USER MOD reduce.3.24.130724 H: found=0, std=0, add=1450, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1448 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 21 SER OG : rot -43:sc= 1.2 USER MOD Set 1.2: B 80 TYR OH : rot 70:sc= 1.08 USER MOD Set 2.1: B 23 THR OG1 : rot 77:sc= 1.24 USER MOD Set 2.2: B 67 HIS :FLIP no HE2:sc= 0.379 F(o=-0.14,f=1.6) USER MOD Set 3.1: B 48 SER OG : rot -140:sc= 0 USER MOD Set 3.2: B 53 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 80 TYR OH : rot -93:sc= 1.23 USER MOD Set 4.2: A 84 HIS : no HE2:sc= 0.84 K(o=4.4,f=-1.3) USER MOD Set 4.3: B 21 SER OG : rot -114:sc= 2.29 USER MOD Set 4.4: B 79 TYR OH : rot 120:sc= 0 USER MOD Set 5.1: B 7 THR OG1 : rot 40:sc= 0.547 USER MOD Set 5.2: B 62 ASN : amide:sc= 0.282 K(o=0.83,f=0.12) USER MOD Set 6.1: A 48 SER OG : rot 86:sc= 0.29 USER MOD Set 6.2: A 53 TYR OH : rot -124:sc= 0.3 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -130:sc= 0.00336 (180deg=-0.047) USER MOD Single : A 4 THR OG1 : rot -90:sc= 0.523 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -1.89 K(o=-1.9,f=-6!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -129:sc= 0.0682 (180deg=-0.0148) USER MOD Single : A 23 THR OG1 : rot 72:sc= 1.23 USER MOD Single : A 26 THR OG1 : rot 86:sc= 1.25 USER MOD Single : A 28 TYR OH : rot 61:sc= 0.211 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 ASN :FLIP amide:sc=-0.00735 F(o=-1.6,f=-0.0074) USER MOD Single : A 41 GLN : amide:sc= -1.7 K(o=-1.7,f=-7.6!) USER MOD Single : A 45 TYR OH : rot 180:sc= -0.296 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -0.218 K(o=-0.22,f=-1.7!) USER MOD Single : A 62 ASN : amide:sc= 0.774 K(o=0.77,f=-4.6!) USER MOD Single : A 67 HIS : no HE2:sc= -0.16 K(o=-0.16,f=-0.95) USER MOD Single : A 73 MET CE :methyl -126:sc= -1.09 (180deg=-1.81!) USER MOD Single : A 77 THR OG1 : rot 75:sc= 0.636 USER MOD Single : A 78 LYS NZ :NH3+ 129:sc= -0.0161 (180deg=-1.11!) USER MOD Single : A 79 TYR OH : rot 150:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 1.23 K(o=1.2,f=-0.051) USER MOD Single : A 89 LYS NZ :NH3+ 160:sc= 0.729 (180deg=0.493) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -170:sc= 0 (180deg=-0.106) USER MOD Single : B 4 THR OG1 : rot -39:sc= 0.795 USER MOD Single : B 15 ASN : amide:sc= -1.67! C(o=-1.7!,f=-5.3!) USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ -156:sc= 2.3 (180deg=0.981) USER MOD Single : B 26 THR OG1 : rot 84:sc= 1.17 USER MOD Single : B 28 TYR OH : rot 47:sc= -0.591! USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 40 ASN : amide:sc= -0.629 K(o=-0.63,f=-2!) USER MOD Single : B 41 GLN : amide:sc= -1.54 K(o=-1.5,f=-5.6!) USER MOD Single : B 45 TYR OH : rot -141:sc= -0.994 USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 GLN : amide:sc= -0.117 K(o=-0.12,f=-0.67) USER MOD Single : B 73 MET CE :methyl 156:sc= -0.957 (180deg=-1.44) USER MOD Single : B 77 THR OG1 : rot 97:sc= 0.597 USER MOD Single : B 78 LYS NZ :NH3+ 175:sc= 0.393 (180deg=0.373) USER MOD Single : B 83 ASN : amide:sc= 1.12 K(o=1.1,f=-0.86) USER MOD Single : B 84 HIS : no HE2:sc= -1.37 X(o=-1.4,f=-0.88) USER MOD Single : B 89 LYS NZ :NH3+ 155:sc= 1.15 (180deg=0.66) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.335 20.268 0.121 1.00 53.11 N ATOM 2 CA MET A 1 -6.397 20.301 1.586 1.00 32.15 C ATOM 3 C MET A 1 -5.592 19.156 2.141 1.00 11.54 C ATOM 4 O MET A 1 -5.515 18.099 1.520 1.00 42.03 O ATOM 5 CB MET A 1 -7.841 20.196 2.078 1.00 51.43 C ATOM 6 CG MET A 1 -8.755 21.310 1.599 1.00 11.22 C ATOM 7 SD MET A 1 -8.172 22.941 2.075 1.00 33.32 S ATOM 8 CE MET A 1 -9.493 23.956 1.419 1.00 32.01 C ATOM 0 H1 MET A 1 -6.076 21.209 -0.237 1.00 53.11 H new ATOM 0 H2 MET A 1 -5.621 19.574 -0.181 1.00 53.11 H new ATOM 0 H3 MET A 1 -7.264 19.997 -0.260 1.00 53.11 H new ATOM 0 HA MET A 1 -5.987 21.251 1.930 1.00 32.15 H new ATOM 0 HB2 MET A 1 -8.253 19.241 1.753 1.00 51.43 H new ATOM 0 HB3 MET A 1 -7.840 20.188 3.168 1.00 51.43 H new ATOM 0 HG2 MET A 1 -8.841 21.262 0.513 1.00 11.22 H new ATOM 0 HG3 MET A 1 -9.755 21.154 2.005 1.00 11.22 H new ATOM 0 HE1 MET A 1 -9.285 25.005 1.631 1.00 32.01 H new ATOM 0 HE2 MET A 1 -9.563 23.810 0.341 1.00 32.01 H new ATOM 0 HE3 MET A 1 -10.436 23.672 1.885 1.00 32.01 H new ATOM 20 N GLY A 2 -4.996 19.350 3.293 1.00 42.42 N ATOM 21 CA GLY A 2 -4.176 18.318 3.872 1.00 44.14 C ATOM 22 C GLY A 2 -4.821 17.684 5.076 1.00 62.51 C ATOM 23 O GLY A 2 -5.239 16.519 5.021 1.00 30.03 O ATOM 0 H GLY A 2 -5.063 20.206 3.843 1.00 42.42 H new ATOM 0 HA2 GLY A 2 -3.978 17.551 3.123 1.00 44.14 H new ATOM 0 HA3 GLY A 2 -3.213 18.740 4.159 1.00 44.14 H new ATOM 27 N PHE A 3 -4.904 18.461 6.163 1.00 62.23 N ATOM 28 CA PHE A 3 -5.468 18.029 7.461 1.00 2.32 C ATOM 29 C PHE A 3 -4.593 17.018 8.179 1.00 3.13 C ATOM 30 O PHE A 3 -4.972 16.486 9.221 1.00 32.42 O ATOM 31 CB PHE A 3 -6.920 17.535 7.353 1.00 22.44 C ATOM 32 CG PHE A 3 -7.902 18.621 7.047 1.00 25.13 C ATOM 33 CD1 PHE A 3 -8.398 19.414 8.069 1.00 22.41 C ATOM 34 CD2 PHE A 3 -8.326 18.861 5.752 1.00 44.01 C ATOM 35 CE1 PHE A 3 -9.295 20.419 7.811 1.00 74.33 C ATOM 36 CE2 PHE A 3 -9.228 19.870 5.489 1.00 51.24 C ATOM 37 CZ PHE A 3 -9.711 20.650 6.521 1.00 53.44 C ATOM 0 H PHE A 3 -4.577 19.427 6.172 1.00 62.23 H new ATOM 0 HA PHE A 3 -5.485 18.929 8.075 1.00 2.32 H new ATOM 0 HB2 PHE A 3 -6.979 16.774 6.575 1.00 22.44 H new ATOM 0 HB3 PHE A 3 -7.202 17.055 8.290 1.00 22.44 H new ATOM 0 HD1 PHE A 3 -8.074 19.238 9.084 1.00 22.41 H new ATOM 0 HD2 PHE A 3 -7.948 18.254 4.942 1.00 44.01 H new ATOM 0 HE1 PHE A 3 -9.674 21.027 8.619 1.00 74.33 H new ATOM 0 HE2 PHE A 3 -9.557 20.050 4.476 1.00 51.24 H new ATOM 0 HZ PHE A 3 -10.416 21.442 6.315 1.00 53.44 H new ATOM 47 N THR A 4 -3.421 16.804 7.657 1.00 13.33 N ATOM 48 CA THR A 4 -2.500 15.870 8.219 1.00 55.41 C ATOM 49 C THR A 4 -1.392 16.625 8.952 1.00 3.15 C ATOM 50 O THR A 4 -0.834 17.605 8.426 1.00 73.12 O ATOM 51 CB THR A 4 -1.911 14.928 7.110 1.00 11.23 C ATOM 52 OG1 THR A 4 -0.977 13.984 7.662 1.00 33.25 O ATOM 53 CG2 THR A 4 -1.240 15.727 5.994 1.00 62.14 C ATOM 0 H THR A 4 -3.078 17.279 6.822 1.00 13.33 H new ATOM 0 HA THR A 4 -3.025 15.237 8.935 1.00 55.41 H new ATOM 0 HB THR A 4 -2.751 14.378 6.686 1.00 11.23 H new ATOM 0 HG1 THR A 4 -0.075 14.367 7.644 1.00 33.25 H new ATOM 0 HG21 THR A 4 -0.844 15.042 5.244 1.00 62.14 H new ATOM 0 HG22 THR A 4 -1.971 16.389 5.531 1.00 62.14 H new ATOM 0 HG23 THR A 4 -0.426 16.320 6.410 1.00 62.14 H new ATOM 61 N ASP A 5 -1.114 16.214 10.159 1.00 61.34 N ATOM 62 CA ASP A 5 -0.064 16.819 10.947 1.00 24.31 C ATOM 63 C ASP A 5 0.474 15.818 11.921 1.00 25.43 C ATOM 64 O ASP A 5 -0.204 14.827 12.259 1.00 51.13 O ATOM 65 CB ASP A 5 -0.539 18.076 11.707 1.00 23.51 C ATOM 66 CG ASP A 5 -1.588 17.802 12.765 1.00 5.21 C ATOM 67 OD1 ASP A 5 -2.786 17.892 12.466 1.00 13.03 O ATOM 68 OD2 ASP A 5 -1.230 17.523 13.924 1.00 72.41 O ATOM 0 H ASP A 5 -1.605 15.452 10.627 1.00 61.34 H new ATOM 0 HA ASP A 5 0.717 17.135 10.255 1.00 24.31 H new ATOM 0 HB2 ASP A 5 0.322 18.549 12.179 1.00 23.51 H new ATOM 0 HB3 ASP A 5 -0.941 18.791 10.989 1.00 23.51 H new ATOM 73 N GLU A 6 1.673 16.043 12.350 1.00 10.24 N ATOM 74 CA GLU A 6 2.307 15.206 13.315 1.00 15.41 C ATOM 75 C GLU A 6 3.002 16.162 14.272 1.00 44.11 C ATOM 76 O GLU A 6 3.763 17.032 13.835 1.00 34.43 O ATOM 77 CB GLU A 6 3.335 14.287 12.599 1.00 60.30 C ATOM 78 CG GLU A 6 3.638 12.941 13.290 1.00 75.30 C ATOM 79 CD GLU A 6 4.214 13.035 14.688 1.00 20.24 C ATOM 80 OE1 GLU A 6 5.423 12.807 14.854 1.00 4.32 O ATOM 81 OE2 GLU A 6 3.446 13.301 15.644 1.00 54.33 O ATOM 0 H GLU A 6 2.248 16.825 12.035 1.00 10.24 H new ATOM 0 HA GLU A 6 1.607 14.558 13.843 1.00 15.41 H new ATOM 0 HB2 GLU A 6 2.969 14.082 11.593 1.00 60.30 H new ATOM 0 HB3 GLU A 6 4.270 14.836 12.492 1.00 60.30 H new ATOM 0 HG2 GLU A 6 2.716 12.361 13.335 1.00 75.30 H new ATOM 0 HG3 GLU A 6 4.336 12.382 12.666 1.00 75.30 H new ATOM 88 N THR A 7 2.704 16.068 15.537 1.00 74.04 N ATOM 89 CA THR A 7 3.316 16.937 16.502 1.00 64.02 C ATOM 90 C THR A 7 4.696 16.391 16.848 1.00 52.50 C ATOM 91 O THR A 7 4.860 15.549 17.756 1.00 41.41 O ATOM 92 CB THR A 7 2.442 17.086 17.760 1.00 13.32 C ATOM 93 OG1 THR A 7 1.123 17.480 17.351 1.00 3.11 O ATOM 94 CG2 THR A 7 3.008 18.153 18.692 1.00 41.50 C ATOM 0 H THR A 7 2.040 15.397 15.924 1.00 74.04 H new ATOM 0 HA THR A 7 3.418 17.934 16.074 1.00 64.02 H new ATOM 0 HB THR A 7 2.420 16.135 18.293 1.00 13.32 H new ATOM 0 HG1 THR A 7 0.551 17.578 18.141 1.00 3.11 H new ATOM 0 HG21 THR A 7 2.373 18.240 19.574 1.00 41.50 H new ATOM 0 HG22 THR A 7 4.016 17.872 18.997 1.00 41.50 H new ATOM 0 HG23 THR A 7 3.040 19.110 18.172 1.00 41.50 H new ATOM 102 N VAL A 8 5.668 16.822 16.091 1.00 70.00 N ATOM 103 CA VAL A 8 6.987 16.305 16.201 1.00 12.01 C ATOM 104 C VAL A 8 8.031 17.403 16.103 1.00 24.30 C ATOM 105 O VAL A 8 7.909 18.326 15.303 1.00 33.44 O ATOM 106 CB VAL A 8 7.236 15.233 15.090 1.00 0.13 C ATOM 107 CG1 VAL A 8 7.061 15.809 13.686 1.00 41.24 C ATOM 108 CG2 VAL A 8 8.594 14.591 15.240 1.00 34.21 C ATOM 0 H VAL A 8 5.558 17.545 15.380 1.00 70.00 H new ATOM 0 HA VAL A 8 7.081 15.842 17.183 1.00 12.01 H new ATOM 0 HB VAL A 8 6.478 14.461 15.222 1.00 0.13 H new ATOM 0 HG11 VAL A 8 7.244 15.029 12.947 1.00 41.24 H new ATOM 0 HG12 VAL A 8 6.045 16.186 13.572 1.00 41.24 H new ATOM 0 HG13 VAL A 8 7.769 16.624 13.536 1.00 41.24 H new ATOM 0 HG21 VAL A 8 8.736 13.851 14.452 1.00 34.21 H new ATOM 0 HG22 VAL A 8 9.368 15.355 15.164 1.00 34.21 H new ATOM 0 HG23 VAL A 8 8.660 14.103 16.212 1.00 34.21 H new ATOM 118 N ARG A 9 9.017 17.318 16.954 1.00 21.24 N ATOM 119 CA ARG A 9 10.172 18.166 16.895 1.00 23.15 C ATOM 120 C ARG A 9 11.363 17.274 16.625 1.00 73.35 C ATOM 121 O ARG A 9 12.049 16.807 17.547 1.00 73.35 O ATOM 122 CB ARG A 9 10.361 18.978 18.184 1.00 4.51 C ATOM 123 CG ARG A 9 9.220 19.942 18.480 1.00 22.01 C ATOM 124 CD ARG A 9 9.448 20.686 19.784 1.00 55.43 C ATOM 125 NE ARG A 9 8.359 21.628 20.071 1.00 41.14 N ATOM 126 CZ ARG A 9 8.117 22.205 21.255 1.00 42.11 C ATOM 127 NH1 ARG A 9 8.893 21.953 22.307 1.00 43.44 N ATOM 128 NH2 ARG A 9 7.093 23.045 21.380 1.00 21.21 N ATOM 0 H ARG A 9 9.039 16.645 17.720 1.00 21.24 H new ATOM 0 HA ARG A 9 10.053 18.903 16.101 1.00 23.15 H new ATOM 0 HB2 ARG A 9 10.469 18.290 19.022 1.00 4.51 H new ATOM 0 HB3 ARG A 9 11.291 19.542 18.113 1.00 4.51 H new ATOM 0 HG2 ARG A 9 9.125 20.657 17.663 1.00 22.01 H new ATOM 0 HG3 ARG A 9 8.281 19.391 18.533 1.00 22.01 H new ATOM 0 HD2 ARG A 9 9.534 19.970 20.601 1.00 55.43 H new ATOM 0 HD3 ARG A 9 10.393 21.227 19.734 1.00 55.43 H new ATOM 0 HE ARG A 9 7.732 21.863 19.302 1.00 41.14 H new ATOM 0 HH11 ARG A 9 9.683 21.314 22.217 1.00 43.44 H new ATOM 0 HH12 ARG A 9 8.698 22.399 23.203 1.00 43.44 H new ATOM 0 HH21 ARG A 9 6.497 23.246 20.577 1.00 21.21 H new ATOM 0 HH22 ARG A 9 6.903 23.488 22.279 1.00 21.21 H new ATOM 142 N PHE A 10 11.532 16.960 15.368 1.00 55.24 N ATOM 143 CA PHE A 10 12.533 16.033 14.902 1.00 44.12 C ATOM 144 C PHE A 10 12.780 16.339 13.438 1.00 23.30 C ATOM 145 O PHE A 10 11.867 16.226 12.619 1.00 10.14 O ATOM 146 CB PHE A 10 11.977 14.610 15.086 1.00 34.33 C ATOM 147 CG PHE A 10 12.870 13.479 14.702 1.00 14.41 C ATOM 148 CD1 PHE A 10 13.888 13.067 15.537 1.00 75.43 C ATOM 149 CD2 PHE A 10 12.663 12.802 13.520 1.00 61.15 C ATOM 150 CE1 PHE A 10 14.687 11.999 15.196 1.00 32.43 C ATOM 151 CE2 PHE A 10 13.455 11.743 13.170 1.00 23.13 C ATOM 152 CZ PHE A 10 14.471 11.335 14.009 1.00 61.11 C ATOM 0 H PHE A 10 10.962 17.352 14.618 1.00 55.24 H new ATOM 0 HA PHE A 10 13.471 16.117 15.451 1.00 44.12 H new ATOM 0 HB2 PHE A 10 11.705 14.486 16.134 1.00 34.33 H new ATOM 0 HB3 PHE A 10 11.058 14.528 14.506 1.00 34.33 H new ATOM 0 HD1 PHE A 10 14.060 13.588 16.468 1.00 75.43 H new ATOM 0 HD2 PHE A 10 11.865 13.111 12.861 1.00 61.15 H new ATOM 0 HE1 PHE A 10 15.480 11.683 15.857 1.00 32.43 H new ATOM 0 HE2 PHE A 10 13.285 11.226 12.237 1.00 23.13 H new ATOM 0 HZ PHE A 10 15.095 10.497 13.736 1.00 61.11 H new ATOM 162 N ASP A 11 13.989 16.741 13.125 1.00 2.32 N ATOM 163 CA ASP A 11 14.351 17.197 11.779 1.00 54.50 C ATOM 164 C ASP A 11 14.147 16.126 10.735 1.00 34.04 C ATOM 165 O ASP A 11 13.378 16.307 9.789 1.00 65.23 O ATOM 166 CB ASP A 11 15.802 17.704 11.733 1.00 65.45 C ATOM 167 CG ASP A 11 16.034 18.886 12.630 1.00 2.11 C ATOM 168 OD1 ASP A 11 15.875 20.027 12.170 1.00 4.22 O ATOM 169 OD2 ASP A 11 16.365 18.697 13.818 1.00 40.30 O ATOM 0 H ASP A 11 14.761 16.766 13.791 1.00 2.32 H new ATOM 0 HA ASP A 11 13.679 18.023 11.544 1.00 54.50 H new ATOM 0 HB2 ASP A 11 16.474 16.896 12.023 1.00 65.45 H new ATOM 0 HB3 ASP A 11 16.055 17.976 10.708 1.00 65.45 H new ATOM 174 N PHE A 12 14.822 15.021 10.904 1.00 21.01 N ATOM 175 CA PHE A 12 14.754 13.922 9.966 1.00 40.40 C ATOM 176 C PHE A 12 15.420 12.725 10.581 1.00 74.23 C ATOM 177 O PHE A 12 16.234 12.862 11.506 1.00 4.42 O ATOM 178 CB PHE A 12 15.470 14.276 8.627 1.00 2.04 C ATOM 179 CG PHE A 12 16.955 14.535 8.772 1.00 0.22 C ATOM 180 CD1 PHE A 12 17.421 15.781 9.141 1.00 62.30 C ATOM 181 CD2 PHE A 12 17.877 13.517 8.556 1.00 53.11 C ATOM 182 CE1 PHE A 12 18.767 16.018 9.289 1.00 13.45 C ATOM 183 CE2 PHE A 12 19.227 13.748 8.705 1.00 53.25 C ATOM 184 CZ PHE A 12 19.673 14.999 9.073 1.00 53.52 C ATOM 0 H PHE A 12 15.439 14.852 11.699 1.00 21.01 H new ATOM 0 HA PHE A 12 13.707 13.713 9.746 1.00 40.40 H new ATOM 0 HB2 PHE A 12 15.321 13.459 7.921 1.00 2.04 H new ATOM 0 HB3 PHE A 12 14.998 15.159 8.197 1.00 2.04 H new ATOM 0 HD1 PHE A 12 16.718 16.582 9.316 1.00 62.30 H new ATOM 0 HD2 PHE A 12 17.531 12.535 8.268 1.00 53.11 H new ATOM 0 HE1 PHE A 12 19.115 17.000 9.574 1.00 13.45 H new ATOM 0 HE2 PHE A 12 19.934 12.950 8.534 1.00 53.25 H new ATOM 0 HZ PHE A 12 20.731 15.182 9.192 1.00 53.52 H new ATOM 194 N ASP A 13 15.092 11.580 10.106 1.00 20.13 N ATOM 195 CA ASP A 13 15.729 10.378 10.560 1.00 23.41 C ATOM 196 C ASP A 13 16.735 9.935 9.537 1.00 33.10 C ATOM 197 O ASP A 13 16.468 9.974 8.336 1.00 41.30 O ATOM 198 CB ASP A 13 14.709 9.241 10.835 1.00 72.41 C ATOM 199 CG ASP A 13 13.878 8.846 9.623 1.00 11.45 C ATOM 200 OD1 ASP A 13 14.279 7.936 8.879 1.00 50.55 O ATOM 201 OD2 ASP A 13 12.801 9.436 9.411 1.00 43.43 O ATOM 0 H ASP A 13 14.377 11.439 9.392 1.00 20.13 H new ATOM 0 HA ASP A 13 16.226 10.596 11.505 1.00 23.41 H new ATOM 0 HB2 ASP A 13 15.247 8.364 11.195 1.00 72.41 H new ATOM 0 HB3 ASP A 13 14.039 9.554 11.635 1.00 72.41 H new ATOM 206 N ASP A 14 17.904 9.583 9.983 1.00 51.20 N ATOM 207 CA ASP A 14 18.861 8.995 9.091 1.00 42.32 C ATOM 208 C ASP A 14 18.812 7.530 9.320 1.00 64.24 C ATOM 209 O ASP A 14 19.477 6.995 10.216 1.00 4.42 O ATOM 210 CB ASP A 14 20.295 9.539 9.264 1.00 14.12 C ATOM 211 CG ASP A 14 21.294 8.898 8.282 1.00 75.50 C ATOM 212 OD1 ASP A 14 21.414 9.372 7.134 1.00 2.35 O ATOM 213 OD2 ASP A 14 21.991 7.926 8.657 1.00 0.52 O ATOM 0 H ASP A 14 18.217 9.690 10.948 1.00 51.20 H new ATOM 0 HA ASP A 14 18.597 9.255 8.066 1.00 42.32 H new ATOM 0 HB2 ASP A 14 20.290 10.619 9.118 1.00 14.12 H new ATOM 0 HB3 ASP A 14 20.628 9.357 10.286 1.00 14.12 H new ATOM 218 N ASN A 15 17.935 6.905 8.607 1.00 21.15 N ATOM 219 CA ASN A 15 17.743 5.494 8.682 1.00 12.43 C ATOM 220 C ASN A 15 17.412 5.015 7.296 1.00 43.33 C ATOM 221 O ASN A 15 16.263 4.696 6.970 1.00 74.31 O ATOM 222 CB ASN A 15 16.611 5.117 9.676 1.00 64.11 C ATOM 223 CG ASN A 15 16.474 3.603 9.931 1.00 53.40 C ATOM 224 OD1 ASN A 15 16.818 2.768 9.096 1.00 45.05 O ATOM 225 ND2 ASN A 15 15.941 3.249 11.078 1.00 3.42 N ATOM 0 H ASN A 15 17.318 7.371 7.941 1.00 21.15 H new ATOM 0 HA ASN A 15 18.650 5.017 9.054 1.00 12.43 H new ATOM 0 HB2 ASN A 15 16.794 5.619 10.626 1.00 64.11 H new ATOM 0 HB3 ASN A 15 15.664 5.497 9.292 1.00 64.11 H new ATOM 0 HD21 ASN A 15 15.804 2.261 11.293 1.00 3.42 H new ATOM 0 HD22 ASN A 15 15.664 3.962 11.753 1.00 3.42 H new ATOM 232 N ARG A 16 18.384 5.067 6.446 1.00 30.43 N ATOM 233 CA ARG A 16 18.201 4.599 5.122 1.00 44.15 C ATOM 234 C ARG A 16 18.686 3.195 5.060 1.00 14.30 C ATOM 235 O ARG A 16 19.851 2.911 4.773 1.00 2.44 O ATOM 236 CB ARG A 16 18.808 5.535 4.073 1.00 42.30 C ATOM 237 CG ARG A 16 18.188 6.930 4.141 1.00 21.20 C ATOM 238 CD ARG A 16 18.631 7.842 3.014 1.00 50.22 C ATOM 239 NE ARG A 16 20.069 8.120 2.993 1.00 1.10 N ATOM 240 CZ ARG A 16 20.644 9.013 2.164 1.00 32.11 C ATOM 241 NH1 ARG A 16 19.886 9.765 1.366 1.00 1.00 N ATOM 242 NH2 ARG A 16 21.957 9.170 2.153 1.00 24.45 N ATOM 0 H ARG A 16 19.315 5.431 6.651 1.00 30.43 H new ATOM 0 HA ARG A 16 17.142 4.602 4.863 1.00 44.15 H new ATOM 0 HB2 ARG A 16 19.885 5.606 4.227 1.00 42.30 H new ATOM 0 HB3 ARG A 16 18.655 5.116 3.078 1.00 42.30 H new ATOM 0 HG2 ARG A 16 17.102 6.838 4.119 1.00 21.20 H new ATOM 0 HG3 ARG A 16 18.449 7.389 5.094 1.00 21.20 H new ATOM 0 HD2 ARG A 16 18.346 7.390 2.064 1.00 50.22 H new ATOM 0 HD3 ARG A 16 18.092 8.786 3.093 1.00 50.22 H new ATOM 0 HE ARG A 16 20.668 7.609 3.642 1.00 1.10 H new ATOM 0 HH11 ARG A 16 18.871 9.664 1.383 1.00 1.00 H new ATOM 0 HH12 ARG A 16 20.321 10.441 0.738 1.00 1.00 H new ATOM 0 HH21 ARG A 16 22.542 8.613 2.775 1.00 24.45 H new ATOM 0 HH22 ARG A 16 22.384 9.848 1.522 1.00 24.45 H new ATOM 256 N LYS A 17 17.789 2.343 5.447 1.00 42.00 N ATOM 257 CA LYS A 17 17.987 0.940 5.642 1.00 5.43 C ATOM 258 C LYS A 17 16.620 0.324 5.318 1.00 52.15 C ATOM 259 O LYS A 17 15.823 0.978 4.645 1.00 34.30 O ATOM 260 CB LYS A 17 18.365 0.769 7.145 1.00 64.34 C ATOM 261 CG LYS A 17 18.815 -0.616 7.613 1.00 3.53 C ATOM 262 CD LYS A 17 19.129 -0.626 9.109 1.00 43.22 C ATOM 263 CE LYS A 17 20.271 0.322 9.463 1.00 13.31 C ATOM 264 NZ LYS A 17 20.567 0.311 10.909 1.00 72.51 N ATOM 0 H LYS A 17 16.831 2.630 5.649 1.00 42.00 H new ATOM 0 HA LYS A 17 18.764 0.477 5.034 1.00 5.43 H new ATOM 0 HB2 LYS A 17 19.163 1.475 7.372 1.00 64.34 H new ATOM 0 HB3 LYS A 17 17.502 1.061 7.743 1.00 64.34 H new ATOM 0 HG2 LYS A 17 18.034 -1.345 7.399 1.00 3.53 H new ATOM 0 HG3 LYS A 17 19.698 -0.922 7.052 1.00 3.53 H new ATOM 0 HD2 LYS A 17 18.237 -0.343 9.668 1.00 43.22 H new ATOM 0 HD3 LYS A 17 19.390 -1.638 9.417 1.00 43.22 H new ATOM 0 HE2 LYS A 17 21.165 0.037 8.907 1.00 13.31 H new ATOM 0 HE3 LYS A 17 20.012 1.334 9.153 1.00 13.31 H new ATOM 0 HZ1 LYS A 17 21.348 0.968 11.108 1.00 72.51 H new ATOM 0 HZ2 LYS A 17 19.722 0.607 11.439 1.00 72.51 H new ATOM 0 HZ3 LYS A 17 20.839 -0.650 11.200 1.00 72.51 H new ATOM 278 N LYS A 18 16.324 -0.877 5.766 1.00 15.50 N ATOM 279 CA LYS A 18 15.010 -1.482 5.517 1.00 74.35 C ATOM 280 C LYS A 18 13.938 -0.879 6.478 1.00 13.42 C ATOM 281 O LYS A 18 12.981 -1.533 6.804 1.00 1.11 O ATOM 282 CB LYS A 18 15.075 -3.018 5.729 1.00 0.14 C ATOM 283 CG LYS A 18 15.234 -3.467 7.187 1.00 30.41 C ATOM 284 CD LYS A 18 15.189 -4.984 7.312 1.00 20.44 C ATOM 285 CE LYS A 18 15.101 -5.432 8.771 1.00 4.10 C ATOM 286 NZ LYS A 18 16.234 -4.961 9.586 1.00 22.12 N ATOM 0 H LYS A 18 16.965 -1.461 6.304 1.00 15.50 H new ATOM 0 HA LYS A 18 14.730 -1.268 4.486 1.00 74.35 H new ATOM 0 HB2 LYS A 18 14.166 -3.464 5.325 1.00 0.14 H new ATOM 0 HB3 LYS A 18 15.909 -3.414 5.150 1.00 0.14 H new ATOM 0 HG2 LYS A 18 16.180 -3.096 7.582 1.00 30.41 H new ATOM 0 HG3 LYS A 18 14.442 -3.027 7.793 1.00 30.41 H new ATOM 0 HD2 LYS A 18 14.330 -5.369 6.761 1.00 20.44 H new ATOM 0 HD3 LYS A 18 16.080 -5.413 6.853 1.00 20.44 H new ATOM 0 HE2 LYS A 18 14.171 -5.063 9.203 1.00 4.10 H new ATOM 0 HE3 LYS A 18 15.060 -6.521 8.809 1.00 4.10 H new ATOM 0 HZ1 LYS A 18 16.648 -5.764 10.102 1.00 22.12 H new ATOM 0 HZ2 LYS A 18 16.955 -4.538 8.967 1.00 22.12 H new ATOM 0 HZ3 LYS A 18 15.900 -4.248 10.266 1.00 22.12 H new ATOM 300 N ALA A 19 14.088 0.387 6.835 1.00 65.20 N ATOM 301 CA ALA A 19 13.240 1.061 7.834 1.00 51.45 C ATOM 302 C ALA A 19 11.743 0.991 7.524 1.00 14.32 C ATOM 303 O ALA A 19 10.937 0.638 8.396 1.00 34.13 O ATOM 304 CB ALA A 19 13.648 2.489 7.952 1.00 63.12 C ATOM 0 H ALA A 19 14.808 0.992 6.440 1.00 65.20 H new ATOM 0 HA ALA A 19 13.391 0.528 8.773 1.00 51.45 H new ATOM 0 HB1 ALA A 19 13.020 2.987 8.691 1.00 63.12 H new ATOM 0 HB2 ALA A 19 14.691 2.545 8.265 1.00 63.12 H new ATOM 0 HB3 ALA A 19 13.532 2.982 6.987 1.00 63.12 H new ATOM 310 N ILE A 20 11.363 1.315 6.300 1.00 3.42 N ATOM 311 CA ILE A 20 9.960 1.269 5.917 1.00 61.23 C ATOM 312 C ILE A 20 9.484 -0.182 5.893 1.00 64.20 C ATOM 313 O ILE A 20 8.354 -0.497 6.299 1.00 72.03 O ATOM 314 CB ILE A 20 9.697 1.968 4.543 1.00 25.32 C ATOM 315 CG1 ILE A 20 10.033 3.470 4.643 1.00 3.15 C ATOM 316 CG2 ILE A 20 8.250 1.769 4.088 1.00 72.01 C ATOM 317 CD1 ILE A 20 9.813 4.247 3.357 1.00 53.21 C ATOM 0 H ILE A 20 11.999 1.610 5.559 1.00 3.42 H new ATOM 0 HA ILE A 20 9.389 1.825 6.661 1.00 61.23 H new ATOM 0 HB ILE A 20 10.344 1.509 3.796 1.00 25.32 H new ATOM 0 HG12 ILE A 20 9.425 3.915 5.431 1.00 3.15 H new ATOM 0 HG13 ILE A 20 11.075 3.578 4.945 1.00 3.15 H new ATOM 0 HG21 ILE A 20 8.098 2.266 3.130 1.00 72.01 H new ATOM 0 HG22 ILE A 20 8.046 0.704 3.980 1.00 72.01 H new ATOM 0 HG23 ILE A 20 7.574 2.195 4.829 1.00 72.01 H new ATOM 0 HD11 ILE A 20 10.073 5.294 3.515 1.00 53.21 H new ATOM 0 HD12 ILE A 20 10.442 3.832 2.569 1.00 53.21 H new ATOM 0 HD13 ILE A 20 8.766 4.174 3.062 1.00 53.21 H new ATOM 329 N SER A 21 10.372 -1.058 5.482 1.00 44.55 N ATOM 330 CA SER A 21 10.079 -2.476 5.429 1.00 62.32 C ATOM 331 C SER A 21 9.887 -3.016 6.853 1.00 54.13 C ATOM 332 O SER A 21 8.942 -3.754 7.132 1.00 63.30 O ATOM 333 CB SER A 21 11.222 -3.211 4.731 1.00 20.32 C ATOM 334 OG SER A 21 11.463 -2.675 3.438 1.00 64.12 O ATOM 0 H SER A 21 11.313 -0.812 5.176 1.00 44.55 H new ATOM 0 HA SER A 21 9.161 -2.638 4.865 1.00 62.32 H new ATOM 0 HB2 SER A 21 12.127 -3.136 5.333 1.00 20.32 H new ATOM 0 HB3 SER A 21 10.980 -4.271 4.649 1.00 20.32 H new ATOM 0 HG SER A 21 10.608 -2.515 2.986 1.00 64.12 H new ATOM 340 N GLU A 22 10.790 -2.597 7.734 1.00 1.45 N ATOM 341 CA GLU A 22 10.808 -2.939 9.149 1.00 41.15 C ATOM 342 C GLU A 22 9.476 -2.545 9.769 1.00 11.42 C ATOM 343 O GLU A 22 8.828 -3.338 10.461 1.00 63.54 O ATOM 344 CB GLU A 22 11.922 -2.108 9.814 1.00 61.42 C ATOM 345 CG GLU A 22 12.180 -2.396 11.279 1.00 32.33 C ATOM 346 CD GLU A 22 12.822 -3.734 11.501 1.00 30.23 C ATOM 347 OE1 GLU A 22 12.113 -4.725 11.684 1.00 64.32 O ATOM 348 OE2 GLU A 22 14.075 -3.800 11.507 1.00 12.22 O ATOM 0 H GLU A 22 11.561 -1.984 7.468 1.00 1.45 H new ATOM 0 HA GLU A 22 10.978 -4.007 9.286 1.00 41.15 H new ATOM 0 HB2 GLU A 22 12.848 -2.272 9.263 1.00 61.42 H new ATOM 0 HB3 GLU A 22 11.672 -1.052 9.710 1.00 61.42 H new ATOM 0 HG2 GLU A 22 12.821 -1.617 11.691 1.00 32.33 H new ATOM 0 HG3 GLU A 22 11.237 -2.355 11.825 1.00 32.33 H new ATOM 355 N THR A 23 9.071 -1.323 9.478 1.00 32.03 N ATOM 356 CA THR A 23 7.852 -0.754 9.993 1.00 34.01 C ATOM 357 C THR A 23 6.635 -1.606 9.598 1.00 53.30 C ATOM 358 O THR A 23 5.878 -2.059 10.461 1.00 2.31 O ATOM 359 CB THR A 23 7.679 0.687 9.452 1.00 14.45 C ATOM 360 OG1 THR A 23 8.822 1.484 9.823 1.00 54.13 O ATOM 361 CG2 THR A 23 6.415 1.333 10.000 1.00 50.11 C ATOM 0 H THR A 23 9.592 -0.693 8.868 1.00 32.03 H new ATOM 0 HA THR A 23 7.916 -0.733 11.081 1.00 34.01 H new ATOM 0 HB THR A 23 7.596 0.634 8.366 1.00 14.45 H new ATOM 0 HG1 THR A 23 9.598 1.211 9.291 1.00 54.13 H new ATOM 0 HG21 THR A 23 6.321 2.344 9.602 1.00 50.11 H new ATOM 0 HG22 THR A 23 5.547 0.744 9.703 1.00 50.11 H new ATOM 0 HG23 THR A 23 6.470 1.375 11.088 1.00 50.11 H new ATOM 369 N LEU A 24 6.501 -1.880 8.313 1.00 63.44 N ATOM 370 CA LEU A 24 5.351 -2.608 7.806 1.00 72.34 C ATOM 371 C LEU A 24 5.355 -4.065 8.236 1.00 40.25 C ATOM 372 O LEU A 24 4.298 -4.631 8.523 1.00 64.03 O ATOM 373 CB LEU A 24 5.250 -2.483 6.293 1.00 51.11 C ATOM 374 CG LEU A 24 5.082 -1.062 5.755 1.00 22.33 C ATOM 375 CD1 LEU A 24 5.014 -1.079 4.251 1.00 32.11 C ATOM 376 CD2 LEU A 24 3.837 -0.398 6.338 1.00 73.01 C ATOM 0 H LEU A 24 7.177 -1.608 7.599 1.00 63.44 H new ATOM 0 HA LEU A 24 4.465 -2.151 8.247 1.00 72.34 H new ATOM 0 HB2 LEU A 24 6.147 -2.916 5.850 1.00 51.11 H new ATOM 0 HB3 LEU A 24 4.406 -3.083 5.953 1.00 51.11 H new ATOM 0 HG LEU A 24 5.949 -0.477 6.061 1.00 22.33 H new ATOM 0 HD11 LEU A 24 4.894 -0.061 3.881 1.00 32.11 H new ATOM 0 HD12 LEU A 24 5.934 -1.505 3.850 1.00 32.11 H new ATOM 0 HD13 LEU A 24 4.165 -1.683 3.932 1.00 32.11 H new ATOM 0 HD21 LEU A 24 3.742 0.612 5.938 1.00 73.01 H new ATOM 0 HD22 LEU A 24 2.955 -0.979 6.069 1.00 73.01 H new ATOM 0 HD23 LEU A 24 3.924 -0.352 7.424 1.00 73.01 H new ATOM 388 N GLU A 25 6.535 -4.666 8.303 1.00 3.32 N ATOM 389 CA GLU A 25 6.647 -6.046 8.726 1.00 25.42 C ATOM 390 C GLU A 25 6.178 -6.172 10.181 1.00 34.43 C ATOM 391 O GLU A 25 5.478 -7.117 10.543 1.00 5.22 O ATOM 392 CB GLU A 25 8.086 -6.541 8.596 1.00 23.22 C ATOM 393 CG GLU A 25 8.235 -8.015 8.908 1.00 43.45 C ATOM 394 CD GLU A 25 9.654 -8.488 8.852 1.00 15.11 C ATOM 395 OE1 GLU A 25 10.309 -8.523 9.899 1.00 0.40 O ATOM 396 OE2 GLU A 25 10.135 -8.838 7.766 1.00 1.24 O ATOM 0 H GLU A 25 7.421 -4.218 8.070 1.00 3.32 H new ATOM 0 HA GLU A 25 6.018 -6.662 8.083 1.00 25.42 H new ATOM 0 HB2 GLU A 25 8.439 -6.352 7.582 1.00 23.22 H new ATOM 0 HB3 GLU A 25 8.724 -5.967 9.268 1.00 23.22 H new ATOM 0 HG2 GLU A 25 7.832 -8.212 9.901 1.00 43.45 H new ATOM 0 HG3 GLU A 25 7.638 -8.592 8.201 1.00 43.45 H new ATOM 403 N THR A 26 6.548 -5.189 10.995 1.00 65.22 N ATOM 404 CA THR A 26 6.160 -5.159 12.392 1.00 3.23 C ATOM 405 C THR A 26 4.632 -5.014 12.517 1.00 21.33 C ATOM 406 O THR A 26 3.997 -5.695 13.328 1.00 73.44 O ATOM 407 CB THR A 26 6.853 -3.992 13.130 1.00 32.21 C ATOM 408 OG1 THR A 26 8.275 -4.092 12.942 1.00 43.51 O ATOM 409 CG2 THR A 26 6.558 -4.045 14.619 1.00 44.34 C ATOM 0 H THR A 26 7.122 -4.398 10.703 1.00 65.22 H new ATOM 0 HA THR A 26 6.473 -6.097 12.850 1.00 3.23 H new ATOM 0 HB THR A 26 6.475 -3.054 12.724 1.00 32.21 H new ATOM 0 HG1 THR A 26 8.527 -3.644 12.107 1.00 43.51 H new ATOM 0 HG21 THR A 26 7.056 -3.214 15.118 1.00 44.34 H new ATOM 0 HG22 THR A 26 5.482 -3.973 14.780 1.00 44.34 H new ATOM 0 HG23 THR A 26 6.924 -4.986 15.029 1.00 44.34 H new ATOM 417 N VAL A 27 4.055 -4.139 11.684 1.00 34.10 N ATOM 418 CA VAL A 27 2.609 -3.922 11.669 1.00 44.02 C ATOM 419 C VAL A 27 1.894 -5.220 11.302 1.00 25.44 C ATOM 420 O VAL A 27 0.857 -5.555 11.878 1.00 54.13 O ATOM 421 CB VAL A 27 2.197 -2.789 10.674 1.00 71.52 C ATOM 422 CG1 VAL A 27 0.690 -2.597 10.662 1.00 3.34 C ATOM 423 CG2 VAL A 27 2.877 -1.479 11.034 1.00 0.14 C ATOM 0 H VAL A 27 4.571 -3.571 11.012 1.00 34.10 H new ATOM 0 HA VAL A 27 2.312 -3.606 12.669 1.00 44.02 H new ATOM 0 HB VAL A 27 2.520 -3.093 9.678 1.00 71.52 H new ATOM 0 HG11 VAL A 27 0.430 -1.803 9.962 1.00 3.34 H new ATOM 0 HG12 VAL A 27 0.207 -3.525 10.354 1.00 3.34 H new ATOM 0 HG13 VAL A 27 0.350 -2.325 11.661 1.00 3.34 H new ATOM 0 HG21 VAL A 27 2.575 -0.706 10.327 1.00 0.14 H new ATOM 0 HG22 VAL A 27 2.586 -1.183 12.042 1.00 0.14 H new ATOM 0 HG23 VAL A 27 3.959 -1.607 10.991 1.00 0.14 H new ATOM 433 N TYR A 28 2.481 -5.961 10.369 1.00 54.40 N ATOM 434 CA TYR A 28 1.926 -7.228 9.939 1.00 31.31 C ATOM 435 C TYR A 28 1.818 -8.190 11.118 1.00 20.53 C ATOM 436 O TYR A 28 0.756 -8.764 11.381 1.00 24.21 O ATOM 437 CB TYR A 28 2.782 -7.863 8.818 1.00 2.04 C ATOM 438 CG TYR A 28 2.232 -9.193 8.326 1.00 60.31 C ATOM 439 CD1 TYR A 28 2.633 -10.397 8.905 1.00 23.22 C ATOM 440 CD2 TYR A 28 1.291 -9.239 7.310 1.00 15.10 C ATOM 441 CE1 TYR A 28 2.101 -11.602 8.478 1.00 44.10 C ATOM 442 CE2 TYR A 28 0.763 -10.436 6.874 1.00 3.11 C ATOM 443 CZ TYR A 28 1.165 -11.613 7.460 1.00 43.54 C ATOM 444 OH TYR A 28 0.617 -12.806 7.038 1.00 55.35 O ATOM 0 H TYR A 28 3.346 -5.699 9.897 1.00 54.40 H new ATOM 0 HA TYR A 28 0.929 -7.036 9.542 1.00 31.31 H new ATOM 0 HB2 TYR A 28 2.843 -7.170 7.979 1.00 2.04 H new ATOM 0 HB3 TYR A 28 3.798 -8.010 9.184 1.00 2.04 H new ATOM 0 HD1 TYR A 28 3.368 -10.389 9.696 1.00 23.22 H new ATOM 0 HD2 TYR A 28 0.964 -8.318 6.850 1.00 15.10 H new ATOM 0 HE1 TYR A 28 2.415 -12.528 8.937 1.00 44.10 H new ATOM 0 HE2 TYR A 28 0.036 -10.449 6.075 1.00 3.11 H new ATOM 0 HH TYR A 28 0.149 -13.233 7.785 1.00 55.35 H new ATOM 454 N ARG A 29 2.920 -8.328 11.834 1.00 34.15 N ATOM 455 CA ARG A 29 3.020 -9.249 12.954 1.00 34.11 C ATOM 456 C ARG A 29 2.014 -8.897 14.050 1.00 44.41 C ATOM 457 O ARG A 29 1.433 -9.788 14.675 1.00 13.55 O ATOM 458 CB ARG A 29 4.443 -9.237 13.520 1.00 44.12 C ATOM 459 CG ARG A 29 5.534 -9.549 12.492 1.00 2.54 C ATOM 460 CD ARG A 29 6.904 -9.516 13.136 1.00 34.00 C ATOM 461 NE ARG A 29 8.009 -9.702 12.174 1.00 32.13 N ATOM 462 CZ ARG A 29 8.891 -10.720 12.195 1.00 61.44 C ATOM 463 NH1 ARG A 29 8.704 -11.750 13.015 1.00 5.31 N ATOM 464 NH2 ARG A 29 9.940 -10.704 11.383 1.00 42.30 N ATOM 0 H ARG A 29 3.775 -7.802 11.654 1.00 34.15 H new ATOM 0 HA ARG A 29 2.788 -10.250 12.591 1.00 34.11 H new ATOM 0 HB2 ARG A 29 4.640 -8.257 13.955 1.00 44.12 H new ATOM 0 HB3 ARG A 29 4.505 -9.964 14.330 1.00 44.12 H new ATOM 0 HG2 ARG A 29 5.357 -10.531 12.053 1.00 2.54 H new ATOM 0 HG3 ARG A 29 5.492 -8.824 11.679 1.00 2.54 H new ATOM 0 HD2 ARG A 29 7.034 -8.562 13.647 1.00 34.00 H new ATOM 0 HD3 ARG A 29 6.959 -10.295 13.896 1.00 34.00 H new ATOM 0 HE ARG A 29 8.112 -9.005 11.436 1.00 32.13 H new ATOM 0 HH11 ARG A 29 7.891 -11.771 13.630 1.00 5.31 H new ATOM 0 HH12 ARG A 29 9.374 -12.519 13.028 1.00 5.31 H new ATOM 0 HH21 ARG A 29 10.078 -9.921 10.744 1.00 42.30 H new ATOM 0 HH22 ARG A 29 10.608 -11.474 11.398 1.00 42.30 H new ATOM 478 N ALA A 30 1.791 -7.599 14.247 1.00 43.45 N ATOM 479 CA ALA A 30 0.880 -7.098 15.271 1.00 73.41 C ATOM 480 C ALA A 30 -0.544 -7.618 15.066 1.00 4.01 C ATOM 481 O ALA A 30 -1.171 -8.125 16.002 1.00 51.42 O ATOM 482 CB ALA A 30 0.894 -5.573 15.298 1.00 0.30 C ATOM 0 H ALA A 30 2.239 -6.864 13.699 1.00 43.45 H new ATOM 0 HA ALA A 30 1.230 -7.471 16.234 1.00 73.41 H new ATOM 0 HB1 ALA A 30 0.209 -5.216 16.067 1.00 0.30 H new ATOM 0 HB2 ALA A 30 1.902 -5.222 15.519 1.00 0.30 H new ATOM 0 HB3 ALA A 30 0.581 -5.189 14.327 1.00 0.30 H new ATOM 488 N LEU A 31 -1.054 -7.517 13.843 1.00 14.25 N ATOM 489 CA LEU A 31 -2.406 -7.980 13.572 1.00 5.31 C ATOM 490 C LEU A 31 -2.520 -9.483 13.565 1.00 61.31 C ATOM 491 O LEU A 31 -3.576 -10.020 13.889 1.00 32.44 O ATOM 492 CB LEU A 31 -3.079 -7.348 12.343 1.00 61.40 C ATOM 493 CG LEU A 31 -3.426 -5.862 12.451 1.00 5.04 C ATOM 494 CD1 LEU A 31 -2.210 -4.966 12.333 1.00 51.04 C ATOM 495 CD2 LEU A 31 -4.527 -5.460 11.494 1.00 32.31 C ATOM 0 H LEU A 31 -0.562 -7.127 13.040 1.00 14.25 H new ATOM 0 HA LEU A 31 -2.979 -7.611 14.423 1.00 5.31 H new ATOM 0 HB2 LEU A 31 -2.421 -7.484 11.485 1.00 61.40 H new ATOM 0 HB3 LEU A 31 -3.996 -7.899 12.133 1.00 61.40 H new ATOM 0 HG LEU A 31 -3.815 -5.715 13.458 1.00 5.04 H new ATOM 0 HD11 LEU A 31 -2.517 -3.923 12.417 1.00 51.04 H new ATOM 0 HD12 LEU A 31 -1.505 -5.202 13.130 1.00 51.04 H new ATOM 0 HD13 LEU A 31 -1.732 -5.127 11.367 1.00 51.04 H new ATOM 0 HD21 LEU A 31 -4.738 -4.397 11.608 1.00 32.31 H new ATOM 0 HD22 LEU A 31 -4.210 -5.659 10.470 1.00 32.31 H new ATOM 0 HD23 LEU A 31 -5.427 -6.034 11.713 1.00 32.31 H new ATOM 507 N GLU A 32 -1.447 -10.165 13.205 1.00 34.11 N ATOM 508 CA GLU A 32 -1.423 -11.626 13.255 1.00 53.53 C ATOM 509 C GLU A 32 -1.567 -12.120 14.695 1.00 24.34 C ATOM 510 O GLU A 32 -2.134 -13.184 14.941 1.00 14.01 O ATOM 511 CB GLU A 32 -0.156 -12.177 12.603 1.00 53.52 C ATOM 512 CG GLU A 32 -0.104 -11.983 11.097 1.00 11.20 C ATOM 513 CD GLU A 32 -1.112 -12.844 10.349 1.00 75.32 C ATOM 514 OE1 GLU A 32 -2.333 -12.568 10.409 1.00 31.50 O ATOM 515 OE2 GLU A 32 -0.689 -13.806 9.678 1.00 60.01 O ATOM 0 H GLU A 32 -0.581 -9.738 12.875 1.00 34.11 H new ATOM 0 HA GLU A 32 -2.274 -12.000 12.686 1.00 53.53 H new ATOM 0 HB2 GLU A 32 0.712 -11.693 13.052 1.00 53.52 H new ATOM 0 HB3 GLU A 32 -0.078 -13.241 12.825 1.00 53.52 H new ATOM 0 HG2 GLU A 32 -0.288 -10.934 10.865 1.00 11.20 H new ATOM 0 HG3 GLU A 32 0.899 -12.217 10.741 1.00 11.20 H new ATOM 522 N GLU A 33 -1.061 -11.337 15.639 1.00 43.12 N ATOM 523 CA GLU A 33 -1.189 -11.650 17.068 1.00 31.30 C ATOM 524 C GLU A 33 -2.608 -11.359 17.565 1.00 20.42 C ATOM 525 O GLU A 33 -3.066 -11.930 18.546 1.00 32.24 O ATOM 526 CB GLU A 33 -0.195 -10.825 17.883 1.00 4.50 C ATOM 527 CG GLU A 33 1.261 -11.108 17.579 1.00 4.40 C ATOM 528 CD GLU A 33 1.654 -12.524 17.909 1.00 0.40 C ATOM 529 OE1 GLU A 33 2.020 -12.785 19.063 1.00 33.41 O ATOM 530 OE2 GLU A 33 1.615 -13.391 17.012 1.00 20.32 O ATOM 0 H GLU A 33 -0.554 -10.474 15.445 1.00 43.12 H new ATOM 0 HA GLU A 33 -0.977 -12.711 17.197 1.00 31.30 H new ATOM 0 HB2 GLU A 33 -0.390 -9.767 17.706 1.00 4.50 H new ATOM 0 HB3 GLU A 33 -0.373 -11.009 18.942 1.00 4.50 H new ATOM 0 HG2 GLU A 33 1.452 -10.918 16.523 1.00 4.40 H new ATOM 0 HG3 GLU A 33 1.888 -10.419 18.145 1.00 4.40 H new ATOM 537 N LYS A 34 -3.287 -10.460 16.883 1.00 71.44 N ATOM 538 CA LYS A 34 -4.635 -10.056 17.270 1.00 53.10 C ATOM 539 C LYS A 34 -5.712 -10.815 16.502 1.00 60.43 C ATOM 540 O LYS A 34 -6.897 -10.705 16.815 1.00 13.14 O ATOM 541 CB LYS A 34 -4.807 -8.550 17.088 1.00 43.44 C ATOM 542 CG LYS A 34 -3.939 -7.704 18.008 1.00 72.11 C ATOM 543 CD LYS A 34 -4.337 -7.859 19.479 1.00 3.50 C ATOM 544 CE LYS A 34 -5.716 -7.275 19.759 1.00 42.42 C ATOM 545 NZ LYS A 34 -6.114 -7.453 21.169 1.00 32.43 N ATOM 0 H LYS A 34 -2.930 -9.989 16.052 1.00 71.44 H new ATOM 0 HA LYS A 34 -4.759 -10.307 18.323 1.00 53.10 H new ATOM 0 HB2 LYS A 34 -4.578 -8.293 16.054 1.00 43.44 H new ATOM 0 HB3 LYS A 34 -5.853 -8.293 17.257 1.00 43.44 H new ATOM 0 HG2 LYS A 34 -2.894 -7.989 17.884 1.00 72.11 H new ATOM 0 HG3 LYS A 34 -4.020 -6.656 17.719 1.00 72.11 H new ATOM 0 HD2 LYS A 34 -4.329 -8.915 19.748 1.00 3.50 H new ATOM 0 HD3 LYS A 34 -3.598 -7.364 20.109 1.00 3.50 H new ATOM 0 HE2 LYS A 34 -5.717 -6.213 19.513 1.00 42.42 H new ATOM 0 HE3 LYS A 34 -6.451 -7.753 19.111 1.00 42.42 H new ATOM 0 HZ1 LYS A 34 -7.058 -7.042 21.318 1.00 32.43 H new ATOM 0 HZ2 LYS A 34 -6.138 -8.467 21.398 1.00 32.43 H new ATOM 0 HZ3 LYS A 34 -5.427 -6.975 21.787 1.00 32.43 H new ATOM 559 N GLY A 35 -5.302 -11.560 15.499 1.00 15.24 N ATOM 560 CA GLY A 35 -6.236 -12.365 14.742 1.00 44.10 C ATOM 561 C GLY A 35 -6.955 -11.597 13.637 1.00 13.35 C ATOM 562 O GLY A 35 -7.935 -12.086 13.082 1.00 41.20 O ATOM 0 H GLY A 35 -4.332 -11.625 15.189 1.00 15.24 H new ATOM 0 HA2 GLY A 35 -5.701 -13.205 14.299 1.00 44.10 H new ATOM 0 HA3 GLY A 35 -6.977 -12.782 15.423 1.00 44.10 H new ATOM 566 N TYR A 36 -6.470 -10.418 13.302 1.00 25.12 N ATOM 567 CA TYR A 36 -7.105 -9.612 12.252 1.00 61.02 C ATOM 568 C TYR A 36 -6.400 -9.853 10.926 1.00 54.43 C ATOM 569 O TYR A 36 -5.500 -10.697 10.841 1.00 62.22 O ATOM 570 CB TYR A 36 -7.028 -8.111 12.562 1.00 64.44 C ATOM 571 CG TYR A 36 -7.661 -7.649 13.852 1.00 15.35 C ATOM 572 CD1 TYR A 36 -6.891 -7.047 14.827 1.00 33.35 C ATOM 573 CD2 TYR A 36 -9.020 -7.796 14.089 1.00 74.31 C ATOM 574 CE1 TYR A 36 -7.446 -6.598 16.002 1.00 61.14 C ATOM 575 CE2 TYR A 36 -9.587 -7.353 15.272 1.00 50.43 C ATOM 576 CZ TYR A 36 -8.788 -6.752 16.224 1.00 42.43 C ATOM 577 OH TYR A 36 -9.339 -6.294 17.405 1.00 64.04 O ATOM 0 H TYR A 36 -5.648 -9.991 13.730 1.00 25.12 H new ATOM 0 HA TYR A 36 -8.152 -9.911 12.202 1.00 61.02 H new ATOM 0 HB2 TYR A 36 -5.978 -7.821 12.576 1.00 64.44 H new ATOM 0 HB3 TYR A 36 -7.497 -7.570 11.740 1.00 64.44 H new ATOM 0 HD1 TYR A 36 -5.830 -6.926 14.663 1.00 33.35 H new ATOM 0 HD2 TYR A 36 -9.644 -8.262 13.341 1.00 74.31 H new ATOM 0 HE1 TYR A 36 -6.825 -6.125 16.748 1.00 61.14 H new ATOM 0 HE2 TYR A 36 -10.645 -7.477 15.448 1.00 50.43 H new ATOM 0 HH TYR A 36 -10.302 -6.477 17.409 1.00 64.04 H new ATOM 587 N ASN A 37 -6.810 -9.123 9.899 1.00 31.54 N ATOM 588 CA ASN A 37 -6.141 -9.156 8.603 1.00 21.33 C ATOM 589 C ASN A 37 -5.204 -7.962 8.497 1.00 21.34 C ATOM 590 O ASN A 37 -5.649 -6.835 8.241 1.00 22.03 O ATOM 591 CB ASN A 37 -7.140 -9.148 7.422 1.00 24.43 C ATOM 592 CG ASN A 37 -7.984 -10.402 7.327 1.00 64.23 C ATOM 593 OD1 ASN A 37 -9.067 -10.490 7.906 1.00 51.02 O ATOM 594 ND2 ASN A 37 -7.513 -11.370 6.573 1.00 30.03 N ATOM 0 H ASN A 37 -7.612 -8.493 9.938 1.00 31.54 H new ATOM 0 HA ASN A 37 -5.580 -10.089 8.540 1.00 21.33 H new ATOM 0 HB2 ASN A 37 -7.798 -8.285 7.521 1.00 24.43 H new ATOM 0 HB3 ASN A 37 -6.587 -9.022 6.491 1.00 24.43 H new ATOM 0 HD21 ASN A 37 -8.049 -12.229 6.452 1.00 30.03 H new ATOM 0 HD22 ASN A 37 -6.611 -11.262 6.108 1.00 30.03 H new ATOM 601 N PRO A 38 -3.889 -8.189 8.720 1.00 13.34 N ATOM 602 CA PRO A 38 -2.869 -7.127 8.726 1.00 55.24 C ATOM 603 C PRO A 38 -2.901 -6.232 7.503 1.00 12.13 C ATOM 604 O PRO A 38 -2.775 -5.013 7.611 1.00 14.42 O ATOM 605 CB PRO A 38 -1.563 -7.897 8.744 1.00 63.12 C ATOM 606 CG PRO A 38 -1.882 -9.205 9.365 1.00 40.31 C ATOM 607 CD PRO A 38 -3.299 -9.513 9.005 1.00 24.04 C ATOM 0 HA PRO A 38 -3.025 -6.453 9.569 1.00 55.24 H new ATOM 0 HB2 PRO A 38 -1.170 -8.027 7.736 1.00 63.12 H new ATOM 0 HB3 PRO A 38 -0.802 -7.366 9.316 1.00 63.12 H new ATOM 0 HG2 PRO A 38 -1.211 -9.982 8.998 1.00 40.31 H new ATOM 0 HG3 PRO A 38 -1.758 -9.161 10.447 1.00 40.31 H new ATOM 0 HD2 PRO A 38 -3.357 -10.171 8.138 1.00 24.04 H new ATOM 0 HD3 PRO A 38 -3.819 -10.015 9.821 1.00 24.04 H new ATOM 615 N ILE A 39 -3.113 -6.837 6.356 1.00 2.34 N ATOM 616 CA ILE A 39 -3.080 -6.133 5.088 1.00 41.30 C ATOM 617 C ILE A 39 -4.198 -5.097 5.013 1.00 65.44 C ATOM 618 O ILE A 39 -3.964 -3.954 4.629 1.00 51.14 O ATOM 619 CB ILE A 39 -3.210 -7.131 3.914 1.00 64.30 C ATOM 620 CG1 ILE A 39 -2.147 -8.236 4.032 1.00 73.21 C ATOM 621 CG2 ILE A 39 -3.090 -6.416 2.568 1.00 12.12 C ATOM 622 CD1 ILE A 39 -0.711 -7.739 4.024 1.00 4.22 C ATOM 0 H ILE A 39 -3.314 -7.834 6.273 1.00 2.34 H new ATOM 0 HA ILE A 39 -2.122 -5.618 5.013 1.00 41.30 H new ATOM 0 HB ILE A 39 -4.198 -7.588 3.965 1.00 64.30 H new ATOM 0 HG12 ILE A 39 -2.320 -8.791 4.954 1.00 73.21 H new ATOM 0 HG13 ILE A 39 -2.279 -8.938 3.208 1.00 73.21 H new ATOM 0 HG21 ILE A 39 -3.185 -7.142 1.761 1.00 12.12 H new ATOM 0 HG22 ILE A 39 -3.880 -5.670 2.480 1.00 12.12 H new ATOM 0 HG23 ILE A 39 -2.119 -5.925 2.502 1.00 12.12 H new ATOM 0 HD11 ILE A 39 -0.032 -8.587 4.111 1.00 4.22 H new ATOM 0 HD12 ILE A 39 -0.514 -7.211 3.091 1.00 4.22 H new ATOM 0 HD13 ILE A 39 -0.556 -7.062 4.864 1.00 4.22 H new ATOM 634 N ASN A 40 -5.387 -5.497 5.459 1.00 13.53 N ATOM 635 CA ASN A 40 -6.587 -4.643 5.399 1.00 21.33 C ATOM 636 C ASN A 40 -6.417 -3.359 6.181 1.00 41.34 C ATOM 637 O ASN A 40 -6.888 -2.295 5.765 1.00 23.14 O ATOM 638 CB ASN A 40 -7.843 -5.400 5.876 1.00 42.33 C ATOM 639 CG ASN A 40 -8.343 -6.474 4.905 1.00 41.42 C ATOM 640 OD1 ASN A 40 -7.481 -6.991 4.065 1.00 4.30 O flip ATOM 641 ND2 ASN A 40 -9.529 -6.795 4.884 1.00 4.44 N flip ATOM 0 H ASN A 40 -5.553 -6.415 5.871 1.00 13.53 H new ATOM 0 HA ASN A 40 -6.722 -4.375 4.351 1.00 21.33 H new ATOM 0 HB2 ASN A 40 -7.627 -5.868 6.836 1.00 42.33 H new ATOM 0 HB3 ASN A 40 -8.644 -4.680 6.045 1.00 42.33 H new ATOM 0 HD21 ASN A 40 -10.182 -6.379 5.548 1.00 4.44 H new ATOM 0 HD22 ASN A 40 -9.861 -7.478 4.202 1.00 4.44 H new ATOM 648 N GLN A 41 -5.775 -3.433 7.316 1.00 44.14 N ATOM 649 CA GLN A 41 -5.542 -2.233 8.073 1.00 35.31 C ATOM 650 C GLN A 41 -4.447 -1.353 7.489 1.00 74.11 C ATOM 651 O GLN A 41 -4.543 -0.124 7.546 1.00 14.43 O ATOM 652 CB GLN A 41 -5.365 -2.475 9.552 1.00 13.10 C ATOM 653 CG GLN A 41 -6.618 -3.021 10.236 1.00 32.24 C ATOM 654 CD GLN A 41 -7.867 -2.191 9.944 1.00 4.03 C ATOM 655 OE1 GLN A 41 -7.804 -1.003 9.682 1.00 12.25 O ATOM 656 NE2 GLN A 41 -8.993 -2.792 10.042 1.00 22.03 N ATOM 0 H GLN A 41 -5.411 -4.291 7.730 1.00 44.14 H new ATOM 0 HA GLN A 41 -6.466 -1.663 7.978 1.00 35.31 H new ATOM 0 HB2 GLN A 41 -4.544 -3.177 9.701 1.00 13.10 H new ATOM 0 HB3 GLN A 41 -5.077 -1.540 10.033 1.00 13.10 H new ATOM 0 HG2 GLN A 41 -6.786 -4.047 9.909 1.00 32.24 H new ATOM 0 HG3 GLN A 41 -6.453 -3.052 11.313 1.00 32.24 H new ATOM 0 HE21 GLN A 41 -9.022 -3.788 10.262 1.00 22.03 H new ATOM 0 HE22 GLN A 41 -9.861 -2.275 9.900 1.00 22.03 H new ATOM 665 N ILE A 42 -3.418 -1.968 6.907 1.00 44.10 N ATOM 666 CA ILE A 42 -2.329 -1.195 6.305 1.00 44.01 C ATOM 667 C ILE A 42 -2.848 -0.400 5.111 1.00 4.30 C ATOM 668 O ILE A 42 -2.638 0.817 5.028 1.00 54.41 O ATOM 669 CB ILE A 42 -1.123 -2.083 5.876 1.00 33.32 C ATOM 670 CG1 ILE A 42 -0.544 -2.818 7.097 1.00 60.02 C ATOM 671 CG2 ILE A 42 -0.038 -1.223 5.205 1.00 45.32 C ATOM 672 CD1 ILE A 42 0.606 -3.759 6.777 1.00 22.33 C ATOM 0 H ILE A 42 -3.314 -2.980 6.839 1.00 44.10 H new ATOM 0 HA ILE A 42 -1.962 -0.512 7.071 1.00 44.01 H new ATOM 0 HB ILE A 42 -1.473 -2.823 5.156 1.00 33.32 H new ATOM 0 HG12 ILE A 42 -0.202 -2.079 7.822 1.00 60.02 H new ATOM 0 HG13 ILE A 42 -1.341 -3.388 7.575 1.00 60.02 H new ATOM 0 HG21 ILE A 42 0.798 -1.857 4.911 1.00 45.32 H new ATOM 0 HG22 ILE A 42 -0.453 -0.737 4.322 1.00 45.32 H new ATOM 0 HG23 ILE A 42 0.311 -0.465 5.906 1.00 45.32 H new ATOM 0 HD11 ILE A 42 0.953 -4.235 7.694 1.00 22.33 H new ATOM 0 HD12 ILE A 42 0.267 -4.523 6.078 1.00 22.33 H new ATOM 0 HD13 ILE A 42 1.424 -3.195 6.329 1.00 22.33 H new ATOM 684 N VAL A 43 -3.559 -1.076 4.212 1.00 54.33 N ATOM 685 CA VAL A 43 -4.145 -0.413 3.050 1.00 13.44 C ATOM 686 C VAL A 43 -5.088 0.720 3.494 1.00 2.11 C ATOM 687 O VAL A 43 -5.098 1.808 2.897 1.00 25.00 O ATOM 688 CB VAL A 43 -4.868 -1.424 2.086 1.00 71.55 C ATOM 689 CG1 VAL A 43 -5.904 -2.222 2.810 1.00 52.43 C ATOM 690 CG2 VAL A 43 -5.521 -0.710 0.924 1.00 21.34 C ATOM 0 H VAL A 43 -3.743 -2.078 4.265 1.00 54.33 H new ATOM 0 HA VAL A 43 -3.328 0.026 2.477 1.00 13.44 H new ATOM 0 HB VAL A 43 -4.099 -2.096 1.706 1.00 71.55 H new ATOM 0 HG11 VAL A 43 -6.384 -2.911 2.115 1.00 52.43 H new ATOM 0 HG12 VAL A 43 -5.432 -2.788 3.613 1.00 52.43 H new ATOM 0 HG13 VAL A 43 -6.652 -1.550 3.231 1.00 52.43 H new ATOM 0 HG21 VAL A 43 -6.011 -1.439 0.278 1.00 21.34 H new ATOM 0 HG22 VAL A 43 -6.261 -0.003 1.300 1.00 21.34 H new ATOM 0 HG23 VAL A 43 -4.763 -0.173 0.355 1.00 21.34 H new ATOM 700 N GLY A 44 -5.834 0.474 4.574 1.00 22.14 N ATOM 701 CA GLY A 44 -6.709 1.473 5.120 1.00 15.01 C ATOM 702 C GLY A 44 -5.944 2.696 5.587 1.00 21.14 C ATOM 703 O GLY A 44 -6.293 3.822 5.230 1.00 73.12 O ATOM 0 H GLY A 44 -5.838 -0.414 5.076 1.00 22.14 H new ATOM 0 HA2 GLY A 44 -7.440 1.767 4.367 1.00 15.01 H new ATOM 0 HA3 GLY A 44 -7.266 1.051 5.957 1.00 15.01 H new ATOM 707 N TYR A 45 -4.877 2.480 6.363 1.00 25.05 N ATOM 708 CA TYR A 45 -4.082 3.590 6.870 1.00 74.52 C ATOM 709 C TYR A 45 -3.474 4.416 5.755 1.00 74.24 C ATOM 710 O TYR A 45 -3.607 5.634 5.750 1.00 13.03 O ATOM 711 CB TYR A 45 -2.979 3.156 7.863 1.00 32.23 C ATOM 712 CG TYR A 45 -2.103 4.338 8.289 1.00 3.42 C ATOM 713 CD1 TYR A 45 -0.823 4.514 7.775 1.00 21.22 C ATOM 714 CD2 TYR A 45 -2.575 5.288 9.172 1.00 73.10 C ATOM 715 CE1 TYR A 45 -0.049 5.599 8.135 1.00 54.23 C ATOM 716 CE2 TYR A 45 -1.812 6.379 9.530 1.00 15.24 C ATOM 717 CZ TYR A 45 -0.553 6.529 9.012 1.00 73.53 C ATOM 718 OH TYR A 45 0.205 7.624 9.360 1.00 10.01 O ATOM 0 H TYR A 45 -4.551 1.556 6.648 1.00 25.05 H new ATOM 0 HA TYR A 45 -4.790 4.210 7.420 1.00 74.52 H new ATOM 0 HB2 TYR A 45 -3.438 2.707 8.744 1.00 32.23 H new ATOM 0 HB3 TYR A 45 -2.356 2.389 7.403 1.00 32.23 H new ATOM 0 HD1 TYR A 45 -0.427 3.788 7.081 1.00 21.22 H new ATOM 0 HD2 TYR A 45 -3.564 5.174 9.592 1.00 73.10 H new ATOM 0 HE1 TYR A 45 0.945 5.716 7.730 1.00 54.23 H new ATOM 0 HE2 TYR A 45 -2.206 7.113 10.217 1.00 15.24 H new ATOM 0 HH TYR A 45 -0.298 8.184 9.988 1.00 10.01 H new ATOM 728 N LEU A 46 -2.819 3.772 4.818 1.00 53.14 N ATOM 729 CA LEU A 46 -2.167 4.507 3.755 1.00 34.23 C ATOM 730 C LEU A 46 -3.138 5.221 2.832 1.00 33.11 C ATOM 731 O LEU A 46 -2.889 6.360 2.441 1.00 74.34 O ATOM 732 CB LEU A 46 -1.137 3.680 2.958 1.00 64.35 C ATOM 733 CG LEU A 46 0.187 3.316 3.673 1.00 70.23 C ATOM 734 CD1 LEU A 46 -0.009 2.354 4.818 1.00 45.21 C ATOM 735 CD2 LEU A 46 1.195 2.778 2.684 1.00 15.03 C ATOM 0 H LEU A 46 -2.723 2.758 4.767 1.00 53.14 H new ATOM 0 HA LEU A 46 -1.600 5.277 4.279 1.00 34.23 H new ATOM 0 HB2 LEU A 46 -1.618 2.753 2.646 1.00 64.35 H new ATOM 0 HB3 LEU A 46 -0.890 4.232 2.051 1.00 64.35 H new ATOM 0 HG LEU A 46 0.574 4.238 4.107 1.00 70.23 H new ATOM 0 HD11 LEU A 46 0.954 2.137 5.280 1.00 45.21 H new ATOM 0 HD12 LEU A 46 -0.674 2.800 5.558 1.00 45.21 H new ATOM 0 HD13 LEU A 46 -0.449 1.429 4.445 1.00 45.21 H new ATOM 0 HD21 LEU A 46 2.119 2.528 3.206 1.00 15.03 H new ATOM 0 HD22 LEU A 46 0.795 1.884 2.206 1.00 15.03 H new ATOM 0 HD23 LEU A 46 1.400 3.534 1.926 1.00 15.03 H new ATOM 747 N LEU A 47 -4.250 4.590 2.511 1.00 34.13 N ATOM 748 CA LEU A 47 -5.190 5.206 1.594 1.00 4.14 C ATOM 749 C LEU A 47 -6.061 6.277 2.261 1.00 52.52 C ATOM 750 O LEU A 47 -6.381 7.283 1.631 1.00 10.22 O ATOM 751 CB LEU A 47 -6.055 4.171 0.854 1.00 25.53 C ATOM 752 CG LEU A 47 -5.308 3.145 -0.017 1.00 73.42 C ATOM 753 CD1 LEU A 47 -6.289 2.276 -0.779 1.00 54.45 C ATOM 754 CD2 LEU A 47 -4.344 3.824 -0.973 1.00 63.01 C ATOM 0 H LEU A 47 -4.522 3.672 2.862 1.00 34.13 H new ATOM 0 HA LEU A 47 -4.577 5.713 0.849 1.00 4.14 H new ATOM 0 HB2 LEU A 47 -6.642 3.627 1.594 1.00 25.53 H new ATOM 0 HB3 LEU A 47 -6.760 4.708 0.219 1.00 25.53 H new ATOM 0 HG LEU A 47 -4.724 2.510 0.649 1.00 73.42 H new ATOM 0 HD11 LEU A 47 -5.741 1.557 -1.389 1.00 54.45 H new ATOM 0 HD12 LEU A 47 -6.926 1.742 -0.074 1.00 54.45 H new ATOM 0 HD13 LEU A 47 -6.906 2.903 -1.423 1.00 54.45 H new ATOM 0 HD21 LEU A 47 -3.834 3.070 -1.572 1.00 63.01 H new ATOM 0 HD22 LEU A 47 -4.896 4.497 -1.629 1.00 63.01 H new ATOM 0 HD23 LEU A 47 -3.609 4.394 -0.405 1.00 63.01 H new ATOM 766 N SER A 48 -6.432 6.083 3.516 1.00 32.21 N ATOM 767 CA SER A 48 -7.280 7.060 4.187 1.00 65.32 C ATOM 768 C SER A 48 -6.464 8.114 4.969 1.00 33.44 C ATOM 769 O SER A 48 -6.927 9.239 5.163 1.00 15.42 O ATOM 770 CB SER A 48 -8.245 6.352 5.128 1.00 3.03 C ATOM 771 OG SER A 48 -9.030 5.382 4.438 1.00 1.41 O ATOM 0 H SER A 48 -6.168 5.277 4.082 1.00 32.21 H new ATOM 0 HA SER A 48 -7.835 7.589 3.413 1.00 65.32 H new ATOM 0 HB2 SER A 48 -7.685 5.867 5.927 1.00 3.03 H new ATOM 0 HB3 SER A 48 -8.901 7.085 5.598 1.00 3.03 H new ATOM 0 HG SER A 48 -8.539 4.535 4.393 1.00 1.41 H new ATOM 777 N GLY A 49 -5.243 7.769 5.379 1.00 54.52 N ATOM 778 CA GLY A 49 -4.431 8.692 6.146 1.00 1.01 C ATOM 779 C GLY A 49 -4.929 8.875 7.580 1.00 1.21 C ATOM 780 O GLY A 49 -4.855 9.970 8.124 1.00 23.13 O ATOM 0 H GLY A 49 -4.805 6.867 5.192 1.00 54.52 H new ATOM 0 HA2 GLY A 49 -3.403 8.331 6.167 1.00 1.01 H new ATOM 0 HA3 GLY A 49 -4.419 9.660 5.645 1.00 1.01 H new ATOM 784 N ASP A 50 -5.431 7.810 8.188 1.00 21.00 N ATOM 785 CA ASP A 50 -5.944 7.890 9.561 1.00 62.30 C ATOM 786 C ASP A 50 -5.355 6.770 10.426 1.00 60.32 C ATOM 787 O ASP A 50 -5.471 5.606 10.087 1.00 32.42 O ATOM 788 CB ASP A 50 -7.474 7.835 9.582 1.00 12.23 C ATOM 789 CG ASP A 50 -8.034 7.942 10.985 1.00 3.11 C ATOM 790 OD1 ASP A 50 -8.158 9.070 11.509 1.00 65.34 O ATOM 791 OD2 ASP A 50 -8.359 6.912 11.586 1.00 31.45 O ATOM 0 H ASP A 50 -5.497 6.885 7.763 1.00 21.00 H new ATOM 0 HA ASP A 50 -5.634 8.848 9.978 1.00 62.30 H new ATOM 0 HB2 ASP A 50 -7.873 8.645 8.971 1.00 12.23 H new ATOM 0 HB3 ASP A 50 -7.808 6.901 9.130 1.00 12.23 H new ATOM 796 N PRO A 51 -4.698 7.119 11.550 1.00 2.33 N ATOM 797 CA PRO A 51 -4.017 6.146 12.438 1.00 72.24 C ATOM 798 C PRO A 51 -4.916 5.063 13.060 1.00 4.31 C ATOM 799 O PRO A 51 -4.426 3.983 13.411 1.00 25.05 O ATOM 800 CB PRO A 51 -3.409 7.014 13.544 1.00 62.03 C ATOM 801 CG PRO A 51 -3.376 8.392 12.985 1.00 60.10 C ATOM 802 CD PRO A 51 -4.543 8.496 12.052 1.00 21.42 C ATOM 0 HA PRO A 51 -3.300 5.570 11.853 1.00 72.24 H new ATOM 0 HB2 PRO A 51 -4.010 6.972 14.453 1.00 62.03 H new ATOM 0 HB3 PRO A 51 -2.408 6.672 13.808 1.00 62.03 H new ATOM 0 HG2 PRO A 51 -3.446 9.135 13.779 1.00 60.10 H new ATOM 0 HG3 PRO A 51 -2.440 8.575 12.458 1.00 60.10 H new ATOM 0 HD2 PRO A 51 -5.440 8.840 12.567 1.00 21.42 H new ATOM 0 HD3 PRO A 51 -4.350 9.200 11.243 1.00 21.42 H new ATOM 810 N ALA A 52 -6.216 5.337 13.188 1.00 60.24 N ATOM 811 CA ALA A 52 -7.141 4.435 13.896 1.00 45.02 C ATOM 812 C ALA A 52 -7.250 3.037 13.269 1.00 25.12 C ATOM 813 O ALA A 52 -7.743 2.098 13.917 1.00 53.01 O ATOM 814 CB ALA A 52 -8.503 5.071 14.038 1.00 34.34 C ATOM 0 H ALA A 52 -6.657 6.176 12.812 1.00 60.24 H new ATOM 0 HA ALA A 52 -6.711 4.281 14.886 1.00 45.02 H new ATOM 0 HB1 ALA A 52 -9.170 4.388 14.564 1.00 34.34 H new ATOM 0 HB2 ALA A 52 -8.414 5.999 14.603 1.00 34.34 H new ATOM 0 HB3 ALA A 52 -8.909 5.286 13.050 1.00 34.34 H new ATOM 820 N TYR A 53 -6.788 2.897 12.036 1.00 61.02 N ATOM 821 CA TYR A 53 -6.792 1.614 11.353 1.00 63.42 C ATOM 822 C TYR A 53 -5.846 0.615 12.008 1.00 70.43 C ATOM 823 O TYR A 53 -6.140 -0.565 12.063 1.00 3.24 O ATOM 824 CB TYR A 53 -6.398 1.805 9.889 1.00 73.11 C ATOM 825 CG TYR A 53 -7.464 2.490 9.089 1.00 41.31 C ATOM 826 CD1 TYR A 53 -8.581 1.797 8.715 1.00 10.42 C ATOM 827 CD2 TYR A 53 -7.369 3.814 8.729 1.00 34.21 C ATOM 828 CE1 TYR A 53 -9.576 2.379 8.001 1.00 2.32 C ATOM 829 CE2 TYR A 53 -8.366 4.423 8.007 1.00 51.50 C ATOM 830 CZ TYR A 53 -9.474 3.700 7.642 1.00 32.11 C ATOM 831 OH TYR A 53 -10.486 4.303 6.915 1.00 13.13 O ATOM 0 H TYR A 53 -6.403 3.664 11.485 1.00 61.02 H new ATOM 0 HA TYR A 53 -7.802 1.210 11.420 1.00 63.42 H new ATOM 0 HB2 TYR A 53 -5.479 2.389 9.837 1.00 73.11 H new ATOM 0 HB3 TYR A 53 -6.184 0.833 9.445 1.00 73.11 H new ATOM 0 HD1 TYR A 53 -8.674 0.758 8.996 1.00 10.42 H new ATOM 0 HD2 TYR A 53 -6.498 4.383 9.018 1.00 34.21 H new ATOM 0 HE1 TYR A 53 -10.446 1.805 7.716 1.00 2.32 H new ATOM 0 HE2 TYR A 53 -8.279 5.463 7.729 1.00 51.50 H new ATOM 0 HH TYR A 53 -10.115 4.685 6.092 1.00 13.13 H new ATOM 841 N ILE A 54 -4.750 1.082 12.563 1.00 51.31 N ATOM 842 CA ILE A 54 -3.792 0.157 13.135 1.00 60.14 C ATOM 843 C ILE A 54 -4.058 -0.050 14.630 1.00 25.24 C ATOM 844 O ILE A 54 -4.118 0.922 15.402 1.00 4.50 O ATOM 845 CB ILE A 54 -2.320 0.610 12.898 1.00 4.10 C ATOM 846 CG1 ILE A 54 -2.074 0.851 11.394 1.00 41.43 C ATOM 847 CG2 ILE A 54 -1.337 -0.441 13.428 1.00 20.34 C ATOM 848 CD1 ILE A 54 -2.337 -0.357 10.505 1.00 31.04 C ATOM 0 H ILE A 54 -4.502 2.069 12.631 1.00 51.31 H new ATOM 0 HA ILE A 54 -3.924 -0.795 12.621 1.00 60.14 H new ATOM 0 HB ILE A 54 -2.156 1.541 13.440 1.00 4.10 H new ATOM 0 HG12 ILE A 54 -2.708 1.674 11.063 1.00 41.43 H new ATOM 0 HG13 ILE A 54 -1.041 1.169 11.255 1.00 41.43 H new ATOM 0 HG21 ILE A 54 -0.315 -0.105 13.252 1.00 20.34 H new ATOM 0 HG22 ILE A 54 -1.495 -0.580 14.498 1.00 20.34 H new ATOM 0 HG23 ILE A 54 -1.502 -1.386 12.911 1.00 20.34 H new ATOM 0 HD11 ILE A 54 -2.138 -0.094 9.466 1.00 31.04 H new ATOM 0 HD12 ILE A 54 -1.684 -1.177 10.803 1.00 31.04 H new ATOM 0 HD13 ILE A 54 -3.377 -0.665 10.608 1.00 31.04 H new ATOM 860 N PRO A 55 -4.285 -1.321 15.043 1.00 13.30 N ATOM 861 CA PRO A 55 -4.496 -1.688 16.445 1.00 1.23 C ATOM 862 C PRO A 55 -3.341 -1.235 17.336 1.00 71.23 C ATOM 863 O PRO A 55 -2.161 -1.310 16.961 1.00 63.42 O ATOM 864 CB PRO A 55 -4.568 -3.216 16.409 1.00 11.30 C ATOM 865 CG PRO A 55 -5.021 -3.528 15.038 1.00 64.14 C ATOM 866 CD PRO A 55 -4.384 -2.495 14.160 1.00 13.21 C ATOM 0 HA PRO A 55 -5.387 -1.217 16.860 1.00 1.23 H new ATOM 0 HB2 PRO A 55 -3.597 -3.665 16.619 1.00 11.30 H new ATOM 0 HB3 PRO A 55 -5.264 -3.599 17.155 1.00 11.30 H new ATOM 0 HG2 PRO A 55 -4.718 -4.533 14.744 1.00 64.14 H new ATOM 0 HG3 PRO A 55 -6.108 -3.488 14.965 1.00 64.14 H new ATOM 0 HD2 PRO A 55 -3.405 -2.816 13.805 1.00 13.21 H new ATOM 0 HD3 PRO A 55 -4.990 -2.286 13.278 1.00 13.21 H new ATOM 874 N ARG A 56 -3.684 -0.806 18.514 1.00 51.20 N ATOM 875 CA ARG A 56 -2.743 -0.249 19.465 1.00 43.42 C ATOM 876 C ARG A 56 -2.110 -1.311 20.355 1.00 43.52 C ATOM 877 O ARG A 56 -1.536 -1.000 21.411 1.00 22.45 O ATOM 878 CB ARG A 56 -3.425 0.850 20.267 1.00 52.44 C ATOM 879 CG ARG A 56 -3.775 2.069 19.420 1.00 22.11 C ATOM 880 CD ARG A 56 -4.616 3.066 20.180 1.00 51.21 C ATOM 881 NE ARG A 56 -5.967 2.556 20.445 1.00 32.21 N ATOM 882 CZ ARG A 56 -6.848 3.121 21.273 1.00 62.13 C ATOM 883 NH1 ARG A 56 -6.497 4.161 22.022 1.00 4.31 N ATOM 884 NH2 ARG A 56 -8.083 2.636 21.355 1.00 44.12 N ATOM 0 H ARG A 56 -4.644 -0.830 18.857 1.00 51.20 H new ATOM 0 HA ARG A 56 -1.913 0.189 18.911 1.00 43.42 H new ATOM 0 HB2 ARG A 56 -4.335 0.453 20.718 1.00 52.44 H new ATOM 0 HB3 ARG A 56 -2.772 1.156 21.084 1.00 52.44 H new ATOM 0 HG2 ARG A 56 -2.857 2.551 19.083 1.00 22.11 H new ATOM 0 HG3 ARG A 56 -4.312 1.748 18.528 1.00 22.11 H new ATOM 0 HD2 ARG A 56 -4.128 3.307 21.124 1.00 51.21 H new ATOM 0 HD3 ARG A 56 -4.683 3.993 19.610 1.00 51.21 H new ATOM 0 HE ARG A 56 -6.254 1.706 19.960 1.00 32.21 H new ATOM 0 HH11 ARG A 56 -5.549 4.533 21.966 1.00 4.31 H new ATOM 0 HH12 ARG A 56 -7.176 4.588 22.653 1.00 4.31 H new ATOM 0 HH21 ARG A 56 -8.355 1.834 20.786 1.00 44.12 H new ATOM 0 HH22 ARG A 56 -8.759 3.066 21.987 1.00 44.12 H new ATOM 898 N TYR A 57 -2.185 -2.544 19.897 1.00 31.43 N ATOM 899 CA TYR A 57 -1.583 -3.693 20.555 1.00 41.30 C ATOM 900 C TYR A 57 -0.059 -3.511 20.741 1.00 21.32 C ATOM 901 O TYR A 57 0.495 -3.850 21.794 1.00 51.24 O ATOM 902 CB TYR A 57 -1.891 -4.954 19.728 1.00 32.33 C ATOM 903 CG TYR A 57 -1.310 -6.248 20.261 1.00 21.54 C ATOM 904 CD1 TYR A 57 -1.748 -6.788 21.458 1.00 1.31 C ATOM 905 CD2 TYR A 57 -0.347 -6.944 19.545 1.00 62.31 C ATOM 906 CE1 TYR A 57 -1.243 -7.978 21.929 1.00 25.11 C ATOM 907 CE2 TYR A 57 0.167 -8.133 20.013 1.00 13.43 C ATOM 908 CZ TYR A 57 -0.285 -8.647 21.206 1.00 42.03 C ATOM 909 OH TYR A 57 0.214 -9.844 21.674 1.00 53.51 O ATOM 0 H TYR A 57 -2.677 -2.784 19.037 1.00 31.43 H new ATOM 0 HA TYR A 57 -2.010 -3.794 21.553 1.00 41.30 H new ATOM 0 HB2 TYR A 57 -2.973 -5.065 19.658 1.00 32.33 H new ATOM 0 HB3 TYR A 57 -1.520 -4.801 18.715 1.00 32.33 H new ATOM 0 HD1 TYR A 57 -2.499 -6.266 22.032 1.00 1.31 H new ATOM 0 HD2 TYR A 57 0.006 -6.547 18.605 1.00 62.31 H new ATOM 0 HE1 TYR A 57 -1.598 -8.385 22.864 1.00 25.11 H new ATOM 0 HE2 TYR A 57 0.921 -8.659 19.446 1.00 13.43 H new ATOM 0 HH TYR A 57 0.882 -10.188 21.045 1.00 53.51 H new ATOM 919 N GLN A 58 0.607 -2.965 19.737 1.00 54.02 N ATOM 920 CA GLN A 58 2.044 -2.751 19.802 1.00 52.53 C ATOM 921 C GLN A 58 2.403 -1.362 19.316 1.00 70.13 C ATOM 922 O GLN A 58 1.547 -0.634 18.808 1.00 42.20 O ATOM 923 CB GLN A 58 2.815 -3.812 18.994 1.00 34.51 C ATOM 924 CG GLN A 58 2.669 -5.226 19.522 1.00 1.13 C ATOM 925 CD GLN A 58 3.467 -6.242 18.731 1.00 51.41 C ATOM 926 OE1 GLN A 58 2.983 -6.820 17.765 1.00 1.15 O ATOM 927 NE2 GLN A 58 4.690 -6.473 19.142 1.00 52.22 N ATOM 0 H GLN A 58 0.174 -2.661 18.865 1.00 54.02 H new ATOM 0 HA GLN A 58 2.338 -2.846 20.847 1.00 52.53 H new ATOM 0 HB2 GLN A 58 2.471 -3.785 17.960 1.00 34.51 H new ATOM 0 HB3 GLN A 58 3.872 -3.547 18.985 1.00 34.51 H new ATOM 0 HG2 GLN A 58 2.989 -5.253 20.564 1.00 1.13 H new ATOM 0 HG3 GLN A 58 1.616 -5.507 19.505 1.00 1.13 H new ATOM 0 HE21 GLN A 58 5.059 -5.973 19.950 1.00 52.22 H new ATOM 0 HE22 GLN A 58 5.272 -7.153 18.653 1.00 52.22 H new ATOM 936 N ASP A 59 3.678 -1.013 19.447 1.00 54.10 N ATOM 937 CA ASP A 59 4.212 0.298 19.024 1.00 32.05 C ATOM 938 C ASP A 59 4.191 0.465 17.526 1.00 4.42 C ATOM 939 O ASP A 59 4.408 1.562 17.022 1.00 24.31 O ATOM 940 CB ASP A 59 5.611 0.603 19.592 1.00 62.15 C ATOM 941 CG ASP A 59 6.684 -0.374 19.180 1.00 72.41 C ATOM 942 OD1 ASP A 59 6.812 -1.435 19.830 1.00 73.13 O ATOM 943 OD2 ASP A 59 7.434 -0.082 18.240 1.00 3.03 O ATOM 0 H ASP A 59 4.384 -1.629 19.851 1.00 54.10 H new ATOM 0 HA ASP A 59 3.534 1.034 19.455 1.00 32.05 H new ATOM 0 HB2 ASP A 59 5.907 1.603 19.275 1.00 62.15 H new ATOM 0 HB3 ASP A 59 5.551 0.619 20.680 1.00 62.15 H new ATOM 948 N ALA A 60 3.934 -0.635 16.821 1.00 71.21 N ATOM 949 CA ALA A 60 3.811 -0.649 15.365 1.00 4.55 C ATOM 950 C ALA A 60 2.862 0.456 14.879 1.00 75.02 C ATOM 951 O ALA A 60 3.089 1.064 13.828 1.00 15.42 O ATOM 952 CB ALA A 60 3.318 -2.008 14.904 1.00 21.01 C ATOM 0 H ALA A 60 3.804 -1.551 17.249 1.00 71.21 H new ATOM 0 HA ALA A 60 4.794 -0.458 14.934 1.00 4.55 H new ATOM 0 HB1 ALA A 60 3.228 -2.013 13.818 1.00 21.01 H new ATOM 0 HB2 ALA A 60 4.027 -2.776 15.213 1.00 21.01 H new ATOM 0 HB3 ALA A 60 2.344 -2.212 15.350 1.00 21.01 H new ATOM 958 N ARG A 61 1.816 0.728 15.670 1.00 72.22 N ATOM 959 CA ARG A 61 0.889 1.804 15.365 1.00 44.41 C ATOM 960 C ARG A 61 1.567 3.166 15.338 1.00 73.33 C ATOM 961 O ARG A 61 1.206 3.999 14.564 1.00 22.22 O ATOM 962 CB ARG A 61 -0.388 1.783 16.272 1.00 74.51 C ATOM 963 CG ARG A 61 -0.167 1.718 17.802 1.00 12.20 C ATOM 964 CD ARG A 61 0.511 2.935 18.404 1.00 62.41 C ATOM 965 NE ARG A 61 0.842 2.727 19.824 1.00 54.42 N ATOM 966 CZ ARG A 61 1.543 3.582 20.587 1.00 3.51 C ATOM 967 NH1 ARG A 61 1.871 4.785 20.126 1.00 11.30 N ATOM 968 NH2 ARG A 61 1.868 3.242 21.833 1.00 50.53 N ATOM 0 H ARG A 61 1.598 0.213 16.523 1.00 72.22 H new ATOM 0 HA ARG A 61 0.536 1.619 14.351 1.00 44.41 H new ATOM 0 HB2 ARG A 61 -0.973 2.676 16.053 1.00 74.51 H new ATOM 0 HB3 ARG A 61 -0.995 0.925 15.981 1.00 74.51 H new ATOM 0 HG2 ARG A 61 -1.133 1.581 18.288 1.00 12.20 H new ATOM 0 HG3 ARG A 61 0.432 0.837 18.030 1.00 12.20 H new ATOM 0 HD2 ARG A 61 1.421 3.157 17.847 1.00 62.41 H new ATOM 0 HD3 ARG A 61 -0.143 3.802 18.306 1.00 62.41 H new ATOM 0 HE ARG A 61 0.513 1.867 20.262 1.00 54.42 H new ATOM 0 HH11 ARG A 61 1.590 5.065 19.186 1.00 11.30 H new ATOM 0 HH12 ARG A 61 2.403 5.428 20.712 1.00 11.30 H new ATOM 0 HH21 ARG A 61 1.585 2.335 22.205 1.00 50.53 H new ATOM 0 HH22 ARG A 61 2.400 3.888 22.416 1.00 50.53 H new ATOM 982 N ASN A 62 2.550 3.376 16.199 1.00 74.23 N ATOM 983 CA ASN A 62 3.253 4.650 16.237 1.00 13.50 C ATOM 984 C ASN A 62 4.246 4.720 15.104 1.00 61.42 C ATOM 985 O ASN A 62 4.381 5.738 14.450 1.00 74.22 O ATOM 986 CB ASN A 62 3.958 4.888 17.576 1.00 5.24 C ATOM 987 CG ASN A 62 4.525 6.305 17.688 1.00 43.42 C ATOM 988 OD1 ASN A 62 3.978 7.258 17.117 1.00 4.22 O ATOM 989 ND2 ASN A 62 5.599 6.454 18.410 1.00 25.43 N ATOM 0 H ASN A 62 2.878 2.687 16.876 1.00 74.23 H new ATOM 0 HA ASN A 62 2.509 5.438 16.124 1.00 13.50 H new ATOM 0 HB2 ASN A 62 3.255 4.715 18.391 1.00 5.24 H new ATOM 0 HB3 ASN A 62 4.766 4.165 17.693 1.00 5.24 H new ATOM 0 HD21 ASN A 62 6.016 7.378 18.519 1.00 25.43 H new ATOM 0 HD22 ASN A 62 6.023 5.646 18.866 1.00 25.43 H new ATOM 996 N LEU A 63 4.916 3.599 14.863 1.00 51.43 N ATOM 997 CA LEU A 63 5.950 3.485 13.832 1.00 3.13 C ATOM 998 C LEU A 63 5.401 3.912 12.464 1.00 24.41 C ATOM 999 O LEU A 63 6.011 4.715 11.749 1.00 41.21 O ATOM 1000 CB LEU A 63 6.445 2.027 13.739 1.00 23.53 C ATOM 1001 CG LEU A 63 6.986 1.375 15.025 1.00 24.53 C ATOM 1002 CD1 LEU A 63 7.451 -0.039 14.728 1.00 3.44 C ATOM 1003 CD2 LEU A 63 8.129 2.186 15.596 1.00 0.24 C ATOM 0 H LEU A 63 4.758 2.734 15.380 1.00 51.43 H new ATOM 0 HA LEU A 63 6.776 4.140 14.108 1.00 3.13 H new ATOM 0 HB2 LEU A 63 5.621 1.415 13.373 1.00 23.53 H new ATOM 0 HB3 LEU A 63 7.231 1.986 12.985 1.00 23.53 H new ATOM 0 HG LEU A 63 6.184 1.344 15.763 1.00 24.53 H new ATOM 0 HD11 LEU A 63 7.833 -0.496 15.641 1.00 3.44 H new ATOM 0 HD12 LEU A 63 6.613 -0.626 14.351 1.00 3.44 H new ATOM 0 HD13 LEU A 63 8.241 -0.012 13.978 1.00 3.44 H new ATOM 0 HD21 LEU A 63 8.496 1.708 16.504 1.00 0.24 H new ATOM 0 HD22 LEU A 63 8.935 2.244 14.865 1.00 0.24 H new ATOM 0 HD23 LEU A 63 7.780 3.191 15.831 1.00 0.24 H new ATOM 1015 N ILE A 64 4.232 3.399 12.135 1.00 62.31 N ATOM 1016 CA ILE A 64 3.591 3.661 10.849 1.00 65.12 C ATOM 1017 C ILE A 64 3.055 5.099 10.815 1.00 71.34 C ATOM 1018 O ILE A 64 2.965 5.729 9.770 1.00 21.12 O ATOM 1019 CB ILE A 64 2.389 2.669 10.646 1.00 14.45 C ATOM 1020 CG1 ILE A 64 1.894 2.685 9.195 1.00 34.24 C ATOM 1021 CG2 ILE A 64 1.223 3.027 11.607 1.00 71.50 C ATOM 1022 CD1 ILE A 64 0.789 1.677 8.915 1.00 42.15 C ATOM 0 H ILE A 64 3.694 2.787 12.749 1.00 62.31 H new ATOM 0 HA ILE A 64 4.326 3.524 10.056 1.00 65.12 H new ATOM 0 HB ILE A 64 2.745 1.664 10.874 1.00 14.45 H new ATOM 0 HG12 ILE A 64 1.531 3.685 8.955 1.00 34.24 H new ATOM 0 HG13 ILE A 64 2.735 2.483 8.531 1.00 34.24 H new ATOM 0 HG21 ILE A 64 0.398 2.331 11.454 1.00 71.50 H new ATOM 0 HG22 ILE A 64 1.568 2.960 12.639 1.00 71.50 H new ATOM 0 HG23 ILE A 64 0.883 4.042 11.404 1.00 71.50 H new ATOM 0 HD11 ILE A 64 0.490 1.746 7.869 1.00 42.15 H new ATOM 0 HD12 ILE A 64 1.153 0.671 9.122 1.00 42.15 H new ATOM 0 HD13 ILE A 64 -0.069 1.891 9.553 1.00 42.15 H new ATOM 1034 N ARG A 65 2.774 5.604 11.984 1.00 74.13 N ATOM 1035 CA ARG A 65 2.077 6.834 12.167 1.00 34.53 C ATOM 1036 C ARG A 65 3.067 8.006 12.158 1.00 62.33 C ATOM 1037 O ARG A 65 2.717 9.127 11.794 1.00 14.54 O ATOM 1038 CB ARG A 65 1.296 6.683 13.483 1.00 71.10 C ATOM 1039 CG ARG A 65 0.190 7.659 13.780 1.00 64.40 C ATOM 1040 CD ARG A 65 0.690 9.005 14.122 1.00 72.33 C ATOM 1041 NE ARG A 65 1.580 8.985 15.291 1.00 4.32 N ATOM 1042 CZ ARG A 65 2.127 10.067 15.831 1.00 30.45 C ATOM 1043 NH1 ARG A 65 1.742 11.271 15.421 1.00 73.12 N ATOM 1044 NH2 ARG A 65 3.029 9.942 16.807 1.00 72.13 N ATOM 0 H ARG A 65 3.035 5.151 12.860 1.00 74.13 H new ATOM 0 HA ARG A 65 1.377 7.054 11.361 1.00 34.53 H new ATOM 0 HB2 ARG A 65 0.867 5.681 13.500 1.00 71.10 H new ATOM 0 HB3 ARG A 65 2.014 6.737 14.302 1.00 71.10 H new ATOM 0 HG2 ARG A 65 -0.468 7.730 12.914 1.00 64.40 H new ATOM 0 HG3 ARG A 65 -0.411 7.279 14.606 1.00 64.40 H new ATOM 0 HD2 ARG A 65 1.224 9.420 13.268 1.00 72.33 H new ATOM 0 HD3 ARG A 65 -0.154 9.665 14.321 1.00 72.33 H new ATOM 0 HE ARG A 65 1.791 8.081 15.715 1.00 4.32 H new ATOM 0 HH11 ARG A 65 1.030 11.359 14.696 1.00 73.12 H new ATOM 0 HH12 ARG A 65 2.158 12.107 15.832 1.00 73.12 H new ATOM 0 HH21 ARG A 65 3.298 9.015 17.138 1.00 72.13 H new ATOM 0 HH22 ARG A 65 3.450 10.773 17.222 1.00 72.13 H new ATOM 1058 N ARG A 66 4.311 7.726 12.521 1.00 13.03 N ATOM 1059 CA ARG A 66 5.369 8.733 12.486 1.00 21.41 C ATOM 1060 C ARG A 66 5.832 8.935 11.070 1.00 42.12 C ATOM 1061 O ARG A 66 6.508 9.913 10.751 1.00 74.01 O ATOM 1062 CB ARG A 66 6.562 8.313 13.326 1.00 54.12 C ATOM 1063 CG ARG A 66 6.302 8.213 14.804 1.00 21.45 C ATOM 1064 CD ARG A 66 7.565 7.817 15.530 1.00 3.03 C ATOM 1065 NE ARG A 66 8.645 8.798 15.328 1.00 42.42 N ATOM 1066 CZ ARG A 66 9.860 8.727 15.895 1.00 31.20 C ATOM 1067 NH1 ARG A 66 10.165 7.714 16.690 1.00 62.45 N ATOM 1068 NH2 ARG A 66 10.760 9.676 15.664 1.00 61.22 N ATOM 0 H ARG A 66 4.616 6.808 12.844 1.00 13.03 H new ATOM 0 HA ARG A 66 4.958 9.658 12.891 1.00 21.41 H new ATOM 0 HB2 ARG A 66 6.914 7.345 12.969 1.00 54.12 H new ATOM 0 HB3 ARG A 66 7.370 9.026 13.163 1.00 54.12 H new ATOM 0 HG2 ARG A 66 5.941 9.169 15.183 1.00 21.45 H new ATOM 0 HG3 ARG A 66 5.519 7.479 14.994 1.00 21.45 H new ATOM 0 HD2 ARG A 66 7.356 7.721 16.596 1.00 3.03 H new ATOM 0 HD3 ARG A 66 7.893 6.838 15.180 1.00 3.03 H new ATOM 0 HE ARG A 66 8.456 9.589 14.712 1.00 42.42 H new ATOM 0 HH11 ARG A 66 9.476 6.984 16.873 1.00 62.45 H new ATOM 0 HH12 ARG A 66 11.089 7.663 17.119 1.00 62.45 H new ATOM 0 HH21 ARG A 66 10.529 10.461 15.055 1.00 61.22 H new ATOM 0 HH22 ARG A 66 11.682 9.620 16.096 1.00 61.22 H new ATOM 1082 N HIS A 67 5.482 8.005 10.229 1.00 21.44 N ATOM 1083 CA HIS A 67 5.833 8.085 8.857 1.00 11.55 C ATOM 1084 C HIS A 67 4.737 8.663 8.023 1.00 31.45 C ATOM 1085 O HIS A 67 3.577 8.748 8.435 1.00 61.15 O ATOM 1086 CB HIS A 67 6.313 6.761 8.280 1.00 4.44 C ATOM 1087 CG HIS A 67 7.718 6.409 8.637 1.00 11.10 C ATOM 1088 ND1 HIS A 67 8.785 6.781 7.858 1.00 65.34 N ATOM 1089 CD2 HIS A 67 8.235 5.692 9.663 1.00 32.41 C ATOM 1090 CE1 HIS A 67 9.895 6.306 8.379 1.00 11.12 C ATOM 1091 NE2 HIS A 67 9.593 5.644 9.477 1.00 52.22 N ATOM 0 H HIS A 67 4.946 7.175 10.483 1.00 21.44 H new ATOM 0 HA HIS A 67 6.679 8.771 8.819 1.00 11.55 H new ATOM 0 HB2 HIS A 67 5.652 5.966 8.627 1.00 4.44 H new ATOM 0 HB3 HIS A 67 6.225 6.798 7.194 1.00 4.44 H new ATOM 0 HD1 HIS A 67 8.726 7.340 7.007 1.00 65.34 H new ATOM 0 HD2 HIS A 67 7.682 5.243 10.475 1.00 32.41 H new ATOM 0 HE1 HIS A 67 10.888 6.437 7.974 1.00 11.12 H new ATOM 1100 N GLU A 68 5.117 9.049 6.871 1.00 65.11 N ATOM 1101 CA GLU A 68 4.288 9.660 5.903 1.00 42.21 C ATOM 1102 C GLU A 68 3.749 8.600 4.959 1.00 35.12 C ATOM 1103 O GLU A 68 4.494 7.724 4.512 1.00 0.14 O ATOM 1104 CB GLU A 68 5.079 10.779 5.158 1.00 35.33 C ATOM 1105 CG GLU A 68 6.462 10.372 4.569 1.00 44.32 C ATOM 1106 CD GLU A 68 7.526 9.997 5.624 1.00 34.05 C ATOM 1107 OE1 GLU A 68 7.629 8.802 5.990 1.00 70.24 O ATOM 1108 OE2 GLU A 68 8.242 10.889 6.119 1.00 71.43 O ATOM 0 H GLU A 68 6.080 8.941 6.553 1.00 65.11 H new ATOM 0 HA GLU A 68 3.434 10.138 6.382 1.00 42.21 H new ATOM 0 HB2 GLU A 68 4.458 11.153 4.344 1.00 35.33 H new ATOM 0 HB3 GLU A 68 5.232 11.608 5.849 1.00 35.33 H new ATOM 0 HG2 GLU A 68 6.321 9.525 3.898 1.00 44.32 H new ATOM 0 HG3 GLU A 68 6.842 11.197 3.966 1.00 44.32 H new ATOM 1115 N ARG A 69 2.455 8.667 4.656 1.00 74.31 N ATOM 1116 CA ARG A 69 1.820 7.644 3.841 1.00 61.12 C ATOM 1117 C ARG A 69 2.368 7.664 2.417 1.00 1.32 C ATOM 1118 O ARG A 69 2.460 6.620 1.770 1.00 13.33 O ATOM 1119 CB ARG A 69 0.253 7.725 3.808 1.00 61.32 C ATOM 1120 CG ARG A 69 -0.532 7.570 5.136 1.00 3.40 C ATOM 1121 CD ARG A 69 -0.630 8.853 5.991 1.00 11.14 C ATOM 1122 NE ARG A 69 0.593 9.252 6.701 1.00 75.11 N ATOM 1123 CZ ARG A 69 0.816 10.505 7.161 1.00 13.44 C ATOM 1124 NH1 ARG A 69 -0.035 11.488 6.866 1.00 74.44 N ATOM 1125 NH2 ARG A 69 1.879 10.758 7.908 1.00 51.13 N ATOM 0 H ARG A 69 1.832 9.415 4.962 1.00 74.31 H new ATOM 0 HA ARG A 69 2.069 6.700 4.325 1.00 61.12 H new ATOM 0 HB2 ARG A 69 -0.018 8.688 3.375 1.00 61.32 H new ATOM 0 HB3 ARG A 69 -0.103 6.956 3.123 1.00 61.32 H new ATOM 0 HG2 ARG A 69 -1.541 7.227 4.906 1.00 3.40 H new ATOM 0 HG3 ARG A 69 -0.058 6.790 5.732 1.00 3.40 H new ATOM 0 HD2 ARG A 69 -0.934 9.675 5.343 1.00 11.14 H new ATOM 0 HD3 ARG A 69 -1.424 8.716 6.725 1.00 11.14 H new ATOM 0 HE ARG A 69 1.313 8.546 6.856 1.00 75.11 H new ATOM 0 HH11 ARG A 69 -0.856 11.296 6.292 1.00 74.44 H new ATOM 0 HH12 ARG A 69 0.135 12.432 7.214 1.00 74.44 H new ATOM 0 HH21 ARG A 69 2.531 10.008 8.138 1.00 51.13 H new ATOM 0 HH22 ARG A 69 2.046 11.703 8.254 1.00 51.13 H new ATOM 1139 N ASP A 70 2.750 8.861 1.953 1.00 3.34 N ATOM 1140 CA ASP A 70 3.289 9.055 0.591 1.00 34.12 C ATOM 1141 C ASP A 70 4.501 8.184 0.352 1.00 3.54 C ATOM 1142 O ASP A 70 4.472 7.282 -0.477 1.00 30.53 O ATOM 1143 CB ASP A 70 3.717 10.512 0.343 1.00 61.21 C ATOM 1144 CG ASP A 70 2.613 11.526 0.441 1.00 72.23 C ATOM 1145 OD1 ASP A 70 1.903 11.743 -0.547 1.00 42.13 O ATOM 1146 OD2 ASP A 70 2.472 12.159 1.507 1.00 55.04 O ATOM 0 H ASP A 70 2.697 9.719 2.502 1.00 3.34 H new ATOM 0 HA ASP A 70 2.481 8.785 -0.089 1.00 34.12 H new ATOM 0 HB2 ASP A 70 4.494 10.773 1.061 1.00 61.21 H new ATOM 0 HB3 ASP A 70 4.164 10.579 -0.649 1.00 61.21 H new ATOM 1151 N GLU A 71 5.553 8.448 1.118 1.00 45.40 N ATOM 1152 CA GLU A 71 6.846 7.782 0.958 1.00 52.23 C ATOM 1153 C GLU A 71 6.709 6.269 1.073 1.00 71.42 C ATOM 1154 O GLU A 71 7.283 5.529 0.280 1.00 63.45 O ATOM 1155 CB GLU A 71 7.836 8.303 2.002 1.00 53.51 C ATOM 1156 CG GLU A 71 9.262 7.800 1.827 1.00 2.21 C ATOM 1157 CD GLU A 71 9.870 8.246 0.519 1.00 35.33 C ATOM 1158 OE1 GLU A 71 10.384 9.379 0.452 1.00 70.35 O ATOM 1159 OE2 GLU A 71 9.853 7.473 -0.456 1.00 2.02 O ATOM 0 H GLU A 71 5.536 9.134 1.873 1.00 45.40 H new ATOM 0 HA GLU A 71 7.222 8.009 -0.040 1.00 52.23 H new ATOM 0 HB2 GLU A 71 7.842 9.392 1.967 1.00 53.51 H new ATOM 0 HB3 GLU A 71 7.483 8.018 2.993 1.00 53.51 H new ATOM 0 HG2 GLU A 71 9.876 8.161 2.652 1.00 2.21 H new ATOM 0 HG3 GLU A 71 9.270 6.711 1.876 1.00 2.21 H new ATOM 1166 N ILE A 72 5.925 5.817 2.044 1.00 0.34 N ATOM 1167 CA ILE A 72 5.725 4.393 2.250 1.00 1.25 C ATOM 1168 C ILE A 72 5.054 3.760 1.030 1.00 11.22 C ATOM 1169 O ILE A 72 5.501 2.731 0.533 1.00 23.45 O ATOM 1170 CB ILE A 72 4.875 4.090 3.517 1.00 71.20 C ATOM 1171 CG1 ILE A 72 5.540 4.669 4.775 1.00 1.14 C ATOM 1172 CG2 ILE A 72 4.668 2.582 3.678 1.00 50.43 C ATOM 1173 CD1 ILE A 72 4.753 4.419 6.052 1.00 1.02 C ATOM 0 H ILE A 72 5.420 6.416 2.698 1.00 0.34 H new ATOM 0 HA ILE A 72 6.714 3.959 2.396 1.00 1.25 H new ATOM 0 HB ILE A 72 3.903 4.566 3.391 1.00 71.20 H new ATOM 0 HG12 ILE A 72 6.535 4.236 4.881 1.00 1.14 H new ATOM 0 HG13 ILE A 72 5.672 5.743 4.644 1.00 1.14 H new ATOM 0 HG21 ILE A 72 4.071 2.390 4.570 1.00 50.43 H new ATOM 0 HG22 ILE A 72 4.149 2.190 2.803 1.00 50.43 H new ATOM 0 HG23 ILE A 72 5.636 2.090 3.776 1.00 50.43 H new ATOM 0 HD11 ILE A 72 5.284 4.856 6.898 1.00 1.02 H new ATOM 0 HD12 ILE A 72 3.767 4.876 5.967 1.00 1.02 H new ATOM 0 HD13 ILE A 72 4.644 3.346 6.208 1.00 1.02 H new ATOM 1185 N MET A 73 4.005 4.398 0.534 1.00 11.41 N ATOM 1186 CA MET A 73 3.260 3.866 -0.590 1.00 42.21 C ATOM 1187 C MET A 73 4.131 3.900 -1.866 1.00 23.44 C ATOM 1188 O MET A 73 4.125 2.951 -2.660 1.00 71.41 O ATOM 1189 CB MET A 73 1.938 4.642 -0.758 1.00 1.50 C ATOM 1190 CG MET A 73 0.885 3.996 -1.669 1.00 2.43 C ATOM 1191 SD MET A 73 1.361 3.854 -3.394 1.00 21.42 S ATOM 1192 CE MET A 73 -0.085 3.073 -4.065 1.00 31.24 C ATOM 0 H MET A 73 3.653 5.285 0.894 1.00 11.41 H new ATOM 0 HA MET A 73 3.003 2.823 -0.404 1.00 42.21 H new ATOM 0 HB2 MET A 73 1.497 4.785 0.228 1.00 1.50 H new ATOM 0 HB3 MET A 73 2.169 5.632 -1.150 1.00 1.50 H new ATOM 0 HG2 MET A 73 0.657 3.001 -1.287 1.00 2.43 H new ATOM 0 HG3 MET A 73 -0.034 4.579 -1.608 1.00 2.43 H new ATOM 0 HE1 MET A 73 0.205 2.167 -4.597 1.00 31.24 H new ATOM 0 HE2 MET A 73 -0.768 2.816 -3.256 1.00 31.24 H new ATOM 0 HE3 MET A 73 -0.581 3.756 -4.755 1.00 31.24 H new ATOM 1202 N GLU A 74 4.911 4.965 -2.038 1.00 41.11 N ATOM 1203 CA GLU A 74 5.816 5.056 -3.183 1.00 10.01 C ATOM 1204 C GLU A 74 6.896 3.982 -3.092 1.00 21.44 C ATOM 1205 O GLU A 74 7.351 3.436 -4.112 1.00 72.23 O ATOM 1206 CB GLU A 74 6.466 6.437 -3.288 1.00 44.41 C ATOM 1207 CG GLU A 74 5.495 7.573 -3.463 1.00 2.35 C ATOM 1208 CD GLU A 74 6.179 8.895 -3.703 1.00 13.53 C ATOM 1209 OE1 GLU A 74 6.163 9.386 -4.855 1.00 54.35 O ATOM 1210 OE2 GLU A 74 6.762 9.465 -2.757 1.00 72.24 O ATOM 0 H GLU A 74 4.936 5.767 -1.409 1.00 41.11 H new ATOM 0 HA GLU A 74 5.220 4.897 -4.081 1.00 10.01 H new ATOM 0 HB2 GLU A 74 7.056 6.616 -2.389 1.00 44.41 H new ATOM 0 HB3 GLU A 74 7.159 6.435 -4.129 1.00 44.41 H new ATOM 0 HG2 GLU A 74 4.834 7.354 -4.301 1.00 2.35 H new ATOM 0 HG3 GLU A 74 4.868 7.649 -2.574 1.00 2.35 H new ATOM 1217 N GLU A 75 7.298 3.671 -1.870 1.00 73.35 N ATOM 1218 CA GLU A 75 8.284 2.647 -1.619 1.00 35.55 C ATOM 1219 C GLU A 75 7.686 1.295 -2.021 1.00 44.51 C ATOM 1220 O GLU A 75 8.348 0.476 -2.665 1.00 43.14 O ATOM 1221 CB GLU A 75 8.671 2.643 -0.133 1.00 72.44 C ATOM 1222 CG GLU A 75 9.932 1.858 0.191 1.00 43.11 C ATOM 1223 CD GLU A 75 11.158 2.477 -0.457 1.00 51.45 C ATOM 1224 OE1 GLU A 75 11.588 2.002 -1.534 1.00 23.21 O ATOM 1225 OE2 GLU A 75 11.687 3.455 0.074 1.00 32.33 O ATOM 0 H GLU A 75 6.946 4.125 -1.027 1.00 73.35 H new ATOM 0 HA GLU A 75 9.185 2.840 -2.202 1.00 35.55 H new ATOM 0 HB2 GLU A 75 8.806 3.673 0.197 1.00 72.44 H new ATOM 0 HB3 GLU A 75 7.843 2.229 0.443 1.00 72.44 H new ATOM 0 HG2 GLU A 75 10.071 1.821 1.272 1.00 43.11 H new ATOM 0 HG3 GLU A 75 9.819 0.829 -0.151 1.00 43.11 H new ATOM 1232 N LEU A 76 6.406 1.098 -1.663 1.00 35.03 N ATOM 1233 CA LEU A 76 5.666 -0.112 -2.017 1.00 35.22 C ATOM 1234 C LEU A 76 5.622 -0.258 -3.522 1.00 12.41 C ATOM 1235 O LEU A 76 5.948 -1.317 -4.058 1.00 32.15 O ATOM 1236 CB LEU A 76 4.210 -0.049 -1.505 1.00 0.44 C ATOM 1237 CG LEU A 76 3.993 0.131 -0.008 1.00 41.55 C ATOM 1238 CD1 LEU A 76 2.513 0.188 0.304 1.00 51.05 C ATOM 1239 CD2 LEU A 76 4.637 -0.984 0.765 1.00 11.13 C ATOM 0 H LEU A 76 5.863 1.772 -1.123 1.00 35.03 H new ATOM 0 HA LEU A 76 6.176 -0.958 -1.556 1.00 35.22 H new ATOM 0 HB2 LEU A 76 3.710 0.773 -2.018 1.00 0.44 H new ATOM 0 HB3 LEU A 76 3.708 -0.967 -1.809 1.00 0.44 H new ATOM 0 HG LEU A 76 4.457 1.071 0.291 1.00 41.55 H new ATOM 0 HD11 LEU A 76 2.372 0.317 1.377 1.00 51.05 H new ATOM 0 HD12 LEU A 76 2.062 1.028 -0.225 1.00 51.05 H new ATOM 0 HD13 LEU A 76 2.038 -0.739 -0.016 1.00 51.05 H new ATOM 0 HD21 LEU A 76 4.468 -0.833 1.831 1.00 11.13 H new ATOM 0 HD22 LEU A 76 4.203 -1.936 0.460 1.00 11.13 H new ATOM 0 HD23 LEU A 76 5.709 -0.994 0.565 1.00 11.13 H new ATOM 1251 N THR A 77 5.237 0.826 -4.194 1.00 35.11 N ATOM 1252 CA THR A 77 5.107 0.840 -5.627 1.00 54.23 C ATOM 1253 C THR A 77 6.428 0.468 -6.341 1.00 63.50 C ATOM 1254 O THR A 77 6.425 -0.365 -7.257 1.00 14.13 O ATOM 1255 CB THR A 77 4.582 2.214 -6.103 1.00 61.11 C ATOM 1256 OG1 THR A 77 3.324 2.476 -5.457 1.00 62.43 O ATOM 1257 CG2 THR A 77 4.373 2.228 -7.611 1.00 40.12 C ATOM 0 H THR A 77 5.009 1.714 -3.748 1.00 35.11 H new ATOM 0 HA THR A 77 4.381 0.074 -5.899 1.00 54.23 H new ATOM 0 HB THR A 77 5.317 2.977 -5.848 1.00 61.11 H new ATOM 0 HG1 THR A 77 3.482 2.727 -4.523 1.00 62.43 H new ATOM 0 HG21 THR A 77 4.003 3.206 -7.918 1.00 40.12 H new ATOM 0 HG22 THR A 77 5.320 2.024 -8.111 1.00 40.12 H new ATOM 0 HG23 THR A 77 3.646 1.463 -7.885 1.00 40.12 H new ATOM 1265 N LYS A 78 7.557 1.045 -5.902 1.00 53.20 N ATOM 1266 CA LYS A 78 8.831 0.737 -6.552 1.00 45.30 C ATOM 1267 C LYS A 78 9.222 -0.709 -6.342 1.00 73.33 C ATOM 1268 O LYS A 78 9.553 -1.413 -7.285 1.00 45.22 O ATOM 1269 CB LYS A 78 9.994 1.620 -6.083 1.00 42.20 C ATOM 1270 CG LYS A 78 9.826 3.111 -6.278 1.00 25.34 C ATOM 1271 CD LYS A 78 11.151 3.857 -6.033 1.00 74.40 C ATOM 1272 CE LYS A 78 11.821 3.459 -4.713 1.00 41.21 C ATOM 1273 NZ LYS A 78 10.987 3.751 -3.534 1.00 34.53 N ATOM 0 H LYS A 78 7.612 1.705 -5.126 1.00 53.20 H new ATOM 0 HA LYS A 78 8.657 0.939 -7.609 1.00 45.30 H new ATOM 0 HB2 LYS A 78 10.161 1.431 -5.023 1.00 42.20 H new ATOM 0 HB3 LYS A 78 10.896 1.306 -6.609 1.00 42.20 H new ATOM 0 HG2 LYS A 78 9.475 3.311 -7.290 1.00 25.34 H new ATOM 0 HG3 LYS A 78 9.063 3.486 -5.596 1.00 25.34 H new ATOM 0 HD2 LYS A 78 11.834 3.655 -6.858 1.00 74.40 H new ATOM 0 HD3 LYS A 78 10.963 4.931 -6.031 1.00 74.40 H new ATOM 0 HE2 LYS A 78 12.050 2.393 -4.735 1.00 41.21 H new ATOM 0 HE3 LYS A 78 12.770 3.987 -4.620 1.00 41.21 H new ATOM 0 HZ1 LYS A 78 10.918 2.901 -2.938 1.00 34.53 H new ATOM 0 HZ2 LYS A 78 11.418 4.523 -2.987 1.00 34.53 H new ATOM 0 HZ3 LYS A 78 10.036 4.035 -3.843 1.00 34.53 H new ATOM 1287 N TYR A 79 9.159 -1.148 -5.111 1.00 53.01 N ATOM 1288 CA TYR A 79 9.596 -2.484 -4.753 1.00 71.23 C ATOM 1289 C TYR A 79 8.720 -3.554 -5.425 1.00 40.42 C ATOM 1290 O TYR A 79 9.199 -4.640 -5.788 1.00 1.13 O ATOM 1291 CB TYR A 79 9.605 -2.621 -3.235 1.00 74.32 C ATOM 1292 CG TYR A 79 10.221 -3.889 -2.718 1.00 52.32 C ATOM 1293 CD1 TYR A 79 11.542 -4.190 -2.989 1.00 54.01 C ATOM 1294 CD2 TYR A 79 9.492 -4.774 -1.954 1.00 34.43 C ATOM 1295 CE1 TYR A 79 12.123 -5.344 -2.506 1.00 74.03 C ATOM 1296 CE2 TYR A 79 10.058 -5.921 -1.462 1.00 2.35 C ATOM 1297 CZ TYR A 79 11.374 -6.204 -1.738 1.00 34.52 C ATOM 1298 OH TYR A 79 11.935 -7.357 -1.250 1.00 73.22 O ATOM 0 H TYR A 79 8.806 -0.597 -4.328 1.00 53.01 H new ATOM 0 HA TYR A 79 10.610 -2.643 -5.119 1.00 71.23 H new ATOM 0 HB2 TYR A 79 10.144 -1.774 -2.812 1.00 74.32 H new ATOM 0 HB3 TYR A 79 8.579 -2.559 -2.873 1.00 74.32 H new ATOM 0 HD1 TYR A 79 12.129 -3.511 -3.589 1.00 54.01 H new ATOM 0 HD2 TYR A 79 8.456 -4.560 -1.739 1.00 34.43 H new ATOM 0 HE1 TYR A 79 13.155 -5.570 -2.729 1.00 74.03 H new ATOM 0 HE2 TYR A 79 9.472 -6.600 -0.860 1.00 2.35 H new ATOM 0 HH TYR A 79 11.503 -7.599 -0.404 1.00 73.22 H new ATOM 1308 N TYR A 80 7.458 -3.231 -5.602 1.00 70.54 N ATOM 1309 CA TYR A 80 6.515 -4.098 -6.281 1.00 42.22 C ATOM 1310 C TYR A 80 6.924 -4.265 -7.749 1.00 53.33 C ATOM 1311 O TYR A 80 6.989 -5.384 -8.273 1.00 5.41 O ATOM 1312 CB TYR A 80 5.113 -3.479 -6.186 1.00 14.24 C ATOM 1313 CG TYR A 80 3.999 -4.269 -6.832 1.00 60.51 C ATOM 1314 CD1 TYR A 80 3.364 -5.288 -6.147 1.00 61.22 C ATOM 1315 CD2 TYR A 80 3.563 -3.974 -8.119 1.00 24.10 C ATOM 1316 CE1 TYR A 80 2.328 -5.997 -6.718 1.00 4.44 C ATOM 1317 CE2 TYR A 80 2.530 -4.680 -8.697 1.00 22.01 C ATOM 1318 CZ TYR A 80 1.915 -5.689 -7.990 1.00 61.52 C ATOM 1319 OH TYR A 80 0.883 -6.393 -8.561 1.00 30.34 O ATOM 0 H TYR A 80 7.052 -2.353 -5.277 1.00 70.54 H new ATOM 0 HA TYR A 80 6.510 -5.081 -5.810 1.00 42.22 H new ATOM 0 HB2 TYR A 80 4.869 -3.338 -5.133 1.00 14.24 H new ATOM 0 HB3 TYR A 80 5.142 -2.489 -6.641 1.00 14.24 H new ATOM 0 HD1 TYR A 80 3.685 -5.534 -5.146 1.00 61.22 H new ATOM 0 HD2 TYR A 80 4.041 -3.180 -8.674 1.00 24.10 H new ATOM 0 HE1 TYR A 80 1.844 -6.790 -6.167 1.00 4.44 H new ATOM 0 HE2 TYR A 80 2.205 -4.443 -9.699 1.00 22.01 H new ATOM 0 HH TYR A 80 1.245 -7.141 -9.080 1.00 30.34 H new ATOM 1329 N LEU A 81 7.214 -3.150 -8.392 1.00 2.33 N ATOM 1330 CA LEU A 81 7.582 -3.134 -9.796 1.00 64.51 C ATOM 1331 C LEU A 81 8.982 -3.692 -10.042 1.00 62.50 C ATOM 1332 O LEU A 81 9.199 -4.418 -11.022 1.00 44.02 O ATOM 1333 CB LEU A 81 7.452 -1.720 -10.373 1.00 41.45 C ATOM 1334 CG LEU A 81 6.042 -1.111 -10.369 1.00 52.05 C ATOM 1335 CD1 LEU A 81 6.070 0.297 -10.936 1.00 72.33 C ATOM 1336 CD2 LEU A 81 5.073 -1.981 -11.157 1.00 52.13 C ATOM 0 H LEU A 81 7.201 -2.228 -7.955 1.00 2.33 H new ATOM 0 HA LEU A 81 6.885 -3.792 -10.314 1.00 64.51 H new ATOM 0 HB2 LEU A 81 8.112 -1.059 -9.811 1.00 41.45 H new ATOM 0 HB3 LEU A 81 7.815 -1.735 -11.401 1.00 41.45 H new ATOM 0 HG LEU A 81 5.696 -1.064 -9.337 1.00 52.05 H new ATOM 0 HD11 LEU A 81 5.063 0.713 -10.926 1.00 72.33 H new ATOM 0 HD12 LEU A 81 6.727 0.921 -10.329 1.00 72.33 H new ATOM 0 HD13 LEU A 81 6.441 0.269 -11.961 1.00 72.33 H new ATOM 0 HD21 LEU A 81 4.081 -1.529 -11.140 1.00 52.13 H new ATOM 0 HD22 LEU A 81 5.415 -2.065 -12.188 1.00 52.13 H new ATOM 0 HD23 LEU A 81 5.027 -2.973 -10.708 1.00 52.13 H new ATOM 1348 N ALA A 82 9.922 -3.392 -9.144 1.00 22.25 N ATOM 1349 CA ALA A 82 11.315 -3.816 -9.300 1.00 43.05 C ATOM 1350 C ALA A 82 11.432 -5.328 -9.391 1.00 34.31 C ATOM 1351 O ALA A 82 12.230 -5.858 -10.171 1.00 15.04 O ATOM 1352 CB ALA A 82 12.167 -3.283 -8.166 1.00 4.04 C ATOM 0 H ALA A 82 9.742 -2.854 -8.296 1.00 22.25 H new ATOM 0 HA ALA A 82 11.683 -3.399 -10.237 1.00 43.05 H new ATOM 0 HB1 ALA A 82 13.198 -3.610 -8.301 1.00 4.04 H new ATOM 0 HB2 ALA A 82 12.129 -2.194 -8.163 1.00 4.04 H new ATOM 0 HB3 ALA A 82 11.788 -3.662 -7.217 1.00 4.04 H new ATOM 1358 N ASN A 83 10.590 -6.021 -8.639 1.00 10.35 N ATOM 1359 CA ASN A 83 10.581 -7.486 -8.623 1.00 42.02 C ATOM 1360 C ASN A 83 9.956 -8.100 -9.876 1.00 32.12 C ATOM 1361 O ASN A 83 9.822 -9.313 -9.973 1.00 44.41 O ATOM 1362 CB ASN A 83 9.931 -8.047 -7.352 1.00 50.44 C ATOM 1363 CG ASN A 83 10.822 -7.947 -6.125 1.00 65.44 C ATOM 1364 OD1 ASN A 83 11.577 -8.865 -5.829 1.00 53.34 O ATOM 1365 ND2 ASN A 83 10.748 -6.858 -5.406 1.00 54.20 N ATOM 0 H ASN A 83 9.897 -5.593 -8.025 1.00 10.35 H new ATOM 0 HA ASN A 83 11.630 -7.781 -8.621 1.00 42.02 H new ATOM 0 HB2 ASN A 83 9.001 -7.511 -7.161 1.00 50.44 H new ATOM 0 HB3 ASN A 83 9.669 -9.092 -7.518 1.00 50.44 H new ATOM 0 HD21 ASN A 83 11.329 -6.756 -4.574 1.00 54.20 H new ATOM 0 HD22 ASN A 83 10.110 -6.110 -5.677 1.00 54.20 H new ATOM 1372 N HIS A 84 9.570 -7.270 -10.832 1.00 73.44 N ATOM 1373 CA HIS A 84 9.087 -7.779 -12.115 1.00 5.43 C ATOM 1374 C HIS A 84 10.120 -7.571 -13.197 1.00 34.34 C ATOM 1375 O HIS A 84 9.871 -7.853 -14.361 1.00 5.40 O ATOM 1376 CB HIS A 84 7.742 -7.174 -12.547 1.00 42.43 C ATOM 1377 CG HIS A 84 6.589 -7.564 -11.687 1.00 13.31 C ATOM 1378 ND1 HIS A 84 6.256 -8.873 -11.438 1.00 53.13 N ATOM 1379 CD2 HIS A 84 5.702 -6.816 -10.997 1.00 23.25 C ATOM 1380 CE1 HIS A 84 5.228 -8.923 -10.635 1.00 63.42 C ATOM 1381 NE2 HIS A 84 4.861 -7.694 -10.343 1.00 72.02 N ATOM 0 H HIS A 84 9.579 -6.253 -10.751 1.00 73.44 H new ATOM 0 HA HIS A 84 8.918 -8.846 -11.969 1.00 5.43 H new ATOM 0 HB2 HIS A 84 7.829 -6.087 -12.547 1.00 42.43 H new ATOM 0 HB3 HIS A 84 7.534 -7.477 -13.573 1.00 42.43 H new ATOM 0 HD1 HIS A 84 6.740 -9.684 -11.823 1.00 53.13 H new ATOM 0 HD2 HIS A 84 5.659 -5.737 -10.963 1.00 23.25 H new ATOM 0 HE1 HIS A 84 4.757 -9.824 -10.271 1.00 63.42 H new ATOM 1390 N GLY A 85 11.287 -7.098 -12.810 1.00 53.23 N ATOM 1391 CA GLY A 85 12.323 -6.853 -13.786 1.00 13.55 C ATOM 1392 C GLY A 85 12.188 -5.480 -14.391 1.00 54.21 C ATOM 1393 O GLY A 85 12.649 -5.227 -15.508 1.00 54.03 O ATOM 0 H GLY A 85 11.537 -6.880 -11.846 1.00 53.23 H new ATOM 0 HA2 GLY A 85 13.301 -6.951 -13.315 1.00 13.55 H new ATOM 0 HA3 GLY A 85 12.271 -7.606 -14.572 1.00 13.55 H new ATOM 1397 N ILE A 86 11.532 -4.602 -13.677 1.00 52.25 N ATOM 1398 CA ILE A 86 11.336 -3.254 -14.130 1.00 23.53 C ATOM 1399 C ILE A 86 12.404 -2.381 -13.541 1.00 71.43 C ATOM 1400 O ILE A 86 12.611 -2.383 -12.330 1.00 74.41 O ATOM 1401 CB ILE A 86 9.950 -2.709 -13.709 1.00 52.34 C ATOM 1402 CG1 ILE A 86 8.836 -3.540 -14.337 1.00 11.44 C ATOM 1403 CG2 ILE A 86 9.792 -1.229 -14.079 1.00 4.52 C ATOM 1404 CD1 ILE A 86 7.462 -3.065 -13.959 1.00 34.24 C ATOM 0 H ILE A 86 11.120 -4.804 -12.766 1.00 52.25 H new ATOM 0 HA ILE A 86 11.388 -3.249 -15.219 1.00 23.53 H new ATOM 0 HB ILE A 86 9.877 -2.789 -12.624 1.00 52.34 H new ATOM 0 HG12 ILE A 86 8.938 -3.512 -15.422 1.00 11.44 H new ATOM 0 HG13 ILE A 86 8.951 -4.580 -14.032 1.00 11.44 H new ATOM 0 HG21 ILE A 86 8.807 -0.880 -13.769 1.00 4.52 H new ATOM 0 HG22 ILE A 86 10.560 -0.644 -13.574 1.00 4.52 H new ATOM 0 HG23 ILE A 86 9.896 -1.111 -15.158 1.00 4.52 H new ATOM 0 HD11 ILE A 86 6.714 -3.697 -14.438 1.00 34.24 H new ATOM 0 HD12 ILE A 86 7.343 -3.118 -12.877 1.00 34.24 H new ATOM 0 HD13 ILE A 86 7.330 -2.034 -14.288 1.00 34.24 H new ATOM 1416 N ASP A 87 13.081 -1.660 -14.379 1.00 53.44 N ATOM 1417 CA ASP A 87 14.105 -0.742 -13.930 1.00 44.24 C ATOM 1418 C ASP A 87 13.472 0.599 -13.694 1.00 51.21 C ATOM 1419 O ASP A 87 12.911 1.203 -14.621 1.00 44.21 O ATOM 1420 CB ASP A 87 15.232 -0.632 -14.953 1.00 35.42 C ATOM 1421 CG ASP A 87 16.296 0.358 -14.534 1.00 21.43 C ATOM 1422 OD1 ASP A 87 17.085 0.048 -13.611 1.00 71.30 O ATOM 1423 OD2 ASP A 87 16.381 1.444 -15.135 1.00 62.41 O ATOM 0 H ASP A 87 12.948 -1.684 -15.390 1.00 53.44 H new ATOM 0 HA ASP A 87 14.544 -1.114 -13.004 1.00 44.24 H new ATOM 0 HB2 ASP A 87 15.687 -1.612 -15.095 1.00 35.42 H new ATOM 0 HB3 ASP A 87 14.818 -0.331 -15.915 1.00 35.42 H new ATOM 1428 N ILE A 88 13.544 1.064 -12.476 1.00 12.14 N ATOM 1429 CA ILE A 88 12.876 2.279 -12.092 1.00 25.14 C ATOM 1430 C ILE A 88 13.809 3.471 -12.113 1.00 0.20 C ATOM 1431 O ILE A 88 14.978 3.391 -11.718 1.00 35.01 O ATOM 1432 CB ILE A 88 12.189 2.126 -10.711 1.00 45.01 C ATOM 1433 CG1 ILE A 88 11.184 0.979 -10.777 1.00 30.43 C ATOM 1434 CG2 ILE A 88 11.504 3.427 -10.259 1.00 20.43 C ATOM 1435 CD1 ILE A 88 10.491 0.707 -9.485 1.00 21.13 C ATOM 0 H ILE A 88 14.065 0.613 -11.724 1.00 12.14 H new ATOM 0 HA ILE A 88 12.101 2.469 -12.834 1.00 25.14 H new ATOM 0 HB ILE A 88 12.955 1.902 -9.968 1.00 45.01 H new ATOM 0 HG12 ILE A 88 10.437 1.207 -11.538 1.00 30.43 H new ATOM 0 HG13 ILE A 88 11.701 0.075 -11.098 1.00 30.43 H new ATOM 0 HG21 ILE A 88 11.036 3.273 -9.287 1.00 20.43 H new ATOM 0 HG22 ILE A 88 12.246 4.222 -10.183 1.00 20.43 H new ATOM 0 HG23 ILE A 88 10.744 3.710 -10.987 1.00 20.43 H new ATOM 0 HD11 ILE A 88 9.794 -0.121 -9.613 1.00 21.13 H new ATOM 0 HD12 ILE A 88 11.228 0.447 -8.725 1.00 21.13 H new ATOM 0 HD13 ILE A 88 9.945 1.596 -9.171 1.00 21.13 H new ATOM 1447 N LYS A 89 13.287 4.543 -12.616 1.00 15.40 N ATOM 1448 CA LYS A 89 13.960 5.818 -12.735 1.00 23.31 C ATOM 1449 C LYS A 89 13.869 6.599 -11.425 1.00 10.45 C ATOM 1450 O LYS A 89 12.840 6.535 -10.723 1.00 43.43 O ATOM 1451 CB LYS A 89 13.277 6.579 -13.855 1.00 25.21 C ATOM 1452 CG LYS A 89 13.807 7.973 -14.141 1.00 12.12 C ATOM 1453 CD LYS A 89 13.029 8.601 -15.292 1.00 31.13 C ATOM 1454 CE LYS A 89 13.223 7.811 -16.580 1.00 50.34 C ATOM 1455 NZ LYS A 89 12.382 8.302 -17.680 1.00 45.11 N ATOM 0 H LYS A 89 12.333 4.565 -12.976 1.00 15.40 H new ATOM 0 HA LYS A 89 15.018 5.675 -12.953 1.00 23.31 H new ATOM 0 HB2 LYS A 89 13.356 5.989 -14.768 1.00 25.21 H new ATOM 0 HB3 LYS A 89 12.216 6.658 -13.618 1.00 25.21 H new ATOM 0 HG2 LYS A 89 13.719 8.594 -13.250 1.00 12.12 H new ATOM 0 HG3 LYS A 89 14.867 7.924 -14.392 1.00 12.12 H new ATOM 0 HD2 LYS A 89 11.969 8.639 -15.041 1.00 31.13 H new ATOM 0 HD3 LYS A 89 13.358 9.630 -15.439 1.00 31.13 H new ATOM 0 HE2 LYS A 89 14.270 7.862 -16.878 1.00 50.34 H new ATOM 0 HE3 LYS A 89 12.995 6.761 -16.395 1.00 50.34 H new ATOM 0 HZ1 LYS A 89 12.776 7.981 -18.588 1.00 45.11 H new ATOM 0 HZ2 LYS A 89 11.417 7.931 -17.571 1.00 45.11 H new ATOM 0 HZ3 LYS A 89 12.358 9.342 -17.661 1.00 45.11 H new TER 1469 LYS A 89 ATOM 1470 N MET B 1 4.826 -9.794 -20.028 1.00 71.12 N ATOM 1471 CA MET B 1 5.414 -8.788 -19.149 1.00 33.03 C ATOM 1472 C MET B 1 5.223 -7.412 -19.766 1.00 30.13 C ATOM 1473 O MET B 1 6.039 -6.965 -20.589 1.00 31.43 O ATOM 1474 CB MET B 1 6.912 -9.056 -18.912 1.00 43.12 C ATOM 1475 CG MET B 1 7.228 -10.409 -18.280 1.00 14.34 C ATOM 1476 SD MET B 1 6.556 -10.596 -16.614 1.00 14.31 S ATOM 1477 CE MET B 1 7.063 -12.276 -16.230 1.00 14.04 C ATOM 0 H1 MET B 1 4.801 -10.711 -19.538 1.00 71.12 H new ATOM 0 H2 MET B 1 3.858 -9.511 -20.281 1.00 71.12 H new ATOM 0 H3 MET B 1 5.399 -9.878 -20.892 1.00 71.12 H new ATOM 0 HA MET B 1 4.912 -8.835 -18.183 1.00 33.03 H new ATOM 0 HB2 MET B 1 7.435 -8.985 -19.866 1.00 43.12 H new ATOM 0 HB3 MET B 1 7.311 -8.269 -18.271 1.00 43.12 H new ATOM 0 HG2 MET B 1 6.830 -11.200 -18.915 1.00 14.34 H new ATOM 0 HG3 MET B 1 8.309 -10.542 -18.245 1.00 14.34 H new ATOM 0 HE1 MET B 1 6.721 -12.540 -15.229 1.00 14.04 H new ATOM 0 HE2 MET B 1 6.627 -12.963 -16.955 1.00 14.04 H new ATOM 0 HE3 MET B 1 8.150 -12.347 -16.272 1.00 14.04 H new ATOM 1487 N GLY B 2 4.132 -6.772 -19.414 1.00 71.41 N ATOM 1488 CA GLY B 2 3.795 -5.497 -19.978 1.00 13.34 C ATOM 1489 C GLY B 2 3.158 -5.661 -21.342 1.00 65.13 C ATOM 1490 O GLY B 2 3.292 -6.726 -21.964 1.00 30.03 O ATOM 0 H GLY B 2 3.460 -7.123 -18.732 1.00 71.41 H new ATOM 0 HA2 GLY B 2 3.110 -4.970 -19.313 1.00 13.34 H new ATOM 0 HA3 GLY B 2 4.692 -4.884 -20.062 1.00 13.34 H new ATOM 1494 N PHE B 3 2.463 -4.626 -21.800 1.00 74.55 N ATOM 1495 CA PHE B 3 1.812 -4.605 -23.123 1.00 71.14 C ATOM 1496 C PHE B 3 0.631 -5.578 -23.160 1.00 43.22 C ATOM 1497 O PHE B 3 0.803 -6.798 -23.292 1.00 62.44 O ATOM 1498 CB PHE B 3 2.798 -4.911 -24.280 1.00 52.42 C ATOM 1499 CG PHE B 3 3.984 -3.985 -24.384 1.00 33.11 C ATOM 1500 CD1 PHE B 3 3.900 -2.808 -25.101 1.00 74.43 C ATOM 1501 CD2 PHE B 3 5.187 -4.306 -23.771 1.00 4.23 C ATOM 1502 CE1 PHE B 3 4.991 -1.966 -25.206 1.00 12.12 C ATOM 1503 CE2 PHE B 3 6.280 -3.469 -23.873 1.00 1.23 C ATOM 1504 CZ PHE B 3 6.180 -2.296 -24.591 1.00 22.34 C ATOM 0 H PHE B 3 2.329 -3.767 -21.267 1.00 74.55 H new ATOM 0 HA PHE B 3 1.446 -3.590 -23.275 1.00 71.14 H new ATOM 0 HB2 PHE B 3 3.164 -5.931 -24.162 1.00 52.42 H new ATOM 0 HB3 PHE B 3 2.249 -4.877 -25.221 1.00 52.42 H new ATOM 0 HD1 PHE B 3 2.972 -2.542 -25.585 1.00 74.43 H new ATOM 0 HD2 PHE B 3 5.269 -5.223 -23.207 1.00 4.23 H new ATOM 0 HE1 PHE B 3 4.912 -1.049 -25.770 1.00 12.12 H new ATOM 0 HE2 PHE B 3 7.210 -3.732 -23.392 1.00 1.23 H new ATOM 0 HZ PHE B 3 7.032 -1.637 -24.671 1.00 22.34 H new ATOM 1514 N THR B 4 -0.551 -5.047 -23.015 1.00 3.10 N ATOM 1515 CA THR B 4 -1.740 -5.852 -22.988 1.00 22.10 C ATOM 1516 C THR B 4 -2.942 -5.032 -23.489 1.00 30.22 C ATOM 1517 O THR B 4 -4.099 -5.311 -23.141 1.00 15.23 O ATOM 1518 CB THR B 4 -1.993 -6.389 -21.530 1.00 64.43 C ATOM 1519 OG1 THR B 4 -3.165 -7.225 -21.476 1.00 25.41 O ATOM 1520 CG2 THR B 4 -2.134 -5.245 -20.527 1.00 42.44 C ATOM 0 H THR B 4 -0.717 -4.046 -22.912 1.00 3.10 H new ATOM 0 HA THR B 4 -1.610 -6.708 -23.650 1.00 22.10 H new ATOM 0 HB THR B 4 -1.122 -6.985 -21.258 1.00 64.43 H new ATOM 0 HG1 THR B 4 -3.865 -6.844 -22.046 1.00 25.41 H new ATOM 0 HG21 THR B 4 -2.308 -5.653 -19.531 1.00 42.44 H new ATOM 0 HG22 THR B 4 -1.220 -4.651 -20.521 1.00 42.44 H new ATOM 0 HG23 THR B 4 -2.975 -4.613 -20.812 1.00 42.44 H new ATOM 1528 N ASP B 5 -2.679 -4.060 -24.355 1.00 61.41 N ATOM 1529 CA ASP B 5 -3.745 -3.191 -24.841 1.00 34.22 C ATOM 1530 C ASP B 5 -4.609 -3.833 -25.914 1.00 24.22 C ATOM 1531 O ASP B 5 -4.401 -3.663 -27.118 1.00 2.43 O ATOM 1532 CB ASP B 5 -3.289 -1.767 -25.223 1.00 61.31 C ATOM 1533 CG ASP B 5 -2.305 -1.668 -26.370 1.00 64.53 C ATOM 1534 OD1 ASP B 5 -1.097 -1.928 -26.166 1.00 55.31 O ATOM 1535 OD2 ASP B 5 -2.712 -1.265 -27.478 1.00 31.34 O ATOM 0 H ASP B 5 -1.753 -3.855 -24.730 1.00 61.41 H new ATOM 0 HA ASP B 5 -4.387 -3.057 -23.971 1.00 34.22 H new ATOM 0 HB2 ASP B 5 -4.172 -1.180 -25.477 1.00 61.31 H new ATOM 0 HB3 ASP B 5 -2.840 -1.303 -24.345 1.00 61.31 H new ATOM 1540 N GLU B 6 -5.525 -4.622 -25.443 1.00 12.32 N ATOM 1541 CA GLU B 6 -6.544 -5.276 -26.214 1.00 23.41 C ATOM 1542 C GLU B 6 -7.419 -5.950 -25.181 1.00 55.23 C ATOM 1543 O GLU B 6 -7.105 -7.040 -24.702 1.00 51.41 O ATOM 1544 CB GLU B 6 -5.939 -6.332 -27.189 1.00 1.33 C ATOM 1545 CG GLU B 6 -6.888 -6.851 -28.287 1.00 43.11 C ATOM 1546 CD GLU B 6 -8.164 -7.474 -27.768 1.00 42.11 C ATOM 1547 OE1 GLU B 6 -8.155 -8.663 -27.401 1.00 3.05 O ATOM 1548 OE2 GLU B 6 -9.197 -6.771 -27.729 1.00 52.21 O ATOM 0 H GLU B 6 -5.587 -4.842 -24.449 1.00 12.32 H new ATOM 0 HA GLU B 6 -7.091 -4.572 -26.841 1.00 23.41 H new ATOM 0 HB2 GLU B 6 -5.063 -5.896 -27.669 1.00 1.33 H new ATOM 0 HB3 GLU B 6 -5.592 -7.183 -26.603 1.00 1.33 H new ATOM 0 HG2 GLU B 6 -7.145 -6.024 -28.948 1.00 43.11 H new ATOM 0 HG3 GLU B 6 -6.357 -7.588 -28.890 1.00 43.11 H new ATOM 1555 N THR B 7 -8.452 -5.285 -24.777 1.00 3.14 N ATOM 1556 CA THR B 7 -9.280 -5.793 -23.727 1.00 53.12 C ATOM 1557 C THR B 7 -10.757 -5.658 -24.053 1.00 5.34 C ATOM 1558 O THR B 7 -11.280 -4.544 -24.132 1.00 63.11 O ATOM 1559 CB THR B 7 -8.969 -5.066 -22.389 1.00 1.50 C ATOM 1560 OG1 THR B 7 -9.015 -3.642 -22.590 1.00 51.24 O ATOM 1561 CG2 THR B 7 -7.607 -5.460 -21.825 1.00 72.21 C ATOM 0 H THR B 7 -8.745 -4.385 -25.158 1.00 3.14 H new ATOM 0 HA THR B 7 -9.055 -6.855 -23.625 1.00 53.12 H new ATOM 0 HB THR B 7 -9.726 -5.368 -21.666 1.00 1.50 H new ATOM 0 HG1 THR B 7 -9.763 -3.419 -23.183 1.00 51.24 H new ATOM 0 HG21 THR B 7 -7.433 -4.928 -20.890 1.00 72.21 H new ATOM 0 HG22 THR B 7 -7.587 -6.534 -21.640 1.00 72.21 H new ATOM 0 HG23 THR B 7 -6.828 -5.200 -22.541 1.00 72.21 H new ATOM 1569 N VAL B 8 -11.414 -6.785 -24.261 1.00 5.45 N ATOM 1570 CA VAL B 8 -12.857 -6.811 -24.478 1.00 41.22 C ATOM 1571 C VAL B 8 -13.565 -6.341 -23.192 1.00 74.05 C ATOM 1572 O VAL B 8 -13.087 -6.609 -22.090 1.00 74.40 O ATOM 1573 CB VAL B 8 -13.338 -8.244 -24.891 1.00 33.54 C ATOM 1574 CG1 VAL B 8 -12.996 -9.283 -23.833 1.00 62.43 C ATOM 1575 CG2 VAL B 8 -14.827 -8.260 -25.218 1.00 22.01 C ATOM 0 H VAL B 8 -10.971 -7.703 -24.285 1.00 5.45 H new ATOM 0 HA VAL B 8 -13.110 -6.137 -25.297 1.00 41.22 H new ATOM 0 HB VAL B 8 -12.796 -8.513 -25.798 1.00 33.54 H new ATOM 0 HG11 VAL B 8 -13.347 -10.262 -24.158 1.00 62.43 H new ATOM 0 HG12 VAL B 8 -11.916 -9.314 -23.689 1.00 62.43 H new ATOM 0 HG13 VAL B 8 -13.480 -9.018 -22.893 1.00 62.43 H new ATOM 0 HG21 VAL B 8 -15.127 -9.269 -25.500 1.00 22.01 H new ATOM 0 HG22 VAL B 8 -15.395 -7.944 -24.343 1.00 22.01 H new ATOM 0 HG23 VAL B 8 -15.025 -7.578 -26.045 1.00 22.01 H new ATOM 1585 N ARG B 9 -14.649 -5.608 -23.322 1.00 32.23 N ATOM 1586 CA ARG B 9 -15.335 -5.089 -22.152 1.00 15.21 C ATOM 1587 C ARG B 9 -16.664 -5.763 -21.919 1.00 35.42 C ATOM 1588 O ARG B 9 -17.351 -6.175 -22.869 1.00 71.00 O ATOM 1589 CB ARG B 9 -15.533 -3.581 -22.243 1.00 1.44 C ATOM 1590 CG ARG B 9 -14.248 -2.802 -22.321 1.00 23.13 C ATOM 1591 CD ARG B 9 -14.496 -1.313 -22.327 1.00 21.40 C ATOM 1592 NE ARG B 9 -15.279 -0.864 -23.477 1.00 62.24 N ATOM 1593 CZ ARG B 9 -15.534 0.419 -23.751 1.00 11.30 C ATOM 1594 NH1 ARG B 9 -15.080 1.386 -22.946 1.00 3.11 N ATOM 1595 NH2 ARG B 9 -16.242 0.737 -24.824 1.00 32.21 N ATOM 0 H ARG B 9 -15.074 -5.358 -24.215 1.00 32.23 H new ATOM 0 HA ARG B 9 -14.690 -5.311 -21.301 1.00 15.21 H new ATOM 0 HB2 ARG B 9 -16.137 -3.356 -23.122 1.00 1.44 H new ATOM 0 HB3 ARG B 9 -16.098 -3.245 -21.373 1.00 1.44 H new ATOM 0 HG2 ARG B 9 -13.613 -3.062 -21.474 1.00 23.13 H new ATOM 0 HG3 ARG B 9 -13.706 -3.084 -23.224 1.00 23.13 H new ATOM 0 HD2 ARG B 9 -15.016 -1.034 -21.410 1.00 21.40 H new ATOM 0 HD3 ARG B 9 -13.539 -0.792 -22.322 1.00 21.40 H new ATOM 0 HE ARG B 9 -15.653 -1.572 -24.108 1.00 62.24 H new ATOM 0 HH11 ARG B 9 -14.536 1.146 -22.117 1.00 3.11 H new ATOM 0 HH12 ARG B 9 -15.278 2.363 -23.161 1.00 3.11 H new ATOM 0 HH21 ARG B 9 -16.592 0.003 -25.440 1.00 32.21 H new ATOM 0 HH22 ARG B 9 -16.437 1.716 -25.034 1.00 32.21 H new ATOM 1609 N PHE B 10 -17.016 -5.871 -20.663 1.00 21.14 N ATOM 1610 CA PHE B 10 -18.278 -6.434 -20.223 1.00 25.13 C ATOM 1611 C PHE B 10 -18.771 -5.596 -19.057 1.00 35.23 C ATOM 1612 O PHE B 10 -18.193 -4.543 -18.775 1.00 4.43 O ATOM 1613 CB PHE B 10 -18.100 -7.896 -19.768 1.00 63.51 C ATOM 1614 CG PHE B 10 -17.572 -8.812 -20.828 1.00 65.20 C ATOM 1615 CD1 PHE B 10 -18.390 -9.241 -21.859 1.00 25.12 C ATOM 1616 CD2 PHE B 10 -16.254 -9.233 -20.802 1.00 4.34 C ATOM 1617 CE1 PHE B 10 -17.905 -10.072 -22.842 1.00 54.42 C ATOM 1618 CE2 PHE B 10 -15.764 -10.063 -21.780 1.00 10.24 C ATOM 1619 CZ PHE B 10 -16.589 -10.484 -22.803 1.00 2.40 C ATOM 0 H PHE B 10 -16.421 -5.563 -19.894 1.00 21.14 H new ATOM 0 HA PHE B 10 -18.993 -6.425 -21.045 1.00 25.13 H new ATOM 0 HB2 PHE B 10 -17.422 -7.919 -18.915 1.00 63.51 H new ATOM 0 HB3 PHE B 10 -19.061 -8.276 -19.422 1.00 63.51 H new ATOM 0 HD1 PHE B 10 -19.421 -8.920 -21.892 1.00 25.12 H new ATOM 0 HD2 PHE B 10 -15.604 -8.905 -20.004 1.00 4.34 H new ATOM 0 HE1 PHE B 10 -18.552 -10.401 -23.642 1.00 54.42 H new ATOM 0 HE2 PHE B 10 -14.734 -10.386 -21.749 1.00 10.24 H new ATOM 0 HZ PHE B 10 -16.204 -11.136 -23.573 1.00 2.40 H new ATOM 1629 N ASP B 11 -19.821 -6.037 -18.388 1.00 2.42 N ATOM 1630 CA ASP B 11 -20.320 -5.333 -17.203 1.00 1.22 C ATOM 1631 C ASP B 11 -19.281 -5.435 -16.123 1.00 55.33 C ATOM 1632 O ASP B 11 -18.860 -4.437 -15.534 1.00 12.11 O ATOM 1633 CB ASP B 11 -21.633 -5.946 -16.702 1.00 3.13 C ATOM 1634 CG ASP B 11 -22.762 -5.832 -17.682 1.00 51.01 C ATOM 1635 OD1 ASP B 11 -22.821 -6.639 -18.648 1.00 75.03 O ATOM 1636 OD2 ASP B 11 -23.634 -4.960 -17.493 1.00 11.44 O ATOM 0 H ASP B 11 -20.348 -6.874 -18.637 1.00 2.42 H new ATOM 0 HA ASP B 11 -20.513 -4.292 -17.464 1.00 1.22 H new ATOM 0 HB2 ASP B 11 -21.468 -6.999 -16.472 1.00 3.13 H new ATOM 0 HB3 ASP B 11 -21.920 -5.457 -15.771 1.00 3.13 H new ATOM 1641 N PHE B 12 -18.860 -6.644 -15.886 1.00 13.04 N ATOM 1642 CA PHE B 12 -17.823 -6.935 -14.949 1.00 64.42 C ATOM 1643 C PHE B 12 -16.952 -8.024 -15.536 1.00 43.40 C ATOM 1644 O PHE B 12 -17.457 -9.041 -16.044 1.00 23.10 O ATOM 1645 CB PHE B 12 -18.393 -7.352 -13.562 1.00 10.52 C ATOM 1646 CG PHE B 12 -19.228 -8.619 -13.548 1.00 25.14 C ATOM 1647 CD1 PHE B 12 -20.573 -8.591 -13.883 1.00 14.10 C ATOM 1648 CD2 PHE B 12 -18.657 -9.838 -13.196 1.00 50.33 C ATOM 1649 CE1 PHE B 12 -21.330 -9.747 -13.868 1.00 23.13 C ATOM 1650 CE2 PHE B 12 -19.410 -10.994 -13.180 1.00 0.40 C ATOM 1651 CZ PHE B 12 -20.749 -10.949 -13.517 1.00 21.23 C ATOM 0 H PHE B 12 -19.238 -7.470 -16.350 1.00 13.04 H new ATOM 0 HA PHE B 12 -17.231 -6.037 -14.773 1.00 64.42 H new ATOM 0 HB2 PHE B 12 -17.560 -7.480 -12.871 1.00 10.52 H new ATOM 0 HB3 PHE B 12 -19.002 -6.533 -13.179 1.00 10.52 H new ATOM 0 HD1 PHE B 12 -21.035 -7.654 -14.159 1.00 14.10 H new ATOM 0 HD2 PHE B 12 -17.611 -9.880 -12.932 1.00 50.33 H new ATOM 0 HE1 PHE B 12 -22.377 -9.710 -14.131 1.00 23.13 H new ATOM 0 HE2 PHE B 12 -18.953 -11.933 -12.904 1.00 0.40 H new ATOM 0 HZ PHE B 12 -21.340 -11.853 -13.506 1.00 21.23 H new ATOM 1661 N ASP B 13 -15.680 -7.818 -15.517 1.00 74.23 N ATOM 1662 CA ASP B 13 -14.771 -8.794 -16.040 1.00 40.13 C ATOM 1663 C ASP B 13 -13.846 -9.253 -14.955 1.00 21.43 C ATOM 1664 O ASP B 13 -13.622 -8.537 -13.959 1.00 15.21 O ATOM 1665 CB ASP B 13 -13.993 -8.255 -17.245 1.00 21.22 C ATOM 1666 CG ASP B 13 -13.082 -7.101 -16.913 1.00 63.12 C ATOM 1667 OD1 ASP B 13 -11.848 -7.281 -16.951 1.00 12.51 O ATOM 1668 OD2 ASP B 13 -13.581 -5.997 -16.647 1.00 22.40 O ATOM 0 H ASP B 13 -15.238 -6.978 -15.143 1.00 74.23 H new ATOM 0 HA ASP B 13 -15.348 -9.648 -16.396 1.00 40.13 H new ATOM 0 HB2 ASP B 13 -13.400 -9.063 -17.674 1.00 21.22 H new ATOM 0 HB3 ASP B 13 -14.701 -7.938 -18.011 1.00 21.22 H new ATOM 1673 N ASP B 14 -13.335 -10.430 -15.123 1.00 44.44 N ATOM 1674 CA ASP B 14 -12.488 -11.052 -14.138 1.00 30.35 C ATOM 1675 C ASP B 14 -11.115 -11.316 -14.693 1.00 32.51 C ATOM 1676 O ASP B 14 -10.976 -11.842 -15.801 1.00 14.13 O ATOM 1677 CB ASP B 14 -13.120 -12.366 -13.674 1.00 32.31 C ATOM 1678 CG ASP B 14 -12.217 -13.189 -12.781 1.00 20.12 C ATOM 1679 OD1 ASP B 14 -12.230 -13.000 -11.555 1.00 2.20 O ATOM 1680 OD2 ASP B 14 -11.511 -14.077 -13.298 1.00 31.43 O ATOM 0 H ASP B 14 -13.492 -10.999 -15.955 1.00 44.44 H new ATOM 0 HA ASP B 14 -12.388 -10.372 -13.292 1.00 30.35 H new ATOM 0 HB2 ASP B 14 -14.044 -12.146 -13.139 1.00 32.31 H new ATOM 0 HB3 ASP B 14 -13.391 -12.958 -14.548 1.00 32.31 H new ATOM 1685 N ASN B 15 -10.112 -10.926 -13.954 1.00 73.22 N ATOM 1686 CA ASN B 15 -8.749 -11.216 -14.321 1.00 50.54 C ATOM 1687 C ASN B 15 -7.895 -11.204 -13.067 1.00 61.43 C ATOM 1688 O ASN B 15 -7.516 -10.131 -12.573 1.00 24.23 O ATOM 1689 CB ASN B 15 -8.199 -10.190 -15.341 1.00 32.00 C ATOM 1690 CG ASN B 15 -6.840 -10.586 -15.945 1.00 70.30 C ATOM 1691 OD1 ASN B 15 -6.048 -11.312 -15.346 1.00 20.22 O ATOM 1692 ND2 ASN B 15 -6.559 -10.095 -17.131 1.00 72.10 N ATOM 0 H ASN B 15 -10.213 -10.401 -13.085 1.00 73.22 H new ATOM 0 HA ASN B 15 -8.718 -12.197 -14.796 1.00 50.54 H new ATOM 0 HB2 ASN B 15 -8.923 -10.068 -16.147 1.00 32.00 H new ATOM 0 HB3 ASN B 15 -8.101 -9.221 -14.851 1.00 32.00 H new ATOM 0 HD21 ASN B 15 -5.667 -10.314 -17.575 1.00 72.10 H new ATOM 0 HD22 ASN B 15 -7.233 -9.495 -17.607 1.00 72.10 H new ATOM 1699 N ARG B 16 -7.670 -12.370 -12.512 1.00 70.03 N ATOM 1700 CA ARG B 16 -6.785 -12.530 -11.392 1.00 2.22 C ATOM 1701 C ARG B 16 -5.670 -13.455 -11.789 1.00 51.01 C ATOM 1702 O ARG B 16 -5.858 -14.660 -11.972 1.00 55.10 O ATOM 1703 CB ARG B 16 -7.510 -12.967 -10.116 1.00 74.45 C ATOM 1704 CG ARG B 16 -8.454 -11.896 -9.589 1.00 42.13 C ATOM 1705 CD ARG B 16 -9.122 -12.291 -8.284 1.00 40.45 C ATOM 1706 NE ARG B 16 -9.984 -13.461 -8.424 1.00 2.24 N ATOM 1707 CZ ARG B 16 -10.756 -13.964 -7.453 1.00 21.23 C ATOM 1708 NH1 ARG B 16 -10.768 -13.409 -6.240 1.00 44.40 N ATOM 1709 NH2 ARG B 16 -11.513 -15.015 -7.701 1.00 13.01 N ATOM 0 H ARG B 16 -8.100 -13.238 -12.830 1.00 70.03 H new ATOM 0 HA ARG B 16 -6.359 -11.561 -11.133 1.00 2.22 H new ATOM 0 HB2 ARG B 16 -8.074 -13.878 -10.316 1.00 74.45 H new ATOM 0 HB3 ARG B 16 -6.775 -13.209 -9.348 1.00 74.45 H new ATOM 0 HG2 ARG B 16 -7.899 -10.969 -9.442 1.00 42.13 H new ATOM 0 HG3 ARG B 16 -9.220 -11.693 -10.337 1.00 42.13 H new ATOM 0 HD2 ARG B 16 -8.356 -12.496 -7.536 1.00 40.45 H new ATOM 0 HD3 ARG B 16 -9.712 -11.452 -7.914 1.00 40.45 H new ATOM 0 HE ARG B 16 -9.999 -13.930 -9.330 1.00 2.24 H new ATOM 0 HH11 ARG B 16 -10.186 -12.594 -6.046 1.00 44.40 H new ATOM 0 HH12 ARG B 16 -11.360 -13.799 -5.506 1.00 44.40 H new ATOM 0 HH21 ARG B 16 -11.508 -15.440 -8.628 1.00 13.01 H new ATOM 0 HH22 ARG B 16 -12.104 -15.403 -6.965 1.00 13.01 H new ATOM 1723 N LYS B 17 -4.528 -12.872 -11.942 1.00 11.11 N ATOM 1724 CA LYS B 17 -3.372 -13.495 -12.525 1.00 63.13 C ATOM 1725 C LYS B 17 -2.250 -12.534 -12.161 1.00 44.40 C ATOM 1726 O LYS B 17 -2.270 -11.971 -11.079 1.00 65.41 O ATOM 1727 CB LYS B 17 -3.634 -13.467 -14.055 1.00 21.11 C ATOM 1728 CG LYS B 17 -2.752 -14.350 -14.936 1.00 23.31 C ATOM 1729 CD LYS B 17 -3.063 -14.113 -16.420 1.00 43.14 C ATOM 1730 CE LYS B 17 -4.541 -14.340 -16.734 1.00 64.14 C ATOM 1731 NZ LYS B 17 -4.856 -14.098 -18.158 1.00 2.34 N ATOM 0 H LYS B 17 -4.361 -11.908 -11.654 1.00 11.11 H new ATOM 0 HA LYS B 17 -3.150 -14.513 -12.205 1.00 63.13 H new ATOM 0 HB2 LYS B 17 -4.672 -13.753 -14.224 1.00 21.11 H new ATOM 0 HB3 LYS B 17 -3.527 -12.437 -14.396 1.00 21.11 H new ATOM 0 HG2 LYS B 17 -1.702 -14.135 -14.740 1.00 23.31 H new ATOM 0 HG3 LYS B 17 -2.914 -15.399 -14.688 1.00 23.31 H new ATOM 0 HD2 LYS B 17 -2.786 -13.094 -16.691 1.00 43.14 H new ATOM 0 HD3 LYS B 17 -2.455 -14.781 -17.030 1.00 43.14 H new ATOM 0 HE2 LYS B 17 -4.813 -15.363 -16.473 1.00 64.14 H new ATOM 0 HE3 LYS B 17 -5.147 -13.681 -16.113 1.00 64.14 H new ATOM 0 HZ1 LYS B 17 -5.869 -14.264 -18.323 1.00 2.34 H new ATOM 0 HZ2 LYS B 17 -4.622 -13.115 -18.403 1.00 2.34 H new ATOM 0 HZ3 LYS B 17 -4.298 -14.744 -18.752 1.00 2.34 H new ATOM 1745 N LYS B 18 -1.311 -12.306 -13.043 1.00 4.44 N ATOM 1746 CA LYS B 18 -0.323 -11.262 -12.821 1.00 3.51 C ATOM 1747 C LYS B 18 -0.929 -9.922 -13.284 1.00 15.15 C ATOM 1748 O LYS B 18 -0.223 -8.984 -13.533 1.00 50.13 O ATOM 1749 CB LYS B 18 0.976 -11.552 -13.607 1.00 70.50 C ATOM 1750 CG LYS B 18 0.794 -11.624 -15.124 1.00 0.12 C ATOM 1751 CD LYS B 18 2.109 -11.893 -15.861 1.00 41.33 C ATOM 1752 CE LYS B 18 3.138 -10.762 -15.697 1.00 34.03 C ATOM 1753 NZ LYS B 18 2.641 -9.464 -16.215 1.00 64.01 N ATOM 0 H LYS B 18 -1.203 -12.820 -13.917 1.00 4.44 H new ATOM 0 HA LYS B 18 -0.068 -11.222 -11.762 1.00 3.51 H new ATOM 0 HB2 LYS B 18 1.706 -10.776 -13.377 1.00 70.50 H new ATOM 0 HB3 LYS B 18 1.394 -12.496 -13.258 1.00 70.50 H new ATOM 0 HG2 LYS B 18 0.079 -12.411 -15.364 1.00 0.12 H new ATOM 0 HG3 LYS B 18 0.367 -10.687 -15.480 1.00 0.12 H new ATOM 0 HD2 LYS B 18 2.540 -12.824 -15.493 1.00 41.33 H new ATOM 0 HD3 LYS B 18 1.901 -12.035 -16.921 1.00 41.33 H new ATOM 0 HE2 LYS B 18 3.392 -10.656 -14.642 1.00 34.03 H new ATOM 0 HE3 LYS B 18 4.056 -11.031 -16.220 1.00 34.03 H new ATOM 0 HZ1 LYS B 18 3.448 -8.857 -16.463 1.00 64.01 H new ATOM 0 HZ2 LYS B 18 2.059 -9.628 -17.061 1.00 64.01 H new ATOM 0 HZ3 LYS B 18 2.067 -8.996 -15.485 1.00 64.01 H new ATOM 1767 N ALA B 19 -2.266 -9.875 -13.327 1.00 42.00 N ATOM 1768 CA ALA B 19 -3.062 -8.758 -13.838 1.00 62.41 C ATOM 1769 C ALA B 19 -2.797 -7.446 -13.141 1.00 22.34 C ATOM 1770 O ALA B 19 -2.612 -6.417 -13.798 1.00 34.40 O ATOM 1771 CB ALA B 19 -4.512 -9.085 -13.697 1.00 33.32 C ATOM 0 H ALA B 19 -2.844 -10.646 -12.993 1.00 42.00 H new ATOM 0 HA ALA B 19 -2.772 -8.628 -14.881 1.00 62.41 H new ATOM 0 HB1 ALA B 19 -5.110 -8.257 -14.076 1.00 33.32 H new ATOM 0 HB2 ALA B 19 -4.739 -9.987 -14.266 1.00 33.32 H new ATOM 0 HB3 ALA B 19 -4.747 -9.251 -12.646 1.00 33.32 H new ATOM 1777 N ILE B 20 -2.793 -7.460 -11.819 1.00 31.22 N ATOM 1778 CA ILE B 20 -2.548 -6.241 -11.063 1.00 43.43 C ATOM 1779 C ILE B 20 -1.148 -5.742 -11.348 1.00 14.13 C ATOM 1780 O ILE B 20 -0.904 -4.534 -11.477 1.00 74.54 O ATOM 1781 CB ILE B 20 -2.780 -6.442 -9.543 1.00 53.14 C ATOM 1782 CG1 ILE B 20 -4.254 -6.801 -9.294 1.00 61.31 C ATOM 1783 CG2 ILE B 20 -2.376 -5.201 -8.753 1.00 11.24 C ATOM 1784 CD1 ILE B 20 -4.617 -6.990 -7.841 1.00 13.32 C ATOM 0 H ILE B 20 -2.955 -8.292 -11.251 1.00 31.22 H new ATOM 0 HA ILE B 20 -3.266 -5.487 -11.385 1.00 43.43 H new ATOM 0 HB ILE B 20 -2.151 -7.262 -9.196 1.00 53.14 H new ATOM 0 HG12 ILE B 20 -4.882 -6.014 -9.713 1.00 61.31 H new ATOM 0 HG13 ILE B 20 -4.488 -7.718 -9.836 1.00 61.31 H new ATOM 0 HG21 ILE B 20 -2.550 -5.373 -7.691 1.00 11.24 H new ATOM 0 HG22 ILE B 20 -1.319 -4.993 -8.918 1.00 11.24 H new ATOM 0 HG23 ILE B 20 -2.970 -4.349 -9.085 1.00 11.24 H new ATOM 0 HD11 ILE B 20 -5.675 -7.241 -7.760 1.00 13.32 H new ATOM 0 HD12 ILE B 20 -4.019 -7.798 -7.419 1.00 13.32 H new ATOM 0 HD13 ILE B 20 -4.419 -6.068 -7.294 1.00 13.32 H new ATOM 1796 N SER B 21 -0.252 -6.676 -11.515 1.00 42.52 N ATOM 1797 CA SER B 21 1.092 -6.359 -11.866 1.00 4.34 C ATOM 1798 C SER B 21 1.136 -5.845 -13.277 1.00 22.44 C ATOM 1799 O SER B 21 1.663 -4.806 -13.510 1.00 54.32 O ATOM 1800 CB SER B 21 1.996 -7.565 -11.712 1.00 13.44 C ATOM 1801 OG SER B 21 2.067 -7.982 -10.357 1.00 60.13 O ATOM 0 H SER B 21 -0.439 -7.673 -11.410 1.00 42.52 H new ATOM 0 HA SER B 21 1.455 -5.585 -11.190 1.00 4.34 H new ATOM 0 HB2 SER B 21 1.624 -8.383 -12.328 1.00 13.44 H new ATOM 0 HB3 SER B 21 2.995 -7.323 -12.074 1.00 13.44 H new ATOM 0 HG SER B 21 2.976 -7.841 -10.019 1.00 60.13 H new ATOM 1807 N GLU B 22 0.474 -6.567 -14.175 1.00 73.55 N ATOM 1808 CA GLU B 22 0.428 -6.312 -15.618 1.00 21.51 C ATOM 1809 C GLU B 22 -0.012 -4.882 -15.858 1.00 70.11 C ATOM 1810 O GLU B 22 0.521 -4.185 -16.726 1.00 53.41 O ATOM 1811 CB GLU B 22 -0.644 -7.236 -16.216 1.00 54.13 C ATOM 1812 CG GLU B 22 -0.653 -7.366 -17.724 1.00 74.04 C ATOM 1813 CD GLU B 22 0.513 -8.169 -18.214 1.00 43.22 C ATOM 1814 OE1 GLU B 22 1.404 -7.623 -18.856 1.00 34.21 O ATOM 1815 OE2 GLU B 22 0.551 -9.391 -17.927 1.00 11.33 O ATOM 0 H GLU B 22 -0.072 -7.386 -13.908 1.00 73.55 H new ATOM 0 HA GLU B 22 1.407 -6.484 -16.065 1.00 21.51 H new ATOM 0 HB2 GLU B 22 -0.516 -8.230 -15.788 1.00 54.13 H new ATOM 0 HB3 GLU B 22 -1.622 -6.875 -15.898 1.00 54.13 H new ATOM 0 HG2 GLU B 22 -1.582 -7.839 -18.044 1.00 74.04 H new ATOM 0 HG3 GLU B 22 -0.628 -6.374 -18.176 1.00 74.04 H new ATOM 1822 N THR B 23 -0.970 -4.451 -15.059 1.00 44.14 N ATOM 1823 CA THR B 23 -1.510 -3.133 -15.163 1.00 63.31 C ATOM 1824 C THR B 23 -0.431 -2.086 -14.837 1.00 22.33 C ATOM 1825 O THR B 23 -0.114 -1.257 -15.667 1.00 22.41 O ATOM 1826 CB THR B 23 -2.699 -2.977 -14.182 1.00 21.45 C ATOM 1827 OG1 THR B 23 -3.679 -3.996 -14.454 1.00 22.43 O ATOM 1828 CG2 THR B 23 -3.352 -1.607 -14.312 1.00 4.11 C ATOM 0 H THR B 23 -1.389 -5.017 -14.321 1.00 44.14 H new ATOM 0 HA THR B 23 -1.857 -2.975 -16.184 1.00 63.31 H new ATOM 0 HB THR B 23 -2.316 -3.079 -13.166 1.00 21.45 H new ATOM 0 HG1 THR B 23 -3.369 -4.853 -14.094 1.00 22.43 H new ATOM 0 HG21 THR B 23 -4.182 -1.532 -13.610 1.00 4.11 H new ATOM 0 HG22 THR B 23 -2.618 -0.832 -14.091 1.00 4.11 H new ATOM 0 HG23 THR B 23 -3.724 -1.476 -15.328 1.00 4.11 H new ATOM 1836 N LEU B 24 0.195 -2.204 -13.676 1.00 31.02 N ATOM 1837 CA LEU B 24 1.184 -1.213 -13.235 1.00 41.24 C ATOM 1838 C LEU B 24 2.484 -1.349 -14.018 1.00 32.41 C ATOM 1839 O LEU B 24 3.161 -0.366 -14.302 1.00 55.35 O ATOM 1840 CB LEU B 24 1.440 -1.335 -11.731 1.00 53.13 C ATOM 1841 CG LEU B 24 0.217 -1.158 -10.820 1.00 73.14 C ATOM 1842 CD1 LEU B 24 0.618 -1.285 -9.363 1.00 1.24 C ATOM 1843 CD2 LEU B 24 -0.469 0.182 -11.070 1.00 74.22 C ATOM 0 H LEU B 24 0.042 -2.970 -13.020 1.00 31.02 H new ATOM 0 HA LEU B 24 0.777 -0.221 -13.433 1.00 41.24 H new ATOM 0 HB2 LEU B 24 1.874 -2.316 -11.536 1.00 53.13 H new ATOM 0 HB3 LEU B 24 2.188 -0.594 -11.449 1.00 53.13 H new ATOM 0 HG LEU B 24 -0.495 -1.949 -11.057 1.00 73.14 H new ATOM 0 HD11 LEU B 24 -0.261 -1.157 -8.731 1.00 1.24 H new ATOM 0 HD12 LEU B 24 1.049 -2.271 -9.189 1.00 1.24 H new ATOM 0 HD13 LEU B 24 1.354 -0.519 -9.120 1.00 1.24 H new ATOM 0 HD21 LEU B 24 -1.331 0.278 -10.410 1.00 74.22 H new ATOM 0 HD22 LEU B 24 0.232 0.992 -10.871 1.00 74.22 H new ATOM 0 HD23 LEU B 24 -0.799 0.234 -12.108 1.00 74.22 H new ATOM 1855 N GLU B 25 2.788 -2.575 -14.370 1.00 62.13 N ATOM 1856 CA GLU B 25 3.949 -2.960 -15.151 1.00 2.41 C ATOM 1857 C GLU B 25 3.896 -2.221 -16.498 1.00 72.24 C ATOM 1858 O GLU B 25 4.910 -1.733 -17.005 1.00 74.22 O ATOM 1859 CB GLU B 25 3.864 -4.489 -15.314 1.00 54.11 C ATOM 1860 CG GLU B 25 4.985 -5.233 -15.985 1.00 11.42 C ATOM 1861 CD GLU B 25 4.767 -6.732 -15.805 1.00 3.34 C ATOM 1862 OE1 GLU B 25 4.117 -7.355 -16.657 1.00 63.14 O ATOM 1863 OE2 GLU B 25 5.207 -7.280 -14.778 1.00 32.25 O ATOM 0 H GLU B 25 2.208 -3.372 -14.109 1.00 62.13 H new ATOM 0 HA GLU B 25 4.896 -2.697 -14.679 1.00 2.41 H new ATOM 0 HB2 GLU B 25 3.741 -4.916 -14.319 1.00 54.11 H new ATOM 0 HB3 GLU B 25 2.951 -4.706 -15.869 1.00 54.11 H new ATOM 0 HG2 GLU B 25 5.021 -4.983 -17.045 1.00 11.42 H new ATOM 0 HG3 GLU B 25 5.942 -4.938 -15.555 1.00 11.42 H new ATOM 1870 N THR B 26 2.702 -2.161 -17.062 1.00 53.30 N ATOM 1871 CA THR B 26 2.429 -1.402 -18.264 1.00 33.03 C ATOM 1872 C THR B 26 2.355 0.120 -17.980 1.00 72.41 C ATOM 1873 O THR B 26 3.009 0.912 -18.663 1.00 41.40 O ATOM 1874 CB THR B 26 1.132 -1.894 -18.923 1.00 75.03 C ATOM 1875 OG1 THR B 26 1.261 -3.305 -19.201 1.00 45.33 O ATOM 1876 CG2 THR B 26 0.877 -1.161 -20.221 1.00 34.14 C ATOM 0 H THR B 26 1.885 -2.646 -16.690 1.00 53.30 H new ATOM 0 HA THR B 26 3.258 -1.564 -18.953 1.00 33.03 H new ATOM 0 HB THR B 26 0.299 -1.707 -18.246 1.00 75.03 H new ATOM 0 HG1 THR B 26 1.030 -3.819 -18.399 1.00 45.33 H new ATOM 0 HG21 THR B 26 -0.047 -1.526 -20.670 1.00 34.14 H new ATOM 0 HG22 THR B 26 0.787 -0.093 -20.024 1.00 34.14 H new ATOM 0 HG23 THR B 26 1.707 -1.335 -20.906 1.00 34.14 H new ATOM 1884 N VAL B 27 1.568 0.511 -16.955 1.00 2.23 N ATOM 1885 CA VAL B 27 1.367 1.935 -16.595 1.00 32.12 C ATOM 1886 C VAL B 27 2.693 2.662 -16.369 1.00 41.34 C ATOM 1887 O VAL B 27 2.850 3.814 -16.785 1.00 71.35 O ATOM 1888 CB VAL B 27 0.429 2.119 -15.349 1.00 31.20 C ATOM 1889 CG1 VAL B 27 0.312 3.581 -14.959 1.00 33.34 C ATOM 1890 CG2 VAL B 27 -0.958 1.572 -15.635 1.00 44.22 C ATOM 0 H VAL B 27 1.059 -0.141 -16.359 1.00 2.23 H new ATOM 0 HA VAL B 27 0.869 2.387 -17.453 1.00 32.12 H new ATOM 0 HB VAL B 27 0.877 1.566 -14.524 1.00 31.20 H new ATOM 0 HG11 VAL B 27 -0.344 3.675 -14.093 1.00 33.34 H new ATOM 0 HG12 VAL B 27 1.299 3.971 -14.711 1.00 33.34 H new ATOM 0 HG13 VAL B 27 -0.103 4.148 -15.792 1.00 33.34 H new ATOM 0 HG21 VAL B 27 -1.591 1.710 -14.759 1.00 44.22 H new ATOM 0 HG22 VAL B 27 -1.391 2.103 -16.483 1.00 44.22 H new ATOM 0 HG23 VAL B 27 -0.889 0.510 -15.869 1.00 44.22 H new ATOM 1900 N TYR B 28 3.649 1.977 -15.739 1.00 14.24 N ATOM 1901 CA TYR B 28 4.974 2.540 -15.501 1.00 64.25 C ATOM 1902 C TYR B 28 5.587 3.052 -16.815 1.00 73.33 C ATOM 1903 O TYR B 28 6.118 4.163 -16.890 1.00 2.42 O ATOM 1904 CB TYR B 28 5.929 1.484 -14.853 1.00 44.11 C ATOM 1905 CG TYR B 28 7.336 2.017 -14.627 1.00 5.03 C ATOM 1906 CD1 TYR B 28 8.297 1.935 -15.627 1.00 11.03 C ATOM 1907 CD2 TYR B 28 7.685 2.649 -13.440 1.00 51.10 C ATOM 1908 CE1 TYR B 28 9.545 2.473 -15.456 1.00 4.04 C ATOM 1909 CE2 TYR B 28 8.948 3.178 -13.259 1.00 34.53 C ATOM 1910 CZ TYR B 28 9.868 3.091 -14.277 1.00 53.11 C ATOM 1911 OH TYR B 28 11.105 3.664 -14.135 1.00 40.03 O ATOM 0 H TYR B 28 3.527 1.028 -15.384 1.00 14.24 H new ATOM 0 HA TYR B 28 4.858 3.374 -14.809 1.00 64.25 H new ATOM 0 HB2 TYR B 28 5.511 1.161 -13.900 1.00 44.11 H new ATOM 0 HB3 TYR B 28 5.978 0.604 -15.494 1.00 44.11 H new ATOM 0 HD1 TYR B 28 8.056 1.438 -16.555 1.00 11.03 H new ATOM 0 HD2 TYR B 28 6.957 2.728 -12.646 1.00 51.10 H new ATOM 0 HE1 TYR B 28 10.274 2.410 -16.250 1.00 4.04 H new ATOM 0 HE2 TYR B 28 9.210 3.656 -12.327 1.00 34.53 H new ATOM 0 HH TYR B 28 11.309 4.203 -14.928 1.00 40.03 H new ATOM 1921 N ARG B 29 5.445 2.258 -17.841 1.00 71.22 N ATOM 1922 CA ARG B 29 6.056 2.510 -19.131 1.00 53.43 C ATOM 1923 C ARG B 29 5.407 3.704 -19.811 1.00 74.24 C ATOM 1924 O ARG B 29 6.061 4.424 -20.577 1.00 64.31 O ATOM 1925 CB ARG B 29 5.929 1.262 -19.997 1.00 22.24 C ATOM 1926 CG ARG B 29 6.395 0.016 -19.277 1.00 4.51 C ATOM 1927 CD ARG B 29 6.254 -1.231 -20.114 1.00 31.43 C ATOM 1928 NE ARG B 29 6.512 -2.427 -19.303 1.00 44.43 N ATOM 1929 CZ ARG B 29 7.194 -3.508 -19.700 1.00 64.12 C ATOM 1930 NH1 ARG B 29 7.826 -3.514 -20.866 1.00 23.24 N ATOM 1931 NH2 ARG B 29 7.280 -4.570 -18.901 1.00 3.11 N ATOM 0 H ARG B 29 4.893 1.401 -17.810 1.00 71.22 H new ATOM 0 HA ARG B 29 7.111 2.744 -18.989 1.00 53.43 H new ATOM 0 HB2 ARG B 29 4.890 1.137 -20.300 1.00 22.24 H new ATOM 0 HB3 ARG B 29 6.513 1.393 -20.908 1.00 22.24 H new ATOM 0 HG2 ARG B 29 7.439 0.138 -18.988 1.00 4.51 H new ATOM 0 HG3 ARG B 29 5.822 -0.102 -18.358 1.00 4.51 H new ATOM 0 HD2 ARG B 29 5.251 -1.281 -20.537 1.00 31.43 H new ATOM 0 HD3 ARG B 29 6.951 -1.195 -20.951 1.00 31.43 H new ATOM 0 HE ARG B 29 6.139 -2.435 -18.354 1.00 44.43 H new ATOM 0 HH11 ARG B 29 7.794 -2.691 -21.467 1.00 23.24 H new ATOM 0 HH12 ARG B 29 8.344 -4.342 -21.161 1.00 23.24 H new ATOM 0 HH21 ARG B 29 6.826 -4.559 -17.988 1.00 3.11 H new ATOM 0 HH22 ARG B 29 7.799 -5.394 -19.203 1.00 3.11 H new ATOM 1945 N ALA B 30 4.132 3.903 -19.537 1.00 73.12 N ATOM 1946 CA ALA B 30 3.377 5.009 -20.109 1.00 11.21 C ATOM 1947 C ALA B 30 3.927 6.365 -19.662 1.00 35.24 C ATOM 1948 O ALA B 30 4.089 7.278 -20.477 1.00 2.02 O ATOM 1949 CB ALA B 30 1.901 4.889 -19.769 1.00 74.10 C ATOM 0 H ALA B 30 3.589 3.306 -18.914 1.00 73.12 H new ATOM 0 HA ALA B 30 3.488 4.952 -21.192 1.00 11.21 H new ATOM 0 HB1 ALA B 30 1.358 5.726 -20.207 1.00 74.10 H new ATOM 0 HB2 ALA B 30 1.510 3.953 -20.169 1.00 74.10 H new ATOM 0 HB3 ALA B 30 1.775 4.901 -18.686 1.00 74.10 H new ATOM 1955 N LEU B 31 4.234 6.503 -18.377 1.00 30.34 N ATOM 1956 CA LEU B 31 4.768 7.768 -17.894 1.00 3.11 C ATOM 1957 C LEU B 31 6.196 7.996 -18.327 1.00 44.32 C ATOM 1958 O LEU B 31 6.612 9.140 -18.500 1.00 31.13 O ATOM 1959 CB LEU B 31 4.571 8.035 -16.393 1.00 52.13 C ATOM 1960 CG LEU B 31 3.127 8.229 -15.925 1.00 52.20 C ATOM 1961 CD1 LEU B 31 2.365 6.925 -15.795 1.00 14.32 C ATOM 1962 CD2 LEU B 31 3.047 9.066 -14.672 1.00 64.11 C ATOM 0 H LEU B 31 4.126 5.776 -17.669 1.00 30.34 H new ATOM 0 HA LEU B 31 4.148 8.517 -18.386 1.00 3.11 H new ATOM 0 HB2 LEU B 31 5.002 7.202 -15.837 1.00 52.13 H new ATOM 0 HB3 LEU B 31 5.140 8.925 -16.126 1.00 52.13 H new ATOM 0 HG LEU B 31 2.625 8.788 -16.715 1.00 52.20 H new ATOM 0 HD11 LEU B 31 1.348 7.130 -15.460 1.00 14.32 H new ATOM 0 HD12 LEU B 31 2.334 6.424 -16.762 1.00 14.32 H new ATOM 0 HD13 LEU B 31 2.864 6.283 -15.069 1.00 14.32 H new ATOM 0 HD21 LEU B 31 2.004 9.178 -14.375 1.00 64.11 H new ATOM 0 HD22 LEU B 31 3.601 8.576 -13.871 1.00 64.11 H new ATOM 0 HD23 LEU B 31 3.478 10.049 -14.863 1.00 64.11 H new ATOM 1974 N GLU B 32 6.943 6.919 -18.510 1.00 61.05 N ATOM 1975 CA GLU B 32 8.304 7.010 -19.034 1.00 23.42 C ATOM 1976 C GLU B 32 8.287 7.653 -20.425 1.00 3.22 C ATOM 1977 O GLU B 32 9.148 8.469 -20.760 1.00 55.14 O ATOM 1978 CB GLU B 32 8.947 5.624 -19.086 1.00 53.02 C ATOM 1979 CG GLU B 32 9.168 4.992 -17.719 1.00 62.25 C ATOM 1980 CD GLU B 32 10.254 5.679 -16.908 1.00 5.22 C ATOM 1981 OE1 GLU B 32 10.125 6.872 -16.606 1.00 72.40 O ATOM 1982 OE2 GLU B 32 11.262 5.009 -16.560 1.00 1.21 O ATOM 0 H GLU B 32 6.633 5.969 -18.304 1.00 61.05 H new ATOM 0 HA GLU B 32 8.899 7.636 -18.369 1.00 23.42 H new ATOM 0 HB2 GLU B 32 8.316 4.964 -19.682 1.00 53.02 H new ATOM 0 HB3 GLU B 32 9.906 5.699 -19.600 1.00 53.02 H new ATOM 0 HG2 GLU B 32 8.234 5.019 -17.159 1.00 62.25 H new ATOM 0 HG3 GLU B 32 9.431 3.942 -17.850 1.00 62.25 H new ATOM 1989 N GLU B 33 7.279 7.298 -21.208 1.00 74.24 N ATOM 1990 CA GLU B 33 7.079 7.850 -22.550 1.00 15.42 C ATOM 1991 C GLU B 33 6.704 9.337 -22.493 1.00 24.10 C ATOM 1992 O GLU B 33 7.094 10.121 -23.357 1.00 41.42 O ATOM 1993 CB GLU B 33 5.958 7.089 -23.266 1.00 13.14 C ATOM 1994 CG GLU B 33 6.254 5.628 -23.553 1.00 13.21 C ATOM 1995 CD GLU B 33 7.343 5.438 -24.572 1.00 41.42 C ATOM 1996 OE1 GLU B 33 7.020 5.352 -25.781 1.00 71.32 O ATOM 1997 OE2 GLU B 33 8.527 5.368 -24.200 1.00 33.53 O ATOM 0 H GLU B 33 6.571 6.617 -20.934 1.00 74.24 H new ATOM 0 HA GLU B 33 8.018 7.743 -23.094 1.00 15.42 H new ATOM 0 HB2 GLU B 33 5.054 7.148 -22.659 1.00 13.14 H new ATOM 0 HB3 GLU B 33 5.743 7.592 -24.209 1.00 13.14 H new ATOM 0 HG2 GLU B 33 6.541 5.132 -22.626 1.00 13.21 H new ATOM 0 HG3 GLU B 33 5.345 5.141 -23.906 1.00 13.21 H new ATOM 2004 N LYS B 34 5.952 9.713 -21.474 1.00 20.22 N ATOM 2005 CA LYS B 34 5.445 11.084 -21.350 1.00 12.55 C ATOM 2006 C LYS B 34 6.355 12.010 -20.547 1.00 40.12 C ATOM 2007 O LYS B 34 6.123 13.219 -20.499 1.00 52.24 O ATOM 2008 CB LYS B 34 4.033 11.084 -20.768 1.00 73.45 C ATOM 2009 CG LYS B 34 2.973 10.469 -21.676 1.00 53.01 C ATOM 2010 CD LYS B 34 2.800 11.269 -22.972 1.00 2.32 C ATOM 2011 CE LYS B 34 2.282 12.681 -22.709 1.00 24.34 C ATOM 2012 NZ LYS B 34 2.138 13.456 -23.953 1.00 64.24 N ATOM 0 H LYS B 34 5.674 9.092 -20.714 1.00 20.22 H new ATOM 0 HA LYS B 34 5.424 11.488 -22.362 1.00 12.55 H new ATOM 0 HB2 LYS B 34 4.043 10.540 -19.823 1.00 73.45 H new ATOM 0 HB3 LYS B 34 3.747 12.111 -20.542 1.00 73.45 H new ATOM 0 HG2 LYS B 34 3.251 9.443 -21.917 1.00 53.01 H new ATOM 0 HG3 LYS B 34 2.021 10.425 -21.146 1.00 53.01 H new ATOM 0 HD2 LYS B 34 3.755 11.325 -23.494 1.00 2.32 H new ATOM 0 HD3 LYS B 34 2.107 10.746 -23.631 1.00 2.32 H new ATOM 0 HE2 LYS B 34 1.318 12.625 -22.203 1.00 24.34 H new ATOM 0 HE3 LYS B 34 2.966 13.199 -22.036 1.00 24.34 H new ATOM 0 HZ1 LYS B 34 1.784 14.408 -23.730 1.00 64.24 H new ATOM 0 HZ2 LYS B 34 3.062 13.532 -24.424 1.00 64.24 H new ATOM 0 HZ3 LYS B 34 1.466 12.976 -24.585 1.00 64.24 H new ATOM 2026 N GLY B 35 7.360 11.457 -19.913 1.00 22.25 N ATOM 2027 CA GLY B 35 8.299 12.280 -19.172 1.00 63.12 C ATOM 2028 C GLY B 35 7.796 12.662 -17.789 1.00 74.30 C ATOM 2029 O GLY B 35 8.074 13.763 -17.295 1.00 31.23 O ATOM 0 H GLY B 35 7.552 10.455 -19.891 1.00 22.25 H new ATOM 0 HA2 GLY B 35 9.243 11.744 -19.073 1.00 63.12 H new ATOM 0 HA3 GLY B 35 8.505 13.187 -19.740 1.00 63.12 H new ATOM 2033 N TYR B 36 7.051 11.777 -17.174 1.00 31.43 N ATOM 2034 CA TYR B 36 6.569 11.988 -15.817 1.00 34.02 C ATOM 2035 C TYR B 36 7.093 10.863 -14.974 1.00 23.41 C ATOM 2036 O TYR B 36 7.435 9.820 -15.515 1.00 5.22 O ATOM 2037 CB TYR B 36 5.039 11.952 -15.739 1.00 42.30 C ATOM 2038 CG TYR B 36 4.295 12.956 -16.576 1.00 52.14 C ATOM 2039 CD1 TYR B 36 3.572 12.549 -17.681 1.00 34.25 C ATOM 2040 CD2 TYR B 36 4.299 14.304 -16.254 1.00 43.44 C ATOM 2041 CE1 TYR B 36 2.864 13.448 -18.445 1.00 11.51 C ATOM 2042 CE2 TYR B 36 3.597 15.215 -17.015 1.00 1.33 C ATOM 2043 CZ TYR B 36 2.880 14.778 -18.109 1.00 24.02 C ATOM 2044 OH TYR B 36 2.161 15.680 -18.868 1.00 71.22 O ATOM 0 H TYR B 36 6.759 10.893 -17.590 1.00 31.43 H new ATOM 0 HA TYR B 36 6.908 12.966 -15.477 1.00 34.02 H new ATOM 0 HB2 TYR B 36 4.707 10.955 -16.029 1.00 42.30 H new ATOM 0 HB3 TYR B 36 4.748 12.095 -14.698 1.00 42.30 H new ATOM 0 HD1 TYR B 36 3.562 11.503 -17.951 1.00 34.25 H new ATOM 0 HD2 TYR B 36 4.859 14.645 -15.396 1.00 43.44 H new ATOM 0 HE1 TYR B 36 2.300 13.110 -19.302 1.00 11.51 H new ATOM 0 HE2 TYR B 36 3.609 16.263 -16.756 1.00 1.33 H new ATOM 0 HH TYR B 36 2.274 16.581 -18.500 1.00 71.22 H new ATOM 2054 N ASN B 37 7.161 11.048 -13.676 1.00 22.50 N ATOM 2055 CA ASN B 37 7.592 9.973 -12.789 1.00 55.31 C ATOM 2056 C ASN B 37 6.420 9.060 -12.475 1.00 33.35 C ATOM 2057 O ASN B 37 5.485 9.459 -11.764 1.00 31.53 O ATOM 2058 CB ASN B 37 8.226 10.506 -11.500 1.00 24.31 C ATOM 2059 CG ASN B 37 9.531 11.234 -11.739 1.00 11.01 C ATOM 2060 OD1 ASN B 37 9.560 12.438 -11.990 1.00 33.14 O ATOM 2061 ND2 ASN B 37 10.616 10.520 -11.654 1.00 23.33 N ATOM 0 H ASN B 37 6.927 11.923 -13.206 1.00 22.50 H new ATOM 0 HA ASN B 37 8.363 9.403 -13.308 1.00 55.31 H new ATOM 0 HB2 ASN B 37 7.525 11.181 -11.009 1.00 24.31 H new ATOM 0 HB3 ASN B 37 8.400 9.675 -10.817 1.00 24.31 H new ATOM 0 HD21 ASN B 37 11.527 10.957 -11.797 1.00 23.33 H new ATOM 0 HD22 ASN B 37 10.556 9.524 -11.444 1.00 23.33 H new ATOM 2068 N PRO B 38 6.447 7.822 -13.018 1.00 22.32 N ATOM 2069 CA PRO B 38 5.361 6.843 -12.870 1.00 53.54 C ATOM 2070 C PRO B 38 4.958 6.599 -11.434 1.00 65.51 C ATOM 2071 O PRO B 38 3.774 6.506 -11.126 1.00 71.21 O ATOM 2072 CB PRO B 38 5.948 5.565 -13.449 1.00 15.24 C ATOM 2073 CG PRO B 38 7.021 6.003 -14.376 1.00 62.51 C ATOM 2074 CD PRO B 38 7.555 7.288 -13.841 1.00 23.24 C ATOM 0 HA PRO B 38 4.456 7.197 -13.364 1.00 53.54 H new ATOM 0 HB2 PRO B 38 6.347 4.925 -12.662 1.00 15.24 H new ATOM 0 HB3 PRO B 38 5.188 4.987 -13.975 1.00 15.24 H new ATOM 0 HG2 PRO B 38 7.809 5.253 -14.437 1.00 62.51 H new ATOM 0 HG3 PRO B 38 6.630 6.137 -15.384 1.00 62.51 H new ATOM 0 HD2 PRO B 38 8.454 7.129 -13.245 1.00 23.24 H new ATOM 0 HD3 PRO B 38 7.822 7.974 -14.644 1.00 23.24 H new ATOM 2082 N ILE B 39 5.943 6.532 -10.563 1.00 52.31 N ATOM 2083 CA ILE B 39 5.719 6.233 -9.161 1.00 41.10 C ATOM 2084 C ILE B 39 4.818 7.295 -8.516 1.00 11.43 C ATOM 2085 O ILE B 39 3.876 6.960 -7.803 1.00 51.30 O ATOM 2086 CB ILE B 39 7.063 6.136 -8.387 1.00 12.11 C ATOM 2087 CG1 ILE B 39 8.015 5.120 -9.062 1.00 35.53 C ATOM 2088 CG2 ILE B 39 6.825 5.752 -6.927 1.00 32.23 C ATOM 2089 CD1 ILE B 39 7.471 3.702 -9.159 1.00 45.45 C ATOM 0 H ILE B 39 6.922 6.683 -10.805 1.00 52.31 H new ATOM 0 HA ILE B 39 5.219 5.266 -9.106 1.00 41.10 H new ATOM 0 HB ILE B 39 7.534 7.119 -8.411 1.00 12.11 H new ATOM 0 HG12 ILE B 39 8.248 5.474 -10.066 1.00 35.53 H new ATOM 0 HG13 ILE B 39 8.952 5.097 -8.506 1.00 35.53 H new ATOM 0 HG21 ILE B 39 7.781 5.691 -6.407 1.00 32.23 H new ATOM 0 HG22 ILE B 39 6.200 6.506 -6.450 1.00 32.23 H new ATOM 0 HG23 ILE B 39 6.325 4.785 -6.882 1.00 32.23 H new ATOM 0 HD11 ILE B 39 8.207 3.062 -9.646 1.00 45.45 H new ATOM 0 HD12 ILE B 39 7.265 3.322 -8.158 1.00 45.45 H new ATOM 0 HD13 ILE B 39 6.550 3.705 -9.743 1.00 45.45 H new ATOM 2101 N ASN B 40 5.086 8.568 -8.833 1.00 11.43 N ATOM 2102 CA ASN B 40 4.329 9.695 -8.261 1.00 75.43 C ATOM 2103 C ASN B 40 2.858 9.625 -8.648 1.00 41.33 C ATOM 2104 O ASN B 40 1.974 9.878 -7.829 1.00 75.32 O ATOM 2105 CB ASN B 40 4.895 11.060 -8.699 1.00 54.21 C ATOM 2106 CG ASN B 40 6.341 11.327 -8.287 1.00 42.52 C ATOM 2107 OD1 ASN B 40 7.059 12.054 -8.979 1.00 63.11 O ATOM 2108 ND2 ASN B 40 6.784 10.777 -7.177 1.00 4.53 N ATOM 0 H ASN B 40 5.821 8.846 -9.483 1.00 11.43 H new ATOM 0 HA ASN B 40 4.428 9.608 -7.179 1.00 75.43 H new ATOM 0 HB2 ASN B 40 4.824 11.133 -9.784 1.00 54.21 H new ATOM 0 HB3 ASN B 40 4.265 11.847 -8.284 1.00 54.21 H new ATOM 0 HD21 ASN B 40 7.742 10.948 -6.870 1.00 4.53 H new ATOM 0 HD22 ASN B 40 6.170 10.180 -6.623 1.00 4.53 H new ATOM 2115 N GLN B 41 2.583 9.292 -9.892 1.00 52.10 N ATOM 2116 CA GLN B 41 1.204 9.197 -10.310 1.00 43.12 C ATOM 2117 C GLN B 41 0.501 7.976 -9.780 1.00 42.23 C ATOM 2118 O GLN B 41 -0.670 8.050 -9.450 1.00 31.40 O ATOM 2119 CB GLN B 41 1.004 9.359 -11.802 1.00 33.43 C ATOM 2120 CG GLN B 41 1.234 10.778 -12.301 1.00 73.33 C ATOM 2121 CD GLN B 41 0.368 11.793 -11.569 1.00 33.34 C ATOM 2122 OE1 GLN B 41 -0.700 11.486 -11.087 1.00 60.51 O ATOM 2123 NE2 GLN B 41 0.805 12.997 -11.521 1.00 14.12 N ATOM 0 H GLN B 41 3.276 9.088 -10.612 1.00 52.10 H new ATOM 0 HA GLN B 41 0.724 10.058 -9.846 1.00 43.12 H new ATOM 0 HB2 GLN B 41 1.682 8.685 -12.326 1.00 33.43 H new ATOM 0 HB3 GLN B 41 -0.010 9.053 -12.059 1.00 33.43 H new ATOM 0 HG2 GLN B 41 2.284 11.040 -12.174 1.00 73.33 H new ATOM 0 HG3 GLN B 41 1.021 10.825 -13.369 1.00 73.33 H new ATOM 0 HE21 GLN B 41 1.708 13.229 -11.935 1.00 14.12 H new ATOM 0 HE22 GLN B 41 0.250 13.723 -11.069 1.00 14.12 H new ATOM 2132 N ILE B 42 1.203 6.854 -9.680 1.00 21.54 N ATOM 2133 CA ILE B 42 0.579 5.648 -9.151 1.00 31.44 C ATOM 2134 C ILE B 42 0.173 5.857 -7.695 1.00 34.41 C ATOM 2135 O ILE B 42 -0.973 5.598 -7.328 1.00 63.44 O ATOM 2136 CB ILE B 42 1.466 4.374 -9.294 1.00 42.14 C ATOM 2137 CG1 ILE B 42 1.755 4.093 -10.783 1.00 24.03 C ATOM 2138 CG2 ILE B 42 0.770 3.161 -8.644 1.00 43.23 C ATOM 2139 CD1 ILE B 42 2.661 2.899 -11.034 1.00 4.00 C ATOM 0 H ILE B 42 2.181 6.753 -9.951 1.00 21.54 H new ATOM 0 HA ILE B 42 -0.309 5.469 -9.758 1.00 31.44 H new ATOM 0 HB ILE B 42 2.412 4.546 -8.781 1.00 42.14 H new ATOM 0 HG12 ILE B 42 0.809 3.930 -11.299 1.00 24.03 H new ATOM 0 HG13 ILE B 42 2.211 4.979 -11.225 1.00 24.03 H new ATOM 0 HG21 ILE B 42 1.401 2.279 -8.752 1.00 43.23 H new ATOM 0 HG22 ILE B 42 0.603 3.361 -7.586 1.00 43.23 H new ATOM 0 HG23 ILE B 42 -0.187 2.985 -9.135 1.00 43.23 H new ATOM 0 HD11 ILE B 42 2.811 2.775 -12.107 1.00 4.00 H new ATOM 0 HD12 ILE B 42 3.624 3.065 -10.550 1.00 4.00 H new ATOM 0 HD13 ILE B 42 2.200 2.000 -10.626 1.00 4.00 H new ATOM 2151 N VAL B 43 1.095 6.364 -6.880 1.00 2.24 N ATOM 2152 CA VAL B 43 0.790 6.608 -5.479 1.00 14.13 C ATOM 2153 C VAL B 43 -0.398 7.582 -5.333 1.00 31.02 C ATOM 2154 O VAL B 43 -1.363 7.282 -4.622 1.00 34.21 O ATOM 2155 CB VAL B 43 2.038 7.079 -4.647 1.00 62.55 C ATOM 2156 CG1 VAL B 43 2.650 8.336 -5.224 1.00 45.12 C ATOM 2157 CG2 VAL B 43 1.662 7.320 -3.198 1.00 31.33 C ATOM 0 H VAL B 43 2.044 6.609 -7.162 1.00 2.24 H new ATOM 0 HA VAL B 43 0.496 5.649 -5.052 1.00 14.13 H new ATOM 0 HB VAL B 43 2.776 6.279 -4.699 1.00 62.55 H new ATOM 0 HG11 VAL B 43 3.510 8.631 -4.623 1.00 45.12 H new ATOM 0 HG12 VAL B 43 2.971 8.147 -6.248 1.00 45.12 H new ATOM 0 HG13 VAL B 43 1.911 9.137 -5.217 1.00 45.12 H new ATOM 0 HG21 VAL B 43 2.542 7.645 -2.643 1.00 31.33 H new ATOM 0 HG22 VAL B 43 0.894 8.092 -3.145 1.00 31.33 H new ATOM 0 HG23 VAL B 43 1.279 6.397 -2.763 1.00 31.33 H new ATOM 2167 N GLY B 44 -0.355 8.705 -6.067 1.00 21.13 N ATOM 2168 CA GLY B 44 -1.429 9.678 -6.016 1.00 13.41 C ATOM 2169 C GLY B 44 -2.743 9.089 -6.483 1.00 3.51 C ATOM 2170 O GLY B 44 -3.808 9.390 -5.923 1.00 24.51 O ATOM 0 H GLY B 44 0.411 8.950 -6.695 1.00 21.13 H new ATOM 0 HA2 GLY B 44 -1.538 10.046 -4.996 1.00 13.41 H new ATOM 0 HA3 GLY B 44 -1.173 10.535 -6.639 1.00 13.41 H new ATOM 2174 N TYR B 45 -2.670 8.234 -7.493 1.00 33.53 N ATOM 2175 CA TYR B 45 -3.837 7.577 -8.027 1.00 13.02 C ATOM 2176 C TYR B 45 -4.544 6.732 -6.982 1.00 34.42 C ATOM 2177 O TYR B 45 -5.738 6.899 -6.769 1.00 62.24 O ATOM 2178 CB TYR B 45 -3.506 6.739 -9.277 1.00 73.50 C ATOM 2179 CG TYR B 45 -4.673 5.905 -9.747 1.00 13.44 C ATOM 2180 CD1 TYR B 45 -4.622 4.520 -9.712 1.00 51.31 C ATOM 2181 CD2 TYR B 45 -5.829 6.502 -10.203 1.00 63.54 C ATOM 2182 CE1 TYR B 45 -5.689 3.762 -10.118 1.00 74.33 C ATOM 2183 CE2 TYR B 45 -6.903 5.754 -10.604 1.00 14.31 C ATOM 2184 CZ TYR B 45 -6.828 4.384 -10.561 1.00 51.52 C ATOM 2185 OH TYR B 45 -7.901 3.630 -10.959 1.00 12.22 O ATOM 0 H TYR B 45 -1.799 7.982 -7.959 1.00 33.53 H new ATOM 0 HA TYR B 45 -4.523 8.368 -8.331 1.00 13.02 H new ATOM 0 HB2 TYR B 45 -3.193 7.404 -10.082 1.00 73.50 H new ATOM 0 HB3 TYR B 45 -2.662 6.085 -9.057 1.00 73.50 H new ATOM 0 HD1 TYR B 45 -3.726 4.030 -9.359 1.00 51.31 H new ATOM 0 HD2 TYR B 45 -5.888 7.580 -10.245 1.00 63.54 H new ATOM 0 HE1 TYR B 45 -5.633 2.684 -10.089 1.00 74.33 H new ATOM 0 HE2 TYR B 45 -7.803 6.238 -10.952 1.00 14.31 H new ATOM 0 HH TYR B 45 -8.317 4.042 -11.745 1.00 12.22 H new ATOM 2195 N LEU B 46 -3.831 5.828 -6.337 1.00 21.33 N ATOM 2196 CA LEU B 46 -4.462 4.979 -5.336 1.00 73.24 C ATOM 2197 C LEU B 46 -4.880 5.758 -4.091 1.00 11.05 C ATOM 2198 O LEU B 46 -5.926 5.466 -3.494 1.00 54.23 O ATOM 2199 CB LEU B 46 -3.651 3.715 -4.968 1.00 34.22 C ATOM 2200 CG LEU B 46 -3.475 2.627 -6.063 1.00 63.31 C ATOM 2201 CD1 LEU B 46 -2.548 3.053 -7.166 1.00 32.45 C ATOM 2202 CD2 LEU B 46 -3.033 1.316 -5.459 1.00 53.33 C ATOM 0 H LEU B 46 -2.835 5.662 -6.481 1.00 21.33 H new ATOM 0 HA LEU B 46 -5.368 4.614 -5.821 1.00 73.24 H new ATOM 0 HB2 LEU B 46 -2.659 4.034 -4.649 1.00 34.22 H new ATOM 0 HB3 LEU B 46 -4.128 3.249 -4.106 1.00 34.22 H new ATOM 0 HG LEU B 46 -4.455 2.485 -6.519 1.00 63.31 H new ATOM 0 HD11 LEU B 46 -2.465 2.252 -7.901 1.00 32.45 H new ATOM 0 HD12 LEU B 46 -2.942 3.948 -7.648 1.00 32.45 H new ATOM 0 HD13 LEU B 46 -1.563 3.268 -6.751 1.00 32.45 H new ATOM 0 HD21 LEU B 46 -2.918 0.573 -6.248 1.00 53.33 H new ATOM 0 HD22 LEU B 46 -2.080 1.454 -4.948 1.00 53.33 H new ATOM 0 HD23 LEU B 46 -3.782 0.974 -4.745 1.00 53.33 H new ATOM 2214 N LEU B 47 -4.081 6.755 -3.707 1.00 30.35 N ATOM 2215 CA LEU B 47 -4.393 7.563 -2.526 1.00 62.22 C ATOM 2216 C LEU B 47 -5.664 8.380 -2.716 1.00 2.02 C ATOM 2217 O LEU B 47 -6.468 8.509 -1.787 1.00 14.32 O ATOM 2218 CB LEU B 47 -3.243 8.514 -2.138 1.00 11.34 C ATOM 2219 CG LEU B 47 -1.899 7.888 -1.750 1.00 31.14 C ATOM 2220 CD1 LEU B 47 -0.923 8.969 -1.323 1.00 32.45 C ATOM 2221 CD2 LEU B 47 -2.066 6.854 -0.656 1.00 64.32 C ATOM 0 H LEU B 47 -3.223 7.021 -4.190 1.00 30.35 H new ATOM 0 HA LEU B 47 -4.541 6.847 -1.717 1.00 62.22 H new ATOM 0 HB2 LEU B 47 -3.069 9.189 -2.976 1.00 11.34 H new ATOM 0 HB3 LEU B 47 -3.582 9.126 -1.302 1.00 11.34 H new ATOM 0 HG LEU B 47 -1.498 7.377 -2.625 1.00 31.14 H new ATOM 0 HD11 LEU B 47 0.028 8.513 -1.050 1.00 32.45 H new ATOM 0 HD12 LEU B 47 -0.768 9.665 -2.147 1.00 32.45 H new ATOM 0 HD13 LEU B 47 -1.328 9.506 -0.465 1.00 32.45 H new ATOM 0 HD21 LEU B 47 -1.094 6.430 -0.405 1.00 64.32 H new ATOM 0 HD22 LEU B 47 -2.495 7.326 0.228 1.00 64.32 H new ATOM 0 HD23 LEU B 47 -2.729 6.061 -1.003 1.00 64.32 H new ATOM 2233 N SER B 48 -5.851 8.919 -3.905 1.00 71.10 N ATOM 2234 CA SER B 48 -6.982 9.778 -4.157 1.00 51.32 C ATOM 2235 C SER B 48 -8.155 9.012 -4.804 1.00 11.31 C ATOM 2236 O SER B 48 -9.320 9.403 -4.644 1.00 44.13 O ATOM 2237 CB SER B 48 -6.533 10.952 -5.043 1.00 54.11 C ATOM 2238 OG SER B 48 -7.544 11.941 -5.183 1.00 41.43 O ATOM 0 H SER B 48 -5.235 8.776 -4.706 1.00 71.10 H new ATOM 0 HA SER B 48 -7.349 10.159 -3.204 1.00 51.32 H new ATOM 0 HB2 SER B 48 -5.640 11.407 -4.614 1.00 54.11 H new ATOM 0 HB3 SER B 48 -6.257 10.576 -6.028 1.00 54.11 H new ATOM 0 HG SER B 48 -7.555 12.270 -6.106 1.00 41.43 H new ATOM 2244 N GLY B 49 -7.861 7.911 -5.498 1.00 52.02 N ATOM 2245 CA GLY B 49 -8.891 7.159 -6.162 1.00 23.01 C ATOM 2246 C GLY B 49 -9.520 7.947 -7.290 1.00 23.21 C ATOM 2247 O GLY B 49 -10.751 8.041 -7.380 1.00 74.34 O ATOM 0 H GLY B 49 -6.920 7.534 -5.606 1.00 52.02 H new ATOM 0 HA2 GLY B 49 -8.470 6.234 -6.555 1.00 23.01 H new ATOM 0 HA3 GLY B 49 -9.659 6.879 -5.441 1.00 23.01 H new ATOM 2251 N ASP B 50 -8.695 8.521 -8.152 1.00 10.03 N ATOM 2252 CA ASP B 50 -9.223 9.327 -9.236 1.00 12.40 C ATOM 2253 C ASP B 50 -8.424 9.118 -10.521 1.00 12.33 C ATOM 2254 O ASP B 50 -7.201 9.180 -10.508 1.00 43.52 O ATOM 2255 CB ASP B 50 -9.220 10.797 -8.856 1.00 73.13 C ATOM 2256 CG ASP B 50 -9.976 11.624 -9.850 1.00 10.31 C ATOM 2257 OD1 ASP B 50 -11.222 11.717 -9.723 1.00 0.53 O ATOM 2258 OD2 ASP B 50 -9.354 12.182 -10.774 1.00 31.01 O ATOM 0 H ASP B 50 -7.678 8.445 -8.123 1.00 10.03 H new ATOM 0 HA ASP B 50 -10.250 9.009 -9.417 1.00 12.40 H new ATOM 0 HB2 ASP B 50 -9.663 10.919 -7.868 1.00 73.13 H new ATOM 0 HB3 ASP B 50 -8.192 11.155 -8.791 1.00 73.13 H new ATOM 2263 N PRO B 51 -9.113 8.870 -11.646 1.00 23.12 N ATOM 2264 CA PRO B 51 -8.483 8.584 -12.953 1.00 2.25 C ATOM 2265 C PRO B 51 -7.582 9.703 -13.518 1.00 33.34 C ATOM 2266 O PRO B 51 -6.679 9.417 -14.309 1.00 14.33 O ATOM 2267 CB PRO B 51 -9.674 8.350 -13.888 1.00 11.30 C ATOM 2268 CG PRO B 51 -10.823 9.006 -13.210 1.00 71.12 C ATOM 2269 CD PRO B 51 -10.587 8.827 -11.750 1.00 74.14 C ATOM 0 HA PRO B 51 -7.800 7.741 -12.851 1.00 2.25 H new ATOM 0 HB2 PRO B 51 -9.495 8.783 -14.872 1.00 11.30 H new ATOM 0 HB3 PRO B 51 -9.857 7.286 -14.037 1.00 11.30 H new ATOM 0 HG2 PRO B 51 -10.880 10.063 -13.471 1.00 71.12 H new ATOM 0 HG3 PRO B 51 -11.767 8.552 -13.512 1.00 71.12 H new ATOM 0 HD2 PRO B 51 -11.057 9.618 -11.165 1.00 74.14 H new ATOM 0 HD3 PRO B 51 -10.990 7.881 -11.389 1.00 74.14 H new ATOM 2277 N ALA B 52 -7.814 10.964 -13.115 1.00 11.14 N ATOM 2278 CA ALA B 52 -7.075 12.125 -13.684 1.00 31.04 C ATOM 2279 C ALA B 52 -5.564 12.078 -13.419 1.00 23.03 C ATOM 2280 O ALA B 52 -4.799 12.847 -14.008 1.00 53.03 O ATOM 2281 CB ALA B 52 -7.654 13.434 -13.186 1.00 22.24 C ATOM 0 H ALA B 52 -8.500 11.214 -12.403 1.00 11.14 H new ATOM 0 HA ALA B 52 -7.205 12.060 -14.764 1.00 31.04 H new ATOM 0 HB1 ALA B 52 -7.096 14.266 -13.616 1.00 22.24 H new ATOM 0 HB2 ALA B 52 -8.700 13.506 -13.484 1.00 22.24 H new ATOM 0 HB3 ALA B 52 -7.583 13.473 -12.099 1.00 22.24 H new ATOM 2287 N TYR B 53 -5.152 11.205 -12.534 1.00 30.03 N ATOM 2288 CA TYR B 53 -3.747 11.017 -12.219 1.00 73.14 C ATOM 2289 C TYR B 53 -3.014 10.257 -13.315 1.00 62.21 C ATOM 2290 O TYR B 53 -1.820 10.432 -13.518 1.00 13.15 O ATOM 2291 CB TYR B 53 -3.615 10.298 -10.880 1.00 0.01 C ATOM 2292 CG TYR B 53 -3.989 11.199 -9.753 1.00 40.12 C ATOM 2293 CD1 TYR B 53 -3.051 12.052 -9.225 1.00 41.22 C ATOM 2294 CD2 TYR B 53 -5.270 11.239 -9.246 1.00 52.32 C ATOM 2295 CE1 TYR B 53 -3.357 12.911 -8.226 1.00 2.34 C ATOM 2296 CE2 TYR B 53 -5.599 12.112 -8.240 1.00 40.41 C ATOM 2297 CZ TYR B 53 -4.636 12.949 -7.728 1.00 14.43 C ATOM 2298 OH TYR B 53 -4.959 13.836 -6.723 1.00 11.52 O ATOM 0 H TYR B 53 -5.780 10.599 -12.006 1.00 30.03 H new ATOM 0 HA TYR B 53 -3.280 12.000 -12.150 1.00 73.14 H new ATOM 0 HB2 TYR B 53 -4.254 9.415 -10.872 1.00 0.01 H new ATOM 0 HB3 TYR B 53 -2.590 9.951 -10.749 1.00 0.01 H new ATOM 0 HD1 TYR B 53 -2.045 12.037 -9.617 1.00 41.22 H new ATOM 0 HD2 TYR B 53 -6.023 10.576 -9.645 1.00 52.32 H new ATOM 0 HE1 TYR B 53 -2.598 13.565 -7.822 1.00 2.34 H new ATOM 0 HE2 TYR B 53 -6.607 12.141 -7.853 1.00 40.41 H new ATOM 0 HH TYR B 53 -5.905 13.733 -6.488 1.00 11.52 H new ATOM 2308 N ILE B 54 -3.729 9.450 -14.051 1.00 24.31 N ATOM 2309 CA ILE B 54 -3.103 8.622 -15.055 1.00 11.10 C ATOM 2310 C ILE B 54 -3.286 9.205 -16.459 1.00 42.02 C ATOM 2311 O ILE B 54 -4.426 9.433 -16.903 1.00 35.35 O ATOM 2312 CB ILE B 54 -3.635 7.176 -14.984 1.00 21.03 C ATOM 2313 CG1 ILE B 54 -3.447 6.632 -13.556 1.00 72.22 C ATOM 2314 CG2 ILE B 54 -2.932 6.274 -16.004 1.00 10.44 C ATOM 2315 CD1 ILE B 54 -2.003 6.643 -13.049 1.00 73.31 C ATOM 0 H ILE B 54 -4.741 9.346 -13.978 1.00 24.31 H new ATOM 0 HA ILE B 54 -2.033 8.602 -14.846 1.00 11.10 H new ATOM 0 HB ILE B 54 -4.697 7.181 -15.231 1.00 21.03 H new ATOM 0 HG12 ILE B 54 -4.061 7.221 -12.874 1.00 72.22 H new ATOM 0 HG13 ILE B 54 -3.822 5.609 -13.520 1.00 72.22 H new ATOM 0 HG21 ILE B 54 -3.329 5.262 -15.929 1.00 10.44 H new ATOM 0 HG22 ILE B 54 -3.105 6.658 -17.009 1.00 10.44 H new ATOM 0 HG23 ILE B 54 -1.861 6.260 -15.800 1.00 10.44 H new ATOM 0 HD11 ILE B 54 -1.970 6.242 -12.036 1.00 73.31 H new ATOM 0 HD12 ILE B 54 -1.383 6.029 -13.702 1.00 73.31 H new ATOM 0 HD13 ILE B 54 -1.626 7.666 -13.047 1.00 73.31 H new ATOM 2327 N PRO B 55 -2.152 9.489 -17.158 1.00 55.13 N ATOM 2328 CA PRO B 55 -2.138 10.050 -18.528 1.00 70.52 C ATOM 2329 C PRO B 55 -3.022 9.276 -19.527 1.00 43.33 C ATOM 2330 O PRO B 55 -3.207 8.054 -19.424 1.00 74.44 O ATOM 2331 CB PRO B 55 -0.664 9.954 -18.933 1.00 42.14 C ATOM 2332 CG PRO B 55 0.074 10.024 -17.653 1.00 53.20 C ATOM 2333 CD PRO B 55 -0.777 9.302 -16.645 1.00 12.44 C ATOM 0 HA PRO B 55 -2.545 11.061 -18.542 1.00 70.52 H new ATOM 0 HB2 PRO B 55 -0.457 9.023 -19.461 1.00 42.14 H new ATOM 0 HB3 PRO B 55 -0.381 10.768 -19.600 1.00 42.14 H new ATOM 0 HG2 PRO B 55 1.055 9.557 -17.742 1.00 53.20 H new ATOM 0 HG3 PRO B 55 0.240 11.059 -17.354 1.00 53.20 H new ATOM 0 HD2 PRO B 55 -0.513 8.246 -16.579 1.00 12.44 H new ATOM 0 HD3 PRO B 55 -0.660 9.723 -15.646 1.00 12.44 H new ATOM 2341 N ARG B 56 -3.524 9.995 -20.507 1.00 22.22 N ATOM 2342 CA ARG B 56 -4.470 9.468 -21.482 1.00 14.52 C ATOM 2343 C ARG B 56 -3.772 9.052 -22.764 1.00 5.33 C ATOM 2344 O ARG B 56 -4.410 8.606 -23.717 1.00 34.34 O ATOM 2345 CB ARG B 56 -5.535 10.521 -21.759 1.00 14.23 C ATOM 2346 CG ARG B 56 -6.327 10.901 -20.520 1.00 32.02 C ATOM 2347 CD ARG B 56 -7.268 12.057 -20.775 1.00 35.12 C ATOM 2348 NE ARG B 56 -6.543 13.281 -21.123 1.00 33.41 N ATOM 2349 CZ ARG B 56 -6.995 14.514 -20.929 1.00 61.35 C ATOM 2350 NH1 ARG B 56 -8.205 14.712 -20.425 1.00 35.50 N ATOM 2351 NH2 ARG B 56 -6.233 15.551 -21.237 1.00 3.23 N ATOM 0 H ARG B 56 -3.287 10.976 -20.656 1.00 22.22 H new ATOM 0 HA ARG B 56 -4.940 8.574 -21.072 1.00 14.52 H new ATOM 0 HB2 ARG B 56 -5.059 11.413 -22.168 1.00 14.23 H new ATOM 0 HB3 ARG B 56 -6.219 10.147 -22.521 1.00 14.23 H new ATOM 0 HG2 ARG B 56 -6.899 10.038 -20.178 1.00 32.02 H new ATOM 0 HG3 ARG B 56 -5.638 11.166 -19.718 1.00 32.02 H new ATOM 0 HD2 ARG B 56 -7.952 11.798 -21.583 1.00 35.12 H new ATOM 0 HD3 ARG B 56 -7.875 12.234 -19.887 1.00 35.12 H new ATOM 0 HE ARG B 56 -5.621 13.178 -21.547 1.00 33.41 H new ATOM 0 HH11 ARG B 56 -8.794 13.915 -20.184 1.00 35.50 H new ATOM 0 HH12 ARG B 56 -8.547 15.662 -20.278 1.00 35.50 H new ATOM 0 HH21 ARG B 56 -5.301 15.402 -21.623 1.00 3.23 H new ATOM 0 HH22 ARG B 56 -6.578 16.499 -21.089 1.00 3.23 H new ATOM 2365 N TYR B 57 -2.465 9.195 -22.764 1.00 43.04 N ATOM 2366 CA TYR B 57 -1.616 8.840 -23.894 1.00 4.12 C ATOM 2367 C TYR B 57 -1.780 7.370 -24.288 1.00 51.02 C ATOM 2368 O TYR B 57 -1.804 7.031 -25.476 1.00 13.33 O ATOM 2369 CB TYR B 57 -0.149 9.164 -23.544 1.00 1.43 C ATOM 2370 CG TYR B 57 0.885 8.759 -24.582 1.00 3.05 C ATOM 2371 CD1 TYR B 57 0.953 9.388 -25.812 1.00 5.30 C ATOM 2372 CD2 TYR B 57 1.802 7.757 -24.312 1.00 4.51 C ATOM 2373 CE1 TYR B 57 1.904 9.024 -26.747 1.00 44.03 C ATOM 2374 CE2 TYR B 57 2.752 7.386 -25.238 1.00 13.24 C ATOM 2375 CZ TYR B 57 2.799 8.021 -26.453 1.00 24.22 C ATOM 2376 OH TYR B 57 3.745 7.643 -27.384 1.00 13.33 O ATOM 0 H TYR B 57 -1.948 9.567 -21.968 1.00 43.04 H new ATOM 0 HA TYR B 57 -1.920 9.429 -24.760 1.00 4.12 H new ATOM 0 HB2 TYR B 57 -0.065 10.237 -23.374 1.00 1.43 H new ATOM 0 HB3 TYR B 57 0.097 8.672 -22.603 1.00 1.43 H new ATOM 0 HD1 TYR B 57 0.252 10.176 -26.046 1.00 5.30 H new ATOM 0 HD2 TYR B 57 1.772 7.256 -23.356 1.00 4.51 H new ATOM 0 HE1 TYR B 57 1.944 9.524 -27.703 1.00 44.03 H new ATOM 0 HE2 TYR B 57 3.456 6.600 -25.009 1.00 13.24 H new ATOM 0 HH TYR B 57 4.297 6.923 -27.015 1.00 13.33 H new ATOM 2386 N GLN B 58 -1.919 6.502 -23.306 1.00 52.11 N ATOM 2387 CA GLN B 58 -2.025 5.088 -23.590 1.00 11.20 C ATOM 2388 C GLN B 58 -3.099 4.398 -22.798 1.00 21.02 C ATOM 2389 O GLN B 58 -3.815 4.999 -21.986 1.00 4.22 O ATOM 2390 CB GLN B 58 -0.688 4.355 -23.369 1.00 2.45 C ATOM 2391 CG GLN B 58 0.392 4.719 -24.357 1.00 31.10 C ATOM 2392 CD GLN B 58 1.664 3.959 -24.130 1.00 4.31 C ATOM 2393 OE1 GLN B 58 2.535 4.392 -23.383 1.00 31.34 O ATOM 2394 NE2 GLN B 58 1.791 2.830 -24.769 1.00 20.14 N ATOM 0 H GLN B 58 -1.961 6.748 -22.317 1.00 52.11 H new ATOM 0 HA GLN B 58 -2.300 5.036 -24.644 1.00 11.20 H new ATOM 0 HB2 GLN B 58 -0.331 4.572 -22.362 1.00 2.45 H new ATOM 0 HB3 GLN B 58 -0.864 3.280 -23.421 1.00 2.45 H new ATOM 0 HG2 GLN B 58 0.034 4.526 -25.368 1.00 31.10 H new ATOM 0 HG3 GLN B 58 0.595 5.788 -24.290 1.00 31.10 H new ATOM 0 HE21 GLN B 58 1.043 2.504 -25.382 1.00 20.14 H new ATOM 0 HE22 GLN B 58 2.638 2.273 -24.656 1.00 20.14 H new ATOM 2403 N ASP B 59 -3.147 3.113 -23.040 1.00 23.20 N ATOM 2404 CA ASP B 59 -4.021 2.119 -22.441 1.00 2.51 C ATOM 2405 C ASP B 59 -3.892 2.040 -20.934 1.00 0.33 C ATOM 2406 O ASP B 59 -4.723 1.421 -20.280 1.00 11.21 O ATOM 2407 CB ASP B 59 -3.690 0.771 -23.053 1.00 61.14 C ATOM 2408 CG ASP B 59 -2.202 0.451 -22.979 1.00 23.32 C ATOM 2409 OD1 ASP B 59 -1.787 -0.273 -22.085 1.00 33.40 O ATOM 2410 OD2 ASP B 59 -1.430 0.950 -23.853 1.00 72.41 O ATOM 0 H ASP B 59 -2.519 2.690 -23.724 1.00 23.20 H new ATOM 0 HA ASP B 59 -5.051 2.411 -22.645 1.00 2.51 H new ATOM 0 HB2 ASP B 59 -4.253 -0.007 -22.538 1.00 61.14 H new ATOM 0 HB3 ASP B 59 -4.010 0.759 -24.095 1.00 61.14 H new ATOM 2415 N ALA B 60 -2.854 2.667 -20.398 1.00 73.20 N ATOM 2416 CA ALA B 60 -2.590 2.710 -18.966 1.00 60.42 C ATOM 2417 C ALA B 60 -3.844 3.116 -18.186 1.00 22.05 C ATOM 2418 O ALA B 60 -4.174 2.504 -17.173 1.00 14.21 O ATOM 2419 CB ALA B 60 -1.464 3.696 -18.694 1.00 52.51 C ATOM 0 H ALA B 60 -2.161 3.168 -20.954 1.00 73.20 H new ATOM 0 HA ALA B 60 -2.297 1.714 -18.634 1.00 60.42 H new ATOM 0 HB1 ALA B 60 -1.263 3.732 -17.623 1.00 52.51 H new ATOM 0 HB2 ALA B 60 -0.565 3.377 -19.222 1.00 52.51 H new ATOM 0 HB3 ALA B 60 -1.756 4.687 -19.042 1.00 52.51 H new ATOM 2425 N ARG B 61 -4.554 4.136 -18.678 1.00 43.22 N ATOM 2426 CA ARG B 61 -5.780 4.573 -18.033 1.00 74.41 C ATOM 2427 C ARG B 61 -6.870 3.500 -18.124 1.00 43.33 C ATOM 2428 O ARG B 61 -7.551 3.244 -17.160 1.00 21.44 O ATOM 2429 CB ARG B 61 -6.294 5.912 -18.598 1.00 13.32 C ATOM 2430 CG ARG B 61 -6.604 5.908 -20.086 1.00 25.31 C ATOM 2431 CD ARG B 61 -7.240 7.213 -20.522 1.00 43.44 C ATOM 2432 NE ARG B 61 -7.499 7.233 -21.965 1.00 64.11 N ATOM 2433 CZ ARG B 61 -8.315 8.078 -22.612 1.00 62.13 C ATOM 2434 NH1 ARG B 61 -9.021 8.996 -21.945 1.00 65.44 N ATOM 2435 NH2 ARG B 61 -8.428 7.987 -23.928 1.00 45.12 N ATOM 0 H ARG B 61 -4.299 4.665 -19.512 1.00 43.22 H new ATOM 0 HA ARG B 61 -5.537 4.733 -16.982 1.00 74.41 H new ATOM 0 HB2 ARG B 61 -7.196 6.195 -18.056 1.00 13.32 H new ATOM 0 HB3 ARG B 61 -5.548 6.682 -18.400 1.00 13.32 H new ATOM 0 HG2 ARG B 61 -5.686 5.743 -20.650 1.00 25.31 H new ATOM 0 HG3 ARG B 61 -7.274 5.080 -20.317 1.00 25.31 H new ATOM 0 HD2 ARG B 61 -8.175 7.361 -19.982 1.00 43.44 H new ATOM 0 HD3 ARG B 61 -6.585 8.043 -20.258 1.00 43.44 H new ATOM 0 HE ARG B 61 -7.012 6.538 -22.531 1.00 64.11 H new ATOM 0 HH11 ARG B 61 -8.943 9.061 -20.930 1.00 65.44 H new ATOM 0 HH12 ARG B 61 -9.638 9.632 -22.451 1.00 65.44 H new ATOM 0 HH21 ARG B 61 -7.898 7.280 -24.438 1.00 45.12 H new ATOM 0 HH22 ARG B 61 -9.045 8.624 -24.432 1.00 45.12 H new ATOM 2449 N ASN B 62 -6.980 2.853 -19.284 1.00 53.11 N ATOM 2450 CA ASN B 62 -8.009 1.822 -19.533 1.00 64.52 C ATOM 2451 C ASN B 62 -7.830 0.663 -18.577 1.00 63.51 C ATOM 2452 O ASN B 62 -8.775 0.245 -17.896 1.00 1.12 O ATOM 2453 CB ASN B 62 -7.914 1.309 -20.985 1.00 13.23 C ATOM 2454 CG ASN B 62 -8.863 0.147 -21.295 1.00 44.42 C ATOM 2455 OD1 ASN B 62 -9.972 0.045 -20.749 1.00 33.20 O ATOM 2456 ND2 ASN B 62 -8.427 -0.738 -22.160 1.00 44.32 N ATOM 0 H ASN B 62 -6.365 3.022 -20.080 1.00 53.11 H new ATOM 0 HA ASN B 62 -8.990 2.271 -19.375 1.00 64.52 H new ATOM 0 HB2 ASN B 62 -8.129 2.133 -21.666 1.00 13.23 H new ATOM 0 HB3 ASN B 62 -6.890 0.992 -21.182 1.00 13.23 H new ATOM 0 HD21 ASN B 62 -9.006 -1.542 -22.403 1.00 44.32 H new ATOM 0 HD22 ASN B 62 -7.509 -0.622 -22.590 1.00 44.32 H new ATOM 2463 N LEU B 63 -6.607 0.178 -18.511 1.00 60.43 N ATOM 2464 CA LEU B 63 -6.239 -0.927 -17.650 1.00 3.12 C ATOM 2465 C LEU B 63 -6.538 -0.566 -16.204 1.00 23.34 C ATOM 2466 O LEU B 63 -7.143 -1.339 -15.465 1.00 20.54 O ATOM 2467 CB LEU B 63 -4.752 -1.218 -17.822 1.00 22.22 C ATOM 2468 CG LEU B 63 -4.298 -1.558 -19.245 1.00 62.20 C ATOM 2469 CD1 LEU B 63 -2.795 -1.768 -19.292 1.00 21.04 C ATOM 2470 CD2 LEU B 63 -5.034 -2.784 -19.773 1.00 43.04 C ATOM 0 H LEU B 63 -5.831 0.545 -19.061 1.00 60.43 H new ATOM 0 HA LEU B 63 -6.813 -1.814 -17.917 1.00 3.12 H new ATOM 0 HB2 LEU B 63 -4.189 -0.350 -17.479 1.00 22.22 H new ATOM 0 HB3 LEU B 63 -4.486 -2.048 -17.168 1.00 22.22 H new ATOM 0 HG LEU B 63 -4.545 -0.715 -19.890 1.00 62.20 H new ATOM 0 HD11 LEU B 63 -2.493 -2.008 -20.311 1.00 21.04 H new ATOM 0 HD12 LEU B 63 -2.290 -0.858 -18.969 1.00 21.04 H new ATOM 0 HD13 LEU B 63 -2.521 -2.589 -18.629 1.00 21.04 H new ATOM 0 HD21 LEU B 63 -4.694 -3.005 -20.785 1.00 43.04 H new ATOM 0 HD22 LEU B 63 -4.829 -3.638 -19.127 1.00 43.04 H new ATOM 0 HD23 LEU B 63 -6.106 -2.587 -19.785 1.00 43.04 H new ATOM 2482 N ILE B 64 -6.146 0.626 -15.836 1.00 3.14 N ATOM 2483 CA ILE B 64 -6.373 1.157 -14.517 1.00 42.44 C ATOM 2484 C ILE B 64 -7.866 1.347 -14.168 1.00 60.33 C ATOM 2485 O ILE B 64 -8.270 1.137 -13.030 1.00 41.02 O ATOM 2486 CB ILE B 64 -5.513 2.425 -14.288 1.00 21.11 C ATOM 2487 CG1 ILE B 64 -4.259 2.056 -13.468 1.00 74.14 C ATOM 2488 CG2 ILE B 64 -6.292 3.610 -13.735 1.00 52.22 C ATOM 2489 CD1 ILE B 64 -3.335 3.202 -13.159 1.00 42.32 C ATOM 0 H ILE B 64 -5.651 1.267 -16.456 1.00 3.14 H new ATOM 0 HA ILE B 64 -6.039 0.404 -13.803 1.00 42.44 H new ATOM 0 HB ILE B 64 -5.182 2.789 -15.261 1.00 21.11 H new ATOM 0 HG12 ILE B 64 -4.579 1.605 -12.529 1.00 74.14 H new ATOM 0 HG13 ILE B 64 -3.699 1.296 -14.013 1.00 74.14 H new ATOM 0 HG21 ILE B 64 -5.620 4.458 -13.603 1.00 52.22 H new ATOM 0 HG22 ILE B 64 -7.085 3.881 -14.432 1.00 52.22 H new ATOM 0 HG23 ILE B 64 -6.730 3.341 -12.774 1.00 52.22 H new ATOM 0 HD11 ILE B 64 -2.486 2.839 -12.580 1.00 42.32 H new ATOM 0 HD12 ILE B 64 -2.978 3.643 -14.090 1.00 42.32 H new ATOM 0 HD13 ILE B 64 -3.871 3.956 -12.583 1.00 42.32 H new ATOM 2501 N ARG B 65 -8.679 1.697 -15.147 1.00 50.33 N ATOM 2502 CA ARG B 65 -10.120 1.846 -14.923 1.00 44.45 C ATOM 2503 C ARG B 65 -10.744 0.491 -14.621 1.00 62.04 C ATOM 2504 O ARG B 65 -11.738 0.394 -13.913 1.00 13.15 O ATOM 2505 CB ARG B 65 -10.818 2.461 -16.145 1.00 5.43 C ATOM 2506 CG ARG B 65 -10.376 3.872 -16.497 1.00 34.12 C ATOM 2507 CD ARG B 65 -10.696 4.875 -15.403 1.00 33.42 C ATOM 2508 NE ARG B 65 -12.136 4.952 -15.112 1.00 53.42 N ATOM 2509 CZ ARG B 65 -12.867 6.076 -15.129 1.00 5.44 C ATOM 2510 NH1 ARG B 65 -12.353 7.208 -15.613 1.00 24.24 N ATOM 2511 NH2 ARG B 65 -14.124 6.057 -14.701 1.00 11.52 N ATOM 0 H ARG B 65 -8.377 1.884 -16.103 1.00 50.33 H new ATOM 0 HA ARG B 65 -10.254 2.516 -14.074 1.00 44.45 H new ATOM 0 HB2 ARG B 65 -10.643 1.817 -17.007 1.00 5.43 H new ATOM 0 HB3 ARG B 65 -11.893 2.468 -15.965 1.00 5.43 H new ATOM 0 HG2 ARG B 65 -9.302 3.876 -16.685 1.00 34.12 H new ATOM 0 HG3 ARG B 65 -10.863 4.181 -17.422 1.00 34.12 H new ATOM 0 HD2 ARG B 65 -10.159 4.601 -14.495 1.00 33.42 H new ATOM 0 HD3 ARG B 65 -10.336 5.860 -15.701 1.00 33.42 H new ATOM 0 HE ARG B 65 -12.616 4.083 -14.879 1.00 53.42 H new ATOM 0 HH11 ARG B 65 -11.399 7.222 -15.973 1.00 24.24 H new ATOM 0 HH12 ARG B 65 -12.914 8.060 -15.623 1.00 24.24 H new ATOM 0 HH21 ARG B 65 -14.533 5.187 -14.359 1.00 11.52 H new ATOM 0 HH22 ARG B 65 -14.680 6.912 -14.714 1.00 11.52 H new ATOM 2525 N ARG B 66 -10.133 -0.550 -15.140 1.00 31.32 N ATOM 2526 CA ARG B 66 -10.641 -1.902 -14.992 1.00 61.12 C ATOM 2527 C ARG B 66 -10.057 -2.594 -13.756 1.00 64.01 C ATOM 2528 O ARG B 66 -10.276 -3.784 -13.529 1.00 10.04 O ATOM 2529 CB ARG B 66 -10.346 -2.704 -16.260 1.00 44.34 C ATOM 2530 CG ARG B 66 -10.991 -2.103 -17.504 1.00 60.51 C ATOM 2531 CD ARG B 66 -10.680 -2.902 -18.752 1.00 12.45 C ATOM 2532 NE ARG B 66 -11.147 -4.290 -18.662 1.00 43.00 N ATOM 2533 CZ ARG B 66 -11.560 -5.021 -19.697 1.00 61.43 C ATOM 2534 NH1 ARG B 66 -11.679 -4.477 -20.903 1.00 23.43 N ATOM 2535 NH2 ARG B 66 -11.869 -6.287 -19.522 1.00 32.11 N ATOM 0 H ARG B 66 -9.269 -0.487 -15.678 1.00 31.32 H new ATOM 0 HA ARG B 66 -11.720 -1.850 -14.847 1.00 61.12 H new ATOM 0 HB2 ARG B 66 -9.267 -2.759 -16.406 1.00 44.34 H new ATOM 0 HB3 ARG B 66 -10.703 -3.726 -16.129 1.00 44.34 H new ATOM 0 HG2 ARG B 66 -12.071 -2.056 -17.365 1.00 60.51 H new ATOM 0 HG3 ARG B 66 -10.641 -1.079 -17.634 1.00 60.51 H new ATOM 0 HD2 ARG B 66 -11.145 -2.421 -19.613 1.00 12.45 H new ATOM 0 HD3 ARG B 66 -9.604 -2.895 -18.925 1.00 12.45 H new ATOM 0 HE ARG B 66 -11.156 -4.727 -17.740 1.00 43.00 H new ATOM 0 HH11 ARG B 66 -11.454 -3.492 -21.043 1.00 23.43 H new ATOM 0 HH12 ARG B 66 -11.996 -5.044 -21.689 1.00 23.43 H new ATOM 0 HH21 ARG B 66 -11.792 -6.707 -18.596 1.00 32.11 H new ATOM 0 HH22 ARG B 66 -12.185 -6.849 -20.312 1.00 32.11 H new ATOM 2549 N HIS B 67 -9.314 -1.852 -12.964 1.00 5.42 N ATOM 2550 CA HIS B 67 -8.730 -2.386 -11.747 1.00 4.14 C ATOM 2551 C HIS B 67 -8.930 -1.437 -10.584 1.00 1.34 C ATOM 2552 O HIS B 67 -8.470 -0.298 -10.605 1.00 61.30 O ATOM 2553 CB HIS B 67 -7.241 -2.759 -11.921 1.00 44.12 C ATOM 2554 CG HIS B 67 -7.005 -3.948 -12.819 1.00 32.54 C ATOM 2555 ND1 HIS B 67 -6.779 -4.029 -14.149 1.00 55.03 N flip ATOM 2556 CD2 HIS B 67 -6.997 -5.243 -12.357 1.00 63.54 C flip ATOM 2557 CE1 HIS B 67 -6.643 -5.359 -14.460 1.00 12.24 C flip ATOM 2558 NE2 HIS B 67 -6.778 -6.070 -13.359 1.00 33.01 N flip ATOM 0 H HIS B 67 -9.098 -0.871 -13.140 1.00 5.42 H new ATOM 0 HA HIS B 67 -9.258 -3.312 -11.522 1.00 4.14 H new ATOM 0 HB2 HIS B 67 -6.707 -1.899 -12.326 1.00 44.12 H new ATOM 0 HB3 HIS B 67 -6.813 -2.967 -10.941 1.00 44.12 H new ATOM 0 HD1 HIS B 67 -6.720 -3.247 -14.801 1.00 55.03 H new ATOM 0 HD2 HIS B 67 -7.147 -5.538 -11.329 1.00 63.54 H new ATOM 0 HE1 HIS B 67 -6.456 -5.758 -15.446 1.00 12.24 H new ATOM 2567 N GLU B 68 -9.626 -1.908 -9.578 1.00 64.12 N ATOM 2568 CA GLU B 68 -9.936 -1.116 -8.408 1.00 64.41 C ATOM 2569 C GLU B 68 -8.698 -0.867 -7.546 1.00 74.32 C ATOM 2570 O GLU B 68 -7.887 -1.777 -7.320 1.00 23.34 O ATOM 2571 CB GLU B 68 -11.121 -1.700 -7.590 1.00 63.41 C ATOM 2572 CG GLU B 68 -11.025 -3.183 -7.207 1.00 55.33 C ATOM 2573 CD GLU B 68 -11.205 -4.139 -8.385 1.00 30.42 C ATOM 2574 OE1 GLU B 68 -10.194 -4.544 -9.013 1.00 20.43 O ATOM 2575 OE2 GLU B 68 -12.354 -4.495 -8.694 1.00 72.32 O ATOM 0 H GLU B 68 -9.997 -2.858 -9.546 1.00 64.12 H new ATOM 0 HA GLU B 68 -10.270 -0.143 -8.768 1.00 64.41 H new ATOM 0 HB2 GLU B 68 -11.223 -1.117 -6.674 1.00 63.41 H new ATOM 0 HB3 GLU B 68 -12.036 -1.555 -8.164 1.00 63.41 H new ATOM 0 HG2 GLU B 68 -10.054 -3.367 -6.747 1.00 55.33 H new ATOM 0 HG3 GLU B 68 -11.781 -3.403 -6.454 1.00 55.33 H new ATOM 2582 N ARG B 69 -8.571 0.375 -7.055 1.00 20.20 N ATOM 2583 CA ARG B 69 -7.395 0.827 -6.307 1.00 50.41 C ATOM 2584 C ARG B 69 -7.169 -0.026 -5.071 1.00 75.21 C ATOM 2585 O ARG B 69 -6.036 -0.370 -4.738 1.00 44.10 O ATOM 2586 CB ARG B 69 -7.490 2.319 -5.844 1.00 64.42 C ATOM 2587 CG ARG B 69 -7.563 3.450 -6.903 1.00 64.33 C ATOM 2588 CD ARG B 69 -8.922 3.601 -7.613 1.00 60.53 C ATOM 2589 NE ARG B 69 -9.192 2.594 -8.651 1.00 44.40 N ATOM 2590 CZ ARG B 69 -10.395 2.372 -9.207 1.00 64.40 C ATOM 2591 NH1 ARG B 69 -11.480 2.938 -8.699 1.00 50.14 N ATOM 2592 NH2 ARG B 69 -10.501 1.566 -10.259 1.00 13.12 N ATOM 0 H ARG B 69 -9.285 1.094 -7.168 1.00 20.20 H new ATOM 0 HA ARG B 69 -6.563 0.730 -7.005 1.00 50.41 H new ATOM 0 HB2 ARG B 69 -8.373 2.408 -5.212 1.00 64.42 H new ATOM 0 HB3 ARG B 69 -6.624 2.520 -5.213 1.00 64.42 H new ATOM 0 HG2 ARG B 69 -7.318 4.395 -6.418 1.00 64.33 H new ATOM 0 HG3 ARG B 69 -6.796 3.270 -7.656 1.00 64.33 H new ATOM 0 HD2 ARG B 69 -9.714 3.553 -6.865 1.00 60.53 H new ATOM 0 HD3 ARG B 69 -8.971 4.591 -8.066 1.00 60.53 H new ATOM 0 HE ARG B 69 -8.410 2.023 -8.972 1.00 44.40 H new ATOM 0 HH11 ARG B 69 -11.404 3.545 -7.883 1.00 50.14 H new ATOM 0 HH12 ARG B 69 -12.391 2.767 -9.124 1.00 50.14 H new ATOM 0 HH21 ARG B 69 -9.670 1.117 -10.643 1.00 13.12 H new ATOM 0 HH22 ARG B 69 -11.414 1.397 -10.682 1.00 13.12 H new ATOM 2606 N ASP B 70 -8.259 -0.372 -4.411 1.00 10.22 N ATOM 2607 CA ASP B 70 -8.220 -1.126 -3.159 1.00 21.41 C ATOM 2608 C ASP B 70 -7.597 -2.497 -3.373 1.00 42.32 C ATOM 2609 O ASP B 70 -6.677 -2.885 -2.659 1.00 22.22 O ATOM 2610 CB ASP B 70 -9.633 -1.273 -2.578 1.00 61.14 C ATOM 2611 CG ASP B 70 -10.324 0.061 -2.374 1.00 51.13 C ATOM 2612 OD1 ASP B 70 -11.051 0.500 -3.290 1.00 72.41 O ATOM 2613 OD2 ASP B 70 -10.148 0.692 -1.308 1.00 43.15 O ATOM 0 H ASP B 70 -9.202 -0.140 -4.724 1.00 10.22 H new ATOM 0 HA ASP B 70 -7.603 -0.574 -2.450 1.00 21.41 H new ATOM 0 HB2 ASP B 70 -10.234 -1.890 -3.246 1.00 61.14 H new ATOM 0 HB3 ASP B 70 -9.576 -1.798 -1.624 1.00 61.14 H new ATOM 2618 N GLU B 71 -8.076 -3.202 -4.392 1.00 73.34 N ATOM 2619 CA GLU B 71 -7.585 -4.537 -4.739 1.00 52.50 C ATOM 2620 C GLU B 71 -6.091 -4.472 -5.071 1.00 65.35 C ATOM 2621 O GLU B 71 -5.301 -5.342 -4.666 1.00 4.11 O ATOM 2622 CB GLU B 71 -8.344 -5.041 -5.962 1.00 22.20 C ATOM 2623 CG GLU B 71 -8.014 -6.456 -6.388 1.00 75.31 C ATOM 2624 CD GLU B 71 -8.520 -7.492 -5.423 1.00 30.12 C ATOM 2625 OE1 GLU B 71 -7.770 -7.899 -4.504 1.00 4.24 O ATOM 2626 OE2 GLU B 71 -9.676 -7.932 -5.582 1.00 73.32 O ATOM 0 H GLU B 71 -8.819 -2.865 -5.005 1.00 73.34 H new ATOM 0 HA GLU B 71 -7.739 -5.210 -3.896 1.00 52.50 H new ATOM 0 HB2 GLU B 71 -9.413 -4.980 -5.757 1.00 22.20 H new ATOM 0 HB3 GLU B 71 -8.141 -4.371 -6.797 1.00 22.20 H new ATOM 0 HG2 GLU B 71 -8.444 -6.643 -7.372 1.00 75.31 H new ATOM 0 HG3 GLU B 71 -6.933 -6.557 -6.488 1.00 75.31 H new ATOM 2633 N ILE B 72 -5.714 -3.433 -5.804 1.00 62.21 N ATOM 2634 CA ILE B 72 -4.336 -3.227 -6.204 1.00 71.04 C ATOM 2635 C ILE B 72 -3.448 -2.985 -4.982 1.00 54.22 C ATOM 2636 O ILE B 72 -2.390 -3.591 -4.853 1.00 51.43 O ATOM 2637 CB ILE B 72 -4.199 -2.036 -7.199 1.00 74.32 C ATOM 2638 CG1 ILE B 72 -5.001 -2.298 -8.487 1.00 35.12 C ATOM 2639 CG2 ILE B 72 -2.727 -1.754 -7.527 1.00 61.24 C ATOM 2640 CD1 ILE B 72 -4.935 -1.164 -9.499 1.00 33.41 C ATOM 0 H ILE B 72 -6.356 -2.713 -6.135 1.00 62.21 H new ATOM 0 HA ILE B 72 -4.008 -4.134 -6.711 1.00 71.04 H new ATOM 0 HB ILE B 72 -4.612 -1.152 -6.714 1.00 74.32 H new ATOM 0 HG12 ILE B 72 -4.630 -3.210 -8.954 1.00 35.12 H new ATOM 0 HG13 ILE B 72 -6.044 -2.476 -8.224 1.00 35.12 H new ATOM 0 HG21 ILE B 72 -2.663 -0.918 -8.223 1.00 61.24 H new ATOM 0 HG22 ILE B 72 -2.191 -1.505 -6.611 1.00 61.24 H new ATOM 0 HG23 ILE B 72 -2.279 -2.639 -7.980 1.00 61.24 H new ATOM 0 HD11 ILE B 72 -5.525 -1.425 -10.377 1.00 33.41 H new ATOM 0 HD12 ILE B 72 -5.334 -0.254 -9.052 1.00 33.41 H new ATOM 0 HD13 ILE B 72 -3.899 -0.999 -9.794 1.00 33.41 H new ATOM 2652 N MET B 73 -3.899 -2.128 -4.072 1.00 31.43 N ATOM 2653 CA MET B 73 -3.110 -1.782 -2.893 1.00 73.25 C ATOM 2654 C MET B 73 -2.977 -3.024 -1.977 1.00 22.52 C ATOM 2655 O MET B 73 -1.905 -3.280 -1.406 1.00 4.21 O ATOM 2656 CB MET B 73 -3.743 -0.578 -2.172 1.00 54.32 C ATOM 2657 CG MET B 73 -2.797 0.224 -1.263 1.00 55.05 C ATOM 2658 SD MET B 73 -2.126 -0.689 0.125 1.00 5.21 S ATOM 2659 CE MET B 73 -1.103 0.563 0.884 1.00 23.15 C ATOM 0 H MET B 73 -4.804 -1.661 -4.127 1.00 31.43 H new ATOM 0 HA MET B 73 -2.104 -1.484 -3.186 1.00 73.25 H new ATOM 0 HB2 MET B 73 -4.155 0.096 -2.922 1.00 54.32 H new ATOM 0 HB3 MET B 73 -4.579 -0.936 -1.571 1.00 54.32 H new ATOM 0 HG2 MET B 73 -1.970 0.599 -1.866 1.00 55.05 H new ATOM 0 HG3 MET B 73 -3.334 1.093 -0.882 1.00 55.05 H new ATOM 0 HE1 MET B 73 -0.962 0.327 1.939 1.00 23.15 H new ATOM 0 HE2 MET B 73 -0.134 0.592 0.386 1.00 23.15 H new ATOM 0 HE3 MET B 73 -1.588 1.535 0.791 1.00 23.15 H new ATOM 2669 N GLU B 74 -4.054 -3.824 -1.897 1.00 20.32 N ATOM 2670 CA GLU B 74 -4.021 -5.116 -1.184 1.00 20.25 C ATOM 2671 C GLU B 74 -2.932 -5.998 -1.760 1.00 44.30 C ATOM 2672 O GLU B 74 -2.250 -6.726 -1.039 1.00 62.31 O ATOM 2673 CB GLU B 74 -5.347 -5.861 -1.363 1.00 1.54 C ATOM 2674 CG GLU B 74 -6.502 -5.410 -0.495 1.00 44.11 C ATOM 2675 CD GLU B 74 -6.394 -5.950 0.910 1.00 31.11 C ATOM 2676 OE1 GLU B 74 -6.628 -7.171 1.094 1.00 32.11 O ATOM 2677 OE2 GLU B 74 -6.126 -5.198 1.831 1.00 22.34 O ATOM 0 H GLU B 74 -4.957 -3.601 -2.316 1.00 20.32 H new ATOM 0 HA GLU B 74 -3.839 -4.908 -0.130 1.00 20.25 H new ATOM 0 HB2 GLU B 74 -5.650 -5.771 -2.406 1.00 1.54 H new ATOM 0 HB3 GLU B 74 -5.171 -6.920 -1.172 1.00 1.54 H new ATOM 0 HG2 GLU B 74 -6.529 -4.321 -0.464 1.00 44.11 H new ATOM 0 HG3 GLU B 74 -7.441 -5.740 -0.940 1.00 44.11 H new ATOM 2684 N GLU B 75 -2.788 -5.954 -3.061 1.00 63.21 N ATOM 2685 CA GLU B 75 -1.809 -6.759 -3.733 1.00 34.33 C ATOM 2686 C GLU B 75 -0.413 -6.218 -3.435 1.00 11.32 C ATOM 2687 O GLU B 75 0.494 -6.976 -3.115 1.00 32.44 O ATOM 2688 CB GLU B 75 -2.062 -6.763 -5.234 1.00 20.50 C ATOM 2689 CG GLU B 75 -1.315 -7.850 -5.972 1.00 33.15 C ATOM 2690 CD GLU B 75 -1.775 -9.221 -5.535 1.00 22.43 C ATOM 2691 OE1 GLU B 75 -1.209 -9.780 -4.590 1.00 3.03 O ATOM 2692 OE2 GLU B 75 -2.737 -9.752 -6.126 1.00 64.42 O ATOM 0 H GLU B 75 -3.344 -5.362 -3.678 1.00 63.21 H new ATOM 0 HA GLU B 75 -1.883 -7.784 -3.371 1.00 34.33 H new ATOM 0 HB2 GLU B 75 -3.131 -6.882 -5.413 1.00 20.50 H new ATOM 0 HB3 GLU B 75 -1.776 -5.795 -5.645 1.00 20.50 H new ATOM 0 HG2 GLU B 75 -1.469 -7.737 -7.045 1.00 33.15 H new ATOM 0 HG3 GLU B 75 -0.245 -7.747 -5.791 1.00 33.15 H new ATOM 2699 N LEU B 76 -0.276 -4.887 -3.515 1.00 5.41 N ATOM 2700 CA LEU B 76 0.999 -4.203 -3.276 1.00 51.35 C ATOM 2701 C LEU B 76 1.549 -4.550 -1.909 1.00 14.44 C ATOM 2702 O LEU B 76 2.707 -4.954 -1.782 1.00 1.32 O ATOM 2703 CB LEU B 76 0.833 -2.672 -3.350 1.00 24.02 C ATOM 2704 CG LEU B 76 0.292 -2.075 -4.651 1.00 44.42 C ATOM 2705 CD1 LEU B 76 0.200 -0.566 -4.538 1.00 72.44 C ATOM 2706 CD2 LEU B 76 1.160 -2.452 -5.826 1.00 25.20 C ATOM 0 H LEU B 76 -1.044 -4.257 -3.747 1.00 5.41 H new ATOM 0 HA LEU B 76 1.688 -4.537 -4.052 1.00 51.35 H new ATOM 0 HB2 LEU B 76 0.170 -2.368 -2.541 1.00 24.02 H new ATOM 0 HB3 LEU B 76 1.805 -2.220 -3.153 1.00 24.02 H new ATOM 0 HG LEU B 76 -0.705 -2.483 -4.819 1.00 44.42 H new ATOM 0 HD11 LEU B 76 -0.186 -0.154 -5.470 1.00 72.44 H new ATOM 0 HD12 LEU B 76 -0.470 -0.303 -3.720 1.00 72.44 H new ATOM 0 HD13 LEU B 76 1.190 -0.155 -4.342 1.00 72.44 H new ATOM 0 HD21 LEU B 76 0.751 -2.014 -6.736 1.00 25.20 H new ATOM 0 HD22 LEU B 76 2.171 -2.078 -5.666 1.00 25.20 H new ATOM 0 HD23 LEU B 76 1.186 -3.537 -5.926 1.00 25.20 H new ATOM 2718 N THR B 77 0.705 -4.421 -0.894 1.00 1.01 N ATOM 2719 CA THR B 77 1.107 -4.678 0.463 1.00 62.31 C ATOM 2720 C THR B 77 1.481 -6.160 0.675 1.00 13.12 C ATOM 2721 O THR B 77 2.486 -6.462 1.330 1.00 51.20 O ATOM 2722 CB THR B 77 0.006 -4.235 1.448 1.00 72.04 C ATOM 2723 OG1 THR B 77 -0.289 -2.854 1.207 1.00 52.32 O ATOM 2724 CG2 THR B 77 0.471 -4.387 2.891 1.00 51.01 C ATOM 0 H THR B 77 -0.269 -4.137 -0.997 1.00 1.01 H new ATOM 0 HA THR B 77 2.002 -4.089 0.662 1.00 62.31 H new ATOM 0 HB THR B 77 -0.874 -4.860 1.296 1.00 72.04 H new ATOM 0 HG1 THR B 77 -1.070 -2.784 0.620 1.00 52.32 H new ATOM 0 HG21 THR B 77 -0.324 -4.068 3.565 1.00 51.01 H new ATOM 0 HG22 THR B 77 0.715 -5.431 3.087 1.00 51.01 H new ATOM 0 HG23 THR B 77 1.355 -3.771 3.055 1.00 51.01 H new ATOM 2732 N LYS B 78 0.700 -7.082 0.093 1.00 25.32 N ATOM 2733 CA LYS B 78 1.011 -8.501 0.243 1.00 31.11 C ATOM 2734 C LYS B 78 2.306 -8.851 -0.435 1.00 0.33 C ATOM 2735 O LYS B 78 3.144 -9.502 0.143 1.00 33.15 O ATOM 2736 CB LYS B 78 -0.095 -9.436 -0.263 1.00 50.32 C ATOM 2737 CG LYS B 78 -1.407 -9.326 0.482 1.00 70.14 C ATOM 2738 CD LYS B 78 -2.387 -10.444 0.092 1.00 71.55 C ATOM 2739 CE LYS B 78 -2.744 -10.433 -1.390 1.00 44.13 C ATOM 2740 NZ LYS B 78 -3.468 -9.207 -1.780 1.00 61.23 N ATOM 0 H LYS B 78 -0.126 -6.875 -0.468 1.00 25.32 H new ATOM 0 HA LYS B 78 1.099 -8.658 1.318 1.00 31.11 H new ATOM 0 HB2 LYS B 78 -0.273 -9.228 -1.318 1.00 50.32 H new ATOM 0 HB3 LYS B 78 0.259 -10.465 -0.197 1.00 50.32 H new ATOM 0 HG2 LYS B 78 -1.219 -9.367 1.555 1.00 70.14 H new ATOM 0 HG3 LYS B 78 -1.861 -8.357 0.275 1.00 70.14 H new ATOM 0 HD2 LYS B 78 -1.949 -11.409 0.347 1.00 71.55 H new ATOM 0 HD3 LYS B 78 -3.299 -10.342 0.680 1.00 71.55 H new ATOM 0 HE2 LYS B 78 -1.833 -10.519 -1.982 1.00 44.13 H new ATOM 0 HE3 LYS B 78 -3.357 -11.304 -1.621 1.00 44.13 H new ATOM 0 HZ1 LYS B 78 -3.616 -9.204 -2.809 1.00 61.23 H new ATOM 0 HZ2 LYS B 78 -4.389 -9.180 -1.298 1.00 61.23 H new ATOM 0 HZ3 LYS B 78 -2.910 -8.373 -1.508 1.00 61.23 H new ATOM 2754 N TYR B 79 2.463 -8.391 -1.642 1.00 63.02 N ATOM 2755 CA TYR B 79 3.639 -8.690 -2.440 1.00 61.24 C ATOM 2756 C TYR B 79 4.899 -8.136 -1.752 1.00 32.25 C ATOM 2757 O TYR B 79 5.925 -8.820 -1.656 1.00 51.04 O ATOM 2758 CB TYR B 79 3.467 -8.072 -3.825 1.00 61.32 C ATOM 2759 CG TYR B 79 4.466 -8.514 -4.870 1.00 65.04 C ATOM 2760 CD1 TYR B 79 4.063 -9.327 -5.920 1.00 2.22 C ATOM 2761 CD2 TYR B 79 5.788 -8.101 -4.834 1.00 64.30 C ATOM 2762 CE1 TYR B 79 4.947 -9.723 -6.895 1.00 22.44 C ATOM 2763 CE2 TYR B 79 6.679 -8.488 -5.809 1.00 53.51 C ATOM 2764 CZ TYR B 79 6.252 -9.302 -6.839 1.00 2.05 C ATOM 2765 OH TYR B 79 7.132 -9.685 -7.822 1.00 71.41 O ATOM 0 H TYR B 79 1.782 -7.794 -2.112 1.00 63.02 H new ATOM 0 HA TYR B 79 3.754 -9.769 -2.539 1.00 61.24 H new ATOM 0 HB2 TYR B 79 2.465 -8.306 -4.185 1.00 61.32 H new ATOM 0 HB3 TYR B 79 3.526 -6.988 -3.729 1.00 61.32 H new ATOM 0 HD1 TYR B 79 3.035 -9.655 -5.972 1.00 2.22 H new ATOM 0 HD2 TYR B 79 6.125 -7.465 -4.028 1.00 64.30 H new ATOM 0 HE1 TYR B 79 4.617 -10.362 -7.701 1.00 22.44 H new ATOM 0 HE2 TYR B 79 7.706 -8.157 -5.769 1.00 53.51 H new ATOM 0 HH TYR B 79 7.486 -8.890 -8.272 1.00 71.41 H new ATOM 2775 N TYR B 80 4.795 -6.902 -1.269 1.00 43.51 N ATOM 2776 CA TYR B 80 5.885 -6.230 -0.578 1.00 23.24 C ATOM 2777 C TYR B 80 6.316 -7.045 0.644 1.00 20.05 C ATOM 2778 O TYR B 80 7.507 -7.298 0.856 1.00 62.25 O ATOM 2779 CB TYR B 80 5.413 -4.828 -0.146 1.00 2.25 C ATOM 2780 CG TYR B 80 6.454 -3.958 0.539 1.00 61.04 C ATOM 2781 CD1 TYR B 80 7.242 -3.084 -0.195 1.00 4.44 C ATOM 2782 CD2 TYR B 80 6.631 -3.996 1.918 1.00 51.53 C ATOM 2783 CE1 TYR B 80 8.177 -2.273 0.419 1.00 52.43 C ATOM 2784 CE2 TYR B 80 7.563 -3.193 2.539 1.00 14.14 C ATOM 2785 CZ TYR B 80 8.334 -2.332 1.784 1.00 25.04 C ATOM 2786 OH TYR B 80 9.262 -1.524 2.401 1.00 71.23 O ATOM 0 H TYR B 80 3.948 -6.339 -1.347 1.00 43.51 H new ATOM 0 HA TYR B 80 6.741 -6.136 -1.246 1.00 23.24 H new ATOM 0 HB2 TYR B 80 5.050 -4.300 -1.028 1.00 2.25 H new ATOM 0 HB3 TYR B 80 4.564 -4.943 0.528 1.00 2.25 H new ATOM 0 HD1 TYR B 80 7.122 -3.036 -1.267 1.00 4.44 H new ATOM 0 HD2 TYR B 80 6.028 -4.666 2.512 1.00 51.53 H new ATOM 0 HE1 TYR B 80 8.780 -1.597 -0.169 1.00 52.43 H new ATOM 0 HE2 TYR B 80 7.690 -3.237 3.611 1.00 14.14 H new ATOM 0 HH TYR B 80 8.961 -0.592 2.363 1.00 71.23 H new ATOM 2796 N LEU B 81 5.345 -7.448 1.433 1.00 35.40 N ATOM 2797 CA LEU B 81 5.603 -8.203 2.639 1.00 3.41 C ATOM 2798 C LEU B 81 6.009 -9.659 2.369 1.00 33.43 C ATOM 2799 O LEU B 81 6.811 -10.236 3.120 1.00 62.12 O ATOM 2800 CB LEU B 81 4.432 -8.110 3.611 1.00 42.44 C ATOM 2801 CG LEU B 81 4.141 -6.716 4.181 1.00 13.05 C ATOM 2802 CD1 LEU B 81 2.917 -6.756 5.075 1.00 24.33 C ATOM 2803 CD2 LEU B 81 5.342 -6.188 4.958 1.00 20.11 C ATOM 0 H LEU B 81 4.357 -7.262 1.258 1.00 35.40 H new ATOM 0 HA LEU B 81 6.469 -7.739 3.112 1.00 3.41 H new ATOM 0 HB2 LEU B 81 3.536 -8.468 3.105 1.00 42.44 H new ATOM 0 HB3 LEU B 81 4.621 -8.789 4.443 1.00 42.44 H new ATOM 0 HG LEU B 81 3.946 -6.041 3.347 1.00 13.05 H new ATOM 0 HD11 LEU B 81 2.724 -5.759 5.472 1.00 24.33 H new ATOM 0 HD12 LEU B 81 2.055 -7.090 4.497 1.00 24.33 H new ATOM 0 HD13 LEU B 81 3.091 -7.447 5.900 1.00 24.33 H new ATOM 0 HD21 LEU B 81 5.113 -5.198 5.353 1.00 20.11 H new ATOM 0 HD22 LEU B 81 5.568 -6.864 5.782 1.00 20.11 H new ATOM 0 HD23 LEU B 81 6.205 -6.123 4.295 1.00 20.11 H new ATOM 2815 N ALA B 82 5.494 -10.236 1.283 1.00 35.12 N ATOM 2816 CA ALA B 82 5.763 -11.639 0.938 1.00 42.51 C ATOM 2817 C ALA B 82 7.236 -11.863 0.682 1.00 53.41 C ATOM 2818 O ALA B 82 7.780 -12.936 0.970 1.00 34.03 O ATOM 2819 CB ALA B 82 4.947 -12.063 -0.276 1.00 42.34 C ATOM 0 H ALA B 82 4.885 -9.754 0.622 1.00 35.12 H new ATOM 0 HA ALA B 82 5.466 -12.253 1.788 1.00 42.51 H new ATOM 0 HB1 ALA B 82 5.162 -13.105 -0.513 1.00 42.34 H new ATOM 0 HB2 ALA B 82 3.885 -11.953 -0.057 1.00 42.34 H new ATOM 0 HB3 ALA B 82 5.209 -11.435 -1.128 1.00 42.34 H new ATOM 2825 N ASN B 83 7.894 -10.832 0.192 1.00 45.32 N ATOM 2826 CA ASN B 83 9.315 -10.885 -0.123 1.00 3.52 C ATOM 2827 C ASN B 83 10.195 -11.014 1.125 1.00 24.01 C ATOM 2828 O ASN B 83 11.397 -11.241 1.015 1.00 43.02 O ATOM 2829 CB ASN B 83 9.740 -9.694 -0.981 1.00 44.44 C ATOM 2830 CG ASN B 83 9.107 -9.701 -2.363 1.00 15.32 C ATOM 2831 OD1 ASN B 83 8.822 -10.757 -2.929 1.00 34.23 O ATOM 2832 ND2 ASN B 83 8.881 -8.537 -2.913 1.00 74.42 N ATOM 0 H ASN B 83 7.461 -9.929 -0.001 1.00 45.32 H new ATOM 0 HA ASN B 83 9.468 -11.793 -0.706 1.00 3.52 H new ATOM 0 HB2 ASN B 83 9.471 -8.770 -0.469 1.00 44.44 H new ATOM 0 HB3 ASN B 83 10.825 -9.697 -1.084 1.00 44.44 H new ATOM 0 HD21 ASN B 83 8.456 -8.484 -3.839 1.00 74.42 H new ATOM 0 HD22 ASN B 83 9.129 -7.681 -2.416 1.00 74.42 H new ATOM 2839 N HIS B 84 9.589 -10.886 2.313 1.00 44.24 N ATOM 2840 CA HIS B 84 10.314 -11.091 3.579 1.00 31.14 C ATOM 2841 C HIS B 84 10.222 -12.542 4.012 1.00 0.52 C ATOM 2842 O HIS B 84 10.626 -12.897 5.116 1.00 11.13 O ATOM 2843 CB HIS B 84 9.789 -10.197 4.723 1.00 35.14 C ATOM 2844 CG HIS B 84 10.030 -8.735 4.556 1.00 42.42 C ATOM 2845 ND1 HIS B 84 11.254 -8.155 4.760 1.00 52.43 N ATOM 2846 CD2 HIS B 84 9.200 -7.734 4.199 1.00 43.00 C ATOM 2847 CE1 HIS B 84 11.174 -6.870 4.537 1.00 13.30 C ATOM 2848 NE2 HIS B 84 9.935 -6.579 4.186 1.00 22.04 N ATOM 0 H HIS B 84 8.605 -10.643 2.426 1.00 44.24 H new ATOM 0 HA HIS B 84 11.350 -10.814 3.385 1.00 31.14 H new ATOM 0 HB2 HIS B 84 8.716 -10.361 4.826 1.00 35.14 H new ATOM 0 HB3 HIS B 84 10.252 -10.520 5.655 1.00 35.14 H new ATOM 0 HD1 HIS B 84 12.099 -8.651 5.043 1.00 52.43 H new ATOM 0 HD2 HIS B 84 8.149 -7.826 3.966 1.00 43.00 H new ATOM 0 HE1 HIS B 84 11.986 -6.164 4.625 1.00 13.30 H new ATOM 2857 N GLY B 85 9.684 -13.375 3.140 1.00 71.23 N ATOM 2858 CA GLY B 85 9.523 -14.780 3.456 1.00 33.30 C ATOM 2859 C GLY B 85 8.283 -15.006 4.279 1.00 63.10 C ATOM 2860 O GLY B 85 8.164 -15.994 5.000 1.00 25.13 O ATOM 0 H GLY B 85 9.353 -13.104 2.214 1.00 71.23 H new ATOM 0 HA2 GLY B 85 9.464 -15.360 2.535 1.00 33.30 H new ATOM 0 HA3 GLY B 85 10.397 -15.137 4.002 1.00 33.30 H new ATOM 2864 N ILE B 86 7.370 -14.074 4.191 1.00 22.14 N ATOM 2865 CA ILE B 86 6.140 -14.146 4.926 1.00 13.14 C ATOM 2866 C ILE B 86 5.022 -14.622 4.025 1.00 52.53 C ATOM 2867 O ILE B 86 4.836 -14.095 2.926 1.00 45.34 O ATOM 2868 CB ILE B 86 5.767 -12.780 5.547 1.00 33.35 C ATOM 2869 CG1 ILE B 86 6.875 -12.317 6.502 1.00 41.02 C ATOM 2870 CG2 ILE B 86 4.430 -12.871 6.278 1.00 4.23 C ATOM 2871 CD1 ILE B 86 6.600 -10.986 7.158 1.00 63.54 C ATOM 0 H ILE B 86 7.461 -13.243 3.606 1.00 22.14 H new ATOM 0 HA ILE B 86 6.282 -14.858 5.739 1.00 13.14 H new ATOM 0 HB ILE B 86 5.667 -12.047 4.747 1.00 33.35 H new ATOM 0 HG12 ILE B 86 7.012 -13.071 7.277 1.00 41.02 H new ATOM 0 HG13 ILE B 86 7.813 -12.252 5.951 1.00 41.02 H new ATOM 0 HG21 ILE B 86 4.184 -11.900 6.709 1.00 4.23 H new ATOM 0 HG22 ILE B 86 3.650 -13.164 5.575 1.00 4.23 H new ATOM 0 HG23 ILE B 86 4.500 -13.613 7.073 1.00 4.23 H new ATOM 0 HD11 ILE B 86 7.428 -10.728 7.818 1.00 63.54 H new ATOM 0 HD12 ILE B 86 6.493 -10.218 6.392 1.00 63.54 H new ATOM 0 HD13 ILE B 86 5.680 -11.050 7.739 1.00 63.54 H new ATOM 2883 N ASP B 87 4.308 -15.615 4.476 1.00 35.20 N ATOM 2884 CA ASP B 87 3.181 -16.148 3.729 1.00 4.44 C ATOM 2885 C ASP B 87 1.939 -15.436 4.192 1.00 44.33 C ATOM 2886 O ASP B 87 1.588 -15.500 5.369 1.00 1.41 O ATOM 2887 CB ASP B 87 3.032 -17.666 3.935 1.00 4.33 C ATOM 2888 CG ASP B 87 4.249 -18.445 3.488 1.00 41.10 C ATOM 2889 OD1 ASP B 87 4.382 -18.727 2.277 1.00 52.42 O ATOM 2890 OD2 ASP B 87 5.097 -18.790 4.343 1.00 61.20 O ATOM 0 H ASP B 87 4.482 -16.082 5.366 1.00 35.20 H new ATOM 0 HA ASP B 87 3.345 -15.985 2.664 1.00 4.44 H new ATOM 0 HB2 ASP B 87 2.846 -17.867 4.990 1.00 4.33 H new ATOM 0 HB3 ASP B 87 2.160 -18.018 3.384 1.00 4.33 H new ATOM 2895 N ILE B 88 1.283 -14.764 3.288 1.00 33.32 N ATOM 2896 CA ILE B 88 0.150 -13.937 3.633 1.00 20.13 C ATOM 2897 C ILE B 88 -1.155 -14.572 3.174 1.00 13.45 C ATOM 2898 O ILE B 88 -1.193 -15.306 2.186 1.00 61.13 O ATOM 2899 CB ILE B 88 0.297 -12.521 3.015 1.00 63.43 C ATOM 2900 CG1 ILE B 88 1.612 -11.895 3.463 1.00 3.44 C ATOM 2901 CG2 ILE B 88 -0.871 -11.617 3.423 1.00 70.51 C ATOM 2902 CD1 ILE B 88 1.858 -10.537 2.876 1.00 60.25 C ATOM 0 H ILE B 88 1.513 -14.771 2.294 1.00 33.32 H new ATOM 0 HA ILE B 88 0.125 -13.848 4.719 1.00 20.13 H new ATOM 0 HB ILE B 88 0.290 -12.621 1.930 1.00 63.43 H new ATOM 0 HG12 ILE B 88 1.617 -11.819 4.550 1.00 3.44 H new ATOM 0 HG13 ILE B 88 2.433 -12.556 3.186 1.00 3.44 H new ATOM 0 HG21 ILE B 88 -0.742 -10.631 2.976 1.00 70.51 H new ATOM 0 HG22 ILE B 88 -1.807 -12.053 3.075 1.00 70.51 H new ATOM 0 HG23 ILE B 88 -0.896 -11.522 4.509 1.00 70.51 H new ATOM 0 HD11 ILE B 88 2.811 -10.152 3.238 1.00 60.25 H new ATOM 0 HD12 ILE B 88 1.885 -10.610 1.789 1.00 60.25 H new ATOM 0 HD13 ILE B 88 1.057 -9.861 3.174 1.00 60.25 H new ATOM 2914 N LYS B 89 -2.194 -14.300 3.914 1.00 74.11 N ATOM 2915 CA LYS B 89 -3.520 -14.783 3.650 1.00 12.15 C ATOM 2916 C LYS B 89 -4.261 -13.771 2.782 1.00 62.14 C ATOM 2917 O LYS B 89 -4.210 -13.902 1.541 1.00 36.67 O ATOM 2918 CB LYS B 89 -4.236 -14.948 4.978 1.00 65.54 C ATOM 2919 CG LYS B 89 -3.563 -15.950 5.900 1.00 60.23 C ATOM 2920 CD LYS B 89 -4.098 -15.866 7.316 1.00 12.40 C ATOM 2921 CE LYS B 89 -3.739 -14.527 7.962 1.00 40.03 C ATOM 2922 NZ LYS B 89 -4.169 -14.457 9.367 1.00 72.23 N ATOM 2923 OXT LYS B 89 -4.880 -12.840 3.348 1.00 36.67 O ATOM 0 H LYS B 89 -2.138 -13.715 4.747 1.00 74.11 H new ATOM 0 HA LYS B 89 -3.484 -15.738 3.125 1.00 12.15 H new ATOM 0 HB2 LYS B 89 -4.287 -13.981 5.478 1.00 65.54 H new ATOM 0 HB3 LYS B 89 -5.262 -15.266 4.793 1.00 65.54 H new ATOM 0 HG2 LYS B 89 -3.716 -16.958 5.514 1.00 60.23 H new ATOM 0 HG3 LYS B 89 -2.488 -15.771 5.907 1.00 60.23 H new ATOM 0 HD2 LYS B 89 -5.181 -15.990 7.307 1.00 12.40 H new ATOM 0 HD3 LYS B 89 -3.689 -16.682 7.912 1.00 12.40 H new ATOM 0 HE2 LYS B 89 -2.661 -14.375 7.905 1.00 40.03 H new ATOM 0 HE3 LYS B 89 -4.205 -13.718 7.400 1.00 40.03 H new ATOM 0 HZ1 LYS B 89 -3.575 -13.773 9.878 1.00 72.23 H new ATOM 0 HZ2 LYS B 89 -5.163 -14.153 9.411 1.00 72.23 H new ATOM 0 HZ3 LYS B 89 -4.074 -15.395 9.806 1.00 72.23 H new TER 2937 LYS B 89