USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1198 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 117 ASN : amide:sc= -2.35 X(o=-5.6,f=-5.7) USER MOD Set 1.2: A 134 GLN : amide:sc= -3.23 K(o=-5.6,f=-7.6!) USER MOD Set 2.1: A 115 ASN : amide:sc= -5.53! C(o=-8.9!,f=-18!) USER MOD Set 2.2: A 131 GLN : amide:sc= -3.37! K(o=-8.9!,f=-18) USER MOD Set 3.1: A 47 HIS :FLIP no HE2:sc= -1.47 F(o=-6.2!,f=-4.5) USER MOD Set 3.2: A 78 ASN :FLIP amide:sc= -3.04 F(o=-5.4!,f=-4.5) USER MOD Set 4.1: A 73 ASN : amide:sc= -9.26! C(o=-16!,f=-18!) USER MOD Set 4.2: A 136 MET CE :methyl 156:sc= -4.28! (180deg=-6.29!) USER MOD Set 4.3: A 140 GLN : amide:sc= -2.67! C(o=-16!,f=-18!) USER MOD Set 5.1: A 5 HIS : no HD1:sc= -0.164 K(o=-0.23,f=-1.4) USER MOD Set 5.2: A 6 HIS : no HD1:sc= -0.0636 X(o=-0.23,f=-0.17) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HE2:sc= -0.252 K(o=-0.25,f=-1.5) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc=-0.00621 X(o=-0.0062,f=-0.31) USER MOD Single : A 8 MET CE :methyl -156:sc= -0.0832 (180deg=-0.529) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 13 ASN : amide:sc= -0.0318 X(o=-0.032,f=-0.22) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS :FLIP no HD1:sc= -1.53 F(o=-3.7!,f=-1.5) USER MOD Single : A 24 HIS : no HD1:sc= -10.7! C(o=-11!,f=-10!) USER MOD Single : A 27 THR OG1 : rot -170:sc= -1.45 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -137:sc= -7.23! (180deg=-13.6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -170:sc= 0.321 USER MOD Single : A 55 LYS NZ :NH3+ 143:sc= 0 (180deg=-0.887) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 164:sc= -5.02! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.094 USER MOD Single : A 68 SER OG : rot -68:sc= 1.13 USER MOD Single : A 71 SER OG : rot -101:sc= -5.09! USER MOD Single : A 72 HIS : no HD1:sc= -0.199 X(o=-0.2,f=0.035) USER MOD Single : A 76 MET CE :methyl 137:sc= -9.27! (180deg=-11.7!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -161:sc= -0.709! USER MOD Single : A 96 TYR OH : rot -121:sc= 0.0738 USER MOD Single : A 106 SER OG : rot 54:sc= 1.1 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -1.94 K(o=-1.9,f=-2.5) USER MOD Single : A 119 ASN : amide:sc= -1.33 K(o=-1.3,f=-3.1!) USER MOD Single : A 121 SER OG : rot 27:sc= 1.17 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 165:sc= -1.18 USER MOD Single : A 126 TYR OH : rot 180:sc= -0.0619 USER MOD Single : A 128 SER OG : rot 180:sc= 0.102 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 THR OG1 : rot -89:sc= 1.05 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 HIS : no HD1:sc= -0.271 X(o=-0.27,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -22.168 -23.376 -20.487 1.00 0.00 N ATOM 2 CA MET A 1 -20.750 -23.360 -20.933 1.00 0.00 C ATOM 3 C MET A 1 -20.087 -24.716 -20.710 1.00 0.00 C ATOM 4 O MET A 1 -19.936 -25.166 -19.576 1.00 0.00 O ATOM 5 CB MET A 1 -20.007 -22.275 -20.152 1.00 0.00 C ATOM 6 CG MET A 1 -18.775 -21.744 -20.871 1.00 0.00 C ATOM 7 SD MET A 1 -17.267 -21.928 -19.898 1.00 0.00 S ATOM 8 CE MET A 1 -17.560 -20.739 -18.591 1.00 0.00 C ATOM 0 H1 MET A 1 -22.594 -22.441 -20.650 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.693 -24.095 -21.025 1.00 0.00 H new ATOM 0 H3 MET A 1 -22.210 -23.603 -19.473 1.00 0.00 H new ATOM 0 HA MET A 1 -20.713 -23.148 -22.001 1.00 0.00 H new ATOM 0 HB2 MET A 1 -20.689 -21.447 -19.957 1.00 0.00 H new ATOM 0 HB3 MET A 1 -19.708 -22.676 -19.184 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.658 -22.270 -21.818 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.923 -20.690 -21.108 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.713 -20.736 -17.906 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.681 -19.746 -19.023 1.00 0.00 H new ATOM 0 HE3 MET A 1 -18.465 -21.011 -18.048 1.00 0.00 H new ATOM 20 N HIS A 2 -19.692 -25.362 -21.803 1.00 0.00 N ATOM 21 CA HIS A 2 -19.044 -26.666 -21.728 1.00 0.00 C ATOM 22 C HIS A 2 -18.252 -26.954 -22.998 1.00 0.00 C ATOM 23 O HIS A 2 -18.122 -28.108 -23.413 1.00 0.00 O ATOM 24 CB HIS A 2 -20.086 -27.764 -21.502 1.00 0.00 C ATOM 25 CG HIS A 2 -21.212 -27.732 -22.489 1.00 0.00 C ATOM 26 ND1 HIS A 2 -21.032 -27.922 -23.842 1.00 0.00 N ATOM 27 CD2 HIS A 2 -22.540 -27.532 -22.312 1.00 0.00 C ATOM 28 CE1 HIS A 2 -22.199 -27.840 -24.455 1.00 0.00 C ATOM 29 NE2 HIS A 2 -23.130 -27.606 -23.550 1.00 0.00 N ATOM 0 H HIS A 2 -19.810 -25.003 -22.751 1.00 0.00 H new ATOM 0 HA HIS A 2 -18.352 -26.652 -20.886 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -19.595 -28.736 -21.554 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -20.493 -27.666 -20.496 1.00 0.00 H new ATOM 0 HD1 HIS A 2 -20.137 -28.098 -24.299 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -23.041 -27.349 -21.373 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -22.363 -27.946 -25.517 1.00 0.00 H new ATOM 38 N HIS A 3 -17.723 -25.901 -23.612 1.00 0.00 N ATOM 39 CA HIS A 3 -16.942 -26.042 -24.836 1.00 0.00 C ATOM 40 C HIS A 3 -15.816 -25.015 -24.882 1.00 0.00 C ATOM 41 O HIS A 3 -14.663 -25.354 -25.150 1.00 0.00 O ATOM 42 CB HIS A 3 -17.845 -25.888 -26.062 1.00 0.00 C ATOM 43 CG HIS A 3 -18.033 -27.160 -26.828 1.00 0.00 C ATOM 44 ND1 HIS A 3 -17.041 -27.725 -27.605 1.00 0.00 N ATOM 45 CD2 HIS A 3 -19.105 -27.980 -26.938 1.00 0.00 C ATOM 46 CE1 HIS A 3 -17.496 -28.836 -28.157 1.00 0.00 C ATOM 47 NE2 HIS A 3 -18.745 -29.013 -27.768 1.00 0.00 N ATOM 0 H HIS A 3 -17.821 -24.941 -23.282 1.00 0.00 H new ATOM 0 HA HIS A 3 -16.499 -27.038 -24.845 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -18.819 -25.519 -25.742 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -17.420 -25.134 -26.724 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -20.065 -27.846 -26.461 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -16.941 -29.488 -28.815 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -19.346 -29.791 -28.040 1.00 0.00 H new ATOM 56 N HIS A 4 -16.157 -23.757 -24.620 1.00 0.00 N ATOM 57 CA HIS A 4 -15.174 -22.680 -24.632 1.00 0.00 C ATOM 58 C HIS A 4 -14.456 -22.584 -23.290 1.00 0.00 C ATOM 59 O HIS A 4 -14.711 -23.372 -22.379 1.00 0.00 O ATOM 60 CB HIS A 4 -15.851 -21.347 -24.957 1.00 0.00 C ATOM 61 CG HIS A 4 -15.996 -21.091 -26.425 1.00 0.00 C ATOM 62 ND1 HIS A 4 -17.115 -21.452 -27.145 1.00 0.00 N ATOM 63 CD2 HIS A 4 -15.154 -20.504 -27.309 1.00 0.00 C ATOM 64 CE1 HIS A 4 -16.955 -21.099 -28.409 1.00 0.00 C ATOM 65 NE2 HIS A 4 -15.773 -20.522 -28.533 1.00 0.00 N ATOM 0 H HIS A 4 -17.107 -23.459 -24.397 1.00 0.00 H new ATOM 0 HA HIS A 4 -14.437 -22.903 -25.403 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -16.838 -21.328 -24.494 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -15.274 -20.537 -24.511 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -14.177 -20.098 -27.091 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -17.669 -21.256 -29.204 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -15.384 -20.150 -29.399 1.00 0.00 H new ATOM 74 N HIS A 5 -13.556 -21.613 -23.175 1.00 0.00 N ATOM 75 CA HIS A 5 -12.800 -21.414 -21.944 1.00 0.00 C ATOM 76 C HIS A 5 -12.752 -19.937 -21.568 1.00 0.00 C ATOM 77 O HIS A 5 -13.290 -19.088 -22.277 1.00 0.00 O ATOM 78 CB HIS A 5 -11.377 -21.957 -22.101 1.00 0.00 C ATOM 79 CG HIS A 5 -10.656 -21.408 -23.291 1.00 0.00 C ATOM 80 ND1 HIS A 5 -10.218 -20.102 -23.371 1.00 0.00 N ATOM 81 CD2 HIS A 5 -10.292 -21.995 -24.457 1.00 0.00 C ATOM 82 CE1 HIS A 5 -9.620 -19.911 -24.533 1.00 0.00 C ATOM 83 NE2 HIS A 5 -9.651 -21.044 -25.209 1.00 0.00 N ATOM 0 H HIS A 5 -13.332 -20.952 -23.919 1.00 0.00 H new ATOM 0 HA HIS A 5 -13.304 -21.958 -21.146 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -10.807 -21.724 -21.202 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -11.418 -23.043 -22.180 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -10.473 -23.021 -24.741 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -9.180 -18.985 -24.872 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -9.261 -21.189 -26.140 1.00 0.00 H new ATOM 92 N HIS A 6 -12.105 -19.638 -20.446 1.00 0.00 N ATOM 93 CA HIS A 6 -11.987 -18.262 -19.976 1.00 0.00 C ATOM 94 C HIS A 6 -13.362 -17.654 -19.718 1.00 0.00 C ATOM 95 O HIS A 6 -14.387 -18.313 -19.899 1.00 0.00 O ATOM 96 CB HIS A 6 -11.226 -17.416 -20.997 1.00 0.00 C ATOM 97 CG HIS A 6 -9.755 -17.338 -20.732 1.00 0.00 C ATOM 98 ND1 HIS A 6 -8.801 -17.650 -21.677 1.00 0.00 N ATOM 99 CD2 HIS A 6 -9.073 -16.980 -19.617 1.00 0.00 C ATOM 100 CE1 HIS A 6 -7.597 -17.487 -21.157 1.00 0.00 C ATOM 101 NE2 HIS A 6 -7.735 -17.082 -19.909 1.00 0.00 N ATOM 0 H HIS A 6 -11.655 -20.329 -19.846 1.00 0.00 H new ATOM 0 HA HIS A 6 -11.433 -18.272 -19.037 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -11.386 -17.831 -21.992 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -11.640 -16.408 -21.002 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -9.502 -16.672 -18.675 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -6.660 -17.656 -21.667 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -6.971 -16.878 -19.265 1.00 0.00 H new ATOM 110 N HIS A 7 -13.377 -16.395 -19.294 1.00 0.00 N ATOM 111 CA HIS A 7 -14.627 -15.698 -19.012 1.00 0.00 C ATOM 112 C HIS A 7 -15.407 -16.405 -17.909 1.00 0.00 C ATOM 113 O HIS A 7 -16.156 -17.346 -18.170 1.00 0.00 O ATOM 114 CB HIS A 7 -15.480 -15.605 -20.278 1.00 0.00 C ATOM 115 CG HIS A 7 -16.443 -14.458 -20.268 1.00 0.00 C ATOM 116 ND1 HIS A 7 -17.419 -14.303 -19.306 1.00 0.00 N ATOM 117 CD2 HIS A 7 -16.578 -13.406 -21.109 1.00 0.00 C ATOM 118 CE1 HIS A 7 -18.111 -13.205 -19.557 1.00 0.00 C ATOM 119 NE2 HIS A 7 -17.620 -12.643 -20.646 1.00 0.00 N ATOM 0 H HIS A 7 -12.538 -15.836 -19.138 1.00 0.00 H new ATOM 0 HA HIS A 7 -14.384 -14.691 -18.672 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -14.823 -15.510 -21.143 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -16.036 -16.534 -20.401 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -15.977 -13.204 -21.983 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -18.938 -12.831 -18.971 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -17.960 -11.782 -21.074 1.00 0.00 H new ATOM 128 N MET A 8 -15.226 -15.946 -16.675 1.00 0.00 N ATOM 129 CA MET A 8 -15.913 -16.534 -15.532 1.00 0.00 C ATOM 130 C MET A 8 -16.453 -15.452 -14.603 1.00 0.00 C ATOM 131 O MET A 8 -17.646 -15.416 -14.300 1.00 0.00 O ATOM 132 CB MET A 8 -14.968 -17.458 -14.762 1.00 0.00 C ATOM 133 CG MET A 8 -14.997 -18.898 -15.249 1.00 0.00 C ATOM 134 SD MET A 8 -13.514 -19.816 -14.790 1.00 0.00 S ATOM 135 CE MET A 8 -12.296 -19.045 -15.853 1.00 0.00 C ATOM 0 H MET A 8 -14.609 -15.168 -16.441 1.00 0.00 H new ATOM 0 HA MET A 8 -16.754 -17.116 -15.908 1.00 0.00 H new ATOM 0 HB2 MET A 8 -13.951 -17.075 -14.845 1.00 0.00 H new ATOM 0 HB3 MET A 8 -15.232 -17.435 -13.705 1.00 0.00 H new ATOM 0 HG2 MET A 8 -15.872 -19.400 -14.836 1.00 0.00 H new ATOM 0 HG3 MET A 8 -15.105 -18.909 -16.334 1.00 0.00 H new ATOM 0 HE1 MET A 8 -11.467 -19.734 -16.016 1.00 0.00 H new ATOM 0 HE2 MET A 8 -12.754 -18.795 -16.810 1.00 0.00 H new ATOM 0 HE3 MET A 8 -11.924 -18.136 -15.380 1.00 0.00 H new ATOM 145 N SER A 9 -15.566 -14.571 -14.151 1.00 0.00 N ATOM 146 CA SER A 9 -15.952 -13.486 -13.255 1.00 0.00 C ATOM 147 C SER A 9 -15.904 -12.142 -13.975 1.00 0.00 C ATOM 148 O SER A 9 -15.205 -11.988 -14.976 1.00 0.00 O ATOM 149 CB SER A 9 -15.036 -13.457 -12.031 1.00 0.00 C ATOM 150 OG SER A 9 -15.193 -14.625 -11.246 1.00 0.00 O ATOM 0 H SER A 9 -14.575 -14.587 -14.391 1.00 0.00 H new ATOM 0 HA SER A 9 -16.976 -13.665 -12.928 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.998 -13.368 -12.352 1.00 0.00 H new ATOM 0 HB3 SER A 9 -15.259 -12.577 -11.427 1.00 0.00 H new ATOM 0 HG SER A 9 -14.595 -14.581 -10.471 1.00 0.00 H new ATOM 156 N ASP A 10 -16.649 -11.172 -13.457 1.00 0.00 N ATOM 157 CA ASP A 10 -16.689 -9.840 -14.051 1.00 0.00 C ATOM 158 C ASP A 10 -16.996 -8.782 -12.995 1.00 0.00 C ATOM 159 O ASP A 10 -17.719 -9.041 -12.034 1.00 0.00 O ATOM 160 CB ASP A 10 -17.739 -9.786 -15.164 1.00 0.00 C ATOM 161 CG ASP A 10 -19.126 -10.142 -14.667 1.00 0.00 C ATOM 162 OD1 ASP A 10 -19.395 -11.344 -14.468 1.00 0.00 O ATOM 163 OD2 ASP A 10 -19.945 -9.216 -14.480 1.00 0.00 O ATOM 0 H ASP A 10 -17.233 -11.282 -12.628 1.00 0.00 H new ATOM 0 HA ASP A 10 -15.708 -9.629 -14.476 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -17.756 -8.785 -15.595 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -17.455 -10.472 -15.962 1.00 0.00 H new ATOM 168 N GLY A 11 -16.439 -7.589 -13.182 1.00 0.00 N ATOM 169 CA GLY A 11 -16.664 -6.509 -12.241 1.00 0.00 C ATOM 170 C GLY A 11 -15.704 -5.353 -12.446 1.00 0.00 C ATOM 171 O GLY A 11 -14.540 -5.428 -12.055 1.00 0.00 O ATOM 0 H GLY A 11 -15.836 -7.352 -13.969 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -17.688 -6.150 -12.343 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -16.559 -6.889 -11.225 1.00 0.00 H new ATOM 175 N HIS A 12 -16.194 -4.282 -13.062 1.00 0.00 N ATOM 176 CA HIS A 12 -15.373 -3.105 -13.319 1.00 0.00 C ATOM 177 C HIS A 12 -15.865 -1.911 -12.508 1.00 0.00 C ATOM 178 O HIS A 12 -17.063 -1.764 -12.266 1.00 0.00 O ATOM 179 CB HIS A 12 -15.384 -2.767 -14.813 1.00 0.00 C ATOM 180 CG HIS A 12 -14.024 -2.487 -15.371 1.00 0.00 C ATOM 181 ND1 HIS A 12 -13.019 -3.431 -15.418 1.00 0.00 N ATOM 182 CD2 HIS A 12 -13.503 -1.358 -15.911 1.00 0.00 C ATOM 183 CE1 HIS A 12 -11.939 -2.896 -15.960 1.00 0.00 C ATOM 184 NE2 HIS A 12 -12.208 -1.640 -16.268 1.00 0.00 N ATOM 0 H HIS A 12 -17.156 -4.205 -13.392 1.00 0.00 H new ATOM 0 HA HIS A 12 -14.351 -3.330 -13.013 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -15.830 -3.597 -15.362 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -16.021 -1.898 -14.976 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -14.012 -0.414 -16.037 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -10.998 -3.400 -16.123 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -11.558 -0.985 -16.702 1.00 0.00 H new ATOM 193 N ASN A 13 -14.933 -1.059 -12.092 1.00 0.00 N ATOM 194 CA ASN A 13 -15.275 0.122 -11.307 1.00 0.00 C ATOM 195 C ASN A 13 -14.071 1.051 -11.167 1.00 0.00 C ATOM 196 O ASN A 13 -13.057 0.682 -10.576 1.00 0.00 O ATOM 197 CB ASN A 13 -15.782 -0.290 -9.923 1.00 0.00 C ATOM 198 CG ASN A 13 -17.088 0.390 -9.561 1.00 0.00 C ATOM 199 OD1 ASN A 13 -18.014 0.450 -10.368 1.00 0.00 O ATOM 200 ND2 ASN A 13 -17.167 0.903 -8.339 1.00 0.00 N ATOM 0 H ASN A 13 -13.937 -1.164 -12.285 1.00 0.00 H new ATOM 0 HA ASN A 13 -16.066 0.660 -11.830 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -15.918 -1.371 -9.896 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -15.028 -0.045 -9.175 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -18.022 1.370 -8.036 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -16.373 0.830 -7.703 1.00 0.00 H new ATOM 207 N GLY A 14 -14.194 2.256 -11.715 1.00 0.00 N ATOM 208 CA GLY A 14 -13.111 3.218 -11.638 1.00 0.00 C ATOM 209 C GLY A 14 -12.741 3.557 -10.206 1.00 0.00 C ATOM 210 O GLY A 14 -13.562 4.081 -9.454 1.00 0.00 O ATOM 0 H GLY A 14 -15.024 2.583 -12.210 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.237 2.819 -12.152 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -13.400 4.129 -12.162 1.00 0.00 H new ATOM 214 N LEU A 15 -11.503 3.254 -9.830 1.00 0.00 N ATOM 215 CA LEU A 15 -11.028 3.526 -8.478 1.00 0.00 C ATOM 216 C LEU A 15 -9.555 3.932 -8.485 1.00 0.00 C ATOM 217 O LEU A 15 -8.947 4.087 -9.544 1.00 0.00 O ATOM 218 CB LEU A 15 -11.233 2.300 -7.586 1.00 0.00 C ATOM 219 CG LEU A 15 -12.573 2.250 -6.851 1.00 0.00 C ATOM 220 CD1 LEU A 15 -13.091 0.820 -6.783 1.00 0.00 C ATOM 221 CD2 LEU A 15 -12.435 2.835 -5.453 1.00 0.00 C ATOM 0 H LEU A 15 -10.811 2.821 -10.441 1.00 0.00 H new ATOM 0 HA LEU A 15 -11.608 4.357 -8.077 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -11.139 1.404 -8.199 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.430 2.268 -6.849 1.00 0.00 H new ATOM 0 HG LEU A 15 -13.294 2.850 -7.406 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.045 0.803 -6.257 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -13.227 0.434 -7.793 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -12.372 0.198 -6.250 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.398 2.792 -4.944 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -11.700 2.261 -4.889 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -12.108 3.872 -5.523 1.00 0.00 H new ATOM 233 N GLY A 16 -8.993 4.114 -7.292 1.00 0.00 N ATOM 234 CA GLY A 16 -7.601 4.514 -7.170 1.00 0.00 C ATOM 235 C GLY A 16 -7.417 6.019 -7.310 1.00 0.00 C ATOM 236 O GLY A 16 -6.326 6.540 -7.081 1.00 0.00 O ATOM 0 H GLY A 16 -9.480 3.991 -6.404 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.216 4.192 -6.202 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.011 4.006 -7.933 1.00 0.00 H new ATOM 240 N LYS A 17 -8.492 6.716 -7.690 1.00 0.00 N ATOM 241 CA LYS A 17 -8.455 8.166 -7.864 1.00 0.00 C ATOM 242 C LYS A 17 -7.718 8.550 -9.145 1.00 0.00 C ATOM 243 O LYS A 17 -6.907 9.476 -9.149 1.00 0.00 O ATOM 244 CB LYS A 17 -7.795 8.839 -6.658 1.00 0.00 C ATOM 245 CG LYS A 17 -8.231 10.281 -6.450 1.00 0.00 C ATOM 246 CD LYS A 17 -9.742 10.394 -6.320 1.00 0.00 C ATOM 247 CE LYS A 17 -10.388 10.803 -7.635 1.00 0.00 C ATOM 248 NZ LYS A 17 -10.814 12.230 -7.625 1.00 0.00 N ATOM 0 H LYS A 17 -9.401 6.295 -7.883 1.00 0.00 H new ATOM 0 HA LYS A 17 -9.485 8.515 -7.943 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.027 8.265 -5.761 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.713 8.810 -6.784 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -7.757 10.680 -5.553 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -7.890 10.889 -7.288 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.152 9.438 -5.994 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.988 11.125 -5.550 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.684 10.640 -8.451 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -11.252 10.168 -7.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -11.249 12.469 -8.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -11.505 12.381 -6.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -9.986 12.838 -7.467 1.00 0.00 H new ATOM 262 N GLY A 18 -7.999 7.832 -10.228 1.00 0.00 N ATOM 263 CA GLY A 18 -7.344 8.117 -11.493 1.00 0.00 C ATOM 264 C GLY A 18 -6.168 7.195 -11.743 1.00 0.00 C ATOM 265 O GLY A 18 -5.611 7.166 -12.839 1.00 0.00 O ATOM 0 H GLY A 18 -8.666 7.061 -10.253 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.064 8.015 -12.305 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.001 9.152 -11.499 1.00 0.00 H new ATOM 269 N PHE A 19 -5.789 6.444 -10.714 1.00 0.00 N ATOM 270 CA PHE A 19 -4.670 5.516 -10.798 1.00 0.00 C ATOM 271 C PHE A 19 -4.699 4.692 -12.077 1.00 0.00 C ATOM 272 O PHE A 19 -3.949 4.957 -13.017 1.00 0.00 O ATOM 273 CB PHE A 19 -4.672 4.596 -9.582 1.00 0.00 C ATOM 274 CG PHE A 19 -3.438 4.749 -8.757 1.00 0.00 C ATOM 275 CD1 PHE A 19 -2.196 4.664 -9.353 1.00 0.00 C ATOM 276 CD2 PHE A 19 -3.516 4.995 -7.401 1.00 0.00 C ATOM 277 CE1 PHE A 19 -1.043 4.818 -8.610 1.00 0.00 C ATOM 278 CE2 PHE A 19 -2.370 5.152 -6.649 1.00 0.00 C ATOM 279 CZ PHE A 19 -1.130 5.065 -7.254 1.00 0.00 C ATOM 0 H PHE A 19 -6.247 6.462 -9.803 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.753 6.106 -10.815 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.546 4.811 -8.968 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.760 3.561 -9.912 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.125 4.475 -10.414 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.483 5.065 -6.925 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.077 4.746 -9.087 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.442 5.343 -5.588 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.232 5.190 -6.668 1.00 0.00 H new ATOM 289 N GLY A 20 -5.558 3.686 -12.098 1.00 0.00 N ATOM 290 CA GLY A 20 -5.660 2.831 -13.260 1.00 0.00 C ATOM 291 C GLY A 20 -7.038 2.209 -13.380 1.00 0.00 C ATOM 292 O GLY A 20 -7.692 2.320 -14.416 1.00 0.00 O ATOM 0 H GLY A 20 -6.186 3.446 -11.331 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.443 3.410 -14.158 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.909 2.043 -13.199 1.00 0.00 H new ATOM 296 N ASP A 21 -7.476 1.556 -12.304 1.00 0.00 N ATOM 297 CA ASP A 21 -8.786 0.914 -12.272 1.00 0.00 C ATOM 298 C ASP A 21 -9.231 0.636 -10.826 1.00 0.00 C ATOM 299 O ASP A 21 -9.646 1.551 -10.120 1.00 0.00 O ATOM 300 CB ASP A 21 -8.766 -0.375 -13.098 1.00 0.00 C ATOM 301 CG ASP A 21 -8.920 -0.113 -14.583 1.00 0.00 C ATOM 302 OD1 ASP A 21 -9.809 0.683 -14.957 1.00 0.00 O ATOM 303 OD2 ASP A 21 -8.153 -0.702 -15.374 1.00 0.00 O ATOM 0 H ASP A 21 -6.940 1.459 -11.442 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.513 1.595 -12.715 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.829 -0.902 -12.920 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -9.569 -1.031 -12.762 1.00 0.00 H new ATOM 308 N HIS A 22 -9.148 -0.623 -10.388 1.00 0.00 N ATOM 309 CA HIS A 22 -9.557 -0.994 -9.030 1.00 0.00 C ATOM 310 C HIS A 22 -8.359 -1.485 -8.205 1.00 0.00 C ATOM 311 O HIS A 22 -8.212 -1.145 -7.032 1.00 0.00 O ATOM 312 CB HIS A 22 -10.649 -2.066 -9.103 1.00 0.00 C ATOM 313 CG HIS A 22 -10.412 -3.097 -10.167 1.00 0.00 C ATOM 314 ND1 HIS A 22 -9.451 -4.046 -10.288 1.00 0.00 N flip ATOM 315 CD2 HIS A 22 -11.220 -3.230 -11.278 1.00 0.00 C flip ATOM 316 CE1 HIS A 22 -9.695 -4.723 -11.457 1.00 0.00 C flip ATOM 317 NE2 HIS A 22 -10.766 -4.214 -12.035 1.00 0.00 N flip ATOM 0 H HIS A 22 -8.803 -1.400 -10.951 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.956 -0.112 -8.528 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -10.722 -2.564 -8.136 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.609 -1.583 -9.285 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -12.088 -2.625 -11.495 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -9.105 -5.541 -11.842 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -11.174 -4.526 -12.916 1.00 0.00 H new ATOM 326 N ILE A 23 -7.507 -2.265 -8.856 1.00 0.00 N ATOM 327 CA ILE A 23 -6.276 -2.827 -8.280 1.00 0.00 C ATOM 328 C ILE A 23 -6.066 -2.577 -6.754 1.00 0.00 C ATOM 329 O ILE A 23 -6.673 -3.256 -5.892 1.00 0.00 O ATOM 330 CB ILE A 23 -5.077 -2.273 -9.088 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.197 -2.688 -10.555 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.749 -2.728 -8.515 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.852 -1.638 -11.425 1.00 0.00 C ATOM 0 H ILE A 23 -7.650 -2.537 -9.829 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.363 -3.911 -8.358 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.104 -1.186 -9.018 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.203 -2.905 -10.946 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.772 -3.612 -10.618 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.935 -2.317 -9.112 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.657 -2.378 -7.487 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.698 -3.817 -8.534 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.905 -1.998 -12.452 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.859 -1.438 -11.058 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.265 -0.720 -11.392 1.00 0.00 H new ATOM 345 N HIS A 24 -5.167 -1.639 -6.419 1.00 0.00 N ATOM 346 CA HIS A 24 -4.840 -1.348 -5.028 1.00 0.00 C ATOM 347 C HIS A 24 -5.785 -0.317 -4.419 1.00 0.00 C ATOM 348 O HIS A 24 -5.387 0.463 -3.556 1.00 0.00 O ATOM 349 CB HIS A 24 -3.395 -0.865 -4.905 1.00 0.00 C ATOM 350 CG HIS A 24 -2.437 -1.575 -5.815 1.00 0.00 C ATOM 351 ND1 HIS A 24 -2.397 -2.948 -5.942 1.00 0.00 N ATOM 352 CD2 HIS A 24 -1.466 -1.096 -6.628 1.00 0.00 C ATOM 353 CE1 HIS A 24 -1.443 -3.281 -6.793 1.00 0.00 C ATOM 354 NE2 HIS A 24 -0.864 -2.176 -7.224 1.00 0.00 N ATOM 0 H HIS A 24 -4.657 -1.073 -7.097 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.959 -2.278 -4.472 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.360 0.203 -5.119 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -3.065 -0.995 -3.874 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -1.212 -0.057 -6.779 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.181 -4.287 -7.086 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -0.094 -2.132 -7.892 1.00 0.00 H new ATOM 363 N TRP A 25 -7.031 -0.318 -4.871 1.00 0.00 N ATOM 364 CA TRP A 25 -8.026 0.625 -4.368 1.00 0.00 C ATOM 365 C TRP A 25 -9.419 0.027 -4.368 1.00 0.00 C ATOM 366 O TRP A 25 -10.361 0.675 -3.910 1.00 0.00 O ATOM 367 CB TRP A 25 -8.047 1.885 -5.225 1.00 0.00 C ATOM 368 CG TRP A 25 -7.377 1.687 -6.532 1.00 0.00 C ATOM 369 CD1 TRP A 25 -7.973 1.412 -7.716 1.00 0.00 C ATOM 370 CD2 TRP A 25 -5.977 1.732 -6.781 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.028 1.267 -8.688 1.00 0.00 N ATOM 372 CE2 TRP A 25 -5.789 1.473 -8.144 1.00 0.00 C ATOM 373 CE3 TRP A 25 -4.868 1.971 -5.978 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.525 1.442 -8.727 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.617 1.944 -6.548 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.450 1.684 -7.914 1.00 0.00 C ATOM 0 H TRP A 25 -7.379 -0.959 -5.584 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.742 0.866 -3.344 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -9.080 2.192 -5.391 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.556 2.696 -4.687 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.038 1.321 -7.868 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.215 1.041 -9.665 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.987 2.175 -4.924 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.397 1.235 -9.779 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.749 2.126 -5.932 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.455 1.674 -8.334 1.00 0.00 H new ATOM 387 N ARG A 26 -9.573 -1.188 -4.900 1.00 0.00 N ATOM 388 CA ARG A 26 -10.897 -1.801 -4.948 1.00 0.00 C ATOM 389 C ARG A 26 -11.684 -1.488 -3.673 1.00 0.00 C ATOM 390 O ARG A 26 -12.856 -1.117 -3.729 1.00 0.00 O ATOM 391 CB ARG A 26 -10.831 -3.319 -5.114 1.00 0.00 C ATOM 392 CG ARG A 26 -9.939 -3.795 -6.247 1.00 0.00 C ATOM 393 CD ARG A 26 -10.669 -4.793 -7.133 1.00 0.00 C ATOM 394 NE ARG A 26 -10.508 -6.168 -6.665 1.00 0.00 N ATOM 395 CZ ARG A 26 -11.516 -7.028 -6.506 1.00 0.00 C ATOM 396 NH1 ARG A 26 -12.763 -6.669 -6.784 1.00 0.00 N ATOM 397 NH2 ARG A 26 -11.272 -8.256 -6.070 1.00 0.00 N ATOM 0 H ARG A 26 -8.819 -1.752 -5.293 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.398 -1.377 -5.818 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.476 -3.758 -4.181 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -11.840 -3.697 -5.281 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -9.616 -2.942 -6.844 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.040 -4.256 -5.838 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -11.729 -4.543 -7.162 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.294 -4.712 -8.153 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.566 -6.491 -6.446 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -12.959 -5.727 -7.123 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -13.525 -7.335 -6.659 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -10.316 -8.541 -5.857 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -12.040 -8.916 -5.947 1.00 0.00 H new ATOM 411 N THR A 27 -11.019 -1.638 -2.523 1.00 0.00 N ATOM 412 CA THR A 27 -11.637 -1.373 -1.226 1.00 0.00 C ATOM 413 C THR A 27 -10.716 -1.812 -0.091 1.00 0.00 C ATOM 414 O THR A 27 -10.186 -2.922 -0.104 1.00 0.00 O ATOM 415 CB THR A 27 -12.987 -2.092 -1.106 1.00 0.00 C ATOM 416 OG1 THR A 27 -13.069 -3.169 -2.027 1.00 0.00 O ATOM 417 CG2 THR A 27 -14.174 -1.180 -1.344 1.00 0.00 C ATOM 0 H THR A 27 -10.047 -1.943 -2.468 1.00 0.00 H new ATOM 0 HA THR A 27 -11.805 -0.299 -1.151 1.00 0.00 H new ATOM 0 HB THR A 27 -13.032 -2.454 -0.079 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.987 -3.513 -2.048 1.00 0.00 H new ATOM 0 HG21 THR A 27 -15.097 -1.751 -1.244 1.00 0.00 H new ATOM 0 HG22 THR A 27 -14.165 -0.373 -0.611 1.00 0.00 H new ATOM 0 HG23 THR A 27 -14.114 -0.759 -2.348 1.00 0.00 H new ATOM 425 N LEU A 28 -10.530 -0.931 0.887 1.00 0.00 N ATOM 426 CA LEU A 28 -9.670 -1.230 2.028 1.00 0.00 C ATOM 427 C LEU A 28 -10.201 -2.424 2.814 1.00 0.00 C ATOM 428 O LEU A 28 -9.528 -3.448 2.936 1.00 0.00 O ATOM 429 CB LEU A 28 -9.561 -0.011 2.946 1.00 0.00 C ATOM 430 CG LEU A 28 -8.501 -0.121 4.043 1.00 0.00 C ATOM 431 CD1 LEU A 28 -8.010 1.260 4.451 1.00 0.00 C ATOM 432 CD2 LEU A 28 -9.050 -0.874 5.246 1.00 0.00 C ATOM 0 H LEU A 28 -10.961 -0.007 0.913 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.680 -1.480 1.646 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.342 0.866 2.336 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.530 0.160 3.414 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.654 -0.682 3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -7.256 1.162 5.232 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.574 1.761 3.587 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.848 1.848 4.827 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.281 -0.941 6.015 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.915 -0.343 5.644 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.348 -1.877 4.942 1.00 0.00 H new ATOM 444 N GLU A 29 -11.412 -2.288 3.347 1.00 0.00 N ATOM 445 CA GLU A 29 -12.033 -3.355 4.124 1.00 0.00 C ATOM 446 C GLU A 29 -12.062 -4.660 3.335 1.00 0.00 C ATOM 447 O GLU A 29 -11.590 -5.696 3.808 1.00 0.00 O ATOM 448 CB GLU A 29 -13.455 -2.961 4.528 1.00 0.00 C ATOM 449 CG GLU A 29 -14.126 -3.967 5.448 1.00 0.00 C ATOM 450 CD GLU A 29 -15.638 -3.943 5.335 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.256 -2.982 5.840 1.00 0.00 O ATOM 452 OE2 GLU A 29 -16.203 -4.883 4.740 1.00 0.00 O ATOM 0 H GLU A 29 -11.983 -1.448 3.255 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.435 -3.508 5.023 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.427 -1.990 5.023 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.060 -2.843 3.629 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -13.764 -4.968 5.212 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -13.839 -3.759 6.479 1.00 0.00 H new ATOM 459 N ASP A 30 -12.616 -4.605 2.126 1.00 0.00 N ATOM 460 CA ASP A 30 -12.701 -5.782 1.270 1.00 0.00 C ATOM 461 C ASP A 30 -11.313 -6.345 0.980 1.00 0.00 C ATOM 462 O ASP A 30 -11.157 -7.539 0.726 1.00 0.00 O ATOM 463 CB ASP A 30 -13.407 -5.434 -0.042 1.00 0.00 C ATOM 464 CG ASP A 30 -14.097 -6.634 -0.660 1.00 0.00 C ATOM 465 OD1 ASP A 30 -13.393 -7.492 -1.235 1.00 0.00 O ATOM 466 OD2 ASP A 30 -15.339 -6.717 -0.572 1.00 0.00 O ATOM 0 H ASP A 30 -13.012 -3.758 1.719 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.279 -6.542 1.796 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -14.141 -4.649 0.140 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.680 -5.032 -0.748 1.00 0.00 H new ATOM 471 N GLY A 31 -10.307 -5.476 1.015 1.00 0.00 N ATOM 472 CA GLY A 31 -8.947 -5.904 0.752 1.00 0.00 C ATOM 473 C GLY A 31 -8.445 -6.904 1.775 1.00 0.00 C ATOM 474 O GLY A 31 -7.881 -7.938 1.416 1.00 0.00 O ATOM 0 H GLY A 31 -10.411 -4.482 1.221 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.895 -6.349 -0.242 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.290 -5.034 0.746 1.00 0.00 H new ATOM 478 N LYS A 32 -8.647 -6.596 3.051 1.00 0.00 N ATOM 479 CA LYS A 32 -8.208 -7.476 4.129 1.00 0.00 C ATOM 480 C LYS A 32 -8.857 -8.850 4.010 1.00 0.00 C ATOM 481 O LYS A 32 -8.181 -9.877 4.091 1.00 0.00 O ATOM 482 CB LYS A 32 -8.544 -6.858 5.489 1.00 0.00 C ATOM 483 CG LYS A 32 -8.032 -7.668 6.668 1.00 0.00 C ATOM 484 CD LYS A 32 -8.102 -6.872 7.963 1.00 0.00 C ATOM 485 CE LYS A 32 -9.356 -7.208 8.754 1.00 0.00 C ATOM 486 NZ LYS A 32 -9.338 -6.592 10.110 1.00 0.00 N ATOM 0 H LYS A 32 -9.112 -5.744 3.365 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.128 -7.596 4.047 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.121 -5.855 5.537 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.626 -6.753 5.574 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.621 -8.580 6.768 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.002 -7.973 6.482 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -7.221 -7.082 8.569 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.087 -5.806 7.738 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.233 -6.860 8.209 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -9.447 -8.290 8.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -10.210 -6.845 10.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.515 -6.943 10.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -9.277 -5.558 10.021 1.00 0.00 H new ATOM 500 N LYS A 33 -10.172 -8.865 3.816 1.00 0.00 N ATOM 501 CA LYS A 33 -10.914 -10.114 3.685 1.00 0.00 C ATOM 502 C LYS A 33 -10.397 -10.936 2.509 1.00 0.00 C ATOM 503 O LYS A 33 -10.315 -12.163 2.586 1.00 0.00 O ATOM 504 CB LYS A 33 -12.406 -9.828 3.508 1.00 0.00 C ATOM 505 CG LYS A 33 -13.256 -11.083 3.378 1.00 0.00 C ATOM 506 CD LYS A 33 -14.310 -10.935 2.291 1.00 0.00 C ATOM 507 CE LYS A 33 -14.375 -12.169 1.405 1.00 0.00 C ATOM 508 NZ LYS A 33 -13.651 -11.967 0.120 1.00 0.00 N ATOM 0 H LYS A 33 -10.746 -8.025 3.746 1.00 0.00 H new ATOM 0 HA LYS A 33 -10.768 -10.692 4.598 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.759 -9.247 4.360 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.546 -9.211 2.621 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.615 -11.935 3.151 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -13.742 -11.294 4.331 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.284 -10.763 2.749 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.085 -10.060 1.681 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.945 -13.019 1.934 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -15.417 -12.415 1.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -13.718 -12.830 -0.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -14.077 -11.172 -0.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.651 -11.758 0.314 1.00 0.00 H new ATOM 522 N GLU A 34 -10.053 -10.255 1.422 1.00 0.00 N ATOM 523 CA GLU A 34 -9.548 -10.923 0.229 1.00 0.00 C ATOM 524 C GLU A 34 -8.127 -11.434 0.447 1.00 0.00 C ATOM 525 O GLU A 34 -7.762 -12.506 -0.036 1.00 0.00 O ATOM 526 CB GLU A 34 -9.580 -9.971 -0.967 1.00 0.00 C ATOM 527 CG GLU A 34 -9.495 -10.681 -2.310 1.00 0.00 C ATOM 528 CD GLU A 34 -10.595 -10.256 -3.263 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.685 -9.049 -3.567 1.00 0.00 O ATOM 530 OE2 GLU A 34 -11.364 -11.133 -3.707 1.00 0.00 O ATOM 0 H GLU A 34 -10.115 -9.240 1.342 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.194 -11.777 0.024 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.499 -9.386 -0.932 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -8.752 -9.268 -0.884 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.526 -10.476 -2.765 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.552 -11.758 -2.152 1.00 0.00 H new ATOM 537 N ALA A 35 -7.330 -10.661 1.179 1.00 0.00 N ATOM 538 CA ALA A 35 -5.950 -11.037 1.461 1.00 0.00 C ATOM 539 C ALA A 35 -5.880 -12.386 2.168 1.00 0.00 C ATOM 540 O ALA A 35 -4.905 -13.122 2.025 1.00 0.00 O ATOM 541 CB ALA A 35 -5.271 -9.966 2.301 1.00 0.00 C ATOM 0 H ALA A 35 -7.617 -9.771 1.587 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.425 -11.126 0.510 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.241 -10.261 2.503 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.278 -9.020 1.759 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.807 -9.848 3.243 1.00 0.00 H new ATOM 547 N ALA A 36 -6.922 -12.703 2.931 1.00 0.00 N ATOM 548 CA ALA A 36 -6.980 -13.962 3.664 1.00 0.00 C ATOM 549 C ALA A 36 -7.047 -15.152 2.711 1.00 0.00 C ATOM 550 O ALA A 36 -6.281 -16.106 2.841 1.00 0.00 O ATOM 551 CB ALA A 36 -8.176 -13.969 4.603 1.00 0.00 C ATOM 0 H ALA A 36 -7.738 -12.104 3.057 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.067 -14.053 4.253 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.208 -14.914 5.144 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.086 -13.147 5.313 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -9.093 -13.850 4.025 1.00 0.00 H new ATOM 557 N ALA A 37 -7.969 -15.089 1.756 1.00 0.00 N ATOM 558 CA ALA A 37 -8.137 -16.162 0.783 1.00 0.00 C ATOM 559 C ALA A 37 -6.836 -16.438 0.036 1.00 0.00 C ATOM 560 O ALA A 37 -6.202 -17.475 0.235 1.00 0.00 O ATOM 561 CB ALA A 37 -9.248 -15.817 -0.197 1.00 0.00 C ATOM 0 H ALA A 37 -8.611 -14.306 1.635 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.412 -17.068 1.324 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.362 -16.627 -0.917 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -10.183 -15.680 0.346 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.996 -14.896 -0.723 1.00 0.00 H new ATOM 567 N SER A 38 -6.443 -15.505 -0.825 1.00 0.00 N ATOM 568 CA SER A 38 -5.217 -15.649 -1.600 1.00 0.00 C ATOM 569 C SER A 38 -3.996 -15.685 -0.686 1.00 0.00 C ATOM 570 O SER A 38 -2.984 -16.308 -1.011 1.00 0.00 O ATOM 571 CB SER A 38 -5.087 -14.501 -2.602 1.00 0.00 C ATOM 572 OG SER A 38 -6.065 -14.600 -3.622 1.00 0.00 O ATOM 0 H SER A 38 -6.956 -14.642 -1.003 1.00 0.00 H new ATOM 0 HA SER A 38 -5.267 -16.593 -2.143 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.193 -13.548 -2.084 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.092 -14.513 -3.046 1.00 0.00 H new ATOM 0 HG SER A 38 -5.961 -13.853 -4.248 1.00 0.00 H new ATOM 578 N GLY A 39 -4.098 -15.015 0.457 1.00 0.00 N ATOM 579 CA GLY A 39 -2.995 -14.983 1.399 1.00 0.00 C ATOM 580 C GLY A 39 -1.915 -14.001 0.994 1.00 0.00 C ATOM 581 O GLY A 39 -0.735 -14.215 1.272 1.00 0.00 O ATOM 0 H GLY A 39 -4.925 -14.494 0.748 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.372 -14.717 2.386 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.563 -15.980 1.481 1.00 0.00 H new ATOM 585 N LEU A 40 -2.316 -12.916 0.338 1.00 0.00 N ATOM 586 CA LEU A 40 -1.369 -11.897 -0.098 1.00 0.00 C ATOM 587 C LEU A 40 -1.510 -10.633 0.747 1.00 0.00 C ATOM 588 O LEU A 40 -2.608 -10.287 1.181 1.00 0.00 O ATOM 589 CB LEU A 40 -1.574 -11.568 -1.583 1.00 0.00 C ATOM 590 CG LEU A 40 -3.012 -11.239 -1.991 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.427 -9.879 -1.450 1.00 0.00 C ATOM 592 CD2 LEU A 40 -3.160 -11.278 -3.503 1.00 0.00 C ATOM 0 H LEU A 40 -3.288 -12.721 0.098 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.362 -12.292 0.034 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.938 -10.721 -1.841 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.231 -12.416 -2.176 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.670 -11.994 -1.560 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.452 -9.665 -1.752 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.363 -9.885 -0.362 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.764 -9.111 -1.848 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.189 -11.042 -3.774 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.489 -10.547 -3.953 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.908 -12.274 -3.868 1.00 0.00 H new ATOM 604 N PRO A 41 -0.394 -9.922 0.993 1.00 0.00 N ATOM 605 CA PRO A 41 -0.403 -8.691 1.792 1.00 0.00 C ATOM 606 C PRO A 41 -1.286 -7.617 1.173 1.00 0.00 C ATOM 607 O PRO A 41 -1.735 -7.747 0.036 1.00 0.00 O ATOM 608 CB PRO A 41 1.065 -8.246 1.795 1.00 0.00 C ATOM 609 CG PRO A 41 1.687 -8.951 0.638 1.00 0.00 C ATOM 610 CD PRO A 41 0.956 -10.256 0.513 1.00 0.00 C ATOM 0 HA PRO A 41 -0.806 -8.856 2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.149 -7.164 1.689 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.556 -8.514 2.730 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.594 -8.362 -0.274 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.752 -9.114 0.806 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.942 -10.614 -0.516 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.418 -11.037 1.116 1.00 0.00 H new ATOM 618 N LEU A 42 -1.535 -6.549 1.918 1.00 0.00 N ATOM 619 CA LEU A 42 -2.366 -5.468 1.413 1.00 0.00 C ATOM 620 C LEU A 42 -1.512 -4.358 0.827 1.00 0.00 C ATOM 621 O LEU A 42 -0.309 -4.257 1.100 1.00 0.00 O ATOM 622 CB LEU A 42 -3.299 -4.902 2.495 1.00 0.00 C ATOM 623 CG LEU A 42 -3.113 -5.461 3.907 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.034 -4.745 4.885 1.00 0.00 C ATOM 625 CD2 LEU A 42 -3.374 -6.958 3.930 1.00 0.00 C ATOM 0 H LEU A 42 -1.178 -6.409 2.863 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.990 -5.890 0.625 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.163 -3.821 2.534 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -4.329 -5.083 2.188 1.00 0.00 H new ATOM 0 HG LEU A 42 -2.081 -5.289 4.212 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.891 -5.153 5.885 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.801 -3.680 4.891 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -5.071 -4.888 4.580 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -3.236 -7.336 4.943 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.396 -7.154 3.605 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -2.677 -7.459 3.258 1.00 0.00 H new ATOM 637 N MET A 43 -2.148 -3.530 0.014 1.00 0.00 N ATOM 638 CA MET A 43 -1.474 -2.422 -0.631 1.00 0.00 C ATOM 639 C MET A 43 -2.000 -1.098 -0.101 1.00 0.00 C ATOM 640 O MET A 43 -3.006 -0.578 -0.590 1.00 0.00 O ATOM 641 CB MET A 43 -1.662 -2.507 -2.143 1.00 0.00 C ATOM 642 CG MET A 43 -0.855 -1.465 -2.901 1.00 0.00 C ATOM 643 SD MET A 43 0.924 -1.706 -2.727 1.00 0.00 S ATOM 644 CE MET A 43 1.239 -0.821 -1.203 1.00 0.00 C ATOM 0 H MET A 43 -3.139 -3.608 -0.214 1.00 0.00 H new ATOM 0 HA MET A 43 -0.409 -2.479 -0.407 1.00 0.00 H new ATOM 0 HB2 MET A 43 -1.373 -3.501 -2.484 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.719 -2.383 -2.380 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.122 -1.502 -3.957 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.121 -0.471 -2.540 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.148 -0.228 -1.308 1.00 0.00 H new ATOM 0 HE2 MET A 43 0.399 -0.162 -0.985 1.00 0.00 H new ATOM 0 HE3 MET A 43 1.363 -1.533 -0.387 1.00 0.00 H new ATOM 654 N VAL A 44 -1.311 -0.567 0.909 1.00 0.00 N ATOM 655 CA VAL A 44 -1.697 0.692 1.529 1.00 0.00 C ATOM 656 C VAL A 44 -1.231 1.885 0.708 1.00 0.00 C ATOM 657 O VAL A 44 -0.502 2.748 1.198 1.00 0.00 O ATOM 658 CB VAL A 44 -1.133 0.812 2.958 1.00 0.00 C ATOM 659 CG1 VAL A 44 -1.672 2.057 3.645 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.462 -0.433 3.765 1.00 0.00 C ATOM 0 H VAL A 44 -0.479 -0.995 1.314 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.786 0.695 1.573 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.049 0.903 2.894 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.262 2.123 4.653 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.382 2.941 3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.759 2.001 3.699 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.056 -0.332 4.772 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.544 -0.556 3.820 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.022 -1.306 3.283 1.00 0.00 H new ATOM 670 N ILE A 45 -1.673 1.937 -0.541 1.00 0.00 N ATOM 671 CA ILE A 45 -1.319 3.036 -1.427 1.00 0.00 C ATOM 672 C ILE A 45 -2.079 4.290 -1.006 1.00 0.00 C ATOM 673 O ILE A 45 -3.289 4.382 -1.186 1.00 0.00 O ATOM 674 CB ILE A 45 -1.610 2.688 -2.916 1.00 0.00 C ATOM 675 CG1 ILE A 45 -1.806 3.943 -3.774 1.00 0.00 C ATOM 676 CG2 ILE A 45 -2.821 1.777 -3.040 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.513 4.518 -4.292 1.00 0.00 C ATOM 0 H ILE A 45 -2.277 1.231 -0.963 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.247 3.217 -1.344 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.733 2.161 -3.291 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.452 3.701 -4.618 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.322 4.701 -3.185 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -3.000 1.551 -4.091 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -2.637 0.851 -2.496 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -3.696 2.275 -2.622 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.723 5.404 -4.891 1.00 0.00 H new ATOM 0 HD12 ILE A 45 0.126 4.791 -3.452 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.005 3.775 -4.908 1.00 0.00 H new ATOM 689 N ILE A 46 -1.369 5.243 -0.421 1.00 0.00 N ATOM 690 CA ILE A 46 -1.999 6.472 0.040 1.00 0.00 C ATOM 691 C ILE A 46 -1.371 7.684 -0.623 1.00 0.00 C ATOM 692 O ILE A 46 -0.188 7.674 -0.963 1.00 0.00 O ATOM 693 CB ILE A 46 -1.882 6.620 1.567 1.00 0.00 C ATOM 694 CG1 ILE A 46 -1.967 5.256 2.249 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.962 7.547 2.100 1.00 0.00 C ATOM 696 CD1 ILE A 46 -0.936 5.076 3.341 1.00 0.00 C ATOM 0 H ILE A 46 -0.364 5.191 -0.255 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.053 6.414 -0.233 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.910 7.058 1.792 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -2.963 5.129 2.673 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.837 4.473 1.501 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.862 7.638 3.182 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.856 8.530 1.641 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.943 7.138 1.860 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.047 4.088 3.787 1.00 0.00 H new ATOM 0 HD12 ILE A 46 0.064 5.172 2.917 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.080 5.838 4.107 1.00 0.00 H new ATOM 708 N HIS A 47 -2.168 8.725 -0.814 1.00 0.00 N ATOM 709 CA HIS A 47 -1.665 9.937 -1.452 1.00 0.00 C ATOM 710 C HIS A 47 -2.291 11.197 -0.866 1.00 0.00 C ATOM 711 O HIS A 47 -3.480 11.458 -1.049 1.00 0.00 O ATOM 712 CB HIS A 47 -1.922 9.885 -2.960 1.00 0.00 C ATOM 713 CG HIS A 47 -3.293 9.404 -3.310 1.00 0.00 C ATOM 714 ND1 HIS A 47 -3.943 8.265 -2.977 1.00 0.00 N flip ATOM 715 CD2 HIS A 47 -4.167 10.129 -4.093 1.00 0.00 C flip ATOM 716 CE1 HIS A 47 -5.187 8.325 -3.559 1.00 0.00 C flip ATOM 717 NE2 HIS A 47 -5.296 9.457 -4.225 1.00 0.00 N flip ATOM 0 H HIS A 47 -3.151 8.758 -0.542 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.593 9.981 -1.262 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -1.775 10.880 -3.381 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.185 9.230 -3.425 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -3.579 7.505 -2.402 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.960 11.095 -4.530 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -5.952 7.566 -3.483 1.00 0.00 H new ATOM 726 N LYS A 48 -1.474 11.983 -0.172 1.00 0.00 N ATOM 727 CA LYS A 48 -1.941 13.231 0.428 1.00 0.00 C ATOM 728 C LYS A 48 -0.948 14.361 0.164 1.00 0.00 C ATOM 729 O LYS A 48 0.137 14.133 -0.372 1.00 0.00 O ATOM 730 CB LYS A 48 -2.160 13.060 1.931 1.00 0.00 C ATOM 731 CG LYS A 48 -3.602 12.758 2.305 1.00 0.00 C ATOM 732 CD LYS A 48 -3.786 12.684 3.813 1.00 0.00 C ATOM 733 CE LYS A 48 -4.458 13.935 4.359 1.00 0.00 C ATOM 734 NZ LYS A 48 -3.581 14.665 5.315 1.00 0.00 N ATOM 0 H LYS A 48 -0.488 11.780 -0.011 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.894 13.492 -0.033 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.523 12.253 2.293 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.844 13.970 2.442 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.254 13.530 1.896 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.905 11.813 1.854 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.386 11.809 4.064 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -2.816 12.553 4.292 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.722 14.595 3.533 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.388 13.660 4.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.076 15.511 5.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -3.349 14.044 6.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -2.705 14.951 4.833 1.00 0.00 H new ATOM 748 N SER A 49 -1.326 15.583 0.537 1.00 0.00 N ATOM 749 CA SER A 49 -0.463 16.745 0.330 1.00 0.00 C ATOM 750 C SER A 49 -0.278 17.009 -1.165 1.00 0.00 C ATOM 751 O SER A 49 -1.124 16.623 -1.973 1.00 0.00 O ATOM 752 CB SER A 49 0.892 16.524 1.007 1.00 0.00 C ATOM 753 OG SER A 49 1.602 17.745 1.138 1.00 0.00 O ATOM 0 H SER A 49 -2.219 15.794 0.982 1.00 0.00 H new ATOM 0 HA SER A 49 -0.937 17.618 0.778 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.742 16.079 1.991 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.482 15.817 0.424 1.00 0.00 H new ATOM 0 HG SER A 49 2.521 17.560 1.425 1.00 0.00 H new ATOM 759 N TRP A 50 0.829 17.658 -1.536 1.00 0.00 N ATOM 760 CA TRP A 50 1.107 17.953 -2.945 1.00 0.00 C ATOM 761 C TRP A 50 0.845 16.718 -3.799 1.00 0.00 C ATOM 762 O TRP A 50 -0.032 16.716 -4.664 1.00 0.00 O ATOM 763 CB TRP A 50 2.559 18.414 -3.127 1.00 0.00 C ATOM 764 CG TRP A 50 3.048 19.309 -2.028 1.00 0.00 C ATOM 765 CD1 TRP A 50 4.268 19.262 -1.419 1.00 0.00 C ATOM 766 CD2 TRP A 50 2.329 20.378 -1.404 1.00 0.00 C ATOM 767 NE1 TRP A 50 4.353 20.236 -0.454 1.00 0.00 N ATOM 768 CE2 TRP A 50 3.175 20.936 -0.427 1.00 0.00 C ATOM 769 CE3 TRP A 50 1.052 20.919 -1.579 1.00 0.00 C ATOM 770 CZ2 TRP A 50 2.782 22.007 0.373 1.00 0.00 C ATOM 771 CZ3 TRP A 50 0.665 21.983 -0.785 1.00 0.00 C ATOM 772 CH2 TRP A 50 1.529 22.515 0.180 1.00 0.00 C ATOM 0 H TRP A 50 1.543 17.987 -0.886 1.00 0.00 H new ATOM 0 HA TRP A 50 0.445 18.758 -3.264 1.00 0.00 H new ATOM 0 HB2 TRP A 50 3.205 17.538 -3.185 1.00 0.00 H new ATOM 0 HB3 TRP A 50 2.648 18.939 -4.078 1.00 0.00 H new ATOM 0 HD1 TRP A 50 5.053 18.561 -1.661 1.00 0.00 H new ATOM 0 HE1 TRP A 50 5.161 20.410 0.144 1.00 0.00 H new ATOM 0 HE3 TRP A 50 0.380 20.513 -2.321 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 3.444 22.421 1.119 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.319 22.410 -0.911 1.00 0.00 H new ATOM 0 HH2 TRP A 50 1.197 23.346 0.785 1.00 0.00 H new ATOM 783 N CYS A 51 1.593 15.657 -3.522 1.00 0.00 N ATOM 784 CA CYS A 51 1.434 14.393 -4.227 1.00 0.00 C ATOM 785 C CYS A 51 1.685 14.525 -5.729 1.00 0.00 C ATOM 786 O CYS A 51 0.980 15.250 -6.430 1.00 0.00 O ATOM 787 CB CYS A 51 0.021 13.844 -3.980 1.00 0.00 C ATOM 788 SG CYS A 51 -0.466 12.462 -5.069 1.00 0.00 S ATOM 0 H CYS A 51 2.321 15.649 -2.808 1.00 0.00 H new ATOM 0 HA CYS A 51 2.182 13.703 -3.837 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -0.049 13.513 -2.944 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -0.696 14.656 -4.104 1.00 0.00 H new ATOM 793 N GLY A 52 2.672 13.777 -6.215 1.00 0.00 N ATOM 794 CA GLY A 52 2.984 13.770 -7.632 1.00 0.00 C ATOM 795 C GLY A 52 2.599 12.447 -8.252 1.00 0.00 C ATOM 796 O GLY A 52 2.246 12.377 -9.428 1.00 0.00 O ATOM 0 H GLY A 52 3.265 13.172 -5.647 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.453 14.581 -8.131 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.049 13.950 -7.777 1.00 0.00 H new ATOM 800 N ALA A 53 2.649 11.394 -7.440 1.00 0.00 N ATOM 801 CA ALA A 53 2.283 10.065 -7.893 1.00 0.00 C ATOM 802 C ALA A 53 0.859 10.050 -8.396 1.00 0.00 C ATOM 803 O ALA A 53 0.467 9.137 -9.116 1.00 0.00 O ATOM 804 CB ALA A 53 2.470 9.048 -6.777 1.00 0.00 C ATOM 0 H ALA A 53 2.941 11.441 -6.464 1.00 0.00 H new ATOM 0 HA ALA A 53 2.940 9.790 -8.718 1.00 0.00 H new ATOM 0 HB1 ALA A 53 2.190 8.058 -7.137 1.00 0.00 H new ATOM 0 HB2 ALA A 53 3.514 9.039 -6.464 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.840 9.318 -5.930 1.00 0.00 H new ATOM 810 N CYS A 54 0.094 11.070 -8.033 1.00 0.00 N ATOM 811 CA CYS A 54 -1.279 11.151 -8.479 1.00 0.00 C ATOM 812 C CYS A 54 -1.342 11.639 -9.919 1.00 0.00 C ATOM 813 O CYS A 54 -2.149 11.159 -10.715 1.00 0.00 O ATOM 814 CB CYS A 54 -2.138 12.043 -7.566 1.00 0.00 C ATOM 815 SG CYS A 54 -1.233 13.378 -6.711 1.00 0.00 S ATOM 0 H CYS A 54 0.400 11.841 -7.439 1.00 0.00 H new ATOM 0 HA CYS A 54 -1.696 10.145 -8.426 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.933 12.489 -8.164 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -2.618 11.413 -6.817 1.00 0.00 H new ATOM 820 N LYS A 55 -0.466 12.575 -10.261 1.00 0.00 N ATOM 821 CA LYS A 55 -0.413 13.094 -11.617 1.00 0.00 C ATOM 822 C LYS A 55 0.355 12.123 -12.506 1.00 0.00 C ATOM 823 O LYS A 55 0.037 11.955 -13.684 1.00 0.00 O ATOM 824 CB LYS A 55 0.244 14.475 -11.643 1.00 0.00 C ATOM 825 CG LYS A 55 1.591 14.514 -10.948 1.00 0.00 C ATOM 826 CD LYS A 55 2.360 15.779 -11.293 1.00 0.00 C ATOM 827 CE LYS A 55 3.833 15.649 -10.938 1.00 0.00 C ATOM 828 NZ LYS A 55 4.149 16.297 -9.634 1.00 0.00 N ATOM 0 H LYS A 55 0.213 12.987 -9.621 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.430 13.198 -11.995 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.369 14.790 -12.679 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.422 15.195 -11.168 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.447 14.458 -9.869 1.00 0.00 H new ATOM 0 HG3 LYS A 55 2.176 13.641 -11.237 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.258 15.989 -12.358 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.929 16.625 -10.758 1.00 0.00 H new ATOM 0 HE2 LYS A 55 4.104 14.594 -10.895 1.00 0.00 H new ATOM 0 HE3 LYS A 55 4.437 16.101 -11.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.861 15.732 -9.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.522 17.253 -9.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.285 16.359 -9.059 1.00 0.00 H new ATOM 842 N ALA A 56 1.369 11.478 -11.928 1.00 0.00 N ATOM 843 CA ALA A 56 2.184 10.515 -12.661 1.00 0.00 C ATOM 844 C ALA A 56 1.470 9.175 -12.835 1.00 0.00 C ATOM 845 O ALA A 56 1.911 8.338 -13.615 1.00 0.00 O ATOM 846 CB ALA A 56 3.518 10.315 -11.961 1.00 0.00 C ATOM 0 H ALA A 56 1.644 11.607 -10.954 1.00 0.00 H new ATOM 0 HA ALA A 56 2.357 10.923 -13.657 1.00 0.00 H new ATOM 0 HB1 ALA A 56 4.117 9.594 -12.518 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.049 11.266 -11.911 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.347 9.941 -10.951 1.00 0.00 H new ATOM 852 N LEU A 57 0.385 8.953 -12.092 1.00 0.00 N ATOM 853 CA LEU A 57 -0.337 7.684 -12.188 1.00 0.00 C ATOM 854 C LEU A 57 -1.482 7.735 -13.197 1.00 0.00 C ATOM 855 O LEU A 57 -1.774 6.742 -13.861 1.00 0.00 O ATOM 856 CB LEU A 57 -0.884 7.258 -10.818 1.00 0.00 C ATOM 857 CG LEU A 57 -1.814 8.264 -10.121 1.00 0.00 C ATOM 858 CD1 LEU A 57 -3.164 8.353 -10.822 1.00 0.00 C ATOM 859 CD2 LEU A 57 -2.002 7.886 -8.658 1.00 0.00 C ATOM 0 H LEU A 57 -0.008 9.621 -11.429 1.00 0.00 H new ATOM 0 HA LEU A 57 0.386 6.948 -12.539 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.424 6.319 -10.941 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.040 7.057 -10.159 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.344 9.246 -10.176 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.797 9.073 -10.303 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.018 8.675 -11.853 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.644 7.375 -10.812 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.663 8.608 -8.178 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.443 6.891 -8.593 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.035 7.888 -8.154 1.00 0.00 H new ATOM 871 N LYS A 58 -2.159 8.869 -13.287 1.00 0.00 N ATOM 872 CA LYS A 58 -3.299 8.999 -14.189 1.00 0.00 C ATOM 873 C LYS A 58 -3.021 8.440 -15.594 1.00 0.00 C ATOM 874 O LYS A 58 -3.504 7.358 -15.942 1.00 0.00 O ATOM 875 CB LYS A 58 -3.756 10.457 -14.267 1.00 0.00 C ATOM 876 CG LYS A 58 -4.867 10.801 -13.287 1.00 0.00 C ATOM 877 CD LYS A 58 -4.563 12.081 -12.526 1.00 0.00 C ATOM 878 CE LYS A 58 -4.645 13.300 -13.430 1.00 0.00 C ATOM 879 NZ LYS A 58 -5.929 14.034 -13.258 1.00 0.00 N ATOM 0 H LYS A 58 -1.943 9.710 -12.751 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.102 8.393 -13.769 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.902 11.107 -14.078 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.099 10.668 -15.280 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.808 10.912 -13.826 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.999 9.980 -12.582 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.267 12.191 -11.701 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.567 12.018 -12.089 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.812 13.969 -13.213 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.541 12.989 -14.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.945 14.858 -13.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.723 13.403 -13.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.017 14.354 -12.272 1.00 0.00 H new ATOM 893 N PRO A 59 -2.250 9.161 -16.431 1.00 0.00 N ATOM 894 CA PRO A 59 -1.950 8.724 -17.800 1.00 0.00 C ATOM 895 C PRO A 59 -0.912 7.615 -17.882 1.00 0.00 C ATOM 896 O PRO A 59 -0.830 6.910 -18.886 1.00 0.00 O ATOM 897 CB PRO A 59 -1.411 9.994 -18.452 1.00 0.00 C ATOM 898 CG PRO A 59 -0.770 10.733 -17.333 1.00 0.00 C ATOM 899 CD PRO A 59 -1.617 10.458 -16.120 1.00 0.00 C ATOM 0 HA PRO A 59 -2.832 8.299 -18.279 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.694 9.764 -19.240 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -2.210 10.578 -18.909 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.255 10.396 -17.178 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.726 11.801 -17.545 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -1.015 10.404 -15.213 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.360 11.240 -15.963 1.00 0.00 H new ATOM 907 N LYS A 60 -0.108 7.467 -16.839 1.00 0.00 N ATOM 908 CA LYS A 60 0.926 6.442 -16.838 1.00 0.00 C ATOM 909 C LYS A 60 0.457 5.177 -16.132 1.00 0.00 C ATOM 910 O LYS A 60 0.490 4.091 -16.711 1.00 0.00 O ATOM 911 CB LYS A 60 2.203 6.973 -16.186 1.00 0.00 C ATOM 912 CG LYS A 60 2.994 5.910 -15.435 1.00 0.00 C ATOM 913 CD LYS A 60 3.571 4.878 -16.388 1.00 0.00 C ATOM 914 CE LYS A 60 4.579 5.502 -17.339 1.00 0.00 C ATOM 915 NZ LYS A 60 4.221 5.264 -18.766 1.00 0.00 N ATOM 0 H LYS A 60 -0.150 8.035 -15.993 1.00 0.00 H new ATOM 0 HA LYS A 60 1.139 6.185 -17.875 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.839 7.410 -16.956 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.942 7.775 -15.495 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.801 6.382 -14.874 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.347 5.417 -14.709 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.051 4.083 -15.818 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.765 4.419 -16.960 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.637 6.575 -17.154 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.568 5.090 -17.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.934 5.706 -19.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.191 4.241 -18.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.288 5.679 -18.964 1.00 0.00 H new ATOM 929 N PHE A 61 0.020 5.310 -14.882 1.00 0.00 N ATOM 930 CA PHE A 61 -0.445 4.156 -14.136 1.00 0.00 C ATOM 931 C PHE A 61 -1.641 3.550 -14.833 1.00 0.00 C ATOM 932 O PHE A 61 -1.945 2.378 -14.639 1.00 0.00 O ATOM 933 CB PHE A 61 -0.769 4.512 -12.693 1.00 0.00 C ATOM 934 CG PHE A 61 -0.800 3.313 -11.787 1.00 0.00 C ATOM 935 CD1 PHE A 61 -1.916 2.492 -11.740 1.00 0.00 C ATOM 936 CD2 PHE A 61 0.284 3.010 -10.981 1.00 0.00 C ATOM 937 CE1 PHE A 61 -1.948 1.389 -10.905 1.00 0.00 C ATOM 938 CE2 PHE A 61 0.260 1.909 -10.146 1.00 0.00 C ATOM 939 CZ PHE A 61 -0.858 1.098 -10.109 1.00 0.00 C ATOM 0 H PHE A 61 -0.020 6.194 -14.375 1.00 0.00 H new ATOM 0 HA PHE A 61 0.357 3.419 -14.104 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.028 5.221 -12.324 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.736 5.014 -12.656 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -2.770 2.716 -12.362 1.00 0.00 H new ATOM 0 HD2 PHE A 61 1.159 3.642 -11.005 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.823 0.757 -10.876 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.113 1.683 -9.524 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.879 0.237 -9.458 1.00 0.00 H new ATOM 949 N ALA A 62 -2.287 4.328 -15.702 1.00 0.00 N ATOM 950 CA ALA A 62 -3.394 3.803 -16.471 1.00 0.00 C ATOM 951 C ALA A 62 -2.901 2.571 -17.243 1.00 0.00 C ATOM 952 O ALA A 62 -3.680 1.694 -17.619 1.00 0.00 O ATOM 953 CB ALA A 62 -3.933 4.871 -17.407 1.00 0.00 C ATOM 0 H ALA A 62 -2.061 5.306 -15.883 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.212 3.508 -15.814 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.766 4.465 -17.981 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.276 5.726 -16.824 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.144 5.190 -18.088 1.00 0.00 H new ATOM 959 N GLU A 63 -1.574 2.515 -17.424 1.00 0.00 N ATOM 960 CA GLU A 63 -0.895 1.407 -18.091 1.00 0.00 C ATOM 961 C GLU A 63 -0.904 0.172 -17.205 1.00 0.00 C ATOM 962 O GLU A 63 -0.629 -0.941 -17.658 1.00 0.00 O ATOM 963 CB GLU A 63 0.549 1.810 -18.422 1.00 0.00 C ATOM 964 CG GLU A 63 1.132 1.061 -19.609 1.00 0.00 C ATOM 965 CD GLU A 63 2.037 1.931 -20.459 1.00 0.00 C ATOM 966 OE1 GLU A 63 3.171 2.216 -20.019 1.00 0.00 O ATOM 967 OE2 GLU A 63 1.613 2.327 -21.565 1.00 0.00 O ATOM 0 H GLU A 63 -0.940 3.248 -17.106 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.422 1.173 -19.016 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.581 2.880 -18.627 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.176 1.634 -17.548 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.695 0.200 -19.250 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.320 0.676 -20.226 1.00 0.00 H new ATOM 974 N SER A 64 -1.234 0.378 -15.936 1.00 0.00 N ATOM 975 CA SER A 64 -1.296 -0.700 -14.969 1.00 0.00 C ATOM 976 C SER A 64 -2.297 -1.775 -15.379 1.00 0.00 C ATOM 977 O SER A 64 -2.546 -2.706 -14.617 1.00 0.00 O ATOM 978 CB SER A 64 -1.665 -0.145 -13.602 1.00 0.00 C ATOM 979 OG SER A 64 -0.560 0.506 -13.003 1.00 0.00 O ATOM 0 H SER A 64 -1.465 1.295 -15.554 1.00 0.00 H new ATOM 0 HA SER A 64 -0.311 -1.165 -14.926 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.494 0.556 -13.702 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.008 -0.954 -12.957 1.00 0.00 H new ATOM 0 HG SER A 64 -0.873 1.070 -12.265 1.00 0.00 H new ATOM 985 N THR A 65 -2.857 -1.668 -16.587 1.00 0.00 N ATOM 986 CA THR A 65 -3.795 -2.674 -17.067 1.00 0.00 C ATOM 987 C THR A 65 -3.196 -4.051 -16.825 1.00 0.00 C ATOM 988 O THR A 65 -3.892 -4.995 -16.447 1.00 0.00 O ATOM 989 CB THR A 65 -4.089 -2.471 -18.554 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.814 -1.137 -18.943 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.524 -2.772 -18.927 1.00 0.00 C ATOM 0 H THR A 65 -2.678 -0.904 -17.239 1.00 0.00 H new ATOM 0 HA THR A 65 -4.738 -2.583 -16.528 1.00 0.00 H new ATOM 0 HB THR A 65 -3.440 -3.175 -19.075 1.00 0.00 H new ATOM 0 HG1 THR A 65 -4.007 -1.028 -19.898 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.664 -2.608 -19.995 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.752 -3.810 -18.686 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.191 -2.115 -18.368 1.00 0.00 H new ATOM 999 N GLU A 66 -1.879 -4.137 -16.999 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.154 -5.374 -16.752 1.00 0.00 C ATOM 1001 C GLU A 66 -0.917 -5.514 -15.266 1.00 0.00 C ATOM 1002 O GLU A 66 -0.909 -6.622 -14.729 1.00 0.00 O ATOM 1003 CB GLU A 66 0.174 -5.394 -17.509 1.00 0.00 C ATOM 1004 CG GLU A 66 1.041 -4.182 -17.226 1.00 0.00 C ATOM 1005 CD GLU A 66 1.238 -3.302 -18.445 1.00 0.00 C ATOM 1006 OE1 GLU A 66 0.279 -3.160 -19.234 1.00 0.00 O ATOM 1007 OE2 GLU A 66 2.350 -2.758 -18.613 1.00 0.00 O ATOM 0 H GLU A 66 -1.294 -3.361 -17.311 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.749 -6.214 -17.111 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.724 -6.296 -17.242 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -0.026 -5.448 -18.579 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.586 -3.594 -16.429 1.00 0.00 H new ATOM 0 HG3 GLU A 66 2.013 -4.514 -16.862 1.00 0.00 H new ATOM 1014 N ILE A 67 -0.764 -4.380 -14.589 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.579 -4.403 -13.152 1.00 0.00 C ATOM 1016 C ILE A 67 -1.876 -4.836 -12.477 1.00 0.00 C ATOM 1017 O ILE A 67 -1.880 -5.216 -11.306 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.131 -3.036 -12.607 1.00 0.00 C ATOM 1019 CG1 ILE A 67 1.134 -2.567 -13.330 1.00 0.00 C ATOM 1020 CG2 ILE A 67 0.110 -3.113 -11.107 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.588 -1.184 -12.918 1.00 0.00 C ATOM 0 H ILE A 67 -0.765 -3.450 -15.009 1.00 0.00 H new ATOM 0 HA ILE A 67 0.213 -5.118 -12.928 1.00 0.00 H new ATOM 0 HB ILE A 67 -0.925 -2.312 -12.789 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.938 -3.277 -13.136 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.953 -2.576 -14.405 1.00 0.00 H new ATOM 0 HG21 ILE A 67 0.426 -2.137 -10.739 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -0.811 -3.409 -10.605 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.888 -3.848 -10.901 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.489 -0.917 -13.470 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.801 -0.462 -13.137 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.801 -1.174 -11.849 1.00 0.00 H new ATOM 1033 N SER A 68 -2.975 -4.808 -13.238 1.00 0.00 N ATOM 1034 CA SER A 68 -4.265 -5.232 -12.717 1.00 0.00 C ATOM 1035 C SER A 68 -4.219 -6.725 -12.430 1.00 0.00 C ATOM 1036 O SER A 68 -4.850 -7.212 -11.492 1.00 0.00 O ATOM 1037 CB SER A 68 -5.381 -4.917 -13.714 1.00 0.00 C ATOM 1038 OG SER A 68 -5.443 -5.895 -14.738 1.00 0.00 O ATOM 0 H SER A 68 -2.991 -4.497 -14.209 1.00 0.00 H new ATOM 0 HA SER A 68 -4.475 -4.689 -11.796 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.337 -4.872 -13.192 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.212 -3.935 -14.155 1.00 0.00 H new ATOM 0 HG SER A 68 -4.645 -5.828 -15.303 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.441 -7.440 -13.238 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.274 -8.873 -13.066 1.00 0.00 C ATOM 1046 C GLU A 69 -2.223 -9.133 -11.999 1.00 0.00 C ATOM 1047 O GLU A 69 -2.389 -10.000 -11.142 1.00 0.00 O ATOM 1048 CB GLU A 69 -2.867 -9.533 -14.385 1.00 0.00 C ATOM 1049 CG GLU A 69 -3.715 -9.100 -15.569 1.00 0.00 C ATOM 1050 CD GLU A 69 -5.185 -9.427 -15.384 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -5.821 -8.815 -14.501 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -5.696 -10.296 -16.120 1.00 0.00 O ATOM 0 H GLU A 69 -2.917 -7.046 -14.019 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.224 -9.306 -12.752 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.823 -9.299 -14.592 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.935 -10.615 -14.276 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.601 -8.026 -15.719 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.349 -9.589 -16.472 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.145 -8.354 -12.051 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.069 -8.479 -11.071 1.00 0.00 C ATOM 1061 C LEU A 70 -0.605 -8.300 -9.653 1.00 0.00 C ATOM 1062 O LEU A 70 0.014 -8.732 -8.686 1.00 0.00 O ATOM 1063 CB LEU A 70 1.013 -7.432 -11.326 1.00 0.00 C ATOM 1064 CG LEU A 70 1.952 -7.725 -12.495 1.00 0.00 C ATOM 1065 CD1 LEU A 70 2.204 -6.453 -13.282 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.264 -8.313 -11.994 1.00 0.00 C ATOM 0 H LEU A 70 -0.994 -7.634 -12.757 1.00 0.00 H new ATOM 0 HA LEU A 70 0.357 -9.477 -11.173 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.529 -6.471 -11.504 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.611 -7.325 -10.421 1.00 0.00 H new ATOM 0 HG LEU A 70 1.482 -8.458 -13.150 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.874 -6.667 -14.115 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.259 -6.070 -13.666 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.660 -5.707 -12.631 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.919 -8.515 -12.841 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.748 -7.604 -11.322 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.066 -9.242 -11.459 1.00 0.00 H new ATOM 1078 N SER A 71 -1.760 -7.647 -9.541 1.00 0.00 N ATOM 1079 CA SER A 71 -2.384 -7.384 -8.242 1.00 0.00 C ATOM 1080 C SER A 71 -2.362 -8.599 -7.314 1.00 0.00 C ATOM 1081 O SER A 71 -2.517 -8.455 -6.103 1.00 0.00 O ATOM 1082 CB SER A 71 -3.827 -6.940 -8.428 1.00 0.00 C ATOM 1083 OG SER A 71 -3.939 -5.528 -8.389 1.00 0.00 O ATOM 0 H SER A 71 -2.286 -7.288 -10.337 1.00 0.00 H new ATOM 0 HA SER A 71 -1.795 -6.594 -7.776 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.204 -7.311 -9.381 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.448 -7.378 -7.647 1.00 0.00 H new ATOM 0 HG SER A 71 -4.267 -5.250 -7.508 1.00 0.00 H new ATOM 1089 N HIS A 72 -2.151 -9.788 -7.870 1.00 0.00 N ATOM 1090 CA HIS A 72 -2.093 -10.998 -7.061 1.00 0.00 C ATOM 1091 C HIS A 72 -1.028 -10.851 -5.981 1.00 0.00 C ATOM 1092 O HIS A 72 -0.978 -11.625 -5.025 1.00 0.00 O ATOM 1093 CB HIS A 72 -1.796 -12.217 -7.935 1.00 0.00 C ATOM 1094 CG HIS A 72 -3.006 -12.759 -8.632 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -3.452 -14.054 -8.467 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -3.866 -12.175 -9.499 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -4.534 -14.241 -9.203 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -4.805 -13.117 -9.839 1.00 0.00 N ATOM 0 H HIS A 72 -2.018 -9.938 -8.870 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.063 -11.146 -6.586 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -1.047 -11.947 -8.680 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -1.361 -13.001 -7.316 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -3.822 -11.157 -9.857 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.100 -15.158 -9.272 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -5.586 -12.972 -10.479 1.00 0.00 H new ATOM 1107 N ASN A 73 -0.174 -9.847 -6.149 1.00 0.00 N ATOM 1108 CA ASN A 73 0.894 -9.574 -5.208 1.00 0.00 C ATOM 1109 C ASN A 73 0.346 -9.116 -3.856 1.00 0.00 C ATOM 1110 O ASN A 73 0.693 -9.674 -2.815 1.00 0.00 O ATOM 1111 CB ASN A 73 1.800 -8.510 -5.807 1.00 0.00 C ATOM 1112 CG ASN A 73 2.328 -8.933 -7.163 1.00 0.00 C ATOM 1113 OD1 ASN A 73 2.823 -10.049 -7.328 1.00 0.00 O ATOM 1114 ND2 ASN A 73 2.217 -8.054 -8.147 1.00 0.00 N ATOM 0 H ASN A 73 -0.207 -9.204 -6.940 1.00 0.00 H new ATOM 0 HA ASN A 73 1.458 -10.489 -5.029 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.250 -7.574 -5.905 1.00 0.00 H new ATOM 0 HB3 ASN A 73 2.635 -8.319 -5.133 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.548 -8.291 -9.082 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.801 -7.140 -7.970 1.00 0.00 H new ATOM 1121 N PHE A 74 -0.509 -8.100 -3.882 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.113 -7.563 -2.675 1.00 0.00 C ATOM 1123 C PHE A 74 -2.597 -7.274 -2.909 1.00 0.00 C ATOM 1124 O PHE A 74 -3.208 -7.896 -3.778 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.365 -6.314 -2.213 1.00 0.00 C ATOM 1126 CG PHE A 74 0.568 -5.722 -3.232 1.00 0.00 C ATOM 1127 CD1 PHE A 74 1.865 -6.200 -3.371 1.00 0.00 C ATOM 1128 CD2 PHE A 74 0.157 -4.670 -4.030 1.00 0.00 C ATOM 1129 CE1 PHE A 74 2.727 -5.633 -4.285 1.00 0.00 C ATOM 1130 CE2 PHE A 74 1.016 -4.104 -4.948 1.00 0.00 C ATOM 1131 CZ PHE A 74 2.301 -4.585 -5.073 1.00 0.00 C ATOM 0 H PHE A 74 -0.800 -7.629 -4.739 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.038 -8.306 -1.881 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.095 -5.557 -1.926 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.207 -6.561 -1.318 1.00 0.00 H new ATOM 0 HD1 PHE A 74 2.201 -7.023 -2.758 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -0.848 -4.287 -3.933 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.735 -6.009 -4.384 1.00 0.00 H new ATOM 0 HE2 PHE A 74 0.682 -3.285 -5.568 1.00 0.00 H new ATOM 0 HZ PHE A 74 2.976 -4.140 -5.790 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.204 -6.369 -2.128 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.633 -6.107 -2.307 1.00 0.00 C ATOM 1143 C VAL A 75 -5.069 -4.638 -2.138 1.00 0.00 C ATOM 1144 O VAL A 75 -4.546 -3.885 -1.320 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.466 -6.991 -1.350 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.464 -6.432 0.068 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -6.887 -7.147 -1.868 1.00 0.00 C ATOM 0 H VAL A 75 -2.747 -5.827 -1.395 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.823 -6.355 -3.351 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.001 -7.976 -1.316 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.059 -7.077 0.714 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.441 -6.389 0.441 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.891 -5.429 0.064 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.458 -7.772 -1.181 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.357 -6.166 -1.942 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -6.866 -7.615 -2.852 1.00 0.00 H new ATOM 1157 N MET A 76 -6.071 -4.295 -2.946 1.00 0.00 N ATOM 1158 CA MET A 76 -6.720 -2.995 -3.019 1.00 0.00 C ATOM 1159 C MET A 76 -6.904 -2.256 -1.688 1.00 0.00 C ATOM 1160 O MET A 76 -7.956 -2.377 -1.054 1.00 0.00 O ATOM 1161 CB MET A 76 -8.116 -3.264 -3.568 1.00 0.00 C ATOM 1162 CG MET A 76 -8.840 -4.375 -2.804 1.00 0.00 C ATOM 1163 SD MET A 76 -9.299 -5.815 -3.813 1.00 0.00 S ATOM 1164 CE MET A 76 -7.820 -6.124 -4.785 1.00 0.00 C ATOM 0 H MET A 76 -6.473 -4.961 -3.606 1.00 0.00 H new ATOM 0 HA MET A 76 -6.079 -2.356 -3.626 1.00 0.00 H new ATOM 0 HB2 MET A 76 -8.706 -2.349 -3.518 1.00 0.00 H new ATOM 0 HB3 MET A 76 -8.043 -3.539 -4.620 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.202 -4.710 -1.986 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.743 -3.960 -2.355 1.00 0.00 H new ATOM 0 HE1 MET A 76 -7.621 -7.195 -4.814 1.00 0.00 H new ATOM 0 HE2 MET A 76 -7.968 -5.755 -5.800 1.00 0.00 H new ATOM 0 HE3 MET A 76 -6.973 -5.610 -4.332 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.921 -1.427 -1.309 1.00 0.00 N ATOM 1175 CA VAL A 77 -6.040 -0.621 -0.095 1.00 0.00 C ATOM 1176 C VAL A 77 -5.491 0.784 -0.313 1.00 0.00 C ATOM 1177 O VAL A 77 -4.484 1.175 0.279 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.345 -1.270 1.119 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.388 -0.344 2.329 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -6.006 -2.590 1.444 1.00 0.00 C ATOM 0 H VAL A 77 -5.048 -1.301 -1.820 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.105 -0.561 0.127 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.300 -1.447 0.866 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.892 -0.824 3.172 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.878 0.589 2.091 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.425 -0.134 2.590 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.510 -3.043 2.302 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.057 -2.423 1.679 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.928 -3.257 0.586 1.00 0.00 H new ATOM 1190 N ASN A 78 -6.160 1.533 -1.177 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.756 2.889 -1.494 1.00 0.00 C ATOM 1192 C ASN A 78 -6.629 3.919 -0.789 1.00 0.00 C ATOM 1193 O ASN A 78 -7.772 4.153 -1.180 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.834 3.087 -3.000 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.794 4.536 -3.425 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -4.702 5.203 -3.104 1.00 0.00 O flip ATOM 1197 ND2 ASN A 78 -6.733 5.048 -4.035 1.00 0.00 N flip ATOM 0 H ASN A 78 -6.993 1.218 -1.674 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.734 3.035 -1.145 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -5.006 2.557 -3.471 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -6.754 2.634 -3.370 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -7.558 4.492 -4.261 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -6.686 6.028 -4.314 1.00 0.00 H new ATOM 1204 N LEU A 79 -6.078 4.545 0.242 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.812 5.566 0.987 1.00 0.00 C ATOM 1206 C LEU A 79 -6.249 6.969 0.721 1.00 0.00 C ATOM 1207 O LEU A 79 -5.114 7.134 0.252 1.00 0.00 O ATOM 1208 CB LEU A 79 -6.802 5.257 2.487 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.419 5.242 3.141 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -5.240 6.453 4.045 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -5.214 3.957 3.930 1.00 0.00 C ATOM 0 H LEU A 79 -5.133 4.368 0.582 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.844 5.550 0.638 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -7.420 5.996 2.998 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -7.271 4.286 2.645 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.668 5.287 2.352 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.250 6.424 4.501 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.342 7.365 3.456 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.000 6.439 4.827 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.225 3.965 4.388 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.973 3.883 4.708 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -5.297 3.101 3.260 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.063 7.978 1.019 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.677 9.369 0.814 1.00 0.00 C ATOM 1225 C GLU A 80 -7.022 10.213 2.039 1.00 0.00 C ATOM 1226 O GLU A 80 -7.377 9.679 3.090 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.377 9.936 -0.423 1.00 0.00 C ATOM 1228 CG GLU A 80 -6.517 10.903 -1.220 1.00 0.00 C ATOM 1229 CD GLU A 80 -7.284 12.134 -1.664 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -8.290 11.978 -2.387 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -6.879 13.255 -1.287 1.00 0.00 O ATOM 0 H GLU A 80 -7.999 7.856 1.405 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.598 9.404 0.661 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.677 9.112 -1.070 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.289 10.446 -0.112 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.664 11.209 -0.614 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.118 10.392 -2.096 1.00 0.00 H new ATOM 1238 N ASP A 81 -6.915 11.532 1.894 1.00 0.00 N ATOM 1239 CA ASP A 81 -7.215 12.456 2.986 1.00 0.00 C ATOM 1240 C ASP A 81 -8.516 12.079 3.692 1.00 0.00 C ATOM 1241 O ASP A 81 -8.676 12.320 4.889 1.00 0.00 O ATOM 1242 CB ASP A 81 -7.310 13.887 2.455 1.00 0.00 C ATOM 1243 CG ASP A 81 -7.176 14.922 3.554 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -7.749 14.707 4.644 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -6.498 15.947 3.326 1.00 0.00 O ATOM 0 H ASP A 81 -6.622 11.986 1.029 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.403 12.391 3.710 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.530 14.048 1.711 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.266 14.021 1.948 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.441 11.483 2.944 1.00 0.00 N ATOM 1251 CA GLU A 82 -10.724 11.072 3.504 1.00 0.00 C ATOM 1252 C GLU A 82 -10.521 10.112 4.673 1.00 0.00 C ATOM 1253 O GLU A 82 -11.279 10.126 5.641 1.00 0.00 O ATOM 1254 CB GLU A 82 -11.588 10.410 2.428 1.00 0.00 C ATOM 1255 CG GLU A 82 -12.573 11.361 1.769 1.00 0.00 C ATOM 1256 CD GLU A 82 -14.001 11.133 2.226 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -14.377 11.672 3.288 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -14.742 10.414 1.523 1.00 0.00 O ATOM 0 H GLU A 82 -9.326 11.275 1.952 1.00 0.00 H new ATOM 0 HA GLU A 82 -11.235 11.962 3.870 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.938 9.985 1.663 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -12.138 9.582 2.874 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -12.284 12.388 1.991 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -12.519 11.242 0.687 1.00 0.00 H new ATOM 1265 N GLU A 83 -9.487 9.284 4.573 1.00 0.00 N ATOM 1266 CA GLU A 83 -9.173 8.319 5.621 1.00 0.00 C ATOM 1267 C GLU A 83 -7.773 8.563 6.171 1.00 0.00 C ATOM 1268 O GLU A 83 -6.799 7.977 5.699 1.00 0.00 O ATOM 1269 CB GLU A 83 -9.281 6.892 5.081 1.00 0.00 C ATOM 1270 CG GLU A 83 -10.701 6.349 5.074 1.00 0.00 C ATOM 1271 CD GLU A 83 -10.744 4.833 5.148 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -10.138 4.180 4.274 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -11.384 4.303 6.080 1.00 0.00 O ATOM 0 H GLU A 83 -8.851 9.262 3.776 1.00 0.00 H new ATOM 0 HA GLU A 83 -9.893 8.446 6.429 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.886 6.866 4.065 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.653 6.236 5.684 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -11.250 6.766 5.918 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -11.209 6.680 4.168 1.00 0.00 H new ATOM 1280 N GLU A 84 -7.676 9.436 7.167 1.00 0.00 N ATOM 1281 CA GLU A 84 -6.393 9.761 7.777 1.00 0.00 C ATOM 1282 C GLU A 84 -6.216 9.029 9.106 1.00 0.00 C ATOM 1283 O GLU A 84 -6.593 9.544 10.159 1.00 0.00 O ATOM 1284 CB GLU A 84 -6.277 11.270 7.995 1.00 0.00 C ATOM 1285 CG GLU A 84 -7.521 11.892 8.610 1.00 0.00 C ATOM 1286 CD GLU A 84 -7.310 13.335 9.025 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -6.331 13.606 9.753 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -8.123 14.195 8.621 1.00 0.00 O ATOM 0 H GLU A 84 -8.472 9.932 7.569 1.00 0.00 H new ATOM 0 HA GLU A 84 -5.605 9.435 7.098 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.423 11.471 8.641 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -6.074 11.753 7.039 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -8.340 11.841 7.893 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -7.822 11.308 9.480 1.00 0.00 H new ATOM 1295 N PRO A 85 -5.634 7.815 9.077 1.00 0.00 N ATOM 1296 CA PRO A 85 -5.411 7.025 10.291 1.00 0.00 C ATOM 1297 C PRO A 85 -4.459 7.723 11.257 1.00 0.00 C ATOM 1298 O PRO A 85 -4.161 8.907 11.100 1.00 0.00 O ATOM 1299 CB PRO A 85 -4.795 5.720 9.775 1.00 0.00 C ATOM 1300 CG PRO A 85 -4.257 6.050 8.424 1.00 0.00 C ATOM 1301 CD PRO A 85 -5.150 7.125 7.870 1.00 0.00 C ATOM 0 HA PRO A 85 -6.333 6.872 10.852 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -4.005 5.368 10.438 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -5.541 4.927 9.719 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -3.225 6.396 8.489 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -4.258 5.171 7.779 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -4.605 7.801 7.211 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -5.972 6.706 7.289 1.00 0.00 H new ATOM 1309 N LYS A 86 -3.984 6.987 12.257 1.00 0.00 N ATOM 1310 CA LYS A 86 -3.067 7.548 13.243 1.00 0.00 C ATOM 1311 C LYS A 86 -1.951 6.563 13.578 1.00 0.00 C ATOM 1312 O LYS A 86 -1.918 5.990 14.669 1.00 0.00 O ATOM 1313 CB LYS A 86 -3.826 7.934 14.515 1.00 0.00 C ATOM 1314 CG LYS A 86 -3.277 9.178 15.194 1.00 0.00 C ATOM 1315 CD LYS A 86 -4.200 9.664 16.298 1.00 0.00 C ATOM 1316 CE LYS A 86 -3.413 10.199 17.485 1.00 0.00 C ATOM 1317 NZ LYS A 86 -4.203 10.144 18.746 1.00 0.00 N ATOM 0 H LYS A 86 -4.218 6.005 12.406 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.615 8.442 12.813 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.875 8.098 14.267 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.790 7.101 15.217 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.293 8.962 15.610 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.144 9.968 14.455 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -4.853 10.446 15.910 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -4.842 8.846 16.624 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -2.498 9.619 17.605 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -3.115 11.229 17.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.631 10.517 19.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.064 10.718 18.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -4.466 9.158 18.948 1.00 0.00 H new ATOM 1331 N ASP A 87 -1.036 6.373 12.634 1.00 0.00 N ATOM 1332 CA ASP A 87 0.085 5.460 12.827 1.00 0.00 C ATOM 1333 C ASP A 87 1.028 5.494 11.627 1.00 0.00 C ATOM 1334 O ASP A 87 0.823 6.255 10.682 1.00 0.00 O ATOM 1335 CB ASP A 87 -0.424 4.036 13.054 1.00 0.00 C ATOM 1336 CG ASP A 87 0.305 3.338 14.186 1.00 0.00 C ATOM 1337 OD1 ASP A 87 0.062 3.697 15.358 1.00 0.00 O ATOM 1338 OD2 ASP A 87 1.119 2.434 13.902 1.00 0.00 O ATOM 0 H ASP A 87 -1.048 6.839 11.727 1.00 0.00 H new ATOM 0 HA ASP A 87 0.639 5.784 13.708 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.491 4.065 13.275 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.304 3.459 12.137 1.00 0.00 H new ATOM 1343 N GLU A 88 2.062 4.660 11.673 1.00 0.00 N ATOM 1344 CA GLU A 88 3.042 4.583 10.593 1.00 0.00 C ATOM 1345 C GLU A 88 2.401 4.122 9.284 1.00 0.00 C ATOM 1346 O GLU A 88 3.003 4.236 8.217 1.00 0.00 O ATOM 1347 CB GLU A 88 4.175 3.630 10.977 1.00 0.00 C ATOM 1348 CG GLU A 88 4.879 4.011 12.269 1.00 0.00 C ATOM 1349 CD GLU A 88 5.546 5.370 12.191 1.00 0.00 C ATOM 1350 OE1 GLU A 88 6.724 5.432 11.780 1.00 0.00 O ATOM 1351 OE2 GLU A 88 4.889 6.374 12.541 1.00 0.00 O ATOM 0 H GLU A 88 2.244 4.025 12.450 1.00 0.00 H new ATOM 0 HA GLU A 88 3.444 5.585 10.439 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.773 2.622 11.076 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.906 3.604 10.169 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.157 4.011 13.085 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.628 3.256 12.506 1.00 0.00 H new ATOM 1358 N ASP A 89 1.184 3.590 9.375 1.00 0.00 N ATOM 1359 CA ASP A 89 0.464 3.095 8.204 1.00 0.00 C ATOM 1360 C ASP A 89 0.458 4.100 7.044 1.00 0.00 C ATOM 1361 O ASP A 89 0.170 3.726 5.907 1.00 0.00 O ATOM 1362 CB ASP A 89 -0.972 2.721 8.586 1.00 0.00 C ATOM 1363 CG ASP A 89 -1.317 1.294 8.203 1.00 0.00 C ATOM 1364 OD1 ASP A 89 -0.738 0.358 8.798 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -2.168 1.111 7.307 1.00 0.00 O ATOM 0 H ASP A 89 0.674 3.490 10.253 1.00 0.00 H new ATOM 0 HA ASP A 89 0.994 2.209 7.855 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -1.105 2.849 9.660 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -1.666 3.404 8.096 1.00 0.00 H new ATOM 1370 N PHE A 90 0.773 5.370 7.316 1.00 0.00 N ATOM 1371 CA PHE A 90 0.795 6.381 6.256 1.00 0.00 C ATOM 1372 C PHE A 90 2.219 6.850 5.955 1.00 0.00 C ATOM 1373 O PHE A 90 2.487 7.374 4.873 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.092 7.581 6.608 1.00 0.00 C ATOM 1375 CG PHE A 90 0.023 8.049 8.032 1.00 0.00 C ATOM 1376 CD1 PHE A 90 1.254 8.369 8.580 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -1.108 8.175 8.817 1.00 0.00 C ATOM 1378 CE1 PHE A 90 1.353 8.806 9.886 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -1.018 8.609 10.124 1.00 0.00 C ATOM 1380 CZ PHE A 90 0.215 8.926 10.660 1.00 0.00 C ATOM 0 H PHE A 90 1.012 5.718 8.244 1.00 0.00 H new ATOM 0 HA PHE A 90 0.395 5.908 5.359 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.161 8.409 5.946 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.131 7.319 6.408 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.147 8.276 7.979 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.075 7.931 8.402 1.00 0.00 H new ATOM 0 HE1 PHE A 90 2.319 9.054 10.302 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.910 8.701 10.726 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.289 9.267 11.682 1.00 0.00 H new ATOM 1390 N SER A 91 3.132 6.654 6.904 1.00 0.00 N ATOM 1391 CA SER A 91 4.527 7.054 6.723 1.00 0.00 C ATOM 1392 C SER A 91 5.398 6.523 7.861 1.00 0.00 C ATOM 1393 O SER A 91 5.542 7.172 8.897 1.00 0.00 O ATOM 1394 CB SER A 91 4.654 8.579 6.641 1.00 0.00 C ATOM 1395 OG SER A 91 3.396 9.192 6.418 1.00 0.00 O ATOM 0 H SER A 91 2.932 6.221 7.806 1.00 0.00 H new ATOM 0 HA SER A 91 4.874 6.623 5.784 1.00 0.00 H new ATOM 0 HB2 SER A 91 5.087 8.960 7.566 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.338 8.846 5.835 1.00 0.00 H new ATOM 0 HG SER A 91 3.531 10.097 6.067 1.00 0.00 H new ATOM 1401 N PRO A 92 5.992 5.331 7.678 1.00 0.00 N ATOM 1402 CA PRO A 92 6.852 4.707 8.682 1.00 0.00 C ATOM 1403 C PRO A 92 8.251 5.318 8.702 1.00 0.00 C ATOM 1404 O PRO A 92 8.631 5.993 9.658 1.00 0.00 O ATOM 1405 CB PRO A 92 6.920 3.233 8.244 1.00 0.00 C ATOM 1406 CG PRO A 92 6.026 3.112 7.048 1.00 0.00 C ATOM 1407 CD PRO A 92 5.881 4.494 6.487 1.00 0.00 C ATOM 0 HA PRO A 92 6.460 4.844 9.690 1.00 0.00 H new ATOM 0 HB2 PRO A 92 7.942 2.947 7.997 1.00 0.00 H new ATOM 0 HB3 PRO A 92 6.589 2.573 9.046 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.456 2.436 6.309 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.055 2.703 7.328 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.659 4.720 5.758 1.00 0.00 H new ATOM 0 HD3 PRO A 92 4.924 4.629 5.983 1.00 0.00 H new ATOM 1415 N ASP A 93 9.011 5.073 7.639 1.00 0.00 N ATOM 1416 CA ASP A 93 10.369 5.596 7.530 1.00 0.00 C ATOM 1417 C ASP A 93 10.535 6.419 6.257 1.00 0.00 C ATOM 1418 O ASP A 93 11.121 5.955 5.278 1.00 0.00 O ATOM 1419 CB ASP A 93 11.382 4.450 7.543 1.00 0.00 C ATOM 1420 CG ASP A 93 12.700 4.853 8.176 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.740 5.009 9.414 1.00 0.00 O ATOM 1422 OD2 ASP A 93 13.692 5.009 7.433 1.00 0.00 O ATOM 0 H ASP A 93 8.709 4.515 6.840 1.00 0.00 H new ATOM 0 HA ASP A 93 10.551 6.244 8.387 1.00 0.00 H new ATOM 0 HB2 ASP A 93 10.963 3.604 8.088 1.00 0.00 H new ATOM 0 HB3 ASP A 93 11.560 4.114 6.521 1.00 0.00 H new ATOM 1427 N GLY A 94 10.017 7.643 6.275 1.00 0.00 N ATOM 1428 CA GLY A 94 10.121 8.507 5.115 1.00 0.00 C ATOM 1429 C GLY A 94 10.133 9.976 5.485 1.00 0.00 C ATOM 1430 O GLY A 94 11.172 10.632 5.417 1.00 0.00 O ATOM 0 H GLY A 94 9.528 8.051 7.072 1.00 0.00 H new ATOM 0 HA2 GLY A 94 11.032 8.266 4.567 1.00 0.00 H new ATOM 0 HA3 GLY A 94 9.284 8.311 4.444 1.00 0.00 H new ATOM 1434 N GLY A 95 8.973 10.495 5.874 1.00 0.00 N ATOM 1435 CA GLY A 95 8.874 11.894 6.249 1.00 0.00 C ATOM 1436 C GLY A 95 7.970 12.676 5.316 1.00 0.00 C ATOM 1437 O GLY A 95 8.284 13.803 4.931 1.00 0.00 O ATOM 0 H GLY A 95 8.100 9.972 5.936 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.494 11.969 7.268 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.869 12.340 6.247 1.00 0.00 H new ATOM 1441 N TYR A 96 6.842 12.075 4.954 1.00 0.00 N ATOM 1442 CA TYR A 96 5.880 12.712 4.060 1.00 0.00 C ATOM 1443 C TYR A 96 4.460 12.326 4.449 1.00 0.00 C ATOM 1444 O TYR A 96 4.245 11.652 5.457 1.00 0.00 O ATOM 1445 CB TYR A 96 6.150 12.317 2.604 1.00 0.00 C ATOM 1446 CG TYR A 96 6.929 11.028 2.458 1.00 0.00 C ATOM 1447 CD1 TYR A 96 8.317 11.026 2.513 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.277 9.814 2.278 1.00 0.00 C ATOM 1449 CE1 TYR A 96 9.035 9.852 2.391 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.988 8.634 2.160 1.00 0.00 C ATOM 1451 CZ TYR A 96 8.366 8.660 2.216 1.00 0.00 C ATOM 1452 OH TYR A 96 9.080 7.490 2.103 1.00 0.00 O ATOM 0 H TYR A 96 6.570 11.143 5.267 1.00 0.00 H new ATOM 0 HA TYR A 96 5.991 13.792 4.153 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.199 12.217 2.081 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.700 13.121 2.115 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.844 11.958 2.654 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.198 9.792 2.230 1.00 0.00 H new ATOM 0 HE1 TYR A 96 10.114 9.868 2.433 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.467 7.697 2.025 1.00 0.00 H new ATOM 0 HH TYR A 96 8.881 7.067 1.241 1.00 0.00 H new ATOM 1462 N ILE A 97 3.492 12.753 3.647 1.00 0.00 N ATOM 1463 CA ILE A 97 2.092 12.446 3.915 1.00 0.00 C ATOM 1464 C ILE A 97 1.264 12.436 2.590 1.00 0.00 C ATOM 1465 O ILE A 97 0.730 13.517 2.362 1.00 0.00 O ATOM 1466 CB ILE A 97 1.496 13.438 4.951 1.00 0.00 C ATOM 1467 CG1 ILE A 97 1.376 14.860 4.393 1.00 0.00 C ATOM 1468 CG2 ILE A 97 2.344 13.450 6.213 1.00 0.00 C ATOM 1469 CD1 ILE A 97 2.551 15.311 3.551 1.00 0.00 C ATOM 0 H ILE A 97 3.650 13.311 2.808 1.00 0.00 H new ATOM 0 HA ILE A 97 2.037 11.447 4.347 1.00 0.00 H new ATOM 0 HB ILE A 97 0.490 13.091 5.186 1.00 0.00 H new ATOM 0 HG12 ILE A 97 0.469 14.924 3.791 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.256 15.553 5.225 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.917 14.149 6.932 1.00 0.00 H new ATOM 0 HG22 ILE A 97 2.365 12.450 6.647 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.360 13.759 5.966 1.00 0.00 H new ATOM 0 HD11 ILE A 97 2.378 16.328 3.200 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.460 15.284 4.151 1.00 0.00 H new ATOM 0 HD13 ILE A 97 2.662 14.645 2.695 1.00 0.00 H new ATOM 1481 N PRO A 98 0.464 11.341 2.461 1.00 0.00 N ATOM 1482 CA PRO A 98 0.682 9.863 2.619 1.00 0.00 C ATOM 1483 C PRO A 98 1.309 9.260 1.366 1.00 0.00 C ATOM 1484 O PRO A 98 1.179 9.816 0.270 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.709 9.292 2.827 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.179 10.236 3.799 1.00 0.00 C ATOM 1487 CD PRO A 98 0.028 11.111 3.912 1.00 0.00 C ATOM 0 HA PRO A 98 1.361 9.641 3.443 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.307 9.289 1.915 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.695 8.269 3.202 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.059 10.781 3.459 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.442 9.764 4.746 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.207 12.051 4.411 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.815 10.630 4.493 1.00 0.00 H new ATOM 1495 N ARG A 99 2.001 8.132 1.536 1.00 0.00 N ATOM 1496 CA ARG A 99 2.670 7.457 0.429 1.00 0.00 C ATOM 1497 C ARG A 99 2.252 5.989 0.320 1.00 0.00 C ATOM 1498 O ARG A 99 1.301 5.551 0.967 1.00 0.00 O ATOM 1499 CB ARG A 99 4.183 7.557 0.611 1.00 0.00 C ATOM 1500 CG ARG A 99 4.851 8.542 -0.334 1.00 0.00 C ATOM 1501 CD ARG A 99 4.089 9.854 -0.425 1.00 0.00 C ATOM 1502 NE ARG A 99 3.227 9.903 -1.604 1.00 0.00 N ATOM 1503 CZ ARG A 99 2.750 11.028 -2.126 1.00 0.00 C ATOM 1504 NH1 ARG A 99 3.040 12.201 -1.575 1.00 0.00 N ATOM 1505 NH2 ARG A 99 1.980 10.981 -3.204 1.00 0.00 N ATOM 0 H ARG A 99 2.111 7.666 2.437 1.00 0.00 H new ATOM 0 HA ARG A 99 2.373 7.951 -0.496 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.397 7.851 1.638 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.623 6.571 0.464 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.868 8.737 0.006 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.926 8.097 -1.326 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.484 9.986 0.472 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.796 10.683 -0.458 1.00 0.00 H new ATOM 0 HE ARG A 99 2.977 9.022 -2.053 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.632 12.242 -0.746 1.00 0.00 H new ATOM 0 HH12 ARG A 99 2.670 13.061 -1.981 1.00 0.00 H new ATOM 0 HH21 ARG A 99 1.755 10.083 -3.631 1.00 0.00 H new ATOM 0 HH22 ARG A 99 1.613 11.843 -3.606 1.00 0.00 H new ATOM 1519 N ILE A 100 2.972 5.240 -0.517 1.00 0.00 N ATOM 1520 CA ILE A 100 2.687 3.820 -0.737 1.00 0.00 C ATOM 1521 C ILE A 100 3.471 2.934 0.226 1.00 0.00 C ATOM 1522 O ILE A 100 4.686 2.799 0.105 1.00 0.00 O ATOM 1523 CB ILE A 100 3.027 3.411 -2.182 1.00 0.00 C ATOM 1524 CG1 ILE A 100 2.431 4.416 -3.170 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.518 2.006 -2.471 1.00 0.00 C ATOM 1526 CD1 ILE A 100 3.464 5.266 -3.876 1.00 0.00 C ATOM 0 H ILE A 100 3.761 5.595 -1.057 1.00 0.00 H new ATOM 0 HA ILE A 100 1.621 3.679 -0.557 1.00 0.00 H new ATOM 0 HB ILE A 100 4.111 3.412 -2.300 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.848 3.876 -3.916 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.740 5.069 -2.637 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.767 1.733 -3.496 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.986 1.301 -1.784 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.436 1.977 -2.340 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.965 5.953 -4.559 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.032 5.835 -3.140 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.141 4.623 -4.439 1.00 0.00 H new ATOM 1538 N LEU A 101 2.770 2.335 1.187 1.00 0.00 N ATOM 1539 CA LEU A 101 3.408 1.470 2.179 1.00 0.00 C ATOM 1540 C LEU A 101 2.957 0.021 2.032 1.00 0.00 C ATOM 1541 O LEU A 101 1.757 -0.259 2.005 1.00 0.00 O ATOM 1542 CB LEU A 101 3.060 1.935 3.599 1.00 0.00 C ATOM 1543 CG LEU A 101 3.624 3.291 4.042 1.00 0.00 C ATOM 1544 CD1 LEU A 101 3.815 4.229 2.864 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.700 3.922 5.069 1.00 0.00 C ATOM 0 H LEU A 101 1.761 2.432 1.300 1.00 0.00 H new ATOM 0 HA LEU A 101 4.483 1.533 2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.974 1.974 3.687 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.410 1.177 4.300 1.00 0.00 H new ATOM 0 HG LEU A 101 4.603 3.119 4.489 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.216 5.179 3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.511 3.783 2.153 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.856 4.399 2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.105 4.885 5.380 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.713 4.069 4.629 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.617 3.266 5.936 1.00 0.00 H new ATOM 1557 N PHE A 102 3.911 -0.907 1.974 1.00 0.00 N ATOM 1558 CA PHE A 102 3.565 -2.319 1.874 1.00 0.00 C ATOM 1559 C PHE A 102 3.375 -2.896 3.277 1.00 0.00 C ATOM 1560 O PHE A 102 4.201 -2.666 4.167 1.00 0.00 O ATOM 1561 CB PHE A 102 4.655 -3.077 1.122 1.00 0.00 C ATOM 1562 CG PHE A 102 4.525 -2.998 -0.373 1.00 0.00 C ATOM 1563 CD1 PHE A 102 4.190 -1.802 -0.991 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.741 -4.117 -1.160 1.00 0.00 C ATOM 1565 CE1 PHE A 102 4.076 -1.726 -2.366 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.627 -4.047 -2.535 1.00 0.00 C ATOM 1567 CZ PHE A 102 4.294 -2.851 -3.139 1.00 0.00 C ATOM 0 H PHE A 102 4.912 -0.710 1.994 1.00 0.00 H new ATOM 0 HA PHE A 102 2.633 -2.426 1.318 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.628 -2.682 1.415 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.632 -4.124 1.425 1.00 0.00 H new ATOM 0 HD1 PHE A 102 4.016 -0.921 -0.391 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.002 -5.055 -0.693 1.00 0.00 H new ATOM 0 HE1 PHE A 102 3.817 -0.789 -2.836 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.798 -4.927 -3.137 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.204 -2.794 -4.214 1.00 0.00 H new ATOM 1577 N LEU A 103 2.281 -3.626 3.492 1.00 0.00 N ATOM 1578 CA LEU A 103 2.024 -4.191 4.816 1.00 0.00 C ATOM 1579 C LEU A 103 1.611 -5.658 4.754 1.00 0.00 C ATOM 1580 O LEU A 103 1.096 -6.133 3.741 1.00 0.00 O ATOM 1581 CB LEU A 103 0.983 -3.352 5.565 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.469 -3.533 5.143 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.353 -2.534 5.873 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.610 -3.371 3.642 1.00 0.00 C ATOM 0 H LEU A 103 1.575 -3.836 2.787 1.00 0.00 H new ATOM 0 HA LEU A 103 2.962 -4.157 5.370 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.060 -3.582 6.628 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.244 -2.300 5.447 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.788 -4.541 5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.389 -2.672 5.564 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.271 -2.693 6.948 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.034 -1.520 5.630 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.654 -3.504 3.358 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.279 -2.374 3.351 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.001 -4.119 3.136 1.00 0.00 H new ATOM 1596 N ASP A 104 1.871 -6.371 5.850 1.00 0.00 N ATOM 1597 CA ASP A 104 1.564 -7.797 5.946 1.00 0.00 C ATOM 1598 C ASP A 104 0.060 -8.068 5.925 1.00 0.00 C ATOM 1599 O ASP A 104 -0.738 -7.236 6.372 1.00 0.00 O ATOM 1600 CB ASP A 104 2.174 -8.378 7.222 1.00 0.00 C ATOM 1601 CG ASP A 104 3.687 -8.464 7.154 1.00 0.00 C ATOM 1602 OD1 ASP A 104 4.203 -9.114 6.221 1.00 0.00 O ATOM 1603 OD2 ASP A 104 4.354 -7.883 8.035 1.00 0.00 O ATOM 0 H ASP A 104 2.297 -5.980 6.690 1.00 0.00 H new ATOM 0 HA ASP A 104 1.998 -8.281 5.071 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.886 -7.760 8.073 1.00 0.00 H new ATOM 0 HB3 ASP A 104 1.764 -9.373 7.397 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.332 -9.257 5.409 1.00 0.00 N ATOM 1609 CA PRO A 105 -1.739 -9.679 5.318 1.00 0.00 C ATOM 1610 C PRO A 105 -2.462 -9.605 6.655 1.00 0.00 C ATOM 1611 O PRO A 105 -2.462 -10.563 7.428 1.00 0.00 O ATOM 1612 CB PRO A 105 -1.652 -11.133 4.841 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.341 -11.225 4.143 1.00 0.00 C ATOM 1614 CD PRO A 105 0.579 -10.290 4.874 1.00 0.00 C ATOM 0 HA PRO A 105 -2.308 -9.030 4.652 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -1.704 -11.828 5.679 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.475 -11.380 4.171 1.00 0.00 H new ATOM 0 HG2 PRO A 105 0.042 -12.245 4.163 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.435 -10.941 3.095 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.119 -10.800 5.671 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.326 -9.860 4.207 1.00 0.00 H new ATOM 1622 N SER A 106 -3.078 -8.455 6.915 1.00 0.00 N ATOM 1623 CA SER A 106 -3.819 -8.219 8.153 1.00 0.00 C ATOM 1624 C SER A 106 -3.970 -6.725 8.395 1.00 0.00 C ATOM 1625 O SER A 106 -4.924 -6.278 9.034 1.00 0.00 O ATOM 1626 CB SER A 106 -3.116 -8.864 9.352 1.00 0.00 C ATOM 1627 OG SER A 106 -3.620 -10.165 9.597 1.00 0.00 O ATOM 0 H SER A 106 -3.078 -7.661 6.275 1.00 0.00 H new ATOM 0 HA SER A 106 -4.804 -8.674 8.045 1.00 0.00 H new ATOM 0 HB2 SER A 106 -2.043 -8.915 9.165 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.256 -8.243 10.237 1.00 0.00 H new ATOM 0 HG SER A 106 -3.558 -10.700 8.778 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.013 -5.955 7.884 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.041 -4.519 8.053 1.00 0.00 C ATOM 1635 C GLY A 107 -1.936 -4.040 8.969 1.00 0.00 C ATOM 1636 O GLY A 107 -2.165 -3.208 9.848 1.00 0.00 O ATOM 0 H GLY A 107 -2.216 -6.306 7.353 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -2.942 -4.036 7.081 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.007 -4.220 8.461 1.00 0.00 H new ATOM 1640 N LYS A 108 -0.731 -4.577 8.778 1.00 0.00 N ATOM 1641 CA LYS A 108 0.404 -4.200 9.617 1.00 0.00 C ATOM 1642 C LYS A 108 1.544 -3.582 8.804 1.00 0.00 C ATOM 1643 O LYS A 108 2.523 -4.256 8.483 1.00 0.00 O ATOM 1644 CB LYS A 108 0.912 -5.421 10.390 1.00 0.00 C ATOM 1645 CG LYS A 108 0.962 -5.209 11.894 1.00 0.00 C ATOM 1646 CD LYS A 108 2.138 -5.942 12.519 1.00 0.00 C ATOM 1647 CE LYS A 108 1.704 -7.252 13.159 1.00 0.00 C ATOM 1648 NZ LYS A 108 2.648 -8.361 12.851 1.00 0.00 N ATOM 0 H LYS A 108 -0.518 -5.267 8.058 1.00 0.00 H new ATOM 0 HA LYS A 108 0.055 -3.441 10.317 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.267 -6.273 10.172 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.910 -5.677 10.034 1.00 0.00 H new ATOM 0 HG2 LYS A 108 1.039 -4.143 12.110 1.00 0.00 H new ATOM 0 HG3 LYS A 108 0.033 -5.559 12.343 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.891 -6.141 11.756 1.00 0.00 H new ATOM 0 HD3 LYS A 108 2.606 -5.306 13.271 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.636 -7.123 14.239 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.707 -7.516 12.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 2.316 -9.236 13.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 2.694 -8.502 11.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 3.594 -8.121 13.210 1.00 0.00 H new ATOM 1662 N VAL A 109 1.416 -2.292 8.484 1.00 0.00 N ATOM 1663 CA VAL A 109 2.446 -1.585 7.724 1.00 0.00 C ATOM 1664 C VAL A 109 3.796 -1.711 8.407 1.00 0.00 C ATOM 1665 O VAL A 109 3.950 -1.374 9.581 1.00 0.00 O ATOM 1666 CB VAL A 109 2.080 -0.091 7.543 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.293 0.811 7.730 1.00 0.00 C ATOM 1668 CG2 VAL A 109 1.445 0.140 6.181 1.00 0.00 C ATOM 0 H VAL A 109 0.612 -1.719 8.739 1.00 0.00 H new ATOM 0 HA VAL A 109 2.506 -2.045 6.738 1.00 0.00 H new ATOM 0 HB VAL A 109 1.356 0.169 8.315 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.997 1.851 7.595 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.696 0.675 8.734 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.055 0.553 6.995 1.00 0.00 H new ATOM 0 HG21 VAL A 109 1.194 1.195 6.071 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.146 -0.150 5.399 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.539 -0.459 6.096 1.00 0.00 H new ATOM 1678 N HIS A 110 4.770 -2.195 7.656 1.00 0.00 N ATOM 1679 CA HIS A 110 6.114 -2.364 8.175 1.00 0.00 C ATOM 1680 C HIS A 110 7.111 -1.626 7.296 1.00 0.00 C ATOM 1681 O HIS A 110 7.030 -1.692 6.071 1.00 0.00 O ATOM 1682 CB HIS A 110 6.475 -3.850 8.247 1.00 0.00 C ATOM 1683 CG HIS A 110 6.055 -4.628 7.039 1.00 0.00 C ATOM 1684 ND1 HIS A 110 6.755 -4.610 5.849 1.00 0.00 N ATOM 1685 CD2 HIS A 110 4.997 -5.449 6.837 1.00 0.00 C ATOM 1686 CE1 HIS A 110 6.144 -5.386 4.971 1.00 0.00 C ATOM 1687 NE2 HIS A 110 5.077 -5.907 5.546 1.00 0.00 N ATOM 0 H HIS A 110 4.654 -2.478 6.683 1.00 0.00 H new ATOM 0 HA HIS A 110 6.154 -1.947 9.181 1.00 0.00 H new ATOM 0 HB2 HIS A 110 7.553 -3.948 8.375 1.00 0.00 H new ATOM 0 HB3 HIS A 110 6.008 -4.286 9.130 1.00 0.00 H new ATOM 0 HD2 HIS A 110 4.232 -5.697 7.558 1.00 0.00 H new ATOM 0 HE1 HIS A 110 6.464 -5.564 3.955 1.00 0.00 H new ATOM 0 HE2 HIS A 110 4.418 -6.547 5.103 1.00 0.00 H new ATOM 1696 N PRO A 111 8.076 -0.917 7.901 1.00 0.00 N ATOM 1697 CA PRO A 111 9.091 -0.183 7.148 1.00 0.00 C ATOM 1698 C PRO A 111 10.081 -1.130 6.484 1.00 0.00 C ATOM 1699 O PRO A 111 11.287 -0.886 6.485 1.00 0.00 O ATOM 1700 CB PRO A 111 9.787 0.660 8.218 1.00 0.00 C ATOM 1701 CG PRO A 111 9.594 -0.102 9.482 1.00 0.00 C ATOM 1702 CD PRO A 111 8.262 -0.789 9.357 1.00 0.00 C ATOM 0 HA PRO A 111 8.665 0.412 6.340 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.845 0.792 7.992 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.349 1.656 8.285 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.395 -0.828 9.625 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.609 0.564 10.345 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.265 -1.762 9.848 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.464 -0.203 9.814 1.00 0.00 H new ATOM 1710 N GLU A 112 9.560 -2.223 5.931 1.00 0.00 N ATOM 1711 CA GLU A 112 10.402 -3.218 5.278 1.00 0.00 C ATOM 1712 C GLU A 112 10.296 -3.129 3.760 1.00 0.00 C ATOM 1713 O GLU A 112 11.303 -2.970 3.068 1.00 0.00 O ATOM 1714 CB GLU A 112 10.016 -4.623 5.745 1.00 0.00 C ATOM 1715 CG GLU A 112 11.210 -5.512 6.051 1.00 0.00 C ATOM 1716 CD GLU A 112 11.728 -6.237 4.824 1.00 0.00 C ATOM 1717 OE1 GLU A 112 10.967 -6.358 3.841 1.00 0.00 O ATOM 1718 OE2 GLU A 112 12.895 -6.683 4.846 1.00 0.00 O ATOM 0 H GLU A 112 8.563 -2.440 5.923 1.00 0.00 H new ATOM 0 HA GLU A 112 11.436 -3.014 5.557 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.395 -4.542 6.637 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.408 -5.098 4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.010 -4.906 6.475 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.929 -6.243 6.809 1.00 0.00 H new ATOM 1725 N ILE A 113 9.077 -3.246 3.244 1.00 0.00 N ATOM 1726 CA ILE A 113 8.861 -3.192 1.806 1.00 0.00 C ATOM 1727 C ILE A 113 8.537 -1.773 1.331 1.00 0.00 C ATOM 1728 O ILE A 113 7.413 -1.270 1.503 1.00 0.00 O ATOM 1729 CB ILE A 113 7.750 -4.165 1.368 1.00 0.00 C ATOM 1730 CG1 ILE A 113 8.108 -5.593 1.789 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.537 -4.090 -0.138 1.00 0.00 C ATOM 1732 CD1 ILE A 113 9.455 -6.054 1.277 1.00 0.00 C ATOM 0 H ILE A 113 8.230 -3.378 3.797 1.00 0.00 H new ATOM 0 HA ILE A 113 9.796 -3.499 1.337 1.00 0.00 H new ATOM 0 HB ILE A 113 6.820 -3.878 1.858 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.101 -5.655 2.877 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.338 -6.274 1.426 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.749 -4.784 -0.429 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.248 -3.076 -0.415 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.462 -4.356 -0.650 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.643 -7.074 1.613 1.00 0.00 H new ATOM 0 HD12 ILE A 113 9.460 -6.025 0.187 1.00 0.00 H new ATOM 0 HD13 ILE A 113 10.235 -5.396 1.661 1.00 0.00 H new ATOM 1744 N ILE A 114 9.553 -1.150 0.728 1.00 0.00 N ATOM 1745 CA ILE A 114 9.454 0.204 0.197 1.00 0.00 C ATOM 1746 C ILE A 114 9.830 0.217 -1.288 1.00 0.00 C ATOM 1747 O ILE A 114 9.783 -0.814 -1.956 1.00 0.00 O ATOM 1748 CB ILE A 114 10.392 1.168 0.969 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.869 0.891 0.626 1.00 0.00 C ATOM 1750 CG2 ILE A 114 10.160 1.056 2.469 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.407 -0.399 1.210 1.00 0.00 C ATOM 0 H ILE A 114 10.470 -1.576 0.596 1.00 0.00 H new ATOM 0 HA ILE A 114 8.424 0.539 0.317 1.00 0.00 H new ATOM 0 HB ILE A 114 10.158 2.187 0.660 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.980 0.861 -0.458 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.477 1.722 0.986 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.828 1.740 2.993 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.126 1.313 2.697 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.360 0.035 2.793 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.452 -0.521 0.923 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.331 -0.366 2.297 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.826 -1.240 0.831 1.00 0.00 H new ATOM 1763 N ASN A 115 10.230 1.385 -1.790 1.00 0.00 N ATOM 1764 CA ASN A 115 10.643 1.519 -3.180 1.00 0.00 C ATOM 1765 C ASN A 115 12.164 1.500 -3.277 1.00 0.00 C ATOM 1766 O ASN A 115 12.798 2.546 -3.388 1.00 0.00 O ATOM 1767 CB ASN A 115 10.113 2.824 -3.772 1.00 0.00 C ATOM 1768 CG ASN A 115 10.496 2.999 -5.228 1.00 0.00 C ATOM 1769 OD1 ASN A 115 11.295 2.233 -5.769 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.928 4.011 -5.872 1.00 0.00 N ATOM 0 H ASN A 115 10.276 2.250 -1.252 1.00 0.00 H new ATOM 0 HA ASN A 115 10.232 0.681 -3.743 1.00 0.00 H new ATOM 0 HB2 ASN A 115 9.027 2.846 -3.680 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.499 3.664 -3.195 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.148 4.179 -6.854 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.271 4.621 -5.385 1.00 0.00 H new ATOM 1777 N GLU A 116 12.746 0.308 -3.226 1.00 0.00 N ATOM 1778 CA GLU A 116 14.197 0.168 -3.302 1.00 0.00 C ATOM 1779 C GLU A 116 14.757 0.883 -4.529 1.00 0.00 C ATOM 1780 O GLU A 116 15.929 1.259 -4.559 1.00 0.00 O ATOM 1781 CB GLU A 116 14.586 -1.309 -3.325 1.00 0.00 C ATOM 1782 CG GLU A 116 14.820 -1.887 -1.940 1.00 0.00 C ATOM 1783 CD GLU A 116 16.134 -1.434 -1.334 1.00 0.00 C ATOM 1784 OE1 GLU A 116 16.183 -0.308 -0.799 1.00 0.00 O ATOM 1785 OE2 GLU A 116 17.114 -2.207 -1.396 1.00 0.00 O ATOM 0 H GLU A 116 12.239 -0.572 -3.133 1.00 0.00 H new ATOM 0 HA GLU A 116 14.628 0.634 -2.415 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.799 -1.878 -3.821 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.491 -1.431 -3.920 1.00 0.00 H new ATOM 0 HG2 GLU A 116 14.001 -1.592 -1.284 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.807 -2.975 -1.997 1.00 0.00 H new ATOM 1792 N ASN A 117 13.912 1.075 -5.538 1.00 0.00 N ATOM 1793 CA ASN A 117 14.324 1.753 -6.762 1.00 0.00 C ATOM 1794 C ASN A 117 14.201 3.272 -6.625 1.00 0.00 C ATOM 1795 O ASN A 117 14.565 4.013 -7.537 1.00 0.00 O ATOM 1796 CB ASN A 117 13.480 1.267 -7.942 1.00 0.00 C ATOM 1797 CG ASN A 117 13.877 1.924 -9.250 1.00 0.00 C ATOM 1798 OD1 ASN A 117 14.830 1.504 -9.905 1.00 0.00 O ATOM 1799 ND2 ASN A 117 13.146 2.965 -9.636 1.00 0.00 N ATOM 0 H ASN A 117 12.938 0.771 -5.532 1.00 0.00 H new ATOM 0 HA ASN A 117 15.372 1.512 -6.942 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.582 0.186 -8.037 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.428 1.472 -7.741 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.367 3.449 -10.506 1.00 0.00 H new ATOM 0 HD22 ASN A 117 12.364 3.280 -9.062 1.00 0.00 H new ATOM 1806 N GLY A 118 13.682 3.731 -5.486 1.00 0.00 N ATOM 1807 CA GLY A 118 13.524 5.156 -5.269 1.00 0.00 C ATOM 1808 C GLY A 118 14.738 5.788 -4.618 1.00 0.00 C ATOM 1809 O GLY A 118 15.720 5.108 -4.322 1.00 0.00 O ATOM 0 H GLY A 118 13.370 3.141 -4.714 1.00 0.00 H new ATOM 0 HA2 GLY A 118 13.333 5.646 -6.224 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.649 5.329 -4.642 1.00 0.00 H new ATOM 1813 N ASN A 119 14.668 7.097 -4.396 1.00 0.00 N ATOM 1814 CA ASN A 119 15.764 7.834 -3.776 1.00 0.00 C ATOM 1815 C ASN A 119 15.667 7.771 -2.253 1.00 0.00 C ATOM 1816 O ASN A 119 14.600 7.499 -1.705 1.00 0.00 O ATOM 1817 CB ASN A 119 15.749 9.291 -4.241 1.00 0.00 C ATOM 1818 CG ASN A 119 14.393 9.943 -4.049 1.00 0.00 C ATOM 1819 OD1 ASN A 119 14.095 10.481 -2.982 1.00 0.00 O ATOM 1820 ND2 ASN A 119 13.561 9.899 -5.083 1.00 0.00 N ATOM 0 H ASN A 119 13.860 7.671 -4.637 1.00 0.00 H new ATOM 0 HA ASN A 119 16.703 7.372 -4.081 1.00 0.00 H new ATOM 0 HB2 ASN A 119 16.502 9.854 -3.689 1.00 0.00 H new ATOM 0 HB3 ASN A 119 16.026 9.337 -5.294 1.00 0.00 H new ATOM 0 HD21 ASN A 119 12.635 10.321 -5.011 1.00 0.00 H new ATOM 0 HD22 ASN A 119 13.848 9.443 -5.949 1.00 0.00 H new ATOM 1827 N PRO A 120 16.784 8.018 -1.546 1.00 0.00 N ATOM 1828 CA PRO A 120 16.816 7.985 -0.080 1.00 0.00 C ATOM 1829 C PRO A 120 16.183 9.224 0.550 1.00 0.00 C ATOM 1830 O PRO A 120 16.811 9.916 1.351 1.00 0.00 O ATOM 1831 CB PRO A 120 18.310 7.931 0.233 1.00 0.00 C ATOM 1832 CG PRO A 120 18.955 8.639 -0.906 1.00 0.00 C ATOM 1833 CD PRO A 120 18.107 8.345 -2.117 1.00 0.00 C ATOM 0 HA PRO A 120 16.247 7.146 0.321 1.00 0.00 H new ATOM 0 HB2 PRO A 120 18.535 8.418 1.182 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.662 6.902 0.312 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.008 9.711 -0.718 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.977 8.291 -1.053 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.053 9.204 -2.786 1.00 0.00 H new ATOM 0 HD3 PRO A 120 18.510 7.514 -2.696 1.00 0.00 H new ATOM 1841 N SER A 121 14.933 9.496 0.185 1.00 0.00 N ATOM 1842 CA SER A 121 14.209 10.645 0.711 1.00 0.00 C ATOM 1843 C SER A 121 12.814 10.679 0.114 1.00 0.00 C ATOM 1844 O SER A 121 12.298 11.739 -0.239 1.00 0.00 O ATOM 1845 CB SER A 121 14.947 11.944 0.382 1.00 0.00 C ATOM 1846 OG SER A 121 15.922 12.240 1.365 1.00 0.00 O ATOM 0 H SER A 121 14.400 8.932 -0.477 1.00 0.00 H new ATOM 0 HA SER A 121 14.141 10.553 1.795 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.425 11.857 -0.594 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.233 12.765 0.315 1.00 0.00 H new ATOM 0 HG SER A 121 16.224 11.409 1.787 1.00 0.00 H new ATOM 1852 N TYR A 122 12.220 9.499 -0.019 1.00 0.00 N ATOM 1853 CA TYR A 122 10.897 9.376 -0.602 1.00 0.00 C ATOM 1854 C TYR A 122 10.428 7.925 -0.572 1.00 0.00 C ATOM 1855 O TYR A 122 9.280 7.638 -0.235 1.00 0.00 O ATOM 1856 CB TYR A 122 10.938 9.891 -2.038 1.00 0.00 C ATOM 1857 CG TYR A 122 10.235 11.213 -2.234 1.00 0.00 C ATOM 1858 CD1 TYR A 122 8.986 11.452 -1.675 1.00 0.00 C ATOM 1859 CD2 TYR A 122 10.825 12.224 -2.979 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.346 12.664 -1.855 1.00 0.00 C ATOM 1861 CE2 TYR A 122 10.193 13.439 -3.162 1.00 0.00 C ATOM 1862 CZ TYR A 122 8.954 13.654 -2.598 1.00 0.00 C ATOM 1863 OH TYR A 122 8.320 14.862 -2.778 1.00 0.00 O ATOM 0 H TYR A 122 12.638 8.615 0.271 1.00 0.00 H new ATOM 0 HA TYR A 122 10.190 9.968 -0.020 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.978 9.994 -2.347 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.483 9.148 -2.693 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.508 10.679 -1.091 1.00 0.00 H new ATOM 0 HD2 TYR A 122 11.795 12.058 -3.424 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.374 12.835 -1.416 1.00 0.00 H new ATOM 0 HE2 TYR A 122 10.667 14.216 -3.744 1.00 0.00 H new ATOM 0 HH TYR A 122 8.883 15.449 -3.324 1.00 0.00 H new ATOM 1873 N LYS A 123 11.336 7.019 -0.931 1.00 0.00 N ATOM 1874 CA LYS A 123 11.058 5.580 -0.956 1.00 0.00 C ATOM 1875 C LYS A 123 9.615 5.274 -1.386 1.00 0.00 C ATOM 1876 O LYS A 123 9.323 5.149 -2.574 1.00 0.00 O ATOM 1877 CB LYS A 123 11.337 4.962 0.424 1.00 0.00 C ATOM 1878 CG LYS A 123 12.755 4.440 0.609 1.00 0.00 C ATOM 1879 CD LYS A 123 13.207 3.587 -0.568 1.00 0.00 C ATOM 1880 CE LYS A 123 14.193 4.333 -1.450 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.592 3.874 -1.230 1.00 0.00 N ATOM 0 H LYS A 123 12.286 7.260 -1.213 1.00 0.00 H new ATOM 0 HA LYS A 123 11.722 5.135 -1.698 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.137 5.711 1.190 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.638 4.142 0.589 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.438 5.281 0.731 1.00 0.00 H new ATOM 0 HG3 LYS A 123 12.808 3.851 1.525 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.668 2.671 -0.199 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.340 3.292 -1.159 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.924 4.190 -2.497 1.00 0.00 H new ATOM 0 HE3 LYS A 123 14.125 5.402 -1.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.234 4.407 -1.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.858 4.034 -0.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.663 2.860 -1.448 1.00 0.00 H new ATOM 1895 N TYR A 124 8.724 5.147 -0.406 1.00 0.00 N ATOM 1896 CA TYR A 124 7.318 4.838 -0.657 1.00 0.00 C ATOM 1897 C TYR A 124 6.731 5.644 -1.818 1.00 0.00 C ATOM 1898 O TYR A 124 5.747 5.228 -2.428 1.00 0.00 O ATOM 1899 CB TYR A 124 6.507 5.082 0.615 1.00 0.00 C ATOM 1900 CG TYR A 124 7.044 4.335 1.814 1.00 0.00 C ATOM 1901 CD1 TYR A 124 6.997 2.948 1.871 1.00 0.00 C ATOM 1902 CD2 TYR A 124 7.603 5.015 2.887 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.490 2.261 2.963 1.00 0.00 C ATOM 1904 CE2 TYR A 124 8.099 4.336 3.982 1.00 0.00 C ATOM 1905 CZ TYR A 124 8.040 2.961 4.016 1.00 0.00 C ATOM 1906 OH TYR A 124 8.532 2.281 5.106 1.00 0.00 O ATOM 0 H TYR A 124 8.955 5.255 0.582 1.00 0.00 H new ATOM 0 HA TYR A 124 7.262 3.788 -0.944 1.00 0.00 H new ATOM 0 HB2 TYR A 124 6.498 6.150 0.834 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.473 4.784 0.442 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.568 2.397 1.047 1.00 0.00 H new ATOM 0 HD2 TYR A 124 7.651 6.094 2.865 1.00 0.00 H new ATOM 0 HE1 TYR A 124 7.445 1.182 2.992 1.00 0.00 H new ATOM 0 HE2 TYR A 124 8.531 4.881 4.808 1.00 0.00 H new ATOM 0 HH TYR A 124 9.092 2.882 5.641 1.00 0.00 H new ATOM 1916 N PHE A 125 7.324 6.793 -2.121 1.00 0.00 N ATOM 1917 CA PHE A 125 6.837 7.634 -3.208 1.00 0.00 C ATOM 1918 C PHE A 125 7.080 6.982 -4.569 1.00 0.00 C ATOM 1919 O PHE A 125 8.223 6.780 -4.977 1.00 0.00 O ATOM 1920 CB PHE A 125 7.513 9.006 -3.166 1.00 0.00 C ATOM 1921 CG PHE A 125 6.858 10.025 -4.056 1.00 0.00 C ATOM 1922 CD1 PHE A 125 5.499 10.279 -3.959 1.00 0.00 C ATOM 1923 CD2 PHE A 125 7.602 10.732 -4.990 1.00 0.00 C ATOM 1924 CE1 PHE A 125 4.895 11.216 -4.773 1.00 0.00 C ATOM 1925 CE2 PHE A 125 7.003 11.671 -5.807 1.00 0.00 C ATOM 1926 CZ PHE A 125 5.647 11.914 -5.699 1.00 0.00 C ATOM 0 H PHE A 125 8.139 7.162 -1.632 1.00 0.00 H new ATOM 0 HA PHE A 125 5.762 7.757 -3.073 1.00 0.00 H new ATOM 0 HB2 PHE A 125 7.507 9.374 -2.140 1.00 0.00 H new ATOM 0 HB3 PHE A 125 8.557 8.897 -3.459 1.00 0.00 H new ATOM 0 HD1 PHE A 125 4.905 9.737 -3.238 1.00 0.00 H new ATOM 0 HD2 PHE A 125 8.662 10.546 -5.079 1.00 0.00 H new ATOM 0 HE1 PHE A 125 3.835 11.404 -4.686 1.00 0.00 H new ATOM 0 HE2 PHE A 125 7.594 12.215 -6.529 1.00 0.00 H new ATOM 0 HZ PHE A 125 5.176 12.648 -6.337 1.00 0.00 H new ATOM 1936 N TYR A 126 5.993 6.665 -5.269 1.00 0.00 N ATOM 1937 CA TYR A 126 6.083 6.048 -6.589 1.00 0.00 C ATOM 1938 C TYR A 126 5.588 7.015 -7.663 1.00 0.00 C ATOM 1939 O TYR A 126 4.435 6.948 -8.086 1.00 0.00 O ATOM 1940 CB TYR A 126 5.258 4.760 -6.647 1.00 0.00 C ATOM 1941 CG TYR A 126 5.990 3.531 -6.155 1.00 0.00 C ATOM 1942 CD1 TYR A 126 7.231 3.183 -6.669 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.428 2.707 -5.184 1.00 0.00 C ATOM 1944 CE1 TYR A 126 7.896 2.054 -6.228 1.00 0.00 C ATOM 1945 CE2 TYR A 126 6.087 1.577 -4.740 1.00 0.00 C ATOM 1946 CZ TYR A 126 7.319 1.255 -5.265 1.00 0.00 C ATOM 1947 OH TYR A 126 7.977 0.130 -4.824 1.00 0.00 O ATOM 0 H TYR A 126 5.040 6.826 -4.944 1.00 0.00 H new ATOM 0 HA TYR A 126 7.130 5.806 -6.774 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.355 4.894 -6.052 1.00 0.00 H new ATOM 0 HB3 TYR A 126 4.940 4.592 -7.676 1.00 0.00 H new ATOM 0 HD1 TYR A 126 7.685 3.805 -7.426 1.00 0.00 H new ATOM 0 HD2 TYR A 126 4.461 2.955 -4.771 1.00 0.00 H new ATOM 0 HE1 TYR A 126 8.863 1.800 -6.636 1.00 0.00 H new ATOM 0 HE2 TYR A 126 5.638 0.949 -3.985 1.00 0.00 H new ATOM 0 HH TYR A 126 7.434 -0.321 -4.144 1.00 0.00 H new ATOM 1957 N VAL A 127 6.465 7.913 -8.096 1.00 0.00 N ATOM 1958 CA VAL A 127 6.113 8.896 -9.116 1.00 0.00 C ATOM 1959 C VAL A 127 6.284 8.315 -10.518 1.00 0.00 C ATOM 1960 O VAL A 127 6.992 8.880 -11.353 1.00 0.00 O ATOM 1961 CB VAL A 127 6.970 10.171 -8.975 1.00 0.00 C ATOM 1962 CG1 VAL A 127 8.447 9.854 -9.148 1.00 0.00 C ATOM 1963 CG2 VAL A 127 6.525 11.233 -9.967 1.00 0.00 C ATOM 0 H VAL A 127 7.425 7.982 -7.758 1.00 0.00 H new ATOM 0 HA VAL A 127 5.065 9.158 -8.969 1.00 0.00 H new ATOM 0 HB VAL A 127 6.826 10.565 -7.969 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.030 10.769 -9.044 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.757 9.138 -8.387 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.614 9.427 -10.137 1.00 0.00 H new ATOM 0 HG21 VAL A 127 7.143 12.123 -9.849 1.00 0.00 H new ATOM 0 HG22 VAL A 127 6.630 10.850 -10.982 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.482 11.489 -9.782 1.00 0.00 H new ATOM 1973 N SER A 128 5.622 7.180 -10.766 1.00 0.00 N ATOM 1974 CA SER A 128 5.682 6.495 -12.060 1.00 0.00 C ATOM 1975 C SER A 128 5.348 5.012 -11.903 1.00 0.00 C ATOM 1976 O SER A 128 5.681 4.392 -10.890 1.00 0.00 O ATOM 1977 CB SER A 128 7.070 6.635 -12.700 1.00 0.00 C ATOM 1978 OG SER A 128 7.270 5.659 -13.710 1.00 0.00 O ATOM 0 H SER A 128 5.032 6.712 -10.078 1.00 0.00 H new ATOM 0 HA SER A 128 4.945 6.966 -12.710 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.177 7.632 -13.128 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.839 6.532 -11.934 1.00 0.00 H new ATOM 0 HG SER A 128 8.161 5.772 -14.102 1.00 0.00 H new ATOM 1984 N ALA A 129 4.693 4.447 -12.914 1.00 0.00 N ATOM 1985 CA ALA A 129 4.319 3.038 -12.891 1.00 0.00 C ATOM 1986 C ALA A 129 5.538 2.143 -13.102 1.00 0.00 C ATOM 1987 O ALA A 129 5.558 0.993 -12.664 1.00 0.00 O ATOM 1988 CB ALA A 129 3.264 2.748 -13.946 1.00 0.00 C ATOM 0 H ALA A 129 4.411 4.944 -13.759 1.00 0.00 H new ATOM 0 HA ALA A 129 3.901 2.819 -11.909 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.998 1.692 -13.913 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.378 3.352 -13.750 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.659 2.992 -14.932 1.00 0.00 H new ATOM 1994 N GLU A 130 6.548 2.679 -13.781 1.00 0.00 N ATOM 1995 CA GLU A 130 7.770 1.931 -14.059 1.00 0.00 C ATOM 1996 C GLU A 130 8.409 1.413 -12.771 1.00 0.00 C ATOM 1997 O GLU A 130 8.827 0.257 -12.687 1.00 0.00 O ATOM 1998 CB GLU A 130 8.766 2.808 -14.822 1.00 0.00 C ATOM 1999 CG GLU A 130 9.220 2.204 -16.140 1.00 0.00 C ATOM 2000 CD GLU A 130 10.162 3.114 -16.903 1.00 0.00 C ATOM 2001 OE1 GLU A 130 9.720 4.198 -17.337 1.00 0.00 O ATOM 2002 OE2 GLU A 130 11.344 2.742 -17.069 1.00 0.00 O ATOM 0 H GLU A 130 6.544 3.630 -14.149 1.00 0.00 H new ATOM 0 HA GLU A 130 7.504 1.072 -14.675 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.310 3.779 -15.015 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.638 2.985 -14.193 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.716 1.252 -15.948 1.00 0.00 H new ATOM 0 HG3 GLU A 130 8.348 1.990 -16.757 1.00 0.00 H new ATOM 2009 N GLN A 131 8.491 2.268 -11.763 1.00 0.00 N ATOM 2010 CA GLN A 131 9.089 1.856 -10.506 1.00 0.00 C ATOM 2011 C GLN A 131 8.140 0.987 -9.697 1.00 0.00 C ATOM 2012 O GLN A 131 8.476 -0.137 -9.347 1.00 0.00 O ATOM 2013 CB GLN A 131 9.533 3.035 -9.655 1.00 0.00 C ATOM 2014 CG GLN A 131 8.653 4.273 -9.763 1.00 0.00 C ATOM 2015 CD GLN A 131 9.194 5.437 -8.956 1.00 0.00 C ATOM 2016 OE1 GLN A 131 10.059 5.264 -8.098 1.00 0.00 O ATOM 2017 NE2 GLN A 131 8.688 6.631 -9.231 1.00 0.00 N ATOM 0 H GLN A 131 8.158 3.232 -11.789 1.00 0.00 H new ATOM 0 HA GLN A 131 9.973 1.277 -10.774 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.565 2.720 -8.612 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.551 3.305 -9.937 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.570 4.567 -10.809 1.00 0.00 H new ATOM 0 HG3 GLN A 131 7.647 4.032 -9.419 1.00 0.00 H new ATOM 0 HE21 GLN A 131 7.972 6.728 -9.951 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.015 7.453 -8.723 1.00 0.00 H new ATOM 2026 N VAL A 132 6.955 1.504 -9.390 1.00 0.00 N ATOM 2027 CA VAL A 132 5.989 0.739 -8.608 1.00 0.00 C ATOM 2028 C VAL A 132 5.774 -0.642 -9.218 1.00 0.00 C ATOM 2029 O VAL A 132 5.389 -1.580 -8.521 1.00 0.00 O ATOM 2030 CB VAL A 132 4.634 1.471 -8.459 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.172 2.043 -9.784 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.577 0.547 -7.867 1.00 0.00 C ATOM 0 H VAL A 132 6.643 2.435 -9.665 1.00 0.00 H new ATOM 0 HA VAL A 132 6.411 0.630 -7.609 1.00 0.00 H new ATOM 0 HB VAL A 132 4.780 2.303 -7.769 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.217 2.551 -9.648 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.912 2.754 -10.152 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.053 1.236 -10.507 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.634 1.086 -7.773 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.439 -0.314 -8.521 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.901 0.207 -6.883 1.00 0.00 H new ATOM 2042 N VAL A 133 6.046 -0.773 -10.515 1.00 0.00 N ATOM 2043 CA VAL A 133 5.894 -2.056 -11.181 1.00 0.00 C ATOM 2044 C VAL A 133 7.081 -2.965 -10.877 1.00 0.00 C ATOM 2045 O VAL A 133 6.939 -4.187 -10.844 1.00 0.00 O ATOM 2046 CB VAL A 133 5.737 -1.918 -12.708 1.00 0.00 C ATOM 2047 CG1 VAL A 133 7.043 -1.486 -13.345 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.257 -3.230 -13.307 1.00 0.00 C ATOM 0 H VAL A 133 6.369 -0.014 -11.116 1.00 0.00 H new ATOM 0 HA VAL A 133 4.978 -2.498 -10.790 1.00 0.00 H new ATOM 0 HB VAL A 133 4.991 -1.149 -12.911 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.909 -1.395 -14.423 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.347 -0.523 -12.934 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.813 -2.229 -13.136 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.150 -3.120 -14.386 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.982 -4.015 -13.093 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.294 -3.498 -12.872 1.00 0.00 H new ATOM 2058 N GLN A 134 8.260 -2.373 -10.649 1.00 0.00 N ATOM 2059 CA GLN A 134 9.437 -3.185 -10.343 1.00 0.00 C ATOM 2060 C GLN A 134 9.462 -3.508 -8.858 1.00 0.00 C ATOM 2061 O GLN A 134 9.810 -4.619 -8.451 1.00 0.00 O ATOM 2062 CB GLN A 134 10.727 -2.480 -10.763 1.00 0.00 C ATOM 2063 CG GLN A 134 10.759 -1.005 -10.411 1.00 0.00 C ATOM 2064 CD GLN A 134 12.088 -0.356 -10.746 1.00 0.00 C ATOM 2065 OE1 GLN A 134 13.092 -0.583 -10.073 1.00 0.00 O ATOM 2066 NE2 GLN A 134 12.099 0.458 -11.796 1.00 0.00 N ATOM 0 H GLN A 134 8.420 -1.366 -10.670 1.00 0.00 H new ATOM 0 HA GLN A 134 9.373 -4.113 -10.912 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.573 -2.976 -10.287 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.857 -2.590 -11.840 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.962 -0.490 -10.947 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.558 -0.884 -9.347 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.243 0.618 -12.326 1.00 0.00 H new ATOM 0 HE22 GLN A 134 12.964 0.923 -12.072 1.00 0.00 H new ATOM 2075 N GLY A 135 9.056 -2.538 -8.053 1.00 0.00 N ATOM 2076 CA GLY A 135 9.003 -2.737 -6.626 1.00 0.00 C ATOM 2077 C GLY A 135 7.839 -3.624 -6.241 1.00 0.00 C ATOM 2078 O GLY A 135 7.820 -4.192 -5.149 1.00 0.00 O ATOM 0 H GLY A 135 8.762 -1.613 -8.368 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.935 -3.187 -6.284 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.911 -1.773 -6.125 1.00 0.00 H new ATOM 2082 N MET A 136 6.864 -3.756 -7.147 1.00 0.00 N ATOM 2083 CA MET A 136 5.706 -4.599 -6.879 1.00 0.00 C ATOM 2084 C MET A 136 5.963 -6.019 -7.357 1.00 0.00 C ATOM 2085 O MET A 136 5.542 -6.981 -6.723 1.00 0.00 O ATOM 2086 CB MET A 136 4.447 -4.040 -7.544 1.00 0.00 C ATOM 2087 CG MET A 136 4.460 -4.095 -9.058 1.00 0.00 C ATOM 2088 SD MET A 136 3.415 -5.410 -9.714 1.00 0.00 S ATOM 2089 CE MET A 136 1.841 -4.976 -8.979 1.00 0.00 C ATOM 0 H MET A 136 6.857 -3.296 -8.057 1.00 0.00 H new ATOM 0 HA MET A 136 5.544 -4.610 -5.801 1.00 0.00 H new ATOM 0 HB2 MET A 136 3.582 -4.595 -7.180 1.00 0.00 H new ATOM 0 HB3 MET A 136 4.316 -3.004 -7.232 1.00 0.00 H new ATOM 0 HG2 MET A 136 4.124 -3.137 -9.455 1.00 0.00 H new ATOM 0 HG3 MET A 136 5.483 -4.243 -9.404 1.00 0.00 H new ATOM 0 HE1 MET A 136 1.032 -5.389 -9.581 1.00 0.00 H new ATOM 0 HE2 MET A 136 1.786 -5.383 -7.969 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.745 -3.891 -8.939 1.00 0.00 H new ATOM 2099 N LYS A 137 6.670 -6.137 -8.472 1.00 0.00 N ATOM 2100 CA LYS A 137 7.001 -7.437 -9.039 1.00 0.00 C ATOM 2101 C LYS A 137 8.098 -8.125 -8.223 1.00 0.00 C ATOM 2102 O LYS A 137 8.351 -9.319 -8.389 1.00 0.00 O ATOM 2103 CB LYS A 137 7.419 -7.291 -10.506 1.00 0.00 C ATOM 2104 CG LYS A 137 8.778 -6.645 -10.717 1.00 0.00 C ATOM 2105 CD LYS A 137 8.932 -6.105 -12.136 1.00 0.00 C ATOM 2106 CE LYS A 137 8.418 -7.085 -13.184 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.264 -8.307 -13.266 1.00 0.00 N ATOM 0 H LYS A 137 7.027 -5.344 -9.004 1.00 0.00 H new ATOM 0 HA LYS A 137 6.111 -8.065 -8.998 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.425 -8.278 -10.968 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.666 -6.700 -11.027 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.910 -5.833 -10.002 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.563 -7.375 -10.518 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.391 -5.163 -12.225 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.983 -5.888 -12.328 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.393 -7.369 -12.944 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.393 -6.595 -14.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 8.880 -8.947 -13.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.236 -8.040 -13.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.268 -8.789 -12.345 1.00 0.00 H new ATOM 2121 N GLU A 138 8.747 -7.362 -7.344 1.00 0.00 N ATOM 2122 CA GLU A 138 9.815 -7.890 -6.501 1.00 0.00 C ATOM 2123 C GLU A 138 9.289 -8.260 -5.122 1.00 0.00 C ATOM 2124 O GLU A 138 9.201 -9.435 -4.767 1.00 0.00 O ATOM 2125 CB GLU A 138 10.938 -6.859 -6.359 1.00 0.00 C ATOM 2126 CG GLU A 138 12.241 -7.283 -7.013 1.00 0.00 C ATOM 2127 CD GLU A 138 13.262 -7.780 -6.007 1.00 0.00 C ATOM 2128 OE1 GLU A 138 13.993 -6.942 -5.440 1.00 0.00 O ATOM 2129 OE2 GLU A 138 13.326 -9.008 -5.785 1.00 0.00 O ATOM 0 H GLU A 138 8.549 -6.372 -7.198 1.00 0.00 H new ATOM 0 HA GLU A 138 10.205 -8.788 -6.979 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.611 -5.916 -6.798 1.00 0.00 H new ATOM 0 HB3 GLU A 138 11.117 -6.673 -5.300 1.00 0.00 H new ATOM 0 HG2 GLU A 138 12.040 -8.070 -7.740 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.659 -6.440 -7.563 1.00 0.00 H new ATOM 2136 N ALA A 139 8.950 -7.237 -4.347 1.00 0.00 N ATOM 2137 CA ALA A 139 8.439 -7.428 -2.997 1.00 0.00 C ATOM 2138 C ALA A 139 7.304 -8.444 -2.964 1.00 0.00 C ATOM 2139 O ALA A 139 7.047 -9.067 -1.936 1.00 0.00 O ATOM 2140 CB ALA A 139 7.972 -6.101 -2.420 1.00 0.00 C ATOM 0 H ALA A 139 9.021 -6.261 -4.634 1.00 0.00 H new ATOM 0 HA ALA A 139 9.253 -7.819 -2.386 1.00 0.00 H new ATOM 0 HB1 ALA A 139 7.592 -6.257 -1.410 1.00 0.00 H new ATOM 0 HB2 ALA A 139 8.809 -5.403 -2.389 1.00 0.00 H new ATOM 0 HB3 ALA A 139 7.180 -5.690 -3.046 1.00 0.00 H new ATOM 2146 N GLN A 140 6.618 -8.598 -4.090 1.00 0.00 N ATOM 2147 CA GLN A 140 5.508 -9.528 -4.178 1.00 0.00 C ATOM 2148 C GLN A 140 5.961 -10.979 -4.004 1.00 0.00 C ATOM 2149 O GLN A 140 5.139 -11.866 -3.788 1.00 0.00 O ATOM 2150 CB GLN A 140 4.801 -9.364 -5.517 1.00 0.00 C ATOM 2151 CG GLN A 140 5.705 -9.591 -6.712 1.00 0.00 C ATOM 2152 CD GLN A 140 6.008 -11.057 -6.953 1.00 0.00 C ATOM 2153 OE1 GLN A 140 7.169 -11.456 -7.047 1.00 0.00 O ATOM 2154 NE2 GLN A 140 4.962 -11.869 -7.056 1.00 0.00 N ATOM 0 H GLN A 140 6.814 -8.089 -4.952 1.00 0.00 H new ATOM 0 HA GLN A 140 4.819 -9.298 -3.365 1.00 0.00 H new ATOM 0 HB2 GLN A 140 3.966 -10.063 -5.566 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.380 -8.360 -5.576 1.00 0.00 H new ATOM 0 HG2 GLN A 140 5.235 -9.171 -7.601 1.00 0.00 H new ATOM 0 HG3 GLN A 140 6.640 -9.052 -6.561 1.00 0.00 H new ATOM 0 HE21 GLN A 140 4.016 -11.496 -6.972 1.00 0.00 H new ATOM 0 HE22 GLN A 140 5.104 -12.866 -7.219 1.00 0.00 H new ATOM 2163 N GLU A 141 7.265 -11.218 -4.112 1.00 0.00 N ATOM 2164 CA GLU A 141 7.805 -12.568 -3.977 1.00 0.00 C ATOM 2165 C GLU A 141 8.450 -12.774 -2.606 1.00 0.00 C ATOM 2166 O GLU A 141 8.398 -13.866 -2.042 1.00 0.00 O ATOM 2167 CB GLU A 141 8.810 -12.844 -5.108 1.00 0.00 C ATOM 2168 CG GLU A 141 10.191 -13.263 -4.635 1.00 0.00 C ATOM 2169 CD GLU A 141 11.231 -13.196 -5.735 1.00 0.00 C ATOM 2170 OE1 GLU A 141 11.345 -12.132 -6.380 1.00 0.00 O ATOM 2171 OE2 GLU A 141 11.934 -14.206 -5.951 1.00 0.00 O ATOM 0 H GLU A 141 7.965 -10.498 -4.292 1.00 0.00 H new ATOM 0 HA GLU A 141 6.983 -13.279 -4.057 1.00 0.00 H new ATOM 0 HB2 GLU A 141 8.407 -13.626 -5.752 1.00 0.00 H new ATOM 0 HB3 GLU A 141 8.906 -11.946 -5.719 1.00 0.00 H new ATOM 0 HG2 GLU A 141 10.499 -12.620 -3.810 1.00 0.00 H new ATOM 0 HG3 GLU A 141 10.144 -14.280 -4.246 1.00 0.00 H new ATOM 2178 N ARG A 142 9.063 -11.719 -2.084 1.00 0.00 N ATOM 2179 CA ARG A 142 9.728 -11.782 -0.786 1.00 0.00 C ATOM 2180 C ARG A 142 8.783 -11.393 0.350 1.00 0.00 C ATOM 2181 O ARG A 142 9.080 -11.629 1.520 1.00 0.00 O ATOM 2182 CB ARG A 142 10.948 -10.859 -0.777 1.00 0.00 C ATOM 2183 CG ARG A 142 10.662 -9.482 -1.357 1.00 0.00 C ATOM 2184 CD ARG A 142 11.790 -8.503 -1.076 1.00 0.00 C ATOM 2185 NE ARG A 142 13.105 -9.096 -1.313 1.00 0.00 N ATOM 2186 CZ ARG A 142 13.829 -9.706 -0.374 1.00 0.00 C ATOM 2187 NH1 ARG A 142 13.373 -9.811 0.869 1.00 0.00 N ATOM 2188 NH2 ARG A 142 15.014 -10.214 -0.680 1.00 0.00 N ATOM 0 H ARG A 142 9.114 -10.808 -2.539 1.00 0.00 H new ATOM 0 HA ARG A 142 10.044 -12.813 -0.626 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.304 -10.748 0.247 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.753 -11.326 -1.345 1.00 0.00 H new ATOM 0 HG2 ARG A 142 10.513 -9.565 -2.434 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.733 -9.096 -0.936 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.671 -7.622 -1.707 1.00 0.00 H new ATOM 0 HD3 ARG A 142 11.726 -8.165 -0.042 1.00 0.00 H new ATOM 0 HE ARG A 142 13.493 -9.040 -2.255 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.462 -9.423 1.112 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.934 -10.279 1.580 1.00 0.00 H new ATOM 0 HH21 ARG A 142 15.371 -10.138 -1.632 1.00 0.00 H new ATOM 0 HH22 ARG A 142 15.569 -10.681 0.037 1.00 0.00 H new ATOM 2202 N LEU A 143 7.654 -10.783 0.003 1.00 0.00 N ATOM 2203 CA LEU A 143 6.684 -10.350 1.000 1.00 0.00 C ATOM 2204 C LEU A 143 5.535 -11.345 1.141 1.00 0.00 C ATOM 2205 O LEU A 143 5.145 -11.696 2.254 1.00 0.00 O ATOM 2206 CB LEU A 143 6.140 -8.972 0.626 1.00 0.00 C ATOM 2207 CG LEU A 143 5.329 -8.278 1.717 1.00 0.00 C ATOM 2208 CD1 LEU A 143 6.098 -8.261 3.029 1.00 0.00 C ATOM 2209 CD2 LEU A 143 4.969 -6.863 1.287 1.00 0.00 C ATOM 0 H LEU A 143 7.389 -10.578 -0.961 1.00 0.00 H new ATOM 0 HA LEU A 143 7.193 -10.296 1.962 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.977 -8.330 0.353 1.00 0.00 H new ATOM 0 HB3 LEU A 143 5.514 -9.074 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 143 4.407 -8.838 1.872 1.00 0.00 H new ATOM 0 HD11 LEU A 143 5.502 -7.762 3.793 1.00 0.00 H new ATOM 0 HD12 LEU A 143 6.306 -9.284 3.342 1.00 0.00 H new ATOM 0 HD13 LEU A 143 7.037 -7.725 2.893 1.00 0.00 H new ATOM 0 HD21 LEU A 143 4.391 -6.379 2.074 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.881 -6.295 1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 143 4.377 -6.900 0.373 1.00 0.00 H new ATOM 2221 N THR A 144 4.991 -11.791 0.013 1.00 0.00 N ATOM 2222 CA THR A 144 3.883 -12.738 0.021 1.00 0.00 C ATOM 2223 C THR A 144 4.208 -13.964 0.869 1.00 0.00 C ATOM 2224 O THR A 144 3.343 -14.499 1.561 1.00 0.00 O ATOM 2225 CB THR A 144 3.550 -13.163 -1.406 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.714 -13.598 -2.086 1.00 0.00 O ATOM 2227 CG2 THR A 144 2.920 -12.058 -2.227 1.00 0.00 C ATOM 0 H THR A 144 5.300 -11.511 -0.918 1.00 0.00 H new ATOM 0 HA THR A 144 3.018 -12.243 0.462 1.00 0.00 H new ATOM 0 HB THR A 144 2.829 -13.974 -1.305 1.00 0.00 H new ATOM 0 HG1 THR A 144 5.144 -12.832 -2.521 1.00 0.00 H new ATOM 0 HG21 THR A 144 2.708 -12.426 -3.231 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.991 -11.738 -1.754 1.00 0.00 H new ATOM 0 HG23 THR A 144 3.606 -11.213 -2.288 1.00 0.00 H new ATOM 2235 N GLY A 145 5.460 -14.401 0.812 1.00 0.00 N ATOM 2236 CA GLY A 145 5.876 -15.558 1.582 1.00 0.00 C ATOM 2237 C GLY A 145 6.342 -15.185 2.975 1.00 0.00 C ATOM 2238 O GLY A 145 5.529 -14.921 3.859 1.00 0.00 O ATOM 0 H GLY A 145 6.195 -13.975 0.247 1.00 0.00 H new ATOM 0 HA2 GLY A 145 5.046 -16.261 1.655 1.00 0.00 H new ATOM 0 HA3 GLY A 145 6.682 -16.070 1.057 1.00 0.00 H new ATOM 2242 N ASP A 146 7.657 -15.159 3.168 1.00 0.00 N ATOM 2243 CA ASP A 146 8.231 -14.811 4.462 1.00 0.00 C ATOM 2244 C ASP A 146 9.734 -14.582 4.349 1.00 0.00 C ATOM 2245 O ASP A 146 10.481 -14.809 5.300 1.00 0.00 O ATOM 2246 CB ASP A 146 7.946 -15.913 5.485 1.00 0.00 C ATOM 2247 CG ASP A 146 8.229 -17.299 4.938 1.00 0.00 C ATOM 2248 OD1 ASP A 146 9.398 -17.577 4.603 1.00 0.00 O ATOM 2249 OD2 ASP A 146 7.280 -18.107 4.848 1.00 0.00 O ATOM 0 H ASP A 146 8.344 -15.375 2.445 1.00 0.00 H new ATOM 0 HA ASP A 146 7.766 -13.884 4.798 1.00 0.00 H new ATOM 0 HB2 ASP A 146 8.554 -15.745 6.374 1.00 0.00 H new ATOM 0 HB3 ASP A 146 6.903 -15.855 5.796 1.00 0.00 H new ATOM 2254 N ALA A 147 10.169 -14.118 3.183 1.00 0.00 N ATOM 2255 CA ALA A 147 11.579 -13.843 2.949 1.00 0.00 C ATOM 2256 C ALA A 147 11.921 -12.415 3.357 1.00 0.00 C ATOM 2257 O ALA A 147 13.071 -12.101 3.662 1.00 0.00 O ATOM 2258 CB ALA A 147 11.929 -14.077 1.487 1.00 0.00 C ATOM 0 H ALA A 147 9.564 -13.925 2.385 1.00 0.00 H new ATOM 0 HA ALA A 147 12.170 -14.525 3.560 1.00 0.00 H new ATOM 0 HB1 ALA A 147 12.987 -13.867 1.328 1.00 0.00 H new ATOM 0 HB2 ALA A 147 11.721 -15.114 1.225 1.00 0.00 H new ATOM 0 HB3 ALA A 147 11.330 -13.417 0.859 1.00 0.00 H new ATOM 2264 N PHE A 148 10.907 -11.553 3.361 1.00 0.00 N ATOM 2265 CA PHE A 148 11.087 -10.156 3.732 1.00 0.00 C ATOM 2266 C PHE A 148 11.678 -10.036 5.135 1.00 0.00 C ATOM 2267 O PHE A 148 12.464 -9.129 5.412 1.00 0.00 O ATOM 2268 CB PHE A 148 9.748 -9.415 3.653 1.00 0.00 C ATOM 2269 CG PHE A 148 8.765 -9.809 4.719 1.00 0.00 C ATOM 2270 CD1 PHE A 148 8.035 -10.982 4.610 1.00 0.00 C ATOM 2271 CD2 PHE A 148 8.568 -9.002 5.828 1.00 0.00 C ATOM 2272 CE1 PHE A 148 7.127 -11.342 5.588 1.00 0.00 C ATOM 2273 CE2 PHE A 148 7.662 -9.356 6.809 1.00 0.00 C ATOM 2274 CZ PHE A 148 6.941 -10.528 6.689 1.00 0.00 C ATOM 0 H PHE A 148 9.950 -11.801 3.110 1.00 0.00 H new ATOM 0 HA PHE A 148 11.786 -9.701 3.030 1.00 0.00 H new ATOM 0 HB2 PHE A 148 9.933 -8.343 3.723 1.00 0.00 H new ATOM 0 HB3 PHE A 148 9.301 -9.598 2.676 1.00 0.00 H new ATOM 0 HD1 PHE A 148 8.177 -11.622 3.752 1.00 0.00 H new ATOM 0 HD2 PHE A 148 9.130 -8.085 5.927 1.00 0.00 H new ATOM 0 HE1 PHE A 148 6.564 -12.258 5.492 1.00 0.00 H new ATOM 0 HE2 PHE A 148 7.518 -8.718 7.668 1.00 0.00 H new ATOM 0 HZ PHE A 148 6.233 -10.808 7.455 1.00 0.00 H new ATOM 2284 N ARG A 149 11.299 -10.959 6.013 1.00 0.00 N ATOM 2285 CA ARG A 149 11.791 -10.962 7.381 1.00 0.00 C ATOM 2286 C ARG A 149 13.283 -11.274 7.421 1.00 0.00 C ATOM 2287 O ARG A 149 13.723 -12.308 6.920 1.00 0.00 O ATOM 2288 CB ARG A 149 11.021 -11.986 8.213 1.00 0.00 C ATOM 2289 CG ARG A 149 9.528 -12.003 7.933 1.00 0.00 C ATOM 2290 CD ARG A 149 8.765 -12.731 9.027 1.00 0.00 C ATOM 2291 NE ARG A 149 8.404 -14.090 8.631 1.00 0.00 N ATOM 2292 CZ ARG A 149 8.077 -15.050 9.494 1.00 0.00 C ATOM 2293 NH1 ARG A 149 8.059 -14.805 10.799 1.00 0.00 N ATOM 2294 NH2 ARG A 149 7.766 -16.261 9.049 1.00 0.00 N ATOM 0 H ARG A 149 10.650 -11.716 5.798 1.00 0.00 H new ATOM 0 HA ARG A 149 11.636 -9.969 7.802 1.00 0.00 H new ATOM 0 HB2 ARG A 149 11.429 -12.978 8.020 1.00 0.00 H new ATOM 0 HB3 ARG A 149 11.181 -11.776 9.270 1.00 0.00 H new ATOM 0 HG2 ARG A 149 9.160 -10.980 7.850 1.00 0.00 H new ATOM 0 HG3 ARG A 149 9.342 -12.487 6.974 1.00 0.00 H new ATOM 0 HD2 ARG A 149 9.373 -12.766 9.931 1.00 0.00 H new ATOM 0 HD3 ARG A 149 7.861 -12.173 9.272 1.00 0.00 H new ATOM 0 HE ARG A 149 8.402 -14.317 7.636 1.00 0.00 H new ATOM 0 HH11 ARG A 149 8.297 -13.876 11.147 1.00 0.00 H new ATOM 0 HH12 ARG A 149 7.807 -15.546 11.454 1.00 0.00 H new ATOM 0 HH21 ARG A 149 7.778 -16.455 8.048 1.00 0.00 H new ATOM 0 HH22 ARG A 149 7.515 -16.998 9.708 1.00 0.00 H new ATOM 2308 N LYS A 150 14.054 -10.375 8.020 1.00 0.00 N ATOM 2309 CA LYS A 150 15.497 -10.557 8.127 1.00 0.00 C ATOM 2310 C LYS A 150 15.930 -10.617 9.588 1.00 0.00 C ATOM 2311 O LYS A 150 15.527 -9.784 10.401 1.00 0.00 O ATOM 2312 CB LYS A 150 16.229 -9.419 7.412 1.00 0.00 C ATOM 2313 CG LYS A 150 16.009 -8.058 8.050 1.00 0.00 C ATOM 2314 CD LYS A 150 16.789 -6.969 7.327 1.00 0.00 C ATOM 2315 CE LYS A 150 17.538 -6.077 8.304 1.00 0.00 C ATOM 2316 NZ LYS A 150 18.631 -5.315 7.639 1.00 0.00 N ATOM 0 H LYS A 150 13.705 -9.513 8.439 1.00 0.00 H new ATOM 0 HA LYS A 150 15.756 -11.503 7.651 1.00 0.00 H new ATOM 0 HB2 LYS A 150 17.297 -9.637 7.399 1.00 0.00 H new ATOM 0 HB3 LYS A 150 15.899 -9.382 6.374 1.00 0.00 H new ATOM 0 HG2 LYS A 150 14.946 -7.816 8.036 1.00 0.00 H new ATOM 0 HG3 LYS A 150 16.314 -8.092 9.096 1.00 0.00 H new ATOM 0 HD2 LYS A 150 17.496 -7.425 6.634 1.00 0.00 H new ATOM 0 HD3 LYS A 150 16.105 -6.364 6.732 1.00 0.00 H new ATOM 0 HE2 LYS A 150 16.840 -5.380 8.767 1.00 0.00 H new ATOM 0 HE3 LYS A 150 17.957 -6.687 9.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 19.116 -4.720 8.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 19.312 -5.980 7.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 18.230 -4.713 6.892 1.00 0.00 H new ATOM 2330 N LYS A 151 16.752 -11.608 9.917 1.00 0.00 N ATOM 2331 CA LYS A 151 17.240 -11.777 11.281 1.00 0.00 C ATOM 2332 C LYS A 151 16.086 -12.062 12.238 1.00 0.00 C ATOM 2333 O LYS A 151 14.948 -11.661 11.992 1.00 0.00 O ATOM 2334 CB LYS A 151 17.998 -10.527 11.735 1.00 0.00 C ATOM 2335 CG LYS A 151 19.233 -10.833 12.566 1.00 0.00 C ATOM 2336 CD LYS A 151 19.816 -9.570 13.180 1.00 0.00 C ATOM 2337 CE LYS A 151 20.845 -8.925 12.261 1.00 0.00 C ATOM 2338 NZ LYS A 151 20.591 -7.469 12.080 1.00 0.00 N ATOM 0 H LYS A 151 17.094 -12.307 9.257 1.00 0.00 H new ATOM 0 HA LYS A 151 17.920 -12.629 11.294 1.00 0.00 H new ATOM 0 HB2 LYS A 151 18.294 -9.953 10.857 1.00 0.00 H new ATOM 0 HB3 LYS A 151 17.326 -9.896 12.317 1.00 0.00 H new ATOM 0 HG2 LYS A 151 18.976 -11.538 13.356 1.00 0.00 H new ATOM 0 HG3 LYS A 151 19.984 -11.315 11.940 1.00 0.00 H new ATOM 0 HD2 LYS A 151 19.014 -8.860 13.385 1.00 0.00 H new ATOM 0 HD3 LYS A 151 20.281 -9.810 14.136 1.00 0.00 H new ATOM 0 HE2 LYS A 151 21.843 -9.071 12.674 1.00 0.00 H new ATOM 0 HE3 LYS A 151 20.826 -9.420 11.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 21.313 -7.067 11.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 19.649 -7.330 11.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 20.634 -6.992 13.003 1.00 0.00 H new ATOM 2352 N HIS A 152 16.387 -12.758 13.330 1.00 0.00 N ATOM 2353 CA HIS A 152 15.374 -13.097 14.323 1.00 0.00 C ATOM 2354 C HIS A 152 14.735 -11.839 14.903 1.00 0.00 C ATOM 2355 O HIS A 152 15.327 -10.760 14.873 1.00 0.00 O ATOM 2356 CB HIS A 152 15.991 -13.932 15.446 1.00 0.00 C ATOM 2357 CG HIS A 152 16.593 -15.219 14.973 1.00 0.00 C ATOM 2358 ND1 HIS A 152 15.983 -16.444 15.148 1.00 0.00 N ATOM 2359 CD2 HIS A 152 17.756 -15.470 14.326 1.00 0.00 C ATOM 2360 CE1 HIS A 152 16.746 -17.391 14.630 1.00 0.00 C ATOM 2361 NE2 HIS A 152 17.827 -16.825 14.125 1.00 0.00 N ATOM 0 H HIS A 152 17.323 -13.098 13.549 1.00 0.00 H new ATOM 0 HA HIS A 152 14.598 -13.681 13.828 1.00 0.00 H new ATOM 0 HB2 HIS A 152 16.760 -13.343 15.946 1.00 0.00 H new ATOM 0 HB3 HIS A 152 15.224 -14.150 16.189 1.00 0.00 H new ATOM 0 HD2 HIS A 152 18.491 -14.739 14.024 1.00 0.00 H new ATOM 0 HE1 HIS A 152 16.523 -18.448 14.621 1.00 0.00 H new ATOM 0 HE2 HIS A 152 18.591 -17.316 13.661 1.00 0.00 H new ATOM 2370 N LEU A 153 13.524 -11.986 15.427 1.00 0.00 N ATOM 2371 CA LEU A 153 12.803 -10.861 16.012 1.00 0.00 C ATOM 2372 C LEU A 153 11.500 -11.327 16.654 1.00 0.00 C ATOM 2373 O LEU A 153 10.503 -11.552 15.966 1.00 0.00 O ATOM 2374 CB LEU A 153 12.514 -9.801 14.944 1.00 0.00 C ATOM 2375 CG LEU A 153 13.295 -8.492 15.105 1.00 0.00 C ATOM 2376 CD1 LEU A 153 14.170 -8.236 13.886 1.00 0.00 C ATOM 2377 CD2 LEU A 153 12.343 -7.327 15.333 1.00 0.00 C ATOM 0 H LEU A 153 13.020 -12.872 15.459 1.00 0.00 H new ATOM 0 HA LEU A 153 13.431 -10.421 16.787 1.00 0.00 H new ATOM 0 HB2 LEU A 153 12.739 -10.223 13.964 1.00 0.00 H new ATOM 0 HB3 LEU A 153 11.448 -9.575 14.957 1.00 0.00 H new ATOM 0 HG LEU A 153 13.942 -8.584 15.978 1.00 0.00 H new ATOM 0 HD11 LEU A 153 14.716 -7.302 14.020 1.00 0.00 H new ATOM 0 HD12 LEU A 153 14.878 -9.056 13.767 1.00 0.00 H new ATOM 0 HD13 LEU A 153 13.544 -8.166 12.997 1.00 0.00 H new ATOM 0 HD21 LEU A 153 12.915 -6.406 15.445 1.00 0.00 H new ATOM 0 HD22 LEU A 153 11.670 -7.235 14.480 1.00 0.00 H new ATOM 0 HD23 LEU A 153 11.761 -7.505 16.237 1.00 0.00 H new ATOM 2389 N GLU A 154 11.514 -11.471 17.976 1.00 0.00 N ATOM 2390 CA GLU A 154 10.332 -11.911 18.708 1.00 0.00 C ATOM 2391 C GLU A 154 10.475 -11.615 20.199 1.00 0.00 C ATOM 2392 O GLU A 154 11.306 -12.212 20.884 1.00 0.00 O ATOM 2393 CB GLU A 154 10.102 -13.408 18.492 1.00 0.00 C ATOM 2394 CG GLU A 154 8.647 -13.770 18.244 1.00 0.00 C ATOM 2395 CD GLU A 154 8.281 -15.131 18.807 1.00 0.00 C ATOM 2396 OE1 GLU A 154 8.132 -15.239 20.043 1.00 0.00 O ATOM 2397 OE2 GLU A 154 8.145 -16.084 18.013 1.00 0.00 O ATOM 0 H GLU A 154 12.330 -11.290 18.561 1.00 0.00 H new ATOM 0 HA GLU A 154 9.472 -11.360 18.328 1.00 0.00 H new ATOM 0 HB2 GLU A 154 10.700 -13.740 17.644 1.00 0.00 H new ATOM 0 HB3 GLU A 154 10.459 -13.952 19.366 1.00 0.00 H new ATOM 0 HG2 GLU A 154 8.006 -13.011 18.692 1.00 0.00 H new ATOM 0 HG3 GLU A 154 8.451 -13.760 17.172 1.00 0.00 H new ATOM 2404 N ASP A 155 9.658 -10.691 20.693 1.00 0.00 N ATOM 2405 CA ASP A 155 9.692 -10.318 22.103 1.00 0.00 C ATOM 2406 C ASP A 155 8.402 -9.615 22.512 1.00 0.00 C ATOM 2407 O ASP A 155 8.172 -8.459 22.155 1.00 0.00 O ATOM 2408 CB ASP A 155 10.892 -9.411 22.384 1.00 0.00 C ATOM 2409 CG ASP A 155 10.886 -8.164 21.522 1.00 0.00 C ATOM 2410 OD1 ASP A 155 11.182 -8.276 20.313 1.00 0.00 O ATOM 2411 OD2 ASP A 155 10.587 -7.074 22.056 1.00 0.00 O ATOM 0 H ASP A 155 8.965 -10.187 20.139 1.00 0.00 H new ATOM 0 HA ASP A 155 9.789 -11.230 22.691 1.00 0.00 H new ATOM 0 HB2 ASP A 155 10.888 -9.123 23.435 1.00 0.00 H new ATOM 0 HB3 ASP A 155 11.813 -9.967 22.209 1.00 0.00 H new ATOM 2416 N GLU A 156 7.563 -10.320 23.264 1.00 0.00 N ATOM 2417 CA GLU A 156 6.296 -9.764 23.724 1.00 0.00 C ATOM 2418 C GLU A 156 6.006 -10.187 25.160 1.00 0.00 C ATOM 2419 O GLU A 156 5.725 -9.351 26.020 1.00 0.00 O ATOM 2420 CB GLU A 156 5.157 -10.210 22.804 1.00 0.00 C ATOM 2421 CG GLU A 156 4.718 -9.142 21.817 1.00 0.00 C ATOM 2422 CD GLU A 156 5.794 -8.809 20.802 1.00 0.00 C ATOM 2423 OE1 GLU A 156 6.176 -9.710 20.025 1.00 0.00 O ATOM 2424 OE2 GLU A 156 6.256 -7.649 20.783 1.00 0.00 O ATOM 0 H GLU A 156 7.738 -11.278 23.568 1.00 0.00 H new ATOM 0 HA GLU A 156 6.371 -8.677 23.695 1.00 0.00 H new ATOM 0 HB2 GLU A 156 5.473 -11.095 22.252 1.00 0.00 H new ATOM 0 HB3 GLU A 156 4.302 -10.503 23.414 1.00 0.00 H new ATOM 0 HG2 GLU A 156 3.823 -9.481 21.295 1.00 0.00 H new ATOM 0 HG3 GLU A 156 4.446 -8.238 22.362 1.00 0.00 H new ATOM 2431 N LEU A 157 6.075 -11.490 25.413 1.00 0.00 N ATOM 2432 CA LEU A 157 5.821 -12.024 26.746 1.00 0.00 C ATOM 2433 C LEU A 157 6.666 -13.267 27.005 1.00 0.00 C ATOM 2434 O LEU A 157 6.620 -14.196 26.171 1.00 0.00 O ATOM 2435 CB LEU A 157 4.334 -12.355 26.910 1.00 0.00 C ATOM 2436 CG LEU A 157 3.669 -11.750 28.146 1.00 0.00 C ATOM 2437 CD1 LEU A 157 3.132 -10.360 27.838 1.00 0.00 C ATOM 2438 CD2 LEU A 157 2.554 -12.654 28.649 1.00 0.00 C ATOM 2439 OXT LEU A 157 7.365 -13.302 28.038 1.00 0.00 O ATOM 0 H LEU A 157 6.305 -12.195 24.713 1.00 0.00 H new ATOM 0 HA LEU A 157 6.098 -11.263 27.475 1.00 0.00 H new ATOM 0 HB2 LEU A 157 3.801 -12.010 26.024 1.00 0.00 H new ATOM 0 HB3 LEU A 157 4.221 -13.438 26.949 1.00 0.00 H new ATOM 0 HG LEU A 157 4.420 -11.662 28.931 1.00 0.00 H new ATOM 0 HD11 LEU A 157 2.662 -9.946 28.730 1.00 0.00 H new ATOM 0 HD12 LEU A 157 3.953 -9.714 27.526 1.00 0.00 H new ATOM 0 HD13 LEU A 157 2.396 -10.424 27.037 1.00 0.00 H new ATOM 0 HD21 LEU A 157 2.092 -12.207 29.529 1.00 0.00 H new ATOM 0 HD22 LEU A 157 1.804 -12.775 27.868 1.00 0.00 H new ATOM 0 HD23 LEU A 157 2.966 -13.629 28.911 1.00 0.00 H new TER 2451 LEU A 157