USER MOD reduce.3.24.130724 H: found=0, std=0, add=1310, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1313 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 101 SER OG : rot -175:sc= 0.677 USER MOD Set 1.2: A 135 GLN :FLIP amide:sc= 0.652 F(o=0.05!,f=1.3) USER MOD Set 2.1: A 8 GLN : amide:sc= -1.89 K(o=-1.8,f=-7.5!) USER MOD Set 2.2: A 76 MET CE :methyl 176:sc= -1.44 (180deg=-1.52) USER MOD Set 2.3: B 82 LYS NZ :NH3+ -166:sc= 1.57 (180deg=1.28) USER MOD Set 3.1: A 72 MET CE :methyl 140:sc= -0.672 (180deg=-1.22) USER MOD Set 3.2: B 90 GLN : amide:sc= 1.73 K(o=1.1,f=-3.7!) USER MOD Set 4.1: A 60 ASN : amide:sc= -0.0816 K(o=-0.086,f=-1.6) USER MOD Set 4.2: A 62 THR OG1 : rot 180:sc=-0.00418 USER MOD Single : A 1 ALA N :NH3+ 147:sc= 0.00725 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0.447 K(o=0.45,f=-5.1!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0471 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 83:sc= 1.01 USER MOD Single : A 21 LYS NZ :NH3+ -159:sc= -0.136 (180deg=-0.553) USER MOD Single : A 26 THR OG1 : rot -71:sc= 1.23 USER MOD Single : A 28 THR OG1 : rot -79:sc= 0.439 USER MOD Single : A 29 THR OG1 : rot 130:sc= 1.29 USER MOD Single : A 30 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0171) USER MOD Single : A 34 THR OG1 : rot 84:sc= 0.886 USER MOD Single : A 36 MET CE :methyl -127:sc= -1.16 (180deg=-6.27!) USER MOD Single : A 38 SER OG : rot 78:sc= 1.2 USER MOD Single : A 41 GLN : amide:sc= -0.0073 X(o=-0.0073,f=-0.02) USER MOD Single : A 42 ASN :FLIP amide:sc= 0 F(o=-2.7!,f=0) USER MOD Single : A 44 THR OG1 : rot -101:sc= -1.71! USER MOD Single : A 49 GLN : amide:sc= 0.125 X(o=0.12,f=-0.2) USER MOD Single : A 51 MET CE :methyl 162:sc= -0.168 (180deg=-0.607) USER MOD Single : A 53 ASN : amide:sc=-0.00236 X(o=-0.0024,f=-0.0024) USER MOD Single : A 70 THR OG1 : rot 65:sc= 0.494 USER MOD Single : A 71 MET CE :methyl -176:sc= -0.55 (180deg=-0.634) USER MOD Single : A 75 LYS NZ :NH3+ 148:sc= 1.83 (180deg=0.148) USER MOD Single : A 77 LYS NZ :NH3+ 127:sc= -0.0573 (180deg=-0.374) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -176:sc= 0.76 USER MOD Single : A 94 LYS NZ :NH3+ 129:sc= 0.0202 (180deg=-0.0825) USER MOD Single : A 97 ASN :FLIP amide:sc= -0.0683 F(o=-1.1,f=-0.068) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 MET CE :methyl 178:sc= -0.172 (180deg=-0.175) USER MOD Single : A 110 THR OG1 : rot 72:sc= 1.43 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -22:sc= 1.19 USER MOD Single : A 124 MET CE :methyl 170:sc= -0.246 (180deg=-0.286) USER MOD Single : A 137 ASN : amide:sc= 0.193 K(o=0.19,f=-3.1!) USER MOD Single : A 138 TYR OH : rot 110:sc= -1.46 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 MET CE :methyl -165:sc= 0 (180deg=-0.151) USER MOD Single : A 145 MET CE :methyl -151:sc= -0.304 (180deg=-1.13) USER MOD Single : A 146 THR OG1 : rot -17:sc= 0.461 USER MOD Single : A 148 LYS NZ :NH3+ 164:sc= -0.154 (180deg=-0.656) USER MOD Single : B 74 SER OG : rot 28:sc= 0.144 USER MOD Single : B 77 ASN : amide:sc= 1.1 K(o=1.1,f=-1.7) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 HIS : no HD1:sc= -0.0575 X(o=-0.058,f=-0.045) USER MOD Single : B 86 LYS NZ :NH3+ 161:sc= 1.27 (180deg=1.01) USER MOD Single : B 87 HIS : +bothHN:sc= 0.659 K(o=0.66,f=-4.6!) USER MOD Single : B 91 LYS NZ :NH3+ 176:sc= 2.02 (180deg=1.91) USER MOD Single : B 93 LYS NZ :NH3+ -166:sc= 1.1 (180deg=0.933) USER MOD Single : B 94 HIS : no HD1:sc= 0.211 K(o=0.24,f=-4.8!) USER MOD Single : B 95 MET CE :methyl -134:sc= -0.0411 (180deg=-1.46!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -9.653 3.515 -10.831 1.00 0.00 N ATOM 2 CA ALA A 1 -9.033 2.313 -11.370 1.00 0.00 C ATOM 3 C ALA A 1 -9.809 1.110 -10.899 1.00 0.00 C ATOM 4 O ALA A 1 -10.053 0.960 -9.703 1.00 0.00 O ATOM 5 CB ALA A 1 -7.589 2.226 -10.921 1.00 0.00 C ATOM 0 H1 ALA A 1 -8.921 4.230 -10.647 1.00 0.00 H new ATOM 0 H2 ALA A 1 -10.338 3.890 -11.518 1.00 0.00 H new ATOM 0 H3 ALA A 1 -10.143 3.285 -9.943 1.00 0.00 H new ATOM 0 HA ALA A 1 -9.047 2.346 -12.459 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -7.135 1.323 -11.330 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -7.044 3.100 -11.277 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -7.548 2.192 -9.832 1.00 0.00 H new ATOM 13 N ASP A 2 -10.237 0.274 -11.816 1.00 0.00 N ATOM 14 CA ASP A 2 -11.016 -0.910 -11.441 1.00 0.00 C ATOM 15 C ASP A 2 -10.721 -2.098 -12.333 1.00 0.00 C ATOM 16 O ASP A 2 -11.136 -3.228 -12.038 1.00 0.00 O ATOM 17 CB ASP A 2 -12.526 -0.631 -11.412 1.00 0.00 C ATOM 18 CG ASP A 2 -13.140 -0.363 -12.780 1.00 0.00 C ATOM 19 OD1 ASP A 2 -13.090 0.803 -13.262 1.00 0.00 O ATOM 20 OD2 ASP A 2 -13.710 -1.289 -13.378 1.00 0.00 O ATOM 0 H ASP A 2 -10.068 0.378 -12.817 1.00 0.00 H new ATOM 0 HA ASP A 2 -10.701 -1.161 -10.428 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -13.033 -1.484 -10.960 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -12.713 0.229 -10.768 1.00 0.00 H new ATOM 25 N GLN A 3 -10.004 -1.871 -13.390 1.00 0.00 N ATOM 26 CA GLN A 3 -9.654 -2.933 -14.289 1.00 0.00 C ATOM 27 C GLN A 3 -8.165 -3.189 -14.170 1.00 0.00 C ATOM 28 O GLN A 3 -7.409 -2.296 -13.765 1.00 0.00 O ATOM 29 CB GLN A 3 -10.068 -2.585 -15.722 1.00 0.00 C ATOM 30 CG GLN A 3 -9.842 -3.710 -16.739 1.00 0.00 C ATOM 31 CD GLN A 3 -10.536 -5.005 -16.349 1.00 0.00 C ATOM 32 OE1 GLN A 3 -9.965 -5.846 -15.647 1.00 0.00 O ATOM 33 NE2 GLN A 3 -11.737 -5.186 -16.804 1.00 0.00 N ATOM 0 H GLN A 3 -9.646 -0.953 -13.655 1.00 0.00 H new ATOM 0 HA GLN A 3 -10.189 -3.845 -14.026 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -11.124 -2.315 -15.726 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -9.512 -1.704 -16.044 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -10.204 -3.389 -17.716 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -8.772 -3.893 -16.840 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -12.177 -4.469 -17.381 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -12.241 -6.045 -16.585 1.00 0.00 H new ATOM 42 N LEU A 4 -7.749 -4.379 -14.469 1.00 0.00 N ATOM 43 CA LEU A 4 -6.385 -4.729 -14.317 1.00 0.00 C ATOM 44 C LEU A 4 -5.903 -5.431 -15.573 1.00 0.00 C ATOM 45 O LEU A 4 -6.710 -5.968 -16.343 1.00 0.00 O ATOM 46 CB LEU A 4 -6.239 -5.622 -13.090 1.00 0.00 C ATOM 47 CG LEU A 4 -4.827 -5.902 -12.580 1.00 0.00 C ATOM 48 CD1 LEU A 4 -4.062 -4.610 -12.320 1.00 0.00 C ATOM 49 CD2 LEU A 4 -4.906 -6.723 -11.314 1.00 0.00 C ATOM 0 H LEU A 4 -8.346 -5.126 -14.823 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.774 -3.838 -14.172 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.806 -5.169 -12.276 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.711 -6.579 -13.313 1.00 0.00 H new ATOM 0 HG LEU A 4 -4.287 -6.457 -13.347 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -3.061 -4.846 -11.958 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -3.988 -4.039 -13.245 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.589 -4.020 -11.570 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.899 -6.924 -10.948 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.464 -6.172 -10.557 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.412 -7.666 -11.523 1.00 0.00 H new ATOM 61 N THR A 5 -4.617 -5.422 -15.779 1.00 0.00 N ATOM 62 CA THR A 5 -4.010 -6.036 -16.918 1.00 0.00 C ATOM 63 C THR A 5 -3.943 -7.554 -16.739 1.00 0.00 C ATOM 64 O THR A 5 -3.850 -8.053 -15.599 1.00 0.00 O ATOM 65 CB THR A 5 -2.612 -5.448 -17.111 1.00 0.00 C ATOM 66 OG1 THR A 5 -1.933 -5.449 -15.844 1.00 0.00 O ATOM 67 CG2 THR A 5 -2.710 -4.027 -17.632 1.00 0.00 C ATOM 0 H THR A 5 -3.951 -4.978 -15.146 1.00 0.00 H new ATOM 0 HA THR A 5 -4.611 -5.836 -17.805 1.00 0.00 H new ATOM 0 HB THR A 5 -2.060 -6.049 -17.834 1.00 0.00 H new ATOM 0 HG1 THR A 5 -1.034 -5.076 -15.955 1.00 0.00 H new ATOM 0 HG21 THR A 5 -1.708 -3.619 -17.766 1.00 0.00 H new ATOM 0 HG22 THR A 5 -3.233 -4.025 -18.588 1.00 0.00 H new ATOM 0 HG23 THR A 5 -3.259 -3.414 -16.917 1.00 0.00 H new ATOM 75 N GLU A 6 -3.980 -8.277 -17.850 1.00 0.00 N ATOM 76 CA GLU A 6 -3.995 -9.735 -17.841 1.00 0.00 C ATOM 77 C GLU A 6 -2.770 -10.322 -17.144 1.00 0.00 C ATOM 78 O GLU A 6 -2.888 -11.334 -16.452 1.00 0.00 O ATOM 79 CB GLU A 6 -4.131 -10.293 -19.259 1.00 0.00 C ATOM 80 CG GLU A 6 -5.438 -9.922 -19.947 1.00 0.00 C ATOM 81 CD GLU A 6 -6.654 -10.406 -19.189 1.00 0.00 C ATOM 82 OE1 GLU A 6 -7.393 -9.571 -18.608 1.00 0.00 O ATOM 83 OE2 GLU A 6 -6.890 -11.633 -19.143 1.00 0.00 O ATOM 0 H GLU A 6 -4.001 -7.869 -18.785 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.870 -10.038 -17.265 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -3.299 -9.931 -19.863 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.048 -11.379 -19.221 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -5.491 -8.839 -20.057 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -5.448 -10.346 -20.951 1.00 0.00 H new ATOM 90 N GLU A 7 -1.608 -9.670 -17.307 1.00 0.00 N ATOM 91 CA GLU A 7 -0.370 -10.104 -16.646 1.00 0.00 C ATOM 92 C GLU A 7 -0.565 -10.106 -15.153 1.00 0.00 C ATOM 93 O GLU A 7 -0.324 -11.110 -14.477 1.00 0.00 O ATOM 94 CB GLU A 7 0.800 -9.163 -16.949 1.00 0.00 C ATOM 95 CG GLU A 7 2.080 -9.570 -16.219 1.00 0.00 C ATOM 96 CD GLU A 7 3.170 -8.548 -16.295 1.00 0.00 C ATOM 97 OE1 GLU A 7 3.999 -8.614 -17.227 1.00 0.00 O ATOM 98 OE2 GLU A 7 3.231 -7.662 -15.404 1.00 0.00 O ATOM 0 H GLU A 7 -1.501 -8.841 -17.891 1.00 0.00 H new ATOM 0 HA GLU A 7 -0.141 -11.101 -17.023 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.985 -9.152 -18.023 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.529 -8.147 -16.662 1.00 0.00 H new ATOM 0 HG2 GLU A 7 1.845 -9.760 -15.172 1.00 0.00 H new ATOM 0 HG3 GLU A 7 2.444 -10.508 -16.639 1.00 0.00 H new ATOM 105 N GLN A 8 -1.023 -8.972 -14.648 1.00 0.00 N ATOM 106 CA GLN A 8 -1.209 -8.804 -13.241 1.00 0.00 C ATOM 107 C GLN A 8 -2.224 -9.758 -12.719 1.00 0.00 C ATOM 108 O GLN A 8 -1.968 -10.443 -11.741 1.00 0.00 O ATOM 109 CB GLN A 8 -1.544 -7.362 -12.871 1.00 0.00 C ATOM 110 CG GLN A 8 -0.383 -6.402 -13.053 1.00 0.00 C ATOM 111 CD GLN A 8 0.840 -6.892 -12.301 1.00 0.00 C ATOM 112 OE1 GLN A 8 1.038 -6.574 -11.138 1.00 0.00 O ATOM 113 NE2 GLN A 8 1.674 -7.649 -12.950 1.00 0.00 N ATOM 0 H GLN A 8 -1.271 -8.156 -15.208 1.00 0.00 H new ATOM 0 HA GLN A 8 -0.258 -9.033 -12.759 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -2.382 -7.025 -13.481 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -1.872 -7.329 -11.832 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.149 -6.303 -14.113 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.664 -5.412 -12.695 1.00 0.00 H new ATOM 0 HE21 GLN A 8 1.486 -7.900 -13.920 1.00 0.00 H new ATOM 0 HE22 GLN A 8 2.517 -7.992 -12.489 1.00 0.00 H new ATOM 122 N ILE A 9 -3.341 -9.860 -13.407 1.00 0.00 N ATOM 123 CA ILE A 9 -4.391 -10.770 -13.008 1.00 0.00 C ATOM 124 C ILE A 9 -3.886 -12.226 -12.991 1.00 0.00 C ATOM 125 O ILE A 9 -4.219 -12.973 -12.095 1.00 0.00 O ATOM 126 CB ILE A 9 -5.675 -10.604 -13.878 1.00 0.00 C ATOM 127 CG1 ILE A 9 -6.208 -9.178 -13.702 1.00 0.00 C ATOM 128 CG2 ILE A 9 -6.742 -11.610 -13.460 1.00 0.00 C ATOM 129 CD1 ILE A 9 -7.422 -8.831 -14.529 1.00 0.00 C ATOM 0 H ILE A 9 -3.545 -9.321 -14.249 1.00 0.00 H new ATOM 0 HA ILE A 9 -4.677 -10.511 -11.989 1.00 0.00 H new ATOM 0 HB ILE A 9 -5.427 -10.786 -14.924 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -6.451 -9.027 -12.650 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -5.410 -8.478 -13.948 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -7.629 -11.477 -14.079 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -6.358 -12.622 -13.588 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -7.002 -11.451 -12.414 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.716 -7.801 -14.329 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.185 -8.942 -15.587 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.243 -9.500 -14.269 1.00 0.00 H new ATOM 141 N ALA A 10 -3.022 -12.585 -13.934 1.00 0.00 N ATOM 142 CA ALA A 10 -2.437 -13.924 -13.975 1.00 0.00 C ATOM 143 C ALA A 10 -1.554 -14.158 -12.758 1.00 0.00 C ATOM 144 O ALA A 10 -1.643 -15.220 -12.099 1.00 0.00 O ATOM 145 CB ALA A 10 -1.638 -14.125 -15.239 1.00 0.00 C ATOM 0 H ALA A 10 -2.709 -11.967 -14.683 1.00 0.00 H new ATOM 0 HA ALA A 10 -3.253 -14.647 -13.964 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -1.213 -15.129 -15.245 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -2.289 -14.001 -16.104 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -0.834 -13.391 -15.282 1.00 0.00 H new ATOM 151 N GLU A 11 -0.727 -13.161 -12.437 1.00 0.00 N ATOM 152 CA GLU A 11 0.131 -13.215 -11.261 1.00 0.00 C ATOM 153 C GLU A 11 -0.732 -13.319 -9.994 1.00 0.00 C ATOM 154 O GLU A 11 -0.380 -14.028 -9.032 1.00 0.00 O ATOM 155 CB GLU A 11 1.061 -11.982 -11.175 1.00 0.00 C ATOM 156 CG GLU A 11 2.037 -11.807 -12.346 1.00 0.00 C ATOM 157 CD GLU A 11 2.973 -10.606 -12.178 1.00 0.00 C ATOM 158 OE1 GLU A 11 2.657 -9.691 -11.380 1.00 0.00 O ATOM 159 OE2 GLU A 11 4.029 -10.545 -12.862 1.00 0.00 O ATOM 0 H GLU A 11 -0.636 -12.303 -12.981 1.00 0.00 H new ATOM 0 HA GLU A 11 0.764 -14.098 -11.345 1.00 0.00 H new ATOM 0 HB2 GLU A 11 0.443 -11.087 -11.103 1.00 0.00 H new ATOM 0 HB3 GLU A 11 1.637 -12.047 -10.252 1.00 0.00 H new ATOM 0 HG2 GLU A 11 2.634 -12.713 -12.451 1.00 0.00 H new ATOM 0 HG3 GLU A 11 1.469 -11.691 -13.269 1.00 0.00 H new ATOM 166 N PHE A 12 -1.868 -12.636 -10.003 1.00 0.00 N ATOM 167 CA PHE A 12 -2.791 -12.686 -8.891 1.00 0.00 C ATOM 168 C PHE A 12 -3.521 -14.012 -8.802 1.00 0.00 C ATOM 169 O PHE A 12 -3.788 -14.455 -7.736 1.00 0.00 O ATOM 170 CB PHE A 12 -3.769 -11.501 -8.859 1.00 0.00 C ATOM 171 CG PHE A 12 -3.124 -10.202 -8.476 1.00 0.00 C ATOM 172 CD1 PHE A 12 -2.611 -10.032 -7.212 1.00 0.00 C ATOM 173 CD2 PHE A 12 -3.036 -9.158 -9.365 1.00 0.00 C ATOM 174 CE1 PHE A 12 -2.015 -8.850 -6.846 1.00 0.00 C ATOM 175 CE2 PHE A 12 -2.439 -7.970 -9.004 1.00 0.00 C ATOM 176 CZ PHE A 12 -1.929 -7.820 -7.746 1.00 0.00 C ATOM 0 H PHE A 12 -2.168 -12.040 -10.774 1.00 0.00 H new ATOM 0 HA PHE A 12 -2.171 -12.597 -7.999 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -4.229 -11.393 -9.841 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -4.571 -11.721 -8.154 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -2.678 -10.839 -6.497 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -3.440 -9.270 -10.360 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -1.614 -8.732 -5.850 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -2.374 -7.159 -9.714 1.00 0.00 H new ATOM 0 HZ PHE A 12 -1.458 -6.891 -7.461 1.00 0.00 H new ATOM 186 N LYS A 13 -3.822 -14.644 -9.930 1.00 0.00 N ATOM 187 CA LYS A 13 -4.474 -15.975 -9.935 1.00 0.00 C ATOM 188 C LYS A 13 -3.602 -16.980 -9.190 1.00 0.00 C ATOM 189 O LYS A 13 -4.078 -17.768 -8.362 1.00 0.00 O ATOM 190 CB LYS A 13 -4.717 -16.464 -11.376 1.00 0.00 C ATOM 191 CG LYS A 13 -5.746 -15.661 -12.154 1.00 0.00 C ATOM 192 CD LYS A 13 -5.914 -16.179 -13.563 1.00 0.00 C ATOM 193 CE LYS A 13 -6.963 -15.381 -14.323 1.00 0.00 C ATOM 194 NZ LYS A 13 -7.083 -15.809 -15.731 1.00 0.00 N ATOM 0 H LYS A 13 -3.631 -14.268 -10.859 1.00 0.00 H new ATOM 0 HA LYS A 13 -5.438 -15.887 -9.435 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -3.772 -16.439 -11.918 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -5.038 -17.505 -11.343 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -6.704 -15.700 -11.636 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -5.442 -14.615 -12.185 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -4.961 -16.125 -14.089 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -6.203 -17.230 -13.535 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -7.928 -15.491 -13.829 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -6.706 -14.322 -14.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -7.809 -15.237 -16.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -6.170 -15.680 -16.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -7.354 -16.812 -15.767 1.00 0.00 H new ATOM 208 N GLU A 14 -2.321 -16.894 -9.465 1.00 0.00 N ATOM 209 CA GLU A 14 -1.304 -17.725 -8.856 1.00 0.00 C ATOM 210 C GLU A 14 -1.251 -17.489 -7.334 1.00 0.00 C ATOM 211 O GLU A 14 -1.407 -18.425 -6.518 1.00 0.00 O ATOM 212 CB GLU A 14 0.039 -17.363 -9.503 1.00 0.00 C ATOM 213 CG GLU A 14 1.251 -18.053 -8.921 1.00 0.00 C ATOM 214 CD GLU A 14 2.522 -17.605 -9.588 1.00 0.00 C ATOM 215 OE1 GLU A 14 3.060 -18.344 -10.410 1.00 0.00 O ATOM 216 OE2 GLU A 14 2.998 -16.479 -9.308 1.00 0.00 O ATOM 0 H GLU A 14 -1.945 -16.225 -10.138 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.531 -18.779 -9.015 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -0.015 -17.598 -10.566 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.182 -16.286 -9.422 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.309 -17.846 -7.852 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.143 -19.132 -9.032 1.00 0.00 H new ATOM 223 N ALA A 15 -1.089 -16.238 -6.965 1.00 0.00 N ATOM 224 CA ALA A 15 -0.938 -15.855 -5.580 1.00 0.00 C ATOM 225 C ALA A 15 -2.237 -16.030 -4.791 1.00 0.00 C ATOM 226 O ALA A 15 -2.210 -16.339 -3.607 1.00 0.00 O ATOM 227 CB ALA A 15 -0.422 -14.441 -5.491 1.00 0.00 C ATOM 0 H ALA A 15 -1.058 -15.456 -7.619 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.208 -16.522 -5.122 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -0.311 -14.159 -4.444 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.545 -14.375 -5.989 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -1.127 -13.765 -5.975 1.00 0.00 H new ATOM 233 N PHE A 16 -3.367 -15.856 -5.458 1.00 0.00 N ATOM 234 CA PHE A 16 -4.669 -16.044 -4.843 1.00 0.00 C ATOM 235 C PHE A 16 -4.802 -17.483 -4.425 1.00 0.00 C ATOM 236 O PHE A 16 -5.135 -17.768 -3.302 1.00 0.00 O ATOM 237 CB PHE A 16 -5.821 -15.686 -5.810 1.00 0.00 C ATOM 238 CG PHE A 16 -7.187 -15.784 -5.194 1.00 0.00 C ATOM 239 CD1 PHE A 16 -7.899 -16.961 -5.247 1.00 0.00 C ATOM 240 CD2 PHE A 16 -7.755 -14.696 -4.563 1.00 0.00 C ATOM 241 CE1 PHE A 16 -9.139 -17.049 -4.690 1.00 0.00 C ATOM 242 CE2 PHE A 16 -9.007 -14.783 -4.004 1.00 0.00 C ATOM 243 CZ PHE A 16 -9.696 -15.958 -4.069 1.00 0.00 C ATOM 0 H PHE A 16 -3.406 -15.581 -6.439 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.739 -15.379 -3.982 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.671 -14.671 -6.177 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -5.775 -16.348 -6.675 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -7.470 -17.824 -5.735 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -7.209 -13.766 -4.508 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.686 -17.979 -4.737 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -9.444 -13.925 -3.515 1.00 0.00 H new ATOM 0 HZ PHE A 16 -10.681 -16.031 -3.632 1.00 0.00 H new ATOM 253 N SER A 17 -4.474 -18.381 -5.334 1.00 0.00 N ATOM 254 CA SER A 17 -4.580 -19.808 -5.087 1.00 0.00 C ATOM 255 C SER A 17 -3.534 -20.277 -4.041 1.00 0.00 C ATOM 256 O SER A 17 -3.643 -21.365 -3.473 1.00 0.00 O ATOM 257 CB SER A 17 -4.429 -20.554 -6.407 1.00 0.00 C ATOM 258 OG SER A 17 -5.373 -20.064 -7.375 1.00 0.00 O ATOM 0 H SER A 17 -4.127 -18.143 -6.263 1.00 0.00 H new ATOM 0 HA SER A 17 -5.561 -20.029 -4.667 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.414 -20.432 -6.786 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.584 -21.621 -6.248 1.00 0.00 H new ATOM 0 HG SER A 17 -5.015 -19.258 -7.802 1.00 0.00 H new ATOM 264 N LEU A 18 -2.518 -19.453 -3.814 1.00 0.00 N ATOM 265 CA LEU A 18 -1.539 -19.705 -2.775 1.00 0.00 C ATOM 266 C LEU A 18 -2.167 -19.470 -1.391 1.00 0.00 C ATOM 267 O LEU A 18 -1.833 -20.142 -0.410 1.00 0.00 O ATOM 268 CB LEU A 18 -0.342 -18.795 -2.978 1.00 0.00 C ATOM 269 CG LEU A 18 0.814 -18.972 -2.004 1.00 0.00 C ATOM 270 CD1 LEU A 18 1.294 -20.416 -1.987 1.00 0.00 C ATOM 271 CD2 LEU A 18 1.927 -18.087 -2.428 1.00 0.00 C ATOM 0 H LEU A 18 -2.354 -18.597 -4.344 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.209 -20.742 -2.830 1.00 0.00 H new ATOM 0 HB2 LEU A 18 0.036 -18.948 -3.989 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.684 -17.762 -2.919 1.00 0.00 H new ATOM 0 HG LEU A 18 0.478 -18.713 -1.000 1.00 0.00 H new ATOM 0 HD11 LEU A 18 2.120 -20.516 -1.283 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.476 -21.068 -1.681 1.00 0.00 H new ATOM 0 HD13 LEU A 18 1.630 -20.699 -2.984 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.765 -18.201 -1.740 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.244 -18.358 -3.435 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.590 -17.050 -2.421 1.00 0.00 H new ATOM 283 N PHE A 19 -3.095 -18.544 -1.337 1.00 0.00 N ATOM 284 CA PHE A 19 -3.784 -18.202 -0.102 1.00 0.00 C ATOM 285 C PHE A 19 -5.109 -18.949 0.013 1.00 0.00 C ATOM 286 O PHE A 19 -5.518 -19.353 1.104 1.00 0.00 O ATOM 287 CB PHE A 19 -3.967 -16.676 0.017 1.00 0.00 C ATOM 288 CG PHE A 19 -2.692 -15.950 0.392 1.00 0.00 C ATOM 289 CD1 PHE A 19 -1.574 -15.985 -0.425 1.00 0.00 C ATOM 290 CD2 PHE A 19 -2.615 -15.255 1.578 1.00 0.00 C ATOM 291 CE1 PHE A 19 -0.408 -15.349 -0.059 1.00 0.00 C ATOM 292 CE2 PHE A 19 -1.456 -14.613 1.952 1.00 0.00 C ATOM 293 CZ PHE A 19 -0.349 -14.662 1.137 1.00 0.00 C ATOM 0 H PHE A 19 -3.399 -18.002 -2.146 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.165 -18.521 0.737 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.334 -16.285 -0.932 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.731 -16.465 0.765 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.617 -16.519 -1.363 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -3.478 -15.213 2.226 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.456 -15.388 -0.705 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.416 -14.071 2.885 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.563 -14.165 1.432 1.00 0.00 H new ATOM 303 N ASP A 20 -5.765 -19.132 -1.113 1.00 0.00 N ATOM 304 CA ASP A 20 -6.993 -19.904 -1.191 1.00 0.00 C ATOM 305 C ASP A 20 -6.617 -21.378 -1.159 1.00 0.00 C ATOM 306 O ASP A 20 -6.195 -21.962 -2.169 1.00 0.00 O ATOM 307 CB ASP A 20 -7.805 -19.557 -2.471 1.00 0.00 C ATOM 308 CG ASP A 20 -9.169 -20.256 -2.555 1.00 0.00 C ATOM 309 OD1 ASP A 20 -10.013 -19.857 -3.360 1.00 0.00 O ATOM 310 OD2 ASP A 20 -9.434 -21.221 -1.802 1.00 0.00 O ATOM 0 H ASP A 20 -5.461 -18.748 -2.008 1.00 0.00 H new ATOM 0 HA ASP A 20 -7.637 -19.662 -0.346 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.958 -18.479 -2.510 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -7.215 -19.827 -3.347 1.00 0.00 H new ATOM 315 N LYS A 21 -6.745 -21.955 0.007 1.00 0.00 N ATOM 316 CA LYS A 21 -6.311 -23.298 0.288 1.00 0.00 C ATOM 317 C LYS A 21 -7.045 -24.373 -0.475 1.00 0.00 C ATOM 318 O LYS A 21 -6.533 -25.492 -0.613 1.00 0.00 O ATOM 319 CB LYS A 21 -6.378 -23.573 1.749 1.00 0.00 C ATOM 320 CG LYS A 21 -5.416 -22.752 2.570 1.00 0.00 C ATOM 321 CD LYS A 21 -5.442 -23.173 4.022 1.00 0.00 C ATOM 322 CE LYS A 21 -4.327 -22.517 4.809 1.00 0.00 C ATOM 323 NZ LYS A 21 -2.994 -22.884 4.278 1.00 0.00 N ATOM 0 H LYS A 21 -7.167 -21.490 0.811 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.279 -23.343 -0.060 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -7.393 -23.383 2.098 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.175 -24.630 1.919 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -4.407 -22.865 2.174 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -5.674 -21.696 2.490 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -6.404 -22.908 4.462 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.348 -24.257 4.090 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.446 -21.434 4.776 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -4.396 -22.814 5.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -2.274 -22.730 5.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -2.995 -23.886 3.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -2.776 -22.294 3.450 1.00 0.00 H new ATOM 337 N ASP A 22 -8.227 -24.082 -0.945 1.00 0.00 N ATOM 338 CA ASP A 22 -8.962 -25.077 -1.704 1.00 0.00 C ATOM 339 C ASP A 22 -9.119 -24.665 -3.157 1.00 0.00 C ATOM 340 O ASP A 22 -9.447 -25.493 -4.007 1.00 0.00 O ATOM 341 CB ASP A 22 -10.316 -25.427 -1.061 1.00 0.00 C ATOM 342 CG ASP A 22 -11.291 -24.282 -1.023 1.00 0.00 C ATOM 343 OD1 ASP A 22 -11.138 -23.381 -0.164 1.00 0.00 O ATOM 344 OD2 ASP A 22 -12.244 -24.277 -1.809 1.00 0.00 O ATOM 0 H ASP A 22 -8.700 -23.187 -0.824 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.366 -25.989 -1.684 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -10.765 -26.254 -1.611 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -10.143 -25.777 -0.043 1.00 0.00 H new ATOM 349 N GLY A 23 -8.832 -23.404 -3.441 1.00 0.00 N ATOM 350 CA GLY A 23 -8.858 -22.897 -4.802 1.00 0.00 C ATOM 351 C GLY A 23 -10.252 -22.821 -5.367 1.00 0.00 C ATOM 352 O GLY A 23 -10.541 -23.400 -6.427 1.00 0.00 O ATOM 0 H GLY A 23 -8.576 -22.709 -2.740 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.407 -21.905 -4.825 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.248 -23.540 -5.437 1.00 0.00 H new ATOM 356 N ASP A 24 -11.110 -22.106 -4.697 1.00 0.00 N ATOM 357 CA ASP A 24 -12.496 -22.011 -5.117 1.00 0.00 C ATOM 358 C ASP A 24 -12.817 -20.600 -5.578 1.00 0.00 C ATOM 359 O ASP A 24 -13.840 -20.361 -6.224 1.00 0.00 O ATOM 360 CB ASP A 24 -13.444 -22.408 -3.991 1.00 0.00 C ATOM 361 CG ASP A 24 -13.633 -21.333 -2.955 1.00 0.00 C ATOM 362 OD1 ASP A 24 -12.720 -21.080 -2.139 1.00 0.00 O ATOM 363 OD2 ASP A 24 -14.723 -20.737 -2.916 1.00 0.00 O ATOM 0 H ASP A 24 -10.883 -21.576 -3.855 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.636 -22.703 -5.948 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.414 -22.664 -4.417 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -13.062 -23.306 -3.505 1.00 0.00 H new ATOM 368 N GLY A 25 -11.939 -19.673 -5.266 1.00 0.00 N ATOM 369 CA GLY A 25 -12.131 -18.308 -5.657 1.00 0.00 C ATOM 370 C GLY A 25 -12.594 -17.438 -4.524 1.00 0.00 C ATOM 371 O GLY A 25 -12.925 -16.272 -4.743 1.00 0.00 O ATOM 0 H GLY A 25 -11.083 -19.848 -4.740 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -11.195 -17.913 -6.053 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -12.862 -18.265 -6.464 1.00 0.00 H new ATOM 375 N THR A 26 -12.627 -17.977 -3.324 1.00 0.00 N ATOM 376 CA THR A 26 -12.955 -17.189 -2.163 1.00 0.00 C ATOM 377 C THR A 26 -12.024 -17.556 -1.014 1.00 0.00 C ATOM 378 O THR A 26 -11.791 -18.739 -0.733 1.00 0.00 O ATOM 379 CB THR A 26 -14.443 -17.330 -1.702 1.00 0.00 C ATOM 380 OG1 THR A 26 -14.772 -18.684 -1.392 1.00 0.00 O ATOM 381 CG2 THR A 26 -15.423 -16.788 -2.731 1.00 0.00 C ATOM 0 H THR A 26 -12.430 -18.959 -3.130 1.00 0.00 H new ATOM 0 HA THR A 26 -12.821 -16.146 -2.452 1.00 0.00 H new ATOM 0 HB THR A 26 -14.535 -16.728 -0.798 1.00 0.00 H new ATOM 0 HG1 THR A 26 -14.809 -19.209 -2.219 1.00 0.00 H new ATOM 0 HG21 THR A 26 -16.442 -16.910 -2.363 1.00 0.00 H new ATOM 0 HG22 THR A 26 -15.223 -15.730 -2.902 1.00 0.00 H new ATOM 0 HG23 THR A 26 -15.308 -17.335 -3.667 1.00 0.00 H new ATOM 389 N ILE A 27 -11.463 -16.576 -0.390 1.00 0.00 N ATOM 390 CA ILE A 27 -10.612 -16.793 0.731 1.00 0.00 C ATOM 391 C ILE A 27 -11.396 -16.475 1.996 1.00 0.00 C ATOM 392 O ILE A 27 -12.004 -15.393 2.113 1.00 0.00 O ATOM 393 CB ILE A 27 -9.333 -15.915 0.664 1.00 0.00 C ATOM 394 CG1 ILE A 27 -8.585 -16.148 -0.638 1.00 0.00 C ATOM 395 CG2 ILE A 27 -8.420 -16.259 1.797 1.00 0.00 C ATOM 396 CD1 ILE A 27 -7.361 -15.267 -0.826 1.00 0.00 C ATOM 0 H ILE A 27 -11.583 -15.596 -0.645 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.287 -17.834 0.730 1.00 0.00 H new ATOM 0 HB ILE A 27 -9.640 -14.871 0.726 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -8.276 -17.192 -0.683 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -9.269 -15.981 -1.470 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -7.525 -15.639 1.744 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -8.930 -16.079 2.743 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -8.138 -17.310 1.731 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.888 -15.500 -1.780 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.662 -14.219 -0.816 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.654 -15.449 -0.017 1.00 0.00 H new ATOM 408 N THR A 28 -11.442 -17.427 2.884 1.00 0.00 N ATOM 409 CA THR A 28 -12.110 -17.282 4.154 1.00 0.00 C ATOM 410 C THR A 28 -11.112 -16.843 5.233 1.00 0.00 C ATOM 411 O THR A 28 -9.887 -16.908 5.014 1.00 0.00 O ATOM 412 CB THR A 28 -12.756 -18.621 4.566 1.00 0.00 C ATOM 413 OG1 THR A 28 -11.782 -19.672 4.469 1.00 0.00 O ATOM 414 CG2 THR A 28 -13.934 -18.961 3.682 1.00 0.00 C ATOM 0 H THR A 28 -11.011 -18.341 2.748 1.00 0.00 H new ATOM 0 HA THR A 28 -12.885 -16.522 4.054 1.00 0.00 H new ATOM 0 HB THR A 28 -13.110 -18.522 5.592 1.00 0.00 H new ATOM 0 HG1 THR A 28 -11.683 -19.940 3.532 1.00 0.00 H new ATOM 0 HG21 THR A 28 -14.365 -19.910 4.000 1.00 0.00 H new ATOM 0 HG22 THR A 28 -14.686 -18.176 3.760 1.00 0.00 H new ATOM 0 HG23 THR A 28 -13.601 -19.042 2.647 1.00 0.00 H new ATOM 422 N THR A 29 -11.616 -16.426 6.392 1.00 0.00 N ATOM 423 CA THR A 29 -10.771 -16.029 7.502 1.00 0.00 C ATOM 424 C THR A 29 -9.969 -17.227 8.011 1.00 0.00 C ATOM 425 O THR A 29 -8.875 -17.068 8.578 1.00 0.00 O ATOM 426 CB THR A 29 -11.598 -15.427 8.645 1.00 0.00 C ATOM 427 OG1 THR A 29 -12.636 -16.329 9.020 1.00 0.00 O ATOM 428 CG2 THR A 29 -12.202 -14.098 8.251 1.00 0.00 C ATOM 0 H THR A 29 -12.616 -16.356 6.582 1.00 0.00 H new ATOM 0 HA THR A 29 -10.084 -15.264 7.142 1.00 0.00 H new ATOM 0 HB THR A 29 -10.929 -15.261 9.489 1.00 0.00 H new ATOM 0 HG1 THR A 29 -12.627 -16.452 9.992 1.00 0.00 H new ATOM 0 HG21 THR A 29 -12.781 -13.700 9.084 1.00 0.00 H new ATOM 0 HG22 THR A 29 -11.406 -13.398 7.995 1.00 0.00 H new ATOM 0 HG23 THR A 29 -12.855 -14.236 7.389 1.00 0.00 H new ATOM 436 N LYS A 30 -10.531 -18.421 7.792 1.00 0.00 N ATOM 437 CA LYS A 30 -9.895 -19.685 8.091 1.00 0.00 C ATOM 438 C LYS A 30 -8.556 -19.740 7.387 1.00 0.00 C ATOM 439 O LYS A 30 -7.493 -19.771 8.028 1.00 0.00 O ATOM 440 CB LYS A 30 -10.770 -20.803 7.549 1.00 0.00 C ATOM 441 CG LYS A 30 -10.302 -22.198 7.908 1.00 0.00 C ATOM 442 CD LYS A 30 -10.239 -22.424 9.410 1.00 0.00 C ATOM 443 CE LYS A 30 -9.916 -23.877 9.745 1.00 0.00 C ATOM 444 NZ LYS A 30 -8.572 -24.285 9.283 1.00 0.00 N ATOM 0 H LYS A 30 -11.463 -18.525 7.392 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.758 -19.792 9.167 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -11.785 -20.667 7.923 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.816 -20.717 6.463 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -10.976 -22.930 7.462 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -9.316 -22.369 7.477 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -9.481 -21.772 9.845 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.193 -22.149 9.860 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -9.984 -24.020 10.823 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -10.664 -24.525 9.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -8.385 -25.264 9.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -8.528 -24.224 8.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -7.856 -23.654 9.697 1.00 0.00 H new ATOM 458 N GLU A 31 -8.637 -19.651 6.070 1.00 0.00 N ATOM 459 CA GLU A 31 -7.507 -19.711 5.177 1.00 0.00 C ATOM 460 C GLU A 31 -6.548 -18.567 5.478 1.00 0.00 C ATOM 461 O GLU A 31 -5.332 -18.771 5.567 1.00 0.00 O ATOM 462 CB GLU A 31 -8.023 -19.640 3.737 1.00 0.00 C ATOM 463 CG GLU A 31 -9.019 -20.750 3.418 1.00 0.00 C ATOM 464 CD GLU A 31 -9.707 -20.589 2.080 1.00 0.00 C ATOM 465 OE1 GLU A 31 -9.227 -21.089 1.074 1.00 0.00 O ATOM 466 OE2 GLU A 31 -10.792 -19.974 2.007 1.00 0.00 O ATOM 0 H GLU A 31 -9.525 -19.531 5.583 1.00 0.00 H new ATOM 0 HA GLU A 31 -6.961 -20.644 5.314 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -8.497 -18.672 3.572 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.180 -19.704 3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -8.499 -21.708 3.435 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -9.775 -20.783 4.203 1.00 0.00 H new ATOM 473 N LEU A 32 -7.118 -17.379 5.699 1.00 0.00 N ATOM 474 CA LEU A 32 -6.357 -16.183 6.011 1.00 0.00 C ATOM 475 C LEU A 32 -5.466 -16.351 7.231 1.00 0.00 C ATOM 476 O LEU A 32 -4.261 -16.283 7.118 1.00 0.00 O ATOM 477 CB LEU A 32 -7.259 -14.957 6.215 1.00 0.00 C ATOM 478 CG LEU A 32 -7.978 -14.400 4.989 1.00 0.00 C ATOM 479 CD1 LEU A 32 -8.836 -13.213 5.380 1.00 0.00 C ATOM 480 CD2 LEU A 32 -6.982 -13.983 3.930 1.00 0.00 C ATOM 0 H LEU A 32 -8.126 -17.227 5.664 1.00 0.00 H new ATOM 0 HA LEU A 32 -5.722 -16.018 5.140 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.013 -15.214 6.959 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.651 -14.159 6.640 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.615 -15.185 4.581 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.344 -12.824 4.497 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -9.576 -13.526 6.116 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -8.206 -12.434 5.808 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.515 -13.589 3.065 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.324 -13.213 4.333 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -6.389 -14.846 3.629 1.00 0.00 H new ATOM 492 N GLY A 33 -6.045 -16.608 8.376 1.00 0.00 N ATOM 493 CA GLY A 33 -5.242 -16.649 9.585 1.00 0.00 C ATOM 494 C GLY A 33 -4.204 -17.741 9.578 1.00 0.00 C ATOM 495 O GLY A 33 -3.121 -17.561 10.120 1.00 0.00 O ATOM 0 H GLY A 33 -7.041 -16.788 8.503 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.746 -15.687 9.715 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.899 -16.788 10.444 1.00 0.00 H new ATOM 499 N THR A 34 -4.505 -18.843 8.926 1.00 0.00 N ATOM 500 CA THR A 34 -3.571 -19.926 8.834 1.00 0.00 C ATOM 501 C THR A 34 -2.351 -19.534 7.979 1.00 0.00 C ATOM 502 O THR A 34 -1.206 -19.776 8.377 1.00 0.00 O ATOM 503 CB THR A 34 -4.255 -21.168 8.278 1.00 0.00 C ATOM 504 OG1 THR A 34 -5.418 -21.433 9.076 1.00 0.00 O ATOM 505 CG2 THR A 34 -3.329 -22.373 8.326 1.00 0.00 C ATOM 0 H THR A 34 -5.394 -19.006 8.453 1.00 0.00 H new ATOM 0 HA THR A 34 -3.209 -20.154 9.837 1.00 0.00 H new ATOM 0 HB THR A 34 -4.526 -20.991 7.237 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.165 -20.884 8.758 1.00 0.00 H new ATOM 0 HG21 THR A 34 -3.845 -23.244 7.923 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.438 -22.171 7.731 1.00 0.00 H new ATOM 0 HG23 THR A 34 -3.039 -22.568 9.358 1.00 0.00 H new ATOM 513 N VAL A 35 -2.580 -18.887 6.836 1.00 0.00 N ATOM 514 CA VAL A 35 -1.458 -18.462 6.010 1.00 0.00 C ATOM 515 C VAL A 35 -0.727 -17.307 6.674 1.00 0.00 C ATOM 516 O VAL A 35 0.495 -17.244 6.639 1.00 0.00 O ATOM 517 CB VAL A 35 -1.839 -18.093 4.543 1.00 0.00 C ATOM 518 CG1 VAL A 35 -2.391 -19.286 3.802 1.00 0.00 C ATOM 519 CG2 VAL A 35 -2.828 -16.952 4.487 1.00 0.00 C ATOM 0 H VAL A 35 -3.504 -18.653 6.472 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.802 -19.329 5.932 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.919 -17.771 4.054 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.647 -18.995 2.783 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.642 -20.077 3.776 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.284 -19.649 4.311 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -3.066 -16.727 3.447 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -3.739 -17.234 5.015 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.393 -16.070 4.958 1.00 0.00 H new ATOM 529 N MET A 36 -1.481 -16.438 7.335 1.00 0.00 N ATOM 530 CA MET A 36 -0.919 -15.296 8.025 1.00 0.00 C ATOM 531 C MET A 36 -0.023 -15.712 9.159 1.00 0.00 C ATOM 532 O MET A 36 1.090 -15.196 9.294 1.00 0.00 O ATOM 533 CB MET A 36 -1.996 -14.298 8.477 1.00 0.00 C ATOM 534 CG MET A 36 -1.974 -13.019 7.627 1.00 0.00 C ATOM 535 SD MET A 36 -2.146 -13.324 5.868 1.00 0.00 S ATOM 536 CE MET A 36 -3.886 -13.627 5.761 1.00 0.00 C ATOM 0 H MET A 36 -2.496 -16.509 7.405 1.00 0.00 H new ATOM 0 HA MET A 36 -0.295 -14.770 7.302 1.00 0.00 H new ATOM 0 HB2 MET A 36 -2.978 -14.765 8.407 1.00 0.00 H new ATOM 0 HB3 MET A 36 -1.839 -14.042 9.525 1.00 0.00 H new ATOM 0 HG2 MET A 36 -2.780 -12.361 7.954 1.00 0.00 H new ATOM 0 HG3 MET A 36 -1.038 -12.490 7.806 1.00 0.00 H new ATOM 0 HE1 MET A 36 -4.059 -14.577 5.255 1.00 0.00 H new ATOM 0 HE2 MET A 36 -4.311 -13.667 6.764 1.00 0.00 H new ATOM 0 HE3 MET A 36 -4.361 -12.824 5.198 1.00 0.00 H new ATOM 546 N ARG A 37 -0.469 -16.678 9.940 1.00 0.00 N ATOM 547 CA ARG A 37 0.326 -17.192 11.042 1.00 0.00 C ATOM 548 C ARG A 37 1.594 -17.870 10.509 1.00 0.00 C ATOM 549 O ARG A 37 2.655 -17.782 11.114 1.00 0.00 O ATOM 550 CB ARG A 37 -0.498 -18.148 11.919 1.00 0.00 C ATOM 551 CG ARG A 37 0.273 -18.727 13.093 1.00 0.00 C ATOM 552 CD ARG A 37 -0.585 -19.658 13.932 1.00 0.00 C ATOM 553 NE ARG A 37 0.196 -20.281 15.005 1.00 0.00 N ATOM 554 CZ ARG A 37 -0.305 -20.797 16.140 1.00 0.00 C ATOM 555 NH1 ARG A 37 -1.611 -20.721 16.402 1.00 0.00 N ATOM 556 NH2 ARG A 37 0.505 -21.384 17.012 1.00 0.00 N ATOM 0 H ARG A 37 -1.380 -17.124 9.832 1.00 0.00 H new ATOM 0 HA ARG A 37 0.628 -16.356 11.672 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.371 -17.616 12.297 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.866 -18.966 11.300 1.00 0.00 H new ATOM 0 HG2 ARG A 37 1.143 -19.270 12.723 1.00 0.00 H new ATOM 0 HG3 ARG A 37 0.646 -17.915 13.718 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -1.417 -19.100 14.362 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -1.015 -20.432 13.296 1.00 0.00 H new ATOM 0 HE ARG A 37 1.207 -20.327 14.879 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -2.239 -20.268 15.738 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -1.982 -21.116 17.266 1.00 0.00 H new ATOM 0 HH21 ARG A 37 1.505 -21.443 16.820 1.00 0.00 H new ATOM 0 HH22 ARG A 37 0.128 -21.777 17.874 1.00 0.00 H new ATOM 570 N SER A 38 1.485 -18.487 9.342 1.00 0.00 N ATOM 571 CA SER A 38 2.625 -19.116 8.693 1.00 0.00 C ATOM 572 C SER A 38 3.617 -18.057 8.163 1.00 0.00 C ATOM 573 O SER A 38 4.790 -18.348 7.938 1.00 0.00 O ATOM 574 CB SER A 38 2.147 -20.028 7.558 1.00 0.00 C ATOM 575 OG SER A 38 1.247 -21.025 8.055 1.00 0.00 O ATOM 0 H SER A 38 0.611 -18.566 8.822 1.00 0.00 H new ATOM 0 HA SER A 38 3.150 -19.722 9.432 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.651 -19.433 6.791 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.004 -20.508 7.085 1.00 0.00 H new ATOM 0 HG SER A 38 0.365 -20.625 8.203 1.00 0.00 H new ATOM 581 N LEU A 39 3.134 -16.839 7.962 1.00 0.00 N ATOM 582 CA LEU A 39 3.979 -15.743 7.514 1.00 0.00 C ATOM 583 C LEU A 39 4.591 -15.022 8.706 1.00 0.00 C ATOM 584 O LEU A 39 5.627 -14.387 8.586 1.00 0.00 O ATOM 585 CB LEU A 39 3.177 -14.745 6.668 1.00 0.00 C ATOM 586 CG LEU A 39 2.555 -15.291 5.382 1.00 0.00 C ATOM 587 CD1 LEU A 39 1.769 -14.212 4.665 1.00 0.00 C ATOM 588 CD2 LEU A 39 3.619 -15.867 4.471 1.00 0.00 C ATOM 0 H LEU A 39 2.156 -16.585 8.103 1.00 0.00 H new ATOM 0 HA LEU A 39 4.776 -16.164 6.901 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.378 -14.336 7.287 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.833 -13.915 6.405 1.00 0.00 H new ATOM 0 HG LEU A 39 1.868 -16.092 5.654 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.335 -14.623 3.753 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.972 -13.850 5.315 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.433 -13.386 4.411 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.153 -16.249 3.563 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.336 -15.088 4.211 1.00 0.00 H new ATOM 0 HD23 LEU A 39 4.136 -16.679 4.983 1.00 0.00 H new ATOM 600 N GLY A 40 3.959 -15.144 9.851 1.00 0.00 N ATOM 601 CA GLY A 40 4.458 -14.494 11.044 1.00 0.00 C ATOM 602 C GLY A 40 3.593 -13.327 11.481 1.00 0.00 C ATOM 603 O GLY A 40 3.903 -12.646 12.450 1.00 0.00 O ATOM 0 H GLY A 40 3.103 -15.684 9.983 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.514 -15.222 11.853 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.473 -14.141 10.863 1.00 0.00 H new ATOM 607 N GLN A 41 2.497 -13.108 10.784 1.00 0.00 N ATOM 608 CA GLN A 41 1.573 -12.049 11.124 1.00 0.00 C ATOM 609 C GLN A 41 0.403 -12.652 11.845 1.00 0.00 C ATOM 610 O GLN A 41 -0.129 -13.654 11.411 1.00 0.00 O ATOM 611 CB GLN A 41 1.045 -11.379 9.899 1.00 0.00 C ATOM 612 CG GLN A 41 0.245 -10.165 10.279 1.00 0.00 C ATOM 613 CD GLN A 41 1.081 -8.907 10.479 1.00 0.00 C ATOM 614 OE1 GLN A 41 1.300 -8.130 9.549 1.00 0.00 O ATOM 615 NE2 GLN A 41 1.534 -8.683 11.685 1.00 0.00 N ATOM 0 H GLN A 41 2.224 -13.657 9.969 1.00 0.00 H new ATOM 0 HA GLN A 41 2.100 -11.318 11.737 1.00 0.00 H new ATOM 0 HB2 GLN A 41 1.870 -11.091 9.248 1.00 0.00 H new ATOM 0 HB3 GLN A 41 0.422 -12.073 9.335 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -0.498 -9.975 9.504 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -0.301 -10.376 11.199 1.00 0.00 H new ATOM 0 HE21 GLN A 41 1.336 -9.345 12.435 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.085 -7.846 11.875 1.00 0.00 H new ATOM 624 N ASN A 42 0.013 -12.102 12.954 1.00 0.00 N ATOM 625 CA ASN A 42 -1.146 -12.635 13.655 1.00 0.00 C ATOM 626 C ASN A 42 -2.249 -11.599 13.841 1.00 0.00 C ATOM 627 O ASN A 42 -2.312 -10.944 14.870 1.00 0.00 O ATOM 628 CB ASN A 42 -0.798 -13.284 15.019 1.00 0.00 C ATOM 629 CG ASN A 42 -0.125 -14.666 14.961 1.00 0.00 C ATOM 630 OD1 ASN A 42 0.637 -14.953 13.939 1.00 0.00 O flip ATOM 631 ND2 ASN A 42 -0.322 -15.481 15.849 1.00 0.00 N flip ATOM 0 H ASN A 42 0.460 -11.300 13.397 1.00 0.00 H new ATOM 0 HA ASN A 42 -1.520 -13.423 13.001 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -0.141 -12.606 15.564 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -1.716 -13.374 15.600 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -0.920 -15.240 16.639 1.00 0.00 H new ATOM 0 HD22 ASN A 42 0.111 -16.403 15.800 1.00 0.00 H new ATOM 638 N PRO A 43 -3.063 -11.341 12.804 1.00 0.00 N ATOM 639 CA PRO A 43 -4.264 -10.534 12.957 1.00 0.00 C ATOM 640 C PRO A 43 -5.361 -11.401 13.579 1.00 0.00 C ATOM 641 O PRO A 43 -5.336 -12.634 13.433 1.00 0.00 O ATOM 642 CB PRO A 43 -4.642 -10.154 11.513 1.00 0.00 C ATOM 643 CG PRO A 43 -3.486 -10.592 10.676 1.00 0.00 C ATOM 644 CD PRO A 43 -2.864 -11.734 11.405 1.00 0.00 C ATOM 0 HA PRO A 43 -4.127 -9.660 13.593 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -5.562 -10.650 11.204 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.811 -9.081 11.420 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -3.816 -10.896 9.683 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -2.772 -9.780 10.540 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -3.351 -12.681 11.173 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -1.808 -11.850 11.159 1.00 0.00 H new ATOM 652 N THR A 44 -6.296 -10.799 14.261 1.00 0.00 N ATOM 653 CA THR A 44 -7.330 -11.561 14.905 1.00 0.00 C ATOM 654 C THR A 44 -8.441 -11.936 13.913 1.00 0.00 C ATOM 655 O THR A 44 -8.450 -11.468 12.756 1.00 0.00 O ATOM 656 CB THR A 44 -7.902 -10.806 16.121 1.00 0.00 C ATOM 657 OG1 THR A 44 -8.357 -9.520 15.708 1.00 0.00 O ATOM 658 CG2 THR A 44 -6.842 -10.640 17.201 1.00 0.00 C ATOM 0 H THR A 44 -6.364 -9.789 14.385 1.00 0.00 H new ATOM 0 HA THR A 44 -6.883 -12.486 15.269 1.00 0.00 H new ATOM 0 HB THR A 44 -8.731 -11.384 16.530 1.00 0.00 H new ATOM 0 HG1 THR A 44 -7.691 -8.844 15.952 1.00 0.00 H new ATOM 0 HG21 THR A 44 -7.268 -10.105 18.050 1.00 0.00 H new ATOM 0 HG22 THR A 44 -6.498 -11.622 17.527 1.00 0.00 H new ATOM 0 HG23 THR A 44 -6.000 -10.075 16.801 1.00 0.00 H new ATOM 666 N GLU A 45 -9.368 -12.750 14.370 1.00 0.00 N ATOM 667 CA GLU A 45 -10.460 -13.265 13.564 1.00 0.00 C ATOM 668 C GLU A 45 -11.310 -12.110 12.998 1.00 0.00 C ATOM 669 O GLU A 45 -11.706 -12.121 11.826 1.00 0.00 O ATOM 670 CB GLU A 45 -11.317 -14.183 14.441 1.00 0.00 C ATOM 671 CG GLU A 45 -12.284 -15.067 13.688 1.00 0.00 C ATOM 672 CD GLU A 45 -11.581 -16.023 12.748 1.00 0.00 C ATOM 673 OE1 GLU A 45 -10.621 -16.705 13.178 1.00 0.00 O ATOM 674 OE2 GLU A 45 -12.005 -16.148 11.588 1.00 0.00 O ATOM 0 H GLU A 45 -9.386 -13.081 15.335 1.00 0.00 H new ATOM 0 HA GLU A 45 -10.061 -13.826 12.719 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -10.656 -14.816 15.033 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -11.881 -13.568 15.142 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -12.882 -15.636 14.400 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -12.974 -14.444 13.119 1.00 0.00 H new ATOM 681 N ALA A 46 -11.546 -11.106 13.823 1.00 0.00 N ATOM 682 CA ALA A 46 -12.337 -9.958 13.426 1.00 0.00 C ATOM 683 C ALA A 46 -11.574 -9.073 12.452 1.00 0.00 C ATOM 684 O ALA A 46 -12.164 -8.527 11.517 1.00 0.00 O ATOM 685 CB ALA A 46 -12.784 -9.162 14.638 1.00 0.00 C ATOM 0 H ALA A 46 -11.197 -11.064 14.781 1.00 0.00 H new ATOM 0 HA ALA A 46 -13.226 -10.329 12.916 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.376 -8.306 14.313 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -13.389 -9.796 15.287 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -11.909 -8.811 15.186 1.00 0.00 H new ATOM 691 N GLU A 47 -10.260 -8.968 12.655 1.00 0.00 N ATOM 692 CA GLU A 47 -9.389 -8.166 11.789 1.00 0.00 C ATOM 693 C GLU A 47 -9.428 -8.672 10.367 1.00 0.00 C ATOM 694 O GLU A 47 -9.598 -7.895 9.415 1.00 0.00 O ATOM 695 CB GLU A 47 -7.953 -8.208 12.292 1.00 0.00 C ATOM 696 CG GLU A 47 -7.720 -7.471 13.580 1.00 0.00 C ATOM 697 CD GLU A 47 -7.990 -6.007 13.450 1.00 0.00 C ATOM 698 OE1 GLU A 47 -7.093 -5.268 13.001 1.00 0.00 O ATOM 699 OE2 GLU A 47 -9.099 -5.572 13.804 1.00 0.00 O ATOM 0 H GLU A 47 -9.770 -9.433 13.419 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.755 -7.139 11.813 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.659 -9.249 12.426 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.301 -7.789 11.526 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.360 -7.889 14.357 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -6.689 -7.621 13.901 1.00 0.00 H new ATOM 706 N LEU A 48 -9.282 -9.973 10.232 1.00 0.00 N ATOM 707 CA LEU A 48 -9.305 -10.626 8.940 1.00 0.00 C ATOM 708 C LEU A 48 -10.661 -10.428 8.277 1.00 0.00 C ATOM 709 O LEU A 48 -10.747 -10.139 7.087 1.00 0.00 O ATOM 710 CB LEU A 48 -9.025 -12.120 9.113 1.00 0.00 C ATOM 711 CG LEU A 48 -7.673 -12.495 9.731 1.00 0.00 C ATOM 712 CD1 LEU A 48 -7.630 -13.976 10.030 1.00 0.00 C ATOM 713 CD2 LEU A 48 -6.518 -12.107 8.807 1.00 0.00 C ATOM 0 H LEU A 48 -9.144 -10.609 11.017 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.535 -10.186 8.306 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -9.814 -12.545 9.734 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.097 -12.596 8.135 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.560 -11.941 10.663 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.665 -14.231 10.469 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -8.425 -14.229 10.731 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -7.768 -14.538 9.106 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -5.572 -12.385 9.271 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -6.622 -12.628 7.855 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -6.536 -11.031 8.635 1.00 0.00 H new ATOM 725 N GLN A 49 -11.716 -10.535 9.072 1.00 0.00 N ATOM 726 CA GLN A 49 -13.068 -10.426 8.571 1.00 0.00 C ATOM 727 C GLN A 49 -13.375 -9.004 8.082 1.00 0.00 C ATOM 728 O GLN A 49 -14.073 -8.828 7.076 1.00 0.00 O ATOM 729 CB GLN A 49 -14.075 -10.863 9.636 1.00 0.00 C ATOM 730 CG GLN A 49 -15.492 -11.041 9.108 1.00 0.00 C ATOM 731 CD GLN A 49 -15.569 -12.131 8.054 1.00 0.00 C ATOM 732 OE1 GLN A 49 -15.786 -13.294 8.364 1.00 0.00 O ATOM 733 NE2 GLN A 49 -15.399 -11.771 6.816 1.00 0.00 N ATOM 0 H GLN A 49 -11.654 -10.699 10.077 1.00 0.00 H new ATOM 0 HA GLN A 49 -13.159 -11.094 7.715 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -13.740 -11.803 10.075 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -14.086 -10.124 10.437 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -16.159 -11.287 9.934 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -15.843 -10.100 8.684 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -15.220 -10.793 6.589 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -15.445 -12.467 6.072 1.00 0.00 H new ATOM 742 N ASP A 50 -12.837 -7.995 8.774 1.00 0.00 N ATOM 743 CA ASP A 50 -13.043 -6.589 8.369 1.00 0.00 C ATOM 744 C ASP A 50 -12.346 -6.323 7.067 1.00 0.00 C ATOM 745 O ASP A 50 -12.901 -5.686 6.167 1.00 0.00 O ATOM 746 CB ASP A 50 -12.537 -5.596 9.423 1.00 0.00 C ATOM 747 CG ASP A 50 -12.652 -4.145 8.948 1.00 0.00 C ATOM 748 OD1 ASP A 50 -13.768 -3.598 8.935 1.00 0.00 O ATOM 749 OD2 ASP A 50 -11.618 -3.522 8.579 1.00 0.00 O ATOM 0 H ASP A 50 -12.262 -8.116 9.608 1.00 0.00 H new ATOM 0 HA ASP A 50 -14.118 -6.443 8.261 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.108 -5.722 10.343 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.497 -5.818 9.660 1.00 0.00 H new ATOM 754 N MET A 51 -11.141 -6.856 6.960 1.00 0.00 N ATOM 755 CA MET A 51 -10.331 -6.726 5.764 1.00 0.00 C ATOM 756 C MET A 51 -11.064 -7.338 4.581 1.00 0.00 C ATOM 757 O MET A 51 -11.003 -6.842 3.464 1.00 0.00 O ATOM 758 CB MET A 51 -8.998 -7.423 5.965 1.00 0.00 C ATOM 759 CG MET A 51 -8.031 -7.214 4.825 1.00 0.00 C ATOM 760 SD MET A 51 -7.659 -5.471 4.555 1.00 0.00 S ATOM 761 CE MET A 51 -6.954 -5.018 6.147 1.00 0.00 C ATOM 0 H MET A 51 -10.696 -7.393 7.704 1.00 0.00 H new ATOM 0 HA MET A 51 -10.151 -5.670 5.565 1.00 0.00 H new ATOM 0 HB2 MET A 51 -8.543 -7.061 6.887 1.00 0.00 H new ATOM 0 HB3 MET A 51 -9.171 -8.492 6.093 1.00 0.00 H new ATOM 0 HG2 MET A 51 -7.106 -7.753 5.032 1.00 0.00 H new ATOM 0 HG3 MET A 51 -8.450 -7.639 3.913 1.00 0.00 H new ATOM 0 HE1 MET A 51 -6.392 -4.090 6.045 1.00 0.00 H new ATOM 0 HE2 MET A 51 -7.755 -4.879 6.873 1.00 0.00 H new ATOM 0 HE3 MET A 51 -6.288 -5.810 6.488 1.00 0.00 H new ATOM 771 N ILE A 52 -11.759 -8.419 4.847 1.00 0.00 N ATOM 772 CA ILE A 52 -12.585 -9.050 3.856 1.00 0.00 C ATOM 773 C ILE A 52 -13.739 -8.140 3.471 1.00 0.00 C ATOM 774 O ILE A 52 -13.959 -7.876 2.298 1.00 0.00 O ATOM 775 CB ILE A 52 -13.157 -10.400 4.349 1.00 0.00 C ATOM 776 CG1 ILE A 52 -12.036 -11.438 4.524 1.00 0.00 C ATOM 777 CG2 ILE A 52 -14.253 -10.897 3.414 1.00 0.00 C ATOM 778 CD1 ILE A 52 -12.511 -12.811 4.942 1.00 0.00 C ATOM 0 H ILE A 52 -11.765 -8.882 5.756 1.00 0.00 H new ATOM 0 HA ILE A 52 -11.950 -9.240 2.991 1.00 0.00 H new ATOM 0 HB ILE A 52 -13.611 -10.246 5.328 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -11.491 -11.527 3.584 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -11.330 -11.070 5.268 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -14.640 -11.848 3.780 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -15.060 -10.166 3.379 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -13.843 -11.034 2.413 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.654 -13.478 5.041 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -13.029 -12.741 5.898 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -13.192 -13.205 4.188 1.00 0.00 H new ATOM 790 N ASN A 53 -14.439 -7.635 4.470 1.00 0.00 N ATOM 791 CA ASN A 53 -15.642 -6.831 4.255 1.00 0.00 C ATOM 792 C ASN A 53 -15.356 -5.551 3.453 1.00 0.00 C ATOM 793 O ASN A 53 -16.254 -4.994 2.809 1.00 0.00 O ATOM 794 CB ASN A 53 -16.355 -6.525 5.587 1.00 0.00 C ATOM 795 CG ASN A 53 -17.654 -5.743 5.410 1.00 0.00 C ATOM 796 OD1 ASN A 53 -18.720 -6.323 5.205 1.00 0.00 O ATOM 797 ND2 ASN A 53 -17.585 -4.449 5.523 1.00 0.00 N ATOM 0 H ASN A 53 -14.196 -7.766 5.452 1.00 0.00 H new ATOM 0 HA ASN A 53 -16.320 -7.429 3.647 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -16.570 -7.462 6.100 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.682 -5.957 6.230 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -18.430 -3.884 5.442 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -16.685 -3.999 5.693 1.00 0.00 H new ATOM 804 N GLU A 54 -14.098 -5.106 3.492 1.00 0.00 N ATOM 805 CA GLU A 54 -13.621 -3.975 2.740 1.00 0.00 C ATOM 806 C GLU A 54 -13.938 -4.187 1.250 1.00 0.00 C ATOM 807 O GLU A 54 -14.443 -3.292 0.581 1.00 0.00 O ATOM 808 CB GLU A 54 -12.106 -3.886 2.934 1.00 0.00 C ATOM 809 CG GLU A 54 -11.538 -2.484 2.950 1.00 0.00 C ATOM 810 CD GLU A 54 -11.788 -1.683 1.690 1.00 0.00 C ATOM 811 OE1 GLU A 54 -11.077 -1.876 0.689 1.00 0.00 O ATOM 812 OE2 GLU A 54 -12.688 -0.811 1.698 1.00 0.00 O ATOM 0 H GLU A 54 -13.376 -5.542 4.066 1.00 0.00 H new ATOM 0 HA GLU A 54 -14.101 -3.057 3.079 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.847 -4.376 3.873 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.620 -4.448 2.136 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.963 -1.945 3.797 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.463 -2.545 3.118 1.00 0.00 H new ATOM 819 N VAL A 55 -13.687 -5.384 0.762 1.00 0.00 N ATOM 820 CA VAL A 55 -13.899 -5.696 -0.648 1.00 0.00 C ATOM 821 C VAL A 55 -15.132 -6.550 -0.872 1.00 0.00 C ATOM 822 O VAL A 55 -15.610 -6.675 -2.003 1.00 0.00 O ATOM 823 CB VAL A 55 -12.677 -6.409 -1.271 1.00 0.00 C ATOM 824 CG1 VAL A 55 -11.487 -5.524 -1.237 1.00 0.00 C ATOM 825 CG2 VAL A 55 -12.360 -7.715 -0.567 1.00 0.00 C ATOM 0 H VAL A 55 -13.335 -6.163 1.318 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.044 -4.735 -1.141 1.00 0.00 H new ATOM 0 HB VAL A 55 -12.933 -6.638 -2.305 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -10.636 -6.042 -1.679 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.693 -4.615 -1.803 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -11.256 -5.264 -0.204 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -11.495 -8.181 -1.038 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -12.140 -7.519 0.482 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -13.217 -8.385 -0.639 1.00 0.00 H new ATOM 835 N ASP A 56 -15.632 -7.138 0.190 1.00 0.00 N ATOM 836 CA ASP A 56 -16.756 -8.041 0.103 1.00 0.00 C ATOM 837 C ASP A 56 -18.036 -7.305 -0.181 1.00 0.00 C ATOM 838 O ASP A 56 -18.613 -6.670 0.702 1.00 0.00 O ATOM 839 CB ASP A 56 -16.918 -8.856 1.369 1.00 0.00 C ATOM 840 CG ASP A 56 -18.001 -9.876 1.228 1.00 0.00 C ATOM 841 OD1 ASP A 56 -18.686 -10.150 2.204 1.00 0.00 O ATOM 842 OD2 ASP A 56 -18.204 -10.398 0.118 1.00 0.00 O ATOM 0 H ASP A 56 -15.273 -7.005 1.135 1.00 0.00 H new ATOM 0 HA ASP A 56 -16.545 -8.717 -0.726 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -15.977 -9.353 1.606 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -17.147 -8.193 2.203 1.00 0.00 H new ATOM 847 N ALA A 57 -18.471 -7.390 -1.399 1.00 0.00 N ATOM 848 CA ALA A 57 -19.672 -6.726 -1.821 1.00 0.00 C ATOM 849 C ALA A 57 -20.899 -7.588 -1.567 1.00 0.00 C ATOM 850 O ALA A 57 -22.012 -7.068 -1.435 1.00 0.00 O ATOM 851 CB ALA A 57 -19.581 -6.345 -3.290 1.00 0.00 C ATOM 0 H ALA A 57 -18.005 -7.922 -2.133 1.00 0.00 H new ATOM 0 HA ALA A 57 -19.777 -5.816 -1.230 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -20.500 -5.843 -3.593 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.735 -5.675 -3.440 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.444 -7.244 -3.891 1.00 0.00 H new ATOM 857 N ASP A 58 -20.703 -8.901 -1.443 1.00 0.00 N ATOM 858 CA ASP A 58 -21.855 -9.827 -1.321 1.00 0.00 C ATOM 859 C ASP A 58 -22.330 -9.883 0.105 1.00 0.00 C ATOM 860 O ASP A 58 -23.423 -10.394 0.386 1.00 0.00 O ATOM 861 CB ASP A 58 -21.465 -11.280 -1.668 1.00 0.00 C ATOM 862 CG ASP A 58 -20.642 -11.455 -2.903 1.00 0.00 C ATOM 863 OD1 ASP A 58 -19.414 -11.521 -2.780 1.00 0.00 O ATOM 864 OD2 ASP A 58 -21.182 -11.561 -4.009 1.00 0.00 O ATOM 0 H ASP A 58 -19.787 -9.349 -1.423 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.616 -9.450 -2.004 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -20.916 -11.700 -0.825 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -22.378 -11.865 -1.777 1.00 0.00 H new ATOM 869 N GLY A 59 -21.534 -9.337 1.008 1.00 0.00 N ATOM 870 CA GLY A 59 -21.823 -9.445 2.420 1.00 0.00 C ATOM 871 C GLY A 59 -21.793 -10.902 2.859 1.00 0.00 C ATOM 872 O GLY A 59 -22.491 -11.302 3.791 1.00 0.00 O ATOM 0 H GLY A 59 -20.686 -8.816 0.785 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -21.093 -8.871 2.992 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -22.802 -9.015 2.631 1.00 0.00 H new ATOM 876 N ASN A 60 -20.975 -11.700 2.183 1.00 0.00 N ATOM 877 CA ASN A 60 -20.931 -13.129 2.439 1.00 0.00 C ATOM 878 C ASN A 60 -19.750 -13.483 3.318 1.00 0.00 C ATOM 879 O ASN A 60 -19.622 -14.617 3.792 1.00 0.00 O ATOM 880 CB ASN A 60 -20.973 -13.984 1.135 1.00 0.00 C ATOM 881 CG ASN A 60 -19.711 -13.989 0.265 1.00 0.00 C ATOM 882 OD1 ASN A 60 -18.923 -13.033 0.220 1.00 0.00 O ATOM 883 ND2 ASN A 60 -19.537 -15.052 -0.474 1.00 0.00 N ATOM 0 H ASN A 60 -20.336 -11.380 1.456 1.00 0.00 H new ATOM 0 HA ASN A 60 -21.841 -13.383 2.983 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -21.197 -15.014 1.412 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -21.804 -13.630 0.525 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -18.739 -15.109 -1.106 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -20.200 -15.826 -0.419 1.00 0.00 H new ATOM 890 N GLY A 61 -18.891 -12.517 3.538 1.00 0.00 N ATOM 891 CA GLY A 61 -17.803 -12.689 4.453 1.00 0.00 C ATOM 892 C GLY A 61 -16.573 -13.301 3.835 1.00 0.00 C ATOM 893 O GLY A 61 -15.666 -13.707 4.559 1.00 0.00 O ATOM 0 H GLY A 61 -18.930 -11.601 3.090 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -17.540 -11.719 4.876 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.133 -13.318 5.280 1.00 0.00 H new ATOM 897 N THR A 62 -16.513 -13.372 2.519 1.00 0.00 N ATOM 898 CA THR A 62 -15.343 -13.928 1.855 1.00 0.00 C ATOM 899 C THR A 62 -14.872 -13.021 0.717 1.00 0.00 C ATOM 900 O THR A 62 -15.695 -12.303 0.099 1.00 0.00 O ATOM 901 CB THR A 62 -15.626 -15.333 1.298 1.00 0.00 C ATOM 902 OG1 THR A 62 -16.752 -15.288 0.420 1.00 0.00 O ATOM 903 CG2 THR A 62 -15.898 -16.321 2.411 1.00 0.00 C ATOM 0 H THR A 62 -17.252 -13.056 1.891 1.00 0.00 H new ATOM 0 HA THR A 62 -14.557 -13.999 2.607 1.00 0.00 H new ATOM 0 HB THR A 62 -14.742 -15.663 0.753 1.00 0.00 H new ATOM 0 HG1 THR A 62 -16.927 -16.185 0.067 1.00 0.00 H new ATOM 0 HG21 THR A 62 -16.094 -17.305 1.984 1.00 0.00 H new ATOM 0 HG22 THR A 62 -15.030 -16.377 3.068 1.00 0.00 H new ATOM 0 HG23 THR A 62 -16.766 -15.994 2.984 1.00 0.00 H new ATOM 911 N ILE A 63 -13.575 -13.049 0.436 1.00 0.00 N ATOM 912 CA ILE A 63 -12.994 -12.248 -0.635 1.00 0.00 C ATOM 913 C ILE A 63 -12.981 -13.061 -1.903 1.00 0.00 C ATOM 914 O ILE A 63 -12.281 -14.059 -1.998 1.00 0.00 O ATOM 915 CB ILE A 63 -11.519 -11.816 -0.330 1.00 0.00 C ATOM 916 CG1 ILE A 63 -11.449 -10.994 0.932 1.00 0.00 C ATOM 917 CG2 ILE A 63 -10.952 -10.990 -1.489 1.00 0.00 C ATOM 918 CD1 ILE A 63 -10.042 -10.712 1.418 1.00 0.00 C ATOM 0 H ILE A 63 -12.900 -13.624 0.940 1.00 0.00 H new ATOM 0 HA ILE A 63 -13.603 -11.349 -0.732 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.930 -12.724 -0.202 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -11.959 -10.046 0.762 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -11.995 -11.513 1.720 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -9.927 -10.698 -1.261 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -10.965 -11.586 -2.401 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -11.560 -10.097 -1.631 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -10.085 -10.116 2.330 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -9.533 -11.653 1.624 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -9.495 -10.163 0.651 1.00 0.00 H new ATOM 930 N ASP A 64 -13.763 -12.657 -2.841 1.00 0.00 N ATOM 931 CA ASP A 64 -13.778 -13.284 -4.130 1.00 0.00 C ATOM 932 C ASP A 64 -12.613 -12.740 -4.907 1.00 0.00 C ATOM 933 O ASP A 64 -12.172 -11.614 -4.639 1.00 0.00 O ATOM 934 CB ASP A 64 -15.084 -12.979 -4.882 1.00 0.00 C ATOM 935 CG ASP A 64 -16.309 -13.677 -4.333 1.00 0.00 C ATOM 936 OD1 ASP A 64 -16.879 -13.219 -3.316 1.00 0.00 O ATOM 937 OD2 ASP A 64 -16.761 -14.663 -4.945 1.00 0.00 O ATOM 0 H ASP A 64 -14.416 -11.880 -2.743 1.00 0.00 H new ATOM 0 HA ASP A 64 -13.709 -14.366 -4.014 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -15.256 -11.903 -4.861 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -14.960 -13.262 -5.927 1.00 0.00 H new ATOM 942 N PHE A 65 -12.108 -13.512 -5.846 1.00 0.00 N ATOM 943 CA PHE A 65 -10.978 -13.080 -6.669 1.00 0.00 C ATOM 944 C PHE A 65 -11.239 -11.701 -7.335 1.00 0.00 C ATOM 945 O PHE A 65 -10.395 -10.815 -7.232 1.00 0.00 O ATOM 946 CB PHE A 65 -10.571 -14.155 -7.695 1.00 0.00 C ATOM 947 CG PHE A 65 -9.283 -13.843 -8.419 1.00 0.00 C ATOM 948 CD1 PHE A 65 -9.237 -13.755 -9.788 1.00 0.00 C ATOM 949 CD2 PHE A 65 -8.127 -13.621 -7.718 1.00 0.00 C ATOM 950 CE1 PHE A 65 -8.063 -13.454 -10.441 1.00 0.00 C ATOM 951 CE2 PHE A 65 -6.954 -13.323 -8.358 1.00 0.00 C ATOM 952 CZ PHE A 65 -6.923 -13.238 -9.724 1.00 0.00 C ATOM 0 H PHE A 65 -12.457 -14.445 -6.065 1.00 0.00 H new ATOM 0 HA PHE A 65 -10.128 -12.948 -6.000 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -10.468 -15.112 -7.184 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -11.371 -14.268 -8.427 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -10.136 -13.925 -10.362 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -8.141 -13.682 -6.640 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.045 -13.389 -11.519 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -6.054 -13.155 -7.786 1.00 0.00 H new ATOM 0 HZ PHE A 65 -6.000 -13.001 -10.232 1.00 0.00 H new ATOM 962 N PRO A 66 -12.414 -11.491 -8.022 1.00 0.00 N ATOM 963 CA PRO A 66 -12.796 -10.173 -8.560 1.00 0.00 C ATOM 964 C PRO A 66 -12.675 -9.037 -7.513 1.00 0.00 C ATOM 965 O PRO A 66 -12.074 -8.008 -7.791 1.00 0.00 O ATOM 966 CB PRO A 66 -14.274 -10.359 -8.976 1.00 0.00 C ATOM 967 CG PRO A 66 -14.667 -11.712 -8.466 1.00 0.00 C ATOM 968 CD PRO A 66 -13.402 -12.506 -8.414 1.00 0.00 C ATOM 0 HA PRO A 66 -12.140 -9.875 -9.378 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -14.904 -9.580 -8.546 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -14.387 -10.300 -10.058 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -15.126 -11.641 -7.480 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -15.398 -12.182 -9.124 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -13.461 -13.318 -7.689 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -13.163 -12.955 -9.378 1.00 0.00 H new ATOM 976 N GLU A 67 -13.207 -9.264 -6.307 1.00 0.00 N ATOM 977 CA GLU A 67 -13.197 -8.261 -5.222 1.00 0.00 C ATOM 978 C GLU A 67 -11.758 -7.929 -4.814 1.00 0.00 C ATOM 979 O GLU A 67 -11.394 -6.761 -4.587 1.00 0.00 O ATOM 980 CB GLU A 67 -13.960 -8.796 -4.019 1.00 0.00 C ATOM 981 CG GLU A 67 -15.406 -9.162 -4.306 1.00 0.00 C ATOM 982 CD GLU A 67 -16.090 -9.796 -3.114 1.00 0.00 C ATOM 983 OE1 GLU A 67 -15.513 -10.687 -2.475 1.00 0.00 O ATOM 984 OE2 GLU A 67 -17.262 -9.492 -2.818 1.00 0.00 O ATOM 0 H GLU A 67 -13.656 -10.143 -6.050 1.00 0.00 H new ATOM 0 HA GLU A 67 -13.679 -7.352 -5.582 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -13.443 -9.677 -3.639 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -13.938 -8.047 -3.227 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -15.953 -8.266 -4.601 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -15.443 -9.850 -5.151 1.00 0.00 H new ATOM 991 N PHE A 68 -10.952 -8.966 -4.744 1.00 0.00 N ATOM 992 CA PHE A 68 -9.544 -8.861 -4.447 1.00 0.00 C ATOM 993 C PHE A 68 -8.831 -8.025 -5.522 1.00 0.00 C ATOM 994 O PHE A 68 -8.031 -7.125 -5.205 1.00 0.00 O ATOM 995 CB PHE A 68 -8.959 -10.285 -4.306 1.00 0.00 C ATOM 996 CG PHE A 68 -7.467 -10.407 -4.349 1.00 0.00 C ATOM 997 CD1 PHE A 68 -6.645 -9.543 -3.662 1.00 0.00 C ATOM 998 CD2 PHE A 68 -6.903 -11.405 -5.091 1.00 0.00 C ATOM 999 CE1 PHE A 68 -5.283 -9.668 -3.732 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -5.541 -11.546 -5.168 1.00 0.00 C ATOM 1001 CZ PHE A 68 -4.731 -10.669 -4.490 1.00 0.00 C ATOM 0 H PHE A 68 -11.266 -9.925 -4.895 1.00 0.00 H new ATOM 0 HA PHE A 68 -9.389 -8.339 -3.503 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -9.307 -10.704 -3.362 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -9.374 -10.904 -5.102 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.079 -8.758 -3.061 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.540 -12.094 -5.626 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -4.647 -8.982 -3.193 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.109 -12.341 -5.758 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.657 -10.767 -4.554 1.00 0.00 H new ATOM 1011 N LEU A 69 -9.158 -8.284 -6.773 1.00 0.00 N ATOM 1012 CA LEU A 69 -8.587 -7.537 -7.881 1.00 0.00 C ATOM 1013 C LEU A 69 -8.975 -6.070 -7.804 1.00 0.00 C ATOM 1014 O LEU A 69 -8.176 -5.202 -8.140 1.00 0.00 O ATOM 1015 CB LEU A 69 -9.007 -8.122 -9.227 1.00 0.00 C ATOM 1016 CG LEU A 69 -8.535 -9.542 -9.523 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -9.051 -9.991 -10.873 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -7.016 -9.624 -9.485 1.00 0.00 C ATOM 0 H LEU A 69 -9.819 -9.009 -7.050 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.503 -7.617 -7.800 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -10.095 -8.104 -9.283 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.637 -7.467 -10.015 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.932 -10.205 -8.754 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.708 -11.006 -11.074 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.141 -9.970 -10.871 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.676 -9.321 -11.647 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.701 -10.645 -9.699 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.596 -8.951 -10.233 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.661 -9.334 -8.496 1.00 0.00 H new ATOM 1030 N THR A 70 -10.186 -5.802 -7.336 1.00 0.00 N ATOM 1031 CA THR A 70 -10.679 -4.452 -7.177 1.00 0.00 C ATOM 1032 C THR A 70 -9.774 -3.636 -6.234 1.00 0.00 C ATOM 1033 O THR A 70 -9.269 -2.581 -6.625 1.00 0.00 O ATOM 1034 CB THR A 70 -12.118 -4.456 -6.631 1.00 0.00 C ATOM 1035 OG1 THR A 70 -12.916 -5.325 -7.434 1.00 0.00 O ATOM 1036 CG2 THR A 70 -12.716 -3.058 -6.677 1.00 0.00 C ATOM 0 H THR A 70 -10.853 -6.522 -7.056 1.00 0.00 H new ATOM 0 HA THR A 70 -10.671 -3.985 -8.162 1.00 0.00 H new ATOM 0 HB THR A 70 -12.099 -4.797 -5.596 1.00 0.00 H new ATOM 0 HG1 THR A 70 -12.594 -6.246 -7.339 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.733 -3.084 -6.286 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.112 -2.384 -6.070 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.732 -2.703 -7.707 1.00 0.00 H new ATOM 1044 N MET A 71 -9.518 -4.152 -5.023 1.00 0.00 N ATOM 1045 CA MET A 71 -8.700 -3.403 -4.051 1.00 0.00 C ATOM 1046 C MET A 71 -7.281 -3.229 -4.528 1.00 0.00 C ATOM 1047 O MET A 71 -6.651 -2.215 -4.261 1.00 0.00 O ATOM 1048 CB MET A 71 -8.703 -4.005 -2.621 1.00 0.00 C ATOM 1049 CG MET A 71 -8.173 -5.441 -2.471 1.00 0.00 C ATOM 1050 SD MET A 71 -8.115 -5.971 -0.729 1.00 0.00 S ATOM 1051 CE MET A 71 -7.738 -7.717 -0.870 1.00 0.00 C ATOM 0 H MET A 71 -9.853 -5.058 -4.697 1.00 0.00 H new ATOM 0 HA MET A 71 -9.181 -2.427 -3.984 1.00 0.00 H new ATOM 0 HB2 MET A 71 -8.110 -3.355 -1.978 1.00 0.00 H new ATOM 0 HB3 MET A 71 -9.725 -3.979 -2.244 1.00 0.00 H new ATOM 0 HG2 MET A 71 -8.809 -6.123 -3.036 1.00 0.00 H new ATOM 0 HG3 MET A 71 -7.174 -5.505 -2.903 1.00 0.00 H new ATOM 0 HE1 MET A 71 -7.746 -8.172 0.120 1.00 0.00 H new ATOM 0 HE2 MET A 71 -8.486 -8.201 -1.498 1.00 0.00 H new ATOM 0 HE3 MET A 71 -6.752 -7.841 -1.319 1.00 0.00 H new ATOM 1061 N MET A 72 -6.794 -4.187 -5.275 1.00 0.00 N ATOM 1062 CA MET A 72 -5.429 -4.129 -5.700 1.00 0.00 C ATOM 1063 C MET A 72 -5.267 -3.191 -6.864 1.00 0.00 C ATOM 1064 O MET A 72 -4.318 -2.437 -6.919 1.00 0.00 O ATOM 1065 CB MET A 72 -4.912 -5.494 -6.048 1.00 0.00 C ATOM 1066 CG MET A 72 -3.422 -5.625 -5.784 1.00 0.00 C ATOM 1067 SD MET A 72 -2.968 -5.146 -4.088 1.00 0.00 S ATOM 1068 CE MET A 72 -4.026 -6.229 -3.120 1.00 0.00 C ATOM 0 H MET A 72 -7.317 -5.002 -5.595 1.00 0.00 H new ATOM 0 HA MET A 72 -4.840 -3.746 -4.867 1.00 0.00 H new ATOM 0 HB2 MET A 72 -5.450 -6.244 -5.468 1.00 0.00 H new ATOM 0 HB3 MET A 72 -5.113 -5.700 -7.099 1.00 0.00 H new ATOM 0 HG2 MET A 72 -3.114 -6.656 -5.961 1.00 0.00 H new ATOM 0 HG3 MET A 72 -2.875 -5.003 -6.492 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.473 -6.602 -2.258 1.00 0.00 H new ATOM 0 HE2 MET A 72 -4.900 -5.674 -2.779 1.00 0.00 H new ATOM 0 HE3 MET A 72 -4.348 -7.069 -3.736 1.00 0.00 H new ATOM 1078 N ALA A 73 -6.220 -3.199 -7.765 1.00 0.00 N ATOM 1079 CA ALA A 73 -6.162 -2.337 -8.923 1.00 0.00 C ATOM 1080 C ALA A 73 -6.382 -0.878 -8.529 1.00 0.00 C ATOM 1081 O ALA A 73 -5.934 0.023 -9.211 1.00 0.00 O ATOM 1082 CB ALA A 73 -7.140 -2.804 -9.980 1.00 0.00 C ATOM 0 H ALA A 73 -7.047 -3.794 -7.719 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.164 -2.397 -9.357 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -7.083 -2.144 -10.845 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.890 -3.821 -10.283 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.151 -2.784 -9.574 1.00 0.00 H new ATOM 1088 N ARG A 74 -7.059 -0.664 -7.399 1.00 0.00 N ATOM 1089 CA ARG A 74 -7.242 0.674 -6.849 1.00 0.00 C ATOM 1090 C ARG A 74 -5.932 1.189 -6.265 1.00 0.00 C ATOM 1091 O ARG A 74 -5.696 2.386 -6.196 1.00 0.00 O ATOM 1092 CB ARG A 74 -8.327 0.678 -5.780 1.00 0.00 C ATOM 1093 CG ARG A 74 -9.734 0.499 -6.314 1.00 0.00 C ATOM 1094 CD ARG A 74 -10.763 0.566 -5.197 1.00 0.00 C ATOM 1095 NE ARG A 74 -10.728 1.863 -4.495 1.00 0.00 N ATOM 1096 CZ ARG A 74 -11.430 2.159 -3.394 1.00 0.00 C ATOM 1097 NH1 ARG A 74 -12.309 1.288 -2.912 1.00 0.00 N ATOM 1098 NH2 ARG A 74 -11.281 3.349 -2.804 1.00 0.00 N ATOM 0 H ARG A 74 -7.490 -1.406 -6.847 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.554 1.334 -7.659 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -8.119 -0.118 -5.066 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.277 1.619 -5.232 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -9.946 1.272 -7.053 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -9.812 -0.460 -6.825 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.759 0.403 -5.610 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.578 -0.238 -4.484 1.00 0.00 H new ATOM 0 HE ARG A 74 -10.123 2.590 -4.878 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -12.450 0.393 -3.381 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -12.844 1.514 -2.073 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -10.632 4.033 -3.192 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -11.817 3.573 -1.965 1.00 0.00 H new ATOM 1112 N LYS A 75 -5.102 0.269 -5.841 1.00 0.00 N ATOM 1113 CA LYS A 75 -3.788 0.578 -5.325 1.00 0.00 C ATOM 1114 C LYS A 75 -2.872 0.839 -6.501 1.00 0.00 C ATOM 1115 O LYS A 75 -2.156 1.850 -6.569 1.00 0.00 O ATOM 1116 CB LYS A 75 -3.271 -0.631 -4.554 1.00 0.00 C ATOM 1117 CG LYS A 75 -1.877 -0.493 -3.983 1.00 0.00 C ATOM 1118 CD LYS A 75 -1.399 -1.782 -3.469 1.00 0.00 C ATOM 1119 CE LYS A 75 -0.111 -1.648 -2.700 1.00 0.00 C ATOM 1120 NZ LYS A 75 -0.273 -0.777 -1.517 1.00 0.00 N ATOM 0 H LYS A 75 -5.320 -0.727 -5.844 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.825 1.448 -4.670 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.961 -0.840 -3.736 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.289 -1.497 -5.216 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.197 -0.128 -4.753 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.878 0.246 -3.182 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.161 -2.219 -2.824 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.253 -2.471 -4.301 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.229 -2.634 -2.383 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.662 -1.239 -3.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.361 -1.100 -0.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.036 0.203 -1.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.258 -0.820 -1.186 1.00 0.00 H new ATOM 1134 N MET A 76 -2.948 -0.061 -7.442 1.00 0.00 N ATOM 1135 CA MET A 76 -2.138 -0.065 -8.628 1.00 0.00 C ATOM 1136 C MET A 76 -2.723 0.851 -9.687 1.00 0.00 C ATOM 1137 O MET A 76 -3.139 0.415 -10.762 1.00 0.00 O ATOM 1138 CB MET A 76 -2.023 -1.494 -9.145 1.00 0.00 C ATOM 1139 CG MET A 76 -1.309 -2.433 -8.182 1.00 0.00 C ATOM 1140 SD MET A 76 -1.543 -4.171 -8.594 1.00 0.00 S ATOM 1141 CE MET A 76 -1.023 -4.178 -10.296 1.00 0.00 C ATOM 0 H MET A 76 -3.602 -0.843 -7.402 1.00 0.00 H new ATOM 0 HA MET A 76 -1.144 0.312 -8.388 1.00 0.00 H new ATOM 0 HB2 MET A 76 -3.022 -1.881 -9.344 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.489 -1.486 -10.095 1.00 0.00 H new ATOM 0 HG2 MET A 76 -0.243 -2.205 -8.183 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.672 -2.253 -7.170 1.00 0.00 H new ATOM 0 HE1 MET A 76 -1.041 -5.199 -10.678 1.00 0.00 H new ATOM 0 HE2 MET A 76 -1.699 -3.558 -10.885 1.00 0.00 H new ATOM 0 HE3 MET A 76 -0.010 -3.781 -10.369 1.00 0.00 H new ATOM 1151 N LYS A 77 -2.780 2.105 -9.360 1.00 0.00 N ATOM 1152 CA LYS A 77 -3.235 3.113 -10.235 1.00 0.00 C ATOM 1153 C LYS A 77 -2.133 4.137 -10.294 1.00 0.00 C ATOM 1154 O LYS A 77 -1.023 3.890 -9.786 1.00 0.00 O ATOM 1155 CB LYS A 77 -4.530 3.754 -9.692 1.00 0.00 C ATOM 1156 CG LYS A 77 -4.336 4.529 -8.402 1.00 0.00 C ATOM 1157 CD LYS A 77 -5.642 5.119 -7.887 1.00 0.00 C ATOM 1158 CE LYS A 77 -5.402 6.070 -6.720 1.00 0.00 C ATOM 1159 NZ LYS A 77 -4.598 7.260 -7.118 1.00 0.00 N ATOM 0 H LYS A 77 -2.499 2.455 -8.444 1.00 0.00 H new ATOM 0 HA LYS A 77 -3.463 2.710 -11.222 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.938 4.424 -10.449 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -5.270 2.971 -9.527 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.912 3.870 -7.644 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.616 5.331 -8.566 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -6.146 5.651 -8.694 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -6.307 4.315 -7.572 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -6.361 6.399 -6.319 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.888 5.538 -5.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -5.099 8.127 -6.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.672 7.227 -6.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.462 7.258 -8.149 1.00 0.00 H new ATOM 1173 N ASP A 78 -2.400 5.251 -10.872 1.00 0.00 N ATOM 1174 CA ASP A 78 -1.435 6.316 -10.885 1.00 0.00 C ATOM 1175 C ASP A 78 -1.521 7.042 -9.584 1.00 0.00 C ATOM 1176 O ASP A 78 -2.427 7.840 -9.363 1.00 0.00 O ATOM 1177 CB ASP A 78 -1.639 7.298 -12.042 1.00 0.00 C ATOM 1178 CG ASP A 78 -1.441 6.672 -13.390 1.00 0.00 C ATOM 1179 OD1 ASP A 78 -0.286 6.413 -13.777 1.00 0.00 O ATOM 1180 OD2 ASP A 78 -2.444 6.434 -14.104 1.00 0.00 O ATOM 0 H ASP A 78 -3.278 5.460 -11.347 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.449 5.874 -11.028 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -2.646 7.712 -11.985 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -0.945 8.131 -11.930 1.00 0.00 H new ATOM 1185 N THR A 79 -0.662 6.699 -8.683 1.00 0.00 N ATOM 1186 CA THR A 79 -0.621 7.377 -7.437 1.00 0.00 C ATOM 1187 C THR A 79 0.300 8.568 -7.594 1.00 0.00 C ATOM 1188 O THR A 79 1.500 8.484 -7.374 1.00 0.00 O ATOM 1189 CB THR A 79 -0.152 6.453 -6.303 1.00 0.00 C ATOM 1190 OG1 THR A 79 -0.893 5.220 -6.383 1.00 0.00 O ATOM 1191 CG2 THR A 79 -0.425 7.098 -4.946 1.00 0.00 C ATOM 0 H THR A 79 0.022 5.950 -8.790 1.00 0.00 H new ATOM 0 HA THR A 79 -1.622 7.708 -7.161 1.00 0.00 H new ATOM 0 HB THR A 79 0.918 6.273 -6.405 1.00 0.00 H new ATOM 0 HG1 THR A 79 -0.604 4.618 -5.666 1.00 0.00 H new ATOM 0 HG21 THR A 79 -0.087 6.432 -4.152 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.112 8.044 -4.878 1.00 0.00 H new ATOM 0 HG23 THR A 79 -1.494 7.279 -4.838 1.00 0.00 H new ATOM 1199 N ASP A 80 -0.271 9.639 -8.060 1.00 0.00 N ATOM 1200 CA ASP A 80 0.461 10.847 -8.374 1.00 0.00 C ATOM 1201 C ASP A 80 0.508 11.766 -7.176 1.00 0.00 C ATOM 1202 O ASP A 80 1.025 12.873 -7.244 1.00 0.00 O ATOM 1203 CB ASP A 80 -0.187 11.560 -9.570 1.00 0.00 C ATOM 1204 CG ASP A 80 -1.576 12.089 -9.274 1.00 0.00 C ATOM 1205 OD1 ASP A 80 -1.784 13.316 -9.357 1.00 0.00 O ATOM 1206 OD2 ASP A 80 -2.485 11.293 -8.959 1.00 0.00 O ATOM 0 H ASP A 80 -1.273 9.707 -8.238 1.00 0.00 H new ATOM 0 HA ASP A 80 1.483 10.576 -8.638 1.00 0.00 H new ATOM 0 HB2 ASP A 80 0.451 12.388 -9.879 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -0.241 10.868 -10.410 1.00 0.00 H new ATOM 1211 N SER A 81 -0.036 11.313 -6.092 1.00 0.00 N ATOM 1212 CA SER A 81 -0.008 12.033 -4.889 1.00 0.00 C ATOM 1213 C SER A 81 1.066 11.405 -4.003 1.00 0.00 C ATOM 1214 O SER A 81 1.759 10.466 -4.424 1.00 0.00 O ATOM 1215 CB SER A 81 -1.383 11.925 -4.248 1.00 0.00 C ATOM 1216 OG SER A 81 -1.736 10.554 -4.079 1.00 0.00 O ATOM 0 H SER A 81 -0.517 10.416 -6.032 1.00 0.00 H new ATOM 0 HA SER A 81 0.226 13.087 -5.041 1.00 0.00 H new ATOM 0 HB2 SER A 81 -1.384 12.431 -3.283 1.00 0.00 H new ATOM 0 HB3 SER A 81 -2.124 12.426 -4.871 1.00 0.00 H new ATOM 0 HG SER A 81 -2.647 10.492 -3.724 1.00 0.00 H new ATOM 1222 N GLU A 82 1.207 11.894 -2.810 1.00 0.00 N ATOM 1223 CA GLU A 82 2.149 11.344 -1.872 1.00 0.00 C ATOM 1224 C GLU A 82 1.431 10.420 -0.903 1.00 0.00 C ATOM 1225 O GLU A 82 2.057 9.850 -0.015 1.00 0.00 O ATOM 1226 CB GLU A 82 2.807 12.458 -1.072 1.00 0.00 C ATOM 1227 CG GLU A 82 3.558 13.477 -1.896 1.00 0.00 C ATOM 1228 CD GLU A 82 4.239 14.487 -1.022 1.00 0.00 C ATOM 1229 OE1 GLU A 82 3.624 15.518 -0.674 1.00 0.00 O ATOM 1230 OE2 GLU A 82 5.404 14.264 -0.641 1.00 0.00 O ATOM 0 H GLU A 82 0.673 12.687 -2.454 1.00 0.00 H new ATOM 0 HA GLU A 82 2.906 10.792 -2.429 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.039 12.974 -0.496 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.497 12.012 -0.356 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.298 12.972 -2.517 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.867 13.983 -2.571 1.00 0.00 H new ATOM 1237 N GLU A 83 0.129 10.223 -1.131 1.00 0.00 N ATOM 1238 CA GLU A 83 -0.749 9.534 -0.170 1.00 0.00 C ATOM 1239 C GLU A 83 -0.258 8.169 0.262 1.00 0.00 C ATOM 1240 O GLU A 83 0.096 7.980 1.419 1.00 0.00 O ATOM 1241 CB GLU A 83 -2.125 9.413 -0.710 1.00 0.00 C ATOM 1242 CG GLU A 83 -2.768 10.742 -1.043 1.00 0.00 C ATOM 1243 CD GLU A 83 -4.146 10.595 -1.616 1.00 0.00 C ATOM 1244 OE1 GLU A 83 -4.275 10.219 -2.794 1.00 0.00 O ATOM 1245 OE2 GLU A 83 -5.128 10.892 -0.910 1.00 0.00 O ATOM 0 H GLU A 83 -0.347 10.532 -1.979 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.740 10.162 0.721 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -2.100 8.796 -1.609 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.747 8.891 0.018 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.818 11.352 -0.141 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.139 11.276 -1.755 1.00 0.00 H new ATOM 1252 N GLU A 84 -0.163 7.237 -0.662 1.00 0.00 N ATOM 1253 CA GLU A 84 0.233 5.886 -0.293 1.00 0.00 C ATOM 1254 C GLU A 84 1.726 5.801 -0.227 1.00 0.00 C ATOM 1255 O GLU A 84 2.298 4.944 0.452 1.00 0.00 O ATOM 1256 CB GLU A 84 -0.241 4.878 -1.312 1.00 0.00 C ATOM 1257 CG GLU A 84 -0.363 3.503 -0.699 1.00 0.00 C ATOM 1258 CD GLU A 84 -0.819 2.446 -1.638 1.00 0.00 C ATOM 1259 OE1 GLU A 84 0.023 1.717 -2.154 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -2.028 2.260 -1.785 1.00 0.00 O ATOM 0 H GLU A 84 -0.349 7.380 -1.655 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.217 5.663 0.674 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.206 5.188 -1.713 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.457 4.846 -2.149 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.605 3.214 -0.290 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.060 3.553 0.138 1.00 0.00 H new ATOM 1267 N ILE A 85 2.341 6.719 -0.903 1.00 0.00 N ATOM 1268 CA ILE A 85 3.763 6.734 -1.094 1.00 0.00 C ATOM 1269 C ILE A 85 4.442 6.976 0.226 1.00 0.00 C ATOM 1270 O ILE A 85 5.357 6.254 0.614 1.00 0.00 O ATOM 1271 CB ILE A 85 4.172 7.839 -2.096 1.00 0.00 C ATOM 1272 CG1 ILE A 85 3.242 7.849 -3.337 1.00 0.00 C ATOM 1273 CG2 ILE A 85 5.629 7.696 -2.511 1.00 0.00 C ATOM 1274 CD1 ILE A 85 2.957 6.491 -3.960 1.00 0.00 C ATOM 0 H ILE A 85 1.860 7.499 -1.350 1.00 0.00 H new ATOM 0 HA ILE A 85 4.070 5.770 -1.499 1.00 0.00 H new ATOM 0 HB ILE A 85 4.060 8.797 -1.588 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.293 8.304 -3.053 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.688 8.490 -4.097 1.00 0.00 H new ATOM 0 HG21 ILE A 85 5.886 8.487 -3.215 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.267 7.773 -1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 85 5.779 6.726 -2.985 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.298 6.616 -4.819 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.893 6.036 -4.284 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.476 5.847 -3.224 1.00 0.00 H new ATOM 1286 N ARG A 86 3.948 7.962 0.933 1.00 0.00 N ATOM 1287 CA ARG A 86 4.482 8.313 2.204 1.00 0.00 C ATOM 1288 C ARG A 86 4.094 7.281 3.245 1.00 0.00 C ATOM 1289 O ARG A 86 4.862 7.014 4.153 1.00 0.00 O ATOM 1290 CB ARG A 86 4.059 9.726 2.584 1.00 0.00 C ATOM 1291 CG ARG A 86 4.755 10.281 3.802 1.00 0.00 C ATOM 1292 CD ARG A 86 4.403 11.739 4.014 1.00 0.00 C ATOM 1293 NE ARG A 86 4.875 12.598 2.903 1.00 0.00 N ATOM 1294 CZ ARG A 86 5.413 13.823 3.061 1.00 0.00 C ATOM 1295 NH1 ARG A 86 5.620 14.316 4.289 1.00 0.00 N ATOM 1296 NH2 ARG A 86 5.759 14.548 1.998 1.00 0.00 N ATOM 0 H ARG A 86 3.162 8.539 0.633 1.00 0.00 H new ATOM 0 HA ARG A 86 5.571 8.313 2.153 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.249 10.388 1.739 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.983 9.735 2.760 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.471 9.703 4.682 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.834 10.177 3.687 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.322 11.839 4.114 1.00 0.00 H new ATOM 0 HD3 ARG A 86 4.843 12.084 4.950 1.00 0.00 H new ATOM 0 HE ARG A 86 4.787 12.237 1.953 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.370 13.764 5.109 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.028 15.244 4.404 1.00 0.00 H new ATOM 0 HH21 ARG A 86 5.617 14.176 1.059 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.166 15.475 2.123 1.00 0.00 H new ATOM 1310 N GLU A 87 2.926 6.645 3.076 1.00 0.00 N ATOM 1311 CA GLU A 87 2.530 5.582 4.004 1.00 0.00 C ATOM 1312 C GLU A 87 3.495 4.406 3.897 1.00 0.00 C ATOM 1313 O GLU A 87 3.964 3.858 4.914 1.00 0.00 O ATOM 1314 CB GLU A 87 1.127 5.063 3.735 1.00 0.00 C ATOM 1315 CG GLU A 87 0.014 6.062 3.856 1.00 0.00 C ATOM 1316 CD GLU A 87 -1.317 5.370 3.865 1.00 0.00 C ATOM 1317 OE1 GLU A 87 -1.972 5.340 4.937 1.00 0.00 O ATOM 1318 OE2 GLU A 87 -1.702 4.762 2.847 1.00 0.00 O ATOM 0 H GLU A 87 2.259 6.841 2.330 1.00 0.00 H new ATOM 0 HA GLU A 87 2.553 6.021 5.001 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.104 4.645 2.728 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.927 4.243 4.425 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.135 6.641 4.772 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.058 6.766 3.025 1.00 0.00 H new ATOM 1325 N ALA A 88 3.788 4.023 2.667 1.00 0.00 N ATOM 1326 CA ALA A 88 4.684 2.927 2.403 1.00 0.00 C ATOM 1327 C ALA A 88 6.090 3.289 2.818 1.00 0.00 C ATOM 1328 O ALA A 88 6.765 2.503 3.433 1.00 0.00 O ATOM 1329 CB ALA A 88 4.641 2.526 0.935 1.00 0.00 C ATOM 0 H ALA A 88 3.409 4.466 1.830 1.00 0.00 H new ATOM 0 HA ALA A 88 4.358 2.070 2.992 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.327 1.696 0.764 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.629 2.220 0.671 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.936 3.374 0.317 1.00 0.00 H new ATOM 1335 N PHE A 89 6.508 4.495 2.515 1.00 0.00 N ATOM 1336 CA PHE A 89 7.832 4.944 2.893 1.00 0.00 C ATOM 1337 C PHE A 89 7.990 4.900 4.412 1.00 0.00 C ATOM 1338 O PHE A 89 8.972 4.371 4.924 1.00 0.00 O ATOM 1339 CB PHE A 89 8.093 6.354 2.373 1.00 0.00 C ATOM 1340 CG PHE A 89 9.492 6.824 2.614 1.00 0.00 C ATOM 1341 CD1 PHE A 89 10.508 6.450 1.763 1.00 0.00 C ATOM 1342 CD2 PHE A 89 9.792 7.638 3.689 1.00 0.00 C ATOM 1343 CE1 PHE A 89 11.792 6.870 1.976 1.00 0.00 C ATOM 1344 CE2 PHE A 89 11.078 8.061 3.906 1.00 0.00 C ATOM 1345 CZ PHE A 89 12.078 7.674 3.048 1.00 0.00 C ATOM 0 H PHE A 89 5.953 5.184 2.008 1.00 0.00 H new ATOM 0 HA PHE A 89 8.565 4.273 2.444 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.887 6.383 1.303 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.398 7.044 2.851 1.00 0.00 H new ATOM 0 HD1 PHE A 89 10.288 5.817 0.916 1.00 0.00 H new ATOM 0 HD2 PHE A 89 9.007 7.944 4.364 1.00 0.00 H new ATOM 0 HE1 PHE A 89 12.579 6.569 1.301 1.00 0.00 H new ATOM 0 HE2 PHE A 89 11.304 8.697 4.749 1.00 0.00 H new ATOM 0 HZ PHE A 89 13.092 8.004 3.219 1.00 0.00 H new ATOM 1355 N ARG A 90 6.978 5.402 5.106 1.00 0.00 N ATOM 1356 CA ARG A 90 6.951 5.468 6.562 1.00 0.00 C ATOM 1357 C ARG A 90 7.037 4.091 7.209 1.00 0.00 C ATOM 1358 O ARG A 90 7.560 3.955 8.315 1.00 0.00 O ATOM 1359 CB ARG A 90 5.678 6.187 7.026 1.00 0.00 C ATOM 1360 CG ARG A 90 5.521 6.330 8.539 1.00 0.00 C ATOM 1361 CD ARG A 90 6.684 7.088 9.179 1.00 0.00 C ATOM 1362 NE ARG A 90 6.831 8.438 8.643 1.00 0.00 N ATOM 1363 CZ ARG A 90 7.391 9.469 9.288 1.00 0.00 C ATOM 1364 NH1 ARG A 90 7.812 9.337 10.539 1.00 0.00 N ATOM 1365 NH2 ARG A 90 7.530 10.629 8.670 1.00 0.00 N ATOM 0 H ARG A 90 6.139 5.781 4.667 1.00 0.00 H new ATOM 0 HA ARG A 90 7.831 6.028 6.879 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.660 7.182 6.580 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.814 5.648 6.637 1.00 0.00 H new ATOM 0 HG2 ARG A 90 4.588 6.851 8.757 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.446 5.340 8.988 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.529 7.143 10.257 1.00 0.00 H new ATOM 0 HD3 ARG A 90 7.608 6.533 9.018 1.00 0.00 H new ATOM 0 HE ARG A 90 6.479 8.610 7.701 1.00 0.00 H new ATOM 0 HH11 ARG A 90 7.711 8.443 11.020 1.00 0.00 H new ATOM 0 HH12 ARG A 90 8.237 10.129 11.020 1.00 0.00 H new ATOM 0 HH21 ARG A 90 7.211 10.735 7.707 1.00 0.00 H new ATOM 0 HH22 ARG A 90 7.956 11.418 9.156 1.00 0.00 H new ATOM 1379 N VAL A 91 6.516 3.081 6.556 1.00 0.00 N ATOM 1380 CA VAL A 91 6.571 1.766 7.138 1.00 0.00 C ATOM 1381 C VAL A 91 7.959 1.113 6.941 1.00 0.00 C ATOM 1382 O VAL A 91 8.387 0.310 7.764 1.00 0.00 O ATOM 1383 CB VAL A 91 5.393 0.846 6.684 1.00 0.00 C ATOM 1384 CG1 VAL A 91 5.433 0.560 5.210 1.00 0.00 C ATOM 1385 CG2 VAL A 91 5.354 -0.437 7.486 1.00 0.00 C ATOM 0 H VAL A 91 6.061 3.141 5.645 1.00 0.00 H new ATOM 0 HA VAL A 91 6.434 1.893 8.212 1.00 0.00 H new ATOM 0 HB VAL A 91 4.472 1.394 6.880 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.595 -0.083 4.941 1.00 0.00 H new ATOM 0 HG12 VAL A 91 5.364 1.496 4.656 1.00 0.00 H new ATOM 0 HG13 VAL A 91 6.369 0.059 4.962 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.523 -1.054 7.145 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.289 -0.980 7.349 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.222 -0.202 8.542 1.00 0.00 H new ATOM 1395 N PHE A 92 8.673 1.499 5.881 1.00 0.00 N ATOM 1396 CA PHE A 92 10.025 0.977 5.668 1.00 0.00 C ATOM 1397 C PHE A 92 10.995 1.781 6.519 1.00 0.00 C ATOM 1398 O PHE A 92 11.773 1.228 7.300 1.00 0.00 O ATOM 1399 CB PHE A 92 10.464 1.047 4.198 1.00 0.00 C ATOM 1400 CG PHE A 92 9.609 0.295 3.220 1.00 0.00 C ATOM 1401 CD1 PHE A 92 9.498 -1.080 3.271 1.00 0.00 C ATOM 1402 CD2 PHE A 92 8.940 0.973 2.233 1.00 0.00 C ATOM 1403 CE1 PHE A 92 8.723 -1.758 2.347 1.00 0.00 C ATOM 1404 CE2 PHE A 92 8.160 0.308 1.309 1.00 0.00 C ATOM 1405 CZ PHE A 92 8.050 -1.061 1.367 1.00 0.00 C ATOM 0 H PHE A 92 8.348 2.156 5.172 1.00 0.00 H new ATOM 0 HA PHE A 92 10.024 -0.075 5.953 1.00 0.00 H new ATOM 0 HB2 PHE A 92 10.491 2.094 3.897 1.00 0.00 H new ATOM 0 HB3 PHE A 92 11.484 0.668 4.125 1.00 0.00 H new ATOM 0 HD1 PHE A 92 10.021 -1.631 4.039 1.00 0.00 H new ATOM 0 HD2 PHE A 92 9.025 2.048 2.178 1.00 0.00 H new ATOM 0 HE1 PHE A 92 8.645 -2.834 2.394 1.00 0.00 H new ATOM 0 HE2 PHE A 92 7.638 0.861 0.543 1.00 0.00 H new ATOM 0 HZ PHE A 92 7.439 -1.588 0.648 1.00 0.00 H new ATOM 1415 N ASP A 93 10.930 3.096 6.371 1.00 0.00 N ATOM 1416 CA ASP A 93 11.723 3.998 7.177 1.00 0.00 C ATOM 1417 C ASP A 93 10.954 4.305 8.430 1.00 0.00 C ATOM 1418 O ASP A 93 10.228 5.313 8.542 1.00 0.00 O ATOM 1419 CB ASP A 93 12.136 5.278 6.424 1.00 0.00 C ATOM 1420 CG ASP A 93 12.870 6.272 7.316 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.513 7.485 7.304 1.00 0.00 O ATOM 1422 OD2 ASP A 93 13.773 5.861 8.066 1.00 0.00 O ATOM 0 H ASP A 93 10.328 3.561 5.691 1.00 0.00 H new ATOM 0 HA ASP A 93 12.664 3.509 7.428 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.775 5.010 5.583 1.00 0.00 H new ATOM 0 HB3 ASP A 93 11.247 5.754 6.010 1.00 0.00 H new ATOM 1427 N LYS A 94 11.064 3.387 9.334 1.00 0.00 N ATOM 1428 CA LYS A 94 10.335 3.383 10.560 1.00 0.00 C ATOM 1429 C LYS A 94 10.920 4.387 11.530 1.00 0.00 C ATOM 1430 O LYS A 94 10.202 4.955 12.358 1.00 0.00 O ATOM 1431 CB LYS A 94 10.373 1.976 11.136 1.00 0.00 C ATOM 1432 CG LYS A 94 9.652 1.786 12.458 1.00 0.00 C ATOM 1433 CD LYS A 94 9.784 0.356 12.951 1.00 0.00 C ATOM 1434 CE LYS A 94 11.241 -0.035 13.159 1.00 0.00 C ATOM 1435 NZ LYS A 94 11.909 0.791 14.194 1.00 0.00 N ATOM 0 H LYS A 94 11.689 2.587 9.234 1.00 0.00 H new ATOM 0 HA LYS A 94 9.300 3.674 10.380 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.940 1.292 10.406 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.415 1.685 11.267 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.062 2.470 13.201 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.598 2.038 12.341 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.239 0.242 13.888 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.325 -0.321 12.231 1.00 0.00 H new ATOM 0 HE2 LYS A 94 11.294 -1.085 13.447 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.779 0.065 12.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.379 0.170 14.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 12.616 1.406 13.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 11.201 1.377 14.681 1.00 0.00 H new ATOM 1449 N ASP A 95 12.213 4.622 11.422 1.00 0.00 N ATOM 1450 CA ASP A 95 12.882 5.588 12.288 1.00 0.00 C ATOM 1451 C ASP A 95 12.529 7.021 11.876 1.00 0.00 C ATOM 1452 O ASP A 95 12.728 7.965 12.630 1.00 0.00 O ATOM 1453 CB ASP A 95 14.396 5.360 12.251 1.00 0.00 C ATOM 1454 CG ASP A 95 15.188 6.320 13.105 1.00 0.00 C ATOM 1455 OD1 ASP A 95 15.975 7.125 12.551 1.00 0.00 O ATOM 1456 OD2 ASP A 95 15.046 6.288 14.339 1.00 0.00 O ATOM 0 H ASP A 95 12.824 4.162 10.747 1.00 0.00 H new ATOM 0 HA ASP A 95 12.536 5.444 13.311 1.00 0.00 H new ATOM 0 HB2 ASP A 95 14.607 4.342 12.578 1.00 0.00 H new ATOM 0 HB3 ASP A 95 14.739 5.441 11.220 1.00 0.00 H new ATOM 1461 N GLY A 96 11.953 7.158 10.698 1.00 0.00 N ATOM 1462 CA GLY A 96 11.469 8.442 10.237 1.00 0.00 C ATOM 1463 C GLY A 96 12.571 9.451 9.996 1.00 0.00 C ATOM 1464 O GLY A 96 12.438 10.630 10.352 1.00 0.00 O ATOM 0 H GLY A 96 11.809 6.391 10.041 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.909 8.300 9.313 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.773 8.845 10.973 1.00 0.00 H new ATOM 1468 N ASN A 97 13.641 9.017 9.390 1.00 0.00 N ATOM 1469 CA ASN A 97 14.767 9.899 9.121 1.00 0.00 C ATOM 1470 C ASN A 97 14.749 10.419 7.705 1.00 0.00 C ATOM 1471 O ASN A 97 15.526 11.311 7.352 1.00 0.00 O ATOM 1472 CB ASN A 97 16.112 9.287 9.460 1.00 0.00 C ATOM 1473 CG ASN A 97 16.164 7.970 8.922 1.00 0.00 C ATOM 1474 OD1 ASN A 97 15.729 7.077 9.694 1.00 0.00 O flip ATOM 1475 ND2 ASN A 97 16.589 7.748 7.817 1.00 0.00 N flip ATOM 0 H ASN A 97 13.767 8.057 9.068 1.00 0.00 H new ATOM 0 HA ASN A 97 14.638 10.745 9.796 1.00 0.00 H new ATOM 0 HB2 ASN A 97 16.918 9.895 9.049 1.00 0.00 H new ATOM 0 HB3 ASN A 97 16.253 9.259 10.541 1.00 0.00 H new ATOM 0 HD21 ASN A 97 16.928 8.516 7.237 1.00 0.00 H new ATOM 0 HD22 ASN A 97 16.609 6.792 7.461 1.00 0.00 H new ATOM 1482 N GLY A 98 13.889 9.853 6.882 1.00 0.00 N ATOM 1483 CA GLY A 98 13.718 10.363 5.539 1.00 0.00 C ATOM 1484 C GLY A 98 14.416 9.534 4.496 1.00 0.00 C ATOM 1485 O GLY A 98 14.421 9.894 3.310 1.00 0.00 O ATOM 0 H GLY A 98 13.305 9.050 7.116 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.654 10.406 5.307 1.00 0.00 H new ATOM 0 HA3 GLY A 98 14.096 11.384 5.494 1.00 0.00 H new ATOM 1489 N TYR A 99 14.997 8.432 4.919 1.00 0.00 N ATOM 1490 CA TYR A 99 15.675 7.528 4.027 1.00 0.00 C ATOM 1491 C TYR A 99 15.648 6.108 4.558 1.00 0.00 C ATOM 1492 O TYR A 99 15.920 5.863 5.727 1.00 0.00 O ATOM 1493 CB TYR A 99 17.106 8.007 3.680 1.00 0.00 C ATOM 1494 CG TYR A 99 17.958 8.430 4.858 1.00 0.00 C ATOM 1495 CD1 TYR A 99 18.752 7.526 5.532 1.00 0.00 C ATOM 1496 CD2 TYR A 99 17.977 9.754 5.276 1.00 0.00 C ATOM 1497 CE1 TYR A 99 19.542 7.923 6.591 1.00 0.00 C ATOM 1498 CE2 TYR A 99 18.757 10.158 6.333 1.00 0.00 C ATOM 1499 CZ TYR A 99 19.539 9.238 6.986 1.00 0.00 C ATOM 1500 OH TYR A 99 20.339 9.641 8.035 1.00 0.00 O ATOM 0 H TYR A 99 15.010 8.140 5.896 1.00 0.00 H new ATOM 0 HA TYR A 99 15.125 7.527 3.086 1.00 0.00 H new ATOM 0 HB2 TYR A 99 17.621 7.204 3.152 1.00 0.00 H new ATOM 0 HB3 TYR A 99 17.031 8.846 2.989 1.00 0.00 H new ATOM 0 HD1 TYR A 99 18.755 6.490 5.226 1.00 0.00 H new ATOM 0 HD2 TYR A 99 17.367 10.481 4.760 1.00 0.00 H new ATOM 0 HE1 TYR A 99 20.160 7.203 7.107 1.00 0.00 H new ATOM 0 HE2 TYR A 99 18.755 11.191 6.647 1.00 0.00 H new ATOM 0 HH TYR A 99 20.220 10.602 8.187 1.00 0.00 H new ATOM 1510 N ILE A 100 15.298 5.188 3.697 1.00 0.00 N ATOM 1511 CA ILE A 100 15.176 3.804 4.068 1.00 0.00 C ATOM 1512 C ILE A 100 16.561 3.201 4.116 1.00 0.00 C ATOM 1513 O ILE A 100 17.342 3.347 3.155 1.00 0.00 O ATOM 1514 CB ILE A 100 14.366 2.979 3.032 1.00 0.00 C ATOM 1515 CG1 ILE A 100 13.183 3.783 2.450 1.00 0.00 C ATOM 1516 CG2 ILE A 100 13.879 1.688 3.681 1.00 0.00 C ATOM 1517 CD1 ILE A 100 12.325 3.016 1.453 1.00 0.00 C ATOM 0 H ILE A 100 15.089 5.379 2.717 1.00 0.00 H new ATOM 0 HA ILE A 100 14.661 3.770 5.028 1.00 0.00 H new ATOM 0 HB ILE A 100 15.024 2.739 2.196 1.00 0.00 H new ATOM 0 HG12 ILE A 100 12.550 4.119 3.271 1.00 0.00 H new ATOM 0 HG13 ILE A 100 13.573 4.676 1.962 1.00 0.00 H new ATOM 0 HG21 ILE A 100 13.310 1.108 2.955 1.00 0.00 H new ATOM 0 HG22 ILE A 100 14.736 1.105 4.020 1.00 0.00 H new ATOM 0 HG23 ILE A 100 13.243 1.927 4.533 1.00 0.00 H new ATOM 0 HD11 ILE A 100 11.519 3.658 1.097 1.00 0.00 H new ATOM 0 HD12 ILE A 100 12.940 2.703 0.609 1.00 0.00 H new ATOM 0 HD13 ILE A 100 11.901 2.137 1.938 1.00 0.00 H new ATOM 1529 N SER A 101 16.879 2.559 5.199 1.00 0.00 N ATOM 1530 CA SER A 101 18.136 1.894 5.318 1.00 0.00 C ATOM 1531 C SER A 101 17.868 0.379 5.396 1.00 0.00 C ATOM 1532 O SER A 101 16.842 -0.048 5.961 1.00 0.00 O ATOM 1533 CB SER A 101 18.884 2.419 6.545 1.00 0.00 C ATOM 1534 OG SER A 101 20.261 2.077 6.512 1.00 0.00 O ATOM 0 H SER A 101 16.277 2.483 6.019 1.00 0.00 H new ATOM 0 HA SER A 101 18.771 2.090 4.454 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.780 3.503 6.597 1.00 0.00 H new ATOM 0 HB3 SER A 101 18.430 2.012 7.449 1.00 0.00 H new ATOM 0 HG SER A 101 20.689 2.361 7.347 1.00 0.00 H new ATOM 1540 N ALA A 102 18.774 -0.411 4.818 1.00 0.00 N ATOM 1541 CA ALA A 102 18.617 -1.869 4.670 1.00 0.00 C ATOM 1542 C ALA A 102 18.288 -2.592 5.970 1.00 0.00 C ATOM 1543 O ALA A 102 17.324 -3.362 6.018 1.00 0.00 O ATOM 1544 CB ALA A 102 19.853 -2.482 4.030 1.00 0.00 C ATOM 0 H ALA A 102 19.650 -0.058 4.433 1.00 0.00 H new ATOM 0 HA ALA A 102 17.755 -2.006 4.017 1.00 0.00 H new ATOM 0 HB1 ALA A 102 19.715 -3.559 3.930 1.00 0.00 H new ATOM 0 HB2 ALA A 102 20.008 -2.043 3.044 1.00 0.00 H new ATOM 0 HB3 ALA A 102 20.723 -2.284 4.656 1.00 0.00 H new ATOM 1550 N ALA A 103 19.065 -2.332 7.014 1.00 0.00 N ATOM 1551 CA ALA A 103 18.892 -2.999 8.305 1.00 0.00 C ATOM 1552 C ALA A 103 17.493 -2.796 8.864 1.00 0.00 C ATOM 1553 O ALA A 103 16.855 -3.745 9.320 1.00 0.00 O ATOM 1554 CB ALA A 103 19.934 -2.530 9.301 1.00 0.00 C ATOM 0 H ALA A 103 19.830 -1.657 6.994 1.00 0.00 H new ATOM 0 HA ALA A 103 19.028 -4.067 8.136 1.00 0.00 H new ATOM 0 HB1 ALA A 103 19.784 -3.040 10.252 1.00 0.00 H new ATOM 0 HB2 ALA A 103 20.930 -2.758 8.920 1.00 0.00 H new ATOM 0 HB3 ALA A 103 19.839 -1.454 9.448 1.00 0.00 H new ATOM 1560 N GLU A 104 16.998 -1.576 8.785 1.00 0.00 N ATOM 1561 CA GLU A 104 15.684 -1.282 9.299 1.00 0.00 C ATOM 1562 C GLU A 104 14.593 -1.874 8.436 1.00 0.00 C ATOM 1563 O GLU A 104 13.595 -2.379 8.960 1.00 0.00 O ATOM 1564 CB GLU A 104 15.476 0.203 9.524 1.00 0.00 C ATOM 1565 CG GLU A 104 14.052 0.544 9.909 1.00 0.00 C ATOM 1566 CD GLU A 104 13.961 1.832 10.636 1.00 0.00 C ATOM 1567 OE1 GLU A 104 13.894 2.892 9.995 1.00 0.00 O ATOM 1568 OE2 GLU A 104 13.975 1.802 11.894 1.00 0.00 O ATOM 0 H GLU A 104 17.485 -0.781 8.372 1.00 0.00 H new ATOM 0 HA GLU A 104 15.618 -1.763 10.275 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.151 0.545 10.308 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.742 0.744 8.616 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.436 0.592 9.011 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.645 -0.252 10.532 1.00 0.00 H new ATOM 1575 N LEU A 105 14.799 -1.850 7.130 1.00 0.00 N ATOM 1576 CA LEU A 105 13.841 -2.413 6.203 1.00 0.00 C ATOM 1577 C LEU A 105 13.702 -3.920 6.532 1.00 0.00 C ATOM 1578 O LEU A 105 12.608 -4.446 6.632 1.00 0.00 O ATOM 1579 CB LEU A 105 14.332 -2.184 4.738 1.00 0.00 C ATOM 1580 CG LEU A 105 13.313 -2.369 3.569 1.00 0.00 C ATOM 1581 CD1 LEU A 105 13.934 -1.921 2.259 1.00 0.00 C ATOM 1582 CD2 LEU A 105 12.851 -3.806 3.419 1.00 0.00 C ATOM 0 H LEU A 105 15.625 -1.444 6.690 1.00 0.00 H new ATOM 0 HA LEU A 105 12.867 -1.933 6.296 1.00 0.00 H new ATOM 0 HB2 LEU A 105 14.726 -1.170 4.676 1.00 0.00 H new ATOM 0 HB3 LEU A 105 15.167 -2.862 4.559 1.00 0.00 H new ATOM 0 HG LEU A 105 12.445 -1.757 3.814 1.00 0.00 H new ATOM 0 HD11 LEU A 105 13.215 -2.054 1.451 1.00 0.00 H new ATOM 0 HD12 LEU A 105 14.211 -0.869 2.328 1.00 0.00 H new ATOM 0 HD13 LEU A 105 14.823 -2.517 2.055 1.00 0.00 H new ATOM 0 HD21 LEU A 105 12.144 -3.877 2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 105 13.710 -4.445 3.217 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.366 -4.130 4.340 1.00 0.00 H new ATOM 1594 N ARG A 106 14.836 -4.572 6.771 1.00 0.00 N ATOM 1595 CA ARG A 106 14.879 -6.000 7.119 1.00 0.00 C ATOM 1596 C ARG A 106 14.178 -6.200 8.465 1.00 0.00 C ATOM 1597 O ARG A 106 13.355 -7.100 8.626 1.00 0.00 O ATOM 1598 CB ARG A 106 16.359 -6.445 7.212 1.00 0.00 C ATOM 1599 CG ARG A 106 16.674 -7.947 7.046 1.00 0.00 C ATOM 1600 CD ARG A 106 16.132 -8.832 8.135 1.00 0.00 C ATOM 1601 NE ARG A 106 16.689 -10.190 8.023 1.00 0.00 N ATOM 1602 CZ ARG A 106 16.137 -11.335 8.462 1.00 0.00 C ATOM 1603 NH1 ARG A 106 14.972 -11.334 9.099 1.00 0.00 N ATOM 1604 NH2 ARG A 106 16.782 -12.486 8.263 1.00 0.00 N ATOM 0 H ARG A 106 15.755 -4.131 6.730 1.00 0.00 H new ATOM 0 HA ARG A 106 14.373 -6.597 6.360 1.00 0.00 H new ATOM 0 HB2 ARG A 106 16.920 -5.900 6.453 1.00 0.00 H new ATOM 0 HB3 ARG A 106 16.743 -6.128 8.182 1.00 0.00 H new ATOM 0 HG2 ARG A 106 16.272 -8.284 6.090 1.00 0.00 H new ATOM 0 HG3 ARG A 106 17.756 -8.074 7.000 1.00 0.00 H new ATOM 0 HD2 ARG A 106 16.378 -8.411 9.110 1.00 0.00 H new ATOM 0 HD3 ARG A 106 15.045 -8.872 8.071 1.00 0.00 H new ATOM 0 HE ARG A 106 17.595 -10.272 7.561 1.00 0.00 H new ATOM 0 HH11 ARG A 106 14.481 -10.455 9.262 1.00 0.00 H new ATOM 0 HH12 ARG A 106 14.568 -12.212 9.425 1.00 0.00 H new ATOM 0 HH21 ARG A 106 17.682 -12.490 7.783 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.375 -13.362 8.591 1.00 0.00 H new ATOM 1618 N HIS A 107 14.503 -5.333 9.407 1.00 0.00 N ATOM 1619 CA HIS A 107 13.968 -5.387 10.762 1.00 0.00 C ATOM 1620 C HIS A 107 12.436 -5.280 10.764 1.00 0.00 C ATOM 1621 O HIS A 107 11.750 -6.086 11.413 1.00 0.00 O ATOM 1622 CB HIS A 107 14.598 -4.274 11.624 1.00 0.00 C ATOM 1623 CG HIS A 107 14.299 -4.374 13.090 1.00 0.00 C ATOM 1624 ND1 HIS A 107 13.612 -3.413 13.791 1.00 0.00 N ATOM 1625 CD2 HIS A 107 14.631 -5.321 13.991 1.00 0.00 C ATOM 1626 CE1 HIS A 107 13.532 -3.771 15.054 1.00 0.00 C ATOM 1627 NE2 HIS A 107 14.141 -4.923 15.202 1.00 0.00 N ATOM 0 H HIS A 107 15.153 -4.562 9.254 1.00 0.00 H new ATOM 0 HA HIS A 107 14.227 -6.354 11.193 1.00 0.00 H new ATOM 0 HB2 HIS A 107 15.679 -4.293 11.485 1.00 0.00 H new ATOM 0 HB3 HIS A 107 14.247 -3.308 11.260 1.00 0.00 H new ATOM 0 HD2 HIS A 107 15.183 -6.228 13.791 1.00 0.00 H new ATOM 0 HE1 HIS A 107 13.046 -3.210 15.838 1.00 0.00 H new ATOM 0 HE2 HIS A 107 14.234 -5.437 16.078 1.00 0.00 H new ATOM 1636 N VAL A 108 11.900 -4.321 10.015 1.00 0.00 N ATOM 1637 CA VAL A 108 10.463 -4.149 9.959 1.00 0.00 C ATOM 1638 C VAL A 108 9.825 -5.360 9.282 1.00 0.00 C ATOM 1639 O VAL A 108 8.803 -5.830 9.721 1.00 0.00 O ATOM 1640 CB VAL A 108 10.006 -2.802 9.284 1.00 0.00 C ATOM 1641 CG1 VAL A 108 10.260 -2.768 7.780 1.00 0.00 C ATOM 1642 CG2 VAL A 108 8.546 -2.499 9.599 1.00 0.00 C ATOM 0 H VAL A 108 12.435 -3.663 9.448 1.00 0.00 H new ATOM 0 HA VAL A 108 10.112 -4.080 10.989 1.00 0.00 H new ATOM 0 HB VAL A 108 10.626 -2.017 9.717 1.00 0.00 H new ATOM 0 HG11 VAL A 108 9.923 -1.814 7.376 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.326 -2.887 7.588 1.00 0.00 H new ATOM 0 HG13 VAL A 108 9.712 -3.579 7.300 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.257 -1.563 9.120 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.918 -3.307 9.225 1.00 0.00 H new ATOM 0 HG23 VAL A 108 8.418 -2.409 10.678 1.00 0.00 H new ATOM 1652 N MET A 109 10.498 -5.910 8.271 1.00 0.00 N ATOM 1653 CA MET A 109 10.009 -7.094 7.558 1.00 0.00 C ATOM 1654 C MET A 109 9.848 -8.263 8.479 1.00 0.00 C ATOM 1655 O MET A 109 8.835 -8.964 8.435 1.00 0.00 O ATOM 1656 CB MET A 109 10.924 -7.465 6.412 1.00 0.00 C ATOM 1657 CG MET A 109 10.833 -6.488 5.307 1.00 0.00 C ATOM 1658 SD MET A 109 9.185 -6.435 4.615 1.00 0.00 S ATOM 1659 CE MET A 109 9.316 -4.928 3.724 1.00 0.00 C ATOM 0 H MET A 109 11.389 -5.553 7.925 1.00 0.00 H new ATOM 0 HA MET A 109 9.030 -6.837 7.153 1.00 0.00 H new ATOM 0 HB2 MET A 109 11.953 -7.517 6.769 1.00 0.00 H new ATOM 0 HB3 MET A 109 10.664 -8.457 6.044 1.00 0.00 H new ATOM 0 HG2 MET A 109 11.108 -5.498 5.671 1.00 0.00 H new ATOM 0 HG3 MET A 109 11.548 -6.751 4.527 1.00 0.00 H new ATOM 0 HE1 MET A 109 8.385 -4.739 3.189 1.00 0.00 H new ATOM 0 HE2 MET A 109 9.508 -4.110 4.419 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.137 -4.998 3.010 1.00 0.00 H new ATOM 1669 N THR A 110 10.813 -8.439 9.352 1.00 0.00 N ATOM 1670 CA THR A 110 10.791 -9.511 10.312 1.00 0.00 C ATOM 1671 C THR A 110 9.569 -9.349 11.243 1.00 0.00 C ATOM 1672 O THR A 110 8.914 -10.331 11.617 1.00 0.00 O ATOM 1673 CB THR A 110 12.101 -9.507 11.122 1.00 0.00 C ATOM 1674 OG1 THR A 110 13.214 -9.412 10.198 1.00 0.00 O ATOM 1675 CG2 THR A 110 12.238 -10.792 11.929 1.00 0.00 C ATOM 0 H THR A 110 11.636 -7.840 9.414 1.00 0.00 H new ATOM 0 HA THR A 110 10.707 -10.467 9.795 1.00 0.00 H new ATOM 0 HB THR A 110 12.093 -8.661 11.809 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.251 -8.508 9.822 1.00 0.00 H new ATOM 0 HG21 THR A 110 13.170 -10.769 12.494 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.398 -10.880 12.618 1.00 0.00 H new ATOM 0 HG23 THR A 110 12.244 -11.647 11.253 1.00 0.00 H new ATOM 1683 N ASN A 111 9.239 -8.100 11.542 1.00 0.00 N ATOM 1684 CA ASN A 111 8.090 -7.763 12.391 1.00 0.00 C ATOM 1685 C ASN A 111 6.773 -7.964 11.616 1.00 0.00 C ATOM 1686 O ASN A 111 5.751 -8.339 12.184 1.00 0.00 O ATOM 1687 CB ASN A 111 8.182 -6.290 12.824 1.00 0.00 C ATOM 1688 CG ASN A 111 7.215 -5.925 13.949 1.00 0.00 C ATOM 1689 OD1 ASN A 111 7.563 -6.024 15.126 1.00 0.00 O ATOM 1690 ND2 ASN A 111 6.023 -5.486 13.617 1.00 0.00 N ATOM 0 H ASN A 111 9.756 -7.288 11.206 1.00 0.00 H new ATOM 0 HA ASN A 111 8.103 -8.415 13.264 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.201 -6.078 13.148 1.00 0.00 H new ATOM 0 HB3 ASN A 111 7.982 -5.653 11.962 1.00 0.00 H new ATOM 0 HD21 ASN A 111 5.358 -5.217 14.342 1.00 0.00 H new ATOM 0 HD22 ASN A 111 5.762 -5.414 12.634 1.00 0.00 H new ATOM 1697 N LEU A 112 6.827 -7.731 10.318 1.00 0.00 N ATOM 1698 CA LEU A 112 5.642 -7.771 9.454 1.00 0.00 C ATOM 1699 C LEU A 112 5.336 -9.179 8.987 1.00 0.00 C ATOM 1700 O LEU A 112 4.220 -9.478 8.562 1.00 0.00 O ATOM 1701 CB LEU A 112 5.895 -6.893 8.233 1.00 0.00 C ATOM 1702 CG LEU A 112 6.143 -5.415 8.509 1.00 0.00 C ATOM 1703 CD1 LEU A 112 6.684 -4.734 7.274 1.00 0.00 C ATOM 1704 CD2 LEU A 112 4.879 -4.730 8.990 1.00 0.00 C ATOM 0 H LEU A 112 7.691 -7.508 9.824 1.00 0.00 H new ATOM 0 HA LEU A 112 4.789 -7.410 10.029 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.757 -7.291 7.697 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.037 -6.978 7.566 1.00 0.00 H new ATOM 0 HG LEU A 112 6.886 -5.337 9.302 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.856 -3.679 7.486 1.00 0.00 H new ATOM 0 HD12 LEU A 112 7.623 -5.203 6.982 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.963 -4.828 6.462 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.085 -3.677 9.179 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.105 -4.817 8.227 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.536 -5.203 9.910 1.00 0.00 H new ATOM 1716 N GLY A 113 6.318 -10.029 9.048 1.00 0.00 N ATOM 1717 CA GLY A 113 6.120 -11.370 8.614 1.00 0.00 C ATOM 1718 C GLY A 113 6.475 -11.546 7.154 1.00 0.00 C ATOM 1719 O GLY A 113 5.782 -12.253 6.416 1.00 0.00 O ATOM 0 H GLY A 113 7.254 -9.816 9.392 1.00 0.00 H new ATOM 0 HA2 GLY A 113 6.729 -12.042 9.220 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.079 -11.653 8.772 1.00 0.00 H new ATOM 1723 N GLU A 114 7.488 -10.842 6.708 1.00 0.00 N ATOM 1724 CA GLU A 114 7.972 -10.978 5.353 1.00 0.00 C ATOM 1725 C GLU A 114 9.412 -11.414 5.460 1.00 0.00 C ATOM 1726 O GLU A 114 10.246 -10.662 5.968 1.00 0.00 O ATOM 1727 CB GLU A 114 7.890 -9.634 4.614 1.00 0.00 C ATOM 1728 CG GLU A 114 7.983 -9.721 3.107 1.00 0.00 C ATOM 1729 CD GLU A 114 6.921 -10.587 2.496 1.00 0.00 C ATOM 1730 OE1 GLU A 114 5.747 -10.235 2.543 1.00 0.00 O ATOM 1731 OE2 GLU A 114 7.248 -11.644 1.953 1.00 0.00 O ATOM 0 H GLU A 114 7.999 -10.161 7.270 1.00 0.00 H new ATOM 0 HA GLU A 114 7.373 -11.698 4.795 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.949 -9.150 4.877 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.692 -8.990 4.975 1.00 0.00 H new ATOM 0 HG2 GLU A 114 7.910 -8.718 2.687 1.00 0.00 H new ATOM 0 HG3 GLU A 114 8.963 -10.111 2.832 1.00 0.00 H new ATOM 1738 N LYS A 115 9.706 -12.623 5.062 1.00 0.00 N ATOM 1739 CA LYS A 115 11.066 -13.099 5.163 1.00 0.00 C ATOM 1740 C LYS A 115 11.924 -12.593 4.023 1.00 0.00 C ATOM 1741 O LYS A 115 11.910 -13.143 2.926 1.00 0.00 O ATOM 1742 CB LYS A 115 11.168 -14.640 5.344 1.00 0.00 C ATOM 1743 CG LYS A 115 10.466 -15.485 4.290 1.00 0.00 C ATOM 1744 CD LYS A 115 10.663 -16.964 4.552 1.00 0.00 C ATOM 1745 CE LYS A 115 9.907 -17.817 3.547 1.00 0.00 C ATOM 1746 NZ LYS A 115 10.071 -19.265 3.810 1.00 0.00 N ATOM 0 H LYS A 115 9.039 -13.288 4.671 1.00 0.00 H new ATOM 0 HA LYS A 115 11.468 -12.673 6.082 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.223 -14.915 5.358 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.758 -14.899 6.320 1.00 0.00 H new ATOM 0 HG2 LYS A 115 9.401 -15.253 4.284 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.852 -15.234 3.302 1.00 0.00 H new ATOM 0 HD2 LYS A 115 11.725 -17.204 4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.325 -17.203 5.560 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.848 -17.561 3.579 1.00 0.00 H new ATOM 0 HE3 LYS A 115 10.260 -17.589 2.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.539 -19.809 3.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.079 -19.516 3.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.711 -19.488 4.760 1.00 0.00 H new ATOM 1760 N LEU A 116 12.602 -11.499 4.262 1.00 0.00 N ATOM 1761 CA LEU A 116 13.525 -10.946 3.303 1.00 0.00 C ATOM 1762 C LEU A 116 14.861 -10.935 3.984 1.00 0.00 C ATOM 1763 O LEU A 116 14.948 -10.514 5.138 1.00 0.00 O ATOM 1764 CB LEU A 116 13.188 -9.479 2.921 1.00 0.00 C ATOM 1765 CG LEU A 116 11.740 -9.105 2.560 1.00 0.00 C ATOM 1766 CD1 LEU A 116 11.685 -7.698 1.989 1.00 0.00 C ATOM 1767 CD2 LEU A 116 11.109 -10.081 1.599 1.00 0.00 C ATOM 0 H LEU A 116 12.530 -10.966 5.128 1.00 0.00 H new ATOM 0 HA LEU A 116 13.490 -11.540 2.390 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.491 -8.846 3.755 1.00 0.00 H new ATOM 0 HB3 LEU A 116 13.817 -9.210 2.072 1.00 0.00 H new ATOM 0 HG LEU A 116 11.163 -9.147 3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 116 10.654 -7.447 1.738 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.061 -6.990 2.728 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.300 -7.646 1.091 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.088 -9.767 1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.687 -10.107 0.675 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.095 -11.075 2.047 1.00 0.00 H new ATOM 1779 N THR A 117 15.886 -11.400 3.341 1.00 0.00 N ATOM 1780 CA THR A 117 17.163 -11.364 3.976 1.00 0.00 C ATOM 1781 C THR A 117 17.905 -10.106 3.566 1.00 0.00 C ATOM 1782 O THR A 117 17.352 -9.263 2.822 1.00 0.00 O ATOM 1783 CB THR A 117 18.006 -12.644 3.730 1.00 0.00 C ATOM 1784 OG1 THR A 117 18.239 -12.863 2.331 1.00 0.00 O ATOM 1785 CG2 THR A 117 17.313 -13.859 4.330 1.00 0.00 C ATOM 0 H THR A 117 15.866 -11.799 2.402 1.00 0.00 H new ATOM 0 HA THR A 117 16.994 -11.339 5.053 1.00 0.00 H new ATOM 0 HB THR A 117 18.970 -12.498 4.217 1.00 0.00 H new ATOM 0 HG1 THR A 117 17.552 -12.399 1.808 1.00 0.00 H new ATOM 0 HG21 THR A 117 17.917 -14.748 4.149 1.00 0.00 H new ATOM 0 HG22 THR A 117 17.191 -13.715 5.404 1.00 0.00 H new ATOM 0 HG23 THR A 117 16.334 -13.985 3.868 1.00 0.00 H new ATOM 1793 N ASP A 118 19.128 -9.973 4.029 1.00 0.00 N ATOM 1794 CA ASP A 118 19.944 -8.789 3.806 1.00 0.00 C ATOM 1795 C ASP A 118 20.102 -8.490 2.325 1.00 0.00 C ATOM 1796 O ASP A 118 19.969 -7.361 1.916 1.00 0.00 O ATOM 1797 CB ASP A 118 21.326 -8.921 4.480 1.00 0.00 C ATOM 1798 CG ASP A 118 22.283 -9.885 3.794 1.00 0.00 C ATOM 1799 OD1 ASP A 118 23.446 -9.501 3.549 1.00 0.00 O ATOM 1800 OD2 ASP A 118 21.885 -11.028 3.467 1.00 0.00 O ATOM 0 H ASP A 118 19.595 -10.693 4.580 1.00 0.00 H new ATOM 0 HA ASP A 118 19.420 -7.951 4.265 1.00 0.00 H new ATOM 0 HB2 ASP A 118 21.791 -7.936 4.519 1.00 0.00 H new ATOM 0 HB3 ASP A 118 21.182 -9.246 5.510 1.00 0.00 H new ATOM 1805 N GLU A 119 20.319 -9.510 1.531 1.00 0.00 N ATOM 1806 CA GLU A 119 20.498 -9.337 0.107 1.00 0.00 C ATOM 1807 C GLU A 119 19.211 -8.915 -0.624 1.00 0.00 C ATOM 1808 O GLU A 119 19.278 -8.276 -1.677 1.00 0.00 O ATOM 1809 CB GLU A 119 21.177 -10.556 -0.516 1.00 0.00 C ATOM 1810 CG GLU A 119 20.557 -11.881 -0.147 1.00 0.00 C ATOM 1811 CD GLU A 119 21.316 -13.037 -0.728 1.00 0.00 C ATOM 1812 OE1 GLU A 119 20.905 -13.563 -1.791 1.00 0.00 O ATOM 1813 OE2 GLU A 119 22.334 -13.453 -0.140 1.00 0.00 O ATOM 0 H GLU A 119 20.377 -10.477 1.849 1.00 0.00 H new ATOM 0 HA GLU A 119 21.175 -8.493 -0.027 1.00 0.00 H new ATOM 0 HB2 GLU A 119 21.157 -10.451 -1.601 1.00 0.00 H new ATOM 0 HB3 GLU A 119 22.225 -10.564 -0.215 1.00 0.00 H new ATOM 0 HG2 GLU A 119 20.525 -11.977 0.938 1.00 0.00 H new ATOM 0 HG3 GLU A 119 19.526 -11.910 -0.500 1.00 0.00 H new ATOM 1820 N GLU A 120 18.048 -9.229 -0.065 1.00 0.00 N ATOM 1821 CA GLU A 120 16.804 -8.774 -0.675 1.00 0.00 C ATOM 1822 C GLU A 120 16.540 -7.340 -0.327 1.00 0.00 C ATOM 1823 O GLU A 120 16.235 -6.530 -1.201 1.00 0.00 O ATOM 1824 CB GLU A 120 15.573 -9.611 -0.324 1.00 0.00 C ATOM 1825 CG GLU A 120 15.496 -10.952 -1.004 1.00 0.00 C ATOM 1826 CD GLU A 120 16.411 -11.983 -0.422 1.00 0.00 C ATOM 1827 OE1 GLU A 120 16.263 -12.309 0.781 1.00 0.00 O ATOM 1828 OE2 GLU A 120 17.245 -12.539 -1.157 1.00 0.00 O ATOM 0 H GLU A 120 17.940 -9.781 0.786 1.00 0.00 H new ATOM 0 HA GLU A 120 16.960 -8.893 -1.747 1.00 0.00 H new ATOM 0 HB2 GLU A 120 15.554 -9.767 0.755 1.00 0.00 H new ATOM 0 HB3 GLU A 120 14.680 -9.040 -0.579 1.00 0.00 H new ATOM 0 HG2 GLU A 120 14.471 -11.318 -0.948 1.00 0.00 H new ATOM 0 HG3 GLU A 120 15.732 -10.826 -2.061 1.00 0.00 H new ATOM 1835 N VAL A 121 16.685 -7.011 0.948 1.00 0.00 N ATOM 1836 CA VAL A 121 16.443 -5.652 1.402 1.00 0.00 C ATOM 1837 C VAL A 121 17.487 -4.710 0.784 1.00 0.00 C ATOM 1838 O VAL A 121 17.178 -3.585 0.421 1.00 0.00 O ATOM 1839 CB VAL A 121 16.428 -5.534 2.965 1.00 0.00 C ATOM 1840 CG1 VAL A 121 15.449 -6.524 3.557 1.00 0.00 C ATOM 1841 CG2 VAL A 121 17.798 -5.738 3.576 1.00 0.00 C ATOM 0 H VAL A 121 16.967 -7.662 1.681 1.00 0.00 H new ATOM 0 HA VAL A 121 15.448 -5.359 1.066 1.00 0.00 H new ATOM 0 HB VAL A 121 16.114 -4.518 3.203 1.00 0.00 H new ATOM 0 HG11 VAL A 121 15.449 -6.431 4.643 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.449 -6.319 3.175 1.00 0.00 H new ATOM 0 HG13 VAL A 121 15.743 -7.536 3.280 1.00 0.00 H new ATOM 0 HG21 VAL A 121 17.730 -5.646 4.660 1.00 0.00 H new ATOM 0 HG22 VAL A 121 18.167 -6.731 3.319 1.00 0.00 H new ATOM 0 HG23 VAL A 121 18.484 -4.984 3.190 1.00 0.00 H new ATOM 1851 N ASP A 122 18.710 -5.225 0.620 1.00 0.00 N ATOM 1852 CA ASP A 122 19.814 -4.501 -0.014 1.00 0.00 C ATOM 1853 C ASP A 122 19.485 -4.192 -1.446 1.00 0.00 C ATOM 1854 O ASP A 122 19.703 -3.071 -1.910 1.00 0.00 O ATOM 1855 CB ASP A 122 21.099 -5.332 0.039 1.00 0.00 C ATOM 1856 CG ASP A 122 22.226 -4.765 -0.790 1.00 0.00 C ATOM 1857 OD1 ASP A 122 22.922 -3.844 -0.329 1.00 0.00 O ATOM 1858 OD2 ASP A 122 22.470 -5.268 -1.907 1.00 0.00 O ATOM 0 H ASP A 122 18.962 -6.164 0.927 1.00 0.00 H new ATOM 0 HA ASP A 122 19.964 -3.569 0.531 1.00 0.00 H new ATOM 0 HB2 ASP A 122 21.427 -5.411 1.075 1.00 0.00 H new ATOM 0 HB3 ASP A 122 20.881 -6.343 -0.304 1.00 0.00 H new ATOM 1863 N GLU A 123 18.917 -5.175 -2.141 1.00 0.00 N ATOM 1864 CA GLU A 123 18.584 -4.998 -3.526 1.00 0.00 C ATOM 1865 C GLU A 123 17.487 -3.942 -3.638 1.00 0.00 C ATOM 1866 O GLU A 123 17.520 -3.072 -4.509 1.00 0.00 O ATOM 1867 CB GLU A 123 18.092 -6.301 -4.124 1.00 0.00 C ATOM 1868 CG GLU A 123 18.156 -6.318 -5.628 1.00 0.00 C ATOM 1869 CD GLU A 123 19.571 -6.480 -6.129 1.00 0.00 C ATOM 1870 OE1 GLU A 123 19.909 -7.564 -6.653 1.00 0.00 O ATOM 1871 OE2 GLU A 123 20.386 -5.559 -5.984 1.00 0.00 O ATOM 0 H GLU A 123 18.684 -6.091 -1.758 1.00 0.00 H new ATOM 0 HA GLU A 123 19.473 -4.679 -4.071 1.00 0.00 H new ATOM 0 HB2 GLU A 123 18.690 -7.124 -3.731 1.00 0.00 H new ATOM 0 HB3 GLU A 123 17.064 -6.474 -3.807 1.00 0.00 H new ATOM 0 HG2 GLU A 123 17.541 -7.133 -6.008 1.00 0.00 H new ATOM 0 HG3 GLU A 123 17.736 -5.392 -6.020 1.00 0.00 H new ATOM 1878 N MET A 124 16.535 -4.018 -2.718 1.00 0.00 N ATOM 1879 CA MET A 124 15.435 -3.074 -2.650 1.00 0.00 C ATOM 1880 C MET A 124 15.937 -1.661 -2.422 1.00 0.00 C ATOM 1881 O MET A 124 15.447 -0.721 -3.044 1.00 0.00 O ATOM 1882 CB MET A 124 14.409 -3.481 -1.589 1.00 0.00 C ATOM 1883 CG MET A 124 13.639 -4.737 -1.950 1.00 0.00 C ATOM 1884 SD MET A 124 12.376 -5.170 -0.743 1.00 0.00 S ATOM 1885 CE MET A 124 11.662 -6.605 -1.536 1.00 0.00 C ATOM 0 H MET A 124 16.506 -4.739 -1.997 1.00 0.00 H new ATOM 0 HA MET A 124 14.928 -3.092 -3.615 1.00 0.00 H new ATOM 0 HB2 MET A 124 14.921 -3.637 -0.640 1.00 0.00 H new ATOM 0 HB3 MET A 124 13.705 -2.662 -1.441 1.00 0.00 H new ATOM 0 HG2 MET A 124 13.169 -4.599 -2.924 1.00 0.00 H new ATOM 0 HG3 MET A 124 14.338 -5.568 -2.048 1.00 0.00 H new ATOM 0 HE1 MET A 124 10.984 -7.104 -0.843 1.00 0.00 H new ATOM 0 HE2 MET A 124 11.110 -6.294 -2.423 1.00 0.00 H new ATOM 0 HE3 MET A 124 12.456 -7.293 -1.826 1.00 0.00 H new ATOM 1895 N ILE A 125 16.927 -1.521 -1.558 1.00 0.00 N ATOM 1896 CA ILE A 125 17.546 -0.233 -1.312 1.00 0.00 C ATOM 1897 C ILE A 125 18.255 0.246 -2.567 1.00 0.00 C ATOM 1898 O ILE A 125 17.975 1.321 -3.056 1.00 0.00 O ATOM 1899 CB ILE A 125 18.571 -0.276 -0.135 1.00 0.00 C ATOM 1900 CG1 ILE A 125 17.889 -0.652 1.190 1.00 0.00 C ATOM 1901 CG2 ILE A 125 19.310 1.057 0.001 1.00 0.00 C ATOM 1902 CD1 ILE A 125 16.803 0.305 1.635 1.00 0.00 C ATOM 0 H ILE A 125 17.320 -2.288 -1.013 1.00 0.00 H new ATOM 0 HA ILE A 125 16.748 0.455 -1.035 1.00 0.00 H new ATOM 0 HB ILE A 125 19.302 -1.050 -0.368 1.00 0.00 H new ATOM 0 HG12 ILE A 125 17.459 -1.649 1.092 1.00 0.00 H new ATOM 0 HG13 ILE A 125 18.648 -0.708 1.971 1.00 0.00 H new ATOM 0 HG21 ILE A 125 20.017 0.998 0.828 1.00 0.00 H new ATOM 0 HG22 ILE A 125 19.849 1.270 -0.922 1.00 0.00 H new ATOM 0 HG23 ILE A 125 18.591 1.853 0.194 1.00 0.00 H new ATOM 0 HD11 ILE A 125 16.378 -0.040 2.578 1.00 0.00 H new ATOM 0 HD12 ILE A 125 17.228 1.300 1.770 1.00 0.00 H new ATOM 0 HD13 ILE A 125 16.020 0.345 0.878 1.00 0.00 H new ATOM 1914 N ARG A 126 19.117 -0.598 -3.108 1.00 0.00 N ATOM 1915 CA ARG A 126 19.949 -0.267 -4.268 1.00 0.00 C ATOM 1916 C ARG A 126 19.121 0.180 -5.470 1.00 0.00 C ATOM 1917 O ARG A 126 19.481 1.136 -6.164 1.00 0.00 O ATOM 1918 CB ARG A 126 20.805 -1.469 -4.648 1.00 0.00 C ATOM 1919 CG ARG A 126 21.767 -1.229 -5.800 1.00 0.00 C ATOM 1920 CD ARG A 126 22.546 -2.481 -6.095 1.00 0.00 C ATOM 1921 NE ARG A 126 23.535 -2.312 -7.159 1.00 0.00 N ATOM 1922 CZ ARG A 126 24.478 -3.211 -7.456 1.00 0.00 C ATOM 1923 NH1 ARG A 126 24.557 -4.355 -6.763 1.00 0.00 N ATOM 1924 NH2 ARG A 126 25.344 -2.960 -8.427 1.00 0.00 N ATOM 0 H ARG A 126 19.266 -1.544 -2.756 1.00 0.00 H new ATOM 0 HA ARG A 126 20.586 0.571 -3.983 1.00 0.00 H new ATOM 0 HB2 ARG A 126 21.377 -1.780 -3.774 1.00 0.00 H new ATOM 0 HB3 ARG A 126 20.147 -2.298 -4.910 1.00 0.00 H new ATOM 0 HG2 ARG A 126 21.214 -0.919 -6.687 1.00 0.00 H new ATOM 0 HG3 ARG A 126 22.450 -0.417 -5.550 1.00 0.00 H new ATOM 0 HD2 ARG A 126 23.052 -2.807 -5.187 1.00 0.00 H new ATOM 0 HD3 ARG A 126 21.853 -3.274 -6.376 1.00 0.00 H new ATOM 0 HE ARG A 126 23.503 -1.454 -7.709 1.00 0.00 H new ATOM 0 HH11 ARG A 126 23.897 -4.540 -6.008 1.00 0.00 H new ATOM 0 HH12 ARG A 126 25.277 -5.040 -6.991 1.00 0.00 H new ATOM 0 HH21 ARG A 126 25.289 -2.083 -8.945 1.00 0.00 H new ATOM 0 HH22 ARG A 126 26.065 -3.644 -8.657 1.00 0.00 H new ATOM 1938 N GLU A 127 18.015 -0.481 -5.699 1.00 0.00 N ATOM 1939 CA GLU A 127 17.172 -0.167 -6.836 1.00 0.00 C ATOM 1940 C GLU A 127 16.287 1.051 -6.602 1.00 0.00 C ATOM 1941 O GLU A 127 15.629 1.529 -7.520 1.00 0.00 O ATOM 1942 CB GLU A 127 16.361 -1.380 -7.244 1.00 0.00 C ATOM 1943 CG GLU A 127 17.225 -2.539 -7.716 1.00 0.00 C ATOM 1944 CD GLU A 127 18.019 -2.210 -8.955 1.00 0.00 C ATOM 1945 OE1 GLU A 127 17.602 -2.614 -10.057 1.00 0.00 O ATOM 1946 OE2 GLU A 127 19.073 -1.539 -8.856 1.00 0.00 O ATOM 0 H GLU A 127 17.672 -1.243 -5.114 1.00 0.00 H new ATOM 0 HA GLU A 127 17.832 0.102 -7.661 1.00 0.00 H new ATOM 0 HB2 GLU A 127 15.755 -1.706 -6.399 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.672 -1.099 -8.041 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.909 -2.825 -6.917 1.00 0.00 H new ATOM 0 HG3 GLU A 127 16.590 -3.402 -7.916 1.00 0.00 H new ATOM 1953 N ALA A 128 16.270 1.545 -5.391 1.00 0.00 N ATOM 1954 CA ALA A 128 15.506 2.726 -5.079 1.00 0.00 C ATOM 1955 C ALA A 128 16.445 3.917 -4.825 1.00 0.00 C ATOM 1956 O ALA A 128 16.051 5.074 -4.934 1.00 0.00 O ATOM 1957 CB ALA A 128 14.593 2.454 -3.901 1.00 0.00 C ATOM 0 H ALA A 128 16.778 1.146 -4.602 1.00 0.00 H new ATOM 0 HA ALA A 128 14.876 2.989 -5.929 1.00 0.00 H new ATOM 0 HB1 ALA A 128 14.019 3.351 -3.671 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.911 1.641 -4.149 1.00 0.00 H new ATOM 0 HB3 ALA A 128 15.191 2.174 -3.034 1.00 0.00 H new ATOM 1963 N ASP A 129 17.676 3.590 -4.474 1.00 0.00 N ATOM 1964 CA ASP A 129 18.773 4.539 -4.267 1.00 0.00 C ATOM 1965 C ASP A 129 19.223 5.101 -5.617 1.00 0.00 C ATOM 1966 O ASP A 129 19.954 4.451 -6.377 1.00 0.00 O ATOM 1967 CB ASP A 129 19.932 3.805 -3.539 1.00 0.00 C ATOM 1968 CG ASP A 129 21.246 4.566 -3.460 1.00 0.00 C ATOM 1969 OD1 ASP A 129 21.458 5.334 -2.513 1.00 0.00 O ATOM 1970 OD2 ASP A 129 22.121 4.352 -4.329 1.00 0.00 O ATOM 0 H ASP A 129 17.957 2.622 -4.318 1.00 0.00 H new ATOM 0 HA ASP A 129 18.448 5.377 -3.650 1.00 0.00 H new ATOM 0 HB2 ASP A 129 19.608 3.569 -2.525 1.00 0.00 H new ATOM 0 HB3 ASP A 129 20.112 2.857 -4.045 1.00 0.00 H new ATOM 1975 N ILE A 130 18.697 6.246 -5.949 1.00 0.00 N ATOM 1976 CA ILE A 130 18.959 6.892 -7.210 1.00 0.00 C ATOM 1977 C ILE A 130 20.261 7.708 -7.184 1.00 0.00 C ATOM 1978 O ILE A 130 21.111 7.565 -8.076 1.00 0.00 O ATOM 1979 CB ILE A 130 17.756 7.782 -7.671 1.00 0.00 C ATOM 1980 CG1 ILE A 130 16.469 6.929 -7.762 1.00 0.00 C ATOM 1981 CG2 ILE A 130 18.056 8.432 -9.029 1.00 0.00 C ATOM 1982 CD1 ILE A 130 15.219 7.705 -8.155 1.00 0.00 C ATOM 0 H ILE A 130 18.063 6.768 -5.343 1.00 0.00 H new ATOM 0 HA ILE A 130 19.085 6.094 -7.942 1.00 0.00 H new ATOM 0 HB ILE A 130 17.607 8.572 -6.935 1.00 0.00 H new ATOM 0 HG12 ILE A 130 16.628 6.131 -8.488 1.00 0.00 H new ATOM 0 HG13 ILE A 130 16.296 6.452 -6.797 1.00 0.00 H new ATOM 0 HG21 ILE A 130 17.209 9.047 -9.333 1.00 0.00 H new ATOM 0 HG22 ILE A 130 18.946 9.056 -8.945 1.00 0.00 H new ATOM 0 HG23 ILE A 130 18.227 7.655 -9.774 1.00 0.00 H new ATOM 0 HD11 ILE A 130 14.367 7.027 -8.194 1.00 0.00 H new ATOM 0 HD12 ILE A 130 15.028 8.485 -7.418 1.00 0.00 H new ATOM 0 HD13 ILE A 130 15.366 8.159 -9.135 1.00 0.00 H new ATOM 1994 N ASP A 131 20.434 8.536 -6.154 1.00 0.00 N ATOM 1995 CA ASP A 131 21.579 9.475 -6.122 1.00 0.00 C ATOM 1996 C ASP A 131 22.848 8.842 -5.541 1.00 0.00 C ATOM 1997 O ASP A 131 23.950 9.374 -5.691 1.00 0.00 O ATOM 1998 CB ASP A 131 21.206 10.750 -5.333 1.00 0.00 C ATOM 1999 CG ASP A 131 22.310 11.797 -5.320 1.00 0.00 C ATOM 2000 OD1 ASP A 131 22.995 11.967 -4.273 1.00 0.00 O ATOM 2001 OD2 ASP A 131 22.527 12.468 -6.357 1.00 0.00 O ATOM 0 H ASP A 131 19.817 8.584 -5.343 1.00 0.00 H new ATOM 0 HA ASP A 131 21.801 9.739 -7.156 1.00 0.00 H new ATOM 0 HB2 ASP A 131 20.306 11.187 -5.767 1.00 0.00 H new ATOM 0 HB3 ASP A 131 20.964 10.475 -4.306 1.00 0.00 H new ATOM 2006 N GLY A 132 22.709 7.692 -4.959 1.00 0.00 N ATOM 2007 CA GLY A 132 23.859 6.993 -4.453 1.00 0.00 C ATOM 2008 C GLY A 132 24.252 7.439 -3.069 1.00 0.00 C ATOM 2009 O GLY A 132 25.298 8.060 -2.878 1.00 0.00 O ATOM 0 H GLY A 132 21.818 7.215 -4.821 1.00 0.00 H new ATOM 0 HA2 GLY A 132 23.651 5.923 -4.439 1.00 0.00 H new ATOM 0 HA3 GLY A 132 24.699 7.146 -5.131 1.00 0.00 H new ATOM 2013 N ASP A 133 23.416 7.161 -2.114 1.00 0.00 N ATOM 2014 CA ASP A 133 23.702 7.480 -0.716 1.00 0.00 C ATOM 2015 C ASP A 133 23.888 6.171 0.031 1.00 0.00 C ATOM 2016 O ASP A 133 24.460 6.120 1.111 1.00 0.00 O ATOM 2017 CB ASP A 133 22.524 8.267 -0.099 1.00 0.00 C ATOM 2018 CG ASP A 133 22.794 8.830 1.299 1.00 0.00 C ATOM 2019 OD1 ASP A 133 23.265 9.993 1.394 1.00 0.00 O ATOM 2020 OD2 ASP A 133 22.501 8.155 2.326 1.00 0.00 O ATOM 0 H ASP A 133 22.514 6.708 -2.264 1.00 0.00 H new ATOM 0 HA ASP A 133 24.600 8.094 -0.646 1.00 0.00 H new ATOM 0 HB2 ASP A 133 22.267 9.091 -0.764 1.00 0.00 H new ATOM 0 HB3 ASP A 133 21.653 7.613 -0.051 1.00 0.00 H new ATOM 2025 N GLY A 134 23.434 5.094 -0.599 1.00 0.00 N ATOM 2026 CA GLY A 134 23.493 3.775 0.001 1.00 0.00 C ATOM 2027 C GLY A 134 22.218 3.519 0.760 1.00 0.00 C ATOM 2028 O GLY A 134 22.059 2.503 1.437 1.00 0.00 O ATOM 0 H GLY A 134 23.019 5.113 -1.531 1.00 0.00 H new ATOM 0 HA2 GLY A 134 23.629 3.017 -0.770 1.00 0.00 H new ATOM 0 HA3 GLY A 134 24.350 3.705 0.671 1.00 0.00 H new ATOM 2032 N GLN A 135 21.316 4.464 0.622 1.00 0.00 N ATOM 2033 CA GLN A 135 20.042 4.512 1.278 1.00 0.00 C ATOM 2034 C GLN A 135 19.111 5.268 0.369 1.00 0.00 C ATOM 2035 O GLN A 135 19.559 6.127 -0.386 1.00 0.00 O ATOM 2036 CB GLN A 135 20.171 5.240 2.617 1.00 0.00 C ATOM 2037 CG GLN A 135 20.885 4.435 3.696 1.00 0.00 C ATOM 2038 CD GLN A 135 21.303 5.261 4.884 1.00 0.00 C ATOM 2039 OE1 GLN A 135 21.714 6.488 4.642 1.00 0.00 O flip ATOM 2040 NE2 GLN A 135 21.316 4.773 6.024 1.00 0.00 N flip ATOM 0 H GLN A 135 21.468 5.266 0.010 1.00 0.00 H new ATOM 0 HA GLN A 135 19.666 3.508 1.476 1.00 0.00 H new ATOM 0 HB2 GLN A 135 20.709 6.175 2.460 1.00 0.00 H new ATOM 0 HB3 GLN A 135 19.175 5.502 2.973 1.00 0.00 H new ATOM 0 HG2 GLN A 135 20.229 3.633 4.034 1.00 0.00 H new ATOM 0 HG3 GLN A 135 21.767 3.964 3.263 1.00 0.00 H new ATOM 0 HE21 GLN A 135 20.990 3.818 6.174 1.00 0.00 H new ATOM 0 HE22 GLN A 135 21.653 5.326 6.812 1.00 0.00 H new ATOM 2049 N VAL A 136 17.857 4.970 0.436 1.00 0.00 N ATOM 2050 CA VAL A 136 16.883 5.584 -0.442 1.00 0.00 C ATOM 2051 C VAL A 136 16.041 6.655 0.266 1.00 0.00 C ATOM 2052 O VAL A 136 15.296 6.363 1.201 1.00 0.00 O ATOM 2053 CB VAL A 136 15.996 4.506 -1.155 1.00 0.00 C ATOM 2054 CG1 VAL A 136 15.665 3.365 -0.220 1.00 0.00 C ATOM 2055 CG2 VAL A 136 14.703 5.112 -1.651 1.00 0.00 C ATOM 0 H VAL A 136 17.466 4.297 1.095 1.00 0.00 H new ATOM 0 HA VAL A 136 17.442 6.108 -1.217 1.00 0.00 H new ATOM 0 HB VAL A 136 16.572 4.128 -1.999 1.00 0.00 H new ATOM 0 HG11 VAL A 136 15.049 2.633 -0.743 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.587 2.890 0.115 1.00 0.00 H new ATOM 0 HG13 VAL A 136 15.120 3.748 0.643 1.00 0.00 H new ATOM 0 HG21 VAL A 136 14.106 4.344 -2.142 1.00 0.00 H new ATOM 0 HG22 VAL A 136 14.146 5.521 -0.808 1.00 0.00 H new ATOM 0 HG23 VAL A 136 14.924 5.909 -2.361 1.00 0.00 H new ATOM 2065 N ASN A 137 16.179 7.882 -0.188 1.00 0.00 N ATOM 2066 CA ASN A 137 15.441 9.028 0.349 1.00 0.00 C ATOM 2067 C ASN A 137 14.014 9.048 -0.194 1.00 0.00 C ATOM 2068 O ASN A 137 13.723 8.415 -1.212 1.00 0.00 O ATOM 2069 CB ASN A 137 16.204 10.340 0.020 1.00 0.00 C ATOM 2070 CG ASN A 137 15.465 11.628 0.353 1.00 0.00 C ATOM 2071 OD1 ASN A 137 14.737 12.167 -0.485 1.00 0.00 O ATOM 2072 ND2 ASN A 137 15.638 12.129 1.545 1.00 0.00 N ATOM 0 H ASN A 137 16.812 8.125 -0.950 1.00 0.00 H new ATOM 0 HA ASN A 137 15.371 8.940 1.433 1.00 0.00 H new ATOM 0 HB2 ASN A 137 17.151 10.335 0.560 1.00 0.00 H new ATOM 0 HB3 ASN A 137 16.444 10.344 -1.043 1.00 0.00 H new ATOM 0 HD21 ASN A 137 15.164 12.993 1.809 1.00 0.00 H new ATOM 0 HD22 ASN A 137 16.247 11.657 2.213 1.00 0.00 H new ATOM 2079 N TYR A 138 13.135 9.774 0.483 1.00 0.00 N ATOM 2080 CA TYR A 138 11.730 9.854 0.128 1.00 0.00 C ATOM 2081 C TYR A 138 11.529 10.306 -1.314 1.00 0.00 C ATOM 2082 O TYR A 138 10.771 9.697 -2.051 1.00 0.00 O ATOM 2083 CB TYR A 138 10.969 10.771 1.093 1.00 0.00 C ATOM 2084 CG TYR A 138 9.500 10.865 0.773 1.00 0.00 C ATOM 2085 CD1 TYR A 138 8.954 12.018 0.239 1.00 0.00 C ATOM 2086 CD2 TYR A 138 8.667 9.782 0.969 1.00 0.00 C ATOM 2087 CE1 TYR A 138 7.618 12.081 -0.076 1.00 0.00 C ATOM 2088 CE2 TYR A 138 7.339 9.843 0.656 1.00 0.00 C ATOM 2089 CZ TYR A 138 6.818 10.993 0.135 1.00 0.00 C ATOM 2090 OH TYR A 138 5.486 11.058 -0.171 1.00 0.00 O ATOM 0 H TYR A 138 13.383 10.329 1.302 1.00 0.00 H new ATOM 0 HA TYR A 138 11.322 8.847 0.214 1.00 0.00 H new ATOM 0 HB2 TYR A 138 11.091 10.401 2.111 1.00 0.00 H new ATOM 0 HB3 TYR A 138 11.408 11.768 1.061 1.00 0.00 H new ATOM 0 HD1 TYR A 138 9.584 12.878 0.068 1.00 0.00 H new ATOM 0 HD2 TYR A 138 9.073 8.869 1.378 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.201 12.988 -0.489 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.703 8.985 0.820 1.00 0.00 H new ATOM 0 HH TYR A 138 5.302 10.494 -0.951 1.00 0.00 H new ATOM 2100 N GLU A 139 12.252 11.326 -1.720 1.00 0.00 N ATOM 2101 CA GLU A 139 12.138 11.860 -3.061 1.00 0.00 C ATOM 2102 C GLU A 139 12.630 10.883 -4.123 1.00 0.00 C ATOM 2103 O GLU A 139 12.260 10.977 -5.286 1.00 0.00 O ATOM 2104 CB GLU A 139 12.831 13.195 -3.163 1.00 0.00 C ATOM 2105 CG GLU A 139 12.107 14.298 -2.418 1.00 0.00 C ATOM 2106 CD GLU A 139 10.711 14.539 -2.961 1.00 0.00 C ATOM 2107 OE1 GLU A 139 9.722 14.115 -2.332 1.00 0.00 O ATOM 2108 OE2 GLU A 139 10.585 15.176 -4.036 1.00 0.00 O ATOM 0 H GLU A 139 12.933 11.808 -1.133 1.00 0.00 H new ATOM 0 HA GLU A 139 11.077 12.013 -3.260 1.00 0.00 H new ATOM 0 HB2 GLU A 139 13.844 13.103 -2.770 1.00 0.00 H new ATOM 0 HB3 GLU A 139 12.921 13.472 -4.213 1.00 0.00 H new ATOM 0 HG2 GLU A 139 12.044 14.039 -1.361 1.00 0.00 H new ATOM 0 HG3 GLU A 139 12.685 15.220 -2.486 1.00 0.00 H new ATOM 2115 N GLU A 140 13.447 9.953 -3.724 1.00 0.00 N ATOM 2116 CA GLU A 140 13.904 8.925 -4.622 1.00 0.00 C ATOM 2117 C GLU A 140 12.862 7.814 -4.657 1.00 0.00 C ATOM 2118 O GLU A 140 12.542 7.253 -5.713 1.00 0.00 O ATOM 2119 CB GLU A 140 15.237 8.373 -4.144 1.00 0.00 C ATOM 2120 CG GLU A 140 16.321 9.419 -4.029 1.00 0.00 C ATOM 2121 CD GLU A 140 17.597 8.855 -3.498 1.00 0.00 C ATOM 2122 OE1 GLU A 140 17.810 8.887 -2.270 1.00 0.00 O ATOM 2123 OE2 GLU A 140 18.413 8.381 -4.286 1.00 0.00 O ATOM 0 H GLU A 140 13.815 9.882 -2.775 1.00 0.00 H new ATOM 0 HA GLU A 140 14.040 9.338 -5.622 1.00 0.00 H new ATOM 0 HB2 GLU A 140 15.097 7.899 -3.172 1.00 0.00 H new ATOM 0 HB3 GLU A 140 15.566 7.595 -4.833 1.00 0.00 H new ATOM 0 HG2 GLU A 140 16.502 9.861 -5.009 1.00 0.00 H new ATOM 0 HG3 GLU A 140 15.981 10.222 -3.375 1.00 0.00 H new ATOM 2130 N PHE A 141 12.286 7.543 -3.499 1.00 0.00 N ATOM 2131 CA PHE A 141 11.326 6.483 -3.362 1.00 0.00 C ATOM 2132 C PHE A 141 9.965 6.837 -3.968 1.00 0.00 C ATOM 2133 O PHE A 141 9.227 5.936 -4.375 1.00 0.00 O ATOM 2134 CB PHE A 141 11.192 6.003 -1.905 1.00 0.00 C ATOM 2135 CG PHE A 141 10.292 4.805 -1.778 1.00 0.00 C ATOM 2136 CD1 PHE A 141 9.110 4.855 -1.054 1.00 0.00 C ATOM 2137 CD2 PHE A 141 10.623 3.631 -2.430 1.00 0.00 C ATOM 2138 CE1 PHE A 141 8.285 3.747 -0.982 1.00 0.00 C ATOM 2139 CE2 PHE A 141 9.813 2.533 -2.363 1.00 0.00 C ATOM 2140 CZ PHE A 141 8.639 2.585 -1.640 1.00 0.00 C ATOM 0 H PHE A 141 12.475 8.054 -2.636 1.00 0.00 H new ATOM 0 HA PHE A 141 11.717 5.647 -3.941 1.00 0.00 H new ATOM 0 HB2 PHE A 141 12.179 5.756 -1.514 1.00 0.00 H new ATOM 0 HB3 PHE A 141 10.801 6.815 -1.292 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.832 5.765 -0.543 1.00 0.00 H new ATOM 0 HD2 PHE A 141 11.538 3.581 -3.002 1.00 0.00 H new ATOM 0 HE1 PHE A 141 7.368 3.790 -0.414 1.00 0.00 H new ATOM 0 HE2 PHE A 141 10.092 1.624 -2.876 1.00 0.00 H new ATOM 0 HZ PHE A 141 7.997 1.718 -1.589 1.00 0.00 H new ATOM 2150 N VAL A 142 9.638 8.141 -4.065 1.00 0.00 N ATOM 2151 CA VAL A 142 8.370 8.558 -4.702 1.00 0.00 C ATOM 2152 C VAL A 142 8.278 8.013 -6.121 1.00 0.00 C ATOM 2153 O VAL A 142 7.203 7.754 -6.626 1.00 0.00 O ATOM 2154 CB VAL A 142 8.113 10.102 -4.714 1.00 0.00 C ATOM 2155 CG1 VAL A 142 8.004 10.647 -3.313 1.00 0.00 C ATOM 2156 CG2 VAL A 142 9.163 10.860 -5.507 1.00 0.00 C ATOM 0 H VAL A 142 10.216 8.907 -3.721 1.00 0.00 H new ATOM 0 HA VAL A 142 7.589 8.130 -4.074 1.00 0.00 H new ATOM 0 HB VAL A 142 7.159 10.255 -5.219 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.826 11.722 -3.353 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.176 10.161 -2.797 1.00 0.00 H new ATOM 0 HG13 VAL A 142 8.931 10.453 -2.774 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.938 11.926 -5.483 1.00 0.00 H new ATOM 0 HG22 VAL A 142 10.146 10.687 -5.068 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.161 10.512 -6.540 1.00 0.00 H new ATOM 2166 N GLN A 143 9.432 7.808 -6.738 1.00 0.00 N ATOM 2167 CA GLN A 143 9.505 7.230 -8.045 1.00 0.00 C ATOM 2168 C GLN A 143 9.312 5.720 -7.934 1.00 0.00 C ATOM 2169 O GLN A 143 8.299 5.190 -8.352 1.00 0.00 O ATOM 2170 CB GLN A 143 10.868 7.523 -8.682 1.00 0.00 C ATOM 2171 CG GLN A 143 10.988 7.072 -10.126 1.00 0.00 C ATOM 2172 CD GLN A 143 12.371 7.280 -10.691 1.00 0.00 C ATOM 2173 OE1 GLN A 143 12.680 8.346 -11.214 1.00 0.00 O ATOM 2174 NE2 GLN A 143 13.190 6.267 -10.650 1.00 0.00 N ATOM 0 H GLN A 143 10.339 8.043 -6.334 1.00 0.00 H new ATOM 0 HA GLN A 143 8.724 7.662 -8.671 1.00 0.00 H new ATOM 0 HB2 GLN A 143 11.058 8.595 -8.631 1.00 0.00 H new ATOM 0 HB3 GLN A 143 11.644 7.033 -8.094 1.00 0.00 H new ATOM 0 HG2 GLN A 143 10.728 6.016 -10.195 1.00 0.00 H new ATOM 0 HG3 GLN A 143 10.266 7.618 -10.734 1.00 0.00 H new ATOM 0 HE21 GLN A 143 12.901 5.395 -10.207 1.00 0.00 H new ATOM 0 HE22 GLN A 143 14.120 6.346 -11.061 1.00 0.00 H new ATOM 2183 N MET A 144 10.259 5.073 -7.259 1.00 0.00 N ATOM 2184 CA MET A 144 10.370 3.599 -7.181 1.00 0.00 C ATOM 2185 C MET A 144 9.125 2.896 -6.626 1.00 0.00 C ATOM 2186 O MET A 144 8.857 1.742 -6.964 1.00 0.00 O ATOM 2187 CB MET A 144 11.595 3.218 -6.367 1.00 0.00 C ATOM 2188 CG MET A 144 11.894 1.727 -6.345 1.00 0.00 C ATOM 2189 SD MET A 144 12.270 1.080 -7.981 1.00 0.00 S ATOM 2190 CE MET A 144 12.527 -0.641 -7.592 1.00 0.00 C ATOM 0 H MET A 144 10.989 5.558 -6.738 1.00 0.00 H new ATOM 0 HA MET A 144 10.468 3.250 -8.209 1.00 0.00 H new ATOM 0 HB2 MET A 144 12.461 3.744 -6.768 1.00 0.00 H new ATOM 0 HB3 MET A 144 11.458 3.564 -5.343 1.00 0.00 H new ATOM 0 HG2 MET A 144 12.736 1.538 -5.680 1.00 0.00 H new ATOM 0 HG3 MET A 144 11.037 1.193 -5.934 1.00 0.00 H new ATOM 0 HE1 MET A 144 13.023 -1.133 -8.429 1.00 0.00 H new ATOM 0 HE2 MET A 144 13.150 -0.724 -6.701 1.00 0.00 H new ATOM 0 HE3 MET A 144 11.565 -1.120 -7.408 1.00 0.00 H new ATOM 2200 N MET A 145 8.387 3.582 -5.778 1.00 0.00 N ATOM 2201 CA MET A 145 7.177 3.030 -5.179 1.00 0.00 C ATOM 2202 C MET A 145 6.198 2.599 -6.276 1.00 0.00 C ATOM 2203 O MET A 145 5.738 1.447 -6.314 1.00 0.00 O ATOM 2204 CB MET A 145 6.543 4.089 -4.260 1.00 0.00 C ATOM 2205 CG MET A 145 5.400 3.601 -3.371 1.00 0.00 C ATOM 2206 SD MET A 145 3.886 3.173 -4.252 1.00 0.00 S ATOM 2207 CE MET A 145 2.900 2.630 -2.879 1.00 0.00 C ATOM 0 H MET A 145 8.603 4.534 -5.482 1.00 0.00 H new ATOM 0 HA MET A 145 7.425 2.150 -4.586 1.00 0.00 H new ATOM 0 HB2 MET A 145 7.324 4.502 -3.621 1.00 0.00 H new ATOM 0 HB3 MET A 145 6.173 4.906 -4.880 1.00 0.00 H new ATOM 0 HG2 MET A 145 5.739 2.727 -2.814 1.00 0.00 H new ATOM 0 HG3 MET A 145 5.171 4.376 -2.639 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.183 1.883 -3.219 1.00 0.00 H new ATOM 0 HE2 MET A 145 3.546 2.193 -2.117 1.00 0.00 H new ATOM 0 HE3 MET A 145 2.365 3.480 -2.456 1.00 0.00 H new ATOM 2217 N THR A 146 5.919 3.492 -7.189 1.00 0.00 N ATOM 2218 CA THR A 146 4.979 3.197 -8.226 1.00 0.00 C ATOM 2219 C THR A 146 5.711 2.807 -9.531 1.00 0.00 C ATOM 2220 O THR A 146 5.328 1.841 -10.207 1.00 0.00 O ATOM 2221 CB THR A 146 4.057 4.412 -8.436 1.00 0.00 C ATOM 2222 OG1 THR A 146 3.552 4.833 -7.144 1.00 0.00 O ATOM 2223 CG2 THR A 146 2.879 4.061 -9.337 1.00 0.00 C ATOM 0 H THR A 146 6.330 4.425 -7.232 1.00 0.00 H new ATOM 0 HA THR A 146 4.368 2.343 -7.933 1.00 0.00 H new ATOM 0 HB THR A 146 4.628 5.209 -8.913 1.00 0.00 H new ATOM 0 HG1 THR A 146 3.687 4.115 -6.490 1.00 0.00 H new ATOM 0 HG21 THR A 146 2.246 4.939 -9.467 1.00 0.00 H new ATOM 0 HG22 THR A 146 3.249 3.734 -10.309 1.00 0.00 H new ATOM 0 HG23 THR A 146 2.298 3.259 -8.881 1.00 0.00 H new ATOM 2231 N ALA A 147 6.807 3.486 -9.810 1.00 0.00 N ATOM 2232 CA ALA A 147 7.607 3.257 -10.998 1.00 0.00 C ATOM 2233 C ALA A 147 8.721 2.301 -10.665 1.00 0.00 C ATOM 2234 O ALA A 147 9.688 2.677 -10.007 1.00 0.00 O ATOM 2235 CB ALA A 147 8.198 4.570 -11.495 1.00 0.00 C ATOM 0 H ALA A 147 7.172 4.224 -9.208 1.00 0.00 H new ATOM 0 HA ALA A 147 6.976 2.836 -11.780 1.00 0.00 H new ATOM 0 HB1 ALA A 147 8.796 4.385 -12.387 1.00 0.00 H new ATOM 0 HB2 ALA A 147 7.392 5.264 -11.736 1.00 0.00 H new ATOM 0 HB3 ALA A 147 8.829 5.002 -10.718 1.00 0.00 H new ATOM 2241 N LYS A 148 8.588 1.082 -11.085 1.00 0.00 N ATOM 2242 CA LYS A 148 9.567 0.076 -10.765 1.00 0.00 C ATOM 2243 C LYS A 148 10.348 -0.246 -12.018 1.00 0.00 C ATOM 2244 O LYS A 148 9.971 -1.178 -12.745 1.00 0.00 O ATOM 2245 CB LYS A 148 8.856 -1.173 -10.225 1.00 0.00 C ATOM 2246 CG LYS A 148 7.838 -0.849 -9.144 1.00 0.00 C ATOM 2247 CD LYS A 148 7.088 -2.072 -8.667 1.00 0.00 C ATOM 2248 CE LYS A 148 5.867 -1.665 -7.856 1.00 0.00 C ATOM 2249 NZ LYS A 148 4.902 -0.882 -8.681 1.00 0.00 N ATOM 2250 OXT LYS A 148 11.301 0.473 -12.337 1.00 0.00 O ATOM 0 H LYS A 148 7.808 0.752 -11.654 1.00 0.00 H new ATOM 0 HA LYS A 148 10.253 0.435 -9.998 1.00 0.00 H new ATOM 0 HB2 LYS A 148 8.356 -1.685 -11.047 1.00 0.00 H new ATOM 0 HB3 LYS A 148 9.598 -1.863 -9.824 1.00 0.00 H new ATOM 0 HG2 LYS A 148 8.346 -0.386 -8.298 1.00 0.00 H new ATOM 0 HG3 LYS A 148 7.127 -0.118 -9.527 1.00 0.00 H new ATOM 0 HD2 LYS A 148 6.780 -2.674 -9.522 1.00 0.00 H new ATOM 0 HD3 LYS A 148 7.745 -2.695 -8.059 1.00 0.00 H new ATOM 0 HE2 LYS A 148 5.375 -2.555 -7.465 1.00 0.00 H new ATOM 0 HE3 LYS A 148 6.180 -1.071 -6.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 3.980 -0.852 -8.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 5.259 0.087 -8.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 4.794 -1.334 -9.611 1.00 0.00 H new TER 2264 LYS A 148 ATOM 2265 N SER B 74 22.477 -7.774 -5.913 1.00 0.00 N ATOM 2266 CA SER B 74 23.077 -7.972 -7.205 1.00 0.00 C ATOM 2267 C SER B 74 22.303 -9.007 -8.071 1.00 0.00 C ATOM 2268 O SER B 74 21.964 -8.699 -9.201 1.00 0.00 O ATOM 2269 CB SER B 74 24.570 -8.289 -7.059 1.00 0.00 C ATOM 2270 OG SER B 74 25.230 -7.238 -6.341 1.00 0.00 O ATOM 0 HA SER B 74 23.002 -7.037 -7.761 1.00 0.00 H new ATOM 0 HB2 SER B 74 24.699 -9.235 -6.534 1.00 0.00 H new ATOM 0 HB3 SER B 74 25.022 -8.407 -8.044 1.00 0.00 H new ATOM 0 HG SER B 74 24.590 -6.799 -5.742 1.00 0.00 H new ATOM 2278 N PRO B 75 21.983 -10.252 -7.582 1.00 0.00 N ATOM 2279 CA PRO B 75 21.232 -11.200 -8.386 1.00 0.00 C ATOM 2280 C PRO B 75 19.739 -11.255 -8.008 1.00 0.00 C ATOM 2281 O PRO B 75 19.020 -12.165 -8.428 1.00 0.00 O ATOM 2282 CB PRO B 75 21.917 -12.528 -8.037 1.00 0.00 C ATOM 2283 CG PRO B 75 22.479 -12.342 -6.644 1.00 0.00 C ATOM 2284 CD PRO B 75 22.362 -10.869 -6.296 1.00 0.00 C ATOM 0 HA PRO B 75 21.237 -10.944 -9.445 1.00 0.00 H new ATOM 0 HB2 PRO B 75 21.207 -13.355 -8.066 1.00 0.00 H new ATOM 0 HB3 PRO B 75 22.707 -12.761 -8.751 1.00 0.00 H new ATOM 0 HG2 PRO B 75 21.930 -12.950 -5.925 1.00 0.00 H new ATOM 0 HG3 PRO B 75 23.520 -12.663 -6.605 1.00 0.00 H new ATOM 0 HD2 PRO B 75 21.609 -10.695 -5.527 1.00 0.00 H new ATOM 0 HD3 PRO B 75 23.302 -10.468 -5.918 1.00 0.00 H new ATOM 2292 N ALA B 76 19.273 -10.282 -7.242 1.00 0.00 N ATOM 2293 CA ALA B 76 17.902 -10.296 -6.781 1.00 0.00 C ATOM 2294 C ALA B 76 17.026 -9.428 -7.658 1.00 0.00 C ATOM 2295 O ALA B 76 15.874 -9.751 -7.896 1.00 0.00 O ATOM 2296 CB ALA B 76 17.808 -9.884 -5.320 1.00 0.00 C ATOM 0 H ALA B 76 19.822 -9.481 -6.931 1.00 0.00 H new ATOM 0 HA ALA B 76 17.534 -11.319 -6.856 1.00 0.00 H new ATOM 0 HB1 ALA B 76 16.765 -9.904 -5.003 1.00 0.00 H new ATOM 0 HB2 ALA B 76 18.387 -10.576 -4.709 1.00 0.00 H new ATOM 0 HB3 ALA B 76 18.204 -8.876 -5.200 1.00 0.00 H new ATOM 2302 N ASN B 77 17.588 -8.348 -8.181 1.00 0.00 N ATOM 2303 CA ASN B 77 16.828 -7.442 -9.061 1.00 0.00 C ATOM 2304 C ASN B 77 16.666 -8.048 -10.443 1.00 0.00 C ATOM 2305 O ASN B 77 15.901 -7.560 -11.269 1.00 0.00 O ATOM 2306 CB ASN B 77 17.471 -6.038 -9.168 1.00 0.00 C ATOM 2307 CG ASN B 77 18.809 -6.003 -9.902 1.00 0.00 C ATOM 2308 OD1 ASN B 77 19.574 -6.969 -9.895 1.00 0.00 O ATOM 2309 ND2 ASN B 77 19.120 -4.886 -10.500 1.00 0.00 N ATOM 0 H ASN B 77 18.556 -8.071 -8.020 1.00 0.00 H new ATOM 0 HA ASN B 77 15.846 -7.315 -8.605 1.00 0.00 H new ATOM 0 HB2 ASN B 77 16.775 -5.372 -9.678 1.00 0.00 H new ATOM 0 HB3 ASN B 77 17.613 -5.641 -8.163 1.00 0.00 H new ATOM 0 HD21 ASN B 77 20.016 -4.796 -10.978 1.00 0.00 H new ATOM 0 HD22 ASN B 77 18.467 -4.103 -10.489 1.00 0.00 H new ATOM 2316 N SER B 78 17.391 -9.106 -10.673 1.00 0.00 N ATOM 2317 CA SER B 78 17.379 -9.807 -11.913 1.00 0.00 C ATOM 2318 C SER B 78 16.047 -10.558 -12.137 1.00 0.00 C ATOM 2319 O SER B 78 15.477 -10.499 -13.227 1.00 0.00 O ATOM 2320 CB SER B 78 18.559 -10.765 -11.916 1.00 0.00 C ATOM 2321 OG SER B 78 19.745 -10.067 -11.533 1.00 0.00 O ATOM 0 H SER B 78 18.021 -9.511 -9.981 1.00 0.00 H new ATOM 0 HA SER B 78 17.467 -9.097 -12.736 1.00 0.00 H new ATOM 0 HB2 SER B 78 18.372 -11.590 -11.228 1.00 0.00 H new ATOM 0 HB3 SER B 78 18.685 -11.199 -12.908 1.00 0.00 H new ATOM 0 HG SER B 78 20.504 -10.687 -11.534 1.00 0.00 H new ATOM 2327 N PHE B 79 15.539 -11.235 -11.110 1.00 0.00 N ATOM 2328 CA PHE B 79 14.320 -12.034 -11.254 1.00 0.00 C ATOM 2329 C PHE B 79 13.485 -11.963 -9.992 1.00 0.00 C ATOM 2330 O PHE B 79 14.037 -11.919 -8.890 1.00 0.00 O ATOM 2331 CB PHE B 79 14.650 -13.518 -11.530 1.00 0.00 C ATOM 2332 CG PHE B 79 15.407 -13.789 -12.802 1.00 0.00 C ATOM 2333 CD1 PHE B 79 16.781 -13.973 -12.785 1.00 0.00 C ATOM 2334 CD2 PHE B 79 14.743 -13.861 -14.012 1.00 0.00 C ATOM 2335 CE1 PHE B 79 17.475 -14.223 -13.953 1.00 0.00 C ATOM 2336 CE2 PHE B 79 15.428 -14.109 -15.182 1.00 0.00 C ATOM 2337 CZ PHE B 79 16.798 -14.289 -15.153 1.00 0.00 C ATOM 0 H PHE B 79 15.947 -11.248 -10.175 1.00 0.00 H new ATOM 0 HA PHE B 79 13.766 -11.622 -12.097 1.00 0.00 H new ATOM 0 HB2 PHE B 79 15.231 -13.904 -10.693 1.00 0.00 H new ATOM 0 HB3 PHE B 79 13.717 -14.081 -11.557 1.00 0.00 H new ATOM 0 HD1 PHE B 79 17.315 -13.920 -11.848 1.00 0.00 H new ATOM 0 HD2 PHE B 79 13.673 -13.721 -14.041 1.00 0.00 H new ATOM 0 HE1 PHE B 79 18.545 -14.366 -13.927 1.00 0.00 H new ATOM 0 HE2 PHE B 79 14.895 -14.163 -16.120 1.00 0.00 H new ATOM 0 HZ PHE B 79 17.338 -14.481 -16.069 1.00 0.00 H new ATOM 2347 N HIS B 80 12.154 -11.903 -10.168 1.00 0.00 N ATOM 2348 CA HIS B 80 11.159 -11.960 -9.066 1.00 0.00 C ATOM 2349 C HIS B 80 11.156 -10.668 -8.213 1.00 0.00 C ATOM 2350 O HIS B 80 10.385 -10.529 -7.264 1.00 0.00 O ATOM 2351 CB HIS B 80 11.389 -13.251 -8.221 1.00 0.00 C ATOM 2352 CG HIS B 80 10.381 -13.553 -7.145 1.00 0.00 C ATOM 2353 ND1 HIS B 80 9.254 -14.316 -7.360 1.00 0.00 N ATOM 2354 CD2 HIS B 80 10.366 -13.234 -5.831 1.00 0.00 C ATOM 2355 CE1 HIS B 80 8.598 -14.450 -6.233 1.00 0.00 C ATOM 2356 NE2 HIS B 80 9.250 -13.805 -5.290 1.00 0.00 N ATOM 0 H HIS B 80 11.726 -11.812 -11.089 1.00 0.00 H new ATOM 0 HA HIS B 80 10.159 -12.016 -9.496 1.00 0.00 H new ATOM 0 HB2 HIS B 80 11.421 -14.101 -8.903 1.00 0.00 H new ATOM 0 HB3 HIS B 80 12.371 -13.180 -7.754 1.00 0.00 H new ATOM 0 HD2 HIS B 80 11.100 -12.639 -5.307 1.00 0.00 H new ATOM 0 HE1 HIS B 80 7.677 -14.998 -6.101 1.00 0.00 H new ATOM 0 HE2 HIS B 80 8.967 -13.742 -4.312 1.00 0.00 H new ATOM 2365 N PHE B 81 11.949 -9.711 -8.619 1.00 0.00 N ATOM 2366 CA PHE B 81 12.109 -8.459 -7.907 1.00 0.00 C ATOM 2367 C PHE B 81 10.893 -7.568 -8.139 1.00 0.00 C ATOM 2368 O PHE B 81 10.492 -6.773 -7.270 1.00 0.00 O ATOM 2369 CB PHE B 81 13.378 -7.783 -8.388 1.00 0.00 C ATOM 2370 CG PHE B 81 13.758 -6.559 -7.625 1.00 0.00 C ATOM 2371 CD1 PHE B 81 14.253 -6.664 -6.337 1.00 0.00 C ATOM 2372 CD2 PHE B 81 13.641 -5.307 -8.196 1.00 0.00 C ATOM 2373 CE1 PHE B 81 14.623 -5.545 -5.635 1.00 0.00 C ATOM 2374 CE2 PHE B 81 14.006 -4.185 -7.498 1.00 0.00 C ATOM 2375 CZ PHE B 81 14.499 -4.305 -6.214 1.00 0.00 C ATOM 0 H PHE B 81 12.513 -9.775 -9.466 1.00 0.00 H new ATOM 0 HA PHE B 81 12.188 -8.644 -6.836 1.00 0.00 H new ATOM 0 HB2 PHE B 81 14.198 -8.499 -8.333 1.00 0.00 H new ATOM 0 HB3 PHE B 81 13.257 -7.517 -9.438 1.00 0.00 H new ATOM 0 HD1 PHE B 81 14.349 -7.638 -5.879 1.00 0.00 H new ATOM 0 HD2 PHE B 81 13.259 -5.211 -9.201 1.00 0.00 H new ATOM 0 HE1 PHE B 81 15.010 -5.638 -4.631 1.00 0.00 H new ATOM 0 HE2 PHE B 81 13.908 -3.210 -7.951 1.00 0.00 H new ATOM 0 HZ PHE B 81 14.788 -3.422 -5.663 1.00 0.00 H new ATOM 2385 N LYS B 82 10.307 -7.733 -9.302 1.00 0.00 N ATOM 2386 CA LYS B 82 9.093 -7.052 -9.691 1.00 0.00 C ATOM 2387 C LYS B 82 7.975 -7.425 -8.722 1.00 0.00 C ATOM 2388 O LYS B 82 7.305 -6.552 -8.153 1.00 0.00 O ATOM 2389 CB LYS B 82 8.754 -7.460 -11.129 1.00 0.00 C ATOM 2390 CG LYS B 82 7.435 -6.951 -11.697 1.00 0.00 C ATOM 2391 CD LYS B 82 7.339 -7.356 -13.156 1.00 0.00 C ATOM 2392 CE LYS B 82 6.001 -7.032 -13.799 1.00 0.00 C ATOM 2393 NZ LYS B 82 4.872 -7.813 -13.238 1.00 0.00 N ATOM 0 H LYS B 82 10.669 -8.359 -10.021 1.00 0.00 H new ATOM 0 HA LYS B 82 9.219 -5.970 -9.654 1.00 0.00 H new ATOM 0 HB2 LYS B 82 9.559 -7.115 -11.778 1.00 0.00 H new ATOM 0 HB3 LYS B 82 8.748 -8.549 -11.180 1.00 0.00 H new ATOM 0 HG2 LYS B 82 6.598 -7.365 -11.135 1.00 0.00 H new ATOM 0 HG3 LYS B 82 7.377 -5.867 -11.602 1.00 0.00 H new ATOM 0 HD2 LYS B 82 8.130 -6.855 -13.714 1.00 0.00 H new ATOM 0 HD3 LYS B 82 7.520 -8.428 -13.238 1.00 0.00 H new ATOM 0 HE2 LYS B 82 5.795 -5.969 -13.675 1.00 0.00 H new ATOM 0 HE3 LYS B 82 6.066 -7.221 -14.871 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 4.046 -7.727 -13.863 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 5.146 -8.813 -13.162 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 4.632 -7.447 -12.295 1.00 0.00 H new ATOM 2407 N GLU B 83 7.823 -8.726 -8.486 1.00 0.00 N ATOM 2408 CA GLU B 83 6.816 -9.217 -7.559 1.00 0.00 C ATOM 2409 C GLU B 83 7.206 -8.889 -6.118 1.00 0.00 C ATOM 2410 O GLU B 83 6.338 -8.747 -5.246 1.00 0.00 O ATOM 2411 CB GLU B 83 6.575 -10.732 -7.678 1.00 0.00 C ATOM 2412 CG GLU B 83 6.260 -11.251 -9.074 1.00 0.00 C ATOM 2413 CD GLU B 83 7.494 -11.520 -9.879 1.00 0.00 C ATOM 2414 OE1 GLU B 83 8.060 -12.612 -9.732 1.00 0.00 O ATOM 2415 OE2 GLU B 83 7.916 -10.656 -10.670 1.00 0.00 O ATOM 0 H GLU B 83 8.385 -9.455 -8.925 1.00 0.00 H new ATOM 0 HA GLU B 83 5.889 -8.710 -7.826 1.00 0.00 H new ATOM 0 HB2 GLU B 83 7.461 -11.250 -7.311 1.00 0.00 H new ATOM 0 HB3 GLU B 83 5.751 -11.002 -7.017 1.00 0.00 H new ATOM 0 HG2 GLU B 83 5.676 -12.168 -8.994 1.00 0.00 H new ATOM 0 HG3 GLU B 83 5.640 -10.523 -9.597 1.00 0.00 H new ATOM 2422 N ALA B 84 8.503 -8.771 -5.873 1.00 0.00 N ATOM 2423 CA ALA B 84 9.020 -8.453 -4.553 1.00 0.00 C ATOM 2424 C ALA B 84 8.541 -7.081 -4.096 1.00 0.00 C ATOM 2425 O ALA B 84 7.956 -6.959 -3.022 1.00 0.00 O ATOM 2426 CB ALA B 84 10.539 -8.539 -4.516 1.00 0.00 C ATOM 0 H ALA B 84 9.224 -8.893 -6.584 1.00 0.00 H new ATOM 0 HA ALA B 84 8.630 -9.197 -3.858 1.00 0.00 H new ATOM 0 HB1 ALA B 84 10.893 -8.295 -3.514 1.00 0.00 H new ATOM 0 HB2 ALA B 84 10.853 -9.550 -4.776 1.00 0.00 H new ATOM 0 HB3 ALA B 84 10.961 -7.833 -5.232 1.00 0.00 H new ATOM 2432 N TRP B 85 8.762 -6.054 -4.914 1.00 0.00 N ATOM 2433 CA TRP B 85 8.283 -4.704 -4.574 1.00 0.00 C ATOM 2434 C TRP B 85 6.777 -4.613 -4.589 1.00 0.00 C ATOM 2435 O TRP B 85 6.186 -3.903 -3.767 1.00 0.00 O ATOM 2436 CB TRP B 85 8.892 -3.615 -5.448 1.00 0.00 C ATOM 2437 CG TRP B 85 10.144 -3.037 -4.884 1.00 0.00 C ATOM 2438 CD1 TRP B 85 11.404 -3.183 -5.350 1.00 0.00 C ATOM 2439 CD2 TRP B 85 10.244 -2.220 -3.716 1.00 0.00 C ATOM 2440 NE1 TRP B 85 12.284 -2.484 -4.564 1.00 0.00 N ATOM 2441 CE2 TRP B 85 11.596 -1.891 -3.553 1.00 0.00 C ATOM 2442 CE3 TRP B 85 9.317 -1.728 -2.797 1.00 0.00 C ATOM 2443 CZ2 TRP B 85 12.049 -1.097 -2.514 1.00 0.00 C ATOM 2444 CZ3 TRP B 85 9.770 -0.944 -1.764 1.00 0.00 C ATOM 2445 CH2 TRP B 85 11.127 -0.635 -1.634 1.00 0.00 C ATOM 0 H TRP B 85 9.259 -6.121 -5.802 1.00 0.00 H new ATOM 0 HA TRP B 85 8.625 -4.527 -3.554 1.00 0.00 H new ATOM 0 HB2 TRP B 85 9.103 -4.027 -6.435 1.00 0.00 H new ATOM 0 HB3 TRP B 85 8.161 -2.818 -5.585 1.00 0.00 H new ATOM 0 HD1 TRP B 85 11.678 -3.766 -6.217 1.00 0.00 H new ATOM 0 HE1 TRP B 85 13.291 -2.420 -4.714 1.00 0.00 H new ATOM 0 HE3 TRP B 85 8.266 -1.958 -2.895 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 13.096 -0.855 -2.408 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.066 -0.560 -1.040 1.00 0.00 H new ATOM 0 HH2 TRP B 85 11.449 -0.013 -0.812 1.00 0.00 H new ATOM 2456 N LYS B 86 6.171 -5.342 -5.515 1.00 0.00 N ATOM 2457 CA LYS B 86 4.719 -5.439 -5.656 1.00 0.00 C ATOM 2458 C LYS B 86 4.126 -5.821 -4.313 1.00 0.00 C ATOM 2459 O LYS B 86 3.275 -5.123 -3.751 1.00 0.00 O ATOM 2460 CB LYS B 86 4.432 -6.559 -6.628 1.00 0.00 C ATOM 2461 CG LYS B 86 3.003 -6.687 -7.087 1.00 0.00 C ATOM 2462 CD LYS B 86 2.854 -7.928 -7.941 1.00 0.00 C ATOM 2463 CE LYS B 86 1.434 -8.122 -8.398 1.00 0.00 C ATOM 2464 NZ LYS B 86 1.275 -9.381 -9.137 1.00 0.00 N ATOM 0 H LYS B 86 6.681 -5.894 -6.204 1.00 0.00 H new ATOM 0 HA LYS B 86 4.299 -4.494 -6.001 1.00 0.00 H new ATOM 0 HB2 LYS B 86 5.064 -6.422 -7.506 1.00 0.00 H new ATOM 0 HB3 LYS B 86 4.729 -7.500 -6.165 1.00 0.00 H new ATOM 0 HG2 LYS B 86 2.337 -6.744 -6.226 1.00 0.00 H new ATOM 0 HG3 LYS B 86 2.713 -5.804 -7.657 1.00 0.00 H new ATOM 0 HD2 LYS B 86 3.509 -7.853 -8.809 1.00 0.00 H new ATOM 0 HD3 LYS B 86 3.176 -8.801 -7.373 1.00 0.00 H new ATOM 0 HE2 LYS B 86 0.769 -8.119 -7.534 1.00 0.00 H new ATOM 0 HE3 LYS B 86 1.137 -7.287 -9.032 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 0.270 -9.646 -9.158 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 1.621 -9.259 -10.110 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 1.821 -10.131 -8.667 1.00 0.00 H new ATOM 2478 N HIS B 87 4.625 -6.917 -3.800 1.00 0.00 N ATOM 2479 CA HIS B 87 4.208 -7.420 -2.505 1.00 0.00 C ATOM 2480 C HIS B 87 4.649 -6.529 -1.367 1.00 0.00 C ATOM 2481 O HIS B 87 3.898 -6.324 -0.461 1.00 0.00 O ATOM 2482 CB HIS B 87 4.660 -8.861 -2.252 1.00 0.00 C ATOM 2483 CG HIS B 87 3.881 -9.885 -3.005 1.00 0.00 C ATOM 2484 ND1 HIS B 87 4.348 -10.510 -4.128 1.00 0.00 N ATOM 2485 CD2 HIS B 87 2.655 -10.393 -2.782 1.00 0.00 C ATOM 2486 CE1 HIS B 87 3.446 -11.351 -4.568 1.00 0.00 C ATOM 2487 NE2 HIS B 87 2.408 -11.303 -3.772 1.00 0.00 N ATOM 0 H HIS B 87 5.331 -7.489 -4.263 1.00 0.00 H new ATOM 0 HA HIS B 87 3.118 -7.414 -2.537 1.00 0.00 H new ATOM 0 HB2 HIS B 87 5.713 -8.952 -2.519 1.00 0.00 H new ATOM 0 HB3 HIS B 87 4.582 -9.073 -1.186 1.00 0.00 H new ATOM 0 HD1 HIS B 87 5.259 -10.346 -4.557 1.00 0.00 H new ATOM 0 HD2 HIS B 87 1.990 -10.131 -1.972 1.00 0.00 H new ATOM 0 HE1 HIS B 87 3.542 -11.979 -5.441 1.00 0.00 H new ATOM 0 HE2 HIS B 87 1.555 -11.854 -3.874 1.00 0.00 H new ATOM 2496 N ALA B 88 5.850 -5.971 -1.444 1.00 0.00 N ATOM 2497 CA ALA B 88 6.398 -5.143 -0.355 1.00 0.00 C ATOM 2498 C ALA B 88 5.486 -3.967 0.007 1.00 0.00 C ATOM 2499 O ALA B 88 5.129 -3.793 1.166 1.00 0.00 O ATOM 2500 CB ALA B 88 7.803 -4.656 -0.684 1.00 0.00 C ATOM 0 H ALA B 88 6.471 -6.072 -2.247 1.00 0.00 H new ATOM 0 HA ALA B 88 6.453 -5.786 0.524 1.00 0.00 H new ATOM 0 HB1 ALA B 88 8.179 -4.048 0.139 1.00 0.00 H new ATOM 0 HB2 ALA B 88 8.460 -5.513 -0.832 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.777 -4.058 -1.595 1.00 0.00 H new ATOM 2506 N ILE B 89 5.063 -3.199 -0.982 1.00 0.00 N ATOM 2507 CA ILE B 89 4.202 -2.035 -0.722 1.00 0.00 C ATOM 2508 C ILE B 89 2.768 -2.438 -0.347 1.00 0.00 C ATOM 2509 O ILE B 89 1.988 -1.636 0.181 1.00 0.00 O ATOM 2510 CB ILE B 89 4.207 -1.010 -1.877 1.00 0.00 C ATOM 2511 CG1 ILE B 89 3.828 -1.680 -3.214 1.00 0.00 C ATOM 2512 CG2 ILE B 89 5.576 -0.337 -1.956 1.00 0.00 C ATOM 2513 CD1 ILE B 89 3.760 -0.729 -4.392 1.00 0.00 C ATOM 0 H ILE B 89 5.293 -3.349 -1.964 1.00 0.00 H new ATOM 0 HA ILE B 89 4.641 -1.539 0.144 1.00 0.00 H new ATOM 0 HB ILE B 89 3.455 -0.246 -1.679 1.00 0.00 H new ATOM 0 HG12 ILE B 89 4.556 -2.461 -3.434 1.00 0.00 H new ATOM 0 HG13 ILE B 89 2.860 -2.169 -3.100 1.00 0.00 H new ATOM 0 HG21 ILE B 89 5.579 0.386 -2.771 1.00 0.00 H new ATOM 0 HG22 ILE B 89 5.785 0.174 -1.016 1.00 0.00 H new ATOM 0 HG23 ILE B 89 6.342 -1.091 -2.137 1.00 0.00 H new ATOM 0 HD11 ILE B 89 3.488 -1.282 -5.291 1.00 0.00 H new ATOM 0 HD12 ILE B 89 3.011 0.039 -4.197 1.00 0.00 H new ATOM 0 HD13 ILE B 89 4.733 -0.259 -4.536 1.00 0.00 H new ATOM 2525 N GLN B 90 2.412 -3.641 -0.691 1.00 0.00 N ATOM 2526 CA GLN B 90 1.135 -4.228 -0.328 1.00 0.00 C ATOM 2527 C GLN B 90 1.191 -4.726 1.148 1.00 0.00 C ATOM 2528 O GLN B 90 0.327 -4.406 1.985 1.00 0.00 O ATOM 2529 CB GLN B 90 0.863 -5.399 -1.283 1.00 0.00 C ATOM 2530 CG GLN B 90 -0.408 -6.161 -1.016 1.00 0.00 C ATOM 2531 CD GLN B 90 -0.453 -7.471 -1.772 1.00 0.00 C ATOM 2532 OE1 GLN B 90 0.038 -8.465 -1.293 1.00 0.00 O ATOM 2533 NE2 GLN B 90 -1.052 -7.488 -2.930 1.00 0.00 N ATOM 0 H GLN B 90 3.005 -4.261 -1.242 1.00 0.00 H new ATOM 0 HA GLN B 90 0.334 -3.493 -0.409 1.00 0.00 H new ATOM 0 HB2 GLN B 90 0.831 -5.015 -2.303 1.00 0.00 H new ATOM 0 HB3 GLN B 90 1.702 -6.093 -1.230 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -0.496 -6.356 0.053 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -1.264 -5.549 -1.300 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -1.457 -6.631 -3.307 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -1.116 -8.358 -3.458 1.00 0.00 H new ATOM 2542 N LYS B 91 2.236 -5.468 1.426 1.00 0.00 N ATOM 2543 CA LYS B 91 2.494 -6.139 2.689 1.00 0.00 C ATOM 2544 C LYS B 91 2.862 -5.195 3.812 1.00 0.00 C ATOM 2545 O LYS B 91 2.215 -5.206 4.852 1.00 0.00 O ATOM 2546 CB LYS B 91 3.625 -7.169 2.463 1.00 0.00 C ATOM 2547 CG LYS B 91 4.204 -7.867 3.694 1.00 0.00 C ATOM 2548 CD LYS B 91 3.153 -8.590 4.491 1.00 0.00 C ATOM 2549 CE LYS B 91 3.756 -9.632 5.405 1.00 0.00 C ATOM 2550 NZ LYS B 91 4.276 -10.791 4.640 1.00 0.00 N ATOM 0 H LYS B 91 2.974 -5.632 0.742 1.00 0.00 H new ATOM 0 HA LYS B 91 1.571 -6.625 3.005 1.00 0.00 H new ATOM 0 HB2 LYS B 91 3.249 -7.937 1.787 1.00 0.00 H new ATOM 0 HB3 LYS B 91 4.442 -6.663 1.948 1.00 0.00 H new ATOM 0 HG2 LYS B 91 4.970 -8.576 3.380 1.00 0.00 H new ATOM 0 HG3 LYS B 91 4.694 -7.130 4.329 1.00 0.00 H new ATOM 0 HD2 LYS B 91 2.588 -7.871 5.084 1.00 0.00 H new ATOM 0 HD3 LYS B 91 2.447 -9.068 3.812 1.00 0.00 H new ATOM 0 HE2 LYS B 91 4.564 -9.185 5.985 1.00 0.00 H new ATOM 0 HE3 LYS B 91 3.004 -9.972 6.117 1.00 0.00 H new ATOM 0 HZ1 LYS B 91 4.743 -11.455 5.290 1.00 0.00 H new ATOM 0 HZ2 LYS B 91 3.488 -11.272 4.160 1.00 0.00 H new ATOM 0 HZ3 LYS B 91 4.962 -10.460 3.932 1.00 0.00 H new ATOM 2564 N ALA B 92 3.869 -4.369 3.584 1.00 0.00 N ATOM 2565 CA ALA B 92 4.485 -3.571 4.636 1.00 0.00 C ATOM 2566 C ALA B 92 3.519 -2.710 5.429 1.00 0.00 C ATOM 2567 O ALA B 92 3.459 -2.814 6.648 1.00 0.00 O ATOM 2568 CB ALA B 92 5.642 -2.756 4.098 1.00 0.00 C ATOM 0 H ALA B 92 4.285 -4.231 2.663 1.00 0.00 H new ATOM 0 HA ALA B 92 4.868 -4.295 5.356 1.00 0.00 H new ATOM 0 HB1 ALA B 92 6.082 -2.171 4.906 1.00 0.00 H new ATOM 0 HB2 ALA B 92 6.396 -3.425 3.682 1.00 0.00 H new ATOM 0 HB3 ALA B 92 5.283 -2.085 3.318 1.00 0.00 H new ATOM 2574 N LYS B 93 2.710 -1.922 4.753 1.00 0.00 N ATOM 2575 CA LYS B 93 1.812 -1.033 5.394 1.00 0.00 C ATOM 2576 C LYS B 93 0.563 -1.769 5.903 1.00 0.00 C ATOM 2577 O LYS B 93 -0.339 -1.149 6.462 1.00 0.00 O ATOM 2578 CB LYS B 93 1.447 0.034 4.378 1.00 0.00 C ATOM 2579 CG LYS B 93 0.579 -0.437 3.205 1.00 0.00 C ATOM 2580 CD LYS B 93 0.525 0.608 2.087 1.00 0.00 C ATOM 2581 CE LYS B 93 -0.027 1.969 2.531 1.00 0.00 C ATOM 2582 NZ LYS B 93 -1.474 1.964 2.851 1.00 0.00 N ATOM 0 H LYS B 93 2.670 -1.893 3.734 1.00 0.00 H new ATOM 0 HA LYS B 93 2.278 -0.585 6.272 1.00 0.00 H new ATOM 0 HB2 LYS B 93 0.923 0.838 4.895 1.00 0.00 H new ATOM 0 HB3 LYS B 93 2.367 0.459 3.978 1.00 0.00 H new ATOM 0 HG2 LYS B 93 0.976 -1.372 2.810 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -0.431 -0.644 3.559 1.00 0.00 H new ATOM 0 HD2 LYS B 93 1.529 0.748 1.686 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -0.092 0.224 1.275 1.00 0.00 H new ATOM 0 HE2 LYS B 93 0.526 2.304 3.408 1.00 0.00 H new ATOM 0 HE3 LYS B 93 0.156 2.698 1.741 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -1.820 2.943 2.910 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -1.993 1.458 2.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -1.626 1.488 3.763 1.00 0.00 H new ATOM 2596 N HIS B 94 0.559 -3.099 5.722 1.00 0.00 N ATOM 2597 CA HIS B 94 -0.556 -3.970 6.046 1.00 0.00 C ATOM 2598 C HIS B 94 -1.793 -3.452 5.342 1.00 0.00 C ATOM 2599 O HIS B 94 -2.721 -2.938 5.969 1.00 0.00 O ATOM 2600 CB HIS B 94 -0.765 -4.132 7.586 1.00 0.00 C ATOM 2601 CG HIS B 94 -1.850 -5.109 7.987 1.00 0.00 C ATOM 2602 ND1 HIS B 94 -3.161 -4.754 8.098 1.00 0.00 N ATOM 2603 CD2 HIS B 94 -1.803 -6.432 8.282 1.00 0.00 C ATOM 2604 CE1 HIS B 94 -3.874 -5.792 8.429 1.00 0.00 C ATOM 2605 NE2 HIS B 94 -3.084 -6.827 8.549 1.00 0.00 N ATOM 0 H HIS B 94 1.358 -3.601 5.335 1.00 0.00 H new ATOM 0 HA HIS B 94 -0.337 -4.976 5.689 1.00 0.00 H new ATOM 0 HB2 HIS B 94 0.176 -4.454 8.033 1.00 0.00 H new ATOM 0 HB3 HIS B 94 -1.002 -3.156 8.010 1.00 0.00 H new ATOM 0 HD2 HIS B 94 -0.921 -7.055 8.302 1.00 0.00 H new ATOM 0 HE1 HIS B 94 -4.943 -5.797 8.580 1.00 0.00 H new ATOM 0 HE2 HIS B 94 -3.375 -7.772 8.800 1.00 0.00 H new ATOM 2614 N MET B 95 -1.754 -3.497 4.025 1.00 0.00 N ATOM 2615 CA MET B 95 -2.875 -3.017 3.263 1.00 0.00 C ATOM 2616 C MET B 95 -4.021 -4.014 3.338 1.00 0.00 C ATOM 2617 O MET B 95 -5.057 -3.681 3.899 1.00 0.00 O ATOM 2618 CB MET B 95 -2.514 -2.585 1.830 1.00 0.00 C ATOM 2619 CG MET B 95 -3.735 -2.352 0.963 1.00 0.00 C ATOM 2620 SD MET B 95 -3.329 -2.192 -0.771 1.00 0.00 S ATOM 2621 CE MET B 95 -4.987 -2.095 -1.449 1.00 0.00 C ATOM 0 H MET B 95 -0.973 -3.854 3.475 1.00 0.00 H new ATOM 0 HA MET B 95 -3.216 -2.089 3.723 1.00 0.00 H new ATOM 0 HB2 MET B 95 -1.922 -1.671 1.869 1.00 0.00 H new ATOM 0 HB3 MET B 95 -1.889 -3.351 1.371 1.00 0.00 H new ATOM 0 HG2 MET B 95 -4.432 -3.180 1.094 1.00 0.00 H new ATOM 0 HG3 MET B 95 -4.246 -1.449 1.297 1.00 0.00 H new ATOM 0 HE1 MET B 95 -5.065 -2.753 -2.315 1.00 0.00 H new ATOM 0 HE2 MET B 95 -5.708 -2.404 -0.692 1.00 0.00 H new ATOM 0 HE3 MET B 95 -5.197 -1.069 -1.752 1.00 0.00 H new ATOM 2631 N PRO B 96 -3.899 -5.241 2.779 1.00 0.00 N ATOM 2632 CA PRO B 96 -4.853 -6.256 3.031 1.00 0.00 C ATOM 2633 C PRO B 96 -4.248 -7.256 4.009 1.00 0.00 C ATOM 2634 O PRO B 96 -3.231 -6.967 4.664 1.00 0.00 O ATOM 2635 CB PRO B 96 -5.000 -6.890 1.649 1.00 0.00 C ATOM 2636 CG PRO B 96 -3.613 -6.857 1.081 1.00 0.00 C ATOM 2637 CD PRO B 96 -2.884 -5.739 1.803 1.00 0.00 C ATOM 0 HA PRO B 96 -5.796 -5.913 3.458 1.00 0.00 H new ATOM 0 HB2 PRO B 96 -5.379 -7.910 1.717 1.00 0.00 H new ATOM 0 HB3 PRO B 96 -5.699 -6.331 1.027 1.00 0.00 H new ATOM 0 HG2 PRO B 96 -3.108 -7.811 1.232 1.00 0.00 H new ATOM 0 HG3 PRO B 96 -3.637 -6.675 0.007 1.00 0.00 H new ATOM 0 HD2 PRO B 96 -1.987 -6.102 2.305 1.00 0.00 H new ATOM 0 HD3 PRO B 96 -2.569 -4.954 1.115 1.00 0.00 H new ATOM 2645 N ASP B 97 -4.869 -8.370 4.134 1.00 0.00 N ATOM 2646 CA ASP B 97 -4.293 -9.469 4.843 1.00 0.00 C ATOM 2647 C ASP B 97 -3.847 -10.547 3.870 1.00 0.00 C ATOM 2648 O ASP B 97 -2.751 -11.026 3.987 1.00 0.00 O ATOM 2649 CB ASP B 97 -5.171 -10.007 5.973 1.00 0.00 C ATOM 2650 CG ASP B 97 -5.211 -9.065 7.147 1.00 0.00 C ATOM 2651 OD1 ASP B 97 -6.159 -8.285 7.257 1.00 0.00 O ATOM 2652 OD2 ASP B 97 -4.270 -9.070 7.965 1.00 0.00 O ATOM 0 H ASP B 97 -5.795 -8.554 3.749 1.00 0.00 H new ATOM 0 HA ASP B 97 -3.409 -9.091 5.357 1.00 0.00 H new ATOM 0 HB2 ASP B 97 -6.183 -10.168 5.602 1.00 0.00 H new ATOM 0 HB3 ASP B 97 -4.792 -10.976 6.297 1.00 0.00 H new ATOM 2657 N PRO B 98 -4.680 -10.975 2.861 1.00 0.00 N ATOM 2658 CA PRO B 98 -4.178 -11.881 1.840 1.00 0.00 C ATOM 2659 C PRO B 98 -3.172 -11.162 0.943 1.00 0.00 C ATOM 2660 O PRO B 98 -3.551 -10.412 0.028 1.00 0.00 O ATOM 2661 CB PRO B 98 -5.423 -12.293 1.043 1.00 0.00 C ATOM 2662 CG PRO B 98 -6.407 -11.203 1.286 1.00 0.00 C ATOM 2663 CD PRO B 98 -6.122 -10.680 2.666 1.00 0.00 C ATOM 0 HA PRO B 98 -3.659 -12.742 2.262 1.00 0.00 H new ATOM 0 HB2 PRO B 98 -5.198 -12.393 -0.019 1.00 0.00 H new ATOM 0 HB3 PRO B 98 -5.808 -13.256 1.380 1.00 0.00 H new ATOM 0 HG2 PRO B 98 -6.305 -10.413 0.542 1.00 0.00 H new ATOM 0 HG3 PRO B 98 -7.428 -11.578 1.215 1.00 0.00 H new ATOM 0 HD2 PRO B 98 -6.326 -9.612 2.740 1.00 0.00 H new ATOM 0 HD3 PRO B 98 -6.738 -11.175 3.417 1.00 0.00 H new ATOM 2671 N TRP B 99 -1.909 -11.309 1.269 1.00 0.00 N ATOM 2672 CA TRP B 99 -0.852 -10.697 0.516 1.00 0.00 C ATOM 2673 C TRP B 99 -0.514 -11.500 -0.702 1.00 0.00 C ATOM 2674 O TRP B 99 0.450 -12.272 -0.734 1.00 0.00 O ATOM 2675 CB TRP B 99 0.373 -10.415 1.377 1.00 0.00 C ATOM 2676 CG TRP B 99 0.061 -9.476 2.481 1.00 0.00 C ATOM 2677 CD1 TRP B 99 -0.303 -8.181 2.353 1.00 0.00 C ATOM 2678 CD2 TRP B 99 0.084 -9.751 3.876 1.00 0.00 C ATOM 2679 NE1 TRP B 99 -0.518 -7.627 3.580 1.00 0.00 N ATOM 2680 CE2 TRP B 99 -0.289 -8.569 4.533 1.00 0.00 C ATOM 2681 CE3 TRP B 99 0.379 -10.879 4.639 1.00 0.00 C ATOM 2682 CZ2 TRP B 99 -0.374 -8.479 5.905 1.00 0.00 C ATOM 2683 CZ3 TRP B 99 0.295 -10.786 6.011 1.00 0.00 C ATOM 2684 CH2 TRP B 99 -0.080 -9.592 6.630 1.00 0.00 C ATOM 0 H TRP B 99 -1.590 -11.859 2.067 1.00 0.00 H new ATOM 0 HA TRP B 99 -1.217 -9.729 0.172 1.00 0.00 H new ATOM 0 HB2 TRP B 99 0.751 -11.350 1.790 1.00 0.00 H new ATOM 0 HB3 TRP B 99 1.166 -9.997 0.757 1.00 0.00 H new ATOM 0 HD1 TRP B 99 -0.409 -7.659 1.413 1.00 0.00 H new ATOM 0 HE1 TRP B 99 -0.804 -6.664 3.754 1.00 0.00 H new ATOM 0 HE3 TRP B 99 0.667 -11.806 4.165 1.00 0.00 H new ATOM 0 HZ2 TRP B 99 -0.664 -7.558 6.388 1.00 0.00 H new ATOM 0 HZ3 TRP B 99 0.523 -11.650 6.617 1.00 0.00 H new ATOM 0 HH2 TRP B 99 -0.138 -9.551 7.708 1.00 0.00 H new ATOM 2695 N ALA B 100 -1.330 -11.343 -1.671 1.00 0.00 N ATOM 2696 CA ALA B 100 -1.230 -12.030 -2.887 1.00 0.00 C ATOM 2697 C ALA B 100 -0.921 -11.017 -3.957 1.00 0.00 C ATOM 2698 O ALA B 100 -1.546 -9.958 -3.971 1.00 0.00 O ATOM 2699 CB ALA B 100 -2.519 -12.788 -3.157 1.00 0.00 C ATOM 2700 OXT ALA B 100 -0.003 -11.253 -4.771 1.00 0.00 O ATOM 0 H ALA B 100 -2.121 -10.701 -1.631 1.00 0.00 H new ATOM 0 HA ALA B 100 -0.432 -12.772 -2.865 1.00 0.00 H new ATOM 0 HB1 ALA B 100 -2.436 -13.321 -4.104 1.00 0.00 H new ATOM 0 HB2 ALA B 100 -2.696 -13.502 -2.353 1.00 0.00 H new ATOM 0 HB3 ALA B 100 -3.351 -12.085 -3.208 1.00 0.00 H new TER 2706 ALA B 100 HETATM 2707 CA CA A 501 -11.246 -21.063 -0.295 1.00 0.00 CA HETATM 2708 CA CA A 502 -17.437 -11.768 -1.585 1.00 0.00 CA