HB3 CYS A 132 7.743 -16.873 3.045 1.00 0.00 H new ATOM 2035 N GLY A 133 4.582 -18.950 1.542 1.00 0.00 N ATOM 2036 CA GLY A 133 3.411 -19.806 1.538 1.00 0.00 C ATOM 2037 C GLY A 133 2.409 -19.423 2.609 1.00 0.00 C ATOM 2038 O GLY A 133 2.063 -20.238 3.464 1.00 0.00 O ATOM 0 H GLY A 133 4.403 -17.978 1.291 1.00 0.00 H new ATOM 0 HA2 GLY A 133 2.931 -19.755 0.561 1.00 0.00 H new ATOM 0 HA3 GLY A 133 3.720 -20.840 1.688 1.00 0.00 H new ATOM 2042 N TYR A 134 1.944 -18.180 2.565 1.00 0.00 N ATOM 2043 CA TYR A 134 0.980 -17.689 3.542 1.00 0.00 C ATOM 2044 C TYR A 134 -0.343 -17.333 2.871 1.00 0.00 C ATOM 2045 O TYR A 134 -0.369 -16.874 1.729 1.00 0.00 O ATOM 2046 CB TYR A 134 1.539 -16.467 4.273 1.00 0.00 C ATOM 2047 CG TYR A 134 0.493 -15.687 5.037 1.00 0.00 C ATOM 2048 CD1 TYR A 134 -0.468 -14.936 4.370 1.00 0.00 C ATOM 2049 CD2 TYR A 134 0.464 -15.702 6.426 1.00 0.00 C ATOM 2050 CE1 TYR A 134 -1.425 -14.222 5.064 1.00 0.00 C ATOM 2051 CE2 TYR A 134 -0.490 -14.992 7.128 1.00 0.00 C ATOM 2052 CZ TYR A 134 -1.432 -14.253 6.443 1.00 0.00 C ATOM 2053 OH TYR A 134 -2.385 -13.544 7.138 1.00 0.00 O ATOM 0 H TYR A 134 2.219 -17.493 1.863 1.00 0.00 H new ATOM 0 HA TYR A 134 0.798 -18.484 4.265 1.00 0.00 H new ATOM 0 HB2 TYR A 134 2.315 -16.792 4.966 1.00 0.00 H new ATOM 0 HB3 TYR A 134 2.015 -15.807 3.548 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -0.466 -14.910 3.290 1.00 0.00 H new ATOM 0 HD2 TYR A 134 1.200 -16.279 6.966 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -2.164 -13.643 4.530 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -0.499 -15.015 8.208 1.00 0.00 H new ATOM 0 HH TYR A 134 -2.251 -13.673 8.100 1.00 0.00 H new ATOM 2063 N ARG A 135 -1.441 -17.547 3.589 1.00 0.00 N ATOM 2064 CA ARG A 135 -2.768 -17.250 3.064 1.00 0.00 C ATOM 2065 C ARG A 135 -3.734 -16.903 4.193 1.00 0.00 C ATOM 2066 O ARG A 135 -3.531 -17.297 5.341 1.00 0.00 O ATOM 2067 CB ARG A 135 -3.304 -18.442 2.269 1.00 0.00 C ATOM 2068 CG ARG A 135 -2.977 -18.381 0.786 1.00 0.00 C ATOM 2069 CD ARG A 135 -3.197 -19.726 0.111 1.00 0.00 C ATOM 2070 NE ARG A 135 -4.584 -19.907 -0.310 1.00 0.00 N ATOM 2071 CZ ARG A 135 -4.962 -20.778 -1.239 1.00 0.00 C ATOM 2072 NH1 ARG A 135 -4.062 -21.544 -1.840 1.00 0.00 N ATOM 2073 NH2 ARG A 135 -6.243 -20.884 -1.568 1.00 0.00 N ATOM 0 H ARG A 135 -1.437 -17.925 4.536 1.00 0.00 H new ATOM 0 HA ARG A 135 -2.685 -16.388 2.402 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -2.892 -19.361 2.686 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -4.386 -18.493 2.392 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -3.599 -17.626 0.306 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -1.940 -18.071 0.653 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -2.541 -19.808 -0.756 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -2.919 -20.526 0.797 1.00 0.00 H new ATOM 0 HE ARG A 135 -5.301 -19.333 0.134 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -3.076 -21.465 -1.589 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -4.355 -22.212 -2.553 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -6.938 -20.296 -1.108 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -6.533 -21.553 -2.281 1.00 0.00 H new ATOM 2087 N GLY A 136 -4.785 -16.161 3.858 1.00 0.00 N ATOM 2088 CA GLY A 136 -5.766 -15.772 4.855 1.00 0.00 C ATOM 2089 C GLY A 136 -6.769 -14.769 4.320 1.00 0.00 C ATOM 2090 O GLY A 136 -7.180 -14.849 3.163 1.00 0.00 O ATOM 0 H GLY A 136 -4.975 -15.822 2.915 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -6.295 -16.658 5.205 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -5.254 -15.345 5.717 1.00 0.00 H new ATOM 2094 N MET A 137 -7.166 -13.823 5.165 1.00 0.00 N ATOM 2095 CA MET A 137 -8.128 -12.801 4.770 1.00 0.00 C ATOM 2096 C MET A 137 -7.632 -11.410 5.154 1.00 0.00 C ATOM 2097 O MET A 137 -7.031 -11.225 6.214 1.00 0.00 O ATOM 2098 CB MET A 137 -9.486 -13.069 5.422 1.00 0.00 C ATOM 2099 CG MET A 137 -9.516 -12.763 6.911 1.00 0.00 C ATOM 2100 SD MET A 137 -9.660 -10.999 7.255 1.00 0.00 S ATOM 2101 CE MET A 137 -9.128 -10.943 8.964 1.00 0.00 C ATOM 0 H MET A 137 -6.837 -13.743 6.127 1.00 0.00 H new ATOM 0 HA MET A 137 -8.239 -12.842 3.686 1.00 0.00 H new ATOM 0 HB2 MET A 137 -10.245 -12.469 4.921 1.00 0.00 H new ATOM 0 HB3 MET A 137 -9.754 -14.114 5.269 1.00 0.00 H new ATOM 0 HG2 MET A 137 -10.354 -13.288 7.369 1.00 0.00 H new ATOM 0 HG3 MET A 137 -8.607 -13.147 7.375 1.00 0.00 H new ATOM 0 HE1 MET A 137 -9.162 -9.914 9.322 1.00 0.00 H new ATOM 0 HE2 MET A 137 -9.789 -11.561 9.571 1.00 0.00 H new ATOM 0 HE3 MET A 137 -8.108 -11.320 9.040 1.00 0.00 H new ATOM 2111 N LEU A 138 -7.887 -10.436 4.288 1.00 0.00 N ATOM 2112 CA LEU A 138 -7.466 -9.062 4.537 1.00 0.00 C ATOM 2113 C LEU A 138 -8.634 -8.216 5.035 1.00 0.00 C ATOM 2114 O LEU A 138 -9.716 -8.228 4.448 1.00 0.00 O ATOM 2115 CB LEU A 138 -6.884 -8.447 3.263 1.00 0.00 C ATOM 2116 CG LEU A 138 -5.372 -8.590 3.079 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -4.957 -8.125 1.692 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -4.628 -7.808 4.151 1.00 0.00 C ATOM 0 H LEU A 138 -8.383 -10.572 3.407 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.697 -9.078 5.310 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.379 -8.902 2.405 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -7.133 -7.386 3.249 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.111 -9.643 3.180 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.878 -8.234 1.579 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.463 -8.729 0.939 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.231 -7.078 1.562 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.554 -7.921 4.004 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.894 -6.753 4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -4.902 -8.188 5.135 1.00 0.00 H new ATOM 2130 N ASP A 139 -8.407 -7.482 6.118 1.00 0.00 N ATOM 2131 CA ASP A 139 -9.439 -6.628 6.693 1.00 0.00 C ATOM 2132 C ASP A 139 -10.101 -5.775 5.615 1.00 0.00 C ATOM 2133 O ASP A 139 -9.454 -4.938 4.985 1.00 0.00 O ATOM 2134 CB ASP A 139 -8.842 -5.728 7.777 1.00 0.00 C ATOM 2135 CG ASP A 139 -9.715 -4.526 8.078 1.00 0.00 C ATOM 2136 OD1 ASP A 139 -10.946 -4.701 8.196 1.00 0.00 O ATOM 2137 OD2 ASP A 139 -9.167 -3.410 8.195 1.00 0.00 O ATOM 0 H ASP A 139 -7.517 -7.461 6.616 1.00 0.00 H new ATOM 0 HA ASP A 139 -10.198 -7.269 7.141 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -8.700 -6.308 8.689 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -7.856 -5.387 7.460 1.00 0.00 H new ATOM 2142 N THR A 140 -11.396 -5.994 5.407 1.00 0.00 N ATOM 2143 CA THR A 140 -12.146 -5.248 4.404 1.00 0.00 C ATOM 2144 C THR A 140 -12.007 -3.746 4.619 1.00 0.00 C ATOM 2145 O THR A 140 -12.460 -3.208 5.630 1.00 0.00 O ATOM 2146 CB THR A 140 -13.640 -5.623 4.426 1.00 0.00 C ATOM 2147 OG1 THR A 140 -13.789 -7.045 4.363 1.00 0.00 O ATOM 2148 CG2 THR A 140 -14.376 -4.978 3.262 1.00 0.00 C ATOM 0 H THR A 140 -11.947 -6.682 5.920 1.00 0.00 H new ATOM 0 HA THR A 140 -11.727 -5.513 3.433 1.00 0.00 H new ATOM 0 HB THR A 140 -14.071 -5.255 5.357 1.00 0.00 H new ATOM 0 HG1 THR A 140 -14.741 -7.275 4.379 1.00 0.00 H new ATOM 0 HG21 THR A 140 -15.429 -5.257 3.298 1.00 0.00 H new ATOM 0 HG22 THR A 140 -14.285 -3.894 3.330 1.00 0.00 H new ATOM 0 HG23 THR A 140 -13.942 -5.320 2.323 1.00 0.00 H new ATOM 2156 N HIS A 141 -11.377 -3.071 3.662 1.00 0.00 N ATOM 2157 CA HIS A 141 -11.180 -1.629 3.746 1.00 0.00 C ATOM 2158 C HIS A 141 -12.508 -0.910 3.960 1.00 0.00 C ATOM 2159 O HIS A 141 -13.553 -1.545 4.107 1.00 0.00 O ATOM 2160 CB HIS A 141 -10.505 -1.110 2.476 1.00 0.00 C ATOM 2161 CG HIS A 141 -9.731 0.156 2.683 1.00 0.00 C ATOM 2162 ND1 HIS A 141 -10.001 1.323 2.001 1.00 0.00 N ATOM 2163 CD2 HIS A 141 -8.691 0.433 3.503 1.00 0.00 C ATOM 2164 CE1 HIS A 141 -9.160 2.263 2.391 1.00 0.00 C ATOM 2165 NE2 HIS A 141 -8.354 1.749 3.303 1.00 0.00 N ATOM 0 H HIS A 141 -10.994 -3.500 2.820 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.535 -1.425 4.601 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -9.834 -1.878 2.092 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -11.265 -0.941 1.714 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -8.215 -0.253 4.187 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -9.135 3.279 2.027 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -7.604 2.248 3.781 1.00 0.00 H new ATOM 2173 N HIS A 142 -12.461 0.418 3.976 1.00 0.00 N ATOM 2174 CA HIS A 142 -13.662 1.223 4.173 1.00 0.00 C ATOM 2175 C HIS A 142 -14.372 1.472 2.846 1.00 0.00 C ATOM 2176 O HIS A 142 -15.423 0.891 2.573 1.00 0.00 O ATOM 2177 CB HIS A 142 -13.305 2.556 4.832 1.00 0.00 C ATOM 2178 CG HIS A 142 -14.498 3.400 5.160 1.00 0.00 C ATOM 2179 ND1 HIS A 142 -15.711 3.489 4.564 1.00 0.00 N flip ATOM 2180 CD2 HIS A 142 -14.525 4.289 6.214 1.00 0.00 C flip ATOM 2181 CE1 HIS A 142 -16.440 4.419 5.263 1.00 0.00 C flip ATOM 2182 NE2 HIS A 142 -15.702 4.886 6.254 1.00 0.00 N flip ATOM 0 H HIS A 142 -11.605 0.960 3.855 1.00 0.00 H new ATOM 0 HA HIS A 142 -14.337 0.672 4.828 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -12.745 2.361 5.747 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -12.646 3.115 4.168 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -13.710 4.469 6.900 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -17.453 4.720 5.039 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -15.992 5.588 6.934 1.00 0.00 H new ATOM 2190 N LYS A 143 -13.792 2.340 2.023 1.00 0.00 N ATOM 2191 CA LYS A 143 -14.368 2.666 0.724 1.00 0.00 C ATOM 2192 C LYS A 143 -13.818 1.747 -0.361 1.00 0.00 C ATOM 2193 O LYS A 143 -14.577 1.132 -1.112 1.00 0.00 O ATOM 2194 CB LYS A 143 -14.078 4.125 0.367 1.00 0.00 C ATOM 2195 CG LYS A 143 -15.142 4.759 -0.513 1.00 0.00 C ATOM 2196 CD LYS A 143 -15.238 6.258 -0.280 1.00 0.00 C ATOM 2197 CE LYS A 143 -15.865 6.968 -1.470 1.00 0.00 C ATOM 2198 NZ LYS A 143 -15.367 8.364 -1.609 1.00 0.00 N ATOM 0 H LYS A 143 -12.923 2.830 2.233 1.00 0.00 H new ATOM 0 HA LYS A 143 -15.447 2.521 0.786 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -13.986 4.704 1.286 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -13.116 4.181 -0.143 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -14.911 4.567 -1.561 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -16.107 4.296 -0.309 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -15.831 6.451 0.614 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -14.243 6.663 -0.096 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -15.646 6.412 -2.381 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -16.949 6.979 -1.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -15.818 8.813 -2.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -15.599 8.902 -0.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -14.336 8.353 -1.743 1.00 0.00 H new ATOM 2212 N LEU A 144 -12.495 1.656 -0.438 1.00 0.00 N ATOM 2213 CA LEU A 144 -11.843 0.809 -1.432 1.00 0.00 C ATOM 2214 C LEU A 144 -12.620 -0.487 -1.638 1.00 0.00 C ATOM 2215 O LEU A 144 -12.991 -0.828 -2.761 1.00 0.00 O ATOM 2216 CB LEU A 144 -10.409 0.495 -1.000 1.00 0.00 C ATOM 2217 CG LEU A 144 -9.461 0.034 -2.107 1.00 0.00 C ATOM 2218 CD1 LEU A 144 -9.384 1.077 -3.212 1.00 0.00 C ATOM 2219 CD2 LEU A 144 -8.077 -0.248 -1.541 1.00 0.00 C ATOM 0 H LEU A 144 -11.853 2.158 0.175 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.821 1.351 -2.377 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -9.987 1.386 -0.536 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -10.443 -0.278 -0.233 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.853 -0.890 -2.533 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.705 0.732 -3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -10.376 1.231 -3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.016 2.017 -2.800 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -7.416 -0.575 -2.343 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.677 0.659 -1.088 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -8.145 -1.031 -0.785 1.00 0.00 H new ATOM 2231 N CYS A 145 -12.865 -1.203 -0.546 1.00 0.00 N ATOM 2232 CA CYS A 145 -13.600 -2.462 -0.607 1.00 0.00 C ATOM 2233 C CYS A 145 -14.722 -2.387 -1.637 1.00 0.00 C ATOM 2234 O CYS A 145 -14.909 -3.305 -2.436 1.00 0.00 O ATOM 2235 CB CYS A 145 -14.175 -2.807 0.768 1.00 0.00 C ATOM 2236 SG CYS A 145 -15.619 -1.822 1.232 1.00 0.00 S ATOM 0 H CYS A 145 -12.566 -0.934 0.391 1.00 0.00 H new ATOM 0 HA CYS A 145 -12.906 -3.246 -0.910 1.00 0.00 H new ATOM 0 HB2 CYS A 145 -14.449 -3.862 0.781 1.00 0.00 H new ATOM 0 HB3 CYS A 145 -13.398 -2.670 1.520 1.00 0.00 H new ATOM 0 HG CYS A 145 -15.228 -0.713 1.787 1.00 0.00 H new ATOM 2242 N THR A 146 -15.469 -1.287 -1.613 1.00 0.00 N ATOM 2243 CA THR A 146 -16.574 -1.093 -2.542 1.00 0.00 C ATOM 2244 C THR A 146 -16.091 -1.130 -3.987 1.00 0.00 C ATOM 2245 O THR A 146 -16.649 -1.844 -4.821 1.00 0.00 O ATOM 2246 CB THR A 146 -17.294 0.245 -2.288 1.00 0.00 C ATOM 2247 OG1 THR A 146 -17.641 0.359 -0.903 1.00 0.00 O ATOM 2248 CG2 THR A 146 -18.548 0.355 -3.141 1.00 0.00 C ATOM 0 H THR A 146 -15.328 -0.517 -0.959 1.00 0.00 H new ATOM 0 HA THR A 146 -17.274 -1.912 -2.375 1.00 0.00 H new ATOM 0 HB THR A 146 -16.617 1.054 -2.560 1.00 0.00 H new ATOM 0 HG1 THR A 146 -18.097 1.213 -0.749 1.00 0.00 H new ATOM 0 HG21 THR A 146 -19.039 1.308 -2.944 1.00 0.00 H new ATOM 0 HG22 THR A 146 -18.277 0.297 -4.195 1.00 0.00 H new ATOM 0 HG23 THR A 146 -19.228 -0.461 -2.896 1.00 0.00 H new ATOM 2256 N PHE A 147 -15.049 -0.358 -4.278 1.00 0.00 N ATOM 2257 CA PHE A 147 -14.490 -0.302 -5.623 1.00 0.00 C ATOM 2258 C PHE A 147 -13.909 -1.654 -6.027 1.00 0.00 C ATOM 2259 O PHE A 147 -14.182 -2.159 -7.116 1.00 0.00 O ATOM 2260 CB PHE A 147 -13.408 0.776 -5.705 1.00 0.00 C ATOM 2261 CG PHE A 147 -12.382 0.517 -6.771 1.00 0.00 C ATOM 2262 CD1 PHE A 147 -11.299 -0.310 -6.522 1.00 0.00 C ATOM 2263 CD2 PHE A 147 -12.501 1.101 -8.022 1.00 0.00 C ATOM 2264 CE1 PHE A 147 -10.353 -0.551 -7.501 1.00 0.00 C ATOM 2265 CE2 PHE A 147 -11.559 0.863 -9.005 1.00 0.00 C ATOM 2266 CZ PHE A 147 -10.483 0.037 -8.744 1.00 0.00 C ATOM 0 H PHE A 147 -14.575 0.238 -3.599 1.00 0.00 H new ATOM 0 HA PHE A 147 -15.295 -0.051 -6.314 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -13.881 1.740 -5.894 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -12.907 0.850 -4.740 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -11.192 -0.772 -5.552 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -13.339 1.749 -8.231 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -9.513 -1.198 -7.294 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -11.664 1.323 -9.977 1.00 0.00 H new ATOM 0 HZ PHE A 147 -9.745 -0.149 -9.510 1.00 0.00 H new ATOM 2276 N ILE A 148 -13.104 -2.233 -5.142 1.00 0.00 N ATOM 2277 CA ILE A 148 -12.485 -3.526 -5.405 1.00 0.00 C ATOM 2278 C ILE A 148 -13.530 -4.571 -5.780 1.00 0.00 C ATOM 2279 O ILE A 148 -13.399 -5.261 -6.791 1.00 0.00 O ATOM 2280 CB ILE A 148 -11.688 -4.027 -4.186 1.00 0.00 C ATOM 2281 CG1 ILE A 148 -10.696 -2.958 -3.723 1.00 0.00 C ATOM 2282 CG2 ILE A 148 -10.962 -5.320 -4.523 1.00 0.00 C ATOM 2283 CD1 ILE A 148 -9.829 -3.400 -2.565 1.00 0.00 C ATOM 0 H ILE A 148 -12.865 -1.827 -4.237 1.00 0.00 H new ATOM 0 HA ILE A 148 -11.802 -3.384 -6.242 1.00 0.00 H new ATOM 0 HB ILE A 148 -12.385 -4.226 -3.372 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -10.056 -2.681 -4.561 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -11.247 -2.063 -3.433 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -10.403 -5.661 -3.652 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -11.688 -6.081 -4.809 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -10.274 -5.146 -5.350 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -9.150 -2.593 -2.290 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -10.460 -3.650 -1.712 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -9.251 -4.276 -2.857 1.00 0.00 H new ATOM 2295 N LEU A 149 -14.569 -4.681 -4.959 1.00 0.00 N ATOM 2296 CA LEU A 149 -15.640 -5.640 -5.205 1.00 0.00 C ATOM 2297 C LEU A 149 -16.333 -5.355 -6.533 1.00 0.00 C ATOM 2298 O LEU A 149 -16.363 -6.203 -7.425 1.00 0.00 O ATOM 2299 CB LEU A 149 -16.660 -5.599 -4.066 1.00 0.00 C ATOM 2300 CG LEU A 149 -16.219 -6.234 -2.746 1.00 0.00 C ATOM 2301 CD1 LEU A 149 -17.170 -5.849 -1.624 1.00 0.00 C ATOM 2302 CD2 LEU A 149 -16.138 -7.747 -2.884 1.00 0.00 C ATOM 0 H LEU A 149 -14.692 -4.118 -4.117 1.00 0.00 H new ATOM 0 HA LEU A 149 -15.198 -6.635 -5.253 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -16.921 -4.558 -3.876 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -17.569 -6.099 -4.401 1.00 0.00 H new ATOM 0 HG LEU A 149 -15.227 -5.858 -2.497 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -16.840 -6.310 -0.693 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -17.178 -4.765 -1.509 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -18.175 -6.195 -1.864 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -15.823 -8.182 -1.936 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -17.117 -8.140 -3.156 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -15.416 -8.004 -3.659 1.00 0.00 H new ATOM 2314 N LYS A 150 -16.887 -4.154 -6.660 1.00 0.00 N ATOM 2315 CA LYS A 150 -17.577 -3.754 -7.880 1.00 0.00 C ATOM 2316 C LYS A 150 -16.785 -4.172 -9.115 1.00 0.00 C ATOM 2317 O LYS A 150 -17.335 -4.753 -10.049 1.00 0.00 O ATOM 2318 CB LYS A 150 -17.799 -2.240 -7.892 1.00 0.00 C ATOM 2319 CG LYS A 150 -18.948 -1.787 -7.008 1.00 0.00 C ATOM 2320 CD LYS A 150 -19.661 -0.580 -7.595 1.00 0.00 C ATOM 2321 CE LYS A 150 -18.875 0.700 -7.361 1.00 0.00 C ATOM 2322 NZ LYS A 150 -17.885 0.950 -8.446 1.00 0.00 N ATOM 0 H LYS A 150 -16.871 -3.440 -5.932 1.00 0.00 H new ATOM 0 HA LYS A 150 -18.544 -4.257 -7.902 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -16.884 -1.744 -7.567 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -17.990 -1.917 -8.915 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -19.657 -2.605 -6.884 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -18.570 -1.540 -6.016 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -19.808 -0.728 -8.665 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -20.651 -0.487 -7.147 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -19.564 1.542 -7.297 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -18.357 0.638 -6.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -17.580 1.944 -8.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -17.061 0.330 -8.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -18.323 0.751 -9.368 1.00 0.00 H new ATOM 2336 N ASN A 151 -15.490 -3.873 -9.111 1.00 0.00 N ATOM 2337 CA ASN A 151 -14.622 -4.218 -10.231 1.00 0.00 C ATOM 2338 C ASN A 151 -13.390 -4.980 -9.749 1.00 0.00 C ATOM 2339 O ASN A 151 -12.477 -4.415 -9.147 1.00 0.00 O ATOM 2340 CB ASN A 151 -14.193 -2.955 -10.980 1.00 0.00 C ATOM 2341 CG ASN A 151 -13.787 -1.835 -10.041 1.00 0.00 C ATOM 2342 OD1 ASN A 151 -14.754 -1.016 -9.645 1.00 0.00 O flip ATOM 2343 ND2 ASN A 151 -12.619 -1.710 -9.676 1.00 0.00 N flip ATOM 0 H ASN A 151 -15.019 -3.393 -8.345 1.00 0.00 H new ATOM 0 HA ASN A 151 -15.184 -4.861 -10.909 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -13.358 -3.193 -11.639 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -15.013 -2.615 -11.613 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -11.909 -2.363 -10.006 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -12.361 -0.953 -9.043 1.00 0.00 H new ATOM 2350 N PRO A 152 -13.363 -6.293 -10.021 1.00 0.00 N ATOM 2351 CA PRO A 152 -12.249 -7.160 -9.627 1.00 0.00 C ATOM 2352 C PRO A 152 -10.979 -6.869 -10.419 1.00 0.00 C ATOM 2353 O PRO A 152 -10.988 -6.129 -11.403 1.00 0.00 O ATOM 2354 CB PRO A 152 -12.765 -8.566 -9.941 1.00 0.00 C ATOM 2355 CG PRO A 152 -13.780 -8.366 -11.012 1.00 0.00 C ATOM 2356 CD PRO A 152 -14.417 -7.032 -10.736 1.00 0.00 C ATOM 0 HA PRO A 152 -11.971 -7.017 -8.583 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -11.959 -9.218 -10.277 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -13.206 -9.032 -9.060 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -13.315 -8.380 -11.998 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -14.523 -9.163 -10.999 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -14.708 -6.527 -11.657 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -15.318 -7.134 -10.131 1.00 0.00 H new ATOM 2364 N PRO A 153 -9.859 -7.465 -9.983 1.00 0.00 N ATOM 2365 CA PRO A 153 -8.560 -7.285 -10.639 1.00 0.00 C ATOM 2366 C PRO A 153 -8.503 -7.959 -12.006 1.00 0.00 C ATOM 2367 O PRO A 153 -8.794 -9.147 -12.135 1.00 0.00 O ATOM 2368 CB PRO A 153 -7.579 -7.954 -9.672 1.00 0.00 C ATOM 2369 CG PRO A 153 -8.398 -8.955 -8.934 1.00 0.00 C ATOM 2370 CD PRO A 153 -9.774 -8.360 -8.817 1.00 0.00 C ATOM 0 HA PRO A 153 -8.342 -6.234 -10.831 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -6.759 -8.431 -10.208 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -7.135 -7.227 -8.992 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -8.428 -9.905 -9.468 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -7.975 -9.156 -7.950 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -10.547 -9.128 -8.843 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -9.898 -7.814 -7.882 1.00 0.00 H new ATOM 2378 N GLU A 154 -8.124 -7.191 -13.023 1.00 0.00 N ATOM 2379 CA GLU A 154 -8.030 -7.715 -14.381 1.00 0.00 C ATOM 2380 C GLU A 154 -6.572 -7.861 -14.807 1.00 0.00 C ATOM 2381 O GLU A 154 -5.712 -7.084 -14.393 1.00 0.00 O ATOM 2382 CB GLU A 154 -8.769 -6.798 -15.358 1.00 0.00 C ATOM 2383 CG GLU A 154 -8.802 -7.326 -16.782 1.00 0.00 C ATOM 2384 CD GLU A 154 -9.021 -6.230 -17.806 1.00 0.00 C ATOM 2385 OE1 GLU A 154 -8.115 -5.388 -17.977 1.00 0.00 O ATOM 2386 OE2 GLU A 154 -10.099 -6.215 -18.437 1.00 0.00 O ATOM 0 H GLU A 154 -7.877 -6.205 -12.933 1.00 0.00 H new ATOM 0 HA GLU A 154 -8.496 -8.700 -14.396 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -9.792 -6.657 -15.008 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -8.293 -5.818 -15.354 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -7.864 -7.837 -16.998 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -9.597 -8.067 -16.873 1.00 0.00 H new ATOM 2393 N ASN A 155 -6.302 -8.863 -15.637 1.00 0.00 N ATOM 2394 CA ASN A 155 -4.948 -9.113 -16.119 1.00 0.00 C ATOM 2395 C ASN A 155 -4.234 -7.803 -16.437 1.00 0.00 C ATOM 2396 O ASN A 155 -4.500 -7.171 -17.459 1.00 0.00 O ATOM 2397 CB ASN A 155 -4.983 -10.003 -17.363 1.00 0.00 C ATOM 2398 CG ASN A 155 -5.913 -11.190 -17.199 1.00 0.00 C ATOM 2399 OD1 ASN A 155 -5.758 -11.990 -16.276 1.00 0.00 O ATOM 2400 ND2 ASN A 155 -6.885 -11.308 -18.096 1.00 0.00 N ATOM 0 H ASN A 155 -7.002 -9.515 -15.990 1.00 0.00 H new ATOM 0 HA ASN A 155 -4.397 -9.625 -15.330 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -5.302 -9.411 -18.221 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -3.976 -10.361 -17.579 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -7.542 -12.086 -18.037 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -6.975 -10.620 -18.844 1.00 0.00 H new ATOM 2407 N SER A 156 -3.325 -7.401 -15.554 1.00 0.00 N ATOM 2408 CA SER A 156 -2.574 -6.165 -15.739 1.00 0.00 C ATOM 2409 C SER A 156 -1.452 -6.357 -16.755 1.00 0.00 C ATOM 2410 O SER A 156 -1.261 -5.532 -17.649 1.00 0.00 O ATOM 2411 CB SER A 156 -1.993 -5.692 -14.405 1.00 0.00 C ATOM 2412 OG SER A 156 -1.373 -4.425 -14.539 1.00 0.00 O ATOM 0 H SER A 156 -3.091 -7.913 -14.704 1.00 0.00 H new ATOM 0 HA SER A 156 -3.259 -5.407 -16.119 1.00 0.00 H new ATOM 0 HB2 SER A 156 -2.786 -5.635 -13.659 1.00 0.00 H new ATOM 0 HB3 SER A 156 -1.266 -6.419 -14.043 1.00 0.00 H new ATOM 0 HG SER A 156 -1.011 -4.145 -13.672 1.00 0.00 H new ATOM 2418 N ASP A 157 -0.714 -7.452 -16.611 1.00 0.00 N ATOM 2419 CA ASP A 157 0.389 -7.754 -17.517 1.00 0.00 C ATOM 2420 C ASP A 157 -0.103 -8.542 -18.727 1.00 0.00 C ATOM 2421 O ASP A 157 -1.124 -9.221 -18.629 1.00 0.00 O ATOM 2422 CB ASP A 157 1.475 -8.544 -16.785 1.00 0.00 C ATOM 2423 CG ASP A 157 2.505 -7.644 -16.132 1.00 0.00 C ATOM 2424 OD1 ASP A 157 2.144 -6.513 -15.745 1.00 0.00 O ATOM 2425 OD2 ASP A 157 3.673 -8.069 -16.008 1.00 0.00 O ATOM 0 H ASP A 157 -0.859 -8.145 -15.877 1.00 0.00 H new ATOM 0 HA ASP A 157 0.810 -6.811 -17.867 1.00 0.00 H new ATOM 0 HB2 ASP A 157 1.012 -9.173 -16.025 1.00 0.00 H new ATOM 0 HB3 ASP A 157 1.973 -9.210 -17.490 1.00 0.00 H new TER 2430 ASP A 157 HETATM 2431 ZN ZN A 301 5.160 -14.680 2.230 1.00 0.00 ZN