USER MOD reduce.3.24.130724 H: found=0, std=0, add=1119, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1120 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 121 LYS NZ :NH3+ -176:sc= 0.138 (180deg=0) USER MOD Set 1.2: A 125 TYR OH : rot -40:sc= -0.742 USER MOD Set 2.1: A 107 CYS SG : rot 180:sc= -1.4 USER MOD Set 2.2: A 110 CYS SG : rot -151:sc= 0.403 USER MOD Set 2.3: A 115 THR OG1 : rot 148:sc= 1.3 USER MOD Set 3.1: A 34 MET CE :methyl 142:sc= -0.0281 (180deg=-0.219) USER MOD Set 3.2: A 97 MET CE :methyl -151:sc= -0.395 (180deg=-2.33!) USER MOD Set 4.1: A 33 ASN : amide:sc= 0.379 K(o=0.4,f=-5.5!) USER MOD Set 4.2: A 47 ASN : amide:sc= 0.0225 X(o=0.4,f=-0.002) USER MOD Set 5.1: A 28 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 30 SER OG : rot -84:sc= 1.55 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot -79:sc= -0.123! USER MOD Single : A 17 SER OG : rot 180:sc= 0.244 USER MOD Single : A 18 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0434) USER MOD Single : A 22 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0615) USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= -1.48 (180deg=-1.91!) USER MOD Single : A 29 GLN : amide:sc= -4.03! C(o=-4!,f=-1.7!) USER MOD Single : A 38 ASN : amide:sc= -2.32! C(o=-2.3!,f=-5.2!) USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0472 USER MOD Single : A 43 THR OG1 : rot -56:sc= 0.0544 USER MOD Single : A 51 TYR OH : rot 17:sc= -1.72 USER MOD Single : A 52 CYS SG : rot 70:sc= 0.526 USER MOD Single : A 60 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00534) USER MOD Single : A 62 CYS SG : rot -130:sc= 0 USER MOD Single : A 63 MET CE :methyl -169:sc= 0 (180deg=-0.159) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00411) USER MOD Single : A 75 ASN : amide:sc= -0.109 K(o=-0.11,f=-9.6!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 87 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0245) USER MOD Single : A 89 SER OG : rot 48:sc= 0.531 USER MOD Single : A 90 SER OG : rot 82:sc= 1.3 USER MOD Single : A 91 GLN : amide:sc= -0.554 K(o=-0.55,f=-4.7!) USER MOD Single : A 94 ASN : amide:sc= 0.669 K(o=0.67,f=-0.067) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 40:sc= 1.1 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 61:sc= 0.11 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.295) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot -29:sc= 0.847 USER MOD Single : A 131 CYS SG : rot 32:sc= -0.633 USER MOD Single : A 134 GLN : amide:sc= -0.289 K(o=-0.29,f=-3.8!) USER MOD Single : A 135 THR OG1 : rot -120:sc= -0.041 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 7 -16.323 -1.911 7.955 1.00 0.00 N ATOM 2 CA GLU A 7 -17.504 -2.274 7.139 1.00 0.00 C ATOM 3 C GLU A 7 -17.173 -3.274 6.014 1.00 0.00 C ATOM 4 O GLU A 7 -15.999 -3.557 5.750 1.00 0.00 O ATOM 5 CB GLU A 7 -18.169 -0.991 6.615 1.00 0.00 C ATOM 6 CG GLU A 7 -17.250 -0.094 5.781 1.00 0.00 C ATOM 7 CD GLU A 7 -17.863 1.284 5.481 1.00 0.00 C ATOM 8 OE1 GLU A 7 -19.052 1.321 5.110 1.00 0.00 O ATOM 9 OE2 GLU A 7 -17.096 2.270 5.576 1.00 0.00 O ATOM 0 HA GLU A 7 -18.214 -2.802 7.776 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -19.033 -1.266 6.011 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -18.543 -0.418 7.464 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -16.307 0.042 6.310 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -17.019 -0.595 4.841 1.00 0.00 H new ATOM 16 N TYR A 8 -18.217 -3.837 5.404 1.00 0.00 N ATOM 17 CA TYR A 8 -18.115 -4.809 4.297 1.00 0.00 C ATOM 18 C TYR A 8 -17.453 -4.235 3.034 1.00 0.00 C ATOM 19 O TYR A 8 -18.072 -3.533 2.231 1.00 0.00 O ATOM 20 CB TYR A 8 -19.514 -5.353 3.945 1.00 0.00 C ATOM 21 CG TYR A 8 -20.244 -5.980 5.137 1.00 0.00 C ATOM 22 CD1 TYR A 8 -19.969 -7.299 5.523 1.00 0.00 C ATOM 23 CD2 TYR A 8 -21.169 -5.221 5.867 1.00 0.00 C ATOM 24 CE1 TYR A 8 -20.611 -7.856 6.646 1.00 0.00 C ATOM 25 CE2 TYR A 8 -21.811 -5.766 6.983 1.00 0.00 C ATOM 26 CZ TYR A 8 -21.528 -7.081 7.375 1.00 0.00 C ATOM 27 OH TYR A 8 -22.163 -7.609 8.452 1.00 0.00 O ATOM 0 H TYR A 8 -19.181 -3.630 5.666 1.00 0.00 H new ATOM 0 HA TYR A 8 -17.469 -5.612 4.652 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -20.121 -4.541 3.544 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -19.417 -6.098 3.156 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -19.263 -7.890 4.958 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -21.387 -4.207 5.565 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -20.400 -8.872 6.945 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -22.523 -5.175 7.541 1.00 0.00 H new ATOM 0 HH TYR A 8 -22.762 -6.937 8.841 1.00 0.00 H new ATOM 37 N VAL A 9 -16.131 -4.397 2.976 1.00 0.00 N ATOM 38 CA VAL A 9 -15.284 -3.971 1.844 1.00 0.00 C ATOM 39 C VAL A 9 -14.418 -5.168 1.372 1.00 0.00 C ATOM 40 O VAL A 9 -14.455 -6.242 1.976 1.00 0.00 O ATOM 41 CB VAL A 9 -14.438 -2.719 2.180 1.00 0.00 C ATOM 42 CG1 VAL A 9 -14.014 -2.009 0.895 1.00 0.00 C ATOM 43 CG2 VAL A 9 -15.152 -1.678 3.041 1.00 0.00 C ATOM 0 H VAL A 9 -15.600 -4.837 3.728 1.00 0.00 H new ATOM 0 HA VAL A 9 -15.929 -3.666 1.020 1.00 0.00 H new ATOM 0 HB VAL A 9 -13.592 -3.106 2.748 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -13.420 -1.130 1.144 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -13.419 -2.688 0.283 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -14.900 -1.702 0.339 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -14.483 -0.837 3.225 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -16.043 -1.326 2.522 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -15.440 -2.127 3.991 1.00 0.00 H new ATOM 53 N GLU A 10 -13.698 -4.988 0.257 1.00 0.00 N ATOM 54 CA GLU A 10 -12.935 -6.021 -0.498 1.00 0.00 C ATOM 55 C GLU A 10 -13.757 -7.267 -0.903 1.00 0.00 C ATOM 56 O GLU A 10 -13.229 -8.358 -1.125 1.00 0.00 O ATOM 57 CB GLU A 10 -11.562 -6.347 0.111 1.00 0.00 C ATOM 58 CG GLU A 10 -11.555 -7.164 1.409 1.00 0.00 C ATOM 59 CD GLU A 10 -10.143 -7.388 1.956 1.00 0.00 C ATOM 60 OE1 GLU A 10 -9.353 -6.419 1.962 1.00 0.00 O ATOM 61 OE2 GLU A 10 -9.901 -8.515 2.441 1.00 0.00 O ATOM 0 H GLU A 10 -13.620 -4.068 -0.177 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.712 -5.539 -1.450 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -10.980 -6.889 -0.634 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.042 -5.407 0.299 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.154 -6.650 2.161 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.028 -8.129 1.229 1.00 0.00 H new ATOM 68 N MET A 11 -15.003 -6.980 -1.231 1.00 0.00 N ATOM 69 CA MET A 11 -16.024 -7.981 -1.618 1.00 0.00 C ATOM 70 C MET A 11 -16.446 -7.976 -3.103 1.00 0.00 C ATOM 71 O MET A 11 -17.091 -8.916 -3.560 1.00 0.00 O ATOM 72 CB MET A 11 -17.241 -7.900 -0.685 1.00 0.00 C ATOM 73 CG MET A 11 -17.768 -6.487 -0.383 1.00 0.00 C ATOM 74 SD MET A 11 -18.346 -5.561 -1.849 1.00 0.00 S ATOM 75 CE MET A 11 -18.510 -3.938 -1.132 1.00 0.00 C ATOM 0 H MET A 11 -15.359 -6.024 -1.241 1.00 0.00 H new ATOM 0 HA MET A 11 -15.528 -8.944 -1.496 1.00 0.00 H new ATOM 0 HB2 MET A 11 -18.051 -8.481 -1.126 1.00 0.00 H new ATOM 0 HB3 MET A 11 -16.982 -8.379 0.259 1.00 0.00 H new ATOM 0 HG2 MET A 11 -18.590 -6.564 0.329 1.00 0.00 H new ATOM 0 HG3 MET A 11 -16.978 -5.915 0.103 1.00 0.00 H new ATOM 0 HE1 MET A 11 -18.857 -3.238 -1.892 1.00 0.00 H new ATOM 0 HE2 MET A 11 -19.230 -3.972 -0.314 1.00 0.00 H new ATOM 0 HE3 MET A 11 -17.543 -3.609 -0.750 1.00 0.00 H new ATOM 85 N LEU A 12 -15.944 -7.004 -3.880 1.00 0.00 N ATOM 86 CA LEU A 12 -16.332 -6.838 -5.298 1.00 0.00 C ATOM 87 C LEU A 12 -15.546 -7.759 -6.256 1.00 0.00 C ATOM 88 O LEU A 12 -15.066 -7.346 -7.308 1.00 0.00 O ATOM 89 CB LEU A 12 -16.233 -5.360 -5.708 1.00 0.00 C ATOM 90 CG LEU A 12 -17.299 -4.453 -5.095 1.00 0.00 C ATOM 91 CD1 LEU A 12 -16.970 -2.995 -5.422 1.00 0.00 C ATOM 92 CD2 LEU A 12 -18.695 -4.783 -5.636 1.00 0.00 C ATOM 0 H LEU A 12 -15.266 -6.316 -3.553 1.00 0.00 H new ATOM 0 HA LEU A 12 -17.372 -7.153 -5.387 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -15.250 -4.984 -5.425 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -16.300 -5.293 -6.794 1.00 0.00 H new ATOM 0 HG LEU A 12 -17.301 -4.614 -4.017 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -17.728 -2.344 -4.986 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -15.994 -2.741 -5.010 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -16.953 -2.859 -6.503 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -19.429 -4.119 -5.179 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -18.707 -4.648 -6.718 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -18.943 -5.817 -5.397 1.00 0.00 H new ATOM 104 N ASP A 13 -15.669 -9.053 -5.965 1.00 0.00 N ATOM 105 CA ASP A 13 -14.971 -10.167 -6.655 1.00 0.00 C ATOM 106 C ASP A 13 -15.155 -10.218 -8.187 1.00 0.00 C ATOM 107 O ASP A 13 -14.263 -10.634 -8.912 1.00 0.00 O ATOM 108 CB ASP A 13 -15.325 -11.519 -6.011 1.00 0.00 C ATOM 109 CG ASP A 13 -16.779 -11.989 -6.163 1.00 0.00 C ATOM 110 OD1 ASP A 13 -17.684 -11.123 -6.224 1.00 0.00 O ATOM 111 OD2 ASP A 13 -16.957 -13.225 -6.238 1.00 0.00 O ATOM 0 H ASP A 13 -16.278 -9.380 -5.215 1.00 0.00 H new ATOM 0 HA ASP A 13 -13.911 -9.958 -6.514 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -14.673 -12.281 -6.438 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -15.094 -11.461 -4.947 1.00 0.00 H new ATOM 116 N ARG A 14 -16.340 -9.802 -8.640 1.00 0.00 N ATOM 117 CA ARG A 14 -16.688 -9.639 -10.072 1.00 0.00 C ATOM 118 C ARG A 14 -15.705 -8.629 -10.693 1.00 0.00 C ATOM 119 O ARG A 14 -15.564 -7.524 -10.174 1.00 0.00 O ATOM 120 CB ARG A 14 -18.112 -9.075 -10.114 1.00 0.00 C ATOM 121 CG ARG A 14 -18.824 -9.204 -11.455 1.00 0.00 C ATOM 122 CD ARG A 14 -19.297 -10.640 -11.706 1.00 0.00 C ATOM 123 NE ARG A 14 -20.483 -10.609 -12.567 1.00 0.00 N ATOM 124 CZ ARG A 14 -21.317 -11.622 -12.821 1.00 0.00 C ATOM 125 NH1 ARG A 14 -21.088 -12.854 -12.394 1.00 0.00 N ATOM 126 NH2 ARG A 14 -22.393 -11.417 -13.565 1.00 0.00 N ATOM 0 H ARG A 14 -17.109 -9.561 -8.015 1.00 0.00 H new ATOM 0 HA ARG A 14 -16.630 -10.578 -10.622 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -18.708 -9.581 -9.355 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -18.076 -8.021 -9.840 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -19.679 -8.529 -11.480 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -18.152 -8.896 -12.256 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -18.504 -11.220 -12.178 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -19.531 -11.130 -10.761 1.00 0.00 H new ATOM 0 HE ARG A 14 -20.694 -9.720 -13.020 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -20.250 -13.058 -11.850 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -21.750 -13.600 -12.609 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -22.583 -10.488 -13.942 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -23.032 -12.188 -13.761 1.00 0.00 H new ATOM 140 N LEU A 15 -14.936 -9.095 -11.681 1.00 0.00 N ATOM 141 CA LEU A 15 -13.849 -8.333 -12.353 1.00 0.00 C ATOM 142 C LEU A 15 -12.587 -8.029 -11.534 1.00 0.00 C ATOM 143 O LEU A 15 -11.525 -7.824 -12.128 1.00 0.00 O ATOM 144 CB LEU A 15 -14.395 -7.039 -12.984 1.00 0.00 C ATOM 145 CG LEU A 15 -14.584 -7.116 -14.493 1.00 0.00 C ATOM 146 CD1 LEU A 15 -15.598 -6.062 -14.930 1.00 0.00 C ATOM 147 CD2 LEU A 15 -13.247 -6.876 -15.202 1.00 0.00 C ATOM 0 H LEU A 15 -15.046 -10.038 -12.055 1.00 0.00 H new ATOM 0 HA LEU A 15 -13.501 -9.030 -13.115 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -15.351 -6.797 -12.521 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -13.713 -6.220 -12.755 1.00 0.00 H new ATOM 0 HG LEU A 15 -14.951 -8.107 -14.760 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -15.735 -6.115 -16.010 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -16.551 -6.246 -14.434 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -15.233 -5.071 -14.659 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.392 -6.933 -16.281 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -12.867 -5.889 -14.938 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -12.529 -7.635 -14.892 1.00 0.00 H new ATOM 159 N TYR A 16 -12.686 -8.057 -10.200 1.00 0.00 N ATOM 160 CA TYR A 16 -11.615 -7.747 -9.225 1.00 0.00 C ATOM 161 C TYR A 16 -10.195 -8.249 -9.566 1.00 0.00 C ATOM 162 O TYR A 16 -9.230 -7.502 -9.389 1.00 0.00 O ATOM 163 CB TYR A 16 -12.041 -8.317 -7.867 1.00 0.00 C ATOM 164 CG TYR A 16 -12.050 -7.346 -6.669 1.00 0.00 C ATOM 165 CD1 TYR A 16 -12.379 -5.988 -6.817 1.00 0.00 C ATOM 166 CD2 TYR A 16 -12.052 -7.919 -5.387 1.00 0.00 C ATOM 167 CE1 TYR A 16 -12.771 -5.233 -5.707 1.00 0.00 C ATOM 168 CE2 TYR A 16 -12.444 -7.164 -4.277 1.00 0.00 C ATOM 169 CZ TYR A 16 -12.825 -5.820 -4.437 1.00 0.00 C ATOM 170 OH TYR A 16 -13.476 -5.182 -3.426 1.00 0.00 O ATOM 0 H TYR A 16 -13.560 -8.309 -9.739 1.00 0.00 H new ATOM 0 HA TYR A 16 -11.517 -6.661 -9.233 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -13.043 -8.732 -7.974 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -11.377 -9.147 -7.625 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -12.329 -5.525 -7.792 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -11.749 -8.948 -5.258 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -13.033 -4.193 -5.830 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -12.454 -7.614 -3.295 1.00 0.00 H new ATOM 0 HH TYR A 16 -12.906 -4.469 -3.069 1.00 0.00 H new ATOM 180 N SER A 17 -10.101 -9.507 -9.999 1.00 0.00 N ATOM 181 CA SER A 17 -8.834 -10.176 -10.370 1.00 0.00 C ATOM 182 C SER A 17 -9.114 -11.573 -10.967 1.00 0.00 C ATOM 183 O SER A 17 -10.264 -11.953 -11.148 1.00 0.00 O ATOM 184 CB SER A 17 -7.912 -10.304 -9.142 1.00 0.00 C ATOM 185 OG SER A 17 -6.570 -10.538 -9.567 1.00 0.00 O ATOM 0 H SER A 17 -10.916 -10.110 -10.107 1.00 0.00 H new ATOM 0 HA SER A 17 -8.334 -9.566 -11.123 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.960 -9.394 -8.543 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.250 -11.122 -8.506 1.00 0.00 H new ATOM 0 HG SER A 17 -5.988 -10.617 -8.783 1.00 0.00 H new ATOM 191 N LYS A 18 -8.042 -12.339 -11.184 1.00 0.00 N ATOM 192 CA LYS A 18 -8.026 -13.710 -11.742 1.00 0.00 C ATOM 193 C LYS A 18 -8.588 -13.848 -13.167 1.00 0.00 C ATOM 194 O LYS A 18 -7.823 -13.867 -14.130 1.00 0.00 O ATOM 195 CB LYS A 18 -8.658 -14.736 -10.781 1.00 0.00 C ATOM 196 CG LYS A 18 -7.811 -14.960 -9.536 1.00 0.00 C ATOM 197 CD LYS A 18 -8.505 -15.951 -8.587 1.00 0.00 C ATOM 198 CE LYS A 18 -7.641 -16.299 -7.375 1.00 0.00 C ATOM 199 NZ LYS A 18 -6.456 -17.090 -7.742 1.00 0.00 N ATOM 0 H LYS A 18 -7.103 -12.007 -10.965 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.965 -13.940 -11.842 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -9.649 -14.392 -10.486 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -8.792 -15.684 -11.302 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.831 -15.344 -9.819 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.646 -14.011 -9.025 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -9.448 -15.524 -8.247 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -8.746 -16.864 -9.132 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -7.323 -15.380 -6.882 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.238 -16.857 -6.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -5.976 -17.416 -6.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -6.749 -17.912 -8.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -5.805 -16.501 -8.299 1.00 0.00 H new ATOM 213 N LEU A 19 -9.912 -13.880 -13.302 1.00 0.00 N ATOM 214 CA LEU A 19 -10.584 -14.115 -14.596 1.00 0.00 C ATOM 215 C LEU A 19 -10.438 -12.922 -15.556 1.00 0.00 C ATOM 216 O LEU A 19 -10.677 -11.783 -15.143 1.00 0.00 O ATOM 217 CB LEU A 19 -12.062 -14.524 -14.422 1.00 0.00 C ATOM 218 CG LEU A 19 -13.053 -13.436 -13.966 1.00 0.00 C ATOM 219 CD1 LEU A 19 -14.474 -13.914 -14.296 1.00 0.00 C ATOM 220 CD2 LEU A 19 -12.971 -13.143 -12.469 1.00 0.00 C ATOM 0 H LEU A 19 -10.557 -13.745 -12.523 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.070 -14.959 -15.056 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -12.415 -14.923 -15.373 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -12.102 -15.340 -13.700 1.00 0.00 H new ATOM 0 HG LEU A 19 -12.798 -12.515 -14.489 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -15.194 -13.159 -13.982 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -14.563 -14.076 -15.370 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -14.675 -14.848 -13.771 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.693 -12.369 -12.210 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -13.195 -14.050 -11.908 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -11.967 -12.801 -12.220 1.00 0.00 H new ATOM 232 N PRO A 20 -10.071 -13.164 -16.826 1.00 0.00 N ATOM 233 CA PRO A 20 -9.987 -12.112 -17.862 1.00 0.00 C ATOM 234 C PRO A 20 -11.389 -11.649 -18.342 1.00 0.00 C ATOM 235 O PRO A 20 -11.756 -11.767 -19.509 1.00 0.00 O ATOM 236 CB PRO A 20 -9.117 -12.723 -18.963 1.00 0.00 C ATOM 237 CG PRO A 20 -9.426 -14.215 -18.868 1.00 0.00 C ATOM 238 CD PRO A 20 -9.584 -14.451 -17.363 1.00 0.00 C ATOM 0 HA PRO A 20 -9.542 -11.189 -17.489 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -9.370 -12.322 -19.944 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -8.059 -12.520 -18.798 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.335 -14.472 -19.412 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -8.621 -14.819 -19.287 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.291 -15.256 -17.161 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.636 -14.737 -16.906 1.00 0.00 H new ATOM 246 N GLU A 21 -12.133 -11.089 -17.391 1.00 0.00 N ATOM 247 CA GLU A 21 -13.492 -10.540 -17.595 1.00 0.00 C ATOM 248 C GLU A 21 -13.499 -9.240 -18.438 1.00 0.00 C ATOM 249 O GLU A 21 -14.555 -8.804 -18.879 1.00 0.00 O ATOM 250 CB GLU A 21 -14.127 -10.363 -16.216 1.00 0.00 C ATOM 251 CG GLU A 21 -15.664 -10.307 -16.253 1.00 0.00 C ATOM 252 CD GLU A 21 -16.283 -10.156 -14.861 1.00 0.00 C ATOM 253 OE1 GLU A 21 -15.788 -10.794 -13.902 1.00 0.00 O ATOM 254 OE2 GLU A 21 -17.271 -9.397 -14.766 1.00 0.00 O ATOM 0 H GLU A 21 -11.808 -10.997 -16.428 1.00 0.00 H new ATOM 0 HA GLU A 21 -14.086 -11.236 -18.187 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.816 -11.186 -15.573 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -13.748 -9.446 -15.765 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -15.978 -9.471 -16.878 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -16.046 -11.215 -16.719 1.00 0.00 H new ATOM 261 N LYS A 22 -12.354 -8.549 -18.442 1.00 0.00 N ATOM 262 CA LYS A 22 -11.967 -7.438 -19.348 1.00 0.00 C ATOM 263 C LYS A 22 -12.708 -6.089 -19.271 1.00 0.00 C ATOM 264 O LYS A 22 -12.158 -5.075 -19.699 1.00 0.00 O ATOM 265 CB LYS A 22 -11.885 -7.918 -20.802 1.00 0.00 C ATOM 266 CG LYS A 22 -10.685 -8.844 -21.000 1.00 0.00 C ATOM 267 CD LYS A 22 -10.599 -9.369 -22.432 1.00 0.00 C ATOM 268 CE LYS A 22 -9.374 -10.270 -22.642 1.00 0.00 C ATOM 269 NZ LYS A 22 -8.108 -9.523 -22.540 1.00 0.00 N ATOM 0 H LYS A 22 -11.616 -8.758 -17.770 1.00 0.00 H new ATOM 0 HA LYS A 22 -10.991 -7.174 -18.939 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.803 -8.442 -21.069 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -11.802 -7.060 -21.469 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.768 -8.308 -20.755 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.757 -9.684 -20.309 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -11.505 -9.928 -22.668 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -10.553 -8.528 -23.124 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -9.382 -11.070 -21.901 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -9.437 -10.743 -23.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -7.318 -10.138 -22.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.142 -8.695 -23.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -7.969 -9.208 -21.559 1.00 0.00 H new ATOM 283 N GLY A 23 -13.957 -6.102 -18.817 1.00 0.00 N ATOM 284 CA GLY A 23 -14.772 -4.889 -18.577 1.00 0.00 C ATOM 285 C GLY A 23 -14.175 -3.938 -17.523 1.00 0.00 C ATOM 286 O GLY A 23 -13.088 -4.149 -16.983 1.00 0.00 O ATOM 0 H GLY A 23 -14.452 -6.966 -18.598 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.888 -4.349 -19.516 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.770 -5.190 -18.258 1.00 0.00 H new ATOM 290 N ARG A 24 -15.031 -3.028 -17.062 1.00 0.00 N ATOM 291 CA ARG A 24 -14.627 -1.944 -16.137 1.00 0.00 C ATOM 292 C ARG A 24 -14.787 -2.327 -14.662 1.00 0.00 C ATOM 293 O ARG A 24 -15.870 -2.682 -14.195 1.00 0.00 O ATOM 294 CB ARG A 24 -15.400 -0.661 -16.433 1.00 0.00 C ATOM 295 CG ARG A 24 -14.918 -0.009 -17.740 1.00 0.00 C ATOM 296 CD ARG A 24 -15.681 1.280 -18.052 1.00 0.00 C ATOM 297 NE ARG A 24 -17.065 0.994 -18.461 1.00 0.00 N ATOM 298 CZ ARG A 24 -18.018 1.881 -18.751 1.00 0.00 C ATOM 299 NH1 ARG A 24 -17.828 3.188 -18.631 1.00 0.00 N ATOM 300 NH2 ARG A 24 -19.214 1.465 -19.131 1.00 0.00 N ATOM 0 H ARG A 24 -16.020 -3.011 -17.311 1.00 0.00 H new ATOM 0 HA ARG A 24 -13.564 -1.774 -16.310 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -16.465 -0.884 -16.506 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.277 0.040 -15.607 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -13.853 0.209 -17.665 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -15.042 -0.712 -18.563 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -15.685 1.925 -17.173 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -15.170 1.825 -18.846 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.324 0.010 -18.530 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -16.929 3.545 -18.307 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -18.581 3.836 -18.862 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -19.408 0.466 -19.202 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -19.943 2.143 -19.353 1.00 0.00 H new ATOM 314 N LYS A 25 -13.651 -2.295 -13.968 1.00 0.00 N ATOM 315 CA LYS A 25 -13.561 -2.514 -12.516 1.00 0.00 C ATOM 316 C LYS A 25 -13.062 -1.246 -11.809 1.00 0.00 C ATOM 317 O LYS A 25 -12.166 -0.558 -12.292 1.00 0.00 O ATOM 318 CB LYS A 25 -12.605 -3.691 -12.243 1.00 0.00 C ATOM 319 CG LYS A 25 -12.434 -4.105 -10.775 1.00 0.00 C ATOM 320 CD LYS A 25 -13.669 -4.794 -10.166 1.00 0.00 C ATOM 321 CE LYS A 25 -14.657 -3.863 -9.460 1.00 0.00 C ATOM 322 NZ LYS A 25 -15.796 -4.643 -8.972 1.00 0.00 N ATOM 0 H LYS A 25 -12.747 -2.113 -14.403 1.00 0.00 H new ATOM 0 HA LYS A 25 -14.551 -2.750 -12.125 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -12.960 -4.556 -12.803 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.624 -3.434 -12.642 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.580 -4.778 -10.696 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.198 -3.220 -10.185 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -14.197 -5.323 -10.959 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.330 -5.545 -9.453 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.166 -3.356 -8.629 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.000 -3.089 -10.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -16.372 -4.055 -8.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -16.376 -4.952 -9.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -15.450 -5.476 -8.454 1.00 0.00 H new ATOM 336 N GLU A 26 -13.707 -0.960 -10.677 1.00 0.00 N ATOM 337 CA GLU A 26 -13.310 0.144 -9.773 1.00 0.00 C ATOM 338 C GLU A 26 -12.258 -0.235 -8.716 1.00 0.00 C ATOM 339 O GLU A 26 -11.385 0.570 -8.403 1.00 0.00 O ATOM 340 CB GLU A 26 -14.545 0.711 -9.065 1.00 0.00 C ATOM 341 CG GLU A 26 -15.488 1.446 -10.027 1.00 0.00 C ATOM 342 CD GLU A 26 -16.741 1.935 -9.298 1.00 0.00 C ATOM 343 OE1 GLU A 26 -17.687 1.117 -9.195 1.00 0.00 O ATOM 344 OE2 GLU A 26 -16.723 3.092 -8.846 1.00 0.00 O ATOM 0 H GLU A 26 -14.521 -1.482 -10.352 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.843 0.888 -10.418 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -15.087 -0.101 -8.580 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -14.227 1.396 -8.279 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -14.969 2.294 -10.474 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -15.773 0.781 -10.842 1.00 0.00 H new ATOM 351 N GLY A 27 -12.342 -1.475 -8.211 1.00 0.00 N ATOM 352 CA GLY A 27 -11.534 -1.961 -7.071 1.00 0.00 C ATOM 353 C GLY A 27 -11.813 -1.191 -5.765 1.00 0.00 C ATOM 354 O GLY A 27 -12.368 -0.092 -5.776 1.00 0.00 O ATOM 0 H GLY A 27 -12.978 -2.180 -8.583 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -11.738 -3.020 -6.913 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -10.476 -1.874 -7.319 1.00 0.00 H new ATOM 358 N THR A 28 -11.574 -1.868 -4.644 1.00 0.00 N ATOM 359 CA THR A 28 -11.683 -1.295 -3.283 1.00 0.00 C ATOM 360 C THR A 28 -11.359 -2.288 -2.164 1.00 0.00 C ATOM 361 O THR A 28 -11.870 -3.420 -2.133 1.00 0.00 O ATOM 362 CB THR A 28 -13.015 -0.579 -2.959 1.00 0.00 C ATOM 363 OG1 THR A 28 -12.945 -0.036 -1.635 1.00 0.00 O ATOM 364 CG2 THR A 28 -14.265 -1.473 -3.115 1.00 0.00 C ATOM 0 H THR A 28 -11.293 -2.849 -4.644 1.00 0.00 H new ATOM 0 HA THR A 28 -10.910 -0.527 -3.312 1.00 0.00 H new ATOM 0 HB THR A 28 -13.136 0.216 -3.695 1.00 0.00 H new ATOM 0 HG1 THR A 28 -13.786 0.421 -1.424 1.00 0.00 H new ATOM 0 HG21 THR A 28 -15.157 -0.897 -2.870 1.00 0.00 H new ATOM 0 HG22 THR A 28 -14.333 -1.827 -4.144 1.00 0.00 H new ATOM 0 HG23 THR A 28 -14.188 -2.327 -2.442 1.00 0.00 H new ATOM 372 N GLN A 29 -10.541 -1.779 -1.245 1.00 0.00 N ATOM 373 CA GLN A 29 -10.220 -2.423 0.047 1.00 0.00 C ATOM 374 C GLN A 29 -10.077 -1.394 1.186 1.00 0.00 C ATOM 375 O GLN A 29 -9.060 -1.310 1.864 1.00 0.00 O ATOM 376 CB GLN A 29 -9.069 -3.447 -0.045 1.00 0.00 C ATOM 377 CG GLN A 29 -7.746 -2.993 -0.675 1.00 0.00 C ATOM 378 CD GLN A 29 -7.797 -2.751 -2.193 1.00 0.00 C ATOM 379 OE1 GLN A 29 -8.576 -3.316 -2.950 1.00 0.00 O ATOM 380 NE2 GLN A 29 -6.964 -1.859 -2.666 1.00 0.00 N ATOM 0 H GLN A 29 -10.066 -0.885 -1.372 1.00 0.00 H new ATOM 0 HA GLN A 29 -11.082 -3.033 0.317 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.854 -3.799 0.964 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -9.431 -4.305 -0.611 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -7.425 -2.073 -0.186 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.985 -3.746 -0.468 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.313 -1.386 -2.039 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.966 -1.637 -3.662 1.00 0.00 H new ATOM 389 N SER A 30 -11.093 -0.524 1.267 1.00 0.00 N ATOM 390 CA SER A 30 -11.285 0.494 2.324 1.00 0.00 C ATOM 391 C SER A 30 -11.487 -0.131 3.723 1.00 0.00 C ATOM 392 O SER A 30 -12.583 -0.161 4.287 1.00 0.00 O ATOM 393 CB SER A 30 -12.496 1.374 1.986 1.00 0.00 C ATOM 394 OG SER A 30 -12.415 1.921 0.669 1.00 0.00 O ATOM 0 H SER A 30 -11.838 -0.505 0.571 1.00 0.00 H new ATOM 0 HA SER A 30 -10.374 1.092 2.358 1.00 0.00 H new ATOM 0 HB2 SER A 30 -13.408 0.784 2.077 1.00 0.00 H new ATOM 0 HB3 SER A 30 -12.567 2.185 2.711 1.00 0.00 H new ATOM 0 HG SER A 30 -11.871 2.736 0.686 1.00 0.00 H new ATOM 400 N LEU A 31 -10.410 -0.706 4.237 1.00 0.00 N ATOM 401 CA LEU A 31 -10.369 -1.382 5.544 1.00 0.00 C ATOM 402 C LEU A 31 -9.208 -0.908 6.424 1.00 0.00 C ATOM 403 O LEU A 31 -8.157 -0.554 5.876 1.00 0.00 O ATOM 404 CB LEU A 31 -10.296 -2.899 5.335 1.00 0.00 C ATOM 405 CG LEU A 31 -11.593 -3.505 4.802 1.00 0.00 C ATOM 406 CD1 LEU A 31 -11.364 -4.967 4.426 1.00 0.00 C ATOM 407 CD2 LEU A 31 -12.721 -3.429 5.849 1.00 0.00 C ATOM 0 H LEU A 31 -9.513 -0.721 3.752 1.00 0.00 H new ATOM 0 HA LEU A 31 -11.285 -1.122 6.074 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -9.487 -3.123 4.640 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.044 -3.376 6.282 1.00 0.00 H new ATOM 0 HG LEU A 31 -11.892 -2.931 3.925 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -12.292 -5.395 4.046 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.595 -5.029 3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -11.042 -5.523 5.306 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -13.630 -3.869 5.438 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -12.425 -3.978 6.743 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -12.907 -2.387 6.108 1.00 0.00 H new ATOM 419 N PRO A 32 -9.382 -0.885 7.756 1.00 0.00 N ATOM 420 CA PRO A 32 -8.292 -0.575 8.705 1.00 0.00 C ATOM 421 C PRO A 32 -7.175 -1.632 8.679 1.00 0.00 C ATOM 422 O PRO A 32 -7.271 -2.712 9.258 1.00 0.00 O ATOM 423 CB PRO A 32 -8.977 -0.434 10.066 1.00 0.00 C ATOM 424 CG PRO A 32 -10.242 -1.291 9.925 1.00 0.00 C ATOM 425 CD PRO A 32 -10.653 -1.080 8.473 1.00 0.00 C ATOM 0 HA PRO A 32 -7.768 0.344 8.442 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -8.339 -0.791 10.875 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -9.220 0.605 10.287 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -10.041 -2.341 10.137 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -11.023 -0.970 10.614 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -11.199 -1.940 8.086 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -11.306 -0.214 8.367 1.00 0.00 H new ATOM 433 N ASN A 33 -6.185 -1.316 7.848 1.00 0.00 N ATOM 434 CA ASN A 33 -5.019 -2.164 7.524 1.00 0.00 C ATOM 435 C ASN A 33 -3.980 -1.288 6.791 1.00 0.00 C ATOM 436 O ASN A 33 -4.059 -0.060 6.855 1.00 0.00 O ATOM 437 CB ASN A 33 -5.517 -3.308 6.618 1.00 0.00 C ATOM 438 CG ASN A 33 -4.607 -4.531 6.664 1.00 0.00 C ATOM 439 OD1 ASN A 33 -3.618 -4.650 5.945 1.00 0.00 O ATOM 440 ND2 ASN A 33 -4.882 -5.429 7.591 1.00 0.00 N ATOM 0 H ASN A 33 -6.164 -0.423 7.355 1.00 0.00 H new ATOM 0 HA ASN A 33 -4.555 -2.586 8.415 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -6.523 -3.596 6.923 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -5.586 -2.949 5.591 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -4.270 -6.235 7.718 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -5.707 -5.317 8.181 1.00 0.00 H new ATOM 447 N MET A 34 -2.983 -1.925 6.172 1.00 0.00 N ATOM 448 CA MET A 34 -1.973 -1.294 5.296 1.00 0.00 C ATOM 449 C MET A 34 -1.288 -0.035 5.855 1.00 0.00 C ATOM 450 O MET A 34 -1.683 1.102 5.612 1.00 0.00 O ATOM 451 CB MET A 34 -2.586 -1.043 3.907 1.00 0.00 C ATOM 452 CG MET A 34 -2.833 -2.348 3.143 1.00 0.00 C ATOM 453 SD MET A 34 -3.887 -2.128 1.662 1.00 0.00 S ATOM 454 CE MET A 34 -5.490 -2.248 2.414 1.00 0.00 C ATOM 0 H MET A 34 -2.845 -2.931 6.266 1.00 0.00 H new ATOM 0 HA MET A 34 -1.153 -2.009 5.227 1.00 0.00 H new ATOM 0 HB2 MET A 34 -3.527 -0.505 4.018 1.00 0.00 H new ATOM 0 HB3 MET A 34 -1.920 -0.404 3.327 1.00 0.00 H new ATOM 0 HG2 MET A 34 -1.875 -2.771 2.840 1.00 0.00 H new ATOM 0 HG3 MET A 34 -3.303 -3.070 3.811 1.00 0.00 H new ATOM 0 HE1 MET A 34 -6.168 -1.539 1.939 1.00 0.00 H new ATOM 0 HE2 MET A 34 -5.876 -3.260 2.288 1.00 0.00 H new ATOM 0 HE3 MET A 34 -5.411 -2.019 3.477 1.00 0.00 H new ATOM 464 N ILE A 35 -0.234 -0.298 6.626 1.00 0.00 N ATOM 465 CA ILE A 35 0.646 0.759 7.144 1.00 0.00 C ATOM 466 C ILE A 35 2.119 0.500 6.776 1.00 0.00 C ATOM 467 O ILE A 35 2.575 -0.650 6.771 1.00 0.00 O ATOM 468 CB ILE A 35 0.396 1.005 8.645 1.00 0.00 C ATOM 469 CG1 ILE A 35 1.103 2.291 9.105 1.00 0.00 C ATOM 470 CG2 ILE A 35 0.780 -0.215 9.511 1.00 0.00 C ATOM 471 CD1 ILE A 35 0.530 2.899 10.383 1.00 0.00 C ATOM 0 H ILE A 35 0.036 -1.240 6.910 1.00 0.00 H new ATOM 0 HA ILE A 35 0.394 1.698 6.651 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.676 1.144 8.785 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.160 2.075 9.261 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.044 3.030 8.306 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.586 0.008 10.560 1.00 0.00 H new ATOM 0 HG22 ILE A 35 0.187 -1.078 9.207 1.00 0.00 H new ATOM 0 HG23 ILE A 35 1.839 -0.437 9.377 1.00 0.00 H new ATOM 0 HD11 ILE A 35 1.085 3.802 10.637 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.519 3.150 10.228 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.614 2.180 11.198 1.00 0.00 H new ATOM 483 N ILE A 36 2.760 1.552 6.294 1.00 0.00 N ATOM 484 CA ILE A 36 4.225 1.565 6.031 1.00 0.00 C ATOM 485 C ILE A 36 4.986 1.382 7.362 1.00 0.00 C ATOM 486 O ILE A 36 4.827 2.177 8.285 1.00 0.00 O ATOM 487 CB ILE A 36 4.665 2.884 5.366 1.00 0.00 C ATOM 488 CG1 ILE A 36 3.785 3.268 4.170 1.00 0.00 C ATOM 489 CG2 ILE A 36 6.113 2.752 4.882 1.00 0.00 C ATOM 490 CD1 ILE A 36 3.718 4.778 3.904 1.00 0.00 C ATOM 0 H ILE A 36 2.296 2.432 6.067 1.00 0.00 H new ATOM 0 HA ILE A 36 4.456 0.747 5.349 1.00 0.00 H new ATOM 0 HB ILE A 36 4.568 3.667 6.118 1.00 0.00 H new ATOM 0 HG12 ILE A 36 4.164 2.769 3.278 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.775 2.894 4.340 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.426 3.684 4.411 1.00 0.00 H new ATOM 0 HG22 ILE A 36 6.762 2.538 5.731 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.182 1.939 4.159 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.077 4.968 3.043 1.00 0.00 H new ATOM 0 HD12 ILE A 36 3.310 5.284 4.779 1.00 0.00 H new ATOM 0 HD13 ILE A 36 4.720 5.156 3.701 1.00 0.00 H new ATOM 502 N LEU A 37 5.899 0.423 7.346 1.00 0.00 N ATOM 503 CA LEU A 37 6.811 0.137 8.475 1.00 0.00 C ATOM 504 C LEU A 37 8.196 0.701 8.081 1.00 0.00 C ATOM 505 O LEU A 37 8.659 0.489 6.965 1.00 0.00 O ATOM 506 CB LEU A 37 6.844 -1.376 8.682 1.00 0.00 C ATOM 507 CG LEU A 37 7.398 -1.857 10.027 1.00 0.00 C ATOM 508 CD1 LEU A 37 6.881 -3.273 10.293 1.00 0.00 C ATOM 509 CD2 LEU A 37 8.935 -1.900 10.055 1.00 0.00 C ATOM 0 H LEU A 37 6.040 -0.193 6.546 1.00 0.00 H new ATOM 0 HA LEU A 37 6.492 0.596 9.411 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.830 -1.760 8.571 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.442 -1.819 7.886 1.00 0.00 H new ATOM 0 HG LEU A 37 7.066 -1.149 10.787 1.00 0.00 H new ATOM 0 HD11 LEU A 37 7.268 -3.628 11.248 1.00 0.00 H new ATOM 0 HD12 LEU A 37 5.791 -3.263 10.324 1.00 0.00 H new ATOM 0 HD13 LEU A 37 7.215 -3.938 9.496 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.272 -2.248 11.032 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.294 -2.581 9.284 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.330 -0.901 9.870 1.00 0.00 H new ATOM 521 N ASN A 38 8.876 1.306 9.049 1.00 0.00 N ATOM 522 CA ASN A 38 10.096 2.084 8.755 1.00 0.00 C ATOM 523 C ASN A 38 11.363 1.499 9.379 1.00 0.00 C ATOM 524 O ASN A 38 11.434 1.250 10.578 1.00 0.00 O ATOM 525 CB ASN A 38 9.925 3.536 9.236 1.00 0.00 C ATOM 526 CG ASN A 38 8.676 4.227 8.698 1.00 0.00 C ATOM 527 OD1 ASN A 38 8.114 3.911 7.661 1.00 0.00 O ATOM 528 ND2 ASN A 38 8.200 5.204 9.447 1.00 0.00 N ATOM 0 H ASN A 38 8.616 1.280 10.035 1.00 0.00 H new ATOM 0 HA ASN A 38 10.224 2.044 7.673 1.00 0.00 H new ATOM 0 HB2 ASN A 38 9.891 3.545 10.325 1.00 0.00 H new ATOM 0 HB3 ASN A 38 10.802 4.111 8.939 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.357 5.701 9.161 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.676 5.462 10.312 1.00 0.00 H new ATOM 535 N ILE A 39 12.386 1.405 8.532 1.00 0.00 N ATOM 536 CA ILE A 39 13.751 1.006 8.915 1.00 0.00 C ATOM 537 C ILE A 39 14.652 2.217 8.610 1.00 0.00 C ATOM 538 O ILE A 39 15.259 2.336 7.540 1.00 0.00 O ATOM 539 CB ILE A 39 14.206 -0.251 8.138 1.00 0.00 C ATOM 540 CG1 ILE A 39 13.168 -1.385 8.205 1.00 0.00 C ATOM 541 CG2 ILE A 39 15.546 -0.750 8.702 1.00 0.00 C ATOM 542 CD1 ILE A 39 13.300 -2.397 7.066 1.00 0.00 C ATOM 0 H ILE A 39 12.293 1.607 7.537 1.00 0.00 H new ATOM 0 HA ILE A 39 13.803 0.738 9.970 1.00 0.00 H new ATOM 0 HB ILE A 39 14.317 0.034 7.092 1.00 0.00 H new ATOM 0 HG12 ILE A 39 13.270 -1.905 9.157 1.00 0.00 H new ATOM 0 HG13 ILE A 39 12.167 -0.953 8.184 1.00 0.00 H new ATOM 0 HG21 ILE A 39 15.865 -1.636 8.153 1.00 0.00 H new ATOM 0 HG22 ILE A 39 16.298 0.032 8.598 1.00 0.00 H new ATOM 0 HG23 ILE A 39 15.427 -1.000 9.756 1.00 0.00 H new ATOM 0 HD11 ILE A 39 12.538 -3.169 7.175 1.00 0.00 H new ATOM 0 HD12 ILE A 39 13.168 -1.889 6.111 1.00 0.00 H new ATOM 0 HD13 ILE A 39 14.288 -2.856 7.100 1.00 0.00 H new ATOM 554 N GLY A 40 14.557 3.192 9.514 1.00 0.00 N ATOM 555 CA GLY A 40 15.232 4.500 9.426 1.00 0.00 C ATOM 556 C GLY A 40 14.832 5.249 8.136 1.00 0.00 C ATOM 557 O GLY A 40 13.687 5.670 7.979 1.00 0.00 O ATOM 0 H GLY A 40 13.991 3.096 10.357 1.00 0.00 H new ATOM 0 HA2 GLY A 40 14.974 5.105 10.296 1.00 0.00 H new ATOM 0 HA3 GLY A 40 16.312 4.357 9.446 1.00 0.00 H new ATOM 561 N ASN A 41 15.781 5.278 7.203 1.00 0.00 N ATOM 562 CA ASN A 41 15.634 5.900 5.874 1.00 0.00 C ATOM 563 C ASN A 41 14.814 5.104 4.838 1.00 0.00 C ATOM 564 O ASN A 41 14.341 5.676 3.857 1.00 0.00 O ATOM 565 CB ASN A 41 17.022 6.217 5.296 1.00 0.00 C ATOM 566 CG ASN A 41 17.845 7.110 6.233 1.00 0.00 C ATOM 567 OD1 ASN A 41 18.551 6.653 7.103 1.00 0.00 O ATOM 568 ND2 ASN A 41 17.680 8.416 6.115 1.00 0.00 N ATOM 0 H ASN A 41 16.701 4.861 7.347 1.00 0.00 H new ATOM 0 HA ASN A 41 15.052 6.804 6.055 1.00 0.00 H new ATOM 0 HB2 ASN A 41 17.561 5.287 5.116 1.00 0.00 H new ATOM 0 HB3 ASN A 41 16.909 6.711 4.331 1.00 0.00 H new ATOM 0 HD21 ASN A 41 18.150 9.050 6.761 1.00 0.00 H new ATOM 0 HD22 ASN A 41 17.083 8.790 5.378 1.00 0.00 H new ATOM 575 N THR A 42 14.724 3.787 5.031 1.00 0.00 N ATOM 576 CA THR A 42 14.040 2.886 4.076 1.00 0.00 C ATOM 577 C THR A 42 12.740 2.312 4.664 1.00 0.00 C ATOM 578 O THR A 42 12.639 2.052 5.864 1.00 0.00 O ATOM 579 CB THR A 42 14.979 1.799 3.529 1.00 0.00 C ATOM 580 OG1 THR A 42 14.323 1.110 2.460 1.00 0.00 O ATOM 581 CG2 THR A 42 15.487 0.802 4.587 1.00 0.00 C ATOM 0 H THR A 42 15.116 3.310 5.843 1.00 0.00 H new ATOM 0 HA THR A 42 13.749 3.490 3.217 1.00 0.00 H new ATOM 0 HB THR A 42 15.873 2.309 3.171 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.917 0.416 2.105 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.142 0.071 4.113 1.00 0.00 H new ATOM 0 HG22 THR A 42 16.040 1.339 5.358 1.00 0.00 H new ATOM 0 HG23 THR A 42 14.639 0.289 5.040 1.00 0.00 H new ATOM 589 N THR A 43 11.758 2.132 3.790 1.00 0.00 N ATOM 590 CA THR A 43 10.362 1.822 4.182 1.00 0.00 C ATOM 591 C THR A 43 9.950 0.457 3.615 1.00 0.00 C ATOM 592 O THR A 43 10.273 0.118 2.478 1.00 0.00 O ATOM 593 CB THR A 43 9.364 2.918 3.733 1.00 0.00 C ATOM 594 OG1 THR A 43 8.846 2.707 2.418 1.00 0.00 O ATOM 595 CG2 THR A 43 9.955 4.334 3.791 1.00 0.00 C ATOM 0 H THR A 43 11.894 2.194 2.781 1.00 0.00 H new ATOM 0 HA THR A 43 10.328 1.790 5.271 1.00 0.00 H new ATOM 0 HB THR A 43 8.552 2.836 4.455 1.00 0.00 H new ATOM 0 HG1 THR A 43 9.588 2.632 1.782 1.00 0.00 H new ATOM 0 HG21 THR A 43 9.206 5.055 3.464 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.255 4.561 4.814 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.824 4.392 3.136 1.00 0.00 H new ATOM 603 N ILE A 44 9.263 -0.332 4.432 1.00 0.00 N ATOM 604 CA ILE A 44 8.788 -1.672 4.055 1.00 0.00 C ATOM 605 C ILE A 44 7.271 -1.843 4.254 1.00 0.00 C ATOM 606 O ILE A 44 6.674 -1.332 5.203 1.00 0.00 O ATOM 607 CB ILE A 44 9.643 -2.764 4.738 1.00 0.00 C ATOM 608 CG1 ILE A 44 9.352 -4.143 4.128 1.00 0.00 C ATOM 609 CG2 ILE A 44 9.471 -2.761 6.271 1.00 0.00 C ATOM 610 CD1 ILE A 44 10.424 -5.194 4.418 1.00 0.00 C ATOM 0 H ILE A 44 9.014 -0.064 5.384 1.00 0.00 H new ATOM 0 HA ILE A 44 8.930 -1.794 2.981 1.00 0.00 H new ATOM 0 HB ILE A 44 10.691 -2.531 4.548 1.00 0.00 H new ATOM 0 HG12 ILE A 44 8.395 -4.501 4.508 1.00 0.00 H new ATOM 0 HG13 ILE A 44 9.247 -4.036 3.048 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.090 -3.544 6.708 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.775 -1.793 6.669 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.426 -2.943 6.520 1.00 0.00 H new ATOM 0 HD11 ILE A 44 10.143 -6.139 3.952 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.380 -4.860 4.013 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.515 -5.333 5.495 1.00 0.00 H new ATOM 622 N ILE A 45 6.664 -2.453 3.231 1.00 0.00 N ATOM 623 CA ILE A 45 5.235 -2.815 3.207 1.00 0.00 C ATOM 624 C ILE A 45 5.078 -4.255 2.705 1.00 0.00 C ATOM 625 O ILE A 45 5.696 -4.652 1.712 1.00 0.00 O ATOM 626 CB ILE A 45 4.391 -1.876 2.305 1.00 0.00 C ATOM 627 CG1 ILE A 45 4.672 -0.378 2.488 1.00 0.00 C ATOM 628 CG2 ILE A 45 2.894 -2.107 2.568 1.00 0.00 C ATOM 629 CD1 ILE A 45 5.779 0.138 1.556 1.00 0.00 C ATOM 0 H ILE A 45 7.158 -2.716 2.378 1.00 0.00 H new ATOM 0 HA ILE A 45 4.866 -2.714 4.228 1.00 0.00 H new ATOM 0 HB ILE A 45 4.679 -2.134 1.286 1.00 0.00 H new ATOM 0 HG12 ILE A 45 3.757 0.184 2.303 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.958 -0.190 3.523 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.306 -1.445 1.932 1.00 0.00 H new ATOM 0 HG22 ILE A 45 2.641 -3.143 2.345 1.00 0.00 H new ATOM 0 HG23 ILE A 45 2.672 -1.897 3.614 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.934 1.203 1.730 1.00 0.00 H new ATOM 0 HD12 ILE A 45 6.705 -0.401 1.757 1.00 0.00 H new ATOM 0 HD13 ILE A 45 5.485 -0.021 0.519 1.00 0.00 H new ATOM 641 N ARG A 46 4.234 -5.018 3.412 1.00 0.00 N ATOM 642 CA ARG A 46 3.768 -6.337 2.939 1.00 0.00 C ATOM 643 C ARG A 46 2.669 -6.296 1.854 1.00 0.00 C ATOM 644 O ARG A 46 2.905 -6.726 0.730 1.00 0.00 O ATOM 645 CB ARG A 46 3.369 -7.265 4.098 1.00 0.00 C ATOM 646 CG ARG A 46 2.271 -6.718 5.027 1.00 0.00 C ATOM 647 CD ARG A 46 2.743 -6.571 6.475 1.00 0.00 C ATOM 648 NE ARG A 46 3.876 -5.623 6.593 1.00 0.00 N ATOM 649 CZ ARG A 46 3.851 -4.298 6.420 1.00 0.00 C ATOM 650 NH1 ARG A 46 2.730 -3.607 6.276 1.00 0.00 N ATOM 651 NH2 ARG A 46 4.980 -3.610 6.527 1.00 0.00 N ATOM 0 H ARG A 46 3.856 -4.746 4.319 1.00 0.00 H new ATOM 0 HA ARG A 46 4.642 -6.759 2.443 1.00 0.00 H new ATOM 0 HB2 ARG A 46 3.031 -8.214 3.682 1.00 0.00 H new ATOM 0 HB3 ARG A 46 4.256 -7.476 4.695 1.00 0.00 H new ATOM 0 HG2 ARG A 46 1.938 -5.748 4.657 1.00 0.00 H new ATOM 0 HG3 ARG A 46 1.409 -7.384 4.996 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.915 -6.226 7.094 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.043 -7.546 6.860 1.00 0.00 H new ATOM 0 HE ARG A 46 4.780 -6.029 6.834 1.00 0.00 H new ATOM 0 HH11 ARG A 46 1.830 -4.086 6.294 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.767 -2.596 6.147 1.00 0.00 H new ATOM 0 HH21 ARG A 46 5.853 -4.093 6.739 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.975 -2.598 6.397 1.00 0.00 H new ATOM 665 N ASN A 47 1.610 -5.537 2.113 1.00 0.00 N ATOM 666 CA ASN A 47 0.402 -5.496 1.256 1.00 0.00 C ATOM 667 C ASN A 47 0.443 -4.395 0.175 1.00 0.00 C ATOM 668 O ASN A 47 -0.580 -3.864 -0.260 1.00 0.00 O ATOM 669 CB ASN A 47 -0.844 -5.382 2.136 1.00 0.00 C ATOM 670 CG ASN A 47 -1.058 -6.576 3.079 1.00 0.00 C ATOM 671 OD1 ASN A 47 -0.451 -7.632 2.978 1.00 0.00 O ATOM 672 ND2 ASN A 47 -1.862 -6.399 4.100 1.00 0.00 N ATOM 0 H ASN A 47 1.552 -4.924 2.926 1.00 0.00 H new ATOM 0 HA ASN A 47 0.368 -6.432 0.698 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -0.773 -4.471 2.731 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -1.720 -5.277 1.495 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -1.973 -7.137 4.795 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -2.376 -5.523 4.199 1.00 0.00 H new ATOM 679 N PHE A 48 1.635 -4.248 -0.411 1.00 0.00 N ATOM 680 CA PHE A 48 1.993 -3.118 -1.291 1.00 0.00 C ATOM 681 C PHE A 48 1.108 -2.892 -2.522 1.00 0.00 C ATOM 682 O PHE A 48 0.617 -1.774 -2.696 1.00 0.00 O ATOM 683 CB PHE A 48 3.480 -3.166 -1.684 1.00 0.00 C ATOM 684 CG PHE A 48 3.929 -4.491 -2.307 1.00 0.00 C ATOM 685 CD1 PHE A 48 3.806 -4.721 -3.684 1.00 0.00 C ATOM 686 CD2 PHE A 48 4.460 -5.498 -1.483 1.00 0.00 C ATOM 687 CE1 PHE A 48 4.192 -5.946 -4.235 1.00 0.00 C ATOM 688 CE2 PHE A 48 4.834 -6.730 -2.031 1.00 0.00 C ATOM 689 CZ PHE A 48 4.707 -6.951 -3.408 1.00 0.00 C ATOM 0 H PHE A 48 2.394 -4.918 -0.289 1.00 0.00 H new ATOM 0 HA PHE A 48 1.796 -2.245 -0.669 1.00 0.00 H new ATOM 0 HB2 PHE A 48 3.683 -2.360 -2.389 1.00 0.00 H new ATOM 0 HB3 PHE A 48 4.084 -2.973 -0.797 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.410 -3.946 -4.324 1.00 0.00 H new ATOM 0 HD2 PHE A 48 4.580 -5.321 -0.424 1.00 0.00 H new ATOM 0 HE1 PHE A 48 4.093 -6.117 -5.297 1.00 0.00 H new ATOM 0 HE2 PHE A 48 5.221 -7.510 -1.392 1.00 0.00 H new ATOM 0 HZ PHE A 48 5.007 -7.898 -3.832 1.00 0.00 H new ATOM 699 N ALA A 49 0.750 -3.952 -3.241 1.00 0.00 N ATOM 700 CA ALA A 49 -0.129 -3.848 -4.440 1.00 0.00 C ATOM 701 C ALA A 49 -1.506 -3.221 -4.126 1.00 0.00 C ATOM 702 O ALA A 49 -1.866 -2.196 -4.693 1.00 0.00 O ATOM 703 CB ALA A 49 -0.294 -5.241 -5.064 1.00 0.00 C ATOM 0 H ALA A 49 1.048 -4.904 -3.027 1.00 0.00 H new ATOM 0 HA ALA A 49 0.353 -3.175 -5.149 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.936 -5.173 -5.942 1.00 0.00 H new ATOM 0 HB2 ALA A 49 0.682 -5.626 -5.358 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.746 -5.915 -4.336 1.00 0.00 H new ATOM 709 N GLU A 50 -2.128 -3.730 -3.059 1.00 0.00 N ATOM 710 CA GLU A 50 -3.416 -3.226 -2.540 1.00 0.00 C ATOM 711 C GLU A 50 -3.288 -1.779 -2.040 1.00 0.00 C ATOM 712 O GLU A 50 -4.087 -0.911 -2.379 1.00 0.00 O ATOM 713 CB GLU A 50 -3.946 -4.087 -1.374 1.00 0.00 C ATOM 714 CG GLU A 50 -4.012 -5.594 -1.638 1.00 0.00 C ATOM 715 CD GLU A 50 -2.754 -6.302 -1.100 1.00 0.00 C ATOM 716 OE1 GLU A 50 -1.720 -6.219 -1.792 1.00 0.00 O ATOM 717 OE2 GLU A 50 -2.840 -6.820 0.029 1.00 0.00 O ATOM 0 H GLU A 50 -1.753 -4.511 -2.521 1.00 0.00 H new ATOM 0 HA GLU A 50 -4.116 -3.275 -3.374 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -3.312 -3.917 -0.504 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.945 -3.738 -1.114 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.900 -6.012 -1.164 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -4.107 -5.776 -2.709 1.00 0.00 H new ATOM 724 N TYR A 51 -2.184 -1.527 -1.335 1.00 0.00 N ATOM 725 CA TYR A 51 -1.815 -0.219 -0.765 1.00 0.00 C ATOM 726 C TYR A 51 -1.542 0.865 -1.822 1.00 0.00 C ATOM 727 O TYR A 51 -1.953 2.017 -1.631 1.00 0.00 O ATOM 728 CB TYR A 51 -0.594 -0.457 0.126 1.00 0.00 C ATOM 729 CG TYR A 51 -0.285 0.641 1.147 1.00 0.00 C ATOM 730 CD1 TYR A 51 -1.287 1.399 1.769 1.00 0.00 C ATOM 731 CD2 TYR A 51 1.016 0.653 1.676 1.00 0.00 C ATOM 732 CE1 TYR A 51 -1.006 2.127 2.933 1.00 0.00 C ATOM 733 CE2 TYR A 51 1.289 1.353 2.849 1.00 0.00 C ATOM 734 CZ TYR A 51 0.286 2.099 3.479 1.00 0.00 C ATOM 735 OH TYR A 51 0.504 2.645 4.697 1.00 0.00 O ATOM 0 H TYR A 51 -1.494 -2.251 -1.135 1.00 0.00 H new ATOM 0 HA TYR A 51 -2.657 0.174 -0.194 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -0.738 -1.395 0.663 1.00 0.00 H new ATOM 0 HB3 TYR A 51 0.279 -0.587 -0.514 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -2.282 1.422 1.349 1.00 0.00 H new ATOM 0 HD2 TYR A 51 1.807 0.118 1.172 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -1.782 2.708 3.409 1.00 0.00 H new ATOM 0 HE2 TYR A 51 2.281 1.320 3.275 1.00 0.00 H new ATOM 0 HH TYR A 51 -0.351 2.762 5.161 1.00 0.00 H new ATOM 745 N CYS A 52 -0.924 0.485 -2.931 1.00 0.00 N ATOM 746 CA CYS A 52 -0.736 1.340 -4.122 1.00 0.00 C ATOM 747 C CYS A 52 -2.078 1.826 -4.692 1.00 0.00 C ATOM 748 O CYS A 52 -2.310 3.030 -4.801 1.00 0.00 O ATOM 749 CB CYS A 52 0.048 0.605 -5.209 1.00 0.00 C ATOM 750 SG CYS A 52 1.788 0.262 -4.751 1.00 0.00 S ATOM 0 H CYS A 52 -0.525 -0.447 -3.043 1.00 0.00 H new ATOM 0 HA CYS A 52 -0.165 2.210 -3.798 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -0.453 -0.337 -5.433 1.00 0.00 H new ATOM 0 HB3 CYS A 52 0.032 1.200 -6.122 1.00 0.00 H new ATOM 0 HG CYS A 52 1.820 -0.635 -3.811 1.00 0.00 H new ATOM 756 N ASP A 53 -3.014 0.892 -4.846 1.00 0.00 N ATOM 757 CA ASP A 53 -4.411 1.183 -5.226 1.00 0.00 C ATOM 758 C ASP A 53 -5.121 2.082 -4.194 1.00 0.00 C ATOM 759 O ASP A 53 -5.920 2.939 -4.561 1.00 0.00 O ATOM 760 CB ASP A 53 -5.123 -0.153 -5.438 1.00 0.00 C ATOM 761 CG ASP A 53 -6.541 -0.032 -6.002 1.00 0.00 C ATOM 762 OD1 ASP A 53 -6.655 0.230 -7.222 1.00 0.00 O ATOM 763 OD2 ASP A 53 -7.468 -0.334 -5.227 1.00 0.00 O ATOM 0 H ASP A 53 -2.830 -0.102 -4.711 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.434 1.757 -6.152 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -4.527 -0.765 -6.115 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.168 -0.682 -4.486 1.00 0.00 H new ATOM 768 N ARG A 54 -4.796 1.891 -2.907 1.00 0.00 N ATOM 769 CA ARG A 54 -5.295 2.715 -1.788 1.00 0.00 C ATOM 770 C ARG A 54 -4.819 4.173 -1.746 1.00 0.00 C ATOM 771 O ARG A 54 -5.591 5.053 -1.393 1.00 0.00 O ATOM 772 CB ARG A 54 -5.034 2.004 -0.446 1.00 0.00 C ATOM 773 CG ARG A 54 -5.846 0.711 -0.276 1.00 0.00 C ATOM 774 CD ARG A 54 -7.334 0.896 0.069 1.00 0.00 C ATOM 775 NE ARG A 54 -8.011 1.768 -0.903 1.00 0.00 N ATOM 776 CZ ARG A 54 -8.755 1.427 -1.949 1.00 0.00 C ATOM 777 NH1 ARG A 54 -8.805 0.211 -2.465 1.00 0.00 N ATOM 778 NH2 ARG A 54 -9.232 2.402 -2.702 1.00 0.00 N ATOM 0 H ARG A 54 -4.167 1.146 -2.605 1.00 0.00 H new ATOM 0 HA ARG A 54 -6.366 2.806 -1.972 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -3.972 1.771 -0.366 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -5.273 2.685 0.371 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -5.775 0.136 -1.199 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -5.382 0.113 0.509 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -7.826 -0.076 0.091 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -7.426 1.323 1.068 1.00 0.00 H new ATOM 0 HE ARG A 54 -7.893 2.770 -0.754 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -8.248 -0.539 -2.057 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -9.401 0.023 -3.271 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -9.024 3.373 -2.470 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -9.808 2.183 -3.515 1.00 0.00 H new ATOM 792 N ILE A 55 -3.532 4.399 -2.015 1.00 0.00 N ATOM 793 CA ILE A 55 -2.984 5.771 -2.206 1.00 0.00 C ATOM 794 C ILE A 55 -3.478 6.394 -3.523 1.00 0.00 C ATOM 795 O ILE A 55 -3.895 7.554 -3.540 1.00 0.00 O ATOM 796 CB ILE A 55 -1.444 5.810 -1.987 1.00 0.00 C ATOM 797 CG1 ILE A 55 -0.855 7.233 -1.878 1.00 0.00 C ATOM 798 CG2 ILE A 55 -0.655 4.901 -2.939 1.00 0.00 C ATOM 799 CD1 ILE A 55 -0.697 8.066 -3.156 1.00 0.00 C ATOM 0 H ILE A 55 -2.837 3.658 -2.108 1.00 0.00 H new ATOM 0 HA ILE A 55 -3.383 6.422 -1.428 1.00 0.00 H new ATOM 0 HB ILE A 55 -1.309 5.374 -0.997 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.484 7.799 -1.191 1.00 0.00 H new ATOM 0 HG13 ILE A 55 0.128 7.149 -1.415 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.410 4.985 -2.723 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -0.973 3.867 -2.802 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.841 5.204 -3.969 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.271 9.038 -2.907 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -0.036 7.547 -3.849 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -1.672 8.207 -3.622 1.00 0.00 H new ATOM 811 N ARG A 56 -3.446 5.610 -4.604 1.00 0.00 N ATOM 812 CA ARG A 56 -3.983 6.008 -5.919 1.00 0.00 C ATOM 813 C ARG A 56 -4.156 4.795 -6.837 1.00 0.00 C ATOM 814 O ARG A 56 -3.179 4.184 -7.289 1.00 0.00 O ATOM 815 CB ARG A 56 -3.096 7.051 -6.610 1.00 0.00 C ATOM 816 CG ARG A 56 -3.920 7.936 -7.556 1.00 0.00 C ATOM 817 CD ARG A 56 -4.463 9.210 -6.886 1.00 0.00 C ATOM 818 NE ARG A 56 -5.257 8.965 -5.669 1.00 0.00 N ATOM 819 CZ ARG A 56 -6.475 9.428 -5.392 1.00 0.00 C ATOM 820 NH1 ARG A 56 -7.073 10.372 -6.107 1.00 0.00 N ATOM 821 NH2 ARG A 56 -7.062 9.079 -4.258 1.00 0.00 N ATOM 0 H ARG A 56 -3.044 4.672 -4.597 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.958 6.457 -5.732 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -2.607 7.672 -5.859 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -2.308 6.549 -7.171 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -3.301 8.218 -8.408 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -4.756 7.356 -7.947 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -3.625 9.859 -6.634 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -5.079 9.750 -7.605 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.825 8.374 -4.958 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -6.598 10.779 -6.913 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -8.008 10.691 -5.851 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -6.582 8.460 -3.605 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -7.994 9.429 -4.038 1.00 0.00 H new ATOM 835 N ARG A 57 -5.412 4.466 -7.088 1.00 0.00 N ATOM 836 CA ARG A 57 -5.830 3.457 -8.093 1.00 0.00 C ATOM 837 C ARG A 57 -5.090 3.602 -9.439 1.00 0.00 C ATOM 838 O ARG A 57 -4.679 2.606 -10.039 1.00 0.00 O ATOM 839 CB ARG A 57 -7.341 3.582 -8.345 1.00 0.00 C ATOM 840 CG ARG A 57 -8.189 3.119 -7.153 1.00 0.00 C ATOM 841 CD ARG A 57 -9.678 3.348 -7.464 1.00 0.00 C ATOM 842 NE ARG A 57 -10.530 2.701 -6.451 1.00 0.00 N ATOM 843 CZ ARG A 57 -10.806 3.127 -5.219 1.00 0.00 C ATOM 844 NH1 ARG A 57 -10.375 4.281 -4.740 1.00 0.00 N ATOM 845 NH2 ARG A 57 -11.594 2.389 -4.443 1.00 0.00 N ATOM 0 H ARG A 57 -6.199 4.892 -6.598 1.00 0.00 H new ATOM 0 HA ARG A 57 -5.576 2.480 -7.682 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.581 4.621 -8.573 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.607 2.994 -9.223 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.007 2.063 -6.951 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.905 3.669 -6.256 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.888 4.417 -7.493 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.913 2.950 -8.451 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.961 1.819 -6.727 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -9.802 4.893 -5.322 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -10.615 4.560 -3.789 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.977 1.511 -4.793 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.815 2.701 -3.497 1.00 0.00 H new ATOM 859 N GLU A 58 -4.858 4.845 -9.841 1.00 0.00 N ATOM 860 CA GLU A 58 -4.023 5.188 -11.011 1.00 0.00 C ATOM 861 C GLU A 58 -2.541 4.987 -10.657 1.00 0.00 C ATOM 862 O GLU A 58 -1.824 5.909 -10.248 1.00 0.00 O ATOM 863 CB GLU A 58 -4.345 6.631 -11.430 1.00 0.00 C ATOM 864 CG GLU A 58 -4.315 6.825 -12.953 1.00 0.00 C ATOM 865 CD GLU A 58 -2.983 6.486 -13.631 1.00 0.00 C ATOM 866 OE1 GLU A 58 -1.930 6.738 -13.017 1.00 0.00 O ATOM 867 OE2 GLU A 58 -3.039 5.905 -14.740 1.00 0.00 O ATOM 0 H GLU A 58 -5.244 5.661 -9.366 1.00 0.00 H new ATOM 0 HA GLU A 58 -4.237 4.537 -11.858 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.330 6.904 -11.052 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -3.627 7.308 -10.967 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -5.097 6.208 -13.397 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -4.563 7.863 -13.175 1.00 0.00 H new ATOM 874 N ASP A 59 -2.110 3.743 -10.834 1.00 0.00 N ATOM 875 CA ASP A 59 -0.750 3.277 -10.490 1.00 0.00 C ATOM 876 C ASP A 59 0.426 4.081 -11.093 1.00 0.00 C ATOM 877 O ASP A 59 1.432 4.215 -10.416 1.00 0.00 O ATOM 878 CB ASP A 59 -0.622 1.783 -10.803 1.00 0.00 C ATOM 879 CG ASP A 59 0.674 1.171 -10.233 1.00 0.00 C ATOM 880 OD1 ASP A 59 0.622 0.725 -9.070 1.00 0.00 O ATOM 881 OD2 ASP A 59 1.663 1.144 -10.991 1.00 0.00 O ATOM 0 H ASP A 59 -2.698 3.008 -11.227 1.00 0.00 H new ATOM 0 HA ASP A 59 -0.651 3.459 -9.420 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -1.482 1.254 -10.392 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -0.645 1.638 -11.883 1.00 0.00 H new ATOM 886 N LYS A 60 0.281 4.620 -12.304 1.00 0.00 N ATOM 887 CA LYS A 60 1.300 5.502 -12.926 1.00 0.00 C ATOM 888 C LYS A 60 1.622 6.714 -12.027 1.00 0.00 C ATOM 889 O LYS A 60 2.781 6.932 -11.668 1.00 0.00 O ATOM 890 CB LYS A 60 0.808 5.960 -14.302 1.00 0.00 C ATOM 891 CG LYS A 60 1.806 6.827 -15.063 1.00 0.00 C ATOM 892 CD LYS A 60 1.163 7.570 -16.244 1.00 0.00 C ATOM 893 CE LYS A 60 0.793 6.663 -17.427 1.00 0.00 C ATOM 894 NZ LYS A 60 1.984 6.175 -18.144 1.00 0.00 N ATOM 0 H LYS A 60 -0.540 4.465 -12.889 1.00 0.00 H new ATOM 0 HA LYS A 60 2.223 4.935 -13.045 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.574 5.081 -14.903 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.120 6.518 -14.177 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.247 7.552 -14.379 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.619 6.201 -15.431 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.264 8.078 -15.894 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.850 8.341 -16.592 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.215 5.813 -17.065 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.154 7.212 -18.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.688 5.595 -18.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.541 6.985 -18.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.565 5.600 -17.501 1.00 0.00 H new ATOM 908 N ILE A 61 0.572 7.364 -11.521 1.00 0.00 N ATOM 909 CA ILE A 61 0.667 8.502 -10.578 1.00 0.00 C ATOM 910 C ILE A 61 1.359 8.071 -9.268 1.00 0.00 C ATOM 911 O ILE A 61 2.340 8.679 -8.851 1.00 0.00 O ATOM 912 CB ILE A 61 -0.733 9.110 -10.346 1.00 0.00 C ATOM 913 CG1 ILE A 61 -1.446 9.540 -11.645 1.00 0.00 C ATOM 914 CG2 ILE A 61 -0.729 10.265 -9.330 1.00 0.00 C ATOM 915 CD1 ILE A 61 -0.676 10.501 -12.570 1.00 0.00 C ATOM 0 H ILE A 61 -0.390 7.117 -11.754 1.00 0.00 H new ATOM 0 HA ILE A 61 1.291 9.283 -11.011 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.310 8.290 -9.918 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.689 8.642 -12.213 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.391 10.012 -11.375 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -1.742 10.649 -9.212 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.363 9.903 -8.369 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.078 11.063 -9.689 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.283 10.727 -13.447 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.456 11.424 -12.034 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.257 10.033 -12.885 1.00 0.00 H new ATOM 927 N CYS A 62 0.912 6.935 -8.724 1.00 0.00 N ATOM 928 CA CYS A 62 1.529 6.292 -7.535 1.00 0.00 C ATOM 929 C CYS A 62 3.031 6.016 -7.721 1.00 0.00 C ATOM 930 O CYS A 62 3.843 6.425 -6.891 1.00 0.00 O ATOM 931 CB CYS A 62 0.754 5.011 -7.229 1.00 0.00 C ATOM 932 SG CYS A 62 1.406 4.069 -5.797 1.00 0.00 S ATOM 0 H CYS A 62 0.108 6.424 -9.090 1.00 0.00 H new ATOM 0 HA CYS A 62 1.466 6.978 -6.690 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -0.289 5.266 -7.039 1.00 0.00 H new ATOM 0 HB3 CYS A 62 0.770 4.370 -8.110 1.00 0.00 H new ATOM 0 HG CYS A 62 1.564 2.823 -6.133 1.00 0.00 H new ATOM 938 N MET A 63 3.388 5.436 -8.875 1.00 0.00 N ATOM 939 CA MET A 63 4.777 5.148 -9.292 1.00 0.00 C ATOM 940 C MET A 63 5.630 6.424 -9.382 1.00 0.00 C ATOM 941 O MET A 63 6.665 6.529 -8.723 1.00 0.00 O ATOM 942 CB MET A 63 4.723 4.412 -10.639 1.00 0.00 C ATOM 943 CG MET A 63 6.077 3.823 -11.051 1.00 0.00 C ATOM 944 SD MET A 63 6.022 2.966 -12.674 1.00 0.00 S ATOM 945 CE MET A 63 5.030 1.546 -12.279 1.00 0.00 C ATOM 0 H MET A 63 2.700 5.143 -9.569 1.00 0.00 H new ATOM 0 HA MET A 63 5.259 4.522 -8.542 1.00 0.00 H new ATOM 0 HB2 MET A 63 3.986 3.611 -10.580 1.00 0.00 H new ATOM 0 HB3 MET A 63 4.382 5.102 -11.411 1.00 0.00 H new ATOM 0 HG2 MET A 63 6.817 4.622 -11.093 1.00 0.00 H new ATOM 0 HG3 MET A 63 6.409 3.121 -10.286 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.069 0.834 -13.104 1.00 0.00 H new ATOM 0 HE2 MET A 63 5.414 1.075 -11.374 1.00 0.00 H new ATOM 0 HE3 MET A 63 3.998 1.857 -12.117 1.00 0.00 H new ATOM 955 N LYS A 64 5.090 7.442 -10.061 1.00 0.00 N ATOM 956 CA LYS A 64 5.727 8.776 -10.151 1.00 0.00 C ATOM 957 C LYS A 64 5.979 9.398 -8.762 1.00 0.00 C ATOM 958 O LYS A 64 7.104 9.781 -8.462 1.00 0.00 O ATOM 959 CB LYS A 64 4.885 9.726 -11.010 1.00 0.00 C ATOM 960 CG LYS A 64 4.929 9.340 -12.490 1.00 0.00 C ATOM 961 CD LYS A 64 4.138 10.338 -13.339 1.00 0.00 C ATOM 962 CE LYS A 64 4.258 10.002 -14.828 1.00 0.00 C ATOM 963 NZ LYS A 64 3.542 10.992 -15.646 1.00 0.00 N ATOM 0 H LYS A 64 4.205 7.373 -10.563 1.00 0.00 H new ATOM 0 HA LYS A 64 6.697 8.631 -10.627 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.852 9.713 -10.661 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.250 10.746 -10.889 1.00 0.00 H new ATOM 0 HG2 LYS A 64 5.964 9.307 -12.831 1.00 0.00 H new ATOM 0 HG3 LYS A 64 4.518 8.339 -12.621 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.089 10.324 -13.042 1.00 0.00 H new ATOM 0 HD3 LYS A 64 4.507 11.348 -13.159 1.00 0.00 H new ATOM 0 HE2 LYS A 64 5.309 9.977 -15.116 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.853 9.008 -15.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.636 10.745 -16.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 2.536 10.997 -15.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.947 11.936 -15.482 1.00 0.00 H new ATOM 977 N TYR A 65 4.983 9.280 -7.889 1.00 0.00 N ATOM 978 CA TYR A 65 5.060 9.733 -6.484 1.00 0.00 C ATOM 979 C TYR A 65 6.137 9.018 -5.655 1.00 0.00 C ATOM 980 O TYR A 65 7.028 9.674 -5.115 1.00 0.00 O ATOM 981 CB TYR A 65 3.674 9.585 -5.856 1.00 0.00 C ATOM 982 CG TYR A 65 3.167 10.804 -5.075 1.00 0.00 C ATOM 983 CD1 TYR A 65 3.550 12.110 -5.413 1.00 0.00 C ATOM 984 CD2 TYR A 65 2.099 10.614 -4.186 1.00 0.00 C ATOM 985 CE1 TYR A 65 2.848 13.209 -4.902 1.00 0.00 C ATOM 986 CE2 TYR A 65 1.386 11.719 -3.680 1.00 0.00 C ATOM 987 CZ TYR A 65 1.756 13.020 -4.051 1.00 0.00 C ATOM 988 OH TYR A 65 1.031 14.079 -3.642 1.00 0.00 O ATOM 0 H TYR A 65 4.084 8.863 -8.130 1.00 0.00 H new ATOM 0 HA TYR A 65 5.370 10.778 -6.484 1.00 0.00 H new ATOM 0 HB2 TYR A 65 2.959 9.359 -6.647 1.00 0.00 H new ATOM 0 HB3 TYR A 65 3.689 8.726 -5.185 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.391 12.269 -6.071 1.00 0.00 H new ATOM 0 HD2 TYR A 65 1.821 9.614 -3.887 1.00 0.00 H new ATOM 0 HE1 TYR A 65 3.153 14.210 -5.168 1.00 0.00 H new ATOM 0 HE2 TYR A 65 0.555 11.564 -3.007 1.00 0.00 H new ATOM 0 HH TYR A 65 0.307 13.773 -3.056 1.00 0.00 H new ATOM 998 N LEU A 66 6.128 7.676 -5.691 1.00 0.00 N ATOM 999 CA LEU A 66 7.140 6.844 -5.004 1.00 0.00 C ATOM 1000 C LEU A 66 8.582 6.993 -5.513 1.00 0.00 C ATOM 1001 O LEU A 66 9.532 6.559 -4.866 1.00 0.00 O ATOM 1002 CB LEU A 66 6.699 5.372 -4.871 1.00 0.00 C ATOM 1003 CG LEU A 66 6.401 4.597 -6.159 1.00 0.00 C ATOM 1004 CD1 LEU A 66 7.670 4.045 -6.816 1.00 0.00 C ATOM 1005 CD2 LEU A 66 5.415 3.467 -5.864 1.00 0.00 C ATOM 0 H LEU A 66 5.424 7.135 -6.194 1.00 0.00 H new ATOM 0 HA LEU A 66 7.185 7.262 -3.998 1.00 0.00 H new ATOM 0 HB2 LEU A 66 7.479 4.836 -4.330 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.804 5.345 -4.249 1.00 0.00 H new ATOM 0 HG LEU A 66 5.957 5.295 -6.869 1.00 0.00 H new ATOM 0 HD11 LEU A 66 7.404 3.505 -7.724 1.00 0.00 H new ATOM 0 HD12 LEU A 66 8.338 4.869 -7.067 1.00 0.00 H new ATOM 0 HD13 LEU A 66 8.172 3.368 -6.125 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.205 2.918 -6.782 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.847 2.790 -5.127 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.488 3.886 -5.472 1.00 0.00 H new ATOM 1017 N LEU A 67 8.711 7.427 -6.769 1.00 0.00 N ATOM 1018 CA LEU A 67 9.998 7.881 -7.334 1.00 0.00 C ATOM 1019 C LEU A 67 10.352 9.273 -6.779 1.00 0.00 C ATOM 1020 O LEU A 67 11.176 9.393 -5.875 1.00 0.00 O ATOM 1021 CB LEU A 67 9.900 7.852 -8.868 1.00 0.00 C ATOM 1022 CG LEU A 67 11.207 7.686 -9.656 1.00 0.00 C ATOM 1023 CD1 LEU A 67 12.191 8.848 -9.477 1.00 0.00 C ATOM 1024 CD2 LEU A 67 11.879 6.339 -9.347 1.00 0.00 C ATOM 0 H LEU A 67 7.933 7.476 -7.427 1.00 0.00 H new ATOM 0 HA LEU A 67 10.810 7.216 -7.041 1.00 0.00 H new ATOM 0 HB2 LEU A 67 9.232 7.037 -9.148 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.426 8.778 -9.193 1.00 0.00 H new ATOM 0 HG LEU A 67 10.919 7.699 -10.707 1.00 0.00 H new ATOM 0 HD11 LEU A 67 13.089 8.658 -10.064 1.00 0.00 H new ATOM 0 HD12 LEU A 67 11.726 9.774 -9.815 1.00 0.00 H new ATOM 0 HD13 LEU A 67 12.458 8.939 -8.424 1.00 0.00 H new ATOM 0 HD21 LEU A 67 12.802 6.253 -9.921 1.00 0.00 H new ATOM 0 HD22 LEU A 67 12.107 6.282 -8.283 1.00 0.00 H new ATOM 0 HD23 LEU A 67 11.206 5.526 -9.618 1.00 0.00 H new ATOM 1036 N LYS A 68 9.543 10.272 -7.150 1.00 0.00 N ATOM 1037 CA LYS A 68 9.766 11.714 -6.912 1.00 0.00 C ATOM 1038 C LYS A 68 9.999 12.097 -5.438 1.00 0.00 C ATOM 1039 O LYS A 68 10.818 12.965 -5.146 1.00 0.00 O ATOM 1040 CB LYS A 68 8.555 12.460 -7.481 1.00 0.00 C ATOM 1041 CG LYS A 68 8.777 13.967 -7.648 1.00 0.00 C ATOM 1042 CD LYS A 68 7.517 14.620 -8.218 1.00 0.00 C ATOM 1043 CE LYS A 68 7.712 16.119 -8.502 1.00 0.00 C ATOM 1044 NZ LYS A 68 7.947 16.898 -7.275 1.00 0.00 N ATOM 0 H LYS A 68 8.671 10.095 -7.649 1.00 0.00 H new ATOM 0 HA LYS A 68 10.694 11.996 -7.410 1.00 0.00 H new ATOM 0 HB2 LYS A 68 8.298 12.031 -8.450 1.00 0.00 H new ATOM 0 HB3 LYS A 68 7.700 12.299 -6.824 1.00 0.00 H new ATOM 0 HG2 LYS A 68 9.026 14.415 -6.686 1.00 0.00 H new ATOM 0 HG3 LYS A 68 9.622 14.147 -8.312 1.00 0.00 H new ATOM 0 HD2 LYS A 68 7.233 14.112 -9.140 1.00 0.00 H new ATOM 0 HD3 LYS A 68 6.694 14.490 -7.515 1.00 0.00 H new ATOM 0 HE2 LYS A 68 8.556 16.251 -9.180 1.00 0.00 H new ATOM 0 HE3 LYS A 68 6.830 16.507 -9.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 8.038 17.906 -7.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 7.147 16.769 -6.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 8.822 16.571 -6.818 1.00 0.00 H new ATOM 1058 N GLU A 69 9.261 11.457 -4.525 1.00 0.00 N ATOM 1059 CA GLU A 69 9.350 11.733 -3.078 1.00 0.00 C ATOM 1060 C GLU A 69 10.448 10.944 -2.336 1.00 0.00 C ATOM 1061 O GLU A 69 10.654 11.135 -1.130 1.00 0.00 O ATOM 1062 CB GLU A 69 7.946 11.477 -2.500 1.00 0.00 C ATOM 1063 CG GLU A 69 7.704 11.989 -1.069 1.00 0.00 C ATOM 1064 CD GLU A 69 7.782 13.509 -0.951 1.00 0.00 C ATOM 1065 OE1 GLU A 69 6.738 14.145 -1.215 1.00 0.00 O ATOM 1066 OE2 GLU A 69 8.864 14.002 -0.576 1.00 0.00 O ATOM 0 H GLU A 69 8.584 10.732 -4.763 1.00 0.00 H new ATOM 0 HA GLU A 69 9.661 12.767 -2.930 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.213 11.941 -3.160 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.757 10.404 -2.518 1.00 0.00 H new ATOM 0 HG2 GLU A 69 6.723 11.655 -0.732 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.440 11.541 -0.401 1.00 0.00 H new ATOM 1073 N LEU A 70 11.155 10.047 -3.015 1.00 0.00 N ATOM 1074 CA LEU A 70 12.106 9.140 -2.343 1.00 0.00 C ATOM 1075 C LEU A 70 13.565 9.261 -2.803 1.00 0.00 C ATOM 1076 O LEU A 70 13.877 9.267 -3.980 1.00 0.00 O ATOM 1077 CB LEU A 70 11.614 7.684 -2.381 1.00 0.00 C ATOM 1078 CG LEU A 70 10.464 7.459 -1.382 1.00 0.00 C ATOM 1079 CD1 LEU A 70 9.107 7.805 -1.988 1.00 0.00 C ATOM 1080 CD2 LEU A 70 10.469 6.028 -0.857 1.00 0.00 C ATOM 0 H LEU A 70 11.095 9.921 -4.025 1.00 0.00 H new ATOM 0 HA LEU A 70 12.124 9.477 -1.307 1.00 0.00 H new ATOM 0 HB2 LEU A 70 11.278 7.437 -3.388 1.00 0.00 H new ATOM 0 HB3 LEU A 70 12.440 7.012 -2.147 1.00 0.00 H new ATOM 0 HG LEU A 70 10.630 8.135 -0.544 1.00 0.00 H new ATOM 0 HD11 LEU A 70 8.324 7.632 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 70 9.099 8.853 -2.287 1.00 0.00 H new ATOM 0 HD13 LEU A 70 8.928 7.177 -2.861 1.00 0.00 H new ATOM 0 HD21 LEU A 70 9.647 5.896 -0.153 1.00 0.00 H new ATOM 0 HD22 LEU A 70 10.349 5.335 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.414 5.829 -0.352 1.00 0.00 H new ATOM 1092 N ALA A 71 14.422 9.189 -1.789 1.00 0.00 N ATOM 1093 CA ALA A 71 15.885 9.407 -1.894 1.00 0.00 C ATOM 1094 C ALA A 71 16.627 8.416 -2.805 1.00 0.00 C ATOM 1095 O ALA A 71 17.653 8.760 -3.384 1.00 0.00 O ATOM 1096 CB ALA A 71 16.485 9.374 -0.483 1.00 0.00 C ATOM 0 H ALA A 71 14.122 8.972 -0.839 1.00 0.00 H new ATOM 0 HA ALA A 71 16.020 10.378 -2.370 1.00 0.00 H new ATOM 0 HB1 ALA A 71 17.562 9.533 -0.542 1.00 0.00 H new ATOM 0 HB2 ALA A 71 16.035 10.161 0.122 1.00 0.00 H new ATOM 0 HB3 ALA A 71 16.286 8.405 -0.025 1.00 0.00 H new ATOM 1102 N ALA A 72 16.136 7.175 -2.839 1.00 0.00 N ATOM 1103 CA ALA A 72 16.680 6.126 -3.719 1.00 0.00 C ATOM 1104 C ALA A 72 15.624 5.691 -4.742 1.00 0.00 C ATOM 1105 O ALA A 72 14.485 5.379 -4.367 1.00 0.00 O ATOM 1106 CB ALA A 72 17.175 4.953 -2.868 1.00 0.00 C ATOM 0 H ALA A 72 15.354 6.865 -2.262 1.00 0.00 H new ATOM 0 HA ALA A 72 17.529 6.516 -4.280 1.00 0.00 H new ATOM 0 HB1 ALA A 72 17.578 4.176 -3.518 1.00 0.00 H new ATOM 0 HB2 ALA A 72 17.955 5.299 -2.190 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.345 4.548 -2.289 1.00 0.00 H new ATOM 1112 N PRO A 73 15.978 5.725 -6.043 1.00 0.00 N ATOM 1113 CA PRO A 73 15.035 5.476 -7.151 1.00 0.00 C ATOM 1114 C PRO A 73 14.463 4.047 -7.191 1.00 0.00 C ATOM 1115 O PRO A 73 15.204 3.087 -7.384 1.00 0.00 O ATOM 1116 CB PRO A 73 15.809 5.849 -8.419 1.00 0.00 C ATOM 1117 CG PRO A 73 17.260 5.563 -8.042 1.00 0.00 C ATOM 1118 CD PRO A 73 17.331 5.975 -6.569 1.00 0.00 C ATOM 0 HA PRO A 73 14.134 6.078 -7.031 1.00 0.00 H new ATOM 0 HB2 PRO A 73 15.491 5.253 -9.274 1.00 0.00 H new ATOM 0 HB3 PRO A 73 15.662 6.895 -8.687 1.00 0.00 H new ATOM 0 HG2 PRO A 73 17.511 4.511 -8.178 1.00 0.00 H new ATOM 0 HG3 PRO A 73 17.955 6.138 -8.654 1.00 0.00 H new ATOM 0 HD2 PRO A 73 18.079 5.392 -6.031 1.00 0.00 H new ATOM 0 HD3 PRO A 73 17.609 7.024 -6.464 1.00 0.00 H new ATOM 1126 N GLY A 74 13.234 3.952 -6.694 1.00 0.00 N ATOM 1127 CA GLY A 74 12.351 2.775 -6.854 1.00 0.00 C ATOM 1128 C GLY A 74 12.900 1.432 -6.336 1.00 0.00 C ATOM 1129 O GLY A 74 12.852 0.430 -7.055 1.00 0.00 O ATOM 0 H GLY A 74 12.803 4.703 -6.154 1.00 0.00 H new ATOM 0 HA2 GLY A 74 11.411 2.981 -6.341 1.00 0.00 H new ATOM 0 HA3 GLY A 74 12.119 2.664 -7.913 1.00 0.00 H new ATOM 1133 N ASN A 75 13.367 1.418 -5.096 1.00 0.00 N ATOM 1134 CA ASN A 75 13.864 0.187 -4.422 1.00 0.00 C ATOM 1135 C ASN A 75 12.732 -0.850 -4.328 1.00 0.00 C ATOM 1136 O ASN A 75 11.596 -0.529 -3.979 1.00 0.00 O ATOM 1137 CB ASN A 75 14.376 0.492 -3.016 1.00 0.00 C ATOM 1138 CG ASN A 75 15.239 1.752 -2.899 1.00 0.00 C ATOM 1139 OD1 ASN A 75 14.735 2.861 -2.791 1.00 0.00 O ATOM 1140 ND2 ASN A 75 16.544 1.591 -2.918 1.00 0.00 N ATOM 0 H ASN A 75 13.420 2.253 -4.512 1.00 0.00 H new ATOM 0 HA ASN A 75 14.688 -0.208 -5.016 1.00 0.00 H new ATOM 0 HB2 ASN A 75 13.520 0.593 -2.348 1.00 0.00 H new ATOM 0 HB3 ASN A 75 14.956 -0.361 -2.664 1.00 0.00 H new ATOM 0 HD21 ASN A 75 17.159 2.401 -2.842 1.00 0.00 H new ATOM 0 HD22 ASN A 75 16.941 0.656 -3.009 1.00 0.00 H new ATOM 1147 N VAL A 76 13.099 -2.112 -4.585 1.00 0.00 N ATOM 1148 CA VAL A 76 12.120 -3.203 -4.760 1.00 0.00 C ATOM 1149 C VAL A 76 12.596 -4.552 -4.179 1.00 0.00 C ATOM 1150 O VAL A 76 13.788 -4.783 -3.973 1.00 0.00 O ATOM 1151 CB VAL A 76 11.757 -3.269 -6.260 1.00 0.00 C ATOM 1152 CG1 VAL A 76 12.888 -3.778 -7.167 1.00 0.00 C ATOM 1153 CG2 VAL A 76 10.441 -4.012 -6.511 1.00 0.00 C ATOM 0 H VAL A 76 14.071 -2.408 -4.677 1.00 0.00 H new ATOM 0 HA VAL A 76 11.223 -2.987 -4.180 1.00 0.00 H new ATOM 0 HB VAL A 76 11.606 -2.230 -6.551 1.00 0.00 H new ATOM 0 HG11 VAL A 76 12.546 -3.792 -8.202 1.00 0.00 H new ATOM 0 HG12 VAL A 76 13.751 -3.117 -7.079 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.171 -4.786 -6.865 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.232 -4.030 -7.581 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.523 -5.034 -6.140 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.630 -3.502 -5.991 1.00 0.00 H new ATOM 1163 N ASP A 77 11.603 -5.363 -3.809 1.00 0.00 N ATOM 1164 CA ASP A 77 11.724 -6.805 -3.462 1.00 0.00 C ATOM 1165 C ASP A 77 12.647 -7.189 -2.289 1.00 0.00 C ATOM 1166 O ASP A 77 13.736 -7.735 -2.454 1.00 0.00 O ATOM 1167 CB ASP A 77 12.019 -7.624 -4.739 1.00 0.00 C ATOM 1168 CG ASP A 77 12.030 -9.138 -4.520 1.00 0.00 C ATOM 1169 OD1 ASP A 77 11.273 -9.617 -3.646 1.00 0.00 O ATOM 1170 OD2 ASP A 77 12.795 -9.810 -5.255 1.00 0.00 O ATOM 0 H ASP A 77 10.642 -5.029 -3.736 1.00 0.00 H new ATOM 0 HA ASP A 77 10.749 -7.066 -3.051 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.271 -7.382 -5.494 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.986 -7.318 -5.139 1.00 0.00 H new ATOM 1175 N ASP A 78 11.987 -7.249 -1.133 1.00 0.00 N ATOM 1176 CA ASP A 78 12.507 -7.866 0.094 1.00 0.00 C ATOM 1177 C ASP A 78 11.771 -9.208 0.231 1.00 0.00 C ATOM 1178 O ASP A 78 10.701 -9.283 0.842 1.00 0.00 O ATOM 1179 CB ASP A 78 12.201 -6.923 1.274 1.00 0.00 C ATOM 1180 CG ASP A 78 12.775 -7.416 2.601 1.00 0.00 C ATOM 1181 OD1 ASP A 78 13.946 -7.074 2.866 1.00 0.00 O ATOM 1182 OD2 ASP A 78 12.027 -8.096 3.324 1.00 0.00 O ATOM 0 H ASP A 78 11.051 -6.861 -1.017 1.00 0.00 H new ATOM 0 HA ASP A 78 13.584 -8.032 0.074 1.00 0.00 H new ATOM 0 HB2 ASP A 78 12.605 -5.935 1.055 1.00 0.00 H new ATOM 0 HB3 ASP A 78 11.121 -6.812 1.371 1.00 0.00 H new ATOM 1187 N LYS A 79 12.282 -10.167 -0.540 1.00 0.00 N ATOM 1188 CA LYS A 79 11.693 -11.503 -0.825 1.00 0.00 C ATOM 1189 C LYS A 79 10.154 -11.535 -0.699 1.00 0.00 C ATOM 1190 O LYS A 79 9.579 -11.939 0.312 1.00 0.00 O ATOM 1191 CB LYS A 79 12.390 -12.561 0.043 1.00 0.00 C ATOM 1192 CG LYS A 79 12.123 -13.979 -0.469 1.00 0.00 C ATOM 1193 CD LYS A 79 12.851 -15.031 0.372 1.00 0.00 C ATOM 1194 CE LYS A 79 12.606 -16.434 -0.195 1.00 0.00 C ATOM 1195 NZ LYS A 79 13.311 -17.462 0.591 1.00 0.00 N ATOM 0 H LYS A 79 13.173 -10.038 -1.019 1.00 0.00 H new ATOM 0 HA LYS A 79 11.876 -11.739 -1.873 1.00 0.00 H new ATOM 0 HB2 LYS A 79 13.464 -12.374 0.053 1.00 0.00 H new ATOM 0 HB3 LYS A 79 12.042 -12.474 1.072 1.00 0.00 H new ATOM 0 HG2 LYS A 79 11.051 -14.177 -0.451 1.00 0.00 H new ATOM 0 HG3 LYS A 79 12.444 -14.057 -1.508 1.00 0.00 H new ATOM 0 HD2 LYS A 79 13.920 -14.819 0.385 1.00 0.00 H new ATOM 0 HD3 LYS A 79 12.504 -14.984 1.404 1.00 0.00 H new ATOM 0 HE2 LYS A 79 11.537 -16.645 -0.198 1.00 0.00 H new ATOM 0 HE3 LYS A 79 12.941 -16.473 -1.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 13.125 -18.400 0.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 14.333 -17.273 0.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 12.973 -17.440 1.574 1.00 0.00 H new ATOM 1209 N GLY A 80 9.537 -10.913 -1.700 1.00 0.00 N ATOM 1210 CA GLY A 80 8.076 -10.682 -1.750 1.00 0.00 C ATOM 1211 C GLY A 80 7.745 -9.199 -1.501 1.00 0.00 C ATOM 1212 O GLY A 80 7.440 -8.464 -2.433 1.00 0.00 O ATOM 0 H GLY A 80 10.033 -10.547 -2.513 1.00 0.00 H new ATOM 0 HA2 GLY A 80 7.689 -10.987 -2.722 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.580 -11.300 -1.001 1.00 0.00 H new ATOM 1216 N GLU A 81 7.986 -8.778 -0.253 1.00 0.00 N ATOM 1217 CA GLU A 81 7.673 -7.422 0.243 1.00 0.00 C ATOM 1218 C GLU A 81 8.343 -6.273 -0.528 1.00 0.00 C ATOM 1219 O GLU A 81 9.414 -6.435 -1.116 1.00 0.00 O ATOM 1220 CB GLU A 81 8.044 -7.284 1.724 1.00 0.00 C ATOM 1221 CG GLU A 81 7.087 -8.026 2.652 1.00 0.00 C ATOM 1222 CD GLU A 81 7.358 -7.645 4.112 1.00 0.00 C ATOM 1223 OE1 GLU A 81 6.776 -6.628 4.555 1.00 0.00 O ATOM 1224 OE2 GLU A 81 8.131 -8.373 4.766 1.00 0.00 O ATOM 0 H GLU A 81 8.411 -9.376 0.456 1.00 0.00 H new ATOM 0 HA GLU A 81 6.599 -7.325 0.087 1.00 0.00 H new ATOM 0 HB2 GLU A 81 9.055 -7.663 1.876 1.00 0.00 H new ATOM 0 HB3 GLU A 81 8.055 -6.228 1.993 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.057 -7.784 2.391 1.00 0.00 H new ATOM 0 HG3 GLU A 81 7.205 -9.102 2.522 1.00 0.00 H new ATOM 1231 N LEU A 82 7.760 -5.082 -0.401 1.00 0.00 N ATOM 1232 CA LEU A 82 8.340 -3.864 -0.994 1.00 0.00 C ATOM 1233 C LEU A 82 9.095 -3.069 0.075 1.00 0.00 C ATOM 1234 O LEU A 82 8.552 -2.771 1.137 1.00 0.00 O ATOM 1235 CB LEU A 82 7.228 -2.998 -1.607 1.00 0.00 C ATOM 1236 CG LEU A 82 7.734 -1.723 -2.297 1.00 0.00 C ATOM 1237 CD1 LEU A 82 8.509 -2.036 -3.580 1.00 0.00 C ATOM 1238 CD2 LEU A 82 6.579 -0.772 -2.575 1.00 0.00 C ATOM 0 H LEU A 82 6.888 -4.928 0.105 1.00 0.00 H new ATOM 0 HA LEU A 82 9.039 -4.151 -1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 82 6.675 -3.595 -2.332 1.00 0.00 H new ATOM 0 HB3 LEU A 82 6.525 -2.719 -0.822 1.00 0.00 H new ATOM 0 HG LEU A 82 8.429 -1.234 -1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 82 8.849 -1.106 -4.036 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.371 -2.659 -3.342 1.00 0.00 H new ATOM 0 HD13 LEU A 82 7.860 -2.566 -4.277 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.957 0.126 -3.064 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.853 -1.261 -3.225 1.00 0.00 H new ATOM 0 HD23 LEU A 82 6.099 -0.499 -1.636 1.00 0.00 H new ATOM 1250 N VAL A 83 10.372 -2.847 -0.213 1.00 0.00 N ATOM 1251 CA VAL A 83 11.268 -2.000 0.605 1.00 0.00 C ATOM 1252 C VAL A 83 11.887 -0.905 -0.277 1.00 0.00 C ATOM 1253 O VAL A 83 12.568 -1.203 -1.257 1.00 0.00 O ATOM 1254 CB VAL A 83 12.291 -2.864 1.385 1.00 0.00 C ATOM 1255 CG1 VAL A 83 13.349 -3.559 0.513 1.00 0.00 C ATOM 1256 CG2 VAL A 83 12.932 -2.062 2.510 1.00 0.00 C ATOM 0 H VAL A 83 10.832 -3.250 -1.029 1.00 0.00 H new ATOM 0 HA VAL A 83 10.701 -1.483 1.378 1.00 0.00 H new ATOM 0 HB VAL A 83 11.711 -3.681 1.814 1.00 0.00 H new ATOM 0 HG11 VAL A 83 14.019 -4.139 1.147 1.00 0.00 H new ATOM 0 HG12 VAL A 83 12.856 -4.223 -0.197 1.00 0.00 H new ATOM 0 HG13 VAL A 83 13.923 -2.808 -0.030 1.00 0.00 H new ATOM 0 HG21 VAL A 83 13.646 -2.690 3.043 1.00 0.00 H new ATOM 0 HG22 VAL A 83 13.449 -1.198 2.092 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.160 -1.723 3.201 1.00 0.00 H new ATOM 1266 N ILE A 84 11.444 0.329 -0.026 1.00 0.00 N ATOM 1267 CA ILE A 84 11.819 1.530 -0.797 1.00 0.00 C ATOM 1268 C ILE A 84 12.334 2.660 0.114 1.00 0.00 C ATOM 1269 O ILE A 84 11.753 2.928 1.155 1.00 0.00 O ATOM 1270 CB ILE A 84 10.642 1.905 -1.724 1.00 0.00 C ATOM 1271 CG1 ILE A 84 11.074 2.957 -2.758 1.00 0.00 C ATOM 1272 CG2 ILE A 84 9.378 2.296 -0.938 1.00 0.00 C ATOM 1273 CD1 ILE A 84 10.092 3.151 -3.913 1.00 0.00 C ATOM 0 H ILE A 84 10.798 0.532 0.737 1.00 0.00 H new ATOM 0 HA ILE A 84 12.674 1.326 -1.441 1.00 0.00 H new ATOM 0 HB ILE A 84 10.358 1.015 -2.285 1.00 0.00 H new ATOM 0 HG12 ILE A 84 11.212 3.912 -2.250 1.00 0.00 H new ATOM 0 HG13 ILE A 84 12.043 2.670 -3.166 1.00 0.00 H new ATOM 0 HG21 ILE A 84 8.580 2.551 -1.636 1.00 0.00 H new ATOM 0 HG22 ILE A 84 9.063 1.458 -0.316 1.00 0.00 H new ATOM 0 HG23 ILE A 84 9.595 3.156 -0.305 1.00 0.00 H new ATOM 0 HD11 ILE A 84 10.476 3.911 -4.594 1.00 0.00 H new ATOM 0 HD12 ILE A 84 9.971 2.210 -4.450 1.00 0.00 H new ATOM 0 HD13 ILE A 84 9.127 3.471 -3.520 1.00 0.00 H new ATOM 1285 N GLN A 85 13.369 3.373 -0.339 1.00 0.00 N ATOM 1286 CA GLN A 85 14.103 4.327 0.519 1.00 0.00 C ATOM 1287 C GLN A 85 13.848 5.799 0.187 1.00 0.00 C ATOM 1288 O GLN A 85 14.158 6.273 -0.909 1.00 0.00 O ATOM 1289 CB GLN A 85 15.591 3.960 0.426 1.00 0.00 C ATOM 1290 CG GLN A 85 16.474 4.701 1.430 1.00 0.00 C ATOM 1291 CD GLN A 85 17.934 4.205 1.384 1.00 0.00 C ATOM 1292 OE1 GLN A 85 18.241 3.031 1.219 1.00 0.00 O ATOM 1293 NE2 GLN A 85 18.861 5.111 1.583 1.00 0.00 N ATOM 0 H GLN A 85 13.723 3.313 -1.294 1.00 0.00 H new ATOM 0 HA GLN A 85 13.738 4.235 1.542 1.00 0.00 H new ATOM 0 HB2 GLN A 85 15.701 2.887 0.582 1.00 0.00 H new ATOM 0 HB3 GLN A 85 15.946 4.173 -0.582 1.00 0.00 H new ATOM 0 HG2 GLN A 85 16.446 5.770 1.219 1.00 0.00 H new ATOM 0 HG3 GLN A 85 16.075 4.564 2.435 1.00 0.00 H new ATOM 0 HE21 GLN A 85 18.599 6.087 1.720 1.00 0.00 H new ATOM 0 HE22 GLN A 85 19.844 4.839 1.601 1.00 0.00 H new ATOM 1302 N GLY A 86 13.484 6.538 1.235 1.00 0.00 N ATOM 1303 CA GLY A 86 13.165 7.976 1.183 1.00 0.00 C ATOM 1304 C GLY A 86 11.919 8.362 2.001 1.00 0.00 C ATOM 1305 O GLY A 86 11.427 7.562 2.798 1.00 0.00 O ATOM 0 H GLY A 86 13.399 6.147 2.173 1.00 0.00 H new ATOM 0 HA2 GLY A 86 14.020 8.543 1.551 1.00 0.00 H new ATOM 0 HA3 GLY A 86 13.012 8.268 0.144 1.00 0.00 H new ATOM 1309 N LYS A 87 11.312 9.477 1.610 1.00 0.00 N ATOM 1310 CA LYS A 87 10.293 10.172 2.433 1.00 0.00 C ATOM 1311 C LYS A 87 8.999 9.430 2.817 1.00 0.00 C ATOM 1312 O LYS A 87 8.426 9.758 3.848 1.00 0.00 O ATOM 1313 CB LYS A 87 9.942 11.551 1.863 1.00 0.00 C ATOM 1314 CG LYS A 87 11.095 12.554 1.989 1.00 0.00 C ATOM 1315 CD LYS A 87 11.388 12.912 3.453 1.00 0.00 C ATOM 1316 CE LYS A 87 12.597 13.843 3.587 1.00 0.00 C ATOM 1317 NZ LYS A 87 12.346 15.162 2.995 1.00 0.00 N ATOM 0 H LYS A 87 11.502 9.934 0.718 1.00 0.00 H new ATOM 0 HA LYS A 87 10.827 10.243 3.381 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.669 11.447 0.813 1.00 0.00 H new ATOM 0 HB3 LYS A 87 9.067 11.942 2.382 1.00 0.00 H new ATOM 0 HG2 LYS A 87 11.991 12.135 1.532 1.00 0.00 H new ATOM 0 HG3 LYS A 87 10.849 13.461 1.436 1.00 0.00 H new ATOM 0 HD2 LYS A 87 10.512 13.390 3.891 1.00 0.00 H new ATOM 0 HD3 LYS A 87 11.569 11.999 4.020 1.00 0.00 H new ATOM 0 HE2 LYS A 87 12.848 13.961 4.641 1.00 0.00 H new ATOM 0 HE3 LYS A 87 13.461 13.387 3.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 13.156 15.786 3.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 12.215 15.062 1.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 11.488 15.573 3.415 1.00 0.00 H new ATOM 1331 N PHE A 88 8.610 8.413 2.059 1.00 0.00 N ATOM 1332 CA PHE A 88 7.401 7.596 2.345 1.00 0.00 C ATOM 1333 C PHE A 88 7.448 6.723 3.609 1.00 0.00 C ATOM 1334 O PHE A 88 6.692 5.754 3.734 1.00 0.00 O ATOM 1335 CB PHE A 88 7.060 6.752 1.104 1.00 0.00 C ATOM 1336 CG PHE A 88 6.331 7.449 -0.060 1.00 0.00 C ATOM 1337 CD1 PHE A 88 6.057 8.829 -0.082 1.00 0.00 C ATOM 1338 CD2 PHE A 88 5.863 6.642 -1.107 1.00 0.00 C ATOM 1339 CE1 PHE A 88 5.314 9.378 -1.137 1.00 0.00 C ATOM 1340 CE2 PHE A 88 5.115 7.189 -2.154 1.00 0.00 C ATOM 1341 CZ PHE A 88 4.836 8.565 -2.168 1.00 0.00 C ATOM 0 H PHE A 88 9.114 8.118 1.223 1.00 0.00 H new ATOM 0 HA PHE A 88 6.612 8.315 2.568 1.00 0.00 H new ATOM 0 HB2 PHE A 88 7.990 6.336 0.716 1.00 0.00 H new ATOM 0 HB3 PHE A 88 6.446 5.912 1.429 1.00 0.00 H new ATOM 0 HD1 PHE A 88 6.419 9.465 0.713 1.00 0.00 H new ATOM 0 HD2 PHE A 88 6.083 5.585 -1.105 1.00 0.00 H new ATOM 0 HE1 PHE A 88 5.109 10.438 -1.153 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.753 6.555 -2.950 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.255 8.993 -2.972 1.00 0.00 H new ATOM 1351 N SER A 89 8.198 7.160 4.607 1.00 0.00 N ATOM 1352 CA SER A 89 8.368 6.505 5.927 1.00 0.00 C ATOM 1353 C SER A 89 7.138 6.716 6.814 1.00 0.00 C ATOM 1354 O SER A 89 7.042 7.663 7.597 1.00 0.00 O ATOM 1355 CB SER A 89 9.649 7.040 6.596 1.00 0.00 C ATOM 1356 OG SER A 89 9.566 8.452 6.761 1.00 0.00 O ATOM 0 H SER A 89 8.738 8.022 4.532 1.00 0.00 H new ATOM 0 HA SER A 89 8.469 5.429 5.784 1.00 0.00 H new ATOM 0 HB2 SER A 89 9.789 6.561 7.565 1.00 0.00 H new ATOM 0 HB3 SER A 89 10.518 6.788 5.988 1.00 0.00 H new ATOM 0 HG SER A 89 8.703 8.684 7.162 1.00 0.00 H new ATOM 1362 N SER A 90 6.186 5.796 6.656 1.00 0.00 N ATOM 1363 CA SER A 90 4.807 5.869 7.209 1.00 0.00 C ATOM 1364 C SER A 90 4.096 7.208 6.885 1.00 0.00 C ATOM 1365 O SER A 90 3.128 7.600 7.531 1.00 0.00 O ATOM 1366 CB SER A 90 4.793 5.572 8.705 1.00 0.00 C ATOM 1367 OG SER A 90 3.803 4.576 8.973 1.00 0.00 O ATOM 0 H SER A 90 6.347 4.942 6.121 1.00 0.00 H new ATOM 0 HA SER A 90 4.231 5.091 6.707 1.00 0.00 H new ATOM 0 HB2 SER A 90 5.774 5.224 9.029 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.575 6.480 9.267 1.00 0.00 H new ATOM 0 HG SER A 90 4.174 3.688 8.789 1.00 0.00 H new ATOM 1373 N GLN A 91 4.456 7.745 5.720 1.00 0.00 N ATOM 1374 CA GLN A 91 4.076 9.103 5.272 1.00 0.00 C ATOM 1375 C GLN A 91 2.969 9.038 4.193 1.00 0.00 C ATOM 1376 O GLN A 91 2.053 8.245 4.346 1.00 0.00 O ATOM 1377 CB GLN A 91 5.371 9.813 4.853 1.00 0.00 C ATOM 1378 CG GLN A 91 5.219 11.330 4.709 1.00 0.00 C ATOM 1379 CD GLN A 91 6.396 11.929 3.934 1.00 0.00 C ATOM 1380 OE1 GLN A 91 6.525 11.776 2.724 1.00 0.00 O ATOM 1381 NE2 GLN A 91 7.311 12.556 4.636 1.00 0.00 N ATOM 0 H GLN A 91 5.031 7.246 5.041 1.00 0.00 H new ATOM 0 HA GLN A 91 3.619 9.694 6.065 1.00 0.00 H new ATOM 0 HB2 GLN A 91 6.146 9.602 5.590 1.00 0.00 H new ATOM 0 HB3 GLN A 91 5.712 9.399 3.904 1.00 0.00 H new ATOM 0 HG2 GLN A 91 4.286 11.558 4.194 1.00 0.00 H new ATOM 0 HG3 GLN A 91 5.158 11.788 5.696 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.189 12.675 5.642 1.00 0.00 H new ATOM 0 HE22 GLN A 91 8.144 12.924 4.176 1.00 0.00 H new ATOM 1390 N VAL A 92 3.188 9.639 3.015 1.00 0.00 N ATOM 1391 CA VAL A 92 2.148 9.932 1.995 1.00 0.00 C ATOM 1392 C VAL A 92 1.181 8.776 1.670 1.00 0.00 C ATOM 1393 O VAL A 92 -0.032 9.006 1.683 1.00 0.00 O ATOM 1394 CB VAL A 92 2.813 10.530 0.730 1.00 0.00 C ATOM 1395 CG1 VAL A 92 1.796 10.873 -0.368 1.00 0.00 C ATOM 1396 CG2 VAL A 92 3.585 11.811 1.056 1.00 0.00 C ATOM 0 H VAL A 92 4.117 9.947 2.729 1.00 0.00 H new ATOM 0 HA VAL A 92 1.486 10.672 2.445 1.00 0.00 H new ATOM 0 HB VAL A 92 3.488 9.755 0.368 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.318 11.288 -1.230 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.264 9.970 -0.666 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.083 11.605 0.012 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.039 12.204 0.146 1.00 0.00 H new ATOM 0 HG22 VAL A 92 2.902 12.552 1.470 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.365 11.590 1.784 1.00 0.00 H new ATOM 1406 N ILE A 93 1.683 7.560 1.436 1.00 0.00 N ATOM 1407 CA ILE A 93 0.824 6.377 1.178 1.00 0.00 C ATOM 1408 C ILE A 93 -0.188 6.180 2.331 1.00 0.00 C ATOM 1409 O ILE A 93 -1.390 6.338 2.130 1.00 0.00 O ATOM 1410 CB ILE A 93 1.622 5.077 0.946 1.00 0.00 C ATOM 1411 CG1 ILE A 93 2.772 5.269 -0.052 1.00 0.00 C ATOM 1412 CG2 ILE A 93 0.671 3.995 0.413 1.00 0.00 C ATOM 1413 CD1 ILE A 93 3.794 4.116 -0.036 1.00 0.00 C ATOM 0 H ILE A 93 2.683 7.358 1.418 1.00 0.00 H new ATOM 0 HA ILE A 93 0.291 6.586 0.250 1.00 0.00 H new ATOM 0 HB ILE A 93 2.058 4.781 1.900 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.360 5.365 -1.056 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.286 6.204 0.172 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.227 3.072 0.246 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.120 3.815 1.141 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.231 4.328 -0.527 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.580 4.316 -0.765 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.234 4.033 0.958 1.00 0.00 H new ATOM 0 HD13 ILE A 93 3.293 3.182 -0.290 1.00 0.00 H new ATOM 1425 N ASN A 94 0.352 6.081 3.547 1.00 0.00 N ATOM 1426 CA ASN A 94 -0.410 5.974 4.809 1.00 0.00 C ATOM 1427 C ASN A 94 -1.314 7.197 5.036 1.00 0.00 C ATOM 1428 O ASN A 94 -2.513 7.033 5.221 1.00 0.00 O ATOM 1429 CB ASN A 94 0.601 5.817 5.958 1.00 0.00 C ATOM 1430 CG ASN A 94 -0.021 5.663 7.348 1.00 0.00 C ATOM 1431 OD1 ASN A 94 -1.109 5.138 7.543 1.00 0.00 O ATOM 1432 ND2 ASN A 94 0.698 6.129 8.350 1.00 0.00 N ATOM 0 H ASN A 94 1.361 6.072 3.694 1.00 0.00 H new ATOM 0 HA ASN A 94 -1.071 5.109 4.763 1.00 0.00 H new ATOM 0 HB2 ASN A 94 1.225 4.946 5.757 1.00 0.00 H new ATOM 0 HB3 ASN A 94 1.259 6.686 5.965 1.00 0.00 H new ATOM 0 HD21 ASN A 94 0.349 6.055 9.306 1.00 0.00 H new ATOM 0 HD22 ASN A 94 1.603 6.564 8.170 1.00 0.00 H new ATOM 1439 N THR A 95 -0.784 8.395 4.783 1.00 0.00 N ATOM 1440 CA THR A 95 -1.522 9.675 4.898 1.00 0.00 C ATOM 1441 C THR A 95 -2.797 9.683 4.026 1.00 0.00 C ATOM 1442 O THR A 95 -3.893 9.858 4.553 1.00 0.00 O ATOM 1443 CB THR A 95 -0.608 10.861 4.556 1.00 0.00 C ATOM 1444 OG1 THR A 95 0.602 10.759 5.307 1.00 0.00 O ATOM 1445 CG2 THR A 95 -1.262 12.221 4.847 1.00 0.00 C ATOM 0 H THR A 95 0.185 8.516 4.487 1.00 0.00 H new ATOM 0 HA THR A 95 -1.843 9.778 5.935 1.00 0.00 H new ATOM 0 HB THR A 95 -0.410 10.814 3.485 1.00 0.00 H new ATOM 0 HG1 THR A 95 1.187 11.514 5.089 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.569 13.021 4.586 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.172 12.321 4.255 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.509 12.287 5.907 1.00 0.00 H new ATOM 1453 N LEU A 96 -2.630 9.395 2.729 1.00 0.00 N ATOM 1454 CA LEU A 96 -3.771 9.340 1.792 1.00 0.00 C ATOM 1455 C LEU A 96 -4.728 8.179 2.105 1.00 0.00 C ATOM 1456 O LEU A 96 -5.920 8.404 2.215 1.00 0.00 O ATOM 1457 CB LEU A 96 -3.264 9.303 0.337 1.00 0.00 C ATOM 1458 CG LEU A 96 -4.264 9.953 -0.640 1.00 0.00 C ATOM 1459 CD1 LEU A 96 -3.508 10.416 -1.887 1.00 0.00 C ATOM 1460 CD2 LEU A 96 -5.378 8.996 -1.055 1.00 0.00 C ATOM 0 H LEU A 96 -1.725 9.197 2.302 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.357 10.250 1.922 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.307 9.820 0.273 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.088 8.269 0.041 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.730 10.795 -0.128 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -4.206 10.878 -2.585 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.746 11.142 -1.602 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -3.032 9.559 -2.363 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.055 9.502 -1.743 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -4.945 8.125 -1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.931 8.676 -0.172 1.00 0.00 H new ATOM 1472 N MET A 97 -4.163 7.012 2.440 1.00 0.00 N ATOM 1473 CA MET A 97 -4.912 5.835 2.946 1.00 0.00 C ATOM 1474 C MET A 97 -5.830 6.215 4.130 1.00 0.00 C ATOM 1475 O MET A 97 -7.034 5.981 4.068 1.00 0.00 O ATOM 1476 CB MET A 97 -3.889 4.765 3.347 1.00 0.00 C ATOM 1477 CG MET A 97 -4.435 3.535 4.078 1.00 0.00 C ATOM 1478 SD MET A 97 -5.591 2.518 3.090 1.00 0.00 S ATOM 1479 CE MET A 97 -5.782 1.147 4.216 1.00 0.00 C ATOM 0 H MET A 97 -3.159 6.848 2.369 1.00 0.00 H new ATOM 0 HA MET A 97 -5.568 5.447 2.167 1.00 0.00 H new ATOM 0 HB2 MET A 97 -3.378 4.427 2.445 1.00 0.00 H new ATOM 0 HB3 MET A 97 -3.137 5.233 3.982 1.00 0.00 H new ATOM 0 HG2 MET A 97 -3.597 2.911 4.389 1.00 0.00 H new ATOM 0 HG3 MET A 97 -4.943 3.863 4.985 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.995 0.239 3.651 1.00 0.00 H new ATOM 0 HE2 MET A 97 -4.862 1.013 4.786 1.00 0.00 H new ATOM 0 HE3 MET A 97 -6.606 1.350 4.900 1.00 0.00 H new ATOM 1489 N GLU A 98 -5.258 6.932 5.098 1.00 0.00 N ATOM 1490 CA GLU A 98 -5.965 7.501 6.258 1.00 0.00 C ATOM 1491 C GLU A 98 -7.093 8.451 5.824 1.00 0.00 C ATOM 1492 O GLU A 98 -8.254 8.092 6.011 1.00 0.00 O ATOM 1493 CB GLU A 98 -4.989 8.237 7.182 1.00 0.00 C ATOM 1494 CG GLU A 98 -4.028 7.278 7.890 1.00 0.00 C ATOM 1495 CD GLU A 98 -2.926 8.055 8.624 1.00 0.00 C ATOM 1496 OE1 GLU A 98 -1.926 8.412 7.949 1.00 0.00 O ATOM 1497 OE2 GLU A 98 -3.129 8.329 9.821 1.00 0.00 O ATOM 0 H GLU A 98 -4.260 7.142 5.101 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.412 6.670 6.803 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -4.416 8.960 6.601 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.551 8.801 7.927 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.579 6.662 8.600 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.580 6.602 7.162 1.00 0.00 H new ATOM 1504 N ARG A 99 -6.775 9.476 5.041 1.00 0.00 N ATOM 1505 CA ARG A 99 -7.752 10.463 4.529 1.00 0.00 C ATOM 1506 C ARG A 99 -8.925 9.820 3.751 1.00 0.00 C ATOM 1507 O ARG A 99 -10.088 10.084 4.064 1.00 0.00 O ATOM 1508 CB ARG A 99 -7.064 11.503 3.643 1.00 0.00 C ATOM 1509 CG ARG A 99 -6.133 12.415 4.445 1.00 0.00 C ATOM 1510 CD ARG A 99 -5.579 13.522 3.553 1.00 0.00 C ATOM 1511 NE ARG A 99 -4.786 14.499 4.320 1.00 0.00 N ATOM 1512 CZ ARG A 99 -5.237 15.415 5.196 1.00 0.00 C ATOM 1513 NH1 ARG A 99 -6.496 15.444 5.622 1.00 0.00 N ATOM 1514 NH2 ARG A 99 -4.386 16.240 5.772 1.00 0.00 N ATOM 0 H ARG A 99 -5.820 9.658 4.733 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.174 10.945 5.411 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -6.493 10.996 2.865 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -7.819 12.108 3.141 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -6.675 12.852 5.284 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -5.313 11.831 4.864 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -4.958 13.083 2.772 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -6.403 14.034 3.055 1.00 0.00 H new ATOM 0 HE ARG A 99 -3.777 14.478 4.169 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -7.165 14.752 5.284 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -6.793 16.158 6.287 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -3.392 16.182 5.553 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -4.722 16.937 6.437 1.00 0.00 H new ATOM 1528 N PHE A 100 -8.584 8.880 2.874 1.00 0.00 N ATOM 1529 CA PHE A 100 -9.527 8.063 2.098 1.00 0.00 C ATOM 1530 C PHE A 100 -10.456 7.224 2.997 1.00 0.00 C ATOM 1531 O PHE A 100 -11.666 7.402 2.969 1.00 0.00 O ATOM 1532 CB PHE A 100 -8.713 7.215 1.111 1.00 0.00 C ATOM 1533 CG PHE A 100 -9.520 6.162 0.357 1.00 0.00 C ATOM 1534 CD1 PHE A 100 -10.332 6.520 -0.735 1.00 0.00 C ATOM 1535 CD2 PHE A 100 -9.440 4.821 0.765 1.00 0.00 C ATOM 1536 CE1 PHE A 100 -11.079 5.539 -1.402 1.00 0.00 C ATOM 1537 CE2 PHE A 100 -10.177 3.846 0.081 1.00 0.00 C ATOM 1538 CZ PHE A 100 -11.003 4.207 -0.993 1.00 0.00 C ATOM 0 H PHE A 100 -7.610 8.654 2.673 1.00 0.00 H new ATOM 0 HA PHE A 100 -10.206 8.708 1.540 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -8.241 7.879 0.386 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.911 6.717 1.656 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -10.380 7.549 -1.059 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.815 4.543 1.600 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -11.713 5.814 -2.232 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -10.109 2.811 0.382 1.00 0.00 H new ATOM 0 HZ PHE A 100 -11.582 3.452 -1.505 1.00 0.00 H new ATOM 1548 N LEU A 101 -9.860 6.428 3.886 1.00 0.00 N ATOM 1549 CA LEU A 101 -10.595 5.616 4.886 1.00 0.00 C ATOM 1550 C LEU A 101 -11.485 6.473 5.807 1.00 0.00 C ATOM 1551 O LEU A 101 -12.680 6.200 5.968 1.00 0.00 O ATOM 1552 CB LEU A 101 -9.583 4.844 5.729 1.00 0.00 C ATOM 1553 CG LEU A 101 -9.639 3.328 5.528 1.00 0.00 C ATOM 1554 CD1 LEU A 101 -9.152 2.918 4.135 1.00 0.00 C ATOM 1555 CD2 LEU A 101 -8.803 2.645 6.615 1.00 0.00 C ATOM 0 H LEU A 101 -8.847 6.320 3.942 1.00 0.00 H new ATOM 0 HA LEU A 101 -11.255 4.937 4.346 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.580 5.196 5.488 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.755 5.068 6.782 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.678 3.008 5.607 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.208 1.834 4.034 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.781 3.386 3.377 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -8.120 3.242 4.000 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -8.839 1.564 6.477 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -7.770 2.985 6.547 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -9.204 2.899 7.596 1.00 0.00 H new ATOM 1567 N LYS A 102 -10.915 7.564 6.286 1.00 0.00 N ATOM 1568 CA LYS A 102 -11.563 8.548 7.166 1.00 0.00 C ATOM 1569 C LYS A 102 -12.534 9.514 6.466 1.00 0.00 C ATOM 1570 O LYS A 102 -13.095 10.374 7.135 1.00 0.00 O ATOM 1571 CB LYS A 102 -10.489 9.355 7.918 1.00 0.00 C ATOM 1572 CG LYS A 102 -9.669 8.501 8.885 1.00 0.00 C ATOM 1573 CD LYS A 102 -8.515 9.312 9.479 1.00 0.00 C ATOM 1574 CE LYS A 102 -7.632 8.450 10.371 1.00 0.00 C ATOM 1575 NZ LYS A 102 -6.542 9.239 10.955 1.00 0.00 N ATOM 0 H LYS A 102 -9.949 7.808 6.070 1.00 0.00 H new ATOM 0 HA LYS A 102 -12.177 7.963 7.850 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -9.819 9.820 7.195 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -10.970 10.161 8.472 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -10.310 8.132 9.685 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.276 7.628 8.363 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -7.916 9.738 8.674 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -8.914 10.146 10.056 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -8.233 8.010 11.167 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -7.218 7.626 9.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.956 8.628 11.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -5.957 9.639 10.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -6.940 10.011 11.527 1.00 0.00 H new ATOM 1589 N ALA A 103 -12.874 9.257 5.193 1.00 0.00 N ATOM 1590 CA ALA A 103 -13.816 10.085 4.400 1.00 0.00 C ATOM 1591 C ALA A 103 -15.128 10.420 5.124 1.00 0.00 C ATOM 1592 O ALA A 103 -15.489 11.590 5.255 1.00 0.00 O ATOM 1593 CB ALA A 103 -14.147 9.350 3.095 1.00 0.00 C ATOM 0 H ALA A 103 -12.502 8.462 4.674 1.00 0.00 H new ATOM 0 HA ALA A 103 -13.311 11.034 4.220 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -14.839 9.951 2.505 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -13.231 9.188 2.526 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -14.606 8.389 3.325 1.00 0.00 H new ATOM 1599 N TYR A 104 -15.622 9.387 5.823 1.00 0.00 N ATOM 1600 CA TYR A 104 -16.823 9.390 6.678 1.00 0.00 C ATOM 1601 C TYR A 104 -16.847 10.530 7.721 1.00 0.00 C ATOM 1602 O TYR A 104 -17.887 11.131 7.947 1.00 0.00 O ATOM 1603 CB TYR A 104 -16.842 8.028 7.385 1.00 0.00 C ATOM 1604 CG TYR A 104 -18.209 7.633 7.948 1.00 0.00 C ATOM 1605 CD1 TYR A 104 -18.569 8.013 9.247 1.00 0.00 C ATOM 1606 CD2 TYR A 104 -19.044 6.791 7.205 1.00 0.00 C ATOM 1607 CE1 TYR A 104 -19.750 7.512 9.810 1.00 0.00 C ATOM 1608 CE2 TYR A 104 -20.218 6.294 7.773 1.00 0.00 C ATOM 1609 CZ TYR A 104 -20.573 6.652 9.080 1.00 0.00 C ATOM 1610 OH TYR A 104 -21.706 6.143 9.620 1.00 0.00 O ATOM 0 H TYR A 104 -15.169 8.473 5.807 1.00 0.00 H new ATOM 0 HA TYR A 104 -17.702 9.560 6.057 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -16.516 7.262 6.682 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -16.117 8.043 8.199 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -17.941 8.687 9.810 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -18.780 6.526 6.192 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -20.026 7.793 10.816 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -20.854 5.632 7.204 1.00 0.00 H new ATOM 0 HH TYR A 104 -22.150 5.566 8.964 1.00 0.00 H new ATOM 1620 N VAL A 105 -15.660 10.854 8.257 1.00 0.00 N ATOM 1621 CA VAL A 105 -15.465 11.929 9.249 1.00 0.00 C ATOM 1622 C VAL A 105 -14.722 13.161 8.698 1.00 0.00 C ATOM 1623 O VAL A 105 -15.102 14.288 9.022 1.00 0.00 O ATOM 1624 CB VAL A 105 -14.842 11.340 10.535 1.00 0.00 C ATOM 1625 CG1 VAL A 105 -13.392 10.855 10.389 1.00 0.00 C ATOM 1626 CG2 VAL A 105 -14.997 12.292 11.724 1.00 0.00 C ATOM 0 H VAL A 105 -14.795 10.372 8.012 1.00 0.00 H new ATOM 0 HA VAL A 105 -16.445 12.332 9.506 1.00 0.00 H new ATOM 0 HB VAL A 105 -15.420 10.437 10.733 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -13.043 10.459 11.343 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -13.345 10.072 9.632 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -12.758 11.689 10.088 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -14.547 11.844 12.610 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -14.499 13.236 11.502 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -16.056 12.475 11.908 1.00 0.00 H new ATOM 1636 N GLU A 106 -13.831 12.948 7.728 1.00 0.00 N ATOM 1637 CA GLU A 106 -13.061 13.978 6.987 1.00 0.00 C ATOM 1638 C GLU A 106 -13.978 15.097 6.472 1.00 0.00 C ATOM 1639 O GLU A 106 -13.780 16.275 6.783 1.00 0.00 O ATOM 1640 CB GLU A 106 -12.371 13.290 5.799 1.00 0.00 C ATOM 1641 CG GLU A 106 -11.378 14.157 5.010 1.00 0.00 C ATOM 1642 CD GLU A 106 -9.938 14.116 5.531 1.00 0.00 C ATOM 1643 OE1 GLU A 106 -9.748 13.961 6.761 1.00 0.00 O ATOM 1644 OE2 GLU A 106 -9.034 14.164 4.662 1.00 0.00 O ATOM 0 H GLU A 106 -13.607 12.004 7.413 1.00 0.00 H new ATOM 0 HA GLU A 106 -12.329 14.431 7.656 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -11.843 12.411 6.169 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -13.140 12.935 5.113 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -11.383 13.835 3.969 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -11.726 15.190 5.025 1.00 0.00 H new ATOM 1651 N CYS A 107 -15.061 14.686 5.820 1.00 0.00 N ATOM 1652 CA CYS A 107 -16.121 15.604 5.368 1.00 0.00 C ATOM 1653 C CYS A 107 -17.447 15.345 6.126 1.00 0.00 C ATOM 1654 O CYS A 107 -18.481 15.890 5.750 1.00 0.00 O ATOM 1655 CB CYS A 107 -16.300 15.398 3.855 1.00 0.00 C ATOM 1656 SG CYS A 107 -17.372 16.633 3.033 1.00 0.00 S ATOM 0 H CYS A 107 -15.236 13.709 5.586 1.00 0.00 H new ATOM 0 HA CYS A 107 -15.839 16.636 5.578 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -15.318 15.417 3.381 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -16.717 14.405 3.685 1.00 0.00 H new ATOM 0 HG CYS A 107 -17.450 16.364 1.764 1.00 0.00 H new ATOM 1662 N SER A 108 -17.338 14.744 7.318 1.00 0.00 N ATOM 1663 CA SER A 108 -18.442 14.136 8.109 1.00 0.00 C ATOM 1664 C SER A 108 -19.772 13.974 7.361 1.00 0.00 C ATOM 1665 O SER A 108 -20.725 14.736 7.515 1.00 0.00 O ATOM 1666 CB SER A 108 -18.621 14.854 9.455 1.00 0.00 C ATOM 1667 OG SER A 108 -17.559 14.499 10.344 1.00 0.00 O ATOM 0 H SER A 108 -16.437 14.659 7.789 1.00 0.00 H new ATOM 0 HA SER A 108 -18.121 13.112 8.299 1.00 0.00 H new ATOM 0 HB2 SER A 108 -18.633 15.933 9.302 1.00 0.00 H new ATOM 0 HB3 SER A 108 -19.581 14.584 9.896 1.00 0.00 H new ATOM 0 HG SER A 108 -16.717 14.450 9.845 1.00 0.00 H new ATOM 1673 N THR A 109 -19.804 12.881 6.607 1.00 0.00 N ATOM 1674 CA THR A 109 -20.771 12.574 5.513 1.00 0.00 C ATOM 1675 C THR A 109 -21.474 13.808 4.912 1.00 0.00 C ATOM 1676 O THR A 109 -22.657 14.055 5.121 1.00 0.00 O ATOM 1677 CB THR A 109 -21.750 11.483 5.985 1.00 0.00 C ATOM 1678 OG1 THR A 109 -21.011 10.415 6.594 1.00 0.00 O ATOM 1679 CG2 THR A 109 -22.562 10.888 4.832 1.00 0.00 C ATOM 0 H THR A 109 -19.125 12.131 6.735 1.00 0.00 H new ATOM 0 HA THR A 109 -20.196 12.189 4.671 1.00 0.00 H new ATOM 0 HB THR A 109 -22.437 11.953 6.688 1.00 0.00 H new ATOM 0 HG1 THR A 109 -21.631 9.719 6.897 1.00 0.00 H new ATOM 0 HG21 THR A 109 -23.237 10.124 5.218 1.00 0.00 H new ATOM 0 HG22 THR A 109 -23.143 11.675 4.352 1.00 0.00 H new ATOM 0 HG23 THR A 109 -21.886 10.440 4.104 1.00 0.00 H new ATOM 1687 N CYS A 110 -20.623 14.689 4.385 1.00 0.00 N ATOM 1688 CA CYS A 110 -20.941 15.956 3.685 1.00 0.00 C ATOM 1689 C CYS A 110 -21.599 17.097 4.482 1.00 0.00 C ATOM 1690 O CYS A 110 -21.691 18.224 3.977 1.00 0.00 O ATOM 1691 CB CYS A 110 -21.636 15.701 2.346 1.00 0.00 C ATOM 1692 SG CYS A 110 -20.468 15.001 1.124 1.00 0.00 S ATOM 0 H CYS A 110 -19.616 14.534 4.434 1.00 0.00 H new ATOM 0 HA CYS A 110 -19.949 16.373 3.514 1.00 0.00 H new ATOM 0 HB2 CYS A 110 -22.471 15.015 2.490 1.00 0.00 H new ATOM 0 HB3 CYS A 110 -22.052 16.634 1.964 1.00 0.00 H new ATOM 0 HG CYS A 110 -20.831 15.352 -0.074 1.00 0.00 H new ATOM 1698 N LYS A 111 -21.980 16.816 5.726 1.00 0.00 N ATOM 1699 CA LYS A 111 -22.502 17.791 6.728 1.00 0.00 C ATOM 1700 C LYS A 111 -23.701 18.608 6.205 1.00 0.00 C ATOM 1701 O LYS A 111 -24.252 18.322 5.136 1.00 0.00 O ATOM 1702 CB LYS A 111 -21.353 18.709 7.175 1.00 0.00 C ATOM 1703 CG LYS A 111 -20.207 17.968 7.878 1.00 0.00 C ATOM 1704 CD LYS A 111 -19.008 18.862 8.187 1.00 0.00 C ATOM 1705 CE LYS A 111 -19.279 19.846 9.331 1.00 0.00 C ATOM 1706 NZ LYS A 111 -18.106 20.684 9.604 1.00 0.00 N ATOM 0 H LYS A 111 -21.938 15.867 6.096 1.00 0.00 H new ATOM 0 HA LYS A 111 -22.881 17.229 7.582 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -20.956 19.230 6.304 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.749 19.470 7.848 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -20.579 17.537 8.808 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -19.881 17.139 7.250 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -18.153 18.238 8.446 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -18.736 19.420 7.291 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -20.129 20.479 9.075 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -19.552 19.294 10.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -18.321 21.339 10.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -17.303 20.080 9.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -17.862 21.228 8.752 1.00 0.00 H new ATOM 1720 N SER A 112 -24.075 19.662 6.933 1.00 0.00 N ATOM 1721 CA SER A 112 -25.009 20.703 6.453 1.00 0.00 C ATOM 1722 C SER A 112 -24.276 21.670 5.484 1.00 0.00 C ATOM 1723 O SER A 112 -24.234 22.886 5.677 1.00 0.00 O ATOM 1724 CB SER A 112 -25.601 21.440 7.657 1.00 0.00 C ATOM 1725 OG SER A 112 -24.563 22.094 8.393 1.00 0.00 O ATOM 0 H SER A 112 -23.739 19.826 7.882 1.00 0.00 H new ATOM 0 HA SER A 112 -25.828 20.246 5.897 1.00 0.00 H new ATOM 0 HB2 SER A 112 -26.335 22.172 7.320 1.00 0.00 H new ATOM 0 HB3 SER A 112 -26.126 20.736 8.302 1.00 0.00 H new ATOM 0 HG SER A 112 -24.120 22.752 7.818 1.00 0.00 H new ATOM 1731 N LEU A 113 -23.561 21.049 4.554 1.00 0.00 N ATOM 1732 CA LEU A 113 -22.601 21.701 3.644 1.00 0.00 C ATOM 1733 C LEU A 113 -22.787 21.263 2.179 1.00 0.00 C ATOM 1734 O LEU A 113 -23.089 22.085 1.329 1.00 0.00 O ATOM 1735 CB LEU A 113 -21.196 21.438 4.223 1.00 0.00 C ATOM 1736 CG LEU A 113 -19.923 21.916 3.487 1.00 0.00 C ATOM 1737 CD1 LEU A 113 -19.520 20.965 2.361 1.00 0.00 C ATOM 1738 CD2 LEU A 113 -20.037 23.368 3.001 1.00 0.00 C ATOM 0 H LEU A 113 -23.629 20.043 4.400 1.00 0.00 H new ATOM 0 HA LEU A 113 -22.768 22.777 3.594 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -21.174 21.882 5.218 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -21.102 20.360 4.353 1.00 0.00 H new ATOM 0 HG LEU A 113 -19.117 21.898 4.221 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -18.621 21.340 1.872 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -19.322 19.976 2.774 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -20.329 20.900 1.633 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -19.117 23.654 2.491 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -20.877 23.456 2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -20.198 24.026 3.855 1.00 0.00 H new ATOM 1750 N ASP A 114 -22.609 19.961 1.927 1.00 0.00 N ATOM 1751 CA ASP A 114 -22.689 19.335 0.580 1.00 0.00 C ATOM 1752 C ASP A 114 -21.670 19.877 -0.444 1.00 0.00 C ATOM 1753 O ASP A 114 -21.827 20.941 -1.035 1.00 0.00 O ATOM 1754 CB ASP A 114 -24.127 19.344 0.024 1.00 0.00 C ATOM 1755 CG ASP A 114 -25.086 18.471 0.843 1.00 0.00 C ATOM 1756 OD1 ASP A 114 -24.622 17.433 1.371 1.00 0.00 O ATOM 1757 OD2 ASP A 114 -26.265 18.862 0.923 1.00 0.00 O ATOM 0 H ASP A 114 -22.400 19.288 2.664 1.00 0.00 H new ATOM 0 HA ASP A 114 -22.397 18.297 0.738 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -24.499 20.368 0.008 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -24.115 18.993 -1.008 1.00 0.00 H new ATOM 1762 N THR A 115 -20.646 19.064 -0.659 1.00 0.00 N ATOM 1763 CA THR A 115 -19.499 19.350 -1.552 1.00 0.00 C ATOM 1764 C THR A 115 -19.872 19.448 -3.035 1.00 0.00 C ATOM 1765 O THR A 115 -19.966 18.456 -3.753 1.00 0.00 O ATOM 1766 CB THR A 115 -18.384 18.305 -1.356 1.00 0.00 C ATOM 1767 OG1 THR A 115 -18.963 17.008 -1.206 1.00 0.00 O ATOM 1768 CG2 THR A 115 -17.473 18.657 -0.182 1.00 0.00 C ATOM 0 H THR A 115 -20.575 18.152 -0.208 1.00 0.00 H new ATOM 0 HA THR A 115 -19.140 20.337 -1.261 1.00 0.00 H new ATOM 0 HB THR A 115 -17.751 18.304 -2.243 1.00 0.00 H new ATOM 0 HG1 THR A 115 -18.356 16.334 -1.576 1.00 0.00 H new ATOM 0 HG21 THR A 115 -16.701 17.894 -0.079 1.00 0.00 H new ATOM 0 HG22 THR A 115 -17.005 19.625 -0.362 1.00 0.00 H new ATOM 0 HG23 THR A 115 -18.062 18.703 0.734 1.00 0.00 H new ATOM 1776 N ILE A 116 -20.222 20.682 -3.411 1.00 0.00 N ATOM 1777 CA ILE A 116 -20.480 21.050 -4.825 1.00 0.00 C ATOM 1778 C ILE A 116 -19.435 22.002 -5.454 1.00 0.00 C ATOM 1779 O ILE A 116 -19.597 22.449 -6.587 1.00 0.00 O ATOM 1780 CB ILE A 116 -21.912 21.594 -5.002 1.00 0.00 C ATOM 1781 CG1 ILE A 116 -22.322 22.706 -4.018 1.00 0.00 C ATOM 1782 CG2 ILE A 116 -22.921 20.442 -4.960 1.00 0.00 C ATOM 1783 CD1 ILE A 116 -21.821 24.099 -4.424 1.00 0.00 C ATOM 0 H ILE A 116 -20.336 21.456 -2.756 1.00 0.00 H new ATOM 0 HA ILE A 116 -20.377 20.119 -5.383 1.00 0.00 H new ATOM 0 HB ILE A 116 -21.917 22.074 -5.981 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -23.409 22.728 -3.940 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -21.936 22.464 -3.028 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -23.929 20.837 -5.086 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -22.704 19.739 -5.764 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -22.849 19.930 -4.000 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -22.147 24.832 -3.686 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -20.732 24.094 -4.474 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -22.228 24.362 -5.400 1.00 0.00 H new ATOM 1795 N LEU A 117 -18.345 22.244 -4.725 1.00 0.00 N ATOM 1796 CA LEU A 117 -17.258 23.129 -5.157 1.00 0.00 C ATOM 1797 C LEU A 117 -16.230 22.408 -6.045 1.00 0.00 C ATOM 1798 O LEU A 117 -15.972 21.216 -5.891 1.00 0.00 O ATOM 1799 CB LEU A 117 -16.549 23.770 -3.952 1.00 0.00 C ATOM 1800 CG LEU A 117 -17.290 25.005 -3.403 1.00 0.00 C ATOM 1801 CD1 LEU A 117 -18.471 24.633 -2.501 1.00 0.00 C ATOM 1802 CD2 LEU A 117 -16.301 25.905 -2.668 1.00 0.00 C ATOM 0 H LEU A 117 -18.188 21.827 -3.807 1.00 0.00 H new ATOM 0 HA LEU A 117 -17.722 23.913 -5.756 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -16.452 23.029 -3.158 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -15.539 24.059 -4.243 1.00 0.00 H new ATOM 0 HG LEU A 117 -17.715 25.544 -4.250 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -18.956 25.541 -2.143 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -19.188 24.038 -3.067 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -18.111 24.054 -1.650 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -16.824 26.779 -2.279 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -15.852 25.354 -1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -15.520 26.226 -3.357 1.00 0.00 H new ATOM 1814 N LYS A 118 -15.608 23.211 -6.908 1.00 0.00 N ATOM 1815 CA LYS A 118 -14.628 22.777 -7.928 1.00 0.00 C ATOM 1816 C LYS A 118 -13.447 21.938 -7.386 1.00 0.00 C ATOM 1817 O LYS A 118 -13.021 22.088 -6.246 1.00 0.00 O ATOM 1818 CB LYS A 118 -14.096 24.021 -8.650 1.00 0.00 C ATOM 1819 CG LYS A 118 -14.383 24.007 -10.158 1.00 0.00 C ATOM 1820 CD LYS A 118 -13.517 22.981 -10.911 1.00 0.00 C ATOM 1821 CE LYS A 118 -13.851 22.953 -12.403 1.00 0.00 C ATOM 1822 NZ LYS A 118 -13.018 21.965 -13.101 1.00 0.00 N ATOM 0 H LYS A 118 -15.772 24.218 -6.924 1.00 0.00 H new ATOM 0 HA LYS A 118 -15.161 22.109 -8.605 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -14.545 24.911 -8.208 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -13.020 24.095 -8.491 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.436 23.780 -10.322 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -14.204 25.001 -10.568 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -12.463 23.225 -10.778 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -13.671 21.990 -10.484 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -14.905 22.710 -12.541 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -13.692 23.941 -12.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -13.259 21.960 -14.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -12.015 22.213 -12.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -13.190 21.021 -12.700 1.00 0.00 H new ATOM 1836 N LYS A 119 -12.987 21.061 -8.280 1.00 0.00 N ATOM 1837 CA LYS A 119 -11.860 20.105 -8.191 1.00 0.00 C ATOM 1838 C LYS A 119 -12.366 18.671 -7.912 1.00 0.00 C ATOM 1839 O LYS A 119 -13.114 18.171 -8.749 1.00 0.00 O ATOM 1840 CB LYS A 119 -10.669 20.526 -7.300 1.00 0.00 C ATOM 1841 CG LYS A 119 -9.708 21.516 -7.966 1.00 0.00 C ATOM 1842 CD LYS A 119 -10.258 22.940 -8.113 1.00 0.00 C ATOM 1843 CE LYS A 119 -9.210 23.913 -8.672 1.00 0.00 C ATOM 1844 NZ LYS A 119 -8.136 24.169 -7.703 1.00 0.00 N ATOM 0 H LYS A 119 -13.441 20.988 -9.191 1.00 0.00 H new ATOM 0 HA LYS A 119 -11.407 20.118 -9.183 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -11.055 20.972 -6.383 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -10.112 19.634 -7.011 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -8.787 21.555 -7.385 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -9.446 21.138 -8.954 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -11.126 22.926 -8.772 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -10.601 23.297 -7.142 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.784 23.503 -9.588 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -9.692 24.854 -8.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -7.572 24.985 -8.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -8.550 24.372 -6.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.524 23.331 -7.634 1.00 0.00 H new ATOM 1858 N GLU A 120 -12.121 18.140 -6.711 1.00 0.00 N ATOM 1859 CA GLU A 120 -12.457 16.763 -6.285 1.00 0.00 C ATOM 1860 C GLU A 120 -12.061 15.667 -7.296 1.00 0.00 C ATOM 1861 O GLU A 120 -12.618 15.583 -8.393 1.00 0.00 O ATOM 1862 CB GLU A 120 -13.936 16.679 -5.873 1.00 0.00 C ATOM 1863 CG GLU A 120 -14.334 15.269 -5.399 1.00 0.00 C ATOM 1864 CD GLU A 120 -15.649 15.195 -4.628 1.00 0.00 C ATOM 1865 OE1 GLU A 120 -15.949 16.126 -3.851 1.00 0.00 O ATOM 1866 OE2 GLU A 120 -16.306 14.144 -4.791 1.00 0.00 O ATOM 0 H GLU A 120 -11.664 18.674 -5.972 1.00 0.00 H new ATOM 0 HA GLU A 120 -11.839 16.549 -5.413 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -14.129 17.396 -5.075 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -14.563 16.966 -6.718 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -14.403 14.616 -6.269 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -13.537 14.876 -4.767 1.00 0.00 H new ATOM 1873 N LYS A 121 -11.247 14.733 -6.813 1.00 0.00 N ATOM 1874 CA LYS A 121 -10.592 13.647 -7.604 1.00 0.00 C ATOM 1875 C LYS A 121 -9.580 14.284 -8.574 1.00 0.00 C ATOM 1876 O LYS A 121 -8.370 14.243 -8.350 1.00 0.00 O ATOM 1877 CB LYS A 121 -11.567 12.734 -8.384 1.00 0.00 C ATOM 1878 CG LYS A 121 -12.815 12.267 -7.617 1.00 0.00 C ATOM 1879 CD LYS A 121 -12.558 11.294 -6.458 1.00 0.00 C ATOM 1880 CE LYS A 121 -12.143 9.900 -6.942 1.00 0.00 C ATOM 1881 NZ LYS A 121 -11.886 8.995 -5.807 1.00 0.00 N ATOM 0 H LYS A 121 -11.003 14.693 -5.823 1.00 0.00 H new ATOM 0 HA LYS A 121 -10.102 12.992 -6.883 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -11.893 13.265 -9.279 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -11.019 11.853 -8.718 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -13.327 13.145 -7.223 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -13.496 11.791 -8.323 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -11.777 11.699 -5.815 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -13.460 11.211 -5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -12.928 9.483 -7.572 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -11.247 9.978 -7.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -11.542 8.080 -6.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -11.168 9.416 -5.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -12.766 8.849 -5.273 1.00 0.00 H new ATOM 1895 N LYS A 122 -10.131 15.072 -9.500 1.00 0.00 N ATOM 1896 CA LYS A 122 -9.380 15.966 -10.412 1.00 0.00 C ATOM 1897 C LYS A 122 -8.647 17.033 -9.588 1.00 0.00 C ATOM 1898 O LYS A 122 -9.129 17.487 -8.543 1.00 0.00 O ATOM 1899 CB LYS A 122 -10.375 16.607 -11.389 1.00 0.00 C ATOM 1900 CG LYS A 122 -11.020 15.556 -12.302 1.00 0.00 C ATOM 1901 CD LYS A 122 -12.139 16.095 -13.195 1.00 0.00 C ATOM 1902 CE LYS A 122 -11.634 16.987 -14.329 1.00 0.00 C ATOM 1903 NZ LYS A 122 -12.743 17.373 -15.210 1.00 0.00 N ATOM 0 H LYS A 122 -11.139 15.114 -9.648 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.636 15.406 -10.979 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -11.151 17.130 -10.830 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.862 17.353 -11.996 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.247 15.118 -12.934 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -11.420 14.752 -11.684 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.690 15.256 -13.620 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.842 16.661 -12.583 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -11.162 17.879 -13.916 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -10.872 16.460 -14.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.384 17.979 -15.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.175 16.520 -15.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -13.457 17.894 -14.662 1.00 0.00 H new ATOM 1917 N SER A 123 -7.417 17.306 -10.021 1.00 0.00 N ATOM 1918 CA SER A 123 -6.434 18.158 -9.319 1.00 0.00 C ATOM 1919 C SER A 123 -6.116 17.720 -7.870 1.00 0.00 C ATOM 1920 O SER A 123 -5.868 18.545 -6.985 1.00 0.00 O ATOM 1921 CB SER A 123 -6.826 19.637 -9.389 1.00 0.00 C ATOM 1922 OG SER A 123 -6.924 20.061 -10.748 1.00 0.00 O ATOM 0 H SER A 123 -7.057 16.932 -10.899 1.00 0.00 H new ATOM 0 HA SER A 123 -5.499 18.019 -9.863 1.00 0.00 H new ATOM 0 HB2 SER A 123 -7.779 19.792 -8.883 1.00 0.00 H new ATOM 0 HB3 SER A 123 -6.086 20.241 -8.865 1.00 0.00 H new ATOM 0 HG SER A 123 -7.177 21.007 -10.778 1.00 0.00 H new ATOM 1928 N TRP A 124 -6.265 16.414 -7.623 1.00 0.00 N ATOM 1929 CA TRP A 124 -5.875 15.675 -6.397 1.00 0.00 C ATOM 1930 C TRP A 124 -6.337 16.257 -5.037 1.00 0.00 C ATOM 1931 O TRP A 124 -5.725 16.013 -4.001 1.00 0.00 O ATOM 1932 CB TRP A 124 -4.362 15.408 -6.427 1.00 0.00 C ATOM 1933 CG TRP A 124 -3.966 14.050 -5.823 1.00 0.00 C ATOM 1934 CD1 TRP A 124 -4.753 13.184 -5.179 1.00 0.00 C ATOM 1935 CD2 TRP A 124 -2.750 13.402 -6.021 1.00 0.00 C ATOM 1936 NE1 TRP A 124 -4.110 12.031 -4.988 1.00 0.00 N ATOM 1937 CE2 TRP A 124 -2.886 12.123 -5.477 1.00 0.00 C ATOM 1938 CE3 TRP A 124 -1.540 13.795 -6.606 1.00 0.00 C ATOM 1939 CZ2 TRP A 124 -1.817 11.223 -5.537 1.00 0.00 C ATOM 1940 CZ3 TRP A 124 -0.472 12.896 -6.667 1.00 0.00 C ATOM 1941 CH2 TRP A 124 -0.613 11.603 -6.142 1.00 0.00 C ATOM 0 H TRP A 124 -6.689 15.796 -8.315 1.00 0.00 H new ATOM 0 HA TRP A 124 -6.439 14.743 -6.439 1.00 0.00 H new ATOM 0 HB2 TRP A 124 -4.014 15.453 -7.459 1.00 0.00 H new ATOM 0 HB3 TRP A 124 -3.850 16.202 -5.883 1.00 0.00 H new ATOM 0 HD1 TRP A 124 -5.764 13.388 -4.859 1.00 0.00 H new ATOM 0 HE1 TRP A 124 -4.503 11.206 -4.535 1.00 0.00 H new ATOM 0 HE3 TRP A 124 -1.432 14.791 -7.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 -1.920 10.234 -5.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 0.462 13.197 -7.118 1.00 0.00 H new ATOM 0 HH2 TRP A 124 0.206 10.902 -6.204 1.00 0.00 H new ATOM 1952 N TYR A 125 -7.534 16.847 -5.056 1.00 0.00 N ATOM 1953 CA TYR A 125 -8.250 17.410 -3.880 1.00 0.00 C ATOM 1954 C TYR A 125 -7.549 18.640 -3.273 1.00 0.00 C ATOM 1955 O TYR A 125 -6.349 18.848 -3.417 1.00 0.00 O ATOM 1956 CB TYR A 125 -8.476 16.381 -2.762 1.00 0.00 C ATOM 1957 CG TYR A 125 -8.946 14.993 -3.238 1.00 0.00 C ATOM 1958 CD1 TYR A 125 -10.275 14.756 -3.609 1.00 0.00 C ATOM 1959 CD2 TYR A 125 -8.014 13.943 -3.276 1.00 0.00 C ATOM 1960 CE1 TYR A 125 -10.678 13.476 -3.994 1.00 0.00 C ATOM 1961 CE2 TYR A 125 -8.410 12.669 -3.691 1.00 0.00 C ATOM 1962 CZ TYR A 125 -9.741 12.429 -4.040 1.00 0.00 C ATOM 1963 OH TYR A 125 -10.117 11.173 -4.388 1.00 0.00 O ATOM 0 H TYR A 125 -8.064 16.957 -5.921 1.00 0.00 H new ATOM 0 HA TYR A 125 -9.215 17.715 -4.285 1.00 0.00 H new ATOM 0 HB2 TYR A 125 -7.546 16.262 -2.206 1.00 0.00 H new ATOM 0 HB3 TYR A 125 -9.215 16.779 -2.067 1.00 0.00 H new ATOM 0 HD1 TYR A 125 -10.990 15.565 -3.597 1.00 0.00 H new ATOM 0 HD2 TYR A 125 -6.990 14.121 -2.984 1.00 0.00 H new ATOM 0 HE1 TYR A 125 -11.709 13.290 -4.256 1.00 0.00 H new ATOM 0 HE2 TYR A 125 -7.686 11.869 -3.742 1.00 0.00 H new ATOM 0 HH TYR A 125 -10.985 10.967 -3.983 1.00 0.00 H new ATOM 1973 N ILE A 126 -8.341 19.470 -2.583 1.00 0.00 N ATOM 1974 CA ILE A 126 -7.867 20.755 -2.031 1.00 0.00 C ATOM 1975 C ILE A 126 -7.903 20.749 -0.493 1.00 0.00 C ATOM 1976 O ILE A 126 -8.830 20.239 0.147 1.00 0.00 O ATOM 1977 CB ILE A 126 -8.681 21.921 -2.638 1.00 0.00 C ATOM 1978 CG1 ILE A 126 -8.686 21.929 -4.176 1.00 0.00 C ATOM 1979 CG2 ILE A 126 -8.267 23.300 -2.100 1.00 0.00 C ATOM 1980 CD1 ILE A 126 -7.316 21.971 -4.876 1.00 0.00 C ATOM 0 H ILE A 126 -9.324 19.276 -2.390 1.00 0.00 H new ATOM 0 HA ILE A 126 -6.823 20.899 -2.311 1.00 0.00 H new ATOM 0 HB ILE A 126 -9.702 21.730 -2.307 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -9.215 21.039 -4.518 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -9.264 22.791 -4.509 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -8.878 24.072 -2.568 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -8.412 23.328 -1.020 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -7.217 23.480 -2.330 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -7.459 21.973 -5.957 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -6.783 22.874 -4.579 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -6.734 21.096 -4.589 1.00 0.00 H new ATOM 1992 N VAL A 127 -6.812 21.269 0.081 1.00 0.00 N ATOM 1993 CA VAL A 127 -6.704 21.556 1.531 1.00 0.00 C ATOM 1994 C VAL A 127 -7.544 22.808 1.831 1.00 0.00 C ATOM 1995 O VAL A 127 -7.151 23.918 1.477 1.00 0.00 O ATOM 1996 CB VAL A 127 -5.225 21.710 1.950 1.00 0.00 C ATOM 1997 CG1 VAL A 127 -5.070 22.018 3.448 1.00 0.00 C ATOM 1998 CG2 VAL A 127 -4.424 20.438 1.644 1.00 0.00 C ATOM 0 H VAL A 127 -5.970 21.507 -0.443 1.00 0.00 H new ATOM 0 HA VAL A 127 -7.093 20.726 2.121 1.00 0.00 H new ATOM 0 HB VAL A 127 -4.840 22.549 1.370 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -4.012 22.117 3.692 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -5.585 22.949 3.683 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -5.503 21.206 4.033 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -3.387 20.578 1.950 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -4.853 19.598 2.190 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -4.462 20.233 0.574 1.00 0.00 H new ATOM 2008 N CYS A 128 -8.693 22.546 2.450 1.00 0.00 N ATOM 2009 CA CYS A 128 -9.829 23.458 2.695 1.00 0.00 C ATOM 2010 C CYS A 128 -10.458 24.010 1.404 1.00 0.00 C ATOM 2011 O CYS A 128 -9.773 24.454 0.487 1.00 0.00 O ATOM 2012 CB CYS A 128 -9.528 24.586 3.708 1.00 0.00 C ATOM 2013 SG CYS A 128 -8.476 25.966 3.140 1.00 0.00 S ATOM 0 H CYS A 128 -8.877 21.617 2.827 1.00 0.00 H new ATOM 0 HA CYS A 128 -10.578 22.822 3.167 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.479 25.002 4.041 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -9.053 24.137 4.581 1.00 0.00 H new ATOM 0 HG CYS A 128 -7.651 25.537 2.232 1.00 0.00 H new ATOM 2019 N LEU A 129 -11.788 24.024 1.404 1.00 0.00 N ATOM 2020 CA LEU A 129 -12.606 24.283 0.188 1.00 0.00 C ATOM 2021 C LEU A 129 -14.104 24.362 0.525 1.00 0.00 C ATOM 2022 O LEU A 129 -14.765 25.354 0.229 1.00 0.00 O ATOM 2023 CB LEU A 129 -12.383 23.156 -0.840 1.00 0.00 C ATOM 2024 CG LEU A 129 -13.035 23.396 -2.207 1.00 0.00 C ATOM 2025 CD1 LEU A 129 -12.300 24.468 -3.016 1.00 0.00 C ATOM 2026 CD2 LEU A 129 -13.091 22.078 -2.984 1.00 0.00 C ATOM 0 H LEU A 129 -12.345 23.857 2.242 1.00 0.00 H new ATOM 0 HA LEU A 129 -12.292 25.241 -0.227 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -11.311 23.020 -0.983 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -12.770 22.224 -0.427 1.00 0.00 H new ATOM 0 HG LEU A 129 -14.047 23.765 -2.039 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -12.797 24.604 -3.976 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -12.309 25.409 -2.466 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -11.269 24.155 -3.182 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -13.554 22.248 -3.956 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -12.080 21.696 -3.126 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -13.679 21.350 -2.424 1.00 0.00 H new ATOM 2038 N ALA A 130 -14.576 23.340 1.241 1.00 0.00 N ATOM 2039 CA ALA A 130 -15.994 23.131 1.633 1.00 0.00 C ATOM 2040 C ALA A 130 -16.077 22.010 2.694 1.00 0.00 C ATOM 2041 O ALA A 130 -16.667 22.182 3.756 1.00 0.00 O ATOM 2042 CB ALA A 130 -16.839 22.759 0.405 1.00 0.00 C ATOM 0 H ALA A 130 -13.966 22.598 1.584 1.00 0.00 H new ATOM 0 HA ALA A 130 -16.386 24.056 2.055 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -17.875 22.609 0.708 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -16.788 23.563 -0.329 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -16.454 21.840 -0.037 1.00 0.00 H new ATOM 2048 N CYS A 131 -15.419 20.901 2.385 1.00 0.00 N ATOM 2049 CA CYS A 131 -15.123 19.801 3.326 1.00 0.00 C ATOM 2050 C CYS A 131 -14.419 20.290 4.596 1.00 0.00 C ATOM 2051 O CYS A 131 -13.510 21.122 4.514 1.00 0.00 O ATOM 2052 CB CYS A 131 -14.213 18.797 2.608 1.00 0.00 C ATOM 2053 SG CYS A 131 -12.706 19.563 1.897 1.00 0.00 S ATOM 0 H CYS A 131 -15.060 20.725 1.446 1.00 0.00 H new ATOM 0 HA CYS A 131 -16.066 19.349 3.632 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -13.919 18.017 3.310 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -14.776 18.312 1.811 1.00 0.00 H new ATOM 0 HG CYS A 131 -12.335 20.563 2.641 1.00 0.00 H new ATOM 2059 N GLY A 132 -14.804 19.675 5.719 1.00 0.00 N ATOM 2060 CA GLY A 132 -14.290 19.972 7.074 1.00 0.00 C ATOM 2061 C GLY A 132 -12.769 19.814 7.211 1.00 0.00 C ATOM 2062 O GLY A 132 -12.018 20.772 7.030 1.00 0.00 O ATOM 0 H GLY A 132 -15.503 18.933 5.718 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -14.565 20.993 7.341 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -14.780 19.313 7.790 1.00 0.00 H new ATOM 2066 N ALA A 133 -12.346 18.577 7.459 1.00 0.00 N ATOM 2067 CA ALA A 133 -10.923 18.220 7.636 1.00 0.00 C ATOM 2068 C ALA A 133 -10.230 18.015 6.270 1.00 0.00 C ATOM 2069 O ALA A 133 -9.768 16.932 5.901 1.00 0.00 O ATOM 2070 CB ALA A 133 -10.830 16.983 8.541 1.00 0.00 C ATOM 0 H ALA A 133 -12.978 17.781 7.545 1.00 0.00 H new ATOM 0 HA ALA A 133 -10.390 19.037 8.122 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -9.784 16.711 8.678 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -11.277 17.206 9.510 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -11.363 16.153 8.078 1.00 0.00 H new ATOM 2076 N GLN A 134 -10.249 19.103 5.502 1.00 0.00 N ATOM 2077 CA GLN A 134 -9.732 19.225 4.111 1.00 0.00 C ATOM 2078 C GLN A 134 -10.092 18.017 3.204 1.00 0.00 C ATOM 2079 O GLN A 134 -11.116 17.378 3.421 1.00 0.00 O ATOM 2080 CB GLN A 134 -8.234 19.580 4.101 1.00 0.00 C ATOM 2081 CG GLN A 134 -7.256 18.525 4.638 1.00 0.00 C ATOM 2082 CD GLN A 134 -6.779 18.822 6.057 1.00 0.00 C ATOM 2083 OE1 GLN A 134 -7.402 18.507 7.059 1.00 0.00 O ATOM 2084 NE2 GLN A 134 -5.605 19.410 6.168 1.00 0.00 N ATOM 0 H GLN A 134 -10.645 19.981 5.839 1.00 0.00 H new ATOM 0 HA GLN A 134 -10.257 20.063 3.653 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -7.949 19.812 3.075 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -8.100 20.492 4.683 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -7.738 17.548 4.620 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -6.393 18.467 3.975 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -5.085 19.673 5.331 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -5.216 19.602 7.091 1.00 0.00 H new ATOM 2093 N THR A 135 -9.444 17.959 2.034 1.00 0.00 N ATOM 2094 CA THR A 135 -9.450 16.798 1.112 1.00 0.00 C ATOM 2095 C THR A 135 -10.895 16.354 0.756 1.00 0.00 C ATOM 2096 O THR A 135 -11.406 15.386 1.334 1.00 0.00 O ATOM 2097 CB THR A 135 -8.621 15.652 1.723 1.00 0.00 C ATOM 2098 OG1 THR A 135 -7.360 16.176 2.180 1.00 0.00 O ATOM 2099 CG2 THR A 135 -8.339 14.530 0.720 1.00 0.00 C ATOM 0 H THR A 135 -8.883 18.736 1.685 1.00 0.00 H new ATOM 0 HA THR A 135 -8.987 17.092 0.170 1.00 0.00 H new ATOM 0 HB THR A 135 -9.204 15.233 2.543 1.00 0.00 H new ATOM 0 HG1 THR A 135 -6.628 15.723 1.711 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.752 13.749 1.203 1.00 0.00 H new ATOM 0 HG22 THR A 135 -9.282 14.110 0.369 1.00 0.00 H new ATOM 0 HG23 THR A 135 -7.782 14.931 -0.127 1.00 0.00 H new ATOM 2107 N PRO A 136 -11.546 17.025 -0.212 1.00 0.00 N ATOM 2108 CA PRO A 136 -12.931 16.705 -0.633 1.00 0.00 C ATOM 2109 C PRO A 136 -13.021 15.418 -1.456 1.00 0.00 C ATOM 2110 O PRO A 136 -13.153 15.422 -2.669 1.00 0.00 O ATOM 2111 CB PRO A 136 -13.394 17.947 -1.393 1.00 0.00 C ATOM 2112 CG PRO A 136 -12.103 18.474 -2.027 1.00 0.00 C ATOM 2113 CD PRO A 136 -11.050 18.207 -0.953 1.00 0.00 C ATOM 0 HA PRO A 136 -13.579 16.493 0.217 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -14.142 17.702 -2.147 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -13.844 18.682 -0.726 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -11.870 17.955 -2.957 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -12.175 19.535 -2.264 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -10.074 18.013 -1.398 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -10.934 19.066 -0.292 1.00 0.00 H new ATOM 2121 N VAL A 137 -12.845 14.302 -0.751 1.00 0.00 N ATOM 2122 CA VAL A 137 -12.989 12.939 -1.316 1.00 0.00 C ATOM 2123 C VAL A 137 -14.421 12.525 -1.689 1.00 0.00 C ATOM 2124 O VAL A 137 -14.631 11.907 -2.733 1.00 0.00 O ATOM 2125 CB VAL A 137 -12.327 11.861 -0.426 1.00 0.00 C ATOM 2126 CG1 VAL A 137 -10.805 11.898 -0.585 1.00 0.00 C ATOM 2127 CG2 VAL A 137 -12.677 12.000 1.061 1.00 0.00 C ATOM 0 H VAL A 137 -12.596 14.306 0.238 1.00 0.00 H new ATOM 0 HA VAL A 137 -12.450 13.001 -2.261 1.00 0.00 H new ATOM 0 HB VAL A 137 -12.725 10.905 -0.768 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -10.354 11.133 0.048 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -10.543 11.708 -1.626 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -10.432 12.879 -0.290 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -12.180 11.212 1.627 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -12.345 12.973 1.424 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -13.756 11.914 1.190 1.00 0.00 H new ATOM 2137 N LYS A 138 -15.386 13.072 -0.950 1.00 0.00 N ATOM 2138 CA LYS A 138 -16.812 12.725 -1.040 1.00 0.00 C ATOM 2139 C LYS A 138 -17.580 13.843 -1.782 1.00 0.00 C ATOM 2140 O LYS A 138 -17.333 15.013 -1.494 1.00 0.00 O ATOM 2141 CB LYS A 138 -17.322 12.581 0.409 1.00 0.00 C ATOM 2142 CG LYS A 138 -18.730 11.996 0.549 1.00 0.00 C ATOM 2143 CD LYS A 138 -18.786 10.511 0.189 1.00 0.00 C ATOM 2144 CE LYS A 138 -20.221 9.989 0.360 1.00 0.00 C ATOM 2145 NZ LYS A 138 -20.290 8.550 0.058 1.00 0.00 N ATOM 0 H LYS A 138 -15.196 13.790 -0.251 1.00 0.00 H new ATOM 0 HA LYS A 138 -16.964 11.800 -1.596 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -16.627 11.949 0.961 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -17.305 13.563 0.883 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -19.076 12.131 1.574 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.415 12.548 -0.094 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -18.456 10.364 -0.839 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -18.105 9.947 0.826 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.559 10.168 1.381 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -20.894 10.537 -0.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -21.268 8.216 0.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -19.988 8.386 -0.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -19.664 8.029 0.705 1.00 0.00 H new ATOM 2159 N PRO A 139 -18.453 13.487 -2.740 1.00 0.00 N ATOM 2160 CA PRO A 139 -19.267 14.469 -3.498 1.00 0.00 C ATOM 2161 C PRO A 139 -20.633 14.781 -2.864 1.00 0.00 C ATOM 2162 O PRO A 139 -21.080 14.077 -1.957 1.00 0.00 O ATOM 2163 CB PRO A 139 -19.462 13.808 -4.866 1.00 0.00 C ATOM 2164 CG PRO A 139 -19.523 12.319 -4.535 1.00 0.00 C ATOM 2165 CD PRO A 139 -18.507 12.164 -3.395 1.00 0.00 C ATOM 0 HA PRO A 139 -18.761 15.434 -3.531 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -20.377 14.150 -5.350 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -18.639 14.036 -5.543 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -20.523 12.017 -4.225 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -19.257 11.705 -5.396 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -18.818 11.390 -2.693 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -17.528 11.874 -3.777 1.00 0.00 H new ATOM 2173 N LEU A 140 -21.198 15.918 -3.270 1.00 0.00 N ATOM 2174 CA LEU A 140 -22.609 16.304 -2.990 1.00 0.00 C ATOM 2175 C LEU A 140 -23.052 16.260 -1.514 1.00 0.00 C ATOM 2176 O LEU A 140 -24.276 16.135 -1.268 1.00 0.00 O ATOM 2177 CB LEU A 140 -23.545 15.497 -3.903 1.00 0.00 C ATOM 2178 CG LEU A 140 -23.937 16.271 -5.167 1.00 0.00 C ATOM 2179 CD1 LEU A 140 -24.471 15.295 -6.217 1.00 0.00 C ATOM 2180 CD2 LEU A 140 -25.025 17.293 -4.842 1.00 0.00 C ATOM 2181 OXT LEU A 140 -22.202 16.598 -0.674 1.00 0.00 O ATOM 0 H LEU A 140 -20.692 16.618 -3.813 1.00 0.00 H new ATOM 0 HA LEU A 140 -22.676 17.368 -3.219 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -23.056 14.565 -4.188 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -24.445 15.229 -3.350 1.00 0.00 H new ATOM 0 HG LEU A 140 -23.057 16.788 -5.550 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -24.750 15.845 -7.116 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -23.699 14.566 -6.462 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -25.345 14.778 -5.822 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -25.295 17.837 -5.747 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -25.903 16.778 -4.452 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -24.654 17.994 -4.095 1.00 0.00 H new TER 2193 LEU A 140