USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1069 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 35 ASN : amide:sc= -0.201 K(o=-0.2,f=-3.7!) USER MOD Set 1.2: A 41 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 53 MET CE :methyl -141:sc= -0.916 (180deg=-2.72!) USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.409 X(o=-0.41,f=-0.034) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc=-0.00672 K(o=-0.0067,f=-1.6) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -174:sc= 1.09 (180deg=1.04) USER MOD Single : A 21 LYS NZ :NH3+ -162:sc=-0.00184 (180deg=-0.125) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.0375 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 169:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0108) USER MOD Single : A 45 ASN : amide:sc= -1.51 K(o=-1.5,f=-2.3!) USER MOD Single : A 48 THR OG1 : rot -82:sc= 1.3 USER MOD Single : A 56 SER OG : rot -67:sc= 1.28 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -171:sc= 1.22 (180deg=1.14) USER MOD Single : A 60 ASN : amide:sc= -0.465 K(o=-0.47,f=-6.4!) USER MOD Single : A 61 MET CE :methyl -153:sc= -0.0979 (180deg=-1.22) USER MOD Single : A 67 ASN : amide:sc= -0.232 X(o=-0.23,f=0) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 72 ASN : amide:sc= -0.0314 K(o=-0.031,f=-1.6!) USER MOD Single : A 74 MET CE :methyl -128:sc= 0 (180deg=-0.0128) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 144:sc= -0.177 (180deg=-1.59!) USER MOD Single : A 80 HIS :FLIP no HD1:sc= -1.26 F(o=-2!,f=-1.3) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl -163:sc= 0 (180deg=-0.512) USER MOD Single : A 88 GLN : amide:sc= -0.243 X(o=-0.24,f=-0.25) USER MOD Single : A 89 GLN : amide:sc= -0.0615 K(o=-0.062,f=-0.8) USER MOD Single : A 95 HIS : no HD1:sc= -0.108 X(o=-0.11,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 91:sc= 1.21 USER MOD Single : A 104 ASN : amide:sc= 0.493 K(o=0.49,f=-6.7!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 THR OG1 : rot 90:sc= 1.23 USER MOD Single : A 116 THR OG1 : rot 88:sc= 0.574 USER MOD Single : A 119 LYS NZ :NH3+ 145:sc= 1.32 (180deg=1.07) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= 0.19 K(o=0.19,f=-2.7!) USER MOD Single : A 130 SER OG : rot -75:sc= 0.126 USER MOD Single : A 131 MET CE :methyl -158:sc=-0.000688 (180deg=-0.893) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 6.404 20.982 9.346 1.00 0.00 N ATOM 2 CA SER A 1 5.824 20.961 10.694 1.00 0.00 C ATOM 3 C SER A 1 6.541 19.914 11.528 1.00 0.00 C ATOM 4 O SER A 1 6.717 18.765 11.119 1.00 0.00 O ATOM 5 CB SER A 1 4.310 20.709 10.652 1.00 0.00 C ATOM 6 OG SER A 1 3.680 20.811 11.931 1.00 0.00 O ATOM 0 H1 SER A 1 5.917 21.698 8.770 1.00 0.00 H new ATOM 0 H2 SER A 1 7.415 21.216 9.407 1.00 0.00 H new ATOM 0 H3 SER A 1 6.291 20.047 8.905 1.00 0.00 H new ATOM 0 HA SER A 1 5.962 21.939 11.156 1.00 0.00 H new ATOM 0 HB2 SER A 1 3.849 21.424 9.971 1.00 0.00 H new ATOM 0 HB3 SER A 1 4.126 19.715 10.243 1.00 0.00 H new ATOM 0 HG SER A 1 2.719 20.642 11.837 1.00 0.00 H new ATOM 12 N GLN A 2 6.941 20.303 12.729 1.00 0.00 N ATOM 13 CA GLN A 2 7.479 19.396 13.726 1.00 0.00 C ATOM 14 C GLN A 2 6.368 18.481 14.255 1.00 0.00 C ATOM 15 O GLN A 2 5.183 18.811 14.180 1.00 0.00 O ATOM 16 CB GLN A 2 8.133 20.239 14.824 1.00 0.00 C ATOM 17 CG GLN A 2 9.428 20.869 14.278 1.00 0.00 C ATOM 18 CD GLN A 2 9.920 22.008 15.155 1.00 0.00 C ATOM 19 OE1 GLN A 2 10.832 21.839 15.957 1.00 0.00 O ATOM 20 NE2 GLN A 2 9.369 23.194 15.011 1.00 0.00 N ATOM 0 H GLN A 2 6.899 21.273 13.041 1.00 0.00 H new ATOM 0 HA GLN A 2 8.237 18.739 13.300 1.00 0.00 H new ATOM 0 HB2 GLN A 2 7.448 21.019 15.157 1.00 0.00 H new ATOM 0 HB3 GLN A 2 8.355 19.618 15.692 1.00 0.00 H new ATOM 0 HG2 GLN A 2 10.202 20.105 14.208 1.00 0.00 H new ATOM 0 HG3 GLN A 2 9.253 21.239 13.268 1.00 0.00 H new ATOM 0 HE21 GLN A 2 8.611 23.326 14.342 1.00 0.00 H new ATOM 0 HE22 GLN A 2 9.700 23.981 15.569 1.00 0.00 H new ATOM 29 N GLU A 3 6.781 17.324 14.770 1.00 0.00 N ATOM 30 CA GLU A 3 5.992 16.240 15.344 1.00 0.00 C ATOM 31 C GLU A 3 4.764 15.828 14.515 1.00 0.00 C ATOM 32 O GLU A 3 3.708 15.496 15.054 1.00 0.00 O ATOM 33 CB GLU A 3 5.736 16.513 16.829 1.00 0.00 C ATOM 34 CG GLU A 3 7.031 16.382 17.654 1.00 0.00 C ATOM 35 CD GLU A 3 6.800 16.561 19.156 1.00 0.00 C ATOM 36 OE1 GLU A 3 5.811 17.215 19.547 1.00 0.00 O ATOM 37 OE2 GLU A 3 7.594 16.040 19.971 1.00 0.00 O ATOM 0 H GLU A 3 7.776 17.103 14.797 1.00 0.00 H new ATOM 0 HA GLU A 3 6.585 15.327 15.292 1.00 0.00 H new ATOM 0 HB2 GLU A 3 5.324 17.515 16.951 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.990 15.814 17.206 1.00 0.00 H new ATOM 0 HG2 GLU A 3 7.473 15.402 17.474 1.00 0.00 H new ATOM 0 HG3 GLU A 3 7.751 17.125 17.311 1.00 0.00 H new ATOM 44 N VAL A 4 4.926 15.746 13.193 1.00 0.00 N ATOM 45 CA VAL A 4 3.930 15.221 12.255 1.00 0.00 C ATOM 46 C VAL A 4 4.517 13.989 11.550 1.00 0.00 C ATOM 47 O VAL A 4 4.511 13.879 10.327 1.00 0.00 O ATOM 48 CB VAL A 4 3.411 16.313 11.288 1.00 0.00 C ATOM 49 CG1 VAL A 4 2.050 15.927 10.691 1.00 0.00 C ATOM 50 CG2 VAL A 4 3.228 17.676 11.957 1.00 0.00 C ATOM 0 H VAL A 4 5.782 16.053 12.730 1.00 0.00 H new ATOM 0 HA VAL A 4 3.041 14.901 12.798 1.00 0.00 H new ATOM 0 HB VAL A 4 4.179 16.388 10.518 1.00 0.00 H new ATOM 0 HG11 VAL A 4 1.712 16.714 10.016 1.00 0.00 H new ATOM 0 HG12 VAL A 4 2.147 14.992 10.139 1.00 0.00 H new ATOM 0 HG13 VAL A 4 1.323 15.801 11.494 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.862 18.395 11.224 1.00 0.00 H new ATOM 0 HG22 VAL A 4 2.507 17.588 12.770 1.00 0.00 H new ATOM 0 HG23 VAL A 4 4.184 18.017 12.355 1.00 0.00 H new ATOM 60 N MET A 5 5.007 13.017 12.314 1.00 0.00 N ATOM 61 CA MET A 5 5.416 11.687 11.882 1.00 0.00 C ATOM 62 C MET A 5 4.825 10.664 12.852 1.00 0.00 C ATOM 63 O MET A 5 5.495 9.715 13.270 1.00 0.00 O ATOM 64 CB MET A 5 6.943 11.568 11.758 1.00 0.00 C ATOM 65 CG MET A 5 7.536 12.628 10.839 1.00 0.00 C ATOM 66 SD MET A 5 9.207 12.225 10.266 1.00 0.00 S ATOM 67 CE MET A 5 9.480 13.639 9.174 1.00 0.00 C ATOM 0 H MET A 5 5.137 13.148 13.317 1.00 0.00 H new ATOM 0 HA MET A 5 5.032 11.491 10.881 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.393 11.656 12.747 1.00 0.00 H new ATOM 0 HB3 MET A 5 7.198 10.578 11.379 1.00 0.00 H new ATOM 0 HG2 MET A 5 6.884 12.756 9.975 1.00 0.00 H new ATOM 0 HG3 MET A 5 7.560 13.583 11.365 1.00 0.00 H new ATOM 0 HE1 MET A 5 10.470 13.565 8.723 1.00 0.00 H new ATOM 0 HE2 MET A 5 8.724 13.644 8.389 1.00 0.00 H new ATOM 0 HE3 MET A 5 9.412 14.562 9.750 1.00 0.00 H new ATOM 77 N LYS A 6 3.562 10.871 13.236 1.00 0.00 N ATOM 78 CA LYS A 6 2.703 9.823 13.726 1.00 0.00 C ATOM 79 C LYS A 6 2.620 8.680 12.719 1.00 0.00 C ATOM 80 O LYS A 6 3.122 8.767 11.599 1.00 0.00 O ATOM 81 CB LYS A 6 1.332 10.434 14.027 1.00 0.00 C ATOM 82 CG LYS A 6 1.023 10.353 15.519 1.00 0.00 C ATOM 83 CD LYS A 6 -0.335 10.960 15.878 1.00 0.00 C ATOM 84 CE LYS A 6 -0.551 10.929 17.396 1.00 0.00 C ATOM 85 NZ LYS A 6 -1.408 9.810 17.827 1.00 0.00 N ATOM 0 H LYS A 6 3.115 11.787 13.210 1.00 0.00 H new ATOM 0 HA LYS A 6 3.107 9.393 14.643 1.00 0.00 H new ATOM 0 HB2 LYS A 6 1.312 11.474 13.702 1.00 0.00 H new ATOM 0 HB3 LYS A 6 0.562 9.909 13.462 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.044 9.310 15.833 1.00 0.00 H new ATOM 0 HG3 LYS A 6 1.805 10.869 16.076 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.388 11.987 15.518 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.131 10.406 15.380 1.00 0.00 H new ATOM 0 HE2 LYS A 6 0.415 10.854 17.895 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -1.001 11.869 17.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -1.521 9.837 18.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -2.341 9.893 17.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.968 8.909 17.550 1.00 0.00 H new ATOM 99 N ASN A 7 1.962 7.605 13.143 1.00 0.00 N ATOM 100 CA ASN A 7 1.854 6.395 12.343 1.00 0.00 C ATOM 101 C ASN A 7 1.284 6.736 10.984 1.00 0.00 C ATOM 102 O ASN A 7 0.199 7.311 10.893 1.00 0.00 O ATOM 103 CB ASN A 7 0.946 5.354 12.988 1.00 0.00 C ATOM 104 CG ASN A 7 0.870 4.078 12.165 1.00 0.00 C ATOM 105 OD1 ASN A 7 1.610 3.133 12.423 1.00 0.00 O ATOM 106 ND2 ASN A 7 0.005 4.019 11.173 1.00 0.00 N ATOM 0 H ASN A 7 1.492 7.550 14.047 1.00 0.00 H new ATOM 0 HA ASN A 7 2.857 5.977 12.260 1.00 0.00 H new ATOM 0 HB2 ASN A 7 1.315 5.120 13.987 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -0.055 5.769 13.107 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -0.059 3.176 10.602 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -0.600 4.816 10.976 1.00 0.00 H new ATOM 113 N LEU A 8 1.969 6.227 9.973 1.00 0.00 N ATOM 114 CA LEU A 8 1.707 6.384 8.555 1.00 0.00 C ATOM 115 C LEU A 8 1.621 7.857 8.117 1.00 0.00 C ATOM 116 O LEU A 8 0.597 8.521 8.261 1.00 0.00 O ATOM 117 CB LEU A 8 0.545 5.449 8.199 1.00 0.00 C ATOM 118 CG LEU A 8 0.055 5.441 6.756 1.00 0.00 C ATOM 119 CD1 LEU A 8 -0.991 6.533 6.552 1.00 0.00 C ATOM 120 CD2 LEU A 8 1.218 5.519 5.763 1.00 0.00 C ATOM 0 H LEU A 8 2.790 5.645 10.139 1.00 0.00 H new ATOM 0 HA LEU A 8 2.550 6.066 7.941 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.842 4.433 8.457 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.300 5.706 8.838 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.433 4.488 6.553 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.335 6.519 5.518 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.836 6.356 7.218 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.551 7.505 6.775 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.828 5.511 4.745 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.778 6.439 5.930 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.877 4.662 5.906 1.00 0.00 H new ATOM 132 N SER A 9 2.728 8.364 7.577 1.00 0.00 N ATOM 133 CA SER A 9 2.898 9.744 7.138 1.00 0.00 C ATOM 134 C SER A 9 2.285 10.044 5.763 1.00 0.00 C ATOM 135 O SER A 9 2.105 11.214 5.416 1.00 0.00 O ATOM 136 CB SER A 9 4.399 10.047 7.132 1.00 0.00 C ATOM 137 OG SER A 9 4.870 10.145 8.465 1.00 0.00 O ATOM 0 H SER A 9 3.564 7.799 7.428 1.00 0.00 H new ATOM 0 HA SER A 9 2.358 10.387 7.834 1.00 0.00 H new ATOM 0 HB2 SER A 9 4.937 9.260 6.603 1.00 0.00 H new ATOM 0 HB3 SER A 9 4.590 10.978 6.599 1.00 0.00 H new ATOM 0 HG SER A 9 5.831 10.337 8.459 1.00 0.00 H new ATOM 143 N LEU A 10 1.947 9.031 4.956 1.00 0.00 N ATOM 144 CA LEU A 10 1.154 9.263 3.749 1.00 0.00 C ATOM 145 C LEU A 10 -0.252 9.754 4.130 1.00 0.00 C ATOM 146 O LEU A 10 -0.652 9.739 5.297 1.00 0.00 O ATOM 147 CB LEU A 10 1.127 8.022 2.826 1.00 0.00 C ATOM 148 CG LEU A 10 2.353 7.827 1.904 1.00 0.00 C ATOM 149 CD1 LEU A 10 2.190 6.650 0.930 1.00 0.00 C ATOM 150 CD2 LEU A 10 2.631 9.090 1.083 1.00 0.00 C ATOM 0 H LEU A 10 2.207 8.058 5.115 1.00 0.00 H new ATOM 0 HA LEU A 10 1.632 10.049 3.165 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.023 7.134 3.450 1.00 0.00 H new ATOM 0 HB3 LEU A 10 0.235 8.079 2.202 1.00 0.00 H new ATOM 0 HG LEU A 10 3.188 7.612 2.571 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.082 6.564 0.310 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.050 5.728 1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.322 6.822 0.294 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.498 8.925 0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.763 9.321 0.465 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.830 9.925 1.755 1.00 0.00 H new ATOM 162 N ASN A 11 -1.033 10.191 3.140 1.00 0.00 N ATOM 163 CA ASN A 11 -2.414 10.628 3.347 1.00 0.00 C ATOM 164 C ASN A 11 -3.373 9.553 2.835 1.00 0.00 C ATOM 165 O ASN A 11 -4.128 9.782 1.889 1.00 0.00 O ATOM 166 CB ASN A 11 -2.640 11.986 2.668 1.00 0.00 C ATOM 167 CG ASN A 11 -3.930 12.666 3.133 1.00 0.00 C ATOM 168 OD1 ASN A 11 -4.750 12.103 3.861 1.00 0.00 O ATOM 169 ND2 ASN A 11 -4.133 13.899 2.706 1.00 0.00 N ATOM 0 H ASN A 11 -0.724 10.252 2.170 1.00 0.00 H new ATOM 0 HA ASN A 11 -2.610 10.764 4.411 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -1.793 12.639 2.878 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -2.675 11.847 1.587 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -4.979 14.400 2.978 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -3.444 14.350 2.104 1.00 0.00 H new ATOM 176 N PHE A 12 -3.295 8.342 3.389 1.00 0.00 N ATOM 177 CA PHE A 12 -4.189 7.250 3.031 1.00 0.00 C ATOM 178 C PHE A 12 -5.617 7.598 3.408 1.00 0.00 C ATOM 179 O PHE A 12 -6.518 7.308 2.628 1.00 0.00 O ATOM 180 CB PHE A 12 -3.774 5.954 3.725 1.00 0.00 C ATOM 181 CG PHE A 12 -2.666 5.210 3.013 1.00 0.00 C ATOM 182 CD1 PHE A 12 -1.325 5.597 3.166 1.00 0.00 C ATOM 183 CD2 PHE A 12 -2.982 4.128 2.173 1.00 0.00 C ATOM 184 CE1 PHE A 12 -0.318 4.937 2.444 1.00 0.00 C ATOM 185 CE2 PHE A 12 -1.964 3.440 1.492 1.00 0.00 C ATOM 186 CZ PHE A 12 -0.631 3.856 1.610 1.00 0.00 C ATOM 0 H PHE A 12 -2.607 8.095 4.100 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.126 7.101 1.953 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.451 6.183 4.740 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -4.643 5.302 3.807 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -1.068 6.402 3.839 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.011 3.825 2.051 1.00 0.00 H new ATOM 0 HE1 PHE A 12 0.707 5.266 2.532 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -2.209 2.588 0.876 1.00 0.00 H new ATOM 0 HZ PHE A 12 0.149 3.347 1.062 1.00 0.00 H new ATOM 196 N GLY A 13 -5.819 8.227 4.568 1.00 0.00 N ATOM 197 CA GLY A 13 -7.114 8.602 5.109 1.00 0.00 C ATOM 198 C GLY A 13 -8.029 9.191 4.043 1.00 0.00 C ATOM 199 O GLY A 13 -9.035 8.580 3.686 1.00 0.00 O ATOM 0 H GLY A 13 -5.047 8.498 5.177 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.589 7.727 5.551 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -6.976 9.328 5.910 1.00 0.00 H new ATOM 203 N LYS A 14 -7.663 10.345 3.478 1.00 0.00 N ATOM 204 CA LYS A 14 -8.471 11.008 2.455 1.00 0.00 C ATOM 205 C LYS A 14 -8.638 10.125 1.216 1.00 0.00 C ATOM 206 O LYS A 14 -9.753 9.984 0.724 1.00 0.00 O ATOM 207 CB LYS A 14 -7.854 12.373 2.109 1.00 0.00 C ATOM 208 CG LYS A 14 -8.449 13.531 2.928 1.00 0.00 C ATOM 209 CD LYS A 14 -9.494 14.345 2.153 1.00 0.00 C ATOM 210 CE LYS A 14 -8.792 15.231 1.116 1.00 0.00 C ATOM 211 NZ LYS A 14 -9.712 16.129 0.391 1.00 0.00 N ATOM 0 H LYS A 14 -6.804 10.842 3.716 1.00 0.00 H new ATOM 0 HA LYS A 14 -9.472 11.177 2.852 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.778 12.332 2.278 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -8.002 12.573 1.048 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -8.908 13.130 3.832 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -7.644 14.194 3.246 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.197 13.675 1.657 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -10.072 14.962 2.841 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.031 15.830 1.617 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.275 14.596 0.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.174 16.699 -0.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.424 15.563 -0.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.187 16.759 1.068 1.00 0.00 H new ATOM 225 N ALA A 15 -7.572 9.516 0.701 1.00 0.00 N ATOM 226 CA ALA A 15 -7.634 8.676 -0.494 1.00 0.00 C ATOM 227 C ALA A 15 -8.604 7.494 -0.325 1.00 0.00 C ATOM 228 O ALA A 15 -9.307 7.131 -1.275 1.00 0.00 O ATOM 229 CB ALA A 15 -6.227 8.150 -0.807 1.00 0.00 C ATOM 0 H ALA A 15 -6.637 9.591 1.102 1.00 0.00 H new ATOM 0 HA ALA A 15 -8.008 9.286 -1.316 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.263 7.522 -1.697 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.555 8.990 -0.983 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.862 7.564 0.036 1.00 0.00 H new ATOM 235 N LEU A 16 -8.638 6.874 0.858 1.00 0.00 N ATOM 236 CA LEU A 16 -9.577 5.817 1.236 1.00 0.00 C ATOM 237 C LEU A 16 -10.971 6.422 1.332 1.00 0.00 C ATOM 238 O LEU A 16 -11.907 5.891 0.752 1.00 0.00 O ATOM 239 CB LEU A 16 -9.198 5.221 2.612 1.00 0.00 C ATOM 240 CG LEU A 16 -8.047 4.201 2.571 1.00 0.00 C ATOM 241 CD1 LEU A 16 -7.330 4.125 3.918 1.00 0.00 C ATOM 242 CD2 LEU A 16 -8.543 2.784 2.277 1.00 0.00 C ATOM 0 H LEU A 16 -7.986 7.105 1.607 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.546 5.025 0.487 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.922 6.035 3.282 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.078 4.740 3.040 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.381 4.547 1.780 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.522 3.396 3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.919 5.103 4.167 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.037 3.821 4.690 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.696 2.099 2.258 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.242 2.475 3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.045 2.768 1.310 1.00 0.00 H new ATOM 254 N ASP A 17 -11.122 7.538 2.046 1.00 0.00 N ATOM 255 CA ASP A 17 -12.364 8.286 2.253 1.00 0.00 C ATOM 256 C ASP A 17 -12.998 8.751 0.934 1.00 0.00 C ATOM 257 O ASP A 17 -14.214 8.948 0.874 1.00 0.00 O ATOM 258 CB ASP A 17 -12.048 9.470 3.184 1.00 0.00 C ATOM 259 CG ASP A 17 -13.255 10.248 3.695 1.00 0.00 C ATOM 260 OD1 ASP A 17 -14.330 9.665 3.962 1.00 0.00 O ATOM 261 OD2 ASP A 17 -13.125 11.479 3.884 1.00 0.00 O ATOM 0 H ASP A 17 -10.332 7.971 2.525 1.00 0.00 H new ATOM 0 HA ASP A 17 -13.107 7.634 2.712 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -11.490 9.095 4.042 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -11.391 10.160 2.654 1.00 0.00 H new ATOM 266 N GLU A 18 -12.225 8.854 -0.151 1.00 0.00 N ATOM 267 CA GLU A 18 -12.756 9.080 -1.492 1.00 0.00 C ATOM 268 C GLU A 18 -13.050 7.752 -2.173 1.00 0.00 C ATOM 269 O GLU A 18 -14.138 7.577 -2.709 1.00 0.00 O ATOM 270 CB GLU A 18 -11.782 9.902 -2.357 1.00 0.00 C ATOM 271 CG GLU A 18 -11.334 11.213 -1.691 1.00 0.00 C ATOM 272 CD GLU A 18 -11.697 12.453 -2.498 1.00 0.00 C ATOM 273 OE1 GLU A 18 -10.866 12.928 -3.295 1.00 0.00 O ATOM 274 OE2 GLU A 18 -12.766 13.059 -2.236 1.00 0.00 O ATOM 0 H GLU A 18 -11.208 8.782 -0.120 1.00 0.00 H new ATOM 0 HA GLU A 18 -13.680 9.649 -1.388 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -10.903 9.296 -2.578 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.259 10.131 -3.310 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -11.789 11.285 -0.703 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -10.254 11.187 -1.543 1.00 0.00 H new ATOM 281 N CYS A 19 -12.114 6.799 -2.182 1.00 0.00 N ATOM 282 CA CYS A 19 -12.315 5.584 -2.964 1.00 0.00 C ATOM 283 C CYS A 19 -13.421 4.701 -2.412 1.00 0.00 C ATOM 284 O CYS A 19 -14.141 4.044 -3.159 1.00 0.00 O ATOM 285 CB CYS A 19 -11.047 4.774 -3.065 1.00 0.00 C ATOM 286 SG CYS A 19 -11.141 3.719 -4.531 1.00 0.00 S ATOM 0 H CYS A 19 -11.233 6.844 -1.670 1.00 0.00 H new ATOM 0 HA CYS A 19 -12.613 5.924 -3.956 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -10.182 5.434 -3.131 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -10.916 4.165 -2.170 1.00 0.00 H new ATOM 291 N LYS A 20 -13.617 4.736 -1.100 1.00 0.00 N ATOM 292 CA LYS A 20 -14.782 4.136 -0.469 1.00 0.00 C ATOM 293 C LYS A 20 -16.061 4.673 -1.090 1.00 0.00 C ATOM 294 O LYS A 20 -17.027 3.925 -1.167 1.00 0.00 O ATOM 295 CB LYS A 20 -14.712 4.272 1.059 1.00 0.00 C ATOM 296 CG LYS A 20 -14.927 5.696 1.592 1.00 0.00 C ATOM 297 CD LYS A 20 -16.369 6.054 1.961 1.00 0.00 C ATOM 298 CE LYS A 20 -16.809 5.174 3.143 1.00 0.00 C ATOM 299 NZ LYS A 20 -17.972 5.726 3.855 1.00 0.00 N ATOM 0 H LYS A 20 -12.973 5.181 -0.446 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.788 3.063 -0.661 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.462 3.617 1.502 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.738 3.916 1.397 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -14.301 5.833 2.474 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.577 6.403 0.840 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.440 7.108 2.228 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.028 5.896 1.107 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -17.051 4.176 2.778 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.978 5.066 3.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -18.166 5.152 4.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -17.772 6.706 4.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -18.802 5.710 3.229 1.00 0.00 H new ATOM 313 N LYS A 21 -16.080 5.915 -1.588 1.00 0.00 N ATOM 314 CA LYS A 21 -17.203 6.410 -2.357 1.00 0.00 C ATOM 315 C LYS A 21 -17.112 5.935 -3.805 1.00 0.00 C ATOM 316 O LYS A 21 -18.141 5.591 -4.380 1.00 0.00 O ATOM 317 CB LYS A 21 -17.295 7.939 -2.277 1.00 0.00 C ATOM 318 CG LYS A 21 -17.346 8.384 -0.813 1.00 0.00 C ATOM 319 CD LYS A 21 -17.616 9.884 -0.672 1.00 0.00 C ATOM 320 CE LYS A 21 -18.390 10.119 0.627 1.00 0.00 C ATOM 321 NZ LYS A 21 -19.813 9.738 0.491 1.00 0.00 N ATOM 0 H LYS A 21 -15.324 6.589 -1.466 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.118 6.004 -1.926 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -16.435 8.390 -2.773 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -18.185 8.286 -2.803 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -18.125 7.826 -0.293 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.401 8.140 -0.328 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.677 10.438 -0.659 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -18.189 10.247 -1.525 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -17.934 9.543 1.432 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -18.320 11.170 0.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -20.365 10.179 1.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -20.173 10.063 -0.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -19.903 8.704 0.552 1.00 0.00 H new ATOM 335 N GLU A 22 -15.924 5.926 -4.420 1.00 0.00 N ATOM 336 CA GLU A 22 -15.733 5.530 -5.823 1.00 0.00 C ATOM 337 C GLU A 22 -16.209 4.100 -6.103 1.00 0.00 C ATOM 338 O GLU A 22 -16.757 3.854 -7.179 1.00 0.00 O ATOM 339 CB GLU A 22 -14.269 5.653 -6.283 1.00 0.00 C ATOM 340 CG GLU A 22 -13.775 7.104 -6.319 1.00 0.00 C ATOM 341 CD GLU A 22 -12.353 7.276 -6.870 1.00 0.00 C ATOM 342 OE1 GLU A 22 -11.549 6.319 -6.909 1.00 0.00 O ATOM 343 OE2 GLU A 22 -11.998 8.423 -7.237 1.00 0.00 O ATOM 0 H GLU A 22 -15.058 6.196 -3.954 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.346 6.230 -6.390 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -13.633 5.074 -5.613 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -14.167 5.215 -7.276 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.461 7.694 -6.927 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.812 7.513 -5.309 1.00 0.00 H new ATOM 350 N MET A 23 -16.009 3.166 -5.169 1.00 0.00 N ATOM 351 CA MET A 23 -16.407 1.770 -5.306 1.00 0.00 C ATOM 352 C MET A 23 -17.612 1.428 -4.423 1.00 0.00 C ATOM 353 O MET A 23 -17.951 0.251 -4.301 1.00 0.00 O ATOM 354 CB MET A 23 -15.225 0.809 -5.063 1.00 0.00 C ATOM 355 CG MET A 23 -13.804 1.386 -5.022 1.00 0.00 C ATOM 356 SD MET A 23 -12.475 0.166 -5.239 1.00 0.00 S ATOM 357 CE MET A 23 -12.385 0.134 -7.050 1.00 0.00 C ATOM 0 H MET A 23 -15.555 3.368 -4.278 1.00 0.00 H new ATOM 0 HA MET A 23 -16.723 1.631 -6.340 1.00 0.00 H new ATOM 0 HB2 MET A 23 -15.402 0.299 -4.116 1.00 0.00 H new ATOM 0 HB3 MET A 23 -15.251 0.049 -5.844 1.00 0.00 H new ATOM 0 HG2 MET A 23 -13.713 2.143 -5.801 1.00 0.00 H new ATOM 0 HG3 MET A 23 -13.660 1.892 -4.067 1.00 0.00 H new ATOM 0 HE1 MET A 23 -11.613 -0.569 -7.364 1.00 0.00 H new ATOM 0 HE2 MET A 23 -13.347 -0.178 -7.457 1.00 0.00 H new ATOM 0 HE3 MET A 23 -12.140 1.130 -7.420 1.00 0.00 H new ATOM 367 N THR A 24 -18.228 2.430 -3.782 1.00 0.00 N ATOM 368 CA THR A 24 -19.214 2.275 -2.716 1.00 0.00 C ATOM 369 C THR A 24 -18.821 1.089 -1.811 1.00 0.00 C ATOM 370 O THR A 24 -19.525 0.081 -1.693 1.00 0.00 O ATOM 371 CB THR A 24 -20.626 2.213 -3.321 1.00 0.00 C ATOM 372 OG1 THR A 24 -20.860 3.303 -4.200 1.00 0.00 O ATOM 373 CG2 THR A 24 -21.676 2.358 -2.225 1.00 0.00 C ATOM 0 H THR A 24 -18.042 3.408 -4.004 1.00 0.00 H new ATOM 0 HA THR A 24 -19.228 3.141 -2.054 1.00 0.00 H new ATOM 0 HB THR A 24 -20.695 1.258 -3.842 1.00 0.00 H new ATOM 0 HG1 THR A 24 -21.765 3.236 -4.571 1.00 0.00 H new ATOM 0 HG21 THR A 24 -22.672 2.312 -2.667 1.00 0.00 H new ATOM 0 HG22 THR A 24 -21.562 1.550 -1.503 1.00 0.00 H new ATOM 0 HG23 THR A 24 -21.546 3.316 -1.721 1.00 0.00 H new ATOM 381 N LEU A 25 -17.628 1.175 -1.228 1.00 0.00 N ATOM 382 CA LEU A 25 -17.073 0.140 -0.354 1.00 0.00 C ATOM 383 C LEU A 25 -17.797 0.192 0.994 1.00 0.00 C ATOM 384 O LEU A 25 -18.632 1.068 1.244 1.00 0.00 O ATOM 385 CB LEU A 25 -15.552 0.283 -0.140 1.00 0.00 C ATOM 386 CG LEU A 25 -14.668 0.363 -1.412 1.00 0.00 C ATOM 387 CD1 LEU A 25 -13.317 1.033 -1.120 1.00 0.00 C ATOM 388 CD2 LEU A 25 -14.414 -1.038 -1.991 1.00 0.00 C ATOM 0 H LEU A 25 -17.009 1.977 -1.350 1.00 0.00 H new ATOM 0 HA LEU A 25 -17.228 -0.823 -0.841 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -15.376 1.181 0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -15.212 -0.564 0.456 1.00 0.00 H new ATOM 0 HG LEU A 25 -15.212 0.967 -2.138 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -12.725 1.071 -2.034 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -13.485 2.046 -0.754 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.781 0.458 -0.365 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -13.792 -0.956 -2.882 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -13.905 -1.652 -1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -15.365 -1.501 -2.254 1.00 0.00 H new ATOM 400 N THR A 26 -17.474 -0.743 1.877 1.00 0.00 N ATOM 401 CA THR A 26 -17.958 -0.721 3.251 1.00 0.00 C ATOM 402 C THR A 26 -17.353 0.478 3.994 1.00 0.00 C ATOM 403 O THR A 26 -16.322 1.009 3.587 1.00 0.00 O ATOM 404 CB THR A 26 -17.685 -2.083 3.918 1.00 0.00 C ATOM 405 OG1 THR A 26 -16.442 -2.670 3.558 1.00 0.00 O ATOM 406 CG2 THR A 26 -18.767 -3.074 3.478 1.00 0.00 C ATOM 0 H THR A 26 -16.870 -1.537 1.662 1.00 0.00 H new ATOM 0 HA THR A 26 -19.038 -0.580 3.282 1.00 0.00 H new ATOM 0 HB THR A 26 -17.675 -1.889 4.991 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.339 -3.528 4.020 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.585 -4.042 3.944 1.00 0.00 H new ATOM 0 HG22 THR A 26 -19.746 -2.703 3.783 1.00 0.00 H new ATOM 0 HG23 THR A 26 -18.742 -3.182 2.394 1.00 0.00 H new ATOM 414 N ASP A 27 -17.979 0.918 5.087 1.00 0.00 N ATOM 415 CA ASP A 27 -17.509 2.107 5.803 1.00 0.00 C ATOM 416 C ASP A 27 -16.257 1.762 6.612 1.00 0.00 C ATOM 417 O ASP A 27 -15.262 2.485 6.594 1.00 0.00 O ATOM 418 CB ASP A 27 -18.616 2.675 6.701 1.00 0.00 C ATOM 419 CG ASP A 27 -18.385 4.163 6.954 1.00 0.00 C ATOM 420 OD1 ASP A 27 -17.554 4.533 7.808 1.00 0.00 O ATOM 421 OD2 ASP A 27 -19.050 4.966 6.258 1.00 0.00 O ATOM 0 H ASP A 27 -18.803 0.475 5.493 1.00 0.00 H new ATOM 0 HA ASP A 27 -17.250 2.879 5.079 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -19.588 2.526 6.230 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -18.636 2.137 7.649 1.00 0.00 H new ATOM 426 N ALA A 28 -16.277 0.585 7.245 1.00 0.00 N ATOM 427 CA ALA A 28 -15.241 0.028 8.108 1.00 0.00 C ATOM 428 C ALA A 28 -13.873 -0.198 7.437 1.00 0.00 C ATOM 429 O ALA A 28 -12.957 -0.670 8.108 1.00 0.00 O ATOM 430 CB ALA A 28 -15.769 -1.298 8.666 1.00 0.00 C ATOM 0 H ALA A 28 -17.075 -0.044 7.159 1.00 0.00 H new ATOM 0 HA ALA A 28 -15.046 0.767 8.885 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -15.017 -1.744 9.318 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -16.681 -1.116 9.235 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -15.985 -1.979 7.843 1.00 0.00 H new ATOM 436 N ILE A 29 -13.710 0.103 6.148 1.00 0.00 N ATOM 437 CA ILE A 29 -12.443 0.078 5.406 1.00 0.00 C ATOM 438 C ILE A 29 -11.394 0.969 6.073 1.00 0.00 C ATOM 439 O ILE A 29 -10.226 0.596 6.069 1.00 0.00 O ATOM 440 CB ILE A 29 -12.713 0.319 3.902 1.00 0.00 C ATOM 441 CG1 ILE A 29 -13.203 1.740 3.567 1.00 0.00 C ATOM 442 CG2 ILE A 29 -13.714 -0.736 3.385 1.00 0.00 C ATOM 443 CD1 ILE A 29 -11.998 2.641 3.329 1.00 0.00 C ATOM 0 H ILE A 29 -14.495 0.385 5.562 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.984 -0.910 5.446 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.754 0.218 3.394 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.838 1.720 2.681 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.809 2.131 4.384 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.905 -0.567 2.325 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -13.296 -1.733 3.524 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -14.649 -0.654 3.940 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -12.339 3.649 3.091 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.381 2.669 4.227 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.411 2.251 2.498 1.00 0.00 H new ATOM 455 N ASN A 30 -11.783 2.090 6.698 1.00 0.00 N ATOM 456 CA ASN A 30 -10.813 2.972 7.352 1.00 0.00 C ATOM 457 C ASN A 30 -10.120 2.269 8.523 1.00 0.00 C ATOM 458 O ASN A 30 -8.970 2.562 8.827 1.00 0.00 O ATOM 459 CB ASN A 30 -11.486 4.261 7.836 1.00 0.00 C ATOM 460 CG ASN A 30 -10.460 5.380 8.000 1.00 0.00 C ATOM 461 OD1 ASN A 30 -9.815 5.512 9.034 1.00 0.00 O ATOM 462 ND2 ASN A 30 -10.274 6.212 6.990 1.00 0.00 N ATOM 0 H ASN A 30 -12.752 2.402 6.763 1.00 0.00 H new ATOM 0 HA ASN A 30 -10.055 3.229 6.612 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -12.253 4.566 7.124 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -11.988 4.080 8.786 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -9.592 6.966 7.070 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -10.812 6.100 6.131 1.00 0.00 H new ATOM 469 N GLU A 31 -10.816 1.326 9.162 1.00 0.00 N ATOM 470 CA GLU A 31 -10.264 0.496 10.225 1.00 0.00 C ATOM 471 C GLU A 31 -9.583 -0.733 9.619 1.00 0.00 C ATOM 472 O GLU A 31 -8.400 -0.951 9.857 1.00 0.00 O ATOM 473 CB GLU A 31 -11.380 0.059 11.184 1.00 0.00 C ATOM 474 CG GLU A 31 -12.011 1.218 11.965 1.00 0.00 C ATOM 475 CD GLU A 31 -13.091 0.722 12.930 1.00 0.00 C ATOM 476 OE1 GLU A 31 -13.938 -0.118 12.540 1.00 0.00 O ATOM 477 OE2 GLU A 31 -13.133 1.189 14.095 1.00 0.00 O ATOM 0 H GLU A 31 -11.792 1.118 8.950 1.00 0.00 H new ATOM 0 HA GLU A 31 -9.527 1.074 10.783 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -12.158 -0.450 10.614 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -10.976 -0.666 11.890 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -11.238 1.746 12.523 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.446 1.934 11.268 1.00 0.00 H new ATOM 484 N ASP A 32 -10.330 -1.532 8.848 1.00 0.00 N ATOM 485 CA ASP A 32 -9.969 -2.867 8.345 1.00 0.00 C ATOM 486 C ASP A 32 -8.621 -2.858 7.633 1.00 0.00 C ATOM 487 O ASP A 32 -7.758 -3.694 7.905 1.00 0.00 O ATOM 488 CB ASP A 32 -11.072 -3.332 7.386 1.00 0.00 C ATOM 489 CG ASP A 32 -10.836 -4.711 6.759 1.00 0.00 C ATOM 490 OD1 ASP A 32 -11.335 -5.707 7.331 1.00 0.00 O ATOM 491 OD2 ASP A 32 -10.365 -4.772 5.600 1.00 0.00 O ATOM 0 H ASP A 32 -11.260 -1.248 8.539 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.879 -3.552 9.188 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -12.019 -3.350 7.925 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.174 -2.597 6.587 1.00 0.00 H new ATOM 496 N PHE A 33 -8.434 -1.858 6.772 1.00 0.00 N ATOM 497 CA PHE A 33 -7.230 -1.634 5.996 1.00 0.00 C ATOM 498 C PHE A 33 -6.006 -1.505 6.908 1.00 0.00 C ATOM 499 O PHE A 33 -5.012 -2.205 6.721 1.00 0.00 O ATOM 500 CB PHE A 33 -7.459 -0.370 5.157 1.00 0.00 C ATOM 501 CG PHE A 33 -6.284 -0.021 4.268 1.00 0.00 C ATOM 502 CD1 PHE A 33 -6.028 -0.777 3.112 1.00 0.00 C ATOM 503 CD2 PHE A 33 -5.421 1.037 4.614 1.00 0.00 C ATOM 504 CE1 PHE A 33 -4.931 -0.457 2.294 1.00 0.00 C ATOM 505 CE2 PHE A 33 -4.317 1.347 3.802 1.00 0.00 C ATOM 506 CZ PHE A 33 -4.067 0.593 2.644 1.00 0.00 C ATOM 0 H PHE A 33 -9.152 -1.156 6.594 1.00 0.00 H new ATOM 0 HA PHE A 33 -7.027 -2.481 5.340 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.346 -0.509 4.538 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.663 0.468 5.823 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.673 -1.603 2.852 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.609 1.613 5.508 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.752 -1.022 1.391 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.662 2.164 4.068 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.212 0.820 2.024 1.00 0.00 H new ATOM 516 N TYR A 34 -6.086 -0.625 7.909 1.00 0.00 N ATOM 517 CA TYR A 34 -5.003 -0.382 8.854 1.00 0.00 C ATOM 518 C TYR A 34 -4.839 -1.565 9.814 1.00 0.00 C ATOM 519 O TYR A 34 -3.736 -1.855 10.284 1.00 0.00 O ATOM 520 CB TYR A 34 -5.289 0.897 9.656 1.00 0.00 C ATOM 521 CG TYR A 34 -5.071 2.203 8.914 1.00 0.00 C ATOM 522 CD1 TYR A 34 -6.008 2.616 7.953 1.00 0.00 C ATOM 523 CD2 TYR A 34 -3.976 3.040 9.221 1.00 0.00 C ATOM 524 CE1 TYR A 34 -5.887 3.863 7.326 1.00 0.00 C ATOM 525 CE2 TYR A 34 -3.834 4.286 8.582 1.00 0.00 C ATOM 526 CZ TYR A 34 -4.810 4.711 7.653 1.00 0.00 C ATOM 527 OH TYR A 34 -4.760 5.964 7.135 1.00 0.00 O ATOM 0 H TYR A 34 -6.915 -0.057 8.085 1.00 0.00 H new ATOM 0 HA TYR A 34 -4.077 -0.262 8.291 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -6.323 0.864 10.000 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.657 0.895 10.544 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -6.830 1.966 7.695 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -3.244 2.723 9.949 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -6.617 4.174 6.594 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -2.983 4.914 8.801 1.00 0.00 H new ATOM 0 HH TYR A 34 -4.059 6.477 7.588 1.00 0.00 H new ATOM 537 N ASN A 35 -5.945 -2.219 10.166 1.00 0.00 N ATOM 538 CA ASN A 35 -5.995 -3.296 11.144 1.00 0.00 C ATOM 539 C ASN A 35 -5.242 -4.513 10.649 1.00 0.00 C ATOM 540 O ASN A 35 -4.521 -5.129 11.432 1.00 0.00 O ATOM 541 CB ASN A 35 -7.449 -3.679 11.467 1.00 0.00 C ATOM 542 CG ASN A 35 -8.051 -2.814 12.563 1.00 0.00 C ATOM 543 OD1 ASN A 35 -7.347 -2.083 13.260 1.00 0.00 O ATOM 544 ND2 ASN A 35 -9.351 -2.890 12.763 1.00 0.00 N ATOM 0 H ASN A 35 -6.857 -2.004 9.764 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.517 -2.935 12.055 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -8.054 -3.589 10.565 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -7.486 -4.725 11.773 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.786 -2.339 13.503 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.922 -3.500 12.178 1.00 0.00 H new ATOM 551 N PHE A 36 -5.373 -4.834 9.360 1.00 0.00 N ATOM 552 CA PHE A 36 -4.761 -5.977 8.692 1.00 0.00 C ATOM 553 C PHE A 36 -3.323 -6.230 9.157 1.00 0.00 C ATOM 554 O PHE A 36 -2.953 -7.360 9.495 1.00 0.00 O ATOM 555 CB PHE A 36 -4.808 -5.687 7.178 1.00 0.00 C ATOM 556 CG PHE A 36 -4.075 -6.627 6.233 1.00 0.00 C ATOM 557 CD1 PHE A 36 -4.075 -8.022 6.426 1.00 0.00 C ATOM 558 CD2 PHE A 36 -3.429 -6.090 5.101 1.00 0.00 C ATOM 559 CE1 PHE A 36 -3.450 -8.868 5.492 1.00 0.00 C ATOM 560 CE2 PHE A 36 -2.795 -6.937 4.175 1.00 0.00 C ATOM 561 CZ PHE A 36 -2.804 -8.327 4.368 1.00 0.00 C ATOM 0 H PHE A 36 -5.939 -4.272 8.724 1.00 0.00 H new ATOM 0 HA PHE A 36 -5.311 -6.885 8.940 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -5.856 -5.666 6.877 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -4.411 -4.684 7.021 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.557 -8.444 7.295 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.421 -5.021 4.944 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.467 -9.938 5.640 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.299 -6.517 3.312 1.00 0.00 H new ATOM 0 HZ PHE A 36 -2.317 -8.977 3.656 1.00 0.00 H new ATOM 571 N TRP A 37 -2.514 -5.170 9.177 1.00 0.00 N ATOM 572 CA TRP A 37 -1.090 -5.243 9.453 1.00 0.00 C ATOM 573 C TRP A 37 -0.783 -5.692 10.883 1.00 0.00 C ATOM 574 O TRP A 37 0.240 -6.347 11.082 1.00 0.00 O ATOM 575 CB TRP A 37 -0.464 -3.866 9.211 1.00 0.00 C ATOM 576 CG TRP A 37 -0.919 -3.111 8.000 1.00 0.00 C ATOM 577 CD1 TRP A 37 -1.150 -3.627 6.772 1.00 0.00 C ATOM 578 CD2 TRP A 37 -1.250 -1.693 7.905 1.00 0.00 C ATOM 579 NE1 TRP A 37 -1.610 -2.634 5.936 1.00 0.00 N ATOM 580 CE2 TRP A 37 -1.715 -1.423 6.587 1.00 0.00 C ATOM 581 CE3 TRP A 37 -1.214 -0.609 8.808 1.00 0.00 C ATOM 582 CZ2 TRP A 37 -2.159 -0.150 6.202 1.00 0.00 C ATOM 583 CZ3 TRP A 37 -1.631 0.677 8.421 1.00 0.00 C ATOM 584 CH2 TRP A 37 -2.122 0.908 7.124 1.00 0.00 C ATOM 0 H TRP A 37 -2.843 -4.221 8.998 1.00 0.00 H new ATOM 0 HA TRP A 37 -0.666 -5.991 8.783 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -0.658 -3.248 10.087 1.00 0.00 H new ATOM 0 HB3 TRP A 37 0.616 -3.993 9.144 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -0.997 -4.658 6.490 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -1.845 -2.777 4.954 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -0.859 -0.770 9.815 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -2.528 0.016 5.201 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.574 1.494 9.126 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -2.468 1.891 6.839 1.00 0.00 H new ATOM 595 N LYS A 38 -1.622 -5.320 11.859 1.00 0.00 N ATOM 596 CA LYS A 38 -1.396 -5.556 13.284 1.00 0.00 C ATOM 597 C LYS A 38 -1.428 -7.057 13.507 1.00 0.00 C ATOM 598 O LYS A 38 -2.487 -7.663 13.338 1.00 0.00 O ATOM 599 CB LYS A 38 -2.494 -4.913 14.140 1.00 0.00 C ATOM 600 CG LYS A 38 -2.713 -3.416 13.951 1.00 0.00 C ATOM 601 CD LYS A 38 -4.061 -3.059 14.588 1.00 0.00 C ATOM 602 CE LYS A 38 -4.252 -1.547 14.618 1.00 0.00 C ATOM 603 NZ LYS A 38 -4.407 -1.045 15.993 1.00 0.00 N ATOM 0 H LYS A 38 -2.499 -4.834 11.670 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.440 -5.119 13.573 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -3.433 -5.425 13.931 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -2.259 -5.094 15.189 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.907 -2.850 14.418 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.711 -3.160 12.892 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.871 -3.523 14.025 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.108 -3.458 15.601 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.396 -1.063 14.148 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.131 -1.280 14.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -4.535 -0.013 15.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.239 -1.489 16.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -3.557 -1.278 16.546 1.00 0.00 H new ATOM 617 N GLU A 39 -0.303 -7.662 13.869 1.00 0.00 N ATOM 618 CA GLU A 39 -0.135 -9.107 13.822 1.00 0.00 C ATOM 619 C GLU A 39 -1.253 -9.825 14.568 1.00 0.00 C ATOM 620 O GLU A 39 -1.608 -9.446 15.688 1.00 0.00 O ATOM 621 CB GLU A 39 1.234 -9.517 14.375 1.00 0.00 C ATOM 622 CG GLU A 39 2.338 -9.235 13.351 1.00 0.00 C ATOM 623 CD GLU A 39 2.653 -7.747 13.138 1.00 0.00 C ATOM 624 OE1 GLU A 39 2.440 -6.936 14.065 1.00 0.00 O ATOM 625 OE2 GLU A 39 3.099 -7.376 12.030 1.00 0.00 O ATOM 0 H GLU A 39 0.520 -7.162 14.204 1.00 0.00 H new ATOM 0 HA GLU A 39 -0.187 -9.408 12.776 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.438 -8.972 15.296 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.227 -10.577 14.627 1.00 0.00 H new ATOM 0 HG2 GLU A 39 3.248 -9.743 13.670 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.048 -9.671 12.395 1.00 0.00 H new ATOM 632 N GLY A 40 -1.801 -10.850 13.922 1.00 0.00 N ATOM 633 CA GLY A 40 -2.901 -11.670 14.403 1.00 0.00 C ATOM 634 C GLY A 40 -4.248 -11.332 13.757 1.00 0.00 C ATOM 635 O GLY A 40 -5.198 -12.099 13.897 1.00 0.00 O ATOM 0 H GLY A 40 -1.471 -11.143 13.003 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.670 -12.719 14.215 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.986 -11.551 15.483 1.00 0.00 H new ATOM 639 N TYR A 41 -4.378 -10.203 13.056 1.00 0.00 N ATOM 640 CA TYR A 41 -5.602 -9.837 12.350 1.00 0.00 C ATOM 641 C TYR A 41 -5.732 -10.687 11.088 1.00 0.00 C ATOM 642 O TYR A 41 -5.053 -10.432 10.090 1.00 0.00 O ATOM 643 CB TYR A 41 -5.610 -8.337 12.023 1.00 0.00 C ATOM 644 CG TYR A 41 -6.630 -7.534 12.811 1.00 0.00 C ATOM 645 CD1 TYR A 41 -8.004 -7.800 12.709 1.00 0.00 C ATOM 646 CD2 TYR A 41 -6.206 -6.482 13.631 1.00 0.00 C ATOM 647 CE1 TYR A 41 -8.931 -6.985 13.378 1.00 0.00 C ATOM 648 CE2 TYR A 41 -7.106 -5.710 14.375 1.00 0.00 C ATOM 649 CZ TYR A 41 -8.490 -5.961 14.247 1.00 0.00 C ATOM 650 OH TYR A 41 -9.406 -5.262 14.969 1.00 0.00 O ATOM 0 H TYR A 41 -3.631 -9.515 12.964 1.00 0.00 H new ATOM 0 HA TYR A 41 -6.463 -10.032 12.989 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -4.617 -7.930 12.214 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -5.807 -8.210 10.959 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -8.349 -8.633 12.115 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -5.151 -6.259 13.692 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -9.989 -7.142 13.228 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -6.748 -4.935 15.036 1.00 0.00 H new ATOM 0 HH TYR A 41 -8.947 -4.593 15.520 1.00 0.00 H new ATOM 660 N GLU A 42 -6.649 -11.658 11.087 1.00 0.00 N ATOM 661 CA GLU A 42 -7.040 -12.423 9.906 1.00 0.00 C ATOM 662 C GLU A 42 -7.956 -11.577 9.000 1.00 0.00 C ATOM 663 O GLU A 42 -8.982 -12.032 8.495 1.00 0.00 O ATOM 664 CB GLU A 42 -7.666 -13.759 10.362 1.00 0.00 C ATOM 665 CG GLU A 42 -7.736 -14.796 9.227 1.00 0.00 C ATOM 666 CD GLU A 42 -8.418 -16.100 9.650 1.00 0.00 C ATOM 667 OE1 GLU A 42 -9.620 -16.046 10.010 1.00 0.00 O ATOM 668 OE2 GLU A 42 -7.753 -17.163 9.577 1.00 0.00 O ATOM 0 H GLU A 42 -7.151 -11.939 11.929 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.172 -12.669 9.294 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.082 -14.167 11.187 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.670 -13.574 10.743 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.276 -14.367 8.383 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.726 -15.016 8.881 1.00 0.00 H new ATOM 675 N ILE A 43 -7.595 -10.315 8.782 1.00 0.00 N ATOM 676 CA ILE A 43 -8.193 -9.474 7.760 1.00 0.00 C ATOM 677 C ILE A 43 -7.736 -10.055 6.430 1.00 0.00 C ATOM 678 O ILE A 43 -6.561 -9.934 6.077 1.00 0.00 O ATOM 679 CB ILE A 43 -7.790 -8.005 7.930 1.00 0.00 C ATOM 680 CG1 ILE A 43 -8.273 -7.398 9.261 1.00 0.00 C ATOM 681 CG2 ILE A 43 -8.324 -7.161 6.773 1.00 0.00 C ATOM 682 CD1 ILE A 43 -9.596 -7.903 9.820 1.00 0.00 C ATOM 0 H ILE A 43 -6.868 -9.845 9.321 1.00 0.00 H new ATOM 0 HA ILE A 43 -9.281 -9.471 7.826 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.700 -7.991 7.935 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -7.501 -7.573 10.011 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -8.352 -6.319 9.130 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.027 -6.122 6.913 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.915 -7.532 5.833 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.412 -7.227 6.746 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -9.813 -7.392 10.758 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -10.393 -7.703 9.104 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.530 -8.976 9.999 1.00 0.00 H new ATOM 694 N LYS A 44 -8.629 -10.756 5.735 1.00 0.00 N ATOM 695 CA LYS A 44 -8.395 -11.305 4.411 1.00 0.00 C ATOM 696 C LYS A 44 -9.599 -11.083 3.489 1.00 0.00 C ATOM 697 O LYS A 44 -9.765 -11.829 2.522 1.00 0.00 O ATOM 698 CB LYS A 44 -8.012 -12.793 4.547 1.00 0.00 C ATOM 699 CG LYS A 44 -6.631 -13.037 5.179 1.00 0.00 C ATOM 700 CD LYS A 44 -5.483 -12.534 4.277 1.00 0.00 C ATOM 701 CE LYS A 44 -4.063 -12.801 4.789 1.00 0.00 C ATOM 702 NZ LYS A 44 -3.804 -14.222 5.078 1.00 0.00 N ATOM 0 H LYS A 44 -9.562 -10.961 6.093 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.565 -10.780 3.938 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.768 -13.297 5.149 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -8.033 -13.253 3.559 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -6.580 -12.533 6.144 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.502 -14.103 5.368 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.588 -12.998 3.296 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -5.602 -11.460 4.136 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.345 -12.452 4.047 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.895 -12.217 5.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.813 -14.342 5.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.432 -14.541 5.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.983 -14.788 4.224 1.00 0.00 H new ATOM 716 N ASN A 45 -10.472 -10.113 3.779 1.00 0.00 N ATOM 717 CA ASN A 45 -11.639 -9.891 2.926 1.00 0.00 C ATOM 718 C ASN A 45 -11.204 -9.287 1.590 1.00 0.00 C ATOM 719 O ASN A 45 -10.120 -8.724 1.433 1.00 0.00 O ATOM 720 CB ASN A 45 -12.741 -9.041 3.595 1.00 0.00 C ATOM 721 CG ASN A 45 -13.989 -8.977 2.715 1.00 0.00 C ATOM 722 OD1 ASN A 45 -14.466 -9.997 2.222 1.00 0.00 O ATOM 723 ND2 ASN A 45 -14.473 -7.811 2.341 1.00 0.00 N ATOM 0 H ASN A 45 -10.395 -9.484 4.578 1.00 0.00 H new ATOM 0 HA ASN A 45 -12.092 -10.867 2.750 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -12.996 -9.467 4.565 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -12.368 -8.033 3.778 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -15.228 -7.768 1.656 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -14.093 -6.951 2.736 1.00 0.00 H new ATOM 730 N ARG A 46 -12.090 -9.384 0.606 1.00 0.00 N ATOM 731 CA ARG A 46 -11.914 -8.884 -0.745 1.00 0.00 C ATOM 732 C ARG A 46 -11.643 -7.384 -0.717 1.00 0.00 C ATOM 733 O ARG A 46 -10.717 -6.912 -1.373 1.00 0.00 O ATOM 734 CB ARG A 46 -13.155 -9.180 -1.597 1.00 0.00 C ATOM 735 CG ARG A 46 -13.762 -10.570 -1.384 1.00 0.00 C ATOM 736 CD ARG A 46 -15.101 -10.627 -2.117 1.00 0.00 C ATOM 737 NE ARG A 46 -15.346 -11.969 -2.662 1.00 0.00 N ATOM 738 CZ ARG A 46 -16.463 -12.695 -2.640 1.00 0.00 C ATOM 739 NH1 ARG A 46 -17.564 -12.259 -2.041 1.00 0.00 N ATOM 740 NH2 ARG A 46 -16.456 -13.873 -3.252 1.00 0.00 N ATOM 0 H ARG A 46 -12.994 -9.837 0.739 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.059 -9.391 -1.192 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -13.915 -8.430 -1.380 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.891 -9.071 -2.649 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.089 -11.340 -1.762 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.903 -10.764 -0.321 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -15.906 -10.356 -1.434 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -15.109 -9.895 -2.925 1.00 0.00 H new ATOM 0 HE ARG A 46 -14.548 -12.407 -3.122 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -17.569 -11.348 -1.583 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -18.406 -12.835 -2.039 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -15.611 -14.199 -3.721 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.296 -14.452 -3.253 1.00 0.00 H new ATOM 754 N GLU A 47 -12.450 -6.631 0.035 1.00 0.00 N ATOM 755 CA GLU A 47 -12.372 -5.174 0.065 1.00 0.00 C ATOM 756 C GLU A 47 -11.054 -4.693 0.698 1.00 0.00 C ATOM 757 O GLU A 47 -10.566 -3.635 0.306 1.00 0.00 O ATOM 758 CB GLU A 47 -13.658 -4.571 0.684 1.00 0.00 C ATOM 759 CG GLU A 47 -14.803 -4.580 -0.358 1.00 0.00 C ATOM 760 CD GLU A 47 -16.202 -4.264 0.199 1.00 0.00 C ATOM 761 OE1 GLU A 47 -16.768 -5.181 0.845 1.00 0.00 O ATOM 762 OE2 GLU A 47 -16.771 -3.181 -0.096 1.00 0.00 O ATOM 0 H GLU A 47 -13.175 -7.018 0.639 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.337 -4.791 -0.955 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.951 -5.144 1.563 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.467 -3.551 1.018 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.568 -3.855 -1.138 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -14.832 -5.561 -0.833 1.00 0.00 H new ATOM 769 N THR A 48 -10.374 -5.473 1.548 1.00 0.00 N ATOM 770 CA THR A 48 -9.009 -5.156 1.980 1.00 0.00 C ATOM 771 C THR A 48 -8.085 -5.044 0.754 1.00 0.00 C ATOM 772 O THR A 48 -7.275 -4.121 0.652 1.00 0.00 O ATOM 773 CB THR A 48 -8.510 -6.222 2.971 1.00 0.00 C ATOM 774 OG1 THR A 48 -9.551 -6.635 3.847 1.00 0.00 O ATOM 775 CG2 THR A 48 -7.302 -5.707 3.764 1.00 0.00 C ATOM 0 H THR A 48 -10.750 -6.331 1.951 1.00 0.00 H new ATOM 0 HA THR A 48 -9.002 -4.195 2.494 1.00 0.00 H new ATOM 0 HB THR A 48 -8.193 -7.091 2.395 1.00 0.00 H new ATOM 0 HG1 THR A 48 -9.631 -5.995 4.584 1.00 0.00 H new ATOM 0 HG21 THR A 48 -6.967 -6.478 4.458 1.00 0.00 H new ATOM 0 HG22 THR A 48 -6.493 -5.462 3.076 1.00 0.00 H new ATOM 0 HG23 THR A 48 -7.587 -4.815 4.322 1.00 0.00 H new ATOM 783 N GLY A 49 -8.250 -5.945 -0.218 1.00 0.00 N ATOM 784 CA GLY A 49 -7.542 -5.899 -1.482 1.00 0.00 C ATOM 785 C GLY A 49 -7.989 -4.745 -2.358 1.00 0.00 C ATOM 786 O GLY A 49 -7.148 -4.125 -3.004 1.00 0.00 O ATOM 0 H GLY A 49 -8.890 -6.735 -0.139 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -6.472 -5.813 -1.292 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.697 -6.837 -2.016 1.00 0.00 H new ATOM 790 N CYS A 50 -9.292 -4.452 -2.407 1.00 0.00 N ATOM 791 CA CYS A 50 -9.807 -3.369 -3.230 1.00 0.00 C ATOM 792 C CYS A 50 -9.258 -2.026 -2.778 1.00 0.00 C ATOM 793 O CYS A 50 -9.084 -1.138 -3.614 1.00 0.00 O ATOM 794 CB CYS A 50 -11.328 -3.299 -3.179 1.00 0.00 C ATOM 795 SG CYS A 50 -12.230 -4.792 -3.690 1.00 0.00 S ATOM 0 H CYS A 50 -10.007 -4.956 -1.882 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.485 -3.580 -4.250 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -11.624 -3.055 -2.159 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -11.652 -2.472 -3.811 1.00 0.00 H new ATOM 800 N ALA A 51 -9.001 -1.863 -1.477 1.00 0.00 N ATOM 801 CA ALA A 51 -8.337 -0.680 -0.974 1.00 0.00 C ATOM 802 C ALA A 51 -6.963 -0.551 -1.619 1.00 0.00 C ATOM 803 O ALA A 51 -6.746 0.419 -2.334 1.00 0.00 O ATOM 804 CB ALA A 51 -8.278 -0.663 0.555 1.00 0.00 C ATOM 0 H ALA A 51 -9.248 -2.544 -0.759 1.00 0.00 H new ATOM 0 HA ALA A 51 -8.922 0.197 -1.251 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -7.771 0.242 0.890 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.290 -0.683 0.958 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -7.730 -1.537 0.908 1.00 0.00 H new ATOM 810 N ILE A 52 -6.064 -1.527 -1.441 1.00 0.00 N ATOM 811 CA ILE A 52 -4.720 -1.529 -2.033 1.00 0.00 C ATOM 812 C ILE A 52 -4.819 -1.255 -3.543 1.00 0.00 C ATOM 813 O ILE A 52 -4.195 -0.336 -4.068 1.00 0.00 O ATOM 814 CB ILE A 52 -4.005 -2.864 -1.711 1.00 0.00 C ATOM 815 CG1 ILE A 52 -3.877 -3.049 -0.182 1.00 0.00 C ATOM 816 CG2 ILE A 52 -2.614 -2.931 -2.368 1.00 0.00 C ATOM 817 CD1 ILE A 52 -3.247 -4.373 0.243 1.00 0.00 C ATOM 0 H ILE A 52 -6.253 -2.352 -0.872 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.116 -0.732 -1.600 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.611 -3.672 -2.121 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.281 -2.231 0.222 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.868 -2.972 0.265 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.140 -3.881 -2.121 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.718 -2.848 -3.450 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -1.997 -2.112 -1.999 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.196 -4.419 1.331 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.853 -5.200 -0.127 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.241 -4.447 -0.171 1.00 0.00 H new ATOM 829 N MET A 53 -5.649 -2.029 -4.235 1.00 0.00 N ATOM 830 CA MET A 53 -5.800 -2.006 -5.679 1.00 0.00 C ATOM 831 C MET A 53 -6.267 -0.635 -6.192 1.00 0.00 C ATOM 832 O MET A 53 -5.735 -0.157 -7.195 1.00 0.00 O ATOM 833 CB MET A 53 -6.756 -3.148 -6.035 1.00 0.00 C ATOM 834 CG MET A 53 -6.939 -3.375 -7.531 1.00 0.00 C ATOM 835 SD MET A 53 -8.318 -2.464 -8.281 1.00 0.00 S ATOM 836 CE MET A 53 -9.662 -3.001 -7.196 1.00 0.00 C ATOM 0 H MET A 53 -6.256 -2.714 -3.785 1.00 0.00 H new ATOM 0 HA MET A 53 -4.842 -2.158 -6.176 1.00 0.00 H new ATOM 0 HB2 MET A 53 -6.387 -4.069 -5.583 1.00 0.00 H new ATOM 0 HB3 MET A 53 -7.729 -2.942 -5.590 1.00 0.00 H new ATOM 0 HG2 MET A 53 -6.018 -3.095 -8.041 1.00 0.00 H new ATOM 0 HG3 MET A 53 -7.089 -4.440 -7.706 1.00 0.00 H new ATOM 0 HE1 MET A 53 -10.564 -3.163 -7.786 1.00 0.00 H new ATOM 0 HE2 MET A 53 -9.381 -3.931 -6.701 1.00 0.00 H new ATOM 0 HE3 MET A 53 -9.852 -2.234 -6.445 1.00 0.00 H new ATOM 846 N CYS A 54 -7.202 0.040 -5.513 1.00 0.00 N ATOM 847 CA CYS A 54 -7.572 1.418 -5.847 1.00 0.00 C ATOM 848 C CYS A 54 -6.471 2.392 -5.448 1.00 0.00 C ATOM 849 O CYS A 54 -6.188 3.357 -6.153 1.00 0.00 O ATOM 850 CB CYS A 54 -8.830 1.836 -5.092 1.00 0.00 C ATOM 851 SG CYS A 54 -9.277 3.582 -5.303 1.00 0.00 S ATOM 0 H CYS A 54 -7.718 -0.350 -4.724 1.00 0.00 H new ATOM 0 HA CYS A 54 -7.737 1.447 -6.924 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -9.663 1.216 -5.425 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -8.687 1.635 -4.030 1.00 0.00 H new ATOM 856 N LEU A 55 -5.873 2.196 -4.277 1.00 0.00 N ATOM 857 CA LEU A 55 -4.858 3.105 -3.773 1.00 0.00 C ATOM 858 C LEU A 55 -3.649 3.173 -4.704 1.00 0.00 C ATOM 859 O LEU A 55 -3.023 4.229 -4.791 1.00 0.00 O ATOM 860 CB LEU A 55 -4.445 2.691 -2.353 1.00 0.00 C ATOM 861 CG LEU A 55 -5.457 3.162 -1.303 1.00 0.00 C ATOM 862 CD1 LEU A 55 -5.298 2.374 -0.005 1.00 0.00 C ATOM 863 CD2 LEU A 55 -5.235 4.654 -1.046 1.00 0.00 C ATOM 0 H LEU A 55 -6.078 1.411 -3.659 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.284 4.107 -3.736 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.350 1.606 -2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.464 3.108 -2.124 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.468 2.993 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.027 2.725 0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.462 1.314 -0.200 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -4.292 2.519 0.388 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.948 5.005 -0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -4.220 4.813 -0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.378 5.208 -1.974 1.00 0.00 H new ATOM 875 N SER A 56 -3.395 2.110 -5.474 1.00 0.00 N ATOM 876 CA SER A 56 -2.394 2.080 -6.533 1.00 0.00 C ATOM 877 C SER A 56 -2.577 3.184 -7.578 1.00 0.00 C ATOM 878 O SER A 56 -1.649 3.504 -8.317 1.00 0.00 O ATOM 879 CB SER A 56 -2.331 0.679 -7.153 1.00 0.00 C ATOM 880 OG SER A 56 -3.355 0.475 -8.116 1.00 0.00 O ATOM 0 H SER A 56 -3.895 1.227 -5.371 1.00 0.00 H new ATOM 0 HA SER A 56 -1.428 2.297 -6.078 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.358 0.534 -7.623 1.00 0.00 H new ATOM 0 HB3 SER A 56 -2.420 -0.070 -6.366 1.00 0.00 H new ATOM 0 HG SER A 56 -4.227 0.467 -7.669 1.00 0.00 H new ATOM 886 N THR A 57 -3.764 3.789 -7.637 1.00 0.00 N ATOM 887 CA THR A 57 -4.130 4.769 -8.643 1.00 0.00 C ATOM 888 C THR A 57 -4.658 6.037 -7.948 1.00 0.00 C ATOM 889 O THR A 57 -5.450 6.799 -8.498 1.00 0.00 O ATOM 890 CB THR A 57 -4.992 4.060 -9.712 1.00 0.00 C ATOM 891 OG1 THR A 57 -5.117 4.787 -10.917 1.00 0.00 O ATOM 892 CG2 THR A 57 -6.374 3.637 -9.224 1.00 0.00 C ATOM 0 H THR A 57 -4.511 3.602 -6.968 1.00 0.00 H new ATOM 0 HA THR A 57 -3.298 5.167 -9.224 1.00 0.00 H new ATOM 0 HB THR A 57 -4.423 3.153 -9.919 1.00 0.00 H new ATOM 0 HG1 THR A 57 -5.672 4.282 -11.548 1.00 0.00 H new ATOM 0 HG21 THR A 57 -6.912 3.148 -10.036 1.00 0.00 H new ATOM 0 HG22 THR A 57 -6.269 2.945 -8.389 1.00 0.00 H new ATOM 0 HG23 THR A 57 -6.930 4.516 -8.898 1.00 0.00 H new ATOM 900 N LYS A 58 -4.220 6.256 -6.701 1.00 0.00 N ATOM 901 CA LYS A 58 -4.493 7.419 -5.862 1.00 0.00 C ATOM 902 C LYS A 58 -3.177 8.021 -5.358 1.00 0.00 C ATOM 903 O LYS A 58 -3.183 8.705 -4.334 1.00 0.00 O ATOM 904 CB LYS A 58 -5.423 6.996 -4.707 1.00 0.00 C ATOM 905 CG LYS A 58 -6.894 6.847 -5.126 1.00 0.00 C ATOM 906 CD LYS A 58 -7.623 8.181 -4.978 1.00 0.00 C ATOM 907 CE LYS A 58 -9.085 8.158 -5.437 1.00 0.00 C ATOM 908 NZ LYS A 58 -9.286 8.758 -6.775 1.00 0.00 N ATOM 0 H LYS A 58 -3.626 5.577 -6.225 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.999 8.194 -6.437 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.073 6.049 -4.298 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.354 7.734 -3.907 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.952 6.505 -6.159 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.380 6.089 -4.512 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.588 8.486 -3.932 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.087 8.939 -5.549 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.438 7.127 -5.452 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.696 8.694 -4.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.304 8.852 -6.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -8.840 9.697 -6.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.855 8.147 -7.498 1.00 0.00 H new ATOM 922 N LEU A 59 -2.042 7.777 -6.023 1.00 0.00 N ATOM 923 CA LEU A 59 -0.725 8.232 -5.559 1.00 0.00 C ATOM 924 C LEU A 59 -0.706 9.755 -5.375 1.00 0.00 C ATOM 925 O LEU A 59 -0.087 10.252 -4.440 1.00 0.00 O ATOM 926 CB LEU A 59 0.382 7.793 -6.544 1.00 0.00 C ATOM 927 CG LEU A 59 0.370 6.310 -6.979 1.00 0.00 C ATOM 928 CD1 LEU A 59 1.486 6.046 -7.998 1.00 0.00 C ATOM 929 CD2 LEU A 59 0.513 5.326 -5.816 1.00 0.00 C ATOM 0 H LEU A 59 -2.010 7.257 -6.900 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.530 7.769 -4.592 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.308 8.411 -7.438 1.00 0.00 H new ATOM 0 HB3 LEU A 59 1.349 8.007 -6.088 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.610 6.139 -7.425 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.466 4.998 -8.296 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.334 6.675 -8.875 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.452 6.277 -7.548 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.496 4.306 -6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.457 5.505 -5.302 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.312 5.465 -5.118 1.00 0.00 H new ATOM 941 N ASN A 60 -1.462 10.489 -6.195 1.00 0.00 N ATOM 942 CA ASN A 60 -1.702 11.929 -6.108 1.00 0.00 C ATOM 943 C ASN A 60 -2.308 12.347 -4.763 1.00 0.00 C ATOM 944 O ASN A 60 -1.942 13.365 -4.172 1.00 0.00 O ATOM 945 CB ASN A 60 -2.637 12.340 -7.264 1.00 0.00 C ATOM 946 CG ASN A 60 -4.044 11.733 -7.163 1.00 0.00 C ATOM 947 OD1 ASN A 60 -4.204 10.563 -6.823 1.00 0.00 O ATOM 948 ND2 ASN A 60 -5.088 12.507 -7.387 1.00 0.00 N ATOM 0 H ASN A 60 -1.952 10.067 -6.984 1.00 0.00 H new ATOM 0 HA ASN A 60 -0.742 12.440 -6.186 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.720 13.427 -7.284 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -2.187 12.037 -8.209 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -6.031 12.135 -7.278 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -4.952 13.478 -7.669 1.00 0.00 H new ATOM 955 N MET A 61 -3.256 11.561 -4.265 1.00 0.00 N ATOM 956 CA MET A 61 -3.952 11.822 -3.021 1.00 0.00 C ATOM 957 C MET A 61 -3.023 11.559 -1.840 1.00 0.00 C ATOM 958 O MET A 61 -3.066 12.305 -0.861 1.00 0.00 O ATOM 959 CB MET A 61 -5.204 10.941 -2.958 1.00 0.00 C ATOM 960 CG MET A 61 -6.230 11.315 -4.028 1.00 0.00 C ATOM 961 SD MET A 61 -6.953 12.964 -3.857 1.00 0.00 S ATOM 962 CE MET A 61 -7.753 12.759 -2.240 1.00 0.00 C ATOM 0 H MET A 61 -3.565 10.707 -4.729 1.00 0.00 H new ATOM 0 HA MET A 61 -4.259 12.867 -2.972 1.00 0.00 H new ATOM 0 HB2 MET A 61 -4.917 9.897 -3.082 1.00 0.00 H new ATOM 0 HB3 MET A 61 -5.660 11.032 -1.972 1.00 0.00 H new ATOM 0 HG2 MET A 61 -5.754 11.244 -5.006 1.00 0.00 H new ATOM 0 HG3 MET A 61 -7.034 10.579 -4.011 1.00 0.00 H new ATOM 0 HE1 MET A 61 -8.608 13.431 -2.169 1.00 0.00 H new ATOM 0 HE2 MET A 61 -8.091 11.729 -2.129 1.00 0.00 H new ATOM 0 HE3 MET A 61 -7.041 12.994 -1.449 1.00 0.00 H new ATOM 972 N LEU A 62 -2.184 10.526 -1.917 1.00 0.00 N ATOM 973 CA LEU A 62 -1.236 10.148 -0.879 1.00 0.00 C ATOM 974 C LEU A 62 -0.103 11.151 -0.791 1.00 0.00 C ATOM 975 O LEU A 62 0.276 11.556 0.311 1.00 0.00 O ATOM 976 CB LEU A 62 -0.686 8.750 -1.222 1.00 0.00 C ATOM 977 CG LEU A 62 -1.773 7.686 -1.385 1.00 0.00 C ATOM 978 CD1 LEU A 62 -1.205 6.401 -1.959 1.00 0.00 C ATOM 979 CD2 LEU A 62 -2.454 7.398 -0.053 1.00 0.00 C ATOM 0 H LEU A 62 -2.147 9.912 -2.731 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.736 10.132 0.089 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.109 8.812 -2.145 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.002 8.437 -0.437 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.512 8.080 -2.083 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.002 5.665 -2.063 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.767 6.602 -2.937 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.437 6.012 -1.290 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.223 6.638 -0.194 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.715 7.038 0.663 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.912 8.311 0.327 1.00 0.00 H new ATOM 991 N ASP A 63 0.438 11.527 -1.945 1.00 0.00 N ATOM 992 CA ASP A 63 1.704 12.242 -2.045 1.00 0.00 C ATOM 993 C ASP A 63 1.501 13.576 -2.767 1.00 0.00 C ATOM 994 O ASP A 63 1.681 13.658 -3.985 1.00 0.00 O ATOM 995 CB ASP A 63 2.781 11.347 -2.677 1.00 0.00 C ATOM 996 CG ASP A 63 4.187 11.853 -2.348 1.00 0.00 C ATOM 997 OD1 ASP A 63 4.517 13.026 -2.631 1.00 0.00 O ATOM 998 OD2 ASP A 63 4.968 11.085 -1.751 1.00 0.00 O ATOM 0 H ASP A 63 0.003 11.341 -2.849 1.00 0.00 H new ATOM 0 HA ASP A 63 2.071 12.488 -1.049 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.666 10.325 -2.315 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.646 11.320 -3.758 1.00 0.00 H new ATOM 1003 N PRO A 64 1.082 14.634 -2.047 1.00 0.00 N ATOM 1004 CA PRO A 64 0.845 15.945 -2.642 1.00 0.00 C ATOM 1005 C PRO A 64 2.132 16.588 -3.148 1.00 0.00 C ATOM 1006 O PRO A 64 2.096 17.383 -4.084 1.00 0.00 O ATOM 1007 CB PRO A 64 0.238 16.804 -1.531 1.00 0.00 C ATOM 1008 CG PRO A 64 0.730 16.141 -0.246 1.00 0.00 C ATOM 1009 CD PRO A 64 0.779 14.665 -0.622 1.00 0.00 C ATOM 0 HA PRO A 64 0.188 15.854 -3.507 1.00 0.00 H new ATOM 0 HB2 PRO A 64 0.571 17.840 -1.599 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -0.851 16.815 -1.584 1.00 0.00 H new ATOM 0 HG2 PRO A 64 1.710 16.515 0.052 1.00 0.00 H new ATOM 0 HG3 PRO A 64 0.052 16.323 0.588 1.00 0.00 H new ATOM 0 HD2 PRO A 64 1.542 14.139 -0.047 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -0.172 14.175 -0.413 1.00 0.00 H new ATOM 1017 N GLU A 65 3.275 16.281 -2.533 1.00 0.00 N ATOM 1018 CA GLU A 65 4.551 16.792 -3.009 1.00 0.00 C ATOM 1019 C GLU A 65 4.975 16.115 -4.320 1.00 0.00 C ATOM 1020 O GLU A 65 5.814 16.662 -5.035 1.00 0.00 O ATOM 1021 CB GLU A 65 5.623 16.692 -1.922 1.00 0.00 C ATOM 1022 CG GLU A 65 5.270 17.588 -0.724 1.00 0.00 C ATOM 1023 CD GLU A 65 6.422 17.731 0.271 1.00 0.00 C ATOM 1024 OE1 GLU A 65 7.195 16.759 0.445 1.00 0.00 O ATOM 1025 OE2 GLU A 65 6.516 18.816 0.887 1.00 0.00 O ATOM 0 H GLU A 65 3.338 15.684 -1.709 1.00 0.00 H new ATOM 0 HA GLU A 65 4.428 17.851 -3.236 1.00 0.00 H new ATOM 0 HB2 GLU A 65 5.718 15.657 -1.593 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.590 16.987 -2.330 1.00 0.00 H new ATOM 0 HG2 GLU A 65 4.985 18.576 -1.087 1.00 0.00 H new ATOM 0 HG3 GLU A 65 4.402 17.174 -0.210 1.00 0.00 H new ATOM 1032 N GLY A 66 4.376 14.979 -4.681 1.00 0.00 N ATOM 1033 CA GLY A 66 4.649 14.261 -5.912 1.00 0.00 C ATOM 1034 C GLY A 66 6.010 13.585 -5.904 1.00 0.00 C ATOM 1035 O GLY A 66 6.729 13.653 -6.894 1.00 0.00 O ATOM 0 H GLY A 66 3.668 14.526 -4.103 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.875 13.510 -6.069 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.596 14.954 -6.752 1.00 0.00 H new ATOM 1039 N ASN A 67 6.375 12.964 -4.782 1.00 0.00 N ATOM 1040 CA ASN A 67 7.582 12.161 -4.659 1.00 0.00 C ATOM 1041 C ASN A 67 7.336 10.737 -5.154 1.00 0.00 C ATOM 1042 O ASN A 67 8.181 10.173 -5.844 1.00 0.00 O ATOM 1043 CB ASN A 67 8.054 12.114 -3.207 1.00 0.00 C ATOM 1044 CG ASN A 67 8.693 13.422 -2.790 1.00 0.00 C ATOM 1045 OD1 ASN A 67 9.899 13.605 -2.835 1.00 0.00 O ATOM 1046 ND2 ASN A 67 7.876 14.383 -2.416 1.00 0.00 N ATOM 0 H ASN A 67 5.828 13.008 -3.922 1.00 0.00 H new ATOM 0 HA ASN A 67 8.354 12.626 -5.272 1.00 0.00 H new ATOM 0 HB2 ASN A 67 7.208 11.897 -2.555 1.00 0.00 H new ATOM 0 HB3 ASN A 67 8.770 11.302 -3.082 1.00 0.00 H new ATOM 0 HD21 ASN A 67 8.248 15.297 -2.158 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.871 14.214 -2.384 1.00 0.00 H new ATOM 1053 N LEU A 68 6.205 10.147 -4.752 1.00 0.00 N ATOM 1054 CA LEU A 68 5.753 8.809 -5.128 1.00 0.00 C ATOM 1055 C LEU A 68 5.287 8.823 -6.587 1.00 0.00 C ATOM 1056 O LEU A 68 4.522 9.716 -6.965 1.00 0.00 O ATOM 1057 CB LEU A 68 4.607 8.434 -4.167 1.00 0.00 C ATOM 1058 CG LEU A 68 3.977 7.038 -4.335 1.00 0.00 C ATOM 1059 CD1 LEU A 68 4.981 5.899 -4.133 1.00 0.00 C ATOM 1060 CD2 LEU A 68 2.858 6.898 -3.291 1.00 0.00 C ATOM 0 H LEU A 68 5.550 10.615 -4.125 1.00 0.00 H new ATOM 0 HA LEU A 68 6.552 8.072 -5.050 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.981 8.515 -3.147 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.817 9.177 -4.277 1.00 0.00 H new ATOM 0 HG LEU A 68 3.604 6.959 -5.356 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.477 4.942 -4.264 1.00 0.00 H new ATOM 0 HD12 LEU A 68 5.785 5.989 -4.864 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.397 5.955 -3.127 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.392 5.917 -3.386 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.278 7.005 -2.291 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.109 7.673 -3.455 1.00 0.00 H new ATOM 1072 N HIS A 69 5.705 7.840 -7.389 1.00 0.00 N ATOM 1073 CA HIS A 69 5.362 7.693 -8.804 1.00 0.00 C ATOM 1074 C HIS A 69 5.109 6.225 -9.125 1.00 0.00 C ATOM 1075 O HIS A 69 5.436 5.344 -8.334 1.00 0.00 O ATOM 1076 CB HIS A 69 6.519 8.195 -9.668 1.00 0.00 C ATOM 1077 CG HIS A 69 6.754 9.670 -9.563 1.00 0.00 C ATOM 1078 ND1 HIS A 69 5.939 10.687 -10.012 1.00 0.00 N ATOM 1079 CD2 HIS A 69 7.830 10.232 -8.942 1.00 0.00 C ATOM 1080 CE1 HIS A 69 6.532 11.845 -9.675 1.00 0.00 C ATOM 1081 NE2 HIS A 69 7.688 11.615 -9.036 1.00 0.00 N ATOM 0 H HIS A 69 6.317 7.095 -7.055 1.00 0.00 H new ATOM 0 HA HIS A 69 4.464 8.275 -9.012 1.00 0.00 H new ATOM 0 HB2 HIS A 69 7.430 7.670 -9.380 1.00 0.00 H new ATOM 0 HB3 HIS A 69 6.320 7.941 -10.709 1.00 0.00 H new ATOM 0 HD2 HIS A 69 8.642 9.703 -8.465 1.00 0.00 H new ATOM 0 HE1 HIS A 69 6.133 12.825 -9.889 1.00 0.00 H new ATOM 0 HE2 HIS A 69 8.339 12.318 -8.686 1.00 0.00 H new ATOM 1089 N HIS A 70 4.551 5.969 -10.306 1.00 0.00 N ATOM 1090 CA HIS A 70 4.166 4.642 -10.759 1.00 0.00 C ATOM 1091 C HIS A 70 5.422 3.888 -11.202 1.00 0.00 C ATOM 1092 O HIS A 70 6.165 4.387 -12.053 1.00 0.00 O ATOM 1093 CB HIS A 70 3.153 4.788 -11.903 1.00 0.00 C ATOM 1094 CG HIS A 70 2.480 3.499 -12.295 1.00 0.00 C ATOM 1095 ND1 HIS A 70 3.074 2.395 -12.873 1.00 0.00 N ATOM 1096 CD2 HIS A 70 1.140 3.242 -12.179 1.00 0.00 C ATOM 1097 CE1 HIS A 70 2.109 1.479 -13.062 1.00 0.00 C ATOM 1098 NE2 HIS A 70 0.912 1.972 -12.709 1.00 0.00 N ATOM 0 H HIS A 70 4.351 6.700 -10.989 1.00 0.00 H new ATOM 0 HA HIS A 70 3.695 4.072 -9.958 1.00 0.00 H new ATOM 0 HB2 HIS A 70 2.390 5.509 -11.609 1.00 0.00 H new ATOM 0 HB3 HIS A 70 3.662 5.200 -12.775 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.397 3.901 -11.755 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.274 0.483 -13.445 1.00 0.00 H new ATOM 0 HE2 HIS A 70 0.009 1.508 -12.809 1.00 0.00 H new ATOM 1106 N GLY A 71 5.655 2.697 -10.650 1.00 0.00 N ATOM 1107 CA GLY A 71 6.831 1.862 -10.879 1.00 0.00 C ATOM 1108 C GLY A 71 8.118 2.477 -10.341 1.00 0.00 C ATOM 1109 O GLY A 71 9.200 1.980 -10.658 1.00 0.00 O ATOM 0 H GLY A 71 4.996 2.269 -10.000 1.00 0.00 H new ATOM 0 HA2 GLY A 71 6.676 0.891 -10.409 1.00 0.00 H new ATOM 0 HA3 GLY A 71 6.940 1.685 -11.949 1.00 0.00 H new ATOM 1113 N ASN A 72 8.024 3.589 -9.601 1.00 0.00 N ATOM 1114 CA ASN A 72 9.169 4.418 -9.278 1.00 0.00 C ATOM 1115 C ASN A 72 8.989 5.060 -7.909 1.00 0.00 C ATOM 1116 O ASN A 72 8.760 6.264 -7.787 1.00 0.00 O ATOM 1117 CB ASN A 72 9.382 5.483 -10.363 1.00 0.00 C ATOM 1118 CG ASN A 72 10.763 6.099 -10.222 1.00 0.00 C ATOM 1119 OD1 ASN A 72 11.617 5.639 -9.466 1.00 0.00 O ATOM 1120 ND2 ASN A 72 11.059 7.132 -10.982 1.00 0.00 N ATOM 0 H ASN A 72 7.145 3.931 -9.213 1.00 0.00 H new ATOM 0 HA ASN A 72 10.059 3.789 -9.243 1.00 0.00 H new ATOM 0 HB2 ASN A 72 9.274 5.035 -11.351 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.619 6.257 -10.279 1.00 0.00 H new ATOM 0 HD21 ASN A 72 11.991 7.545 -10.941 1.00 0.00 H new ATOM 0 HD22 ASN A 72 10.357 7.520 -11.612 1.00 0.00 H new ATOM 1127 N ALA A 73 9.062 4.249 -6.862 1.00 0.00 N ATOM 1128 CA ALA A 73 8.852 4.712 -5.504 1.00 0.00 C ATOM 1129 C ALA A 73 10.136 5.255 -4.865 1.00 0.00 C ATOM 1130 O ALA A 73 10.098 5.628 -3.697 1.00 0.00 O ATOM 1131 CB ALA A 73 8.284 3.554 -4.684 1.00 0.00 C ATOM 0 H ALA A 73 9.269 3.253 -6.934 1.00 0.00 H new ATOM 0 HA ALA A 73 8.149 5.545 -5.523 1.00 0.00 H new ATOM 0 HB1 ALA A 73 8.119 3.882 -3.658 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.338 3.230 -5.118 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.990 2.723 -4.690 1.00 0.00 H new ATOM 1137 N MET A 74 11.275 5.304 -5.570 1.00 0.00 N ATOM 1138 CA MET A 74 12.588 5.360 -4.943 1.00 0.00 C ATOM 1139 C MET A 74 12.794 6.694 -4.245 1.00 0.00 C ATOM 1140 O MET A 74 13.356 6.719 -3.159 1.00 0.00 O ATOM 1141 CB MET A 74 13.709 5.134 -5.967 1.00 0.00 C ATOM 1142 CG MET A 74 13.957 3.654 -6.270 1.00 0.00 C ATOM 1143 SD MET A 74 15.480 3.371 -7.219 1.00 0.00 S ATOM 1144 CE MET A 74 15.453 1.559 -7.316 1.00 0.00 C ATOM 0 H MET A 74 11.304 5.306 -6.590 1.00 0.00 H new ATOM 0 HA MET A 74 12.630 4.559 -4.205 1.00 0.00 H new ATOM 0 HB2 MET A 74 13.457 5.651 -6.893 1.00 0.00 H new ATOM 0 HB3 MET A 74 14.630 5.581 -5.593 1.00 0.00 H new ATOM 0 HG2 MET A 74 14.011 3.101 -5.332 1.00 0.00 H new ATOM 0 HG3 MET A 74 13.109 3.255 -6.827 1.00 0.00 H new ATOM 0 HE1 MET A 74 16.409 1.162 -6.975 1.00 0.00 H new ATOM 0 HE2 MET A 74 14.654 1.173 -6.684 1.00 0.00 H new ATOM 0 HE3 MET A 74 15.280 1.252 -8.348 1.00 0.00 H new ATOM 1154 N GLU A 75 12.332 7.794 -4.832 1.00 0.00 N ATOM 1155 CA GLU A 75 12.439 9.116 -4.213 1.00 0.00 C ATOM 1156 C GLU A 75 11.596 9.149 -2.931 1.00 0.00 C ATOM 1157 O GLU A 75 12.079 9.527 -1.866 1.00 0.00 O ATOM 1158 CB GLU A 75 11.997 10.195 -5.217 1.00 0.00 C ATOM 1159 CG GLU A 75 13.076 10.586 -6.249 1.00 0.00 C ATOM 1160 CD GLU A 75 14.012 11.720 -5.801 1.00 0.00 C ATOM 1161 OE1 GLU A 75 14.572 11.677 -4.685 1.00 0.00 O ATOM 1162 OE2 GLU A 75 14.302 12.633 -6.609 1.00 0.00 O ATOM 0 H GLU A 75 11.875 7.797 -5.744 1.00 0.00 H new ATOM 0 HA GLU A 75 13.474 9.321 -3.940 1.00 0.00 H new ATOM 0 HB2 GLU A 75 11.115 9.839 -5.749 1.00 0.00 H new ATOM 0 HB3 GLU A 75 11.699 11.087 -4.666 1.00 0.00 H new ATOM 0 HG2 GLU A 75 13.677 9.706 -6.477 1.00 0.00 H new ATOM 0 HG3 GLU A 75 12.583 10.884 -7.174 1.00 0.00 H new ATOM 1169 N PHE A 76 10.345 8.686 -2.999 1.00 0.00 N ATOM 1170 CA PHE A 76 9.480 8.551 -1.838 1.00 0.00 C ATOM 1171 C PHE A 76 10.107 7.639 -0.784 1.00 0.00 C ATOM 1172 O PHE A 76 9.995 7.940 0.402 1.00 0.00 O ATOM 1173 CB PHE A 76 8.108 8.053 -2.318 1.00 0.00 C ATOM 1174 CG PHE A 76 7.241 7.427 -1.249 1.00 0.00 C ATOM 1175 CD1 PHE A 76 6.500 8.248 -0.383 1.00 0.00 C ATOM 1176 CD2 PHE A 76 7.199 6.025 -1.109 1.00 0.00 C ATOM 1177 CE1 PHE A 76 5.740 7.666 0.647 1.00 0.00 C ATOM 1178 CE2 PHE A 76 6.391 5.447 -0.112 1.00 0.00 C ATOM 1179 CZ PHE A 76 5.677 6.272 0.772 1.00 0.00 C ATOM 0 H PHE A 76 9.906 8.393 -3.872 1.00 0.00 H new ATOM 0 HA PHE A 76 9.349 9.516 -1.347 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.568 8.892 -2.756 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.262 7.323 -3.112 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.514 9.321 -0.508 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.784 5.397 -1.764 1.00 0.00 H new ATOM 0 HE1 PHE A 76 5.204 8.295 1.343 1.00 0.00 H new ATOM 0 HE2 PHE A 76 6.320 4.373 -0.027 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.076 5.829 1.553 1.00 0.00 H new ATOM 1189 N ALA A 77 10.769 6.558 -1.186 1.00 0.00 N ATOM 1190 CA ALA A 77 11.404 5.618 -0.285 1.00 0.00 C ATOM 1191 C ALA A 77 12.678 6.209 0.335 1.00 0.00 C ATOM 1192 O ALA A 77 12.920 6.016 1.531 1.00 0.00 O ATOM 1193 CB ALA A 77 11.662 4.311 -1.034 1.00 0.00 C ATOM 0 H ALA A 77 10.878 6.311 -2.170 1.00 0.00 H new ATOM 0 HA ALA A 77 10.741 5.406 0.554 1.00 0.00 H new ATOM 0 HB1 ALA A 77 12.140 3.596 -0.364 1.00 0.00 H new ATOM 0 HB2 ALA A 77 10.716 3.901 -1.387 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.314 4.503 -1.886 1.00 0.00 H new ATOM 1199 N LYS A 78 13.450 6.999 -0.424 1.00 0.00 N ATOM 1200 CA LYS A 78 14.611 7.737 0.073 1.00 0.00 C ATOM 1201 C LYS A 78 14.208 8.657 1.211 1.00 0.00 C ATOM 1202 O LYS A 78 14.952 8.741 2.191 1.00 0.00 O ATOM 1203 CB LYS A 78 15.301 8.524 -1.057 1.00 0.00 C ATOM 1204 CG LYS A 78 16.170 7.630 -1.962 1.00 0.00 C ATOM 1205 CD LYS A 78 17.645 8.051 -1.922 1.00 0.00 C ATOM 1206 CE LYS A 78 18.533 6.903 -2.405 1.00 0.00 C ATOM 1207 NZ LYS A 78 19.961 7.212 -2.206 1.00 0.00 N ATOM 0 H LYS A 78 13.279 7.143 -1.419 1.00 0.00 H new ATOM 0 HA LYS A 78 15.332 7.014 0.455 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.543 9.020 -1.664 1.00 0.00 H new ATOM 0 HB3 LYS A 78 15.923 9.306 -0.622 1.00 0.00 H new ATOM 0 HG2 LYS A 78 16.079 6.591 -1.644 1.00 0.00 H new ATOM 0 HG3 LYS A 78 15.803 7.683 -2.987 1.00 0.00 H new ATOM 0 HD2 LYS A 78 17.798 8.928 -2.550 1.00 0.00 H new ATOM 0 HD3 LYS A 78 17.923 8.334 -0.907 1.00 0.00 H new ATOM 0 HE2 LYS A 78 18.277 5.991 -1.866 1.00 0.00 H new ATOM 0 HE3 LYS A 78 18.343 6.713 -3.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 20.539 6.415 -2.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 20.208 8.069 -2.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 20.144 7.369 -1.194 1.00 0.00 H new ATOM 1221 N LYS A 79 13.012 9.254 1.167 1.00 0.00 N ATOM 1222 CA LYS A 79 12.524 10.059 2.285 1.00 0.00 C ATOM 1223 C LYS A 79 12.508 9.292 3.607 1.00 0.00 C ATOM 1224 O LYS A 79 12.623 9.918 4.659 1.00 0.00 O ATOM 1225 CB LYS A 79 11.134 10.628 2.017 1.00 0.00 C ATOM 1226 CG LYS A 79 11.104 11.568 0.814 1.00 0.00 C ATOM 1227 CD LYS A 79 9.889 12.500 0.842 1.00 0.00 C ATOM 1228 CE LYS A 79 8.534 11.831 0.575 1.00 0.00 C ATOM 1229 NZ LYS A 79 8.047 10.998 1.699 1.00 0.00 N ATOM 0 H LYS A 79 12.371 9.194 0.376 1.00 0.00 H new ATOM 0 HA LYS A 79 13.234 10.881 2.377 1.00 0.00 H new ATOM 0 HB2 LYS A 79 10.436 9.808 1.849 1.00 0.00 H new ATOM 0 HB3 LYS A 79 10.789 11.164 2.901 1.00 0.00 H new ATOM 0 HG2 LYS A 79 12.017 12.163 0.797 1.00 0.00 H new ATOM 0 HG3 LYS A 79 11.089 10.981 -0.104 1.00 0.00 H new ATOM 0 HD2 LYS A 79 9.848 12.986 1.817 1.00 0.00 H new ATOM 0 HD3 LYS A 79 10.039 13.285 0.101 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.795 12.602 0.360 1.00 0.00 H new ATOM 0 HE3 LYS A 79 8.615 11.210 -0.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.013 11.079 1.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.306 10.005 1.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 8.480 11.324 2.586 1.00 0.00 H new ATOM 1243 N HIS A 80 12.378 7.965 3.587 1.00 0.00 N ATOM 1244 CA HIS A 80 12.312 7.128 4.782 1.00 0.00 C ATOM 1245 C HIS A 80 13.612 6.344 4.992 1.00 0.00 C ATOM 1246 O HIS A 80 13.686 5.477 5.865 1.00 0.00 O ATOM 1247 CB HIS A 80 11.088 6.218 4.699 1.00 0.00 C ATOM 1248 CG HIS A 80 9.856 6.927 4.190 1.00 0.00 C ATOM 1249 ND1 HIS A 80 9.325 8.087 4.684 1.00 0.00 N flip ATOM 1250 CD2 HIS A 80 9.206 6.646 3.016 1.00 0.00 C flip ATOM 1251 CE1 HIS A 80 8.336 8.528 3.793 1.00 0.00 C flip ATOM 1252 NE2 HIS A 80 8.308 7.614 2.810 1.00 0.00 N flip ATOM 0 H HIS A 80 12.314 7.432 2.720 1.00 0.00 H new ATOM 0 HA HIS A 80 12.202 7.765 5.659 1.00 0.00 H new ATOM 0 HB2 HIS A 80 11.312 5.376 4.044 1.00 0.00 H new ATOM 0 HB3 HIS A 80 10.881 5.807 5.687 1.00 0.00 H new ATOM 0 HD2 HIS A 80 9.387 5.796 2.374 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.726 9.415 3.879 1.00 0.00 H new ATOM 0 HE2 HIS A 80 7.680 7.653 2.007 1.00 0.00 H new ATOM 1260 N GLY A 81 14.643 6.648 4.199 1.00 0.00 N ATOM 1261 CA GLY A 81 15.961 6.055 4.326 1.00 0.00 C ATOM 1262 C GLY A 81 16.107 4.696 3.650 1.00 0.00 C ATOM 1263 O GLY A 81 17.106 4.025 3.906 1.00 0.00 O ATOM 0 H GLY A 81 14.576 7.326 3.440 1.00 0.00 H new ATOM 0 HA2 GLY A 81 16.696 6.739 3.902 1.00 0.00 H new ATOM 0 HA3 GLY A 81 16.198 5.948 5.385 1.00 0.00 H new ATOM 1267 N ALA A 82 15.178 4.287 2.783 1.00 0.00 N ATOM 1268 CA ALA A 82 15.483 3.206 1.850 1.00 0.00 C ATOM 1269 C ALA A 82 16.542 3.735 0.875 1.00 0.00 C ATOM 1270 O ALA A 82 16.453 4.890 0.453 1.00 0.00 O ATOM 1271 CB ALA A 82 14.226 2.770 1.095 1.00 0.00 C ATOM 0 H ALA A 82 14.238 4.675 2.709 1.00 0.00 H new ATOM 0 HA ALA A 82 15.854 2.332 2.385 1.00 0.00 H new ATOM 0 HB1 ALA A 82 14.477 1.964 0.406 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.478 2.420 1.806 1.00 0.00 H new ATOM 0 HB3 ALA A 82 13.827 3.615 0.535 1.00 0.00 H new ATOM 1277 N ASP A 83 17.556 2.946 0.515 1.00 0.00 N ATOM 1278 CA ASP A 83 18.399 3.223 -0.633 1.00 0.00 C ATOM 1279 C ASP A 83 17.817 2.513 -1.858 1.00 0.00 C ATOM 1280 O ASP A 83 16.751 1.900 -1.800 1.00 0.00 O ATOM 1281 CB ASP A 83 19.854 2.812 -0.390 1.00 0.00 C ATOM 1282 CG ASP A 83 20.088 1.440 0.225 1.00 0.00 C ATOM 1283 OD1 ASP A 83 19.714 0.424 -0.403 1.00 0.00 O ATOM 1284 OD2 ASP A 83 20.711 1.366 1.303 1.00 0.00 O ATOM 0 H ASP A 83 17.811 2.096 1.018 1.00 0.00 H new ATOM 0 HA ASP A 83 18.412 4.299 -0.807 1.00 0.00 H new ATOM 0 HB2 ASP A 83 20.381 2.851 -1.343 1.00 0.00 H new ATOM 0 HB3 ASP A 83 20.313 3.558 0.259 1.00 0.00 H new ATOM 1289 N GLU A 84 18.509 2.640 -2.989 1.00 0.00 N ATOM 1290 CA GLU A 84 18.119 2.056 -4.261 1.00 0.00 C ATOM 1291 C GLU A 84 18.043 0.535 -4.124 1.00 0.00 C ATOM 1292 O GLU A 84 17.100 -0.069 -4.621 1.00 0.00 O ATOM 1293 CB GLU A 84 19.106 2.561 -5.337 1.00 0.00 C ATOM 1294 CG GLU A 84 19.602 1.534 -6.366 1.00 0.00 C ATOM 1295 CD GLU A 84 20.651 2.114 -7.330 1.00 0.00 C ATOM 1296 OE1 GLU A 84 20.605 3.324 -7.655 1.00 0.00 O ATOM 1297 OE2 GLU A 84 21.605 1.401 -7.713 1.00 0.00 O ATOM 0 H GLU A 84 19.380 3.168 -3.042 1.00 0.00 H new ATOM 0 HA GLU A 84 17.122 2.365 -4.573 1.00 0.00 H new ATOM 0 HB2 GLU A 84 18.629 3.378 -5.877 1.00 0.00 H new ATOM 0 HB3 GLU A 84 19.975 2.979 -4.830 1.00 0.00 H new ATOM 0 HG2 GLU A 84 20.030 0.679 -5.842 1.00 0.00 H new ATOM 0 HG3 GLU A 84 18.753 1.163 -6.940 1.00 0.00 H new ATOM 1304 N THR A 85 18.995 -0.083 -3.426 1.00 0.00 N ATOM 1305 CA THR A 85 19.045 -1.531 -3.273 1.00 0.00 C ATOM 1306 C THR A 85 17.922 -2.019 -2.351 1.00 0.00 C ATOM 1307 O THR A 85 17.319 -3.051 -2.634 1.00 0.00 O ATOM 1308 CB THR A 85 20.437 -1.933 -2.769 1.00 0.00 C ATOM 1309 OG1 THR A 85 21.425 -1.383 -3.621 1.00 0.00 O ATOM 1310 CG2 THR A 85 20.653 -3.445 -2.745 1.00 0.00 C ATOM 0 H THR A 85 19.752 0.409 -2.952 1.00 0.00 H new ATOM 0 HA THR A 85 18.881 -2.014 -4.236 1.00 0.00 H new ATOM 0 HB THR A 85 20.513 -1.555 -1.750 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.314 -1.638 -3.298 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.656 -3.663 -2.379 1.00 0.00 H new ATOM 0 HG22 THR A 85 19.918 -3.907 -2.086 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.539 -3.845 -3.753 1.00 0.00 H new ATOM 1318 N MET A 86 17.621 -1.300 -1.265 1.00 0.00 N ATOM 1319 CA MET A 86 16.492 -1.574 -0.392 1.00 0.00 C ATOM 1320 C MET A 86 15.178 -1.507 -1.167 1.00 0.00 C ATOM 1321 O MET A 86 14.363 -2.415 -1.028 1.00 0.00 O ATOM 1322 CB MET A 86 16.483 -0.530 0.730 1.00 0.00 C ATOM 1323 CG MET A 86 17.474 -0.801 1.863 1.00 0.00 C ATOM 1324 SD MET A 86 17.116 0.162 3.362 1.00 0.00 S ATOM 1325 CE MET A 86 18.711 0.907 3.754 1.00 0.00 C ATOM 0 H MET A 86 18.172 -0.495 -0.968 1.00 0.00 H new ATOM 0 HA MET A 86 16.590 -2.578 0.021 1.00 0.00 H new ATOM 0 HB2 MET A 86 16.702 0.447 0.300 1.00 0.00 H new ATOM 0 HB3 MET A 86 15.478 -0.476 1.149 1.00 0.00 H new ATOM 0 HG2 MET A 86 17.457 -1.863 2.107 1.00 0.00 H new ATOM 0 HG3 MET A 86 18.482 -0.569 1.520 1.00 0.00 H new ATOM 0 HE1 MET A 86 18.704 1.260 4.785 1.00 0.00 H new ATOM 0 HE2 MET A 86 19.500 0.165 3.630 1.00 0.00 H new ATOM 0 HE3 MET A 86 18.895 1.747 3.084 1.00 0.00 H new ATOM 1335 N ALA A 87 14.977 -0.469 -1.981 1.00 0.00 N ATOM 1336 CA ALA A 87 13.797 -0.379 -2.825 1.00 0.00 C ATOM 1337 C ALA A 87 13.769 -1.552 -3.793 1.00 0.00 C ATOM 1338 O ALA A 87 12.788 -2.285 -3.846 1.00 0.00 O ATOM 1339 CB ALA A 87 13.767 0.976 -3.538 1.00 0.00 C ATOM 0 H ALA A 87 15.620 0.318 -2.069 1.00 0.00 H new ATOM 0 HA ALA A 87 12.894 -0.439 -2.217 1.00 0.00 H new ATOM 0 HB1 ALA A 87 12.880 1.036 -4.169 1.00 0.00 H new ATOM 0 HB2 ALA A 87 13.741 1.776 -2.798 1.00 0.00 H new ATOM 0 HB3 ALA A 87 14.659 1.082 -4.156 1.00 0.00 H new ATOM 1345 N GLN A 88 14.855 -1.767 -4.535 1.00 0.00 N ATOM 1346 CA GLN A 88 14.914 -2.791 -5.562 1.00 0.00 C ATOM 1347 C GLN A 88 14.631 -4.183 -4.989 1.00 0.00 C ATOM 1348 O GLN A 88 13.948 -4.959 -5.647 1.00 0.00 O ATOM 1349 CB GLN A 88 16.275 -2.715 -6.270 1.00 0.00 C ATOM 1350 CG GLN A 88 16.311 -3.516 -7.574 1.00 0.00 C ATOM 1351 CD GLN A 88 15.351 -2.956 -8.626 1.00 0.00 C ATOM 1352 OE1 GLN A 88 15.361 -1.764 -8.932 1.00 0.00 O ATOM 1353 NE2 GLN A 88 14.514 -3.791 -9.208 1.00 0.00 N ATOM 0 H GLN A 88 15.717 -1.231 -4.436 1.00 0.00 H new ATOM 0 HA GLN A 88 14.131 -2.609 -6.298 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.511 -1.672 -6.483 1.00 0.00 H new ATOM 0 HB3 GLN A 88 17.050 -3.087 -5.599 1.00 0.00 H new ATOM 0 HG2 GLN A 88 17.326 -3.512 -7.972 1.00 0.00 H new ATOM 0 HG3 GLN A 88 16.054 -4.555 -7.367 1.00 0.00 H new ATOM 0 HE21 GLN A 88 14.514 -4.777 -8.947 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.867 -3.451 -9.919 1.00 0.00 H new ATOM 1362 N GLN A 89 15.098 -4.484 -3.771 1.00 0.00 N ATOM 1363 CA GLN A 89 14.746 -5.688 -3.026 1.00 0.00 C ATOM 1364 C GLN A 89 13.228 -5.841 -2.938 1.00 0.00 C ATOM 1365 O GLN A 89 12.678 -6.885 -3.290 1.00 0.00 O ATOM 1366 CB GLN A 89 15.359 -5.603 -1.611 1.00 0.00 C ATOM 1367 CG GLN A 89 16.761 -6.201 -1.505 1.00 0.00 C ATOM 1368 CD GLN A 89 16.815 -7.722 -1.662 1.00 0.00 C ATOM 1369 OE1 GLN A 89 15.819 -8.409 -1.876 1.00 0.00 O ATOM 1370 NE2 GLN A 89 18.003 -8.286 -1.569 1.00 0.00 N ATOM 0 H GLN A 89 15.747 -3.879 -3.268 1.00 0.00 H new ATOM 0 HA GLN A 89 15.143 -6.561 -3.544 1.00 0.00 H new ATOM 0 HB2 GLN A 89 15.397 -4.558 -1.305 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.702 -6.117 -0.910 1.00 0.00 H new ATOM 0 HG2 GLN A 89 17.395 -5.747 -2.267 1.00 0.00 H new ATOM 0 HG3 GLN A 89 17.184 -5.933 -0.537 1.00 0.00 H new ATOM 0 HE21 GLN A 89 18.827 -7.712 -1.391 1.00 0.00 H new ATOM 0 HE22 GLN A 89 18.098 -9.296 -1.675 1.00 0.00 H new ATOM 1379 N LEU A 90 12.548 -4.811 -2.442 1.00 0.00 N ATOM 1380 CA LEU A 90 11.114 -4.843 -2.214 1.00 0.00 C ATOM 1381 C LEU A 90 10.353 -4.921 -3.534 1.00 0.00 C ATOM 1382 O LEU A 90 9.372 -5.651 -3.619 1.00 0.00 O ATOM 1383 CB LEU A 90 10.704 -3.606 -1.402 1.00 0.00 C ATOM 1384 CG LEU A 90 11.331 -3.578 0.013 1.00 0.00 C ATOM 1385 CD1 LEU A 90 11.177 -2.199 0.631 1.00 0.00 C ATOM 1386 CD2 LEU A 90 10.717 -4.610 0.969 1.00 0.00 C ATOM 0 H LEU A 90 12.984 -3.925 -2.186 1.00 0.00 H new ATOM 0 HA LEU A 90 10.859 -5.737 -1.646 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.001 -2.708 -1.943 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.618 -3.580 -1.313 1.00 0.00 H new ATOM 0 HG LEU A 90 12.383 -3.830 -0.121 1.00 0.00 H new ATOM 0 HD11 LEU A 90 11.622 -2.194 1.626 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.679 -1.462 0.005 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.118 -1.950 0.706 1.00 0.00 H new ATOM 0 HD21 LEU A 90 11.201 -4.537 1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.650 -4.415 1.079 1.00 0.00 H new ATOM 0 HD23 LEU A 90 10.863 -5.612 0.565 1.00 0.00 H new ATOM 1398 N ILE A 91 10.824 -4.236 -4.570 1.00 0.00 N ATOM 1399 CA ILE A 91 10.196 -4.202 -5.888 1.00 0.00 C ATOM 1400 C ILE A 91 10.373 -5.566 -6.583 1.00 0.00 C ATOM 1401 O ILE A 91 9.475 -6.048 -7.275 1.00 0.00 O ATOM 1402 CB ILE A 91 10.784 -2.996 -6.658 1.00 0.00 C ATOM 1403 CG1 ILE A 91 10.351 -1.680 -5.964 1.00 0.00 C ATOM 1404 CG2 ILE A 91 10.349 -2.954 -8.132 1.00 0.00 C ATOM 1405 CD1 ILE A 91 11.303 -0.508 -6.186 1.00 0.00 C ATOM 0 H ILE A 91 11.674 -3.675 -4.516 1.00 0.00 H new ATOM 0 HA ILE A 91 9.118 -4.052 -5.834 1.00 0.00 H new ATOM 0 HB ILE A 91 11.868 -3.108 -6.643 1.00 0.00 H new ATOM 0 HG12 ILE A 91 9.361 -1.402 -6.325 1.00 0.00 H new ATOM 0 HG13 ILE A 91 10.260 -1.861 -4.893 1.00 0.00 H new ATOM 0 HG21 ILE A 91 10.794 -2.086 -8.618 1.00 0.00 H new ATOM 0 HG22 ILE A 91 10.682 -3.862 -8.636 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.263 -2.885 -8.189 1.00 0.00 H new ATOM 0 HD11 ILE A 91 10.924 0.372 -5.666 1.00 0.00 H new ATOM 0 HD12 ILE A 91 12.290 -0.762 -5.798 1.00 0.00 H new ATOM 0 HD13 ILE A 91 11.376 -0.296 -7.253 1.00 0.00 H new ATOM 1417 N ASP A 92 11.504 -6.250 -6.375 1.00 0.00 N ATOM 1418 CA ASP A 92 11.710 -7.630 -6.823 1.00 0.00 C ATOM 1419 C ASP A 92 10.653 -8.533 -6.221 1.00 0.00 C ATOM 1420 O ASP A 92 10.073 -9.375 -6.908 1.00 0.00 O ATOM 1421 CB ASP A 92 13.082 -8.143 -6.366 1.00 0.00 C ATOM 1422 CG ASP A 92 13.622 -9.272 -7.239 1.00 0.00 C ATOM 1423 OD1 ASP A 92 14.155 -8.979 -8.332 1.00 0.00 O ATOM 1424 OD2 ASP A 92 13.636 -10.443 -6.781 1.00 0.00 O ATOM 0 H ASP A 92 12.308 -5.857 -5.887 1.00 0.00 H new ATOM 0 HA ASP A 92 11.649 -7.642 -7.911 1.00 0.00 H new ATOM 0 HB2 ASP A 92 13.792 -7.316 -6.372 1.00 0.00 H new ATOM 0 HB3 ASP A 92 13.008 -8.492 -5.336 1.00 0.00 H new ATOM 1429 N ILE A 93 10.437 -8.360 -4.922 1.00 0.00 N ATOM 1430 CA ILE A 93 9.423 -9.045 -4.145 1.00 0.00 C ATOM 1431 C ILE A 93 8.015 -8.708 -4.644 1.00 0.00 C ATOM 1432 O ILE A 93 7.225 -9.640 -4.773 1.00 0.00 O ATOM 1433 CB ILE A 93 9.666 -8.773 -2.645 1.00 0.00 C ATOM 1434 CG1 ILE A 93 10.981 -9.509 -2.284 1.00 0.00 C ATOM 1435 CG2 ILE A 93 8.470 -9.222 -1.804 1.00 0.00 C ATOM 1436 CD1 ILE A 93 11.537 -9.286 -0.881 1.00 0.00 C ATOM 0 H ILE A 93 10.989 -7.710 -4.363 1.00 0.00 H new ATOM 0 HA ILE A 93 9.501 -10.124 -4.281 1.00 0.00 H new ATOM 0 HB ILE A 93 9.768 -7.709 -2.432 1.00 0.00 H new ATOM 0 HG12 ILE A 93 10.818 -10.578 -2.418 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.744 -9.210 -3.002 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.668 -9.019 -0.752 1.00 0.00 H new ATOM 0 HG22 ILE A 93 7.580 -8.677 -2.117 1.00 0.00 H new ATOM 0 HG23 ILE A 93 8.308 -10.291 -1.943 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.457 -9.857 -0.759 1.00 0.00 H new ATOM 0 HD12 ILE A 93 11.746 -8.226 -0.737 1.00 0.00 H new ATOM 0 HD13 ILE A 93 10.805 -9.615 -0.143 1.00 0.00 H new ATOM 1448 N VAL A 94 7.687 -7.449 -4.949 1.00 0.00 N ATOM 1449 CA VAL A 94 6.378 -7.061 -5.477 1.00 0.00 C ATOM 1450 C VAL A 94 6.050 -7.941 -6.676 1.00 0.00 C ATOM 1451 O VAL A 94 4.998 -8.587 -6.678 1.00 0.00 O ATOM 1452 CB VAL A 94 6.331 -5.544 -5.792 1.00 0.00 C ATOM 1453 CG1 VAL A 94 5.190 -5.098 -6.725 1.00 0.00 C ATOM 1454 CG2 VAL A 94 6.168 -4.763 -4.488 1.00 0.00 C ATOM 0 H VAL A 94 8.329 -6.665 -4.835 1.00 0.00 H new ATOM 0 HA VAL A 94 5.605 -7.223 -4.726 1.00 0.00 H new ATOM 0 HB VAL A 94 7.269 -5.340 -6.309 1.00 0.00 H new ATOM 0 HG11 VAL A 94 5.248 -4.021 -6.881 1.00 0.00 H new ATOM 0 HG12 VAL A 94 5.283 -5.609 -7.683 1.00 0.00 H new ATOM 0 HG13 VAL A 94 4.231 -5.348 -6.272 1.00 0.00 H new ATOM 0 HG21 VAL A 94 6.135 -3.695 -4.705 1.00 0.00 H new ATOM 0 HG22 VAL A 94 5.242 -5.063 -3.998 1.00 0.00 H new ATOM 0 HG23 VAL A 94 7.011 -4.973 -3.830 1.00 0.00 H new ATOM 1464 N HIS A 95 6.949 -8.030 -7.661 1.00 0.00 N ATOM 1465 CA HIS A 95 6.661 -8.816 -8.851 1.00 0.00 C ATOM 1466 C HIS A 95 6.754 -10.310 -8.520 1.00 0.00 C ATOM 1467 O HIS A 95 5.961 -11.117 -9.001 1.00 0.00 O ATOM 1468 CB HIS A 95 7.615 -8.413 -9.977 1.00 0.00 C ATOM 1469 CG HIS A 95 7.762 -6.921 -10.187 1.00 0.00 C ATOM 1470 ND1 HIS A 95 8.939 -6.290 -10.509 1.00 0.00 N ATOM 1471 CD2 HIS A 95 6.814 -5.946 -10.002 1.00 0.00 C ATOM 1472 CE1 HIS A 95 8.710 -4.970 -10.506 1.00 0.00 C ATOM 1473 NE2 HIS A 95 7.420 -4.706 -10.239 1.00 0.00 N ATOM 0 H HIS A 95 7.862 -7.576 -7.655 1.00 0.00 H new ATOM 0 HA HIS A 95 5.645 -8.619 -9.194 1.00 0.00 H new ATOM 0 HB2 HIS A 95 8.598 -8.834 -9.768 1.00 0.00 H new ATOM 0 HB3 HIS A 95 7.267 -8.863 -10.907 1.00 0.00 H new ATOM 0 HD2 HIS A 95 5.783 -6.107 -9.723 1.00 0.00 H new ATOM 0 HE1 HIS A 95 9.462 -4.218 -10.693 1.00 0.00 H new ATOM 0 HE2 HIS A 95 6.973 -3.789 -10.214 1.00 0.00 H new ATOM 1481 N GLY A 96 7.680 -10.697 -7.642 1.00 0.00 N ATOM 1482 CA GLY A 96 7.860 -12.075 -7.194 1.00 0.00 C ATOM 1483 C GLY A 96 6.625 -12.659 -6.515 1.00 0.00 C ATOM 1484 O GLY A 96 6.402 -13.875 -6.562 1.00 0.00 O ATOM 0 H GLY A 96 8.339 -10.046 -7.214 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.122 -12.696 -8.051 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.700 -12.117 -6.501 1.00 0.00 H new ATOM 1488 N CYS A 97 5.813 -11.785 -5.930 1.00 0.00 N ATOM 1489 CA CYS A 97 4.589 -12.101 -5.227 1.00 0.00 C ATOM 1490 C CYS A 97 3.368 -11.933 -6.112 1.00 0.00 C ATOM 1491 O CYS A 97 2.389 -12.647 -5.887 1.00 0.00 O ATOM 1492 CB CYS A 97 4.470 -11.214 -3.989 1.00 0.00 C ATOM 1493 SG CYS A 97 5.420 -11.812 -2.576 1.00 0.00 S ATOM 0 H CYS A 97 6.008 -10.784 -5.938 1.00 0.00 H new ATOM 0 HA CYS A 97 4.631 -13.149 -4.929 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.804 -10.207 -4.240 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.420 -11.140 -3.705 1.00 0.00 H new ATOM 1498 N GLU A 98 3.415 -11.069 -7.133 1.00 0.00 N ATOM 1499 CA GLU A 98 2.460 -11.153 -8.223 1.00 0.00 C ATOM 1500 C GLU A 98 2.554 -12.564 -8.812 1.00 0.00 C ATOM 1501 O GLU A 98 1.532 -13.202 -9.053 1.00 0.00 O ATOM 1502 CB GLU A 98 2.730 -10.134 -9.330 1.00 0.00 C ATOM 1503 CG GLU A 98 2.346 -8.687 -9.008 1.00 0.00 C ATOM 1504 CD GLU A 98 2.527 -7.774 -10.241 1.00 0.00 C ATOM 1505 OE1 GLU A 98 3.328 -8.119 -11.141 1.00 0.00 O ATOM 1506 OE2 GLU A 98 1.851 -6.720 -10.341 1.00 0.00 O ATOM 0 H GLU A 98 4.098 -10.316 -7.219 1.00 0.00 H new ATOM 0 HA GLU A 98 1.468 -10.935 -7.827 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.792 -10.163 -9.574 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.189 -10.444 -10.224 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.309 -8.649 -8.673 1.00 0.00 H new ATOM 0 HG3 GLU A 98 2.960 -8.319 -8.186 1.00 0.00 H new ATOM 1513 N LYS A 99 3.780 -13.063 -9.017 1.00 0.00 N ATOM 1514 CA LYS A 99 4.042 -14.384 -9.574 1.00 0.00 C ATOM 1515 C LYS A 99 3.507 -15.483 -8.666 1.00 0.00 C ATOM 1516 O LYS A 99 2.764 -16.325 -9.174 1.00 0.00 O ATOM 1517 CB LYS A 99 5.541 -14.558 -9.877 1.00 0.00 C ATOM 1518 CG LYS A 99 5.912 -13.935 -11.232 1.00 0.00 C ATOM 1519 CD LYS A 99 7.273 -13.241 -11.256 1.00 0.00 C ATOM 1520 CE LYS A 99 8.433 -14.194 -10.972 1.00 0.00 C ATOM 1521 NZ LYS A 99 9.712 -13.464 -10.854 1.00 0.00 N ATOM 0 H LYS A 99 4.630 -12.545 -8.794 1.00 0.00 H new ATOM 0 HA LYS A 99 3.506 -14.471 -10.519 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.130 -14.093 -9.087 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.793 -15.618 -9.881 1.00 0.00 H new ATOM 0 HG2 LYS A 99 5.903 -14.716 -11.992 1.00 0.00 H new ATOM 0 HG3 LYS A 99 5.144 -13.212 -11.508 1.00 0.00 H new ATOM 0 HD2 LYS A 99 7.421 -12.777 -12.231 1.00 0.00 H new ATOM 0 HD3 LYS A 99 7.279 -12.439 -10.517 1.00 0.00 H new ATOM 0 HE2 LYS A 99 8.239 -14.742 -10.050 1.00 0.00 H new ATOM 0 HE3 LYS A 99 8.505 -14.931 -11.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 10.480 -14.138 -10.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 9.908 -12.961 -11.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 9.650 -12.778 -10.075 1.00 0.00 H new ATOM 1535 N SER A 100 3.884 -15.538 -7.384 1.00 0.00 N ATOM 1536 CA SER A 100 3.491 -16.671 -6.549 1.00 0.00 C ATOM 1537 C SER A 100 2.053 -16.575 -6.023 1.00 0.00 C ATOM 1538 O SER A 100 1.563 -17.554 -5.447 1.00 0.00 O ATOM 1539 CB SER A 100 4.504 -16.915 -5.425 1.00 0.00 C ATOM 1540 OG SER A 100 4.707 -15.788 -4.600 1.00 0.00 O ATOM 0 H SER A 100 4.447 -14.829 -6.914 1.00 0.00 H new ATOM 0 HA SER A 100 3.501 -17.546 -7.199 1.00 0.00 H new ATOM 0 HB2 SER A 100 4.161 -17.748 -4.812 1.00 0.00 H new ATOM 0 HB3 SER A 100 5.457 -17.212 -5.863 1.00 0.00 H new ATOM 0 HG SER A 100 5.361 -16.006 -3.903 1.00 0.00 H new ATOM 1546 N THR A 101 1.352 -15.456 -6.205 1.00 0.00 N ATOM 1547 CA THR A 101 -0.088 -15.420 -5.996 1.00 0.00 C ATOM 1548 C THR A 101 -0.752 -15.927 -7.282 1.00 0.00 C ATOM 1549 O THR A 101 -0.488 -15.383 -8.357 1.00 0.00 O ATOM 1550 CB THR A 101 -0.550 -14.008 -5.632 1.00 0.00 C ATOM 1551 OG1 THR A 101 0.220 -13.545 -4.541 1.00 0.00 O ATOM 1552 CG2 THR A 101 -2.021 -14.006 -5.203 1.00 0.00 C ATOM 0 H THR A 101 1.760 -14.567 -6.496 1.00 0.00 H new ATOM 0 HA THR A 101 -0.374 -16.058 -5.160 1.00 0.00 H new ATOM 0 HB THR A 101 -0.428 -13.369 -6.507 1.00 0.00 H new ATOM 0 HG1 THR A 101 1.006 -13.065 -4.876 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.325 -12.990 -4.949 1.00 0.00 H new ATOM 0 HG22 THR A 101 -2.639 -14.376 -6.021 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.147 -14.650 -4.333 1.00 0.00 H new ATOM 1560 N PRO A 102 -1.611 -16.957 -7.218 1.00 0.00 N ATOM 1561 CA PRO A 102 -2.286 -17.439 -8.408 1.00 0.00 C ATOM 1562 C PRO A 102 -3.242 -16.371 -8.933 1.00 0.00 C ATOM 1563 O PRO A 102 -4.026 -15.805 -8.166 1.00 0.00 O ATOM 1564 CB PRO A 102 -3.020 -18.712 -7.993 1.00 0.00 C ATOM 1565 CG PRO A 102 -3.173 -18.581 -6.476 1.00 0.00 C ATOM 1566 CD PRO A 102 -1.983 -17.730 -6.047 1.00 0.00 C ATOM 0 HA PRO A 102 -1.590 -17.654 -9.219 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -3.989 -18.791 -8.485 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -2.453 -19.604 -8.260 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -4.117 -18.105 -6.211 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -3.160 -19.556 -5.990 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -2.248 -17.078 -5.215 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -1.155 -18.355 -5.711 1.00 0.00 H new ATOM 1574 N ALA A 103 -3.196 -16.162 -10.247 1.00 0.00 N ATOM 1575 CA ALA A 103 -3.993 -15.265 -11.063 1.00 0.00 C ATOM 1576 C ALA A 103 -5.471 -15.510 -10.774 1.00 0.00 C ATOM 1577 O ALA A 103 -6.052 -16.477 -11.273 1.00 0.00 O ATOM 1578 CB ALA A 103 -3.626 -15.504 -12.536 1.00 0.00 C ATOM 0 H ALA A 103 -2.527 -16.674 -10.821 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.791 -14.219 -10.832 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -4.214 -14.840 -13.170 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.565 -15.302 -12.684 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.839 -16.540 -12.801 1.00 0.00 H new ATOM 1584 N ASN A 104 -6.021 -14.684 -9.887 1.00 0.00 N ATOM 1585 CA ASN A 104 -7.402 -14.774 -9.422 1.00 0.00 C ATOM 1586 C ASN A 104 -8.321 -14.082 -10.410 1.00 0.00 C ATOM 1587 O ASN A 104 -7.996 -13.031 -10.953 1.00 0.00 O ATOM 1588 CB ASN A 104 -7.587 -14.164 -8.021 1.00 0.00 C ATOM 1589 CG ASN A 104 -8.848 -14.642 -7.307 1.00 0.00 C ATOM 1590 OD1 ASN A 104 -9.981 -14.497 -7.756 1.00 0.00 O ATOM 1591 ND2 ASN A 104 -8.700 -15.220 -6.139 1.00 0.00 N ATOM 0 H ASN A 104 -5.505 -13.914 -9.461 1.00 0.00 H new ATOM 0 HA ASN A 104 -7.656 -15.832 -9.353 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -6.719 -14.409 -7.410 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -7.619 -13.078 -8.108 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -9.518 -15.540 -5.621 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -7.767 -15.350 -5.749 1.00 0.00 H new ATOM 1598 N ASP A 105 -9.516 -14.633 -10.549 1.00 0.00 N ATOM 1599 CA ASP A 105 -10.680 -14.045 -11.185 1.00 0.00 C ATOM 1600 C ASP A 105 -10.954 -12.600 -10.748 1.00 0.00 C ATOM 1601 O ASP A 105 -11.400 -11.794 -11.566 1.00 0.00 O ATOM 1602 CB ASP A 105 -11.883 -14.920 -10.831 1.00 0.00 C ATOM 1603 CG ASP A 105 -13.142 -14.471 -11.558 1.00 0.00 C ATOM 1604 OD1 ASP A 105 -13.296 -14.827 -12.750 1.00 0.00 O ATOM 1605 OD2 ASP A 105 -13.986 -13.786 -10.952 1.00 0.00 O ATOM 0 H ASP A 105 -9.710 -15.570 -10.194 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.497 -14.005 -12.259 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.666 -15.957 -11.087 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.053 -14.886 -9.755 1.00 0.00 H new ATOM 1610 N ASP A 106 -10.681 -12.274 -9.482 1.00 0.00 N ATOM 1611 CA ASP A 106 -11.010 -11.002 -8.836 1.00 0.00 C ATOM 1612 C ASP A 106 -9.718 -10.244 -8.544 1.00 0.00 C ATOM 1613 O ASP A 106 -8.858 -10.760 -7.817 1.00 0.00 O ATOM 1614 CB ASP A 106 -11.735 -11.278 -7.516 1.00 0.00 C ATOM 1615 CG ASP A 106 -12.429 -10.045 -6.943 1.00 0.00 C ATOM 1616 OD1 ASP A 106 -11.742 -9.186 -6.347 1.00 0.00 O ATOM 1617 OD2 ASP A 106 -13.678 -9.998 -6.992 1.00 0.00 O ATOM 0 H ASP A 106 -10.203 -12.918 -8.852 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.650 -10.411 -9.491 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.474 -12.064 -7.672 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -11.018 -11.655 -6.787 1.00 0.00 H new ATOM 1622 N LYS A 107 -9.534 -9.045 -9.110 1.00 0.00 N ATOM 1623 CA LYS A 107 -8.275 -8.334 -8.968 1.00 0.00 C ATOM 1624 C LYS A 107 -8.049 -7.906 -7.527 1.00 0.00 C ATOM 1625 O LYS A 107 -6.898 -7.928 -7.098 1.00 0.00 O ATOM 1626 CB LYS A 107 -8.208 -7.131 -9.926 1.00 0.00 C ATOM 1627 CG LYS A 107 -6.989 -7.229 -10.849 1.00 0.00 C ATOM 1628 CD LYS A 107 -7.254 -8.229 -11.984 1.00 0.00 C ATOM 1629 CE LYS A 107 -7.926 -7.568 -13.194 1.00 0.00 C ATOM 1630 NZ LYS A 107 -6.950 -6.891 -14.070 1.00 0.00 N ATOM 0 H LYS A 107 -10.238 -8.558 -9.664 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.471 -9.018 -9.240 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.118 -7.087 -10.524 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -8.159 -6.206 -9.351 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.761 -6.248 -11.266 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.116 -7.542 -10.276 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -6.312 -8.680 -12.295 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -7.887 -9.036 -11.615 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -8.464 -8.323 -13.767 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -8.664 -6.845 -12.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -7.447 -6.458 -14.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -6.454 -6.152 -13.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -6.260 -7.585 -14.422 1.00 0.00 H new ATOM 1644 N CYS A 108 -9.088 -7.560 -6.758 1.00 0.00 N ATOM 1645 CA CYS A 108 -8.923 -7.236 -5.354 1.00 0.00 C ATOM 1646 C CYS A 108 -8.355 -8.448 -4.620 1.00 0.00 C ATOM 1647 O CYS A 108 -7.420 -8.314 -3.837 1.00 0.00 O ATOM 1648 CB CYS A 108 -10.247 -6.858 -4.690 1.00 0.00 C ATOM 1649 SG CYS A 108 -11.228 -5.479 -5.335 1.00 0.00 S ATOM 0 H CYS A 108 -10.049 -7.500 -7.094 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.249 -6.382 -5.295 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -10.882 -7.743 -4.709 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -10.033 -6.641 -3.643 1.00 0.00 H new ATOM 1654 N ILE A 109 -8.940 -9.629 -4.826 1.00 0.00 N ATOM 1655 CA ILE A 109 -8.566 -10.832 -4.092 1.00 0.00 C ATOM 1656 C ILE A 109 -7.151 -11.263 -4.467 1.00 0.00 C ATOM 1657 O ILE A 109 -6.382 -11.622 -3.569 1.00 0.00 O ATOM 1658 CB ILE A 109 -9.625 -11.934 -4.308 1.00 0.00 C ATOM 1659 CG1 ILE A 109 -10.979 -11.426 -3.768 1.00 0.00 C ATOM 1660 CG2 ILE A 109 -9.199 -13.223 -3.601 1.00 0.00 C ATOM 1661 CD1 ILE A 109 -12.146 -12.370 -4.021 1.00 0.00 C ATOM 0 H ILE A 109 -9.686 -9.775 -5.507 1.00 0.00 H new ATOM 0 HA ILE A 109 -8.548 -10.626 -3.022 1.00 0.00 H new ATOM 0 HB ILE A 109 -9.722 -12.158 -5.370 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -10.889 -11.257 -2.695 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -11.201 -10.462 -4.225 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -9.954 -13.992 -3.761 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.245 -13.561 -4.005 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -9.094 -13.034 -2.533 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -13.059 -11.938 -3.611 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -12.266 -12.520 -5.094 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -11.950 -13.328 -3.540 1.00 0.00 H new ATOM 1673 N TRP A 110 -6.795 -11.193 -5.751 1.00 0.00 N ATOM 1674 CA TRP A 110 -5.417 -11.343 -6.191 1.00 0.00 C ATOM 1675 C TRP A 110 -4.531 -10.362 -5.423 1.00 0.00 C ATOM 1676 O TRP A 110 -3.655 -10.799 -4.686 1.00 0.00 O ATOM 1677 CB TRP A 110 -5.306 -11.151 -7.705 1.00 0.00 C ATOM 1678 CG TRP A 110 -3.923 -11.287 -8.246 1.00 0.00 C ATOM 1679 CD1 TRP A 110 -3.267 -12.450 -8.450 1.00 0.00 C ATOM 1680 CD2 TRP A 110 -3.033 -10.236 -8.708 1.00 0.00 C ATOM 1681 NE1 TRP A 110 -2.037 -12.194 -9.024 1.00 0.00 N ATOM 1682 CE2 TRP A 110 -1.850 -10.841 -9.225 1.00 0.00 C ATOM 1683 CE3 TRP A 110 -3.126 -8.829 -8.764 1.00 0.00 C ATOM 1684 CZ2 TRP A 110 -0.823 -10.080 -9.807 1.00 0.00 C ATOM 1685 CZ3 TRP A 110 -2.110 -8.059 -9.350 1.00 0.00 C ATOM 1686 CH2 TRP A 110 -0.980 -8.687 -9.896 1.00 0.00 C ATOM 0 H TRP A 110 -7.457 -11.031 -6.510 1.00 0.00 H new ATOM 0 HA TRP A 110 -5.073 -12.355 -5.976 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -5.949 -11.879 -8.199 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -5.688 -10.163 -7.962 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -3.646 -13.430 -8.202 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -1.355 -12.912 -9.268 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -3.993 -8.337 -8.349 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 0.071 -10.557 -10.179 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -2.198 -6.983 -9.381 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -0.224 -8.094 -10.389 1.00 0.00 H new ATOM 1697 N THR A 111 -4.797 -9.060 -5.521 1.00 0.00 N ATOM 1698 CA THR A 111 -4.030 -7.991 -4.888 1.00 0.00 C ATOM 1699 C THR A 111 -3.860 -8.221 -3.376 1.00 0.00 C ATOM 1700 O THR A 111 -2.784 -7.990 -2.833 1.00 0.00 O ATOM 1701 CB THR A 111 -4.719 -6.652 -5.219 1.00 0.00 C ATOM 1702 OG1 THR A 111 -4.756 -6.451 -6.614 1.00 0.00 O ATOM 1703 CG2 THR A 111 -4.055 -5.422 -4.612 1.00 0.00 C ATOM 0 H THR A 111 -5.585 -8.708 -6.066 1.00 0.00 H new ATOM 0 HA THR A 111 -3.014 -7.975 -5.282 1.00 0.00 H new ATOM 0 HB THR A 111 -5.713 -6.746 -4.782 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.582 -6.833 -6.978 1.00 0.00 H new ATOM 0 HG21 THR A 111 -4.610 -4.529 -4.900 1.00 0.00 H new ATOM 0 HG22 THR A 111 -4.049 -5.511 -3.526 1.00 0.00 H new ATOM 0 HG23 THR A 111 -3.030 -5.345 -4.976 1.00 0.00 H new ATOM 1711 N LEU A 112 -4.876 -8.717 -2.661 1.00 0.00 N ATOM 1712 CA LEU A 112 -4.794 -9.006 -1.238 1.00 0.00 C ATOM 1713 C LEU A 112 -3.859 -10.197 -0.998 1.00 0.00 C ATOM 1714 O LEU A 112 -3.063 -10.183 -0.056 1.00 0.00 O ATOM 1715 CB LEU A 112 -6.235 -9.231 -0.758 1.00 0.00 C ATOM 1716 CG LEU A 112 -6.483 -9.376 0.749 1.00 0.00 C ATOM 1717 CD1 LEU A 112 -6.324 -10.834 1.141 1.00 0.00 C ATOM 1718 CD2 LEU A 112 -5.638 -8.454 1.637 1.00 0.00 C ATOM 0 H LEU A 112 -5.788 -8.929 -3.067 1.00 0.00 H new ATOM 0 HA LEU A 112 -4.359 -8.188 -0.663 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.839 -8.397 -1.116 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.612 -10.130 -1.245 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.505 -9.045 0.931 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.499 -10.944 2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.045 -11.439 0.591 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -5.314 -11.167 0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -5.885 -8.631 2.684 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -4.580 -8.661 1.474 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -5.847 -7.414 1.385 1.00 0.00 H new ATOM 1730 N GLY A 113 -3.904 -11.204 -1.871 1.00 0.00 N ATOM 1731 CA GLY A 113 -2.969 -12.320 -1.888 1.00 0.00 C ATOM 1732 C GLY A 113 -1.533 -11.851 -2.128 1.00 0.00 C ATOM 1733 O GLY A 113 -0.638 -12.249 -1.374 1.00 0.00 O ATOM 0 H GLY A 113 -4.612 -11.264 -2.603 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -3.023 -12.855 -0.940 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -3.257 -13.024 -2.668 1.00 0.00 H new ATOM 1737 N VAL A 114 -1.311 -10.991 -3.125 1.00 0.00 N ATOM 1738 CA VAL A 114 -0.008 -10.409 -3.433 1.00 0.00 C ATOM 1739 C VAL A 114 0.480 -9.628 -2.206 1.00 0.00 C ATOM 1740 O VAL A 114 1.584 -9.876 -1.732 1.00 0.00 O ATOM 1741 CB VAL A 114 -0.071 -9.553 -4.717 1.00 0.00 C ATOM 1742 CG1 VAL A 114 1.325 -9.012 -5.042 1.00 0.00 C ATOM 1743 CG2 VAL A 114 -0.525 -10.353 -5.947 1.00 0.00 C ATOM 0 H VAL A 114 -2.050 -10.675 -3.753 1.00 0.00 H new ATOM 0 HA VAL A 114 0.718 -11.194 -3.645 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.792 -8.760 -4.518 1.00 0.00 H new ATOM 0 HG11 VAL A 114 1.279 -8.408 -5.948 1.00 0.00 H new ATOM 0 HG12 VAL A 114 1.679 -8.398 -4.214 1.00 0.00 H new ATOM 0 HG13 VAL A 114 2.011 -9.845 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -0.550 -9.698 -6.818 1.00 0.00 H new ATOM 0 HG22 VAL A 114 0.173 -11.171 -6.127 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -1.521 -10.759 -5.770 1.00 0.00 H new ATOM 1753 N ALA A 115 -0.347 -8.757 -1.622 1.00 0.00 N ATOM 1754 CA ALA A 115 -0.004 -7.952 -0.456 1.00 0.00 C ATOM 1755 C ALA A 115 0.391 -8.798 0.750 1.00 0.00 C ATOM 1756 O ALA A 115 1.327 -8.459 1.483 1.00 0.00 O ATOM 1757 CB ALA A 115 -1.194 -7.060 -0.094 1.00 0.00 C ATOM 0 H ALA A 115 -1.296 -8.591 -1.958 1.00 0.00 H new ATOM 0 HA ALA A 115 0.865 -7.348 -0.718 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.944 -6.455 0.778 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -1.428 -6.406 -0.934 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -2.060 -7.682 0.133 1.00 0.00 H new ATOM 1763 N THR A 116 -0.328 -9.896 0.966 1.00 0.00 N ATOM 1764 CA THR A 116 -0.020 -10.874 1.995 1.00 0.00 C ATOM 1765 C THR A 116 1.372 -11.455 1.728 1.00 0.00 C ATOM 1766 O THR A 116 2.204 -11.497 2.639 1.00 0.00 O ATOM 1767 CB THR A 116 -1.130 -11.945 1.987 1.00 0.00 C ATOM 1768 OG1 THR A 116 -2.381 -11.347 2.273 1.00 0.00 O ATOM 1769 CG2 THR A 116 -0.909 -13.085 2.978 1.00 0.00 C ATOM 0 H THR A 116 -1.156 -10.132 0.418 1.00 0.00 H new ATOM 0 HA THR A 116 0.006 -10.426 2.988 1.00 0.00 H new ATOM 0 HB THR A 116 -1.108 -12.377 0.987 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.789 -11.029 1.441 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.734 -13.793 2.908 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.026 -13.594 2.745 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.861 -12.683 3.990 1.00 0.00 H new ATOM 1777 N CYS A 117 1.637 -11.872 0.485 1.00 0.00 N ATOM 1778 CA CYS A 117 2.930 -12.385 0.073 1.00 0.00 C ATOM 1779 C CYS A 117 4.025 -11.338 0.290 1.00 0.00 C ATOM 1780 O CYS A 117 5.028 -11.701 0.899 1.00 0.00 O ATOM 1781 CB CYS A 117 2.862 -12.911 -1.366 1.00 0.00 C ATOM 1782 SG CYS A 117 4.425 -13.516 -2.060 1.00 0.00 S ATOM 0 H CYS A 117 0.946 -11.859 -0.265 1.00 0.00 H new ATOM 0 HA CYS A 117 3.199 -13.235 0.700 1.00 0.00 H new ATOM 0 HB2 CYS A 117 2.133 -13.720 -1.403 1.00 0.00 H new ATOM 0 HB3 CYS A 117 2.486 -12.113 -2.007 1.00 0.00 H new ATOM 1787 N PHE A 118 3.850 -10.068 -0.122 1.00 0.00 N ATOM 1788 CA PHE A 118 4.889 -9.050 0.010 1.00 0.00 C ATOM 1789 C PHE A 118 5.357 -9.024 1.474 1.00 0.00 C ATOM 1790 O PHE A 118 6.509 -9.323 1.776 1.00 0.00 O ATOM 1791 CB PHE A 118 4.362 -7.677 -0.478 1.00 0.00 C ATOM 1792 CG PHE A 118 5.364 -6.533 -0.608 1.00 0.00 C ATOM 1793 CD1 PHE A 118 6.641 -6.638 -0.047 1.00 0.00 C ATOM 1794 CD2 PHE A 118 4.960 -5.272 -1.097 1.00 0.00 C ATOM 1795 CE1 PHE A 118 7.485 -5.531 0.043 1.00 0.00 C ATOM 1796 CE2 PHE A 118 5.800 -4.144 -0.974 1.00 0.00 C ATOM 1797 CZ PHE A 118 7.063 -4.270 -0.392 1.00 0.00 C ATOM 0 H PHE A 118 2.989 -9.729 -0.551 1.00 0.00 H new ATOM 0 HA PHE A 118 5.747 -9.287 -0.619 1.00 0.00 H new ATOM 0 HB2 PHE A 118 3.895 -7.825 -1.452 1.00 0.00 H new ATOM 0 HB3 PHE A 118 3.577 -7.358 0.207 1.00 0.00 H new ATOM 0 HD1 PHE A 118 6.980 -7.594 0.323 1.00 0.00 H new ATOM 0 HD2 PHE A 118 3.995 -5.169 -1.572 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.477 -5.649 0.454 1.00 0.00 H new ATOM 0 HE2 PHE A 118 5.465 -3.181 -1.331 1.00 0.00 H new ATOM 0 HZ PHE A 118 7.704 -3.408 -0.279 1.00 0.00 H new ATOM 1807 N LYS A 119 4.444 -8.742 2.403 1.00 0.00 N ATOM 1808 CA LYS A 119 4.702 -8.681 3.841 1.00 0.00 C ATOM 1809 C LYS A 119 5.452 -9.906 4.357 1.00 0.00 C ATOM 1810 O LYS A 119 6.343 -9.797 5.203 1.00 0.00 O ATOM 1811 CB LYS A 119 3.370 -8.575 4.592 1.00 0.00 C ATOM 1812 CG LYS A 119 3.514 -7.660 5.827 1.00 0.00 C ATOM 1813 CD LYS A 119 2.623 -8.078 7.004 1.00 0.00 C ATOM 1814 CE LYS A 119 2.979 -7.247 8.249 1.00 0.00 C ATOM 1815 NZ LYS A 119 2.423 -7.835 9.483 1.00 0.00 N ATOM 0 H LYS A 119 3.472 -8.543 2.167 1.00 0.00 H new ATOM 0 HA LYS A 119 5.328 -7.806 4.016 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.602 -8.180 3.927 1.00 0.00 H new ATOM 0 HB3 LYS A 119 3.042 -9.567 4.904 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.555 -7.661 6.151 1.00 0.00 H new ATOM 0 HG3 LYS A 119 3.270 -6.637 5.542 1.00 0.00 H new ATOM 0 HD2 LYS A 119 1.574 -7.933 6.747 1.00 0.00 H new ATOM 0 HD3 LYS A 119 2.756 -9.139 7.214 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.063 -7.174 8.338 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.600 -6.232 8.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 3.084 -7.679 10.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.511 -7.385 9.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 2.281 -8.856 9.348 1.00 0.00 H new ATOM 1829 N ALA A 120 5.030 -11.083 3.902 1.00 0.00 N ATOM 1830 CA ALA A 120 5.670 -12.341 4.268 1.00 0.00 C ATOM 1831 C ALA A 120 7.150 -12.333 3.871 1.00 0.00 C ATOM 1832 O ALA A 120 8.003 -12.710 4.669 1.00 0.00 O ATOM 1833 CB ALA A 120 4.933 -13.529 3.639 1.00 0.00 C ATOM 0 H ALA A 120 4.236 -11.190 3.270 1.00 0.00 H new ATOM 0 HA ALA A 120 5.616 -12.450 5.351 1.00 0.00 H new ATOM 0 HB1 ALA A 120 5.428 -14.457 3.925 1.00 0.00 H new ATOM 0 HB2 ALA A 120 3.901 -13.544 3.990 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.945 -13.431 2.553 1.00 0.00 H new ATOM 1839 N GLU A 121 7.473 -11.889 2.657 1.00 0.00 N ATOM 1840 CA GLU A 121 8.849 -11.805 2.194 1.00 0.00 C ATOM 1841 C GLU A 121 9.634 -10.697 2.910 1.00 0.00 C ATOM 1842 O GLU A 121 10.837 -10.859 3.105 1.00 0.00 O ATOM 1843 CB GLU A 121 8.900 -11.580 0.685 1.00 0.00 C ATOM 1844 CG GLU A 121 8.202 -12.657 -0.168 1.00 0.00 C ATOM 1845 CD GLU A 121 8.837 -14.045 -0.063 1.00 0.00 C ATOM 1846 OE1 GLU A 121 10.015 -14.220 -0.451 1.00 0.00 O ATOM 1847 OE2 GLU A 121 8.156 -14.996 0.396 1.00 0.00 O ATOM 0 H GLU A 121 6.785 -11.579 1.970 1.00 0.00 H new ATOM 0 HA GLU A 121 9.321 -12.758 2.433 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.446 -10.614 0.463 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.944 -11.519 0.379 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.157 -12.724 0.134 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.213 -12.342 -1.211 1.00 0.00 H new ATOM 1854 N ILE A 122 9.013 -9.589 3.343 1.00 0.00 N ATOM 1855 CA ILE A 122 9.695 -8.597 4.192 1.00 0.00 C ATOM 1856 C ILE A 122 10.239 -9.307 5.438 1.00 0.00 C ATOM 1857 O ILE A 122 11.368 -9.049 5.864 1.00 0.00 O ATOM 1858 CB ILE A 122 8.800 -7.394 4.586 1.00 0.00 C ATOM 1859 CG1 ILE A 122 8.111 -6.687 3.409 1.00 0.00 C ATOM 1860 CG2 ILE A 122 9.628 -6.362 5.366 1.00 0.00 C ATOM 1861 CD1 ILE A 122 7.071 -5.648 3.840 1.00 0.00 C ATOM 0 H ILE A 122 8.045 -9.357 3.121 1.00 0.00 H new ATOM 0 HA ILE A 122 10.510 -8.168 3.609 1.00 0.00 H new ATOM 0 HB ILE A 122 8.004 -7.819 5.197 1.00 0.00 H new ATOM 0 HG12 ILE A 122 8.868 -6.198 2.796 1.00 0.00 H new ATOM 0 HG13 ILE A 122 7.627 -7.434 2.781 1.00 0.00 H new ATOM 0 HG21 ILE A 122 8.994 -5.519 5.640 1.00 0.00 H new ATOM 0 HG22 ILE A 122 10.028 -6.824 6.269 1.00 0.00 H new ATOM 0 HG23 ILE A 122 10.451 -6.010 4.743 1.00 0.00 H new ATOM 0 HD11 ILE A 122 6.626 -5.190 2.956 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.292 -6.135 4.427 1.00 0.00 H new ATOM 0 HD13 ILE A 122 7.553 -4.879 4.443 1.00 0.00 H new ATOM 1873 N HIS A 123 9.483 -10.260 5.987 1.00 0.00 N ATOM 1874 CA HIS A 123 9.913 -11.045 7.136 1.00 0.00 C ATOM 1875 C HIS A 123 11.179 -11.859 6.837 1.00 0.00 C ATOM 1876 O HIS A 123 11.960 -12.137 7.746 1.00 0.00 O ATOM 1877 CB HIS A 123 8.762 -11.951 7.595 1.00 0.00 C ATOM 1878 CG HIS A 123 8.587 -11.961 9.087 1.00 0.00 C ATOM 1879 ND1 HIS A 123 9.123 -12.873 9.969 1.00 0.00 N ATOM 1880 CD2 HIS A 123 7.879 -11.039 9.807 1.00 0.00 C ATOM 1881 CE1 HIS A 123 8.727 -12.525 11.204 1.00 0.00 C ATOM 1882 NE2 HIS A 123 7.930 -11.444 11.145 1.00 0.00 N ATOM 0 H HIS A 123 8.555 -10.506 5.644 1.00 0.00 H new ATOM 0 HA HIS A 123 10.172 -10.360 7.943 1.00 0.00 H new ATOM 0 HB2 HIS A 123 7.835 -11.618 7.128 1.00 0.00 H new ATOM 0 HB3 HIS A 123 8.946 -12.968 7.249 1.00 0.00 H new ATOM 0 HD2 HIS A 123 7.377 -10.166 9.417 1.00 0.00 H new ATOM 0 HE1 HIS A 123 9.008 -13.038 12.112 1.00 0.00 H new ATOM 0 HE2 HIS A 123 7.452 -11.002 11.930 1.00 0.00 H new ATOM 1890 N LYS A 124 11.429 -12.211 5.572 1.00 0.00 N ATOM 1891 CA LYS A 124 12.636 -12.919 5.151 1.00 0.00 C ATOM 1892 C LYS A 124 13.808 -11.971 4.918 1.00 0.00 C ATOM 1893 O LYS A 124 14.942 -12.454 4.846 1.00 0.00 O ATOM 1894 CB LYS A 124 12.391 -13.688 3.846 1.00 0.00 C ATOM 1895 CG LYS A 124 11.191 -14.641 3.899 1.00 0.00 C ATOM 1896 CD LYS A 124 10.836 -15.151 2.501 1.00 0.00 C ATOM 1897 CE LYS A 124 11.838 -16.136 1.891 1.00 0.00 C ATOM 1898 NZ LYS A 124 11.449 -17.547 2.087 1.00 0.00 N ATOM 0 H LYS A 124 10.789 -12.008 4.804 1.00 0.00 H new ATOM 0 HA LYS A 124 12.882 -13.605 5.962 1.00 0.00 H new ATOM 0 HB2 LYS A 124 12.238 -12.973 3.038 1.00 0.00 H new ATOM 0 HB3 LYS A 124 13.286 -14.260 3.600 1.00 0.00 H new ATOM 0 HG2 LYS A 124 11.420 -15.484 4.551 1.00 0.00 H new ATOM 0 HG3 LYS A 124 10.333 -14.127 4.332 1.00 0.00 H new ATOM 0 HD2 LYS A 124 9.859 -15.632 2.545 1.00 0.00 H new ATOM 0 HD3 LYS A 124 10.740 -14.295 1.833 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.933 -15.936 0.824 1.00 0.00 H new ATOM 0 HE3 LYS A 124 12.819 -15.970 2.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 12.163 -18.167 1.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 11.384 -17.751 3.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 10.526 -17.718 1.640 1.00 0.00 H new ATOM 1912 N LEU A 125 13.598 -10.661 4.745 1.00 0.00 N ATOM 1913 CA LEU A 125 14.725 -9.739 4.659 1.00 0.00 C ATOM 1914 C LEU A 125 15.426 -9.713 6.004 1.00 0.00 C ATOM 1915 O LEU A 125 14.842 -9.966 7.060 1.00 0.00 O ATOM 1916 CB LEU A 125 14.321 -8.305 4.294 1.00 0.00 C ATOM 1917 CG LEU A 125 13.906 -8.124 2.824 1.00 0.00 C ATOM 1918 CD1 LEU A 125 13.151 -6.805 2.643 1.00 0.00 C ATOM 1919 CD2 LEU A 125 15.165 -8.127 1.945 1.00 0.00 C ATOM 0 H LEU A 125 12.678 -10.227 4.664 1.00 0.00 H new ATOM 0 HA LEU A 125 15.373 -10.100 3.860 1.00 0.00 H new ATOM 0 HB2 LEU A 125 13.494 -7.998 4.934 1.00 0.00 H new ATOM 0 HB3 LEU A 125 15.156 -7.638 4.509 1.00 0.00 H new ATOM 0 HG LEU A 125 13.248 -8.943 2.532 1.00 0.00 H new ATOM 0 HD11 LEU A 125 12.864 -6.691 1.598 1.00 0.00 H new ATOM 0 HD12 LEU A 125 12.257 -6.809 3.267 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.794 -5.975 2.935 1.00 0.00 H new ATOM 0 HD21 LEU A 125 14.880 -7.999 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 125 15.820 -7.309 2.245 1.00 0.00 H new ATOM 0 HD23 LEU A 125 15.690 -9.075 2.064 1.00 0.00 H new ATOM 1931 N ASN A 126 16.691 -9.333 5.955 1.00 0.00 N ATOM 1932 CA ASN A 126 17.536 -9.124 7.104 1.00 0.00 C ATOM 1933 C ASN A 126 17.242 -7.800 7.797 1.00 0.00 C ATOM 1934 O ASN A 126 17.522 -7.656 8.987 1.00 0.00 O ATOM 1935 CB ASN A 126 18.990 -9.147 6.642 1.00 0.00 C ATOM 1936 CG ASN A 126 19.301 -7.973 5.737 1.00 0.00 C ATOM 1937 OD1 ASN A 126 18.833 -7.921 4.606 1.00 0.00 O ATOM 1938 ND2 ASN A 126 19.988 -6.974 6.241 1.00 0.00 N ATOM 0 H ASN A 126 17.172 -9.156 5.073 1.00 0.00 H new ATOM 0 HA ASN A 126 17.342 -9.918 7.826 1.00 0.00 H new ATOM 0 HB2 ASN A 126 19.649 -9.124 7.510 1.00 0.00 H new ATOM 0 HB3 ASN A 126 19.191 -10.079 6.113 1.00 0.00 H new ATOM 0 HD21 ASN A 126 20.142 -6.131 5.688 1.00 0.00 H new ATOM 0 HD22 ASN A 126 20.368 -7.041 7.185 1.00 0.00 H new ATOM 1945 N TRP A 127 16.671 -6.850 7.062 1.00 0.00 N ATOM 1946 CA TRP A 127 16.316 -5.511 7.524 1.00 0.00 C ATOM 1947 C TRP A 127 14.793 -5.371 7.565 1.00 0.00 C ATOM 1948 O TRP A 127 14.072 -6.342 7.324 1.00 0.00 O ATOM 1949 CB TRP A 127 17.006 -4.438 6.666 1.00 0.00 C ATOM 1950 CG TRP A 127 16.538 -4.322 5.244 1.00 0.00 C ATOM 1951 CD1 TRP A 127 16.802 -5.200 4.252 1.00 0.00 C ATOM 1952 CD2 TRP A 127 15.719 -3.278 4.632 1.00 0.00 C ATOM 1953 NE1 TRP A 127 16.169 -4.807 3.094 1.00 0.00 N ATOM 1954 CE2 TRP A 127 15.427 -3.666 3.290 1.00 0.00 C ATOM 1955 CE3 TRP A 127 15.215 -2.030 5.058 1.00 0.00 C ATOM 1956 CZ2 TRP A 127 14.585 -2.925 2.456 1.00 0.00 C ATOM 1957 CZ3 TRP A 127 14.381 -1.264 4.221 1.00 0.00 C ATOM 1958 CH2 TRP A 127 14.050 -1.719 2.933 1.00 0.00 C ATOM 0 H TRP A 127 16.432 -7.000 6.082 1.00 0.00 H new ATOM 0 HA TRP A 127 16.680 -5.358 8.540 1.00 0.00 H new ATOM 0 HB2 TRP A 127 16.869 -3.472 7.151 1.00 0.00 H new ATOM 0 HB3 TRP A 127 18.077 -4.642 6.658 1.00 0.00 H new ATOM 0 HD1 TRP A 127 17.419 -6.081 4.352 1.00 0.00 H new ATOM 0 HE1 TRP A 127 16.241 -5.300 2.204 1.00 0.00 H new ATOM 0 HE3 TRP A 127 15.472 -1.658 6.039 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 14.350 -3.275 1.462 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 13.993 -0.319 4.572 1.00 0.00 H new ATOM 0 HH2 TRP A 127 13.384 -1.140 2.310 1.00 0.00 H new ATOM 1969 N ALA A 128 14.294 -4.180 7.903 1.00 0.00 N ATOM 1970 CA ALA A 128 12.866 -3.880 7.955 1.00 0.00 C ATOM 1971 C ALA A 128 12.616 -2.501 7.329 1.00 0.00 C ATOM 1972 O ALA A 128 13.162 -1.525 7.848 1.00 0.00 O ATOM 1973 CB ALA A 128 12.361 -3.917 9.399 1.00 0.00 C ATOM 0 H ALA A 128 14.883 -3.385 8.152 1.00 0.00 H new ATOM 0 HA ALA A 128 12.319 -4.635 7.390 1.00 0.00 H new ATOM 0 HB1 ALA A 128 11.295 -3.691 9.418 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.529 -4.909 9.818 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.899 -3.177 9.992 1.00 0.00 H new ATOM 1979 N PRO A 129 11.849 -2.395 6.233 1.00 0.00 N ATOM 1980 CA PRO A 129 11.324 -1.127 5.743 1.00 0.00 C ATOM 1981 C PRO A 129 10.288 -0.571 6.721 1.00 0.00 C ATOM 1982 O PRO A 129 9.663 -1.325 7.478 1.00 0.00 O ATOM 1983 CB PRO A 129 10.660 -1.429 4.390 1.00 0.00 C ATOM 1984 CG PRO A 129 10.878 -2.924 4.149 1.00 0.00 C ATOM 1985 CD PRO A 129 11.266 -3.493 5.498 1.00 0.00 C ATOM 0 HA PRO A 129 12.115 -0.384 5.642 1.00 0.00 H new ATOM 0 HB2 PRO A 129 9.598 -1.186 4.412 1.00 0.00 H new ATOM 0 HB3 PRO A 129 11.106 -0.834 3.593 1.00 0.00 H new ATOM 0 HG2 PRO A 129 9.973 -3.397 3.768 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.662 -3.093 3.410 1.00 0.00 H new ATOM 0 HD2 PRO A 129 10.396 -3.894 6.018 1.00 0.00 H new ATOM 0 HD3 PRO A 129 11.977 -4.312 5.388 1.00 0.00 H new ATOM 1993 N SER A 130 10.025 0.730 6.627 1.00 0.00 N ATOM 1994 CA SER A 130 8.879 1.369 7.241 1.00 0.00 C ATOM 1995 C SER A 130 7.592 0.795 6.636 1.00 0.00 C ATOM 1996 O SER A 130 7.581 0.242 5.529 1.00 0.00 O ATOM 1997 CB SER A 130 8.950 2.889 6.994 1.00 0.00 C ATOM 1998 OG SER A 130 9.997 3.280 6.121 1.00 0.00 O ATOM 0 H SER A 130 10.619 1.378 6.109 1.00 0.00 H new ATOM 0 HA SER A 130 8.881 1.182 8.315 1.00 0.00 H new ATOM 0 HB2 SER A 130 8.000 3.225 6.579 1.00 0.00 H new ATOM 0 HB3 SER A 130 9.078 3.397 7.950 1.00 0.00 H new ATOM 0 HG SER A 130 10.853 3.231 6.595 1.00 0.00 H new ATOM 2004 N MET A 131 6.472 1.006 7.320 1.00 0.00 N ATOM 2005 CA MET A 131 5.158 0.842 6.712 1.00 0.00 C ATOM 2006 C MET A 131 4.925 1.903 5.641 1.00 0.00 C ATOM 2007 O MET A 131 4.299 1.614 4.622 1.00 0.00 O ATOM 2008 CB MET A 131 4.087 0.979 7.791 1.00 0.00 C ATOM 2009 CG MET A 131 3.792 -0.350 8.493 1.00 0.00 C ATOM 2010 SD MET A 131 2.141 -1.034 8.203 1.00 0.00 S ATOM 2011 CE MET A 131 2.561 -2.554 7.312 1.00 0.00 C ATOM 0 H MET A 131 6.449 1.292 8.299 1.00 0.00 H new ATOM 0 HA MET A 131 5.106 -0.143 6.249 1.00 0.00 H new ATOM 0 HB2 MET A 131 4.411 1.713 8.529 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.170 1.361 7.342 1.00 0.00 H new ATOM 0 HG2 MET A 131 4.532 -1.083 8.171 1.00 0.00 H new ATOM 0 HG3 MET A 131 3.926 -0.212 9.566 1.00 0.00 H new ATOM 0 HE1 MET A 131 1.700 -2.885 6.732 1.00 0.00 H new ATOM 0 HE2 MET A 131 3.399 -2.363 6.641 1.00 0.00 H new ATOM 0 HE3 MET A 131 2.837 -3.330 8.026 1.00 0.00 H new ATOM 2021 N ASP A 132 5.439 3.120 5.845 1.00 0.00 N ATOM 2022 CA ASP A 132 5.371 4.208 4.874 1.00 0.00 C ATOM 2023 C ASP A 132 5.856 3.684 3.528 1.00 0.00 C ATOM 2024 O ASP A 132 5.104 3.691 2.556 1.00 0.00 O ATOM 2025 CB ASP A 132 6.177 5.437 5.308 1.00 0.00 C ATOM 2026 CG ASP A 132 5.725 5.955 6.669 1.00 0.00 C ATOM 2027 OD1 ASP A 132 4.558 6.374 6.795 1.00 0.00 O ATOM 2028 OD2 ASP A 132 6.451 5.751 7.671 1.00 0.00 O ATOM 0 H ASP A 132 5.922 3.378 6.706 1.00 0.00 H new ATOM 0 HA ASP A 132 4.336 4.542 4.799 1.00 0.00 H new ATOM 0 HB2 ASP A 132 7.236 5.182 5.349 1.00 0.00 H new ATOM 0 HB3 ASP A 132 6.068 6.226 4.564 1.00 0.00 H new ATOM 2033 N VAL A 133 7.069 3.130 3.504 1.00 0.00 N ATOM 2034 CA VAL A 133 7.661 2.492 2.343 1.00 0.00 C ATOM 2035 C VAL A 133 6.816 1.285 1.918 1.00 0.00 C ATOM 2036 O VAL A 133 6.117 1.381 0.917 1.00 0.00 O ATOM 2037 CB VAL A 133 9.144 2.182 2.627 1.00 0.00 C ATOM 2038 CG1 VAL A 133 9.834 1.496 1.454 1.00 0.00 C ATOM 2039 CG2 VAL A 133 9.916 3.482 2.892 1.00 0.00 C ATOM 0 H VAL A 133 7.680 3.116 4.321 1.00 0.00 H new ATOM 0 HA VAL A 133 7.657 3.160 1.482 1.00 0.00 H new ATOM 0 HB VAL A 133 9.151 1.520 3.493 1.00 0.00 H new ATOM 0 HG11 VAL A 133 10.876 1.301 1.708 1.00 0.00 H new ATOM 0 HG12 VAL A 133 9.331 0.554 1.236 1.00 0.00 H new ATOM 0 HG13 VAL A 133 9.789 2.142 0.577 1.00 0.00 H new ATOM 0 HG21 VAL A 133 10.962 3.250 3.091 1.00 0.00 H new ATOM 0 HG22 VAL A 133 9.848 4.130 2.018 1.00 0.00 H new ATOM 0 HG23 VAL A 133 9.487 3.991 3.755 1.00 0.00 H new ATOM 2049 N ALA A 134 6.811 0.168 2.653 1.00 0.00 N ATOM 2050 CA ALA A 134 6.337 -1.104 2.096 1.00 0.00 C ATOM 2051 C ALA A 134 4.837 -1.119 1.758 1.00 0.00 C ATOM 2052 O ALA A 134 4.406 -1.994 1.009 1.00 0.00 O ATOM 2053 CB ALA A 134 6.659 -2.232 3.074 1.00 0.00 C ATOM 0 H ALA A 134 7.125 0.118 3.622 1.00 0.00 H new ATOM 0 HA ALA A 134 6.859 -1.244 1.150 1.00 0.00 H new ATOM 0 HB1 ALA A 134 6.309 -3.180 2.665 1.00 0.00 H new ATOM 0 HB2 ALA A 134 7.737 -2.281 3.231 1.00 0.00 H new ATOM 0 HB3 ALA A 134 6.162 -2.042 4.025 1.00 0.00 H new ATOM 2059 N VAL A 135 4.028 -0.207 2.303 1.00 0.00 N ATOM 2060 CA VAL A 135 2.606 -0.083 1.971 1.00 0.00 C ATOM 2061 C VAL A 135 2.380 1.032 0.923 1.00 0.00 C ATOM 2062 O VAL A 135 1.330 1.082 0.291 1.00 0.00 O ATOM 2063 CB VAL A 135 1.781 0.106 3.260 1.00 0.00 C ATOM 2064 CG1 VAL A 135 0.280 -0.023 2.975 1.00 0.00 C ATOM 2065 CG2 VAL A 135 2.134 -0.878 4.394 1.00 0.00 C ATOM 0 H VAL A 135 4.345 0.473 2.994 1.00 0.00 H new ATOM 0 HA VAL A 135 2.255 -1.003 1.504 1.00 0.00 H new ATOM 0 HB VAL A 135 2.037 1.109 3.600 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -0.279 0.114 3.900 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -0.020 0.737 2.254 1.00 0.00 H new ATOM 0 HG13 VAL A 135 0.071 -1.012 2.568 1.00 0.00 H new ATOM 0 HG21 VAL A 135 1.506 -0.674 5.262 1.00 0.00 H new ATOM 0 HG22 VAL A 135 1.963 -1.900 4.055 1.00 0.00 H new ATOM 0 HG23 VAL A 135 3.182 -0.757 4.668 1.00 0.00 H new ATOM 2075 N GLY A 136 3.369 1.895 0.700 1.00 0.00 N ATOM 2076 CA GLY A 136 3.460 2.872 -0.383 1.00 0.00 C ATOM 2077 C GLY A 136 3.901 2.251 -1.711 1.00 0.00 C ATOM 2078 O GLY A 136 3.278 2.501 -2.737 1.00 0.00 O ATOM 0 H GLY A 136 4.183 1.933 1.313 1.00 0.00 H new ATOM 0 HA2 GLY A 136 2.490 3.351 -0.516 1.00 0.00 H new ATOM 0 HA3 GLY A 136 4.165 3.654 -0.102 1.00 0.00 H new ATOM 2082 N GLU A 137 4.971 1.455 -1.709 1.00 0.00 N ATOM 2083 CA GLU A 137 5.593 0.901 -2.920 1.00 0.00 C ATOM 2084 C GLU A 137 4.618 -0.023 -3.645 1.00 0.00 C ATOM 2085 O GLU A 137 4.392 0.090 -4.845 1.00 0.00 O ATOM 2086 CB GLU A 137 6.878 0.144 -2.550 1.00 0.00 C ATOM 2087 CG GLU A 137 7.919 1.117 -1.951 1.00 0.00 C ATOM 2088 CD GLU A 137 9.347 0.595 -1.886 1.00 0.00 C ATOM 2089 OE1 GLU A 137 9.578 -0.370 -1.128 1.00 0.00 O ATOM 2090 OE2 GLU A 137 10.255 1.298 -2.393 1.00 0.00 O ATOM 0 H GLU A 137 5.442 1.170 -0.850 1.00 0.00 H new ATOM 0 HA GLU A 137 5.850 1.721 -3.591 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.650 -0.644 -1.832 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.290 -0.341 -3.435 1.00 0.00 H new ATOM 0 HG2 GLU A 137 7.913 2.034 -2.540 1.00 0.00 H new ATOM 0 HG3 GLU A 137 7.602 1.383 -0.943 1.00 0.00 H new ATOM 2097 N ILE A 138 3.905 -0.846 -2.875 1.00 0.00 N ATOM 2098 CA ILE A 138 2.938 -1.817 -3.379 1.00 0.00 C ATOM 2099 C ILE A 138 1.774 -1.183 -4.180 1.00 0.00 C ATOM 2100 O ILE A 138 0.928 -1.890 -4.722 1.00 0.00 O ATOM 2101 CB ILE A 138 2.458 -2.671 -2.177 1.00 0.00 C ATOM 2102 CG1 ILE A 138 1.475 -3.798 -2.538 1.00 0.00 C ATOM 2103 CG2 ILE A 138 1.843 -1.828 -1.053 1.00 0.00 C ATOM 2104 CD1 ILE A 138 1.403 -4.945 -1.514 1.00 0.00 C ATOM 0 H ILE A 138 3.987 -0.855 -1.858 1.00 0.00 H new ATOM 0 HA ILE A 138 3.425 -2.456 -4.115 1.00 0.00 H new ATOM 0 HB ILE A 138 3.380 -3.135 -1.827 1.00 0.00 H new ATOM 0 HG12 ILE A 138 0.479 -3.369 -2.653 1.00 0.00 H new ATOM 0 HG13 ILE A 138 1.758 -4.211 -3.506 1.00 0.00 H new ATOM 0 HG21 ILE A 138 1.526 -2.481 -0.240 1.00 0.00 H new ATOM 0 HG22 ILE A 138 2.584 -1.120 -0.682 1.00 0.00 H new ATOM 0 HG23 ILE A 138 0.981 -1.283 -1.437 1.00 0.00 H new ATOM 0 HD11 ILE A 138 0.685 -5.691 -1.854 1.00 0.00 H new ATOM 0 HD12 ILE A 138 2.386 -5.406 -1.414 1.00 0.00 H new ATOM 0 HD13 ILE A 138 1.087 -4.551 -0.548 1.00 0.00 H new ATOM 2116 N LEU A 139 1.696 0.146 -4.222 1.00 0.00 N ATOM 2117 CA LEU A 139 0.705 0.945 -4.922 1.00 0.00 C ATOM 2118 C LEU A 139 1.297 1.537 -6.194 1.00 0.00 C ATOM 2119 O LEU A 139 0.650 1.592 -7.228 1.00 0.00 O ATOM 2120 CB LEU A 139 0.328 2.110 -4.017 1.00 0.00 C ATOM 2121 CG LEU A 139 -0.177 1.730 -2.621 1.00 0.00 C ATOM 2122 CD1 LEU A 139 -0.550 3.022 -1.904 1.00 0.00 C ATOM 2123 CD2 LEU A 139 -1.372 0.771 -2.650 1.00 0.00 C ATOM 0 H LEU A 139 2.374 0.729 -3.731 1.00 0.00 H new ATOM 0 HA LEU A 139 -0.150 0.318 -5.172 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.199 2.756 -3.905 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -0.443 2.698 -4.515 1.00 0.00 H new ATOM 0 HG LEU A 139 0.615 1.194 -2.097 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -0.915 2.790 -0.903 1.00 0.00 H new ATOM 0 HD12 LEU A 139 0.328 3.664 -1.830 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.330 3.537 -2.465 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -1.680 0.542 -1.630 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -2.200 1.238 -3.183 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.087 -0.150 -3.158 1.00 0.00 H new ATOM 2135 N ALA A 140 2.519 2.041 -6.097 1.00 0.00 N ATOM 2136 CA ALA A 140 3.306 2.453 -7.249 1.00 0.00 C ATOM 2137 C ALA A 140 3.327 1.358 -8.323 1.00 0.00 C ATOM 2138 O ALA A 140 3.354 1.680 -9.507 1.00 0.00 O ATOM 2139 CB ALA A 140 4.733 2.788 -6.800 1.00 0.00 C ATOM 0 H ALA A 140 2.997 2.177 -5.206 1.00 0.00 H new ATOM 0 HA ALA A 140 2.847 3.339 -7.687 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.323 3.097 -7.663 1.00 0.00 H new ATOM 0 HB2 ALA A 140 4.704 3.598 -6.071 1.00 0.00 H new ATOM 0 HB3 ALA A 140 5.188 1.908 -6.346 1.00 0.00 H new ATOM 2145 N GLU A 141 3.382 0.086 -7.937 1.00 0.00 N ATOM 2146 CA GLU A 141 3.799 -0.993 -8.822 1.00 0.00 C ATOM 2147 C GLU A 141 2.639 -1.875 -9.283 1.00 0.00 C ATOM 2148 O GLU A 141 2.494 -2.111 -10.489 1.00 0.00 O ATOM 2149 CB GLU A 141 4.892 -1.772 -8.090 1.00 0.00 C ATOM 2150 CG GLU A 141 6.198 -0.962 -8.152 1.00 0.00 C ATOM 2151 CD GLU A 141 6.841 -0.657 -6.797 1.00 0.00 C ATOM 2152 OE1 GLU A 141 6.859 -1.564 -5.941 1.00 0.00 O ATOM 2153 OE2 GLU A 141 7.322 0.496 -6.656 1.00 0.00 O ATOM 0 H GLU A 141 3.137 -0.225 -6.997 1.00 0.00 H new ATOM 0 HA GLU A 141 4.191 -0.583 -9.753 1.00 0.00 H new ATOM 0 HB2 GLU A 141 4.603 -1.945 -7.053 1.00 0.00 H new ATOM 0 HB3 GLU A 141 5.032 -2.750 -8.550 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.917 -1.508 -8.762 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.998 -0.019 -8.662 1.00 0.00 H new ATOM 2160 N VAL A 142 1.860 -2.429 -8.353 1.00 0.00 N ATOM 2161 CA VAL A 142 0.853 -3.448 -8.649 1.00 0.00 C ATOM 2162 C VAL A 142 -0.304 -2.778 -9.391 1.00 0.00 C ATOM 2163 O VAL A 142 -0.646 -3.287 -10.486 1.00 0.00 O ATOM 2164 CB VAL A 142 0.483 -4.196 -7.337 1.00 0.00 C ATOM 2165 CG1 VAL A 142 -0.999 -4.213 -6.940 1.00 0.00 C ATOM 2166 CG2 VAL A 142 0.963 -5.649 -7.438 1.00 0.00 C ATOM 0 H VAL A 142 1.911 -2.181 -7.365 1.00 0.00 H new ATOM 0 HA VAL A 142 1.218 -4.227 -9.318 1.00 0.00 H new ATOM 0 HB VAL A 142 0.981 -3.623 -6.555 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.120 -4.766 -6.008 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.351 -3.190 -6.803 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.581 -4.695 -7.726 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.708 -6.181 -6.522 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.479 -6.134 -8.286 1.00 0.00 H new ATOM 0 HG23 VAL A 142 2.044 -5.666 -7.578 1.00 0.00 H new TER 2176 VAL A 142