USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1666 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 NoAdj : A 66 ASNHD21 : A 66 ASN OD1 : A 198 CACA :(metal ligand) USER MOD NoAdj : A 66 ASNHD22 : A 66 ASN OD1 : A 198 CACA :(metal ligand) USER MOD NoAdj : B 66 ASNHD21 : B 66 ASN OD1 : B 200 CACA :(metal ligand) USER MOD NoAdj : B 66 ASNHD22 : B 66 ASN OD1 : B 200 CACA :(metal ligand) USER MOD Set 1.1: B 61 LYS NZ :NH3+ 172:sc= 1.01 (180deg=-0.00708) USER MOD Set 1.2: B 67 GLN : amide:sc= 0.753 K(o=1.8,f=-10!) USER MOD Set 2.1: B 44 GLN : amide:sc= 0.803 K(o=1.4,f=-0.62) USER MOD Set 2.2: B 45 GLN : amide:sc= 0.586 K(o=1.4,f=-0.23) USER MOD Set 3.1: B 36 ASN : amide:sc= 1.21 K(o=2.3,f=-10!) USER MOD Set 3.2: B 39 LYS NZ :NH3+ 137:sc= 1.05 (180deg=-0.665) USER MOD Set 4.1: A 85 LYS NZ :NH3+ 160:sc= 0.832 (180deg=-1.17) USER MOD Set 4.2: B 74 ASN : amide:sc= 1.81 K(o=2.6,f=-8!) USER MOD Set 5.1: A 74 ASN : amide:sc= 1.64 K(o=3.1,f=-8.2!) USER MOD Set 5.2: B 85 LYS NZ :NH3+ -179:sc= 1.42 (180deg=0.218) USER MOD Set 6.1: A 60 MET CE :methyl -175:sc= 0 (180deg=-0.0486) USER MOD Set 6.2: A 69 SER OG : rot 180:sc= 0 USER MOD Set 7.1: A 55 SER OG : rot -100:sc= 1.79 USER MOD Set 7.2: A 59 LYS NZ :NH3+ 179:sc= 3.31 (180deg=2.41) USER MOD Set 8.1: A 39 LYS NZ :NH3+ -164:sc= 1.22 (180deg=-0.176) USER MOD Set 8.2: A 43 THR OG1 : rot 76:sc= 1.54 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0.58 (180deg=0.399) USER MOD Single : A 7 THR OG1 : rot 179:sc= 1.16 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 82:sc= 1.22 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -0.0204 X(o=-0.02,f=-0.2) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= -0.351 USER MOD Single : A 34 SER OG : rot 54:sc= 1.19 USER MOD Single : A 36 ASN : amide:sc= 1.24 K(o=1.2,f=-0.12) USER MOD Single : A 44 GLN : amide:sc=-0.00039 X(o=-0.00039,f=0) USER MOD Single : A 45 GLN : amide:sc= 1.6 K(o=1.6,f=-6.5!) USER MOD Single : A 48 HIS : no HE2:sc= 0.581 K(o=0.58,f=-2.4!) USER MOD Single : A 51 LYS NZ :NH3+ 157:sc= 1.22 (180deg=1.13) USER MOD Single : A 61 LYS NZ :NH3+ 178:sc= 1.53 (180deg=1.36) USER MOD Single : A 62 SER OG : rot 71:sc= 0.906 USER MOD Single : A 67 GLN : amide:sc= 0.965 K(o=0.96,f=-0.56) USER MOD Single : A 72 LYS NZ :NH3+ -173:sc= 1.2 (180deg=1.1) USER MOD Single : A 76 TYR OH : rot 165:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -148:sc= -0.153 (180deg=-1) USER MOD Single : A 90 LYS NZ :NH3+ -175:sc= 1.1 (180deg=1.02) USER MOD Single : A 91 LYS NZ :NH3+ 173:sc= 1.52 (180deg=1.4) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00257) USER MOD Single : A 98 LYS NZ :NH3+ -149:sc= 1.19 (180deg=0.919) USER MOD Single : B 1 MET CE :methyl -175:sc= 0 (180deg=-0.052) USER MOD Single : B 1 MET N :NH3+ -176:sc= 2.14 (180deg=1.83) USER MOD Single : B 7 THR OG1 : rot -165:sc= 0.974 USER MOD Single : B 12 SER OG : rot 72:sc= 1.04 USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 180:sc= 0.0124 USER MOD Single : B 22 THR OG1 : rot -71:sc= 1.15 USER MOD Single : B 26 GLN : amide:sc= 1.27 K(o=1.3,f=-0.69) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 169:sc= 0.682 USER MOD Single : B 34 SER OG : rot 110:sc= -0.661 USER MOD Single : B 43 THR OG1 : rot 87:sc= 1.14 USER MOD Single : B 48 HIS : no HD1:sc= -0.254 X(o=-0.25,f=-0.41) USER MOD Single : B 51 LYS NZ :NH3+ -156:sc= 1 (180deg=-1.99!) USER MOD Single : B 55 SER OG : rot -48:sc= 0.557 USER MOD Single : B 59 LYS NZ :NH3+ -174:sc= 1.26 (180deg=1.02) USER MOD Single : B 60 MET CE :methyl -176:sc= -0.227 (180deg=-0.301) USER MOD Single : B 62 SER OG : rot 82:sc= 1.18 USER MOD Single : B 69 SER OG : rot 180:sc= -0.0734 USER MOD Single : B 72 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.151) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 89 LYS NZ :NH3+ 144:sc= 3.16 (180deg=1.04) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 165:sc= 1.15 (180deg=1.08) USER MOD Single : B 97 LYS NZ :NH3+ -169:sc= 1.13 (180deg=1) USER MOD Single : B 98 LYS NZ :NH3+ -154:sc= 1.12 (180deg=-0.224) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.206 -23.955 -22.594 1.00 4.69 N ATOM 2 CA MET A 1 7.835 -23.720 -21.287 1.00 3.80 C ATOM 3 C MET A 1 8.507 -22.348 -21.317 1.00 3.10 C ATOM 4 O MET A 1 9.456 -22.175 -22.074 1.00 3.76 O ATOM 5 CB MET A 1 8.839 -24.838 -20.939 1.00 5.02 C ATOM 6 CG MET A 1 8.353 -26.252 -21.299 1.00 5.78 C ATOM 7 SD MET A 1 6.610 -26.613 -20.979 1.00 6.69 S ATOM 8 CE MET A 1 6.558 -26.444 -19.180 1.00 7.81 C ATOM 0 H1 MET A 1 6.657 -24.838 -22.561 1.00 4.69 H new ATOM 0 H2 MET A 1 6.573 -23.162 -22.822 1.00 4.69 H new ATOM 0 H3 MET A 1 7.942 -24.032 -23.325 1.00 4.69 H new ATOM 0 HA MET A 1 7.076 -23.735 -20.504 1.00 3.80 H new ATOM 0 HB2 MET A 1 9.777 -24.644 -21.459 1.00 5.02 H new ATOM 0 HB3 MET A 1 9.053 -24.800 -19.871 1.00 5.02 H new ATOM 0 HG2 MET A 1 8.547 -26.420 -22.358 1.00 5.78 H new ATOM 0 HG3 MET A 1 8.957 -26.971 -20.746 1.00 5.78 H new ATOM 0 HE1 MET A 1 5.545 -26.637 -18.826 1.00 7.81 H new ATOM 0 HE2 MET A 1 7.243 -27.160 -18.727 1.00 7.81 H new ATOM 0 HE3 MET A 1 6.854 -25.433 -18.901 1.00 7.81 H new ATOM 20 N ALA A 2 7.958 -21.375 -20.585 1.00 2.75 N ATOM 21 CA ALA A 2 8.352 -19.971 -20.572 1.00 2.39 C ATOM 22 C ALA A 2 7.397 -19.258 -19.623 1.00 2.17 C ATOM 23 O ALA A 2 6.426 -19.869 -19.176 1.00 2.63 O ATOM 24 CB ALA A 2 8.269 -19.357 -21.979 1.00 2.95 C ATOM 0 H ALA A 2 7.182 -21.561 -19.950 1.00 2.75 H new ATOM 0 HA ALA A 2 9.386 -19.867 -20.244 1.00 2.39 H new ATOM 0 HB1 ALA A 2 8.569 -18.310 -21.937 1.00 2.95 H new ATOM 0 HB2 ALA A 2 8.934 -19.898 -22.652 1.00 2.95 H new ATOM 0 HB3 ALA A 2 7.245 -19.427 -22.347 1.00 2.95 H new ATOM 30 N ALA A 3 7.684 -17.983 -19.353 1.00 2.08 N ATOM 31 CA ALA A 3 6.910 -17.085 -18.511 1.00 2.22 C ATOM 32 C ALA A 3 7.016 -17.459 -17.030 1.00 1.82 C ATOM 33 O ALA A 3 6.278 -18.307 -16.537 1.00 2.44 O ATOM 34 CB ALA A 3 5.457 -16.963 -18.989 1.00 3.10 C ATOM 0 H ALA A 3 8.511 -17.529 -19.741 1.00 2.08 H new ATOM 0 HA ALA A 3 7.348 -16.092 -18.608 1.00 2.22 H new ATOM 0 HB1 ALA A 3 4.914 -16.283 -18.333 1.00 3.10 H new ATOM 0 HB2 ALA A 3 5.440 -16.575 -20.007 1.00 3.10 H new ATOM 0 HB3 ALA A 3 4.983 -17.944 -18.967 1.00 3.10 H new ATOM 40 N GLU A 4 7.940 -16.808 -16.319 1.00 1.41 N ATOM 41 CA GLU A 4 8.174 -17.026 -14.913 1.00 1.53 C ATOM 42 C GLU A 4 6.994 -16.440 -14.123 1.00 1.29 C ATOM 43 O GLU A 4 6.725 -15.248 -14.274 1.00 1.27 O ATOM 44 CB GLU A 4 9.503 -16.332 -14.573 1.00 2.16 C ATOM 45 CG GLU A 4 10.080 -16.872 -13.270 1.00 3.89 C ATOM 46 CD GLU A 4 10.706 -18.249 -13.460 1.00 5.07 C ATOM 47 OE1 GLU A 4 11.831 -18.285 -14.002 1.00 5.59 O ATOM 48 OE2 GLU A 4 10.036 -19.238 -13.095 1.00 5.95 O ATOM 0 H GLU A 4 8.553 -16.102 -16.726 1.00 1.41 H new ATOM 0 HA GLU A 4 8.245 -18.083 -14.656 1.00 1.53 H new ATOM 0 HB2 GLU A 4 10.216 -16.486 -15.383 1.00 2.16 H new ATOM 0 HB3 GLU A 4 9.345 -15.257 -14.488 1.00 2.16 H new ATOM 0 HG2 GLU A 4 10.831 -16.180 -12.890 1.00 3.89 H new ATOM 0 HG3 GLU A 4 9.292 -16.931 -12.519 1.00 3.89 H new ATOM 55 N PRO A 5 6.268 -17.229 -13.312 1.00 1.52 N ATOM 56 CA PRO A 5 5.233 -16.694 -12.443 1.00 1.63 C ATOM 57 C PRO A 5 5.912 -15.892 -11.332 1.00 1.40 C ATOM 58 O PRO A 5 6.972 -16.291 -10.849 1.00 1.58 O ATOM 59 CB PRO A 5 4.492 -17.917 -11.899 1.00 2.19 C ATOM 60 CG PRO A 5 5.579 -18.993 -11.866 1.00 2.33 C ATOM 61 CD PRO A 5 6.465 -18.649 -13.066 1.00 1.98 C ATOM 0 HA PRO A 5 4.535 -16.025 -12.946 1.00 1.63 H new ATOM 0 HB2 PRO A 5 4.079 -17.730 -10.908 1.00 2.19 H new ATOM 0 HB3 PRO A 5 3.660 -18.204 -12.542 1.00 2.19 H new ATOM 0 HG2 PRO A 5 6.141 -18.966 -10.932 1.00 2.33 H new ATOM 0 HG3 PRO A 5 5.155 -19.993 -11.955 1.00 2.33 H new ATOM 0 HD2 PRO A 5 7.512 -18.867 -12.854 1.00 1.98 H new ATOM 0 HD3 PRO A 5 6.187 -19.239 -13.939 1.00 1.98 H new ATOM 69 N LEU A 6 5.332 -14.759 -10.938 1.00 1.22 N ATOM 70 CA LEU A 6 5.939 -13.864 -9.967 1.00 1.11 C ATOM 71 C LEU A 6 5.300 -14.133 -8.597 1.00 1.14 C ATOM 72 O LEU A 6 4.284 -14.825 -8.510 1.00 1.24 O ATOM 73 CB LEU A 6 5.787 -12.429 -10.494 1.00 1.07 C ATOM 74 CG LEU A 6 6.454 -12.224 -11.872 1.00 0.92 C ATOM 75 CD1 LEU A 6 6.166 -10.796 -12.351 1.00 1.11 C ATOM 76 CD2 LEU A 6 7.971 -12.448 -11.837 1.00 1.33 C ATOM 0 H LEU A 6 4.428 -14.440 -11.286 1.00 1.22 H new ATOM 0 HA LEU A 6 7.008 -14.028 -9.831 1.00 1.11 H new ATOM 0 HB2 LEU A 6 4.727 -12.184 -10.568 1.00 1.07 H new ATOM 0 HB3 LEU A 6 6.225 -11.735 -9.777 1.00 1.07 H new ATOM 0 HG LEU A 6 6.035 -12.963 -12.555 1.00 0.92 H new ATOM 0 HD11 LEU A 6 6.632 -10.638 -13.324 1.00 1.11 H new ATOM 0 HD12 LEU A 6 5.089 -10.651 -12.436 1.00 1.11 H new ATOM 0 HD13 LEU A 6 6.572 -10.083 -11.634 1.00 1.11 H new ATOM 0 HD21 LEU A 6 8.385 -12.290 -12.833 1.00 1.33 H new ATOM 0 HD22 LEU A 6 8.427 -11.746 -11.139 1.00 1.33 H new ATOM 0 HD23 LEU A 6 8.181 -13.468 -11.514 1.00 1.33 H new ATOM 88 N THR A 7 5.912 -13.676 -7.499 1.00 1.10 N ATOM 89 CA THR A 7 5.366 -14.007 -6.175 1.00 1.17 C ATOM 90 C THR A 7 4.091 -13.192 -5.917 1.00 1.10 C ATOM 91 O THR A 7 3.943 -12.107 -6.470 1.00 1.20 O ATOM 92 CB THR A 7 6.433 -13.875 -5.076 1.00 1.21 C ATOM 93 OG1 THR A 7 5.928 -14.348 -3.845 1.00 1.96 O ATOM 94 CG2 THR A 7 6.935 -12.448 -4.871 1.00 0.88 C ATOM 0 H THR A 7 6.753 -13.098 -7.494 1.00 1.10 H new ATOM 0 HA THR A 7 5.073 -15.057 -6.153 1.00 1.17 H new ATOM 0 HB THR A 7 7.277 -14.475 -5.416 1.00 1.21 H new ATOM 0 HG1 THR A 7 6.620 -14.269 -3.156 1.00 1.96 H new ATOM 0 HG21 THR A 7 7.685 -12.436 -4.080 1.00 0.88 H new ATOM 0 HG22 THR A 7 7.378 -12.082 -5.797 1.00 0.88 H new ATOM 0 HG23 THR A 7 6.101 -11.806 -4.589 1.00 0.88 H new ATOM 102 N GLU A 8 3.160 -13.682 -5.090 1.00 1.21 N ATOM 103 CA GLU A 8 1.860 -13.046 -4.870 1.00 1.22 C ATOM 104 C GLU A 8 1.965 -11.535 -4.669 1.00 1.04 C ATOM 105 O GLU A 8 1.268 -10.762 -5.325 1.00 1.04 O ATOM 106 CB GLU A 8 1.159 -13.688 -3.667 1.00 1.48 C ATOM 107 CG GLU A 8 0.365 -14.908 -4.134 1.00 1.60 C ATOM 108 CD GLU A 8 -0.157 -15.719 -2.956 1.00 1.86 C ATOM 109 OE1 GLU A 8 0.700 -16.175 -2.168 1.00 2.06 O ATOM 110 OE2 GLU A 8 -1.395 -15.861 -2.865 1.00 2.46 O ATOM 0 H GLU A 8 3.291 -14.538 -4.551 1.00 1.21 H new ATOM 0 HA GLU A 8 1.271 -13.206 -5.773 1.00 1.22 H new ATOM 0 HB2 GLU A 8 1.894 -13.984 -2.919 1.00 1.48 H new ATOM 0 HB3 GLU A 8 0.493 -12.967 -3.192 1.00 1.48 H new ATOM 0 HG2 GLU A 8 -0.472 -14.584 -4.753 1.00 1.60 H new ATOM 0 HG3 GLU A 8 0.998 -15.538 -4.759 1.00 1.60 H new ATOM 117 N LEU A 9 2.832 -11.108 -3.750 1.00 0.95 N ATOM 118 CA LEU A 9 3.033 -9.691 -3.506 1.00 0.82 C ATOM 119 C LEU A 9 3.497 -8.967 -4.779 1.00 0.76 C ATOM 120 O LEU A 9 2.863 -7.991 -5.155 1.00 0.75 O ATOM 121 CB LEU A 9 3.944 -9.486 -2.287 1.00 0.76 C ATOM 122 CG LEU A 9 3.106 -9.589 -0.997 1.00 0.86 C ATOM 123 CD1 LEU A 9 3.935 -10.050 0.203 1.00 1.19 C ATOM 124 CD2 LEU A 9 2.484 -8.228 -0.659 1.00 1.54 C ATOM 0 H LEU A 9 3.400 -11.724 -3.169 1.00 0.95 H new ATOM 0 HA LEU A 9 2.082 -9.224 -3.251 1.00 0.82 H new ATOM 0 HB2 LEU A 9 4.735 -10.236 -2.280 1.00 0.76 H new ATOM 0 HB3 LEU A 9 4.429 -8.511 -2.342 1.00 0.76 H new ATOM 0 HG LEU A 9 2.332 -10.332 -1.188 1.00 0.86 H new ATOM 0 HD11 LEU A 9 3.298 -10.106 1.086 1.00 1.19 H new ATOM 0 HD12 LEU A 9 4.357 -11.034 -0.003 1.00 1.19 H new ATOM 0 HD13 LEU A 9 4.742 -9.339 0.382 1.00 1.19 H new ATOM 0 HD21 LEU A 9 1.895 -8.314 0.254 1.00 1.54 H new ATOM 0 HD22 LEU A 9 3.275 -7.493 -0.512 1.00 1.54 H new ATOM 0 HD23 LEU A 9 1.840 -7.909 -1.478 1.00 1.54 H new ATOM 136 N GLU A 10 4.550 -9.447 -5.450 1.00 0.74 N ATOM 137 CA GLU A 10 5.060 -8.983 -6.742 1.00 0.66 C ATOM 138 C GLU A 10 3.932 -8.855 -7.791 1.00 0.64 C ATOM 139 O GLU A 10 3.722 -7.774 -8.345 1.00 0.63 O ATOM 140 CB GLU A 10 6.185 -9.952 -7.139 1.00 0.72 C ATOM 141 CG GLU A 10 7.129 -9.573 -8.285 1.00 1.74 C ATOM 142 CD GLU A 10 8.201 -10.657 -8.477 1.00 1.70 C ATOM 143 OE1 GLU A 10 7.923 -11.817 -8.081 1.00 2.56 O ATOM 144 OE2 GLU A 10 9.273 -10.318 -9.021 1.00 2.39 O ATOM 0 H GLU A 10 5.103 -10.220 -5.080 1.00 0.74 H new ATOM 0 HA GLU A 10 5.464 -7.973 -6.678 1.00 0.66 H new ATOM 0 HB2 GLU A 10 6.797 -10.125 -6.254 1.00 0.72 H new ATOM 0 HB3 GLU A 10 5.722 -10.904 -7.397 1.00 0.72 H new ATOM 0 HG2 GLU A 10 6.560 -9.448 -9.207 1.00 1.74 H new ATOM 0 HG3 GLU A 10 7.605 -8.616 -8.071 1.00 1.74 H new ATOM 151 N GLU A 11 3.169 -9.928 -8.031 1.00 0.68 N ATOM 152 CA GLU A 11 2.003 -9.926 -8.915 1.00 0.70 C ATOM 153 C GLU A 11 1.044 -8.793 -8.515 1.00 0.70 C ATOM 154 O GLU A 11 0.640 -7.967 -9.338 1.00 0.72 O ATOM 155 CB GLU A 11 1.286 -11.290 -8.839 1.00 0.79 C ATOM 156 CG GLU A 11 2.119 -12.492 -9.325 1.00 1.44 C ATOM 157 CD GLU A 11 2.157 -12.688 -10.842 1.00 2.20 C ATOM 158 OE1 GLU A 11 1.509 -11.883 -11.544 1.00 2.95 O ATOM 159 OE2 GLU A 11 2.833 -13.653 -11.276 1.00 3.06 O ATOM 0 H GLU A 11 3.350 -10.838 -7.607 1.00 0.68 H new ATOM 0 HA GLU A 11 2.331 -9.759 -9.941 1.00 0.70 H new ATOM 0 HB2 GLU A 11 0.986 -11.469 -7.806 1.00 0.79 H new ATOM 0 HB3 GLU A 11 0.373 -11.237 -9.432 1.00 0.79 H new ATOM 0 HG2 GLU A 11 3.141 -12.375 -8.964 1.00 1.44 H new ATOM 0 HG3 GLU A 11 1.721 -13.398 -8.868 1.00 1.44 H new ATOM 166 N SER A 12 0.682 -8.754 -7.227 1.00 0.71 N ATOM 167 CA SER A 12 -0.244 -7.769 -6.684 1.00 0.72 C ATOM 168 C SER A 12 0.260 -6.342 -6.933 1.00 0.67 C ATOM 169 O SER A 12 -0.472 -5.499 -7.454 1.00 0.72 O ATOM 170 CB SER A 12 -0.506 -8.048 -5.196 1.00 0.76 C ATOM 171 OG SER A 12 -1.572 -7.244 -4.725 1.00 2.39 O ATOM 0 H SER A 12 1.030 -9.414 -6.531 1.00 0.71 H new ATOM 0 HA SER A 12 -1.198 -7.856 -7.205 1.00 0.72 H new ATOM 0 HB2 SER A 12 -0.746 -9.102 -5.053 1.00 0.76 H new ATOM 0 HB3 SER A 12 0.395 -7.845 -4.617 1.00 0.76 H new ATOM 0 HG SER A 12 -1.730 -7.433 -3.776 1.00 2.39 H new ATOM 177 N ILE A 13 1.519 -6.049 -6.586 1.00 0.60 N ATOM 178 CA ILE A 13 2.058 -4.721 -6.813 1.00 0.57 C ATOM 179 C ILE A 13 2.082 -4.405 -8.300 1.00 0.57 C ATOM 180 O ILE A 13 1.747 -3.282 -8.661 1.00 0.58 O ATOM 181 CB ILE A 13 3.360 -4.409 -6.052 1.00 0.59 C ATOM 182 CG1 ILE A 13 4.503 -5.413 -6.231 1.00 0.58 C ATOM 183 CG2 ILE A 13 3.015 -4.303 -4.558 1.00 0.64 C ATOM 184 CD1 ILE A 13 5.416 -5.116 -7.413 1.00 0.66 C ATOM 0 H ILE A 13 2.167 -6.708 -6.154 1.00 0.60 H new ATOM 0 HA ILE A 13 1.370 -4.012 -6.353 1.00 0.57 H new ATOM 0 HB ILE A 13 3.741 -3.480 -6.477 1.00 0.59 H new ATOM 0 HG12 ILE A 13 5.101 -5.431 -5.320 1.00 0.58 H new ATOM 0 HG13 ILE A 13 4.080 -6.410 -6.355 1.00 0.58 H new ATOM 0 HG21 ILE A 13 3.919 -4.082 -3.991 1.00 0.64 H new ATOM 0 HG22 ILE A 13 2.288 -3.505 -4.408 1.00 0.64 H new ATOM 0 HG23 ILE A 13 2.593 -5.247 -4.214 1.00 0.64 H new ATOM 0 HD11 ILE A 13 6.198 -5.874 -7.468 1.00 0.66 H new ATOM 0 HD12 ILE A 13 4.834 -5.127 -8.334 1.00 0.66 H new ATOM 0 HD13 ILE A 13 5.871 -4.134 -7.284 1.00 0.66 H new ATOM 196 N GLU A 14 2.388 -5.373 -9.171 1.00 0.59 N ATOM 197 CA GLU A 14 2.298 -5.114 -10.598 1.00 0.61 C ATOM 198 C GLU A 14 0.880 -4.662 -10.959 1.00 0.63 C ATOM 199 O GLU A 14 0.722 -3.536 -11.425 1.00 0.62 O ATOM 200 CB GLU A 14 2.788 -6.296 -11.445 1.00 0.71 C ATOM 201 CG GLU A 14 3.321 -5.791 -12.801 1.00 0.71 C ATOM 202 CD GLU A 14 2.261 -5.117 -13.670 1.00 1.85 C ATOM 203 OE1 GLU A 14 1.157 -5.688 -13.777 1.00 2.68 O ATOM 204 OE2 GLU A 14 2.570 -4.027 -14.199 1.00 2.72 O ATOM 0 H GLU A 14 2.691 -6.313 -8.917 1.00 0.59 H new ATOM 0 HA GLU A 14 2.978 -4.298 -10.841 1.00 0.61 H new ATOM 0 HB2 GLU A 14 3.574 -6.833 -10.914 1.00 0.71 H new ATOM 0 HB3 GLU A 14 1.972 -7.001 -11.606 1.00 0.71 H new ATOM 0 HG2 GLU A 14 4.132 -5.085 -12.622 1.00 0.71 H new ATOM 0 HG3 GLU A 14 3.746 -6.632 -13.349 1.00 0.71 H new ATOM 211 N THR A 15 -0.150 -5.481 -10.697 1.00 0.73 N ATOM 212 CA THR A 15 -1.499 -5.157 -11.175 1.00 0.84 C ATOM 213 C THR A 15 -1.934 -3.746 -10.730 1.00 0.80 C ATOM 214 O THR A 15 -2.488 -2.960 -11.507 1.00 0.94 O ATOM 215 CB THR A 15 -2.523 -6.269 -10.881 1.00 1.09 C ATOM 216 OG1 THR A 15 -3.682 -6.040 -11.655 1.00 1.81 O ATOM 217 CG2 THR A 15 -2.946 -6.391 -9.417 1.00 0.80 C ATOM 0 H THR A 15 -0.077 -6.351 -10.170 1.00 0.73 H new ATOM 0 HA THR A 15 -1.462 -5.119 -12.264 1.00 0.84 H new ATOM 0 HB THR A 15 -2.021 -7.203 -11.135 1.00 1.09 H new ATOM 0 HG1 THR A 15 -4.340 -6.744 -11.476 1.00 1.81 H new ATOM 0 HG21 THR A 15 -3.668 -7.201 -9.313 1.00 0.80 H new ATOM 0 HG22 THR A 15 -2.071 -6.603 -8.802 1.00 0.80 H new ATOM 0 HG23 THR A 15 -3.401 -5.456 -9.090 1.00 0.80 H new ATOM 225 N VAL A 16 -1.623 -3.366 -9.488 1.00 0.67 N ATOM 226 CA VAL A 16 -1.962 -2.030 -9.005 1.00 0.62 C ATOM 227 C VAL A 16 -1.015 -0.957 -9.561 1.00 0.60 C ATOM 228 O VAL A 16 -1.450 0.176 -9.759 1.00 0.78 O ATOM 229 CB VAL A 16 -2.139 -1.966 -7.479 1.00 0.57 C ATOM 230 CG1 VAL A 16 -3.085 -3.068 -6.984 1.00 0.63 C ATOM 231 CG2 VAL A 16 -0.810 -2.045 -6.732 1.00 0.55 C ATOM 0 H VAL A 16 -1.144 -3.957 -8.809 1.00 0.67 H new ATOM 0 HA VAL A 16 -2.948 -1.796 -9.407 1.00 0.62 H new ATOM 0 HB VAL A 16 -2.581 -0.994 -7.263 1.00 0.57 H new ATOM 0 HG11 VAL A 16 -3.191 -2.998 -5.901 1.00 0.63 H new ATOM 0 HG12 VAL A 16 -4.062 -2.947 -7.453 1.00 0.63 H new ATOM 0 HG13 VAL A 16 -2.676 -4.044 -7.246 1.00 0.63 H new ATOM 0 HG21 VAL A 16 -0.992 -1.995 -5.659 1.00 0.55 H new ATOM 0 HG22 VAL A 16 -0.313 -2.985 -6.973 1.00 0.55 H new ATOM 0 HG23 VAL A 16 -0.175 -1.211 -7.031 1.00 0.55 H new ATOM 241 N VAL A 17 0.254 -1.274 -9.840 1.00 0.51 N ATOM 242 CA VAL A 17 1.178 -0.357 -10.503 1.00 0.50 C ATOM 243 C VAL A 17 0.693 -0.059 -11.924 1.00 0.55 C ATOM 244 O VAL A 17 0.690 1.100 -12.335 1.00 0.60 O ATOM 245 CB VAL A 17 2.631 -0.878 -10.461 1.00 0.48 C ATOM 246 CG1 VAL A 17 3.537 -0.147 -11.463 1.00 0.49 C ATOM 247 CG2 VAL A 17 3.216 -0.650 -9.057 1.00 0.51 C ATOM 0 H VAL A 17 0.667 -2.178 -9.610 1.00 0.51 H new ATOM 0 HA VAL A 17 1.188 0.586 -9.956 1.00 0.50 H new ATOM 0 HB VAL A 17 2.599 -1.937 -10.718 1.00 0.48 H new ATOM 0 HG11 VAL A 17 4.549 -0.547 -11.398 1.00 0.49 H new ATOM 0 HG12 VAL A 17 3.154 -0.292 -12.473 1.00 0.49 H new ATOM 0 HG13 VAL A 17 3.552 0.918 -11.230 1.00 0.49 H new ATOM 0 HG21 VAL A 17 4.242 -1.017 -9.026 1.00 0.51 H new ATOM 0 HG22 VAL A 17 3.205 0.415 -8.827 1.00 0.51 H new ATOM 0 HG23 VAL A 17 2.616 -1.186 -8.321 1.00 0.51 H new ATOM 257 N THR A 18 0.266 -1.068 -12.684 1.00 0.60 N ATOM 258 CA THR A 18 -0.289 -0.825 -14.010 1.00 0.69 C ATOM 259 C THR A 18 -1.603 -0.033 -13.900 1.00 0.70 C ATOM 260 O THR A 18 -1.787 0.940 -14.637 1.00 0.75 O ATOM 261 CB THR A 18 -0.356 -2.114 -14.848 1.00 0.78 C ATOM 262 OG1 THR A 18 -0.807 -1.828 -16.155 1.00 0.90 O ATOM 263 CG2 THR A 18 -1.244 -3.191 -14.238 1.00 0.76 C ATOM 0 H THR A 18 0.294 -2.049 -12.406 1.00 0.60 H new ATOM 0 HA THR A 18 0.386 -0.186 -14.580 1.00 0.69 H new ATOM 0 HB THR A 18 0.660 -2.508 -14.871 1.00 0.78 H new ATOM 0 HG1 THR A 18 -0.843 -2.657 -16.677 1.00 0.90 H new ATOM 0 HG21 THR A 18 -1.244 -4.070 -14.882 1.00 0.76 H new ATOM 0 HG22 THR A 18 -0.863 -3.462 -13.253 1.00 0.76 H new ATOM 0 HG23 THR A 18 -2.261 -2.812 -14.142 1.00 0.76 H new ATOM 271 N THR A 19 -2.484 -0.366 -12.941 1.00 0.68 N ATOM 272 CA THR A 19 -3.685 0.428 -12.694 1.00 0.77 C ATOM 273 C THR A 19 -3.305 1.892 -12.422 1.00 0.78 C ATOM 274 O THR A 19 -3.819 2.798 -13.071 1.00 0.86 O ATOM 275 CB THR A 19 -4.527 -0.196 -11.567 1.00 0.79 C ATOM 276 OG1 THR A 19 -4.818 -1.540 -11.884 1.00 0.82 O ATOM 277 CG2 THR A 19 -5.878 0.507 -11.392 1.00 0.97 C ATOM 0 H THR A 19 -2.382 -1.177 -12.331 1.00 0.68 H new ATOM 0 HA THR A 19 -4.313 0.424 -13.585 1.00 0.77 H new ATOM 0 HB THR A 19 -3.941 -0.100 -10.653 1.00 0.79 H new ATOM 0 HG1 THR A 19 -4.054 -2.105 -11.645 1.00 0.82 H new ATOM 0 HG21 THR A 19 -6.435 0.030 -10.585 1.00 0.97 H new ATOM 0 HG22 THR A 19 -5.713 1.556 -11.148 1.00 0.97 H new ATOM 0 HG23 THR A 19 -6.448 0.435 -12.318 1.00 0.97 H new ATOM 285 N PHE A 20 -2.363 2.131 -11.505 1.00 0.74 N ATOM 286 CA PHE A 20 -1.789 3.450 -11.269 1.00 0.77 C ATOM 287 C PHE A 20 -1.382 4.090 -12.595 1.00 0.73 C ATOM 288 O PHE A 20 -1.894 5.147 -12.947 1.00 0.75 O ATOM 289 CB PHE A 20 -0.597 3.343 -10.306 1.00 0.78 C ATOM 290 CG PHE A 20 0.406 4.484 -10.366 1.00 1.33 C ATOM 291 CD1 PHE A 20 0.035 5.772 -9.946 1.00 2.39 C ATOM 292 CD2 PHE A 20 1.694 4.270 -10.896 1.00 2.51 C ATOM 293 CE1 PHE A 20 0.968 6.825 -9.976 1.00 3.08 C ATOM 294 CE2 PHE A 20 2.616 5.331 -10.962 1.00 3.26 C ATOM 295 CZ PHE A 20 2.257 6.602 -10.487 1.00 3.14 C ATOM 0 H PHE A 20 -1.977 1.404 -10.902 1.00 0.74 H new ATOM 0 HA PHE A 20 -2.538 4.091 -10.804 1.00 0.77 H new ATOM 0 HB2 PHE A 20 -0.981 3.275 -9.288 1.00 0.78 H new ATOM 0 HB3 PHE A 20 -0.071 2.411 -10.511 1.00 0.78 H new ATOM 0 HD1 PHE A 20 -0.971 5.955 -9.598 1.00 2.39 H new ATOM 0 HD2 PHE A 20 1.974 3.290 -11.252 1.00 2.51 H new ATOM 0 HE1 PHE A 20 0.694 7.802 -9.607 1.00 3.08 H new ATOM 0 HE2 PHE A 20 3.599 5.167 -11.378 1.00 3.26 H new ATOM 0 HZ PHE A 20 2.973 7.410 -10.515 1.00 3.14 H new ATOM 305 N PHE A 21 -0.477 3.444 -13.330 1.00 0.71 N ATOM 306 CA PHE A 21 0.116 3.973 -14.549 1.00 0.72 C ATOM 307 C PHE A 21 -0.954 4.420 -15.547 1.00 0.85 C ATOM 308 O PHE A 21 -0.923 5.553 -16.036 1.00 0.95 O ATOM 309 CB PHE A 21 1.048 2.918 -15.155 1.00 0.73 C ATOM 310 CG PHE A 21 1.808 3.374 -16.384 1.00 1.24 C ATOM 311 CD1 PHE A 21 2.753 4.412 -16.280 1.00 2.13 C ATOM 312 CD2 PHE A 21 1.626 2.717 -17.615 1.00 2.64 C ATOM 313 CE1 PHE A 21 3.534 4.769 -17.392 1.00 2.68 C ATOM 314 CE2 PHE A 21 2.409 3.074 -18.727 1.00 3.43 C ATOM 315 CZ PHE A 21 3.373 4.091 -18.613 1.00 3.00 C ATOM 0 H PHE A 21 -0.130 2.517 -13.085 1.00 0.71 H new ATOM 0 HA PHE A 21 0.699 4.861 -14.304 1.00 0.72 H new ATOM 0 HB2 PHE A 21 1.766 2.608 -14.395 1.00 0.73 H new ATOM 0 HB3 PHE A 21 0.459 2.039 -15.415 1.00 0.73 H new ATOM 0 HD1 PHE A 21 2.878 4.935 -15.343 1.00 2.13 H new ATOM 0 HD2 PHE A 21 0.884 1.938 -17.706 1.00 2.64 H new ATOM 0 HE1 PHE A 21 4.259 5.565 -17.309 1.00 2.68 H new ATOM 0 HE2 PHE A 21 2.270 2.566 -19.670 1.00 3.43 H new ATOM 0 HZ PHE A 21 3.989 4.351 -19.462 1.00 3.00 H new ATOM 325 N THR A 22 -1.920 3.544 -15.847 1.00 0.92 N ATOM 326 CA THR A 22 -2.926 3.872 -16.847 1.00 1.08 C ATOM 327 C THR A 22 -3.793 5.064 -16.426 1.00 1.12 C ATOM 328 O THR A 22 -4.332 5.737 -17.304 1.00 1.22 O ATOM 329 CB THR A 22 -3.740 2.649 -17.298 1.00 1.16 C ATOM 330 OG1 THR A 22 -4.449 2.981 -18.476 1.00 2.20 O ATOM 331 CG2 THR A 22 -4.734 2.146 -16.253 1.00 2.12 C ATOM 0 H THR A 22 -2.021 2.624 -15.419 1.00 0.92 H new ATOM 0 HA THR A 22 -2.387 4.196 -17.737 1.00 1.08 H new ATOM 0 HB THR A 22 -3.025 1.843 -17.464 1.00 1.16 H new ATOM 0 HG1 THR A 22 -4.971 2.206 -18.773 1.00 2.20 H new ATOM 0 HG21 THR A 22 -5.269 1.282 -16.646 1.00 2.12 H new ATOM 0 HG22 THR A 22 -4.197 1.860 -15.349 1.00 2.12 H new ATOM 0 HG23 THR A 22 -5.446 2.937 -16.017 1.00 2.12 H new ATOM 339 N PHE A 23 -3.933 5.335 -15.123 1.00 1.16 N ATOM 340 CA PHE A 23 -4.551 6.571 -14.652 1.00 1.25 C ATOM 341 C PHE A 23 -3.557 7.734 -14.665 1.00 1.24 C ATOM 342 O PHE A 23 -3.891 8.831 -15.084 1.00 1.41 O ATOM 343 CB PHE A 23 -5.196 6.380 -13.275 1.00 1.26 C ATOM 344 CG PHE A 23 -6.564 5.724 -13.321 1.00 1.10 C ATOM 345 CD1 PHE A 23 -6.685 4.345 -13.572 1.00 1.79 C ATOM 346 CD2 PHE A 23 -7.728 6.503 -13.178 1.00 2.43 C ATOM 347 CE1 PHE A 23 -7.946 3.728 -13.581 1.00 2.21 C ATOM 348 CE2 PHE A 23 -8.993 5.892 -13.228 1.00 2.63 C ATOM 349 CZ PHE A 23 -9.100 4.501 -13.378 1.00 1.97 C ATOM 0 H PHE A 23 -3.624 4.711 -14.378 1.00 1.16 H new ATOM 0 HA PHE A 23 -5.350 6.830 -15.347 1.00 1.25 H new ATOM 0 HB2 PHE A 23 -4.534 5.774 -12.656 1.00 1.26 H new ATOM 0 HB3 PHE A 23 -5.286 7.352 -12.789 1.00 1.26 H new ATOM 0 HD1 PHE A 23 -5.800 3.756 -13.759 1.00 1.79 H new ATOM 0 HD2 PHE A 23 -7.649 7.570 -13.030 1.00 2.43 H new ATOM 0 HE1 PHE A 23 -8.028 2.663 -13.743 1.00 2.21 H new ATOM 0 HE2 PHE A 23 -9.885 6.495 -13.151 1.00 2.63 H new ATOM 0 HZ PHE A 23 -10.069 4.026 -13.337 1.00 1.97 H new ATOM 359 N ALA A 24 -2.322 7.519 -14.227 1.00 1.10 N ATOM 360 CA ALA A 24 -1.285 8.539 -14.167 1.00 1.09 C ATOM 361 C ALA A 24 -1.133 9.233 -15.518 1.00 1.07 C ATOM 362 O ALA A 24 -0.938 10.454 -15.588 1.00 1.07 O ATOM 363 CB ALA A 24 0.034 7.884 -13.748 1.00 0.95 C ATOM 0 H ALA A 24 -2.007 6.607 -13.896 1.00 1.10 H new ATOM 0 HA ALA A 24 -1.564 9.296 -13.434 1.00 1.09 H new ATOM 0 HB1 ALA A 24 0.817 8.641 -13.700 1.00 0.95 H new ATOM 0 HB2 ALA A 24 -0.084 7.422 -12.768 1.00 0.95 H new ATOM 0 HB3 ALA A 24 0.310 7.122 -14.477 1.00 0.95 H new ATOM 369 N ARG A 25 -1.212 8.422 -16.581 1.00 1.09 N ATOM 370 CA ARG A 25 -1.068 8.883 -17.947 1.00 1.14 C ATOM 371 C ARG A 25 -2.273 9.663 -18.450 1.00 1.03 C ATOM 372 O ARG A 25 -2.117 10.279 -19.506 1.00 1.04 O ATOM 373 CB ARG A 25 -0.721 7.730 -18.908 1.00 1.29 C ATOM 374 CG ARG A 25 -1.909 6.822 -19.273 1.00 1.51 C ATOM 375 CD ARG A 25 -2.404 6.919 -20.731 1.00 1.81 C ATOM 376 NE ARG A 25 -2.980 8.238 -21.067 1.00 3.03 N ATOM 377 CZ ARG A 25 -3.993 8.485 -21.916 1.00 3.52 C ATOM 378 NH1 ARG A 25 -4.478 7.502 -22.682 1.00 3.16 N ATOM 379 NH2 ARG A 25 -4.519 9.714 -22.001 1.00 4.98 N ATOM 0 H ARG A 25 -1.380 7.419 -16.504 1.00 1.09 H new ATOM 0 HA ARG A 25 -0.230 9.580 -17.932 1.00 1.14 H new ATOM 0 HB2 ARG A 25 -0.307 8.150 -19.824 1.00 1.29 H new ATOM 0 HB3 ARG A 25 0.060 7.120 -18.455 1.00 1.29 H new ATOM 0 HG2 ARG A 25 -1.627 5.788 -19.073 1.00 1.51 H new ATOM 0 HG3 ARG A 25 -2.741 7.060 -18.610 1.00 1.51 H new ATOM 0 HD2 ARG A 25 -1.572 6.712 -21.404 1.00 1.81 H new ATOM 0 HD3 ARG A 25 -3.155 6.148 -20.905 1.00 1.81 H new ATOM 0 HE ARG A 25 -2.565 9.047 -20.606 1.00 3.03 H new ATOM 0 HH11 ARG A 25 -4.080 6.565 -22.622 1.00 3.16 H new ATOM 0 HH12 ARG A 25 -5.246 7.689 -23.326 1.00 3.16 H new ATOM 0 HH21 ARG A 25 -4.151 10.467 -21.420 1.00 4.98 H new ATOM 0 HH22 ARG A 25 -5.287 9.896 -22.647 1.00 4.98 H new ATOM 393 N GLN A 26 -3.466 9.556 -17.838 1.00 0.96 N ATOM 394 CA GLN A 26 -4.690 10.084 -18.422 1.00 0.88 C ATOM 395 C GLN A 26 -4.448 11.487 -18.969 1.00 0.90 C ATOM 396 O GLN A 26 -4.501 11.689 -20.183 1.00 1.05 O ATOM 397 CB GLN A 26 -5.819 10.089 -17.381 1.00 0.79 C ATOM 398 CG GLN A 26 -7.117 9.503 -17.906 1.00 0.88 C ATOM 399 CD GLN A 26 -7.063 7.986 -18.064 1.00 1.10 C ATOM 400 OE1 GLN A 26 -7.208 7.249 -17.095 1.00 1.95 O ATOM 401 NE2 GLN A 26 -6.873 7.499 -19.287 1.00 2.55 N ATOM 0 H GLN A 26 -3.598 9.104 -16.933 1.00 0.96 H new ATOM 0 HA GLN A 26 -4.993 9.441 -19.248 1.00 0.88 H new ATOM 0 HB2 GLN A 26 -5.500 9.523 -16.506 1.00 0.79 H new ATOM 0 HB3 GLN A 26 -5.997 11.113 -17.052 1.00 0.79 H new ATOM 0 HG2 GLN A 26 -7.928 9.764 -17.227 1.00 0.88 H new ATOM 0 HG3 GLN A 26 -7.350 9.955 -18.870 1.00 0.88 H new ATOM 0 HE21 GLN A 26 -6.755 8.134 -20.076 1.00 2.55 H new ATOM 0 HE22 GLN A 26 -6.845 6.490 -19.436 1.00 2.55 H new ATOM 410 N GLU A 27 -4.086 12.389 -18.060 1.00 0.89 N ATOM 411 CA GLU A 27 -3.846 13.793 -18.296 1.00 0.99 C ATOM 412 C GLU A 27 -2.479 14.135 -17.702 1.00 1.00 C ATOM 413 O GLU A 27 -2.334 14.360 -16.494 1.00 1.88 O ATOM 414 CB GLU A 27 -4.988 14.614 -17.680 1.00 1.26 C ATOM 415 CG GLU A 27 -6.364 14.193 -18.230 1.00 1.65 C ATOM 416 CD GLU A 27 -6.457 14.301 -19.749 1.00 4.20 C ATOM 417 OE1 GLU A 27 -5.855 15.257 -20.287 1.00 5.25 O ATOM 418 OE2 GLU A 27 -7.119 13.421 -20.340 1.00 5.58 O ATOM 0 H GLU A 27 -3.946 12.134 -17.082 1.00 0.89 H new ATOM 0 HA GLU A 27 -3.828 14.032 -19.359 1.00 0.99 H new ATOM 0 HB2 GLU A 27 -4.978 14.493 -16.597 1.00 1.26 H new ATOM 0 HB3 GLU A 27 -4.825 15.672 -17.884 1.00 1.26 H new ATOM 0 HG2 GLU A 27 -6.570 13.165 -17.931 1.00 1.65 H new ATOM 0 HG3 GLU A 27 -7.136 14.817 -17.779 1.00 1.65 H new ATOM 425 N GLY A 28 -1.463 14.132 -18.570 1.00 1.21 N ATOM 426 CA GLY A 28 -0.136 14.669 -18.316 1.00 1.35 C ATOM 427 C GLY A 28 0.657 13.912 -17.247 1.00 1.18 C ATOM 428 O GLY A 28 0.090 13.382 -16.290 1.00 1.22 O ATOM 0 H GLY A 28 -1.553 13.737 -19.506 1.00 1.21 H new ATOM 0 HA2 GLY A 28 0.431 14.660 -19.247 1.00 1.35 H new ATOM 0 HA3 GLY A 28 -0.231 15.711 -18.011 1.00 1.35 H new ATOM 432 N ARG A 29 1.986 13.911 -17.389 1.00 1.32 N ATOM 433 CA ARG A 29 2.911 13.333 -16.423 1.00 1.40 C ATOM 434 C ARG A 29 2.517 11.889 -16.088 1.00 1.27 C ATOM 435 O ARG A 29 1.900 11.634 -15.053 1.00 1.30 O ATOM 436 CB ARG A 29 3.004 14.200 -15.154 1.00 1.51 C ATOM 437 CG ARG A 29 3.706 15.558 -15.348 1.00 2.16 C ATOM 438 CD ARG A 29 2.763 16.765 -15.508 1.00 2.80 C ATOM 439 NE ARG A 29 2.247 16.954 -16.874 1.00 3.82 N ATOM 440 CZ ARG A 29 2.936 17.480 -17.903 1.00 4.22 C ATOM 441 NH1 ARG A 29 4.236 17.756 -17.762 1.00 3.71 N ATOM 442 NH2 ARG A 29 2.324 17.724 -19.069 1.00 5.89 N ATOM 0 H ARG A 29 2.453 14.322 -18.197 1.00 1.32 H new ATOM 0 HA ARG A 29 3.902 13.311 -16.876 1.00 1.40 H new ATOM 0 HB2 ARG A 29 1.996 14.378 -14.778 1.00 1.51 H new ATOM 0 HB3 ARG A 29 3.536 13.639 -14.386 1.00 1.51 H new ATOM 0 HG2 ARG A 29 4.358 15.737 -14.493 1.00 2.16 H new ATOM 0 HG3 ARG A 29 4.345 15.497 -16.229 1.00 2.16 H new ATOM 0 HD2 ARG A 29 1.920 16.645 -14.827 1.00 2.80 H new ATOM 0 HD3 ARG A 29 3.293 17.668 -15.204 1.00 2.80 H new ATOM 0 HE ARG A 29 1.287 16.662 -17.055 1.00 3.82 H new ATOM 0 HH11 ARG A 29 4.704 17.568 -16.875 1.00 3.71 H new ATOM 0 HH12 ARG A 29 4.760 18.155 -18.541 1.00 3.71 H new ATOM 0 HH21 ARG A 29 1.333 17.511 -19.179 1.00 5.89 H new ATOM 0 HH22 ARG A 29 2.849 18.123 -19.847 1.00 5.89 H new ATOM 456 N LYS A 30 2.916 10.932 -16.935 1.00 1.31 N ATOM 457 CA LYS A 30 2.535 9.525 -16.802 1.00 1.24 C ATOM 458 C LYS A 30 3.198 8.787 -15.626 1.00 1.15 C ATOM 459 O LYS A 30 3.428 7.583 -15.705 1.00 1.29 O ATOM 460 CB LYS A 30 2.719 8.794 -18.145 1.00 1.42 C ATOM 461 CG LYS A 30 4.181 8.633 -18.596 1.00 1.51 C ATOM 462 CD LYS A 30 4.218 7.787 -19.881 1.00 1.85 C ATOM 463 CE LYS A 30 5.631 7.319 -20.264 1.00 2.46 C ATOM 464 NZ LYS A 30 6.523 8.432 -20.647 1.00 3.62 N ATOM 0 H LYS A 30 3.517 11.117 -17.738 1.00 1.31 H new ATOM 0 HA LYS A 30 1.476 9.516 -16.543 1.00 1.24 H new ATOM 0 HB2 LYS A 30 2.266 7.806 -18.070 1.00 1.42 H new ATOM 0 HB3 LYS A 30 2.173 9.337 -18.916 1.00 1.42 H new ATOM 0 HG2 LYS A 30 4.630 9.610 -18.775 1.00 1.51 H new ATOM 0 HG3 LYS A 30 4.766 8.153 -17.812 1.00 1.51 H new ATOM 0 HD2 LYS A 30 3.577 6.915 -19.751 1.00 1.85 H new ATOM 0 HD3 LYS A 30 3.801 8.369 -20.703 1.00 1.85 H new ATOM 0 HE2 LYS A 30 6.070 6.781 -19.424 1.00 2.46 H new ATOM 0 HE3 LYS A 30 5.562 6.614 -21.092 1.00 2.46 H new ATOM 0 HZ1 LYS A 30 7.461 8.056 -20.895 1.00 3.62 H new ATOM 0 HZ2 LYS A 30 6.123 8.931 -21.467 1.00 3.62 H new ATOM 0 HZ3 LYS A 30 6.615 9.093 -19.850 1.00 3.62 H new ATOM 478 N ASP A 31 3.486 9.498 -14.536 1.00 1.30 N ATOM 479 CA ASP A 31 3.875 8.951 -13.248 1.00 1.31 C ATOM 480 C ASP A 31 3.180 9.762 -12.138 1.00 1.25 C ATOM 481 O ASP A 31 3.676 9.820 -11.011 1.00 1.90 O ATOM 482 CB ASP A 31 5.412 8.992 -13.152 1.00 1.79 C ATOM 483 CG ASP A 31 6.005 7.880 -12.296 1.00 3.15 C ATOM 484 OD1 ASP A 31 5.388 7.504 -11.281 1.00 4.51 O ATOM 485 OD2 ASP A 31 7.104 7.414 -12.679 1.00 3.87 O ATOM 0 H ASP A 31 3.451 10.517 -14.533 1.00 1.30 H new ATOM 0 HA ASP A 31 3.564 7.913 -13.132 1.00 1.31 H new ATOM 0 HB2 ASP A 31 5.831 8.927 -14.156 1.00 1.79 H new ATOM 0 HB3 ASP A 31 5.715 9.955 -12.741 1.00 1.79 H new ATOM 490 N SER A 32 2.064 10.457 -12.441 1.00 1.16 N ATOM 491 CA SER A 32 1.344 11.272 -11.468 1.00 1.10 C ATOM 492 C SER A 32 -0.149 11.456 -11.816 1.00 0.82 C ATOM 493 O SER A 32 -0.494 11.648 -12.990 1.00 0.79 O ATOM 494 CB SER A 32 2.047 12.632 -11.307 1.00 1.32 C ATOM 495 OG SER A 32 3.459 12.526 -11.262 1.00 2.71 O ATOM 0 H SER A 32 1.645 10.462 -13.371 1.00 1.16 H new ATOM 0 HA SER A 32 1.364 10.737 -10.519 1.00 1.10 H new ATOM 0 HB2 SER A 32 1.764 13.281 -12.136 1.00 1.32 H new ATOM 0 HB3 SER A 32 1.695 13.110 -10.393 1.00 1.32 H new ATOM 0 HG SER A 32 3.851 13.418 -11.161 1.00 2.71 H new ATOM 501 N LEU A 33 -1.032 11.418 -10.803 1.00 0.76 N ATOM 502 CA LEU A 33 -2.478 11.655 -10.931 1.00 0.71 C ATOM 503 C LEU A 33 -2.900 13.046 -10.421 1.00 0.76 C ATOM 504 O LEU A 33 -2.816 13.301 -9.224 1.00 1.23 O ATOM 505 CB LEU A 33 -3.256 10.601 -10.125 1.00 0.84 C ATOM 506 CG LEU A 33 -3.284 9.221 -10.782 1.00 0.93 C ATOM 507 CD1 LEU A 33 -1.987 8.432 -10.595 1.00 1.94 C ATOM 508 CD2 LEU A 33 -4.467 8.417 -10.229 1.00 2.58 C ATOM 0 H LEU A 33 -0.749 11.215 -9.844 1.00 0.76 H new ATOM 0 HA LEU A 33 -2.708 11.591 -11.995 1.00 0.71 H new ATOM 0 HB2 LEU A 33 -2.810 10.513 -9.134 1.00 0.84 H new ATOM 0 HB3 LEU A 33 -4.280 10.947 -9.984 1.00 0.84 H new ATOM 0 HG LEU A 33 -3.395 9.382 -11.854 1.00 0.93 H new ATOM 0 HD11 LEU A 33 -2.077 7.463 -11.086 1.00 1.94 H new ATOM 0 HD12 LEU A 33 -1.157 8.986 -11.034 1.00 1.94 H new ATOM 0 HD13 LEU A 33 -1.801 8.284 -9.531 1.00 1.94 H new ATOM 0 HD21 LEU A 33 -4.488 7.433 -10.697 1.00 2.58 H new ATOM 0 HD22 LEU A 33 -4.358 8.304 -9.150 1.00 2.58 H new ATOM 0 HD23 LEU A 33 -5.397 8.942 -10.446 1.00 2.58 H new ATOM 520 N SER A 34 -3.441 13.923 -11.272 1.00 0.89 N ATOM 521 CA SER A 34 -4.030 15.184 -10.831 1.00 1.06 C ATOM 522 C SER A 34 -5.472 14.952 -10.381 1.00 0.91 C ATOM 523 O SER A 34 -5.964 13.830 -10.439 1.00 0.81 O ATOM 524 CB SER A 34 -3.949 16.256 -11.920 1.00 1.57 C ATOM 525 OG SER A 34 -4.208 17.523 -11.337 1.00 2.72 O ATOM 0 H SER A 34 -3.481 13.777 -12.281 1.00 0.89 H new ATOM 0 HA SER A 34 -3.455 15.556 -9.983 1.00 1.06 H new ATOM 0 HB2 SER A 34 -2.962 16.249 -12.383 1.00 1.57 H new ATOM 0 HB3 SER A 34 -4.673 16.048 -12.708 1.00 1.57 H new ATOM 0 HG SER A 34 -3.609 17.661 -10.574 1.00 2.72 H new ATOM 531 N VAL A 35 -6.144 15.992 -9.888 1.00 1.02 N ATOM 532 CA VAL A 35 -7.375 15.833 -9.117 1.00 1.01 C ATOM 533 C VAL A 35 -8.451 15.034 -9.867 1.00 0.96 C ATOM 534 O VAL A 35 -8.996 14.080 -9.312 1.00 0.88 O ATOM 535 CB VAL A 35 -7.884 17.176 -8.559 1.00 1.22 C ATOM 536 CG1 VAL A 35 -6.755 17.930 -7.848 1.00 2.78 C ATOM 537 CG2 VAL A 35 -8.515 18.092 -9.613 1.00 2.06 C ATOM 0 H VAL A 35 -5.852 16.962 -10.011 1.00 1.02 H new ATOM 0 HA VAL A 35 -7.125 15.222 -8.249 1.00 1.01 H new ATOM 0 HB VAL A 35 -8.673 16.913 -7.854 1.00 1.22 H new ATOM 0 HG11 VAL A 35 -7.136 18.875 -7.462 1.00 2.78 H new ATOM 0 HG12 VAL A 35 -6.378 17.326 -7.023 1.00 2.78 H new ATOM 0 HG13 VAL A 35 -5.947 18.125 -8.553 1.00 2.78 H new ATOM 0 HG21 VAL A 35 -8.848 19.016 -9.140 1.00 2.06 H new ATOM 0 HG22 VAL A 35 -7.778 18.323 -10.382 1.00 2.06 H new ATOM 0 HG23 VAL A 35 -9.369 17.589 -10.068 1.00 2.06 H new ATOM 547 N ASN A 36 -8.756 15.390 -11.123 1.00 1.04 N ATOM 548 CA ASN A 36 -9.765 14.653 -11.879 1.00 1.05 C ATOM 549 C ASN A 36 -9.316 13.207 -12.066 1.00 0.98 C ATOM 550 O ASN A 36 -10.002 12.311 -11.596 1.00 0.99 O ATOM 551 CB ASN A 36 -10.112 15.299 -13.225 1.00 1.17 C ATOM 552 CG ASN A 36 -11.003 14.350 -14.032 1.00 1.18 C ATOM 553 OD1 ASN A 36 -10.628 13.929 -15.120 1.00 2.07 O ATOM 554 ND2 ASN A 36 -12.152 13.972 -13.477 1.00 2.53 N ATOM 0 H ASN A 36 -8.326 16.168 -11.624 1.00 1.04 H new ATOM 0 HA ASN A 36 -10.684 14.679 -11.294 1.00 1.05 H new ATOM 0 HB2 ASN A 36 -10.625 16.247 -13.064 1.00 1.17 H new ATOM 0 HB3 ASN A 36 -9.200 15.520 -13.780 1.00 1.17 H new ATOM 0 HD21 ASN A 36 -12.757 13.308 -13.960 1.00 2.53 H new ATOM 0 HD22 ASN A 36 -12.427 14.347 -12.569 1.00 2.53 H new ATOM 561 N GLU A 37 -8.141 13.000 -12.672 1.00 0.96 N ATOM 562 CA GLU A 37 -7.486 11.699 -12.827 1.00 0.95 C ATOM 563 C GLU A 37 -7.680 10.843 -11.579 1.00 0.85 C ATOM 564 O GLU A 37 -8.096 9.688 -11.638 1.00 0.90 O ATOM 565 CB GLU A 37 -5.978 11.951 -13.003 1.00 1.02 C ATOM 566 CG GLU A 37 -5.501 11.727 -14.433 1.00 0.90 C ATOM 567 CD GLU A 37 -4.087 12.272 -14.622 1.00 1.03 C ATOM 568 OE1 GLU A 37 -3.598 13.093 -13.820 1.00 2.15 O ATOM 569 OE2 GLU A 37 -3.336 11.873 -15.532 1.00 1.48 O ATOM 0 H GLU A 37 -7.602 13.763 -13.082 1.00 0.96 H new ATOM 0 HA GLU A 37 -7.915 11.179 -13.684 1.00 0.95 H new ATOM 0 HB2 GLU A 37 -5.749 12.974 -12.705 1.00 1.02 H new ATOM 0 HB3 GLU A 37 -5.424 11.293 -12.334 1.00 1.02 H new ATOM 0 HG2 GLU A 37 -5.520 10.662 -14.665 1.00 0.90 H new ATOM 0 HG3 GLU A 37 -6.181 12.217 -15.130 1.00 0.90 H new ATOM 576 N PHE A 38 -7.365 11.445 -10.438 1.00 0.78 N ATOM 577 CA PHE A 38 -7.516 10.831 -9.146 1.00 0.78 C ATOM 578 C PHE A 38 -8.968 10.435 -8.918 1.00 0.78 C ATOM 579 O PHE A 38 -9.267 9.285 -8.585 1.00 0.80 O ATOM 580 CB PHE A 38 -7.025 11.790 -8.057 1.00 0.79 C ATOM 581 CG PHE A 38 -6.367 11.033 -6.939 1.00 1.11 C ATOM 582 CD1 PHE A 38 -7.130 10.107 -6.214 1.00 1.64 C ATOM 583 CD2 PHE A 38 -4.967 10.965 -6.905 1.00 2.98 C ATOM 584 CE1 PHE A 38 -6.494 9.074 -5.518 1.00 2.27 C ATOM 585 CE2 PHE A 38 -4.331 10.016 -6.092 1.00 3.72 C ATOM 586 CZ PHE A 38 -5.091 9.032 -5.445 1.00 2.94 C ATOM 0 H PHE A 38 -6.991 12.393 -10.396 1.00 0.78 H new ATOM 0 HA PHE A 38 -6.912 9.925 -9.103 1.00 0.78 H new ATOM 0 HB2 PHE A 38 -6.320 12.503 -8.484 1.00 0.79 H new ATOM 0 HB3 PHE A 38 -7.864 12.366 -7.668 1.00 0.79 H new ATOM 0 HD1 PHE A 38 -8.207 10.191 -6.193 1.00 1.64 H new ATOM 0 HD2 PHE A 38 -4.379 11.643 -7.505 1.00 2.98 H new ATOM 0 HE1 PHE A 38 -7.082 8.307 -5.036 1.00 2.27 H new ATOM 0 HE2 PHE A 38 -3.259 10.043 -5.965 1.00 3.72 H new ATOM 0 HZ PHE A 38 -4.600 8.244 -4.892 1.00 2.94 H new ATOM 596 N LYS A 39 -9.884 11.394 -9.078 1.00 0.80 N ATOM 597 CA LYS A 39 -11.271 11.146 -8.763 1.00 0.87 C ATOM 598 C LYS A 39 -11.811 10.016 -9.633 1.00 0.87 C ATOM 599 O LYS A 39 -12.598 9.193 -9.161 1.00 0.87 O ATOM 600 CB LYS A 39 -12.148 12.404 -8.826 1.00 0.97 C ATOM 601 CG LYS A 39 -13.523 12.015 -8.259 1.00 1.04 C ATOM 602 CD LYS A 39 -14.486 13.187 -8.066 1.00 1.19 C ATOM 603 CE LYS A 39 -15.782 12.693 -7.398 1.00 1.65 C ATOM 604 NZ LYS A 39 -16.483 11.659 -8.199 1.00 3.24 N ATOM 0 H LYS A 39 -9.683 12.334 -9.420 1.00 0.80 H new ATOM 0 HA LYS A 39 -11.315 10.831 -7.720 1.00 0.87 H new ATOM 0 HB2 LYS A 39 -11.705 13.213 -8.246 1.00 0.97 H new ATOM 0 HB3 LYS A 39 -12.240 12.761 -9.852 1.00 0.97 H new ATOM 0 HG2 LYS A 39 -13.985 11.288 -8.928 1.00 1.04 H new ATOM 0 HG3 LYS A 39 -13.379 11.518 -7.299 1.00 1.04 H new ATOM 0 HD2 LYS A 39 -14.019 13.956 -7.450 1.00 1.19 H new ATOM 0 HD3 LYS A 39 -14.714 13.645 -9.029 1.00 1.19 H new ATOM 0 HE2 LYS A 39 -15.546 12.286 -6.414 1.00 1.65 H new ATOM 0 HE3 LYS A 39 -16.450 13.540 -7.241 1.00 1.65 H new ATOM 0 HZ1 LYS A 39 -17.460 11.558 -7.857 1.00 3.24 H new ATOM 0 HZ2 LYS A 39 -16.494 11.943 -9.199 1.00 3.24 H new ATOM 0 HZ3 LYS A 39 -15.987 10.750 -8.103 1.00 3.24 H new ATOM 618 N GLU A 40 -11.383 9.958 -10.891 1.00 0.88 N ATOM 619 CA GLU A 40 -11.774 8.885 -11.777 1.00 0.89 C ATOM 620 C GLU A 40 -11.466 7.520 -11.153 1.00 0.83 C ATOM 621 O GLU A 40 -12.276 6.610 -11.282 1.00 0.86 O ATOM 622 CB GLU A 40 -11.153 9.066 -13.170 1.00 0.93 C ATOM 623 CG GLU A 40 -11.581 10.395 -13.819 1.00 1.14 C ATOM 624 CD GLU A 40 -13.081 10.551 -14.033 1.00 2.66 C ATOM 625 OE1 GLU A 40 -13.757 9.511 -14.189 1.00 3.54 O ATOM 626 OE2 GLU A 40 -13.522 11.722 -14.016 1.00 3.63 O ATOM 0 H GLU A 40 -10.763 10.649 -11.314 1.00 0.88 H new ATOM 0 HA GLU A 40 -12.854 8.923 -11.917 1.00 0.89 H new ATOM 0 HB2 GLU A 40 -10.066 9.034 -13.090 1.00 0.93 H new ATOM 0 HB3 GLU A 40 -11.450 8.236 -13.811 1.00 0.93 H new ATOM 0 HG2 GLU A 40 -11.231 11.217 -13.195 1.00 1.14 H new ATOM 0 HG3 GLU A 40 -11.080 10.490 -14.782 1.00 1.14 H new ATOM 633 N LEU A 41 -10.353 7.354 -10.428 1.00 0.78 N ATOM 634 CA LEU A 41 -10.028 6.047 -9.867 1.00 0.75 C ATOM 635 C LEU A 41 -11.032 5.706 -8.771 1.00 0.79 C ATOM 636 O LEU A 41 -11.560 4.595 -8.730 1.00 0.82 O ATOM 637 CB LEU A 41 -8.586 6.016 -9.335 1.00 0.74 C ATOM 638 CG LEU A 41 -8.125 4.620 -8.861 1.00 0.78 C ATOM 639 CD1 LEU A 41 -8.034 3.619 -10.017 1.00 2.38 C ATOM 640 CD2 LEU A 41 -6.739 4.746 -8.224 1.00 2.04 C ATOM 0 H LEU A 41 -9.680 8.092 -10.222 1.00 0.78 H new ATOM 0 HA LEU A 41 -10.094 5.294 -10.652 1.00 0.75 H new ATOM 0 HB2 LEU A 41 -7.912 6.364 -10.118 1.00 0.74 H new ATOM 0 HB3 LEU A 41 -8.500 6.718 -8.505 1.00 0.74 H new ATOM 0 HG LEU A 41 -8.862 4.252 -8.147 1.00 0.78 H new ATOM 0 HD11 LEU A 41 -7.706 2.652 -9.636 1.00 2.38 H new ATOM 0 HD12 LEU A 41 -9.013 3.512 -10.484 1.00 2.38 H new ATOM 0 HD13 LEU A 41 -7.318 3.980 -10.755 1.00 2.38 H new ATOM 0 HD21 LEU A 41 -6.404 3.766 -7.886 1.00 2.04 H new ATOM 0 HD22 LEU A 41 -6.035 5.137 -8.959 1.00 2.04 H new ATOM 0 HD23 LEU A 41 -6.790 5.426 -7.373 1.00 2.04 H new ATOM 652 N VAL A 42 -11.309 6.673 -7.892 1.00 0.82 N ATOM 653 CA VAL A 42 -12.144 6.432 -6.724 1.00 0.92 C ATOM 654 C VAL A 42 -13.584 6.200 -7.171 1.00 1.00 C ATOM 655 O VAL A 42 -14.289 5.349 -6.641 1.00 1.15 O ATOM 656 CB VAL A 42 -11.991 7.544 -5.668 1.00 0.98 C ATOM 657 CG1 VAL A 42 -10.515 7.792 -5.329 1.00 1.22 C ATOM 658 CG2 VAL A 42 -12.699 8.861 -5.971 1.00 0.98 C ATOM 0 H VAL A 42 -10.964 7.630 -7.972 1.00 0.82 H new ATOM 0 HA VAL A 42 -11.810 5.526 -6.219 1.00 0.92 H new ATOM 0 HB VAL A 42 -12.514 7.146 -4.798 1.00 0.98 H new ATOM 0 HG11 VAL A 42 -10.441 8.582 -4.581 1.00 1.22 H new ATOM 0 HG12 VAL A 42 -10.073 6.877 -4.935 1.00 1.22 H new ATOM 0 HG13 VAL A 42 -9.981 8.094 -6.230 1.00 1.22 H new ATOM 0 HG21 VAL A 42 -12.520 9.566 -5.159 1.00 0.98 H new ATOM 0 HG22 VAL A 42 -12.313 9.276 -6.902 1.00 0.98 H new ATOM 0 HG23 VAL A 42 -13.770 8.684 -6.069 1.00 0.98 H new ATOM 668 N THR A 43 -13.999 6.960 -8.180 1.00 0.96 N ATOM 669 CA THR A 43 -15.317 6.881 -8.771 1.00 1.07 C ATOM 670 C THR A 43 -15.475 5.562 -9.542 1.00 1.04 C ATOM 671 O THR A 43 -16.518 4.921 -9.450 1.00 1.14 O ATOM 672 CB THR A 43 -15.495 8.129 -9.645 1.00 1.15 C ATOM 673 OG1 THR A 43 -15.302 9.282 -8.837 1.00 1.23 O ATOM 674 CG2 THR A 43 -16.875 8.208 -10.302 1.00 1.35 C ATOM 0 H THR A 43 -13.406 7.666 -8.616 1.00 0.96 H new ATOM 0 HA THR A 43 -16.104 6.870 -8.017 1.00 1.07 H new ATOM 0 HB THR A 43 -14.760 8.073 -10.448 1.00 1.15 H new ATOM 0 HG1 THR A 43 -14.345 9.402 -8.662 1.00 1.23 H new ATOM 0 HG21 THR A 43 -16.939 9.113 -10.907 1.00 1.35 H new ATOM 0 HG22 THR A 43 -17.026 7.335 -10.937 1.00 1.35 H new ATOM 0 HG23 THR A 43 -17.644 8.232 -9.530 1.00 1.35 H new ATOM 682 N GLN A 44 -14.456 5.164 -10.313 1.00 0.97 N ATOM 683 CA GLN A 44 -14.532 4.012 -11.197 1.00 1.00 C ATOM 684 C GLN A 44 -14.330 2.695 -10.435 1.00 1.00 C ATOM 685 O GLN A 44 -15.193 1.822 -10.474 1.00 1.10 O ATOM 686 CB GLN A 44 -13.503 4.185 -12.327 1.00 1.04 C ATOM 687 CG GLN A 44 -13.640 3.117 -13.418 1.00 1.25 C ATOM 688 CD GLN A 44 -12.468 3.187 -14.388 1.00 1.44 C ATOM 689 OE1 GLN A 44 -11.762 2.207 -14.594 1.00 2.07 O ATOM 690 NE2 GLN A 44 -12.216 4.361 -14.961 1.00 1.90 N ATOM 0 H GLN A 44 -13.554 5.640 -10.336 1.00 0.97 H new ATOM 0 HA GLN A 44 -15.531 3.957 -11.630 1.00 1.00 H new ATOM 0 HB2 GLN A 44 -13.622 5.172 -12.773 1.00 1.04 H new ATOM 0 HB3 GLN A 44 -12.498 4.144 -11.907 1.00 1.04 H new ATOM 0 HG2 GLN A 44 -13.683 2.128 -12.962 1.00 1.25 H new ATOM 0 HG3 GLN A 44 -14.576 3.260 -13.959 1.00 1.25 H new ATOM 0 HE21 GLN A 44 -12.820 5.161 -14.772 1.00 1.90 H new ATOM 0 HE22 GLN A 44 -11.419 4.461 -15.589 1.00 1.90 H new ATOM 699 N GLN A 45 -13.171 2.516 -9.793 1.00 1.00 N ATOM 700 CA GLN A 45 -12.766 1.210 -9.266 1.00 1.17 C ATOM 701 C GLN A 45 -13.441 0.866 -7.936 1.00 1.14 C ATOM 702 O GLN A 45 -13.724 -0.307 -7.711 1.00 2.33 O ATOM 703 CB GLN A 45 -11.235 1.129 -9.129 1.00 1.75 C ATOM 704 CG GLN A 45 -10.556 0.422 -10.321 1.00 2.30 C ATOM 705 CD GLN A 45 -10.345 -1.093 -10.149 1.00 2.75 C ATOM 706 OE1 GLN A 45 -10.498 -1.649 -9.061 1.00 3.91 O ATOM 707 NE2 GLN A 45 -9.944 -1.750 -11.235 1.00 2.88 N ATOM 0 H GLN A 45 -12.496 3.262 -9.626 1.00 1.00 H new ATOM 0 HA GLN A 45 -13.101 0.467 -9.990 1.00 1.17 H new ATOM 0 HB2 GLN A 45 -10.831 2.137 -9.034 1.00 1.75 H new ATOM 0 HB3 GLN A 45 -10.986 0.598 -8.210 1.00 1.75 H new ATOM 0 HG2 GLN A 45 -11.158 0.590 -11.214 1.00 2.30 H new ATOM 0 HG3 GLN A 45 -9.588 0.890 -10.497 1.00 2.30 H new ATOM 0 HE21 GLN A 45 -9.829 -1.253 -12.118 1.00 2.88 H new ATOM 0 HE22 GLN A 45 -9.752 -2.750 -11.184 1.00 2.88 H new ATOM 716 N LEU A 46 -13.632 1.849 -7.047 1.00 0.86 N ATOM 717 CA LEU A 46 -13.969 1.654 -5.631 1.00 0.79 C ATOM 718 C LEU A 46 -15.458 1.918 -5.359 1.00 0.96 C ATOM 719 O LEU A 46 -15.802 3.013 -4.913 1.00 1.34 O ATOM 720 CB LEU A 46 -13.081 2.597 -4.802 1.00 0.83 C ATOM 721 CG LEU A 46 -11.630 2.092 -4.846 1.00 1.00 C ATOM 722 CD1 LEU A 46 -10.636 3.134 -5.363 1.00 2.11 C ATOM 723 CD2 LEU A 46 -11.211 1.544 -3.495 1.00 2.29 C ATOM 0 H LEU A 46 -13.554 2.834 -7.302 1.00 0.86 H new ATOM 0 HA LEU A 46 -13.786 0.617 -5.351 1.00 0.79 H new ATOM 0 HB2 LEU A 46 -13.138 3.611 -5.197 1.00 0.83 H new ATOM 0 HB3 LEU A 46 -13.434 2.636 -3.772 1.00 0.83 H new ATOM 0 HG LEU A 46 -11.607 1.281 -5.574 1.00 1.00 H new ATOM 0 HD11 LEU A 46 -9.632 2.709 -5.367 1.00 2.11 H new ATOM 0 HD12 LEU A 46 -10.910 3.427 -6.377 1.00 2.11 H new ATOM 0 HD13 LEU A 46 -10.657 4.010 -4.714 1.00 2.11 H new ATOM 0 HD21 LEU A 46 -10.181 1.192 -3.549 1.00 2.29 H new ATOM 0 HD22 LEU A 46 -11.287 2.330 -2.744 1.00 2.29 H new ATOM 0 HD23 LEU A 46 -11.864 0.715 -3.220 1.00 2.29 H new ATOM 735 N PRO A 47 -16.364 0.947 -5.577 1.00 0.87 N ATOM 736 CA PRO A 47 -17.777 1.121 -5.307 1.00 1.06 C ATOM 737 C PRO A 47 -18.052 1.321 -3.818 1.00 1.18 C ATOM 738 O PRO A 47 -19.026 2.007 -3.497 1.00 1.62 O ATOM 739 CB PRO A 47 -18.471 -0.140 -5.830 1.00 1.10 C ATOM 740 CG PRO A 47 -17.384 -1.202 -5.700 1.00 1.00 C ATOM 741 CD PRO A 47 -16.132 -0.403 -6.051 1.00 0.85 C ATOM 0 HA PRO A 47 -18.154 2.017 -5.800 1.00 1.06 H new ATOM 0 HB2 PRO A 47 -19.353 -0.390 -5.241 1.00 1.10 H new ATOM 0 HB3 PRO A 47 -18.800 -0.022 -6.862 1.00 1.10 H new ATOM 0 HG2 PRO A 47 -17.336 -1.618 -4.694 1.00 1.00 H new ATOM 0 HG3 PRO A 47 -17.543 -2.037 -6.383 1.00 1.00 H new ATOM 0 HD2 PRO A 47 -15.250 -0.835 -5.578 1.00 0.85 H new ATOM 0 HD3 PRO A 47 -15.954 -0.412 -7.126 1.00 0.85 H new ATOM 749 N HIS A 48 -17.266 0.718 -2.905 1.00 1.17 N ATOM 750 CA HIS A 48 -17.620 0.820 -1.493 1.00 1.41 C ATOM 751 C HIS A 48 -16.496 0.805 -0.462 1.00 1.24 C ATOM 752 O HIS A 48 -16.795 1.017 0.710 1.00 1.75 O ATOM 753 CB HIS A 48 -18.766 -0.139 -1.128 1.00 1.81 C ATOM 754 CG HIS A 48 -19.956 0.620 -0.598 1.00 2.75 C ATOM 755 ND1 HIS A 48 -20.637 1.587 -1.301 1.00 4.34 N ATOM 756 CD2 HIS A 48 -20.365 0.692 0.706 1.00 2.95 C ATOM 757 CE1 HIS A 48 -21.460 2.210 -0.442 1.00 4.99 C ATOM 758 NE2 HIS A 48 -21.323 1.710 0.798 1.00 4.05 N ATOM 0 H HIS A 48 -16.423 0.182 -3.113 1.00 1.17 H new ATOM 0 HA HIS A 48 -17.964 1.851 -1.413 1.00 1.41 H new ATOM 0 HB2 HIS A 48 -19.058 -0.713 -2.007 1.00 1.81 H new ATOM 0 HB3 HIS A 48 -18.423 -0.854 -0.380 1.00 1.81 H new ATOM 0 HD1 HIS A 48 -20.535 1.793 -2.295 1.00 4.34 H new ATOM 0 HD2 HIS A 48 -20.012 0.074 1.519 1.00 2.95 H new ATOM 0 HE1 HIS A 48 -22.140 3.005 -0.711 1.00 4.99 H new ATOM 766 N LEU A 49 -15.229 0.634 -0.843 1.00 1.02 N ATOM 767 CA LEU A 49 -14.142 0.740 0.126 1.00 0.95 C ATOM 768 C LEU A 49 -14.143 2.118 0.781 1.00 0.96 C ATOM 769 O LEU A 49 -14.349 2.262 1.985 1.00 1.21 O ATOM 770 CB LEU A 49 -12.801 0.499 -0.574 1.00 1.03 C ATOM 771 CG LEU A 49 -11.686 -0.093 0.287 1.00 0.97 C ATOM 772 CD1 LEU A 49 -12.093 -1.369 1.025 1.00 0.98 C ATOM 773 CD2 LEU A 49 -10.545 -0.503 -0.643 1.00 1.14 C ATOM 0 H LEU A 49 -14.936 0.425 -1.797 1.00 1.02 H new ATOM 0 HA LEU A 49 -14.288 -0.014 0.900 1.00 0.95 H new ATOM 0 HB2 LEU A 49 -12.971 -0.167 -1.420 1.00 1.03 H new ATOM 0 HB3 LEU A 49 -12.452 1.448 -0.981 1.00 1.03 H new ATOM 0 HG LEU A 49 -11.421 0.668 1.021 1.00 0.97 H new ATOM 0 HD11 LEU A 49 -11.252 -1.732 1.615 1.00 0.98 H new ATOM 0 HD12 LEU A 49 -12.934 -1.155 1.685 1.00 0.98 H new ATOM 0 HD13 LEU A 49 -12.384 -2.131 0.302 1.00 0.98 H new ATOM 0 HD21 LEU A 49 -9.732 -0.930 -0.055 1.00 1.14 H new ATOM 0 HD22 LEU A 49 -10.905 -1.244 -1.356 1.00 1.14 H new ATOM 0 HD23 LEU A 49 -10.182 0.372 -1.182 1.00 1.14 H new ATOM 785 N LEU A 50 -13.898 3.151 -0.030 1.00 0.89 N ATOM 786 CA LEU A 50 -13.779 4.503 0.493 1.00 1.03 C ATOM 787 C LEU A 50 -15.156 5.104 0.774 1.00 1.46 C ATOM 788 O LEU A 50 -15.337 5.770 1.791 1.00 3.10 O ATOM 789 CB LEU A 50 -12.981 5.366 -0.493 1.00 0.94 C ATOM 790 CG LEU A 50 -11.492 4.975 -0.532 1.00 1.18 C ATOM 791 CD1 LEU A 50 -10.864 5.535 -1.814 1.00 1.57 C ATOM 792 CD2 LEU A 50 -10.739 5.541 0.680 1.00 1.54 C ATOM 0 H LEU A 50 -13.780 3.073 -1.040 1.00 0.89 H new ATOM 0 HA LEU A 50 -13.243 4.473 1.442 1.00 1.03 H new ATOM 0 HB2 LEU A 50 -13.408 5.265 -1.491 1.00 0.94 H new ATOM 0 HB3 LEU A 50 -13.073 6.415 -0.212 1.00 0.94 H new ATOM 0 HG LEU A 50 -11.418 3.888 -0.509 1.00 1.18 H new ATOM 0 HD11 LEU A 50 -9.809 5.263 -1.851 1.00 1.57 H new ATOM 0 HD12 LEU A 50 -11.376 5.119 -2.682 1.00 1.57 H new ATOM 0 HD13 LEU A 50 -10.960 6.621 -1.822 1.00 1.57 H new ATOM 0 HD21 LEU A 50 -9.690 5.249 0.626 1.00 1.54 H new ATOM 0 HD22 LEU A 50 -10.813 6.628 0.679 1.00 1.54 H new ATOM 0 HD23 LEU A 50 -11.178 5.148 1.597 1.00 1.54 H new ATOM 804 N LYS A 51 -16.112 4.883 -0.143 1.00 1.08 N ATOM 805 CA LYS A 51 -17.446 5.472 -0.250 1.00 1.15 C ATOM 806 C LYS A 51 -17.569 6.881 0.334 1.00 1.22 C ATOM 807 O LYS A 51 -18.561 7.240 0.970 1.00 2.40 O ATOM 808 CB LYS A 51 -18.489 4.473 0.244 1.00 1.49 C ATOM 809 CG LYS A 51 -18.067 3.748 1.526 1.00 2.19 C ATOM 810 CD LYS A 51 -18.205 4.594 2.789 1.00 2.81 C ATOM 811 CE LYS A 51 -19.684 4.887 3.048 1.00 3.44 C ATOM 812 NZ LYS A 51 -20.007 6.327 2.989 1.00 4.41 N ATOM 0 H LYS A 51 -15.948 4.220 -0.901 1.00 1.08 H new ATOM 0 HA LYS A 51 -17.647 5.657 -1.305 1.00 1.15 H new ATOM 0 HB2 LYS A 51 -19.429 4.996 0.422 1.00 1.49 H new ATOM 0 HB3 LYS A 51 -18.677 3.737 -0.538 1.00 1.49 H new ATOM 0 HG2 LYS A 51 -18.669 2.846 1.637 1.00 2.19 H new ATOM 0 HG3 LYS A 51 -17.030 3.428 1.426 1.00 2.19 H new ATOM 0 HD2 LYS A 51 -17.773 4.068 3.641 1.00 2.81 H new ATOM 0 HD3 LYS A 51 -17.653 5.527 2.677 1.00 2.81 H new ATOM 0 HE2 LYS A 51 -20.288 4.355 2.313 1.00 3.44 H new ATOM 0 HE3 LYS A 51 -19.959 4.499 4.029 1.00 3.44 H new ATOM 0 HZ1 LYS A 51 -21.019 6.448 2.782 1.00 4.41 H new ATOM 0 HZ2 LYS A 51 -19.786 6.770 3.903 1.00 4.41 H new ATOM 0 HZ3 LYS A 51 -19.444 6.779 2.240 1.00 4.41 H new ATOM 826 N ASP A 52 -16.532 7.665 0.073 1.00 1.96 N ATOM 827 CA ASP A 52 -16.313 9.028 0.540 1.00 2.25 C ATOM 828 C ASP A 52 -15.802 9.887 -0.627 1.00 1.91 C ATOM 829 O ASP A 52 -15.139 10.908 -0.456 1.00 1.99 O ATOM 830 CB ASP A 52 -15.325 8.942 1.707 1.00 2.95 C ATOM 831 CG ASP A 52 -15.165 10.223 2.501 1.00 3.67 C ATOM 832 OD1 ASP A 52 -15.950 11.168 2.287 1.00 3.74 O ATOM 833 OD2 ASP A 52 -14.263 10.203 3.374 1.00 5.05 O ATOM 0 H ASP A 52 -15.764 7.341 -0.515 1.00 1.96 H new ATOM 0 HA ASP A 52 -17.227 9.506 0.891 1.00 2.25 H new ATOM 0 HB2 ASP A 52 -15.650 8.151 2.382 1.00 2.95 H new ATOM 0 HB3 ASP A 52 -14.350 8.648 1.318 1.00 2.95 H new ATOM 838 N VAL A 53 -16.133 9.457 -1.850 1.00 1.72 N ATOM 839 CA VAL A 53 -15.727 10.107 -3.089 1.00 1.57 C ATOM 840 C VAL A 53 -16.206 11.562 -3.123 1.00 1.70 C ATOM 841 O VAL A 53 -15.570 12.417 -3.736 1.00 2.07 O ATOM 842 CB VAL A 53 -16.226 9.295 -4.300 1.00 1.50 C ATOM 843 CG1 VAL A 53 -15.715 7.848 -4.234 1.00 2.01 C ATOM 844 CG2 VAL A 53 -17.755 9.275 -4.426 1.00 1.98 C ATOM 0 H VAL A 53 -16.705 8.626 -2.003 1.00 1.72 H new ATOM 0 HA VAL A 53 -14.639 10.135 -3.139 1.00 1.57 H new ATOM 0 HB VAL A 53 -15.825 9.799 -5.179 1.00 1.50 H new ATOM 0 HG11 VAL A 53 -16.080 7.294 -5.099 1.00 2.01 H new ATOM 0 HG12 VAL A 53 -14.625 7.847 -4.235 1.00 2.01 H new ATOM 0 HG13 VAL A 53 -16.077 7.375 -3.321 1.00 2.01 H new ATOM 0 HG21 VAL A 53 -18.041 8.687 -5.298 1.00 1.98 H new ATOM 0 HG22 VAL A 53 -18.188 8.830 -3.530 1.00 1.98 H new ATOM 0 HG23 VAL A 53 -18.124 10.294 -4.539 1.00 1.98 H new ATOM 854 N GLY A 54 -17.324 11.837 -2.442 1.00 1.60 N ATOM 855 CA GLY A 54 -17.839 13.176 -2.234 1.00 1.83 C ATOM 856 C GLY A 54 -16.747 14.141 -1.774 1.00 1.75 C ATOM 857 O GLY A 54 -16.697 15.265 -2.262 1.00 1.98 O ATOM 0 H GLY A 54 -17.901 11.113 -2.015 1.00 1.60 H new ATOM 0 HA2 GLY A 54 -18.281 13.543 -3.160 1.00 1.83 H new ATOM 0 HA3 GLY A 54 -18.635 13.147 -1.490 1.00 1.83 H new ATOM 861 N SER A 55 -15.867 13.706 -0.859 1.00 1.74 N ATOM 862 CA SER A 55 -14.825 14.563 -0.311 1.00 1.70 C ATOM 863 C SER A 55 -13.460 14.225 -0.911 1.00 1.51 C ATOM 864 O SER A 55 -12.435 14.320 -0.232 1.00 1.76 O ATOM 865 CB SER A 55 -14.818 14.431 1.217 1.00 2.01 C ATOM 866 OG SER A 55 -14.395 13.134 1.595 1.00 3.33 O ATOM 0 H SER A 55 -15.864 12.757 -0.486 1.00 1.74 H new ATOM 0 HA SER A 55 -15.035 15.600 -0.574 1.00 1.70 H new ATOM 0 HB2 SER A 55 -14.154 15.179 1.651 1.00 2.01 H new ATOM 0 HB3 SER A 55 -15.816 14.625 1.610 1.00 2.01 H new ATOM 0 HG SER A 55 -15.177 12.589 1.824 1.00 3.33 H new ATOM 872 N LEU A 56 -13.407 13.825 -2.186 1.00 1.29 N ATOM 873 CA LEU A 56 -12.157 13.491 -2.832 1.00 1.22 C ATOM 874 C LEU A 56 -11.162 14.650 -2.711 1.00 1.18 C ATOM 875 O LEU A 56 -9.979 14.414 -2.512 1.00 1.25 O ATOM 876 CB LEU A 56 -12.471 13.059 -4.267 1.00 1.16 C ATOM 877 CG LEU A 56 -11.274 12.621 -5.115 1.00 1.15 C ATOM 878 CD1 LEU A 56 -10.545 13.821 -5.720 1.00 1.06 C ATOM 879 CD2 LEU A 56 -10.341 11.673 -4.363 1.00 1.30 C ATOM 0 H LEU A 56 -14.227 13.728 -2.785 1.00 1.29 H new ATOM 0 HA LEU A 56 -11.658 12.654 -2.343 1.00 1.22 H new ATOM 0 HB2 LEU A 56 -13.184 12.236 -4.229 1.00 1.16 H new ATOM 0 HB3 LEU A 56 -12.966 13.887 -4.774 1.00 1.16 H new ATOM 0 HG LEU A 56 -11.667 12.042 -5.951 1.00 1.15 H new ATOM 0 HD11 LEU A 56 -9.701 13.472 -6.315 1.00 1.06 H new ATOM 0 HD12 LEU A 56 -11.231 14.381 -6.356 1.00 1.06 H new ATOM 0 HD13 LEU A 56 -10.182 14.467 -4.921 1.00 1.06 H new ATOM 0 HD21 LEU A 56 -9.509 11.393 -5.009 1.00 1.30 H new ATOM 0 HD22 LEU A 56 -9.957 12.171 -3.472 1.00 1.30 H new ATOM 0 HD23 LEU A 56 -10.890 10.778 -4.070 1.00 1.30 H new ATOM 891 N ASP A 57 -11.624 15.901 -2.751 1.00 1.19 N ATOM 892 CA ASP A 57 -10.775 17.062 -2.509 1.00 1.29 C ATOM 893 C ASP A 57 -10.068 16.983 -1.146 1.00 1.29 C ATOM 894 O ASP A 57 -8.921 17.418 -1.006 1.00 1.38 O ATOM 895 CB ASP A 57 -11.629 18.335 -2.591 1.00 1.52 C ATOM 896 CG ASP A 57 -12.441 18.507 -1.318 1.00 2.82 C ATOM 897 OD1 ASP A 57 -13.277 17.614 -1.068 1.00 3.49 O ATOM 898 OD2 ASP A 57 -12.083 19.434 -0.555 1.00 4.16 O ATOM 0 H ASP A 57 -12.596 16.134 -2.952 1.00 1.19 H new ATOM 0 HA ASP A 57 -9.998 17.083 -3.273 1.00 1.29 H new ATOM 0 HB2 ASP A 57 -10.987 19.203 -2.741 1.00 1.52 H new ATOM 0 HB3 ASP A 57 -12.296 18.279 -3.451 1.00 1.52 H new ATOM 903 N GLU A 58 -10.766 16.523 -0.106 1.00 1.30 N ATOM 904 CA GLU A 58 -10.220 16.371 1.234 1.00 1.37 C ATOM 905 C GLU A 58 -9.204 15.236 1.203 1.00 1.18 C ATOM 906 O GLU A 58 -8.069 15.390 1.658 1.00 1.21 O ATOM 907 CB GLU A 58 -11.349 16.078 2.228 1.00 1.53 C ATOM 908 CG GLU A 58 -10.827 15.961 3.663 1.00 2.18 C ATOM 909 CD GLU A 58 -11.925 15.466 4.592 1.00 2.34 C ATOM 910 OE1 GLU A 58 -12.224 14.254 4.498 1.00 2.43 O ATOM 911 OE2 GLU A 58 -12.458 16.301 5.349 1.00 3.24 O ATOM 0 H GLU A 58 -11.744 16.242 -0.178 1.00 1.30 H new ATOM 0 HA GLU A 58 -9.729 17.289 1.557 1.00 1.37 H new ATOM 0 HB2 GLU A 58 -12.094 16.872 2.176 1.00 1.53 H new ATOM 0 HB3 GLU A 58 -11.850 15.152 1.947 1.00 1.53 H new ATOM 0 HG2 GLU A 58 -9.981 15.275 3.693 1.00 2.18 H new ATOM 0 HG3 GLU A 58 -10.464 16.930 4.004 1.00 2.18 H new ATOM 918 N LYS A 59 -9.618 14.099 0.638 1.00 1.03 N ATOM 919 CA LYS A 59 -8.735 12.955 0.484 1.00 0.93 C ATOM 920 C LYS A 59 -7.446 13.399 -0.229 1.00 0.91 C ATOM 921 O LYS A 59 -6.354 13.047 0.198 1.00 0.90 O ATOM 922 CB LYS A 59 -9.446 11.807 -0.249 1.00 0.91 C ATOM 923 CG LYS A 59 -10.793 11.346 0.349 1.00 1.59 C ATOM 924 CD LYS A 59 -10.705 10.767 1.770 1.00 1.52 C ATOM 925 CE LYS A 59 -11.013 11.786 2.885 1.00 2.08 C ATOM 926 NZ LYS A 59 -12.450 12.122 3.020 1.00 2.66 N ATOM 0 H LYS A 59 -10.562 13.952 0.281 1.00 1.03 H new ATOM 0 HA LYS A 59 -8.461 12.568 1.466 1.00 0.93 H new ATOM 0 HB2 LYS A 59 -9.616 12.113 -1.281 1.00 0.91 H new ATOM 0 HB3 LYS A 59 -8.773 10.950 -0.278 1.00 0.91 H new ATOM 0 HG2 LYS A 59 -11.478 12.193 0.359 1.00 1.59 H new ATOM 0 HG3 LYS A 59 -11.227 10.593 -0.308 1.00 1.59 H new ATOM 0 HD2 LYS A 59 -11.400 9.932 1.854 1.00 1.52 H new ATOM 0 HD3 LYS A 59 -9.704 10.366 1.926 1.00 1.52 H new ATOM 0 HE2 LYS A 59 -10.653 11.389 3.834 1.00 2.08 H new ATOM 0 HE3 LYS A 59 -10.454 12.701 2.690 1.00 2.08 H new ATOM 0 HZ1 LYS A 59 -12.577 12.798 3.800 1.00 2.66 H new ATOM 0 HZ2 LYS A 59 -12.792 12.547 2.134 1.00 2.66 H new ATOM 0 HZ3 LYS A 59 -12.991 11.257 3.221 1.00 2.66 H new ATOM 940 N MET A 60 -7.564 14.225 -1.270 1.00 1.03 N ATOM 941 CA MET A 60 -6.445 14.765 -2.031 1.00 1.09 C ATOM 942 C MET A 60 -5.554 15.614 -1.124 1.00 1.10 C ATOM 943 O MET A 60 -4.346 15.382 -1.050 1.00 1.13 O ATOM 944 CB MET A 60 -6.968 15.537 -3.252 1.00 1.19 C ATOM 945 CG MET A 60 -5.875 15.819 -4.292 1.00 1.22 C ATOM 946 SD MET A 60 -4.599 17.044 -3.880 1.00 2.00 S ATOM 947 CE MET A 60 -5.569 18.566 -3.855 1.00 1.82 C ATOM 0 H MET A 60 -8.470 14.544 -1.614 1.00 1.03 H new ATOM 0 HA MET A 60 -5.824 13.953 -2.410 1.00 1.09 H new ATOM 0 HB2 MET A 60 -7.770 14.966 -3.720 1.00 1.19 H new ATOM 0 HB3 MET A 60 -7.400 16.481 -2.921 1.00 1.19 H new ATOM 0 HG2 MET A 60 -5.374 14.877 -4.513 1.00 1.22 H new ATOM 0 HG3 MET A 60 -6.364 16.143 -5.211 1.00 1.22 H new ATOM 0 HE1 MET A 60 -4.906 19.418 -3.703 1.00 1.82 H new ATOM 0 HE2 MET A 60 -6.093 18.679 -4.804 1.00 1.82 H new ATOM 0 HE3 MET A 60 -6.294 18.522 -3.043 1.00 1.82 H new ATOM 957 N LYS A 61 -6.156 16.578 -0.416 1.00 1.11 N ATOM 958 CA LYS A 61 -5.434 17.410 0.537 1.00 1.18 C ATOM 959 C LYS A 61 -4.674 16.570 1.568 1.00 1.15 C ATOM 960 O LYS A 61 -3.549 16.931 1.912 1.00 1.23 O ATOM 961 CB LYS A 61 -6.368 18.433 1.201 1.00 1.26 C ATOM 962 CG LYS A 61 -6.617 19.621 0.262 1.00 1.43 C ATOM 963 CD LYS A 61 -7.461 20.729 0.914 1.00 1.77 C ATOM 964 CE LYS A 61 -8.915 20.331 1.215 1.00 2.16 C ATOM 965 NZ LYS A 61 -9.618 19.864 0.006 1.00 2.99 N ATOM 0 H LYS A 61 -7.149 16.797 -0.491 1.00 1.11 H new ATOM 0 HA LYS A 61 -4.683 17.970 -0.020 1.00 1.18 H new ATOM 0 HB2 LYS A 61 -7.315 17.958 1.455 1.00 1.26 H new ATOM 0 HB3 LYS A 61 -5.927 18.785 2.134 1.00 1.26 H new ATOM 0 HG2 LYS A 61 -5.660 20.037 -0.052 1.00 1.43 H new ATOM 0 HG3 LYS A 61 -7.121 19.268 -0.637 1.00 1.43 H new ATOM 0 HD2 LYS A 61 -6.981 21.033 1.844 1.00 1.77 H new ATOM 0 HD3 LYS A 61 -7.465 21.599 0.257 1.00 1.77 H new ATOM 0 HE2 LYS A 61 -8.927 19.544 1.969 1.00 2.16 H new ATOM 0 HE3 LYS A 61 -9.445 21.185 1.637 1.00 2.16 H new ATOM 0 HZ1 LYS A 61 -10.584 19.573 0.257 1.00 2.99 H new ATOM 0 HZ2 LYS A 61 -9.658 20.634 -0.692 1.00 2.99 H new ATOM 0 HZ3 LYS A 61 -9.108 19.055 -0.401 1.00 2.99 H new ATOM 979 N SER A 62 -5.249 15.458 2.049 1.00 1.10 N ATOM 980 CA SER A 62 -4.469 14.507 2.838 1.00 1.13 C ATOM 981 C SER A 62 -3.320 13.972 1.987 1.00 1.05 C ATOM 982 O SER A 62 -2.161 14.125 2.362 1.00 1.28 O ATOM 983 CB SER A 62 -5.326 13.341 3.367 1.00 1.26 C ATOM 984 OG SER A 62 -4.510 12.281 3.867 1.00 2.61 O ATOM 0 H SER A 62 -6.227 15.203 1.908 1.00 1.10 H new ATOM 0 HA SER A 62 -4.079 15.034 3.709 1.00 1.13 H new ATOM 0 HB2 SER A 62 -5.984 13.700 4.158 1.00 1.26 H new ATOM 0 HB3 SER A 62 -5.965 12.965 2.568 1.00 1.26 H new ATOM 0 HG SER A 62 -4.085 12.562 4.704 1.00 2.61 H new ATOM 990 N LEU A 63 -3.646 13.301 0.879 1.00 0.91 N ATOM 991 CA LEU A 63 -2.733 12.488 0.089 1.00 0.88 C ATOM 992 C LEU A 63 -1.481 13.252 -0.317 1.00 0.95 C ATOM 993 O LEU A 63 -0.371 12.832 0.034 1.00 1.03 O ATOM 994 CB LEU A 63 -3.435 11.957 -1.161 1.00 0.87 C ATOM 995 CG LEU A 63 -4.436 10.840 -0.852 1.00 0.97 C ATOM 996 CD1 LEU A 63 -5.432 10.751 -2.008 1.00 1.30 C ATOM 997 CD2 LEU A 63 -3.722 9.496 -0.685 1.00 1.40 C ATOM 0 H LEU A 63 -4.592 13.313 0.497 1.00 0.91 H new ATOM 0 HA LEU A 63 -2.425 11.655 0.721 1.00 0.88 H new ATOM 0 HB2 LEU A 63 -3.955 12.777 -1.656 1.00 0.87 H new ATOM 0 HB3 LEU A 63 -2.687 11.585 -1.861 1.00 0.87 H new ATOM 0 HG LEU A 63 -4.951 11.067 0.081 1.00 0.97 H new ATOM 0 HD11 LEU A 63 -6.154 9.960 -1.806 1.00 1.30 H new ATOM 0 HD12 LEU A 63 -5.955 11.702 -2.112 1.00 1.30 H new ATOM 0 HD13 LEU A 63 -4.898 10.528 -2.932 1.00 1.30 H new ATOM 0 HD21 LEU A 63 -4.455 8.719 -0.466 1.00 1.40 H new ATOM 0 HD22 LEU A 63 -3.194 9.248 -1.606 1.00 1.40 H new ATOM 0 HD23 LEU A 63 -3.008 9.563 0.136 1.00 1.40 H new ATOM 1009 N ASP A 64 -1.656 14.335 -1.081 1.00 1.01 N ATOM 1010 CA ASP A 64 -0.525 15.028 -1.667 1.00 1.22 C ATOM 1011 C ASP A 64 0.226 15.774 -0.567 1.00 1.48 C ATOM 1012 O ASP A 64 -0.064 16.936 -0.310 1.00 1.63 O ATOM 1013 CB ASP A 64 -0.934 15.976 -2.802 1.00 1.34 C ATOM 1014 CG ASP A 64 0.313 16.427 -3.544 1.00 1.70 C ATOM 1015 OD1 ASP A 64 1.399 15.858 -3.314 1.00 2.05 O ATOM 1016 OD2 ASP A 64 0.268 17.243 -4.484 1.00 2.09 O ATOM 0 H ASP A 64 -2.565 14.741 -1.302 1.00 1.01 H new ATOM 0 HA ASP A 64 0.130 14.285 -2.122 1.00 1.22 H new ATOM 0 HB2 ASP A 64 -1.617 15.472 -3.486 1.00 1.34 H new ATOM 0 HB3 ASP A 64 -1.465 16.839 -2.399 1.00 1.34 H new ATOM 1021 N VAL A 65 1.191 15.120 0.080 1.00 1.60 N ATOM 1022 CA VAL A 65 1.928 15.658 1.222 1.00 1.85 C ATOM 1023 C VAL A 65 2.473 17.080 0.993 1.00 1.82 C ATOM 1024 O VAL A 65 2.658 17.824 1.953 1.00 2.09 O ATOM 1025 CB VAL A 65 3.048 14.688 1.645 1.00 2.04 C ATOM 1026 CG1 VAL A 65 2.478 13.332 2.087 1.00 2.34 C ATOM 1027 CG2 VAL A 65 4.089 14.469 0.541 1.00 2.10 C ATOM 0 H VAL A 65 1.488 14.180 -0.182 1.00 1.60 H new ATOM 0 HA VAL A 65 1.211 15.750 2.037 1.00 1.85 H new ATOM 0 HB VAL A 65 3.549 15.161 2.490 1.00 2.04 H new ATOM 0 HG11 VAL A 65 3.295 12.672 2.379 1.00 2.34 H new ATOM 0 HG12 VAL A 65 1.809 13.478 2.935 1.00 2.34 H new ATOM 0 HG13 VAL A 65 1.926 12.883 1.262 1.00 2.34 H new ATOM 0 HG21 VAL A 65 4.854 13.777 0.894 1.00 2.10 H new ATOM 0 HG22 VAL A 65 3.602 14.052 -0.341 1.00 2.10 H new ATOM 0 HG23 VAL A 65 4.552 15.422 0.284 1.00 2.10 H new ATOM 1037 N ASN A 66 2.752 17.443 -0.263 1.00 1.54 N ATOM 1038 CA ASN A 66 3.245 18.764 -0.668 1.00 1.49 C ATOM 1039 C ASN A 66 2.165 19.624 -1.332 1.00 1.50 C ATOM 1040 O ASN A 66 2.388 20.817 -1.510 1.00 1.59 O ATOM 1041 CB ASN A 66 4.456 18.623 -1.601 1.00 1.53 C ATOM 1042 CG ASN A 66 4.238 17.523 -2.634 1.00 1.45 C ATOM 1043 OD1 ASN A 66 3.454 17.651 -3.571 1.00 1.30 O ATOM 1044 ND2 ASN A 66 4.883 16.382 -2.417 1.00 2.58 N ATOM 0 H ASN A 66 2.637 16.806 -1.051 1.00 1.54 H new ATOM 0 HA ASN A 66 3.546 19.278 0.245 1.00 1.49 H new ATOM 0 HB2 ASN A 66 4.638 19.570 -2.109 1.00 1.53 H new ATOM 0 HB3 ASN A 66 5.346 18.400 -1.013 1.00 1.53 H new ATOM 0 HD21 ASN A 66 4.733 15.585 -3.036 1.00 2.58 H new ATOM 0 HD22 ASN A 66 5.529 16.303 -1.631 1.00 2.58 H new ATOM 1051 N GLN A 67 1.012 19.050 -1.689 1.00 1.50 N ATOM 1052 CA GLN A 67 -0.112 19.759 -2.286 1.00 1.53 C ATOM 1053 C GLN A 67 0.326 20.568 -3.513 1.00 1.43 C ATOM 1054 O GLN A 67 -0.019 21.739 -3.652 1.00 1.48 O ATOM 1055 CB GLN A 67 -0.860 20.585 -1.223 1.00 1.68 C ATOM 1056 CG GLN A 67 -1.352 19.688 -0.073 1.00 2.94 C ATOM 1057 CD GLN A 67 -2.271 20.408 0.908 1.00 3.06 C ATOM 1058 OE1 GLN A 67 -2.385 21.629 0.898 1.00 3.01 O ATOM 1059 NE2 GLN A 67 -2.953 19.663 1.775 1.00 4.14 N ATOM 0 H GLN A 67 0.835 18.053 -1.565 1.00 1.50 H new ATOM 0 HA GLN A 67 -0.831 19.032 -2.664 1.00 1.53 H new ATOM 0 HB2 GLN A 67 -0.201 21.359 -0.829 1.00 1.68 H new ATOM 0 HB3 GLN A 67 -1.709 21.092 -1.682 1.00 1.68 H new ATOM 0 HG2 GLN A 67 -1.880 18.831 -0.491 1.00 2.94 H new ATOM 0 HG3 GLN A 67 -0.490 19.298 0.468 1.00 2.94 H new ATOM 0 HE21 GLN A 67 -2.847 18.649 1.770 1.00 4.14 H new ATOM 0 HE22 GLN A 67 -3.582 20.107 2.444 1.00 4.14 H new ATOM 1068 N ASP A 68 1.042 19.904 -4.428 1.00 1.40 N ATOM 1069 CA ASP A 68 1.295 20.432 -5.769 1.00 1.28 C ATOM 1070 C ASP A 68 0.080 20.136 -6.663 1.00 1.25 C ATOM 1071 O ASP A 68 -0.132 20.822 -7.660 1.00 1.65 O ATOM 1072 CB ASP A 68 2.642 19.935 -6.344 1.00 1.23 C ATOM 1073 CG ASP A 68 2.696 18.439 -6.570 1.00 1.26 C ATOM 1074 OD1 ASP A 68 1.637 17.827 -6.782 1.00 1.33 O ATOM 1075 OD2 ASP A 68 3.698 17.750 -6.274 1.00 1.33 O ATOM 0 H ASP A 68 1.460 18.989 -4.258 1.00 1.40 H new ATOM 0 HA ASP A 68 1.409 21.515 -5.723 1.00 1.28 H new ATOM 0 HB2 ASP A 68 2.832 20.443 -7.290 1.00 1.23 H new ATOM 0 HB3 ASP A 68 3.444 20.219 -5.663 1.00 1.23 H new ATOM 1080 N SER A 69 -0.748 19.152 -6.281 1.00 1.22 N ATOM 1081 CA SER A 69 -1.982 18.778 -6.963 1.00 1.17 C ATOM 1082 C SER A 69 -1.699 17.920 -8.207 1.00 0.93 C ATOM 1083 O SER A 69 -2.509 17.866 -9.137 1.00 1.01 O ATOM 1084 CB SER A 69 -2.851 20.016 -7.253 1.00 1.46 C ATOM 1085 OG SER A 69 -4.229 19.699 -7.175 1.00 2.09 O ATOM 0 H SER A 69 -0.564 18.578 -5.458 1.00 1.22 H new ATOM 0 HA SER A 69 -2.568 18.146 -6.296 1.00 1.17 H new ATOM 0 HB2 SER A 69 -2.615 20.805 -6.539 1.00 1.46 H new ATOM 0 HB3 SER A 69 -2.619 20.403 -8.245 1.00 1.46 H new ATOM 0 HG SER A 69 -4.760 20.501 -7.361 1.00 2.09 H new ATOM 1091 N GLU A 70 -0.570 17.203 -8.196 1.00 0.91 N ATOM 1092 CA GLU A 70 -0.300 16.069 -9.073 1.00 0.98 C ATOM 1093 C GLU A 70 0.297 15.005 -8.144 1.00 0.96 C ATOM 1094 O GLU A 70 1.253 15.270 -7.405 1.00 1.07 O ATOM 1095 CB GLU A 70 0.613 16.447 -10.268 1.00 1.53 C ATOM 1096 CG GLU A 70 -0.066 16.368 -11.666 1.00 2.30 C ATOM 1097 CD GLU A 70 -0.438 14.943 -12.085 1.00 4.15 C ATOM 1098 OE1 GLU A 70 -0.387 14.100 -11.175 1.00 4.93 O ATOM 1099 OE2 GLU A 70 -0.746 14.659 -13.278 1.00 5.39 O ATOM 0 H GLU A 70 0.199 17.405 -7.558 1.00 0.91 H new ATOM 0 HA GLU A 70 -1.198 15.698 -9.567 1.00 0.98 H new ATOM 0 HB2 GLU A 70 0.982 17.461 -10.117 1.00 1.53 H new ATOM 0 HB3 GLU A 70 1.481 15.788 -10.265 1.00 1.53 H new ATOM 0 HG2 GLU A 70 -0.966 16.983 -11.659 1.00 2.30 H new ATOM 0 HG3 GLU A 70 0.605 16.794 -12.412 1.00 2.30 H new ATOM 1106 N LEU A 71 -0.351 13.846 -8.069 1.00 0.89 N ATOM 1107 CA LEU A 71 -0.094 12.817 -7.075 1.00 0.79 C ATOM 1108 C LEU A 71 0.905 11.849 -7.684 1.00 0.81 C ATOM 1109 O LEU A 71 0.497 10.919 -8.378 1.00 0.86 O ATOM 1110 CB LEU A 71 -1.402 12.109 -6.692 1.00 0.73 C ATOM 1111 CG LEU A 71 -2.289 12.924 -5.720 1.00 0.93 C ATOM 1112 CD1 LEU A 71 -1.871 12.675 -4.267 1.00 1.08 C ATOM 1113 CD2 LEU A 71 -2.366 14.430 -6.001 1.00 1.19 C ATOM 0 H LEU A 71 -1.093 13.592 -8.721 1.00 0.89 H new ATOM 0 HA LEU A 71 0.312 13.245 -6.159 1.00 0.79 H new ATOM 0 HB2 LEU A 71 -1.970 11.899 -7.598 1.00 0.73 H new ATOM 0 HB3 LEU A 71 -1.164 11.149 -6.235 1.00 0.73 H new ATOM 0 HG LEU A 71 -3.299 12.552 -5.894 1.00 0.93 H new ATOM 0 HD11 LEU A 71 -2.507 13.257 -3.600 1.00 1.08 H new ATOM 0 HD12 LEU A 71 -1.976 11.615 -4.035 1.00 1.08 H new ATOM 0 HD13 LEU A 71 -0.832 12.975 -4.131 1.00 1.08 H new ATOM 0 HD21 LEU A 71 -3.012 14.905 -5.263 1.00 1.19 H new ATOM 0 HD22 LEU A 71 -1.367 14.863 -5.941 1.00 1.19 H new ATOM 0 HD23 LEU A 71 -2.773 14.594 -6.999 1.00 1.19 H new ATOM 1125 N LYS A 72 2.203 12.091 -7.476 1.00 0.91 N ATOM 1126 CA LYS A 72 3.254 11.254 -8.047 1.00 1.00 C ATOM 1127 C LYS A 72 3.377 9.940 -7.277 1.00 0.83 C ATOM 1128 O LYS A 72 2.800 9.812 -6.198 1.00 0.81 O ATOM 1129 CB LYS A 72 4.573 12.029 -8.197 1.00 1.51 C ATOM 1130 CG LYS A 72 5.317 12.246 -6.874 1.00 1.13 C ATOM 1131 CD LYS A 72 5.956 13.642 -6.852 1.00 1.67 C ATOM 1132 CE LYS A 72 6.728 13.911 -5.549 1.00 3.31 C ATOM 1133 NZ LYS A 72 6.542 15.303 -5.084 1.00 4.10 N ATOM 0 H LYS A 72 2.549 12.867 -6.911 1.00 0.91 H new ATOM 0 HA LYS A 72 2.975 10.977 -9.064 1.00 1.00 H new ATOM 0 HB2 LYS A 72 5.224 11.490 -8.885 1.00 1.51 H new ATOM 0 HB3 LYS A 72 4.364 12.999 -8.649 1.00 1.51 H new ATOM 0 HG2 LYS A 72 4.626 12.140 -6.038 1.00 1.13 H new ATOM 0 HG3 LYS A 72 6.086 11.483 -6.751 1.00 1.13 H new ATOM 0 HD2 LYS A 72 6.633 13.742 -7.700 1.00 1.67 H new ATOM 0 HD3 LYS A 72 5.179 14.397 -6.974 1.00 1.67 H new ATOM 0 HE2 LYS A 72 6.391 13.220 -4.776 1.00 3.31 H new ATOM 0 HE3 LYS A 72 7.789 13.718 -5.708 1.00 3.31 H new ATOM 0 HZ1 LYS A 72 7.167 15.485 -4.273 1.00 4.10 H new ATOM 0 HZ2 LYS A 72 6.775 15.961 -5.855 1.00 4.10 H new ATOM 0 HZ3 LYS A 72 5.552 15.444 -4.796 1.00 4.10 H new ATOM 1147 N PHE A 73 4.144 8.981 -7.803 1.00 0.88 N ATOM 1148 CA PHE A 73 4.110 7.573 -7.408 1.00 0.92 C ATOM 1149 C PHE A 73 3.875 7.339 -5.907 1.00 0.79 C ATOM 1150 O PHE A 73 2.860 6.750 -5.543 1.00 0.77 O ATOM 1151 CB PHE A 73 5.390 6.865 -7.895 1.00 1.03 C ATOM 1152 CG PHE A 73 6.702 7.540 -7.511 1.00 2.36 C ATOM 1153 CD1 PHE A 73 7.166 8.648 -8.245 1.00 3.55 C ATOM 1154 CD2 PHE A 73 7.401 7.136 -6.358 1.00 3.84 C ATOM 1155 CE1 PHE A 73 8.182 9.466 -7.718 1.00 5.42 C ATOM 1156 CE2 PHE A 73 8.427 7.946 -5.836 1.00 5.60 C ATOM 1157 CZ PHE A 73 8.772 9.145 -6.483 1.00 6.26 C ATOM 0 H PHE A 73 4.826 9.170 -8.538 1.00 0.88 H new ATOM 0 HA PHE A 73 3.238 7.136 -7.894 1.00 0.92 H new ATOM 0 HB2 PHE A 73 5.395 5.849 -7.499 1.00 1.03 H new ATOM 0 HB3 PHE A 73 5.348 6.784 -8.981 1.00 1.03 H new ATOM 0 HD1 PHE A 73 6.742 8.870 -9.213 1.00 3.55 H new ATOM 0 HD2 PHE A 73 7.150 6.204 -5.874 1.00 3.84 H new ATOM 0 HE1 PHE A 73 8.509 10.340 -8.262 1.00 5.42 H new ATOM 0 HE2 PHE A 73 8.949 7.646 -4.939 1.00 5.60 H new ATOM 0 HZ PHE A 73 9.488 9.817 -6.033 1.00 6.26 H new ATOM 1167 N ASN A 74 4.761 7.806 -5.020 1.00 0.73 N ATOM 1168 CA ASN A 74 4.629 7.514 -3.590 1.00 0.69 C ATOM 1169 C ASN A 74 3.537 8.387 -2.941 1.00 0.68 C ATOM 1170 O ASN A 74 2.939 7.972 -1.949 1.00 0.76 O ATOM 1171 CB ASN A 74 5.998 7.577 -2.884 1.00 0.88 C ATOM 1172 CG ASN A 74 6.102 6.833 -1.542 1.00 1.52 C ATOM 1173 OD1 ASN A 74 7.139 6.230 -1.261 1.00 2.15 O ATOM 1174 ND2 ASN A 74 5.083 6.827 -0.691 1.00 2.23 N ATOM 0 H ASN A 74 5.568 8.381 -5.264 1.00 0.73 H new ATOM 0 HA ASN A 74 4.286 6.487 -3.467 1.00 0.69 H new ATOM 0 HB2 ASN A 74 6.751 7.172 -3.560 1.00 0.88 H new ATOM 0 HB3 ASN A 74 6.250 8.624 -2.716 1.00 0.88 H new ATOM 0 HD21 ASN A 74 5.160 6.324 0.193 1.00 2.23 H new ATOM 0 HD22 ASN A 74 4.223 7.325 -0.921 1.00 2.23 H new ATOM 1181 N GLU A 75 3.247 9.577 -3.485 1.00 0.70 N ATOM 1182 CA GLU A 75 2.151 10.409 -2.993 1.00 0.75 C ATOM 1183 C GLU A 75 0.832 9.672 -3.250 1.00 0.72 C ATOM 1184 O GLU A 75 0.071 9.399 -2.322 1.00 0.80 O ATOM 1185 CB GLU A 75 2.126 11.774 -3.704 1.00 0.86 C ATOM 1186 CG GLU A 75 3.405 12.621 -3.587 1.00 1.03 C ATOM 1187 CD GLU A 75 3.334 13.827 -4.514 1.00 1.29 C ATOM 1188 OE1 GLU A 75 2.497 13.877 -5.431 1.00 2.05 O ATOM 1189 OE2 GLU A 75 4.071 14.821 -4.360 1.00 2.08 O ATOM 0 H GLU A 75 3.760 9.982 -4.268 1.00 0.70 H new ATOM 0 HA GLU A 75 2.291 10.589 -1.927 1.00 0.75 H new ATOM 0 HB2 GLU A 75 1.921 11.606 -4.761 1.00 0.86 H new ATOM 0 HB3 GLU A 75 1.293 12.353 -3.306 1.00 0.86 H new ATOM 0 HG2 GLU A 75 3.535 12.954 -2.557 1.00 1.03 H new ATOM 0 HG3 GLU A 75 4.275 12.013 -3.837 1.00 1.03 H new ATOM 1196 N TYR A 76 0.597 9.333 -4.522 1.00 0.68 N ATOM 1197 CA TYR A 76 -0.522 8.520 -4.973 1.00 0.72 C ATOM 1198 C TYR A 76 -0.625 7.267 -4.118 1.00 0.71 C ATOM 1199 O TYR A 76 -1.688 6.976 -3.570 1.00 0.71 O ATOM 1200 CB TYR A 76 -0.329 8.139 -6.452 1.00 0.84 C ATOM 1201 CG TYR A 76 -1.173 6.957 -6.895 1.00 1.23 C ATOM 1202 CD1 TYR A 76 -2.521 7.152 -7.242 1.00 1.77 C ATOM 1203 CD2 TYR A 76 -0.660 5.648 -6.815 1.00 2.68 C ATOM 1204 CE1 TYR A 76 -3.350 6.051 -7.503 1.00 2.23 C ATOM 1205 CE2 TYR A 76 -1.505 4.545 -7.021 1.00 3.13 C ATOM 1206 CZ TYR A 76 -2.844 4.746 -7.391 1.00 2.46 C ATOM 1207 OH TYR A 76 -3.640 3.686 -7.708 1.00 3.15 O ATOM 0 H TYR A 76 1.204 9.630 -5.286 1.00 0.68 H new ATOM 0 HA TYR A 76 -1.445 9.092 -4.874 1.00 0.72 H new ATOM 0 HB2 TYR A 76 -0.572 9.000 -7.074 1.00 0.84 H new ATOM 0 HB3 TYR A 76 0.722 7.908 -6.624 1.00 0.84 H new ATOM 0 HD1 TYR A 76 -2.920 8.153 -7.308 1.00 1.77 H new ATOM 0 HD2 TYR A 76 0.386 5.492 -6.595 1.00 2.68 H new ATOM 0 HE1 TYR A 76 -4.379 6.207 -7.791 1.00 2.23 H new ATOM 0 HE2 TYR A 76 -1.124 3.542 -6.895 1.00 3.13 H new ATOM 0 HH TYR A 76 -3.089 2.882 -7.812 1.00 3.15 H new ATOM 1217 N TRP A 77 0.481 6.521 -4.049 1.00 0.71 N ATOM 1218 CA TRP A 77 0.523 5.185 -3.487 1.00 0.70 C ATOM 1219 C TRP A 77 -0.198 5.108 -2.143 1.00 0.71 C ATOM 1220 O TRP A 77 -0.923 4.142 -1.906 1.00 0.68 O ATOM 1221 CB TRP A 77 1.972 4.711 -3.366 1.00 0.77 C ATOM 1222 CG TRP A 77 2.097 3.451 -2.588 1.00 0.91 C ATOM 1223 CD1 TRP A 77 1.779 2.214 -3.030 1.00 2.38 C ATOM 1224 CD2 TRP A 77 2.399 3.314 -1.173 1.00 1.49 C ATOM 1225 NE1 TRP A 77 1.862 1.325 -1.986 1.00 2.49 N ATOM 1226 CE2 TRP A 77 2.301 1.937 -0.840 1.00 1.47 C ATOM 1227 CE3 TRP A 77 2.679 4.210 -0.117 1.00 3.36 C ATOM 1228 CZ2 TRP A 77 2.576 1.455 0.438 1.00 2.06 C ATOM 1229 CZ3 TRP A 77 2.851 3.727 1.193 1.00 4.23 C ATOM 1230 CH2 TRP A 77 2.920 2.359 1.440 1.00 3.38 C ATOM 0 H TRP A 77 1.386 6.843 -4.392 1.00 0.71 H new ATOM 0 HA TRP A 77 -0.008 4.518 -4.167 1.00 0.70 H new ATOM 0 HB2 TRP A 77 2.386 4.561 -4.363 1.00 0.77 H new ATOM 0 HB3 TRP A 77 2.567 5.490 -2.888 1.00 0.77 H new ATOM 0 HD1 TRP A 77 1.503 1.964 -4.044 1.00 2.38 H new ATOM 0 HE1 TRP A 77 1.627 0.335 -2.055 1.00 2.49 H new ATOM 0 HE3 TRP A 77 2.761 5.268 -0.316 1.00 3.36 H new ATOM 0 HZ2 TRP A 77 2.523 0.397 0.648 1.00 2.06 H new ATOM 0 HZ3 TRP A 77 2.930 4.424 2.014 1.00 4.23 H new ATOM 0 HH2 TRP A 77 3.240 1.999 2.407 1.00 3.38 H new ATOM 1241 N ARG A 78 -0.012 6.116 -1.275 1.00 0.81 N ATOM 1242 CA ARG A 78 -0.669 6.151 0.025 1.00 0.90 C ATOM 1243 C ARG A 78 -2.140 5.784 -0.088 1.00 0.73 C ATOM 1244 O ARG A 78 -2.620 5.038 0.759 1.00 0.71 O ATOM 1245 CB ARG A 78 -0.524 7.507 0.720 1.00 1.16 C ATOM 1246 CG ARG A 78 -1.208 7.505 2.095 1.00 2.05 C ATOM 1247 CD ARG A 78 -0.485 8.356 3.137 1.00 2.28 C ATOM 1248 NE ARG A 78 -0.322 9.739 2.678 1.00 2.03 N ATOM 1249 CZ ARG A 78 -1.125 10.777 2.959 1.00 2.59 C ATOM 1250 NH1 ARG A 78 -2.301 10.626 3.584 1.00 3.20 N ATOM 1251 NH2 ARG A 78 -0.713 11.986 2.581 1.00 3.68 N ATOM 0 H ARG A 78 0.592 6.917 -1.459 1.00 0.81 H new ATOM 0 HA ARG A 78 -0.163 5.407 0.640 1.00 0.90 H new ATOM 0 HB2 ARG A 78 0.533 7.747 0.837 1.00 1.16 H new ATOM 0 HB3 ARG A 78 -0.960 8.287 0.096 1.00 1.16 H new ATOM 0 HG2 ARG A 78 -2.229 7.870 1.984 1.00 2.05 H new ATOM 0 HG3 ARG A 78 -1.274 6.479 2.458 1.00 2.05 H new ATOM 0 HD2 ARG A 78 -1.046 8.345 4.071 1.00 2.28 H new ATOM 0 HD3 ARG A 78 0.493 7.923 3.348 1.00 2.28 H new ATOM 0 HE ARG A 78 0.485 9.932 2.084 1.00 2.03 H new ATOM 0 HH11 ARG A 78 -2.614 9.696 3.864 1.00 3.20 H new ATOM 0 HH12 ARG A 78 -2.883 11.441 3.780 1.00 3.20 H new ATOM 0 HH21 ARG A 78 0.180 12.093 2.099 1.00 3.68 H new ATOM 0 HH22 ARG A 78 -1.290 12.805 2.773 1.00 3.68 H new ATOM 1265 N LEU A 79 -2.837 6.261 -1.124 1.00 0.69 N ATOM 1266 CA LEU A 79 -4.223 5.921 -1.356 1.00 0.66 C ATOM 1267 C LEU A 79 -4.477 4.434 -1.184 1.00 0.60 C ATOM 1268 O LEU A 79 -5.395 4.086 -0.455 1.00 0.67 O ATOM 1269 CB LEU A 79 -4.658 6.351 -2.755 1.00 0.71 C ATOM 1270 CG LEU A 79 -6.181 6.201 -2.899 1.00 0.75 C ATOM 1271 CD1 LEU A 79 -6.874 7.480 -2.433 1.00 0.95 C ATOM 1272 CD2 LEU A 79 -6.551 5.765 -4.321 1.00 0.72 C ATOM 0 H LEU A 79 -2.445 6.894 -1.821 1.00 0.69 H new ATOM 0 HA LEU A 79 -4.810 6.458 -0.611 1.00 0.66 H new ATOM 0 HB2 LEU A 79 -4.367 7.386 -2.933 1.00 0.71 H new ATOM 0 HB3 LEU A 79 -4.152 5.744 -3.505 1.00 0.71 H new ATOM 0 HG LEU A 79 -6.544 5.404 -2.250 1.00 0.75 H new ATOM 0 HD11 LEU A 79 -7.953 7.368 -2.537 1.00 0.95 H new ATOM 0 HD12 LEU A 79 -6.628 7.667 -1.388 1.00 0.95 H new ATOM 0 HD13 LEU A 79 -6.536 8.319 -3.041 1.00 0.95 H new ATOM 0 HD21 LEU A 79 -7.633 5.665 -4.401 1.00 0.72 H new ATOM 0 HD22 LEU A 79 -6.202 6.513 -5.033 1.00 0.72 H new ATOM 0 HD23 LEU A 79 -6.081 4.807 -4.542 1.00 0.72 H new ATOM 1284 N ILE A 80 -3.683 3.563 -1.823 1.00 0.59 N ATOM 1285 CA ILE A 80 -3.903 2.127 -1.766 1.00 0.68 C ATOM 1286 C ILE A 80 -3.845 1.688 -0.296 1.00 0.83 C ATOM 1287 O ILE A 80 -4.572 0.799 0.132 1.00 0.97 O ATOM 1288 CB ILE A 80 -2.915 1.412 -2.706 1.00 0.77 C ATOM 1289 CG1 ILE A 80 -3.202 1.813 -4.167 1.00 0.85 C ATOM 1290 CG2 ILE A 80 -3.010 -0.115 -2.549 1.00 0.95 C ATOM 1291 CD1 ILE A 80 -2.162 1.260 -5.146 1.00 1.64 C ATOM 0 H ILE A 80 -2.879 3.840 -2.387 1.00 0.59 H new ATOM 0 HA ILE A 80 -4.890 1.845 -2.132 1.00 0.68 H new ATOM 0 HB ILE A 80 -1.903 1.717 -2.439 1.00 0.77 H new ATOM 0 HG12 ILE A 80 -4.191 1.452 -4.451 1.00 0.85 H new ATOM 0 HG13 ILE A 80 -3.225 2.900 -4.243 1.00 0.85 H new ATOM 0 HG21 ILE A 80 -2.302 -0.595 -3.224 1.00 0.95 H new ATOM 0 HG22 ILE A 80 -2.775 -0.390 -1.521 1.00 0.95 H new ATOM 0 HG23 ILE A 80 -4.021 -0.443 -2.790 1.00 0.95 H new ATOM 0 HD11 ILE A 80 -2.414 1.573 -6.159 1.00 1.64 H new ATOM 0 HD12 ILE A 80 -1.175 1.641 -4.883 1.00 1.64 H new ATOM 0 HD13 ILE A 80 -2.156 0.171 -5.094 1.00 1.64 H new ATOM 1303 N GLY A 81 -3.028 2.375 0.497 1.00 0.90 N ATOM 1304 CA GLY A 81 -2.836 2.193 1.917 1.00 1.03 C ATOM 1305 C GLY A 81 -4.040 2.630 2.713 1.00 1.02 C ATOM 1306 O GLY A 81 -4.490 1.944 3.628 1.00 1.24 O ATOM 0 H GLY A 81 -2.444 3.126 0.129 1.00 0.90 H new ATOM 0 HA2 GLY A 81 -2.628 1.143 2.123 1.00 1.03 H new ATOM 0 HA3 GLY A 81 -1.963 2.760 2.240 1.00 1.03 H new ATOM 1310 N GLU A 82 -4.500 3.843 2.418 1.00 0.91 N ATOM 1311 CA GLU A 82 -5.675 4.416 3.024 1.00 1.08 C ATOM 1312 C GLU A 82 -6.835 3.464 2.725 1.00 1.20 C ATOM 1313 O GLU A 82 -7.279 2.775 3.635 1.00 1.20 O ATOM 1314 CB GLU A 82 -5.821 5.870 2.556 1.00 1.09 C ATOM 1315 CG GLU A 82 -4.496 6.662 2.684 1.00 1.11 C ATOM 1316 CD GLU A 82 -4.605 8.019 3.373 1.00 1.92 C ATOM 1317 OE1 GLU A 82 -5.620 8.712 3.169 1.00 2.72 O ATOM 1318 OE2 GLU A 82 -3.622 8.362 4.071 1.00 2.90 O ATOM 0 H GLU A 82 -4.051 4.457 1.738 1.00 0.91 H new ATOM 0 HA GLU A 82 -5.630 4.501 4.110 1.00 1.08 H new ATOM 0 HB2 GLU A 82 -6.152 5.884 1.517 1.00 1.09 H new ATOM 0 HB3 GLU A 82 -6.595 6.363 3.144 1.00 1.09 H new ATOM 0 HG2 GLU A 82 -3.780 6.051 3.234 1.00 1.11 H new ATOM 0 HG3 GLU A 82 -4.086 6.813 1.686 1.00 1.11 H new ATOM 1325 N LEU A 83 -7.198 3.256 1.461 1.00 1.35 N ATOM 1326 CA LEU A 83 -8.257 2.313 1.124 1.00 1.54 C ATOM 1327 C LEU A 83 -8.013 0.921 1.729 1.00 1.45 C ATOM 1328 O LEU A 83 -8.961 0.309 2.220 1.00 1.48 O ATOM 1329 CB LEU A 83 -8.611 2.354 -0.371 1.00 2.11 C ATOM 1330 CG LEU A 83 -7.523 1.909 -1.355 1.00 0.99 C ATOM 1331 CD1 LEU A 83 -7.493 0.411 -1.636 1.00 1.65 C ATOM 1332 CD2 LEU A 83 -7.663 2.634 -2.698 1.00 2.01 C ATOM 0 H LEU A 83 -6.776 3.725 0.659 1.00 1.35 H new ATOM 0 HA LEU A 83 -9.176 2.638 1.612 1.00 1.54 H new ATOM 0 HB2 LEU A 83 -9.488 1.727 -0.529 1.00 2.11 H new ATOM 0 HB3 LEU A 83 -8.899 3.374 -0.623 1.00 2.11 H new ATOM 0 HG LEU A 83 -6.590 2.171 -0.855 1.00 0.99 H new ATOM 0 HD11 LEU A 83 -6.693 0.189 -2.342 1.00 1.65 H new ATOM 0 HD12 LEU A 83 -7.317 -0.130 -0.706 1.00 1.65 H new ATOM 0 HD13 LEU A 83 -8.448 0.101 -2.061 1.00 1.65 H new ATOM 0 HD21 LEU A 83 -6.878 2.299 -3.376 1.00 2.01 H new ATOM 0 HD22 LEU A 83 -8.638 2.411 -3.132 1.00 2.01 H new ATOM 0 HD23 LEU A 83 -7.573 3.709 -2.542 1.00 2.01 H new ATOM 1344 N ALA A 84 -6.761 0.442 1.784 1.00 1.41 N ATOM 1345 CA ALA A 84 -6.464 -0.812 2.467 1.00 1.46 C ATOM 1346 C ALA A 84 -6.951 -0.778 3.913 1.00 1.51 C ATOM 1347 O ALA A 84 -7.821 -1.567 4.276 1.00 2.19 O ATOM 1348 CB ALA A 84 -4.975 -1.177 2.411 1.00 1.38 C ATOM 0 H ALA A 84 -5.952 0.902 1.367 1.00 1.41 H new ATOM 0 HA ALA A 84 -7.006 -1.591 1.931 1.00 1.46 H new ATOM 0 HB1 ALA A 84 -4.811 -2.119 2.935 1.00 1.38 H new ATOM 0 HB2 ALA A 84 -4.665 -1.281 1.371 1.00 1.38 H new ATOM 0 HB3 ALA A 84 -4.389 -0.391 2.887 1.00 1.38 H new ATOM 1354 N LYS A 85 -6.433 0.123 4.754 1.00 1.00 N ATOM 1355 CA LYS A 85 -6.814 0.080 6.165 1.00 0.91 C ATOM 1356 C LYS A 85 -8.271 0.507 6.381 1.00 1.04 C ATOM 1357 O LYS A 85 -8.860 0.177 7.412 1.00 1.31 O ATOM 1358 CB LYS A 85 -5.785 0.738 7.106 1.00 1.32 C ATOM 1359 CG LYS A 85 -6.016 2.205 7.499 1.00 0.92 C ATOM 1360 CD LYS A 85 -5.510 3.228 6.476 1.00 1.98 C ATOM 1361 CE LYS A 85 -3.976 3.325 6.406 1.00 1.29 C ATOM 1362 NZ LYS A 85 -3.484 4.477 5.621 1.00 1.91 N ATOM 0 H LYS A 85 -5.777 0.860 4.496 1.00 1.00 H new ATOM 0 HA LYS A 85 -6.783 -0.966 6.470 1.00 0.91 H new ATOM 0 HB2 LYS A 85 -5.742 0.148 8.021 1.00 1.32 H new ATOM 0 HB3 LYS A 85 -4.805 0.667 6.634 1.00 1.32 H new ATOM 0 HG2 LYS A 85 -7.084 2.362 7.653 1.00 0.92 H new ATOM 0 HG3 LYS A 85 -5.525 2.393 8.454 1.00 0.92 H new ATOM 0 HD2 LYS A 85 -5.894 2.964 5.491 1.00 1.98 H new ATOM 0 HD3 LYS A 85 -5.916 4.208 6.724 1.00 1.98 H new ATOM 0 HE2 LYS A 85 -3.579 3.392 7.419 1.00 1.29 H new ATOM 0 HE3 LYS A 85 -3.583 2.406 5.970 1.00 1.29 H new ATOM 0 HZ1 LYS A 85 -2.499 4.682 5.885 1.00 1.91 H new ATOM 0 HZ2 LYS A 85 -3.531 4.252 4.607 1.00 1.91 H new ATOM 0 HZ3 LYS A 85 -4.075 5.310 5.818 1.00 1.91 H new ATOM 1376 N GLU A 86 -8.874 1.227 5.430 1.00 1.02 N ATOM 1377 CA GLU A 86 -10.296 1.556 5.485 1.00 1.14 C ATOM 1378 C GLU A 86 -11.142 0.283 5.597 1.00 1.23 C ATOM 1379 O GLU A 86 -12.158 0.320 6.292 1.00 1.41 O ATOM 1380 CB GLU A 86 -10.706 2.453 4.308 1.00 1.15 C ATOM 1381 CG GLU A 86 -9.925 3.780 4.335 1.00 1.15 C ATOM 1382 CD GLU A 86 -10.532 4.891 5.166 1.00 1.65 C ATOM 1383 OE1 GLU A 86 -10.577 4.732 6.405 1.00 2.41 O ATOM 1384 OE2 GLU A 86 -10.900 5.907 4.543 1.00 2.62 O ATOM 0 H GLU A 86 -8.393 1.594 4.609 1.00 1.02 H new ATOM 0 HA GLU A 86 -10.487 2.138 6.387 1.00 1.14 H new ATOM 0 HB2 GLU A 86 -10.519 1.935 3.367 1.00 1.15 H new ATOM 0 HB3 GLU A 86 -11.776 2.654 4.354 1.00 1.15 H new ATOM 0 HG2 GLU A 86 -8.921 3.580 4.710 1.00 1.15 H new ATOM 0 HG3 GLU A 86 -9.818 4.137 3.311 1.00 1.15 H new ATOM 1391 N ILE A 87 -10.687 -0.845 5.017 1.00 1.19 N ATOM 1392 CA ILE A 87 -11.335 -2.143 5.170 1.00 1.32 C ATOM 1393 C ILE A 87 -11.435 -2.607 6.631 1.00 1.36 C ATOM 1394 O ILE A 87 -12.128 -3.577 6.911 1.00 1.30 O ATOM 1395 CB ILE A 87 -10.626 -3.202 4.295 1.00 1.29 C ATOM 1396 CG1 ILE A 87 -11.676 -4.211 3.796 1.00 1.56 C ATOM 1397 CG2 ILE A 87 -9.507 -3.939 5.052 1.00 1.32 C ATOM 1398 CD1 ILE A 87 -11.115 -5.054 2.660 1.00 1.22 C ATOM 0 H ILE A 87 -9.855 -0.871 4.428 1.00 1.19 H new ATOM 0 HA ILE A 87 -12.363 -2.024 4.826 1.00 1.32 H new ATOM 0 HB ILE A 87 -10.154 -2.689 3.457 1.00 1.29 H new ATOM 0 HG12 ILE A 87 -11.985 -4.858 4.617 1.00 1.56 H new ATOM 0 HG13 ILE A 87 -12.565 -3.680 3.457 1.00 1.56 H new ATOM 0 HG21 ILE A 87 -9.042 -4.671 4.392 1.00 1.32 H new ATOM 0 HG22 ILE A 87 -8.757 -3.220 5.382 1.00 1.32 H new ATOM 0 HG23 ILE A 87 -9.928 -4.448 5.919 1.00 1.32 H new ATOM 0 HD11 ILE A 87 -11.873 -5.760 2.322 1.00 1.22 H new ATOM 0 HD12 ILE A 87 -10.829 -4.405 1.832 1.00 1.22 H new ATOM 0 HD13 ILE A 87 -10.240 -5.601 3.011 1.00 1.22 H new ATOM 1410 N ARG A 88 -10.730 -1.957 7.567 1.00 1.60 N ATOM 1411 CA ARG A 88 -10.889 -2.222 8.990 1.00 1.77 C ATOM 1412 C ARG A 88 -11.365 -0.985 9.756 1.00 1.83 C ATOM 1413 O ARG A 88 -12.187 -1.134 10.662 1.00 2.19 O ATOM 1414 CB ARG A 88 -9.666 -2.955 9.571 1.00 1.88 C ATOM 1415 CG ARG A 88 -8.290 -2.293 9.448 1.00 2.42 C ATOM 1416 CD ARG A 88 -7.148 -3.301 9.694 1.00 2.23 C ATOM 1417 NE ARG A 88 -6.863 -3.601 11.114 1.00 2.77 N ATOM 1418 CZ ARG A 88 -7.315 -4.661 11.811 1.00 3.13 C ATOM 1419 NH1 ARG A 88 -8.350 -5.391 11.382 1.00 3.60 N ATOM 1420 NH2 ARG A 88 -6.739 -5.038 12.963 1.00 4.22 N ATOM 0 H ARG A 88 -10.039 -1.238 7.353 1.00 1.60 H new ATOM 0 HA ARG A 88 -11.706 -2.931 9.127 1.00 1.77 H new ATOM 0 HB2 ARG A 88 -9.856 -3.129 10.630 1.00 1.88 H new ATOM 0 HB3 ARG A 88 -9.607 -3.933 9.093 1.00 1.88 H new ATOM 0 HG2 ARG A 88 -8.183 -1.857 8.455 1.00 2.42 H new ATOM 0 HG3 ARG A 88 -8.214 -1.475 10.165 1.00 2.42 H new ATOM 0 HD2 ARG A 88 -7.393 -4.233 9.185 1.00 2.23 H new ATOM 0 HD3 ARG A 88 -6.239 -2.915 9.232 1.00 2.23 H new ATOM 0 HE ARG A 88 -6.267 -2.941 11.614 1.00 2.77 H new ATOM 0 HH11 ARG A 88 -8.817 -5.150 10.508 1.00 3.60 H new ATOM 0 HH12 ARG A 88 -8.673 -6.189 11.929 1.00 3.60 H new ATOM 0 HH21 ARG A 88 -5.941 -4.518 13.328 1.00 4.22 H new ATOM 0 HH22 ARG A 88 -7.099 -5.844 13.473 1.00 4.22 H new ATOM 1434 N LYS A 89 -10.891 0.228 9.425 1.00 1.64 N ATOM 1435 CA LYS A 89 -11.290 1.408 10.193 1.00 1.73 C ATOM 1436 C LYS A 89 -12.618 2.069 9.796 1.00 2.15 C ATOM 1437 O LYS A 89 -13.354 2.460 10.697 1.00 2.78 O ATOM 1438 CB LYS A 89 -10.160 2.442 10.304 1.00 1.70 C ATOM 1439 CG LYS A 89 -9.786 3.146 9.022 1.00 1.59 C ATOM 1440 CD LYS A 89 -8.834 4.305 9.313 1.00 1.51 C ATOM 1441 CE LYS A 89 -7.665 4.063 10.285 1.00 2.42 C ATOM 1442 NZ LYS A 89 -8.045 4.248 11.702 1.00 3.31 N ATOM 0 H LYS A 89 -10.250 0.410 8.653 1.00 1.64 H new ATOM 0 HA LYS A 89 -11.490 0.995 11.182 1.00 1.73 H new ATOM 0 HB2 LYS A 89 -10.452 3.194 11.038 1.00 1.70 H new ATOM 0 HB3 LYS A 89 -9.273 1.943 10.694 1.00 1.70 H new ATOM 0 HG2 LYS A 89 -9.314 2.442 8.337 1.00 1.59 H new ATOM 0 HG3 LYS A 89 -10.684 3.519 8.528 1.00 1.59 H new ATOM 0 HD2 LYS A 89 -8.414 4.636 8.363 1.00 1.51 H new ATOM 0 HD3 LYS A 89 -9.427 5.132 9.705 1.00 1.51 H new ATOM 0 HE2 LYS A 89 -7.287 3.050 10.145 1.00 2.42 H new ATOM 0 HE3 LYS A 89 -6.850 4.744 10.041 1.00 2.42 H new ATOM 0 HZ1 LYS A 89 -7.228 4.608 12.236 1.00 3.31 H new ATOM 0 HZ2 LYS A 89 -8.828 4.930 11.765 1.00 3.31 H new ATOM 0 HZ3 LYS A 89 -8.347 3.337 12.102 1.00 3.31 H new ATOM 1456 N LYS A 90 -12.888 2.324 8.505 1.00 2.82 N ATOM 1457 CA LYS A 90 -13.736 3.473 8.154 1.00 3.74 C ATOM 1458 C LYS A 90 -15.164 3.289 8.668 1.00 3.28 C ATOM 1459 O LYS A 90 -15.680 4.105 9.427 1.00 3.77 O ATOM 1460 CB LYS A 90 -13.715 3.769 6.642 1.00 5.22 C ATOM 1461 CG LYS A 90 -13.867 5.279 6.372 1.00 6.79 C ATOM 1462 CD LYS A 90 -13.959 5.573 4.864 1.00 7.99 C ATOM 1463 CE LYS A 90 -13.593 7.024 4.489 1.00 9.42 C ATOM 1464 NZ LYS A 90 -14.613 8.024 4.852 1.00 10.43 N ATOM 0 H LYS A 90 -12.547 1.775 7.716 1.00 2.82 H new ATOM 0 HA LYS A 90 -13.314 4.345 8.653 1.00 3.74 H new ATOM 0 HB2 LYS A 90 -12.780 3.411 6.211 1.00 5.22 H new ATOM 0 HB3 LYS A 90 -14.521 3.225 6.150 1.00 5.22 H new ATOM 0 HG2 LYS A 90 -14.761 5.651 6.872 1.00 6.79 H new ATOM 0 HG3 LYS A 90 -13.018 5.814 6.797 1.00 6.79 H new ATOM 0 HD2 LYS A 90 -13.297 4.892 4.329 1.00 7.99 H new ATOM 0 HD3 LYS A 90 -14.973 5.365 4.524 1.00 7.99 H new ATOM 0 HE2 LYS A 90 -12.655 7.287 4.978 1.00 9.42 H new ATOM 0 HE3 LYS A 90 -13.418 7.075 3.414 1.00 9.42 H new ATOM 0 HZ1 LYS A 90 -14.328 8.957 4.491 1.00 10.43 H new ATOM 0 HZ2 LYS A 90 -15.527 7.755 4.435 1.00 10.43 H new ATOM 0 HZ3 LYS A 90 -14.704 8.067 5.887 1.00 10.43 H new ATOM 1478 N LYS A 91 -15.792 2.201 8.227 1.00 3.41 N ATOM 1479 CA LYS A 91 -17.040 1.693 8.783 1.00 3.92 C ATOM 1480 C LYS A 91 -17.139 0.181 8.584 1.00 4.84 C ATOM 1481 O LYS A 91 -18.205 -0.383 8.846 1.00 5.90 O ATOM 1482 CB LYS A 91 -18.228 2.393 8.101 1.00 5.10 C ATOM 1483 CG LYS A 91 -19.494 2.396 8.974 1.00 5.93 C ATOM 1484 CD LYS A 91 -20.777 2.395 8.126 1.00 7.22 C ATOM 1485 CE LYS A 91 -21.373 0.991 7.918 1.00 8.18 C ATOM 1486 NZ LYS A 91 -20.425 0.015 7.341 1.00 8.60 N ATOM 0 H LYS A 91 -15.437 1.636 7.455 1.00 3.41 H new ATOM 0 HA LYS A 91 -17.061 1.901 9.853 1.00 3.92 H new ATOM 0 HB2 LYS A 91 -17.952 3.421 7.864 1.00 5.10 H new ATOM 0 HB3 LYS A 91 -18.444 1.895 7.156 1.00 5.10 H new ATOM 0 HG2 LYS A 91 -19.488 1.521 9.624 1.00 5.93 H new ATOM 0 HG3 LYS A 91 -19.487 3.274 9.620 1.00 5.93 H new ATOM 0 HD2 LYS A 91 -21.521 3.030 8.607 1.00 7.22 H new ATOM 0 HD3 LYS A 91 -20.561 2.837 7.153 1.00 7.22 H new ATOM 0 HE2 LYS A 91 -21.729 0.613 8.876 1.00 8.18 H new ATOM 0 HE3 LYS A 91 -22.241 1.069 7.264 1.00 8.18 H new ATOM 0 HZ1 LYS A 91 -20.858 -0.931 7.341 1.00 8.60 H new ATOM 0 HZ2 LYS A 91 -20.194 0.291 6.365 1.00 8.60 H new ATOM 0 HZ3 LYS A 91 -19.555 -0.003 7.911 1.00 8.60 H new ATOM 1500 N ASP A 92 -16.078 -0.426 8.035 1.00 5.16 N ATOM 1501 CA ASP A 92 -16.128 -1.493 7.038 1.00 7.14 C ATOM 1502 C ASP A 92 -17.550 -2.016 6.777 1.00 8.84 C ATOM 1503 O ASP A 92 -18.385 -1.299 6.218 1.00 10.08 O ATOM 1504 CB ASP A 92 -15.107 -2.565 7.429 1.00 7.28 C ATOM 1505 CG ASP A 92 -15.149 -3.746 6.472 1.00 8.47 C ATOM 1506 OD1 ASP A 92 -14.794 -3.551 5.291 1.00 9.45 O ATOM 1507 OD2 ASP A 92 -15.682 -4.777 6.939 1.00 8.72 O ATOM 0 H ASP A 92 -15.123 -0.173 8.287 1.00 5.16 H new ATOM 0 HA ASP A 92 -15.844 -1.099 6.062 1.00 7.14 H new ATOM 0 HB2 ASP A 92 -14.106 -2.133 7.432 1.00 7.28 H new ATOM 0 HB3 ASP A 92 -15.309 -2.909 8.443 1.00 7.28 H new ATOM 1512 N LEU A 93 -17.851 -3.218 7.259 1.00 9.26 N ATOM 1513 CA LEU A 93 -19.138 -3.859 7.188 1.00 10.89 C ATOM 1514 C LEU A 93 -20.018 -3.199 8.246 1.00 9.86 C ATOM 1515 O LEU A 93 -20.987 -2.513 7.915 1.00 10.72 O ATOM 1516 CB LEU A 93 -18.898 -5.364 7.406 1.00 12.38 C ATOM 1517 CG LEU A 93 -20.142 -6.163 7.797 1.00 13.60 C ATOM 1518 CD1 LEU A 93 -21.263 -6.028 6.762 1.00 15.38 C ATOM 1519 CD2 LEU A 93 -19.765 -7.636 7.989 1.00 14.92 C ATOM 0 H LEU A 93 -17.157 -3.794 7.734 1.00 9.26 H new ATOM 0 HA LEU A 93 -19.650 -3.751 6.232 1.00 10.89 H new ATOM 0 HB2 LEU A 93 -18.484 -5.788 6.491 1.00 12.38 H new ATOM 0 HB3 LEU A 93 -18.145 -5.488 8.184 1.00 12.38 H new ATOM 0 HG LEU A 93 -20.523 -5.756 8.734 1.00 13.60 H new ATOM 0 HD11 LEU A 93 -22.126 -6.612 7.082 1.00 15.38 H new ATOM 0 HD12 LEU A 93 -21.548 -4.980 6.669 1.00 15.38 H new ATOM 0 HD13 LEU A 93 -20.914 -6.395 5.797 1.00 15.38 H new ATOM 0 HD21 LEU A 93 -20.652 -8.205 8.268 1.00 14.92 H new ATOM 0 HD22 LEU A 93 -19.357 -8.032 7.059 1.00 14.92 H new ATOM 0 HD23 LEU A 93 -19.017 -7.720 8.777 1.00 14.92 H new ATOM 1531 N LYS A 94 -19.659 -3.370 9.519 1.00 8.44 N ATOM 1532 CA LYS A 94 -20.395 -2.867 10.667 1.00 7.75 C ATOM 1533 C LYS A 94 -19.407 -2.179 11.611 1.00 6.28 C ATOM 1534 O LYS A 94 -18.576 -2.844 12.224 1.00 6.34 O ATOM 1535 CB LYS A 94 -21.129 -4.036 11.347 1.00 8.98 C ATOM 1536 CG LYS A 94 -22.364 -4.455 10.530 1.00 10.66 C ATOM 1537 CD LYS A 94 -22.767 -5.912 10.801 1.00 12.46 C ATOM 1538 CE LYS A 94 -23.937 -6.309 9.884 1.00 14.16 C ATOM 1539 NZ LYS A 94 -24.224 -7.758 9.921 1.00 15.81 N ATOM 0 H LYS A 94 -18.817 -3.882 9.782 1.00 8.44 H new ATOM 0 HA LYS A 94 -21.147 -2.137 10.367 1.00 7.75 H new ATOM 0 HB2 LYS A 94 -20.452 -4.884 11.453 1.00 8.98 H new ATOM 0 HB3 LYS A 94 -21.434 -3.745 12.352 1.00 8.98 H new ATOM 0 HG2 LYS A 94 -23.199 -3.797 10.772 1.00 10.66 H new ATOM 0 HG3 LYS A 94 -22.156 -4.328 9.468 1.00 10.66 H new ATOM 0 HD2 LYS A 94 -21.917 -6.572 10.628 1.00 12.46 H new ATOM 0 HD3 LYS A 94 -23.055 -6.031 11.845 1.00 12.46 H new ATOM 0 HE2 LYS A 94 -24.829 -5.758 10.181 1.00 14.16 H new ATOM 0 HE3 LYS A 94 -23.707 -6.014 8.860 1.00 14.16 H new ATOM 0 HZ1 LYS A 94 -25.020 -7.971 9.286 1.00 15.81 H new ATOM 0 HZ2 LYS A 94 -23.383 -8.286 9.611 1.00 15.81 H new ATOM 0 HZ3 LYS A 94 -24.471 -8.038 10.892 1.00 15.81 H new ATOM 1553 N ILE A 95 -19.520 -0.852 11.718 1.00 5.82 N ATOM 1554 CA ILE A 95 -18.787 0.049 12.605 1.00 5.79 C ATOM 1555 C ILE A 95 -17.257 0.049 12.450 1.00 6.24 C ATOM 1556 O ILE A 95 -16.697 1.089 12.117 1.00 6.81 O ATOM 1557 CB ILE A 95 -19.297 0.002 14.066 1.00 6.66 C ATOM 1558 CG1 ILE A 95 -19.100 -1.343 14.796 1.00 7.75 C ATOM 1559 CG2 ILE A 95 -20.780 0.407 14.098 1.00 6.98 C ATOM 1560 CD1 ILE A 95 -19.415 -1.258 16.292 1.00 9.10 C ATOM 0 H ILE A 95 -20.183 -0.340 11.136 1.00 5.82 H new ATOM 0 HA ILE A 95 -19.039 1.045 12.242 1.00 5.79 H new ATOM 0 HB ILE A 95 -18.676 0.709 14.616 1.00 6.66 H new ATOM 0 HG12 ILE A 95 -19.739 -2.097 14.337 1.00 7.75 H new ATOM 0 HG13 ILE A 95 -18.070 -1.675 14.665 1.00 7.75 H new ATOM 0 HG21 ILE A 95 -21.144 0.375 15.125 1.00 6.98 H new ATOM 0 HG22 ILE A 95 -20.890 1.418 13.705 1.00 6.98 H new ATOM 0 HG23 ILE A 95 -21.359 -0.285 13.486 1.00 6.98 H new ATOM 0 HD11 ILE A 95 -19.259 -2.233 16.753 1.00 9.10 H new ATOM 0 HD12 ILE A 95 -18.758 -0.526 16.761 1.00 9.10 H new ATOM 0 HD13 ILE A 95 -20.453 -0.954 16.429 1.00 9.10 H new ATOM 1572 N ARG A 96 -16.574 -1.063 12.728 1.00 6.72 N ATOM 1573 CA ARG A 96 -15.130 -1.152 12.953 1.00 7.96 C ATOM 1574 C ARG A 96 -14.887 -2.570 13.471 1.00 8.14 C ATOM 1575 O ARG A 96 -15.111 -2.811 14.659 1.00 8.72 O ATOM 1576 CB ARG A 96 -14.708 -0.122 14.027 1.00 9.04 C ATOM 1577 CG ARG A 96 -13.216 -0.163 14.398 1.00 10.74 C ATOM 1578 CD ARG A 96 -13.007 0.321 15.842 1.00 11.97 C ATOM 1579 NE ARG A 96 -13.618 1.641 16.080 1.00 12.65 N ATOM 1580 CZ ARG A 96 -13.776 2.207 17.291 1.00 13.98 C ATOM 1581 NH1 ARG A 96 -13.300 1.593 18.381 1.00 14.77 N ATOM 1582 NH2 ARG A 96 -14.410 3.379 17.406 1.00 14.74 N ATOM 0 H ARG A 96 -17.035 -1.970 12.806 1.00 6.72 H new ATOM 0 HA ARG A 96 -14.559 -0.945 12.048 1.00 7.96 H new ATOM 0 HB2 ARG A 96 -14.953 0.878 13.669 1.00 9.04 H new ATOM 0 HB3 ARG A 96 -15.298 -0.292 14.927 1.00 9.04 H new ATOM 0 HG2 ARG A 96 -12.836 -1.179 14.290 1.00 10.74 H new ATOM 0 HG3 ARG A 96 -12.647 0.465 13.712 1.00 10.74 H new ATOM 0 HD2 ARG A 96 -13.435 -0.406 16.533 1.00 11.97 H new ATOM 0 HD3 ARG A 96 -11.939 0.373 16.055 1.00 11.97 H new ATOM 0 HE ARG A 96 -13.945 2.164 15.268 1.00 12.65 H new ATOM 0 HH11 ARG A 96 -12.819 0.698 18.293 1.00 14.77 H new ATOM 0 HH12 ARG A 96 -13.419 2.020 19.300 1.00 14.77 H new ATOM 0 HH21 ARG A 96 -14.775 3.845 16.575 1.00 14.74 H new ATOM 0 HH22 ARG A 96 -14.529 3.807 18.324 1.00 14.74 H new ATOM 1596 N LYS A 97 -14.513 -3.542 12.625 1.00 7.97 N ATOM 1597 CA LYS A 97 -14.806 -4.932 12.983 1.00 8.11 C ATOM 1598 C LYS A 97 -14.218 -5.973 12.014 1.00 8.09 C ATOM 1599 O LYS A 97 -14.932 -6.870 11.562 1.00 7.59 O ATOM 1600 CB LYS A 97 -16.344 -5.096 13.103 1.00 7.78 C ATOM 1601 CG LYS A 97 -16.774 -6.066 14.207 1.00 8.69 C ATOM 1602 CD LYS A 97 -18.311 -6.098 14.257 1.00 8.89 C ATOM 1603 CE LYS A 97 -18.862 -6.875 15.463 1.00 10.02 C ATOM 1604 NZ LYS A 97 -18.639 -6.167 16.743 1.00 10.84 N ATOM 0 H LYS A 97 -14.033 -3.402 11.736 1.00 7.97 H new ATOM 0 HA LYS A 97 -14.316 -5.131 13.936 1.00 8.11 H new ATOM 0 HB2 LYS A 97 -16.791 -4.120 13.294 1.00 7.78 H new ATOM 0 HB3 LYS A 97 -16.739 -5.446 12.149 1.00 7.78 H new ATOM 0 HG2 LYS A 97 -16.381 -7.063 14.009 1.00 8.69 H new ATOM 0 HG3 LYS A 97 -16.370 -5.749 15.168 1.00 8.69 H new ATOM 0 HD2 LYS A 97 -18.688 -5.076 14.289 1.00 8.89 H new ATOM 0 HD3 LYS A 97 -18.689 -6.549 13.339 1.00 8.89 H new ATOM 0 HE2 LYS A 97 -19.930 -7.043 15.326 1.00 10.02 H new ATOM 0 HE3 LYS A 97 -18.388 -7.856 15.507 1.00 10.02 H new ATOM 0 HZ1 LYS A 97 -19.043 -6.724 17.523 1.00 10.84 H new ATOM 0 HZ2 LYS A 97 -17.618 -6.044 16.898 1.00 10.84 H new ATOM 0 HZ3 LYS A 97 -19.099 -5.235 16.709 1.00 10.84 H new ATOM 1618 N LYS A 98 -12.893 -5.970 11.836 1.00 9.05 N ATOM 1619 CA LYS A 98 -12.132 -7.047 11.201 1.00 9.56 C ATOM 1620 C LYS A 98 -11.545 -6.533 9.895 1.00 9.69 C ATOM 1621 O LYS A 98 -12.125 -6.900 8.847 1.00 9.58 O ATOM 1622 CB LYS A 98 -11.057 -7.543 12.188 1.00 10.96 C ATOM 1623 CG LYS A 98 -10.224 -8.796 11.826 1.00 11.84 C ATOM 1624 CD LYS A 98 -9.274 -8.744 10.606 1.00 12.72 C ATOM 1625 CE LYS A 98 -9.786 -9.309 9.268 1.00 12.63 C ATOM 1626 NZ LYS A 98 -10.239 -10.712 9.347 1.00 12.64 N ATOM 1627 OXT LYS A 98 -10.504 -5.839 9.988 1.00 10.32 O ATOM 0 H LYS A 98 -12.304 -5.194 12.139 1.00 9.05 H new ATOM 0 HA LYS A 98 -12.769 -7.897 10.957 1.00 9.56 H new ATOM 0 HB2 LYS A 98 -10.360 -6.722 12.355 1.00 10.96 H new ATOM 0 HB3 LYS A 98 -11.551 -7.740 13.140 1.00 10.96 H new ATOM 0 HG2 LYS A 98 -9.624 -9.054 12.698 1.00 11.84 H new ATOM 0 HG3 LYS A 98 -10.921 -9.618 11.664 1.00 11.84 H new ATOM 0 HD2 LYS A 98 -8.995 -7.703 10.444 1.00 12.72 H new ATOM 0 HD3 LYS A 98 -8.363 -9.281 10.869 1.00 12.72 H new ATOM 0 HE2 LYS A 98 -10.611 -8.690 8.915 1.00 12.63 H new ATOM 0 HE3 LYS A 98 -8.992 -9.235 8.525 1.00 12.63 H new ATOM 0 HZ1 LYS A 98 -10.070 -11.183 8.435 1.00 12.64 H new ATOM 0 HZ2 LYS A 98 -9.711 -11.206 10.095 1.00 12.64 H new ATOM 0 HZ3 LYS A 98 -11.255 -10.737 9.567 1.00 12.64 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -14.454 -9.214 12.587 1.00 5.91 N ATOM 1643 CA MET B 1 -14.570 -10.556 12.009 1.00 6.64 C ATOM 1644 C MET B 1 -13.773 -10.576 10.703 1.00 6.23 C ATOM 1645 O MET B 1 -12.584 -10.893 10.714 1.00 7.01 O ATOM 1646 CB MET B 1 -14.062 -11.612 13.009 1.00 7.61 C ATOM 1647 CG MET B 1 -14.863 -11.665 14.325 1.00 8.13 C ATOM 1648 SD MET B 1 -14.807 -10.212 15.417 1.00 7.28 S ATOM 1649 CE MET B 1 -13.055 -10.161 15.862 1.00 7.79 C ATOM 0 H1 MET B 1 -14.931 -9.192 13.511 1.00 5.91 H new ATOM 0 H2 MET B 1 -13.449 -8.975 12.710 1.00 5.91 H new ATOM 0 H3 MET B 1 -14.899 -8.522 11.951 1.00 5.91 H new ATOM 0 HA MET B 1 -15.611 -10.799 11.796 1.00 6.64 H new ATOM 0 HB2 MET B 1 -14.096 -12.593 12.535 1.00 7.61 H new ATOM 0 HB3 MET B 1 -13.017 -11.406 13.240 1.00 7.61 H new ATOM 0 HG2 MET B 1 -15.907 -11.854 14.073 1.00 8.13 H new ATOM 0 HG3 MET B 1 -14.512 -12.525 14.895 1.00 8.13 H new ATOM 0 HE1 MET B 1 -12.889 -9.374 16.598 1.00 7.79 H new ATOM 0 HE2 MET B 1 -12.759 -11.121 16.284 1.00 7.79 H new ATOM 0 HE3 MET B 1 -12.459 -9.956 14.972 1.00 7.79 H new ATOM 1661 N ALA B 2 -14.382 -10.152 9.595 1.00 5.33 N ATOM 1662 CA ALA B 2 -13.679 -9.990 8.331 1.00 4.92 C ATOM 1663 C ALA B 2 -14.546 -9.205 7.354 1.00 3.77 C ATOM 1664 O ALA B 2 -15.617 -9.692 7.001 1.00 4.30 O ATOM 1665 CB ALA B 2 -13.359 -11.366 7.728 1.00 5.99 C ATOM 0 H ALA B 2 -15.373 -9.913 9.553 1.00 5.33 H new ATOM 0 HA ALA B 2 -12.751 -9.449 8.513 1.00 4.92 H new ATOM 0 HB1 ALA B 2 -12.833 -11.235 6.782 1.00 5.99 H new ATOM 0 HB2 ALA B 2 -12.730 -11.928 8.418 1.00 5.99 H new ATOM 0 HB3 ALA B 2 -14.286 -11.912 7.555 1.00 5.99 H new ATOM 1671 N ALA B 3 -14.105 -8.021 6.922 1.00 3.17 N ATOM 1672 CA ALA B 3 -13.844 -7.789 5.499 1.00 3.22 C ATOM 1673 C ALA B 3 -14.609 -8.729 4.544 1.00 2.67 C ATOM 1674 O ALA B 3 -14.155 -9.852 4.322 1.00 3.76 O ATOM 1675 CB ALA B 3 -12.334 -7.858 5.249 1.00 4.76 C ATOM 0 H ALA B 3 -13.923 -7.219 7.526 1.00 3.17 H new ATOM 0 HA ALA B 3 -14.225 -6.794 5.268 1.00 3.22 H new ATOM 0 HB1 ALA B 3 -12.132 -7.686 4.192 1.00 4.76 H new ATOM 0 HB2 ALA B 3 -11.832 -7.095 5.843 1.00 4.76 H new ATOM 0 HB3 ALA B 3 -11.963 -8.842 5.534 1.00 4.76 H new ATOM 1681 N GLU B 4 -15.727 -8.291 3.959 1.00 2.04 N ATOM 1682 CA GLU B 4 -16.411 -9.036 2.898 1.00 1.91 C ATOM 1683 C GLU B 4 -15.626 -8.900 1.571 1.00 1.66 C ATOM 1684 O GLU B 4 -14.780 -8.012 1.479 1.00 1.59 O ATOM 1685 CB GLU B 4 -17.863 -8.525 2.811 1.00 2.62 C ATOM 1686 CG GLU B 4 -18.621 -8.841 4.115 1.00 3.68 C ATOM 1687 CD GLU B 4 -20.100 -8.464 4.074 1.00 4.86 C ATOM 1688 OE1 GLU B 4 -20.483 -7.717 3.150 1.00 5.44 O ATOM 1689 OE2 GLU B 4 -20.825 -8.927 4.983 1.00 5.60 O ATOM 0 H GLU B 4 -16.183 -7.413 4.206 1.00 2.04 H new ATOM 0 HA GLU B 4 -16.448 -10.103 3.117 1.00 1.91 H new ATOM 0 HB2 GLU B 4 -17.867 -7.450 2.632 1.00 2.62 H new ATOM 0 HB3 GLU B 4 -18.370 -8.991 1.966 1.00 2.62 H new ATOM 0 HG2 GLU B 4 -18.533 -9.907 4.327 1.00 3.68 H new ATOM 0 HG3 GLU B 4 -18.143 -8.312 4.940 1.00 3.68 H new ATOM 1696 N PRO B 5 -15.845 -9.770 0.560 1.00 1.97 N ATOM 1697 CA PRO B 5 -15.190 -9.681 -0.751 1.00 1.97 C ATOM 1698 C PRO B 5 -15.850 -8.606 -1.632 1.00 1.47 C ATOM 1699 O PRO B 5 -17.002 -8.241 -1.393 1.00 1.78 O ATOM 1700 CB PRO B 5 -15.332 -11.073 -1.366 1.00 2.86 C ATOM 1701 CG PRO B 5 -16.657 -11.563 -0.783 1.00 3.20 C ATOM 1702 CD PRO B 5 -16.649 -10.980 0.633 1.00 2.70 C ATOM 0 HA PRO B 5 -14.144 -9.386 -0.662 1.00 1.97 H new ATOM 0 HB2 PRO B 5 -15.358 -11.034 -2.455 1.00 2.86 H new ATOM 0 HB3 PRO B 5 -14.503 -11.724 -1.090 1.00 2.86 H new ATOM 0 HG2 PRO B 5 -17.509 -11.206 -1.361 1.00 3.20 H new ATOM 0 HG3 PRO B 5 -16.714 -12.651 -0.771 1.00 3.20 H new ATOM 0 HD2 PRO B 5 -17.661 -10.757 0.969 1.00 2.70 H new ATOM 0 HD3 PRO B 5 -16.225 -11.688 1.345 1.00 2.70 H new ATOM 1710 N LEU B 6 -15.111 -8.055 -2.606 1.00 1.18 N ATOM 1711 CA LEU B 6 -15.332 -6.693 -3.100 1.00 1.06 C ATOM 1712 C LEU B 6 -14.812 -6.490 -4.551 1.00 1.04 C ATOM 1713 O LEU B 6 -14.630 -7.464 -5.279 1.00 1.53 O ATOM 1714 CB LEU B 6 -14.648 -5.762 -2.082 1.00 1.50 C ATOM 1715 CG LEU B 6 -15.323 -5.572 -0.717 1.00 2.34 C ATOM 1716 CD1 LEU B 6 -14.437 -4.704 0.183 1.00 3.51 C ATOM 1717 CD2 LEU B 6 -16.705 -4.915 -0.831 1.00 3.53 C ATOM 0 H LEU B 6 -14.345 -8.542 -3.071 1.00 1.18 H new ATOM 0 HA LEU B 6 -16.396 -6.471 -3.174 1.00 1.06 H new ATOM 0 HB2 LEU B 6 -13.641 -6.140 -1.907 1.00 1.50 H new ATOM 0 HB3 LEU B 6 -14.545 -4.780 -2.544 1.00 1.50 H new ATOM 0 HG LEU B 6 -15.457 -6.565 -0.288 1.00 2.34 H new ATOM 0 HD11 LEU B 6 -14.920 -4.572 1.151 1.00 3.51 H new ATOM 0 HD12 LEU B 6 -13.472 -5.191 0.323 1.00 3.51 H new ATOM 0 HD13 LEU B 6 -14.287 -3.730 -0.284 1.00 3.51 H new ATOM 0 HD21 LEU B 6 -17.138 -4.804 0.163 1.00 3.53 H new ATOM 0 HD22 LEU B 6 -16.604 -3.934 -1.295 1.00 3.53 H new ATOM 0 HD23 LEU B 6 -17.356 -5.540 -1.443 1.00 3.53 H new ATOM 1729 N THR B 7 -14.628 -5.237 -5.012 1.00 1.04 N ATOM 1730 CA THR B 7 -14.109 -4.885 -6.343 1.00 1.12 C ATOM 1731 C THR B 7 -12.651 -5.308 -6.497 1.00 1.19 C ATOM 1732 O THR B 7 -12.017 -5.726 -5.541 1.00 2.05 O ATOM 1733 CB THR B 7 -14.208 -3.363 -6.588 1.00 1.26 C ATOM 1734 OG1 THR B 7 -14.204 -3.061 -7.969 1.00 1.44 O ATOM 1735 CG2 THR B 7 -13.019 -2.605 -5.974 1.00 1.27 C ATOM 0 H THR B 7 -14.845 -4.416 -4.447 1.00 1.04 H new ATOM 0 HA THR B 7 -14.719 -5.416 -7.074 1.00 1.12 H new ATOM 0 HB THR B 7 -15.143 -3.053 -6.122 1.00 1.26 H new ATOM 0 HG1 THR B 7 -14.030 -2.105 -8.094 1.00 1.44 H new ATOM 0 HG21 THR B 7 -13.128 -1.538 -6.169 1.00 1.27 H new ATOM 0 HG22 THR B 7 -12.995 -2.776 -4.898 1.00 1.27 H new ATOM 0 HG23 THR B 7 -12.091 -2.962 -6.419 1.00 1.27 H new ATOM 1743 N GLU B 8 -12.068 -5.084 -7.672 1.00 0.92 N ATOM 1744 CA GLU B 8 -10.722 -5.529 -7.982 1.00 0.85 C ATOM 1745 C GLU B 8 -9.676 -4.943 -7.021 1.00 0.79 C ATOM 1746 O GLU B 8 -8.996 -5.690 -6.312 1.00 0.81 O ATOM 1747 CB GLU B 8 -10.441 -5.187 -9.438 1.00 1.02 C ATOM 1748 CG GLU B 8 -9.164 -5.867 -9.924 1.00 1.15 C ATOM 1749 CD GLU B 8 -8.908 -5.485 -11.377 1.00 1.47 C ATOM 1750 OE1 GLU B 8 -9.131 -4.289 -11.680 1.00 2.69 O ATOM 1751 OE2 GLU B 8 -8.517 -6.385 -12.149 1.00 2.43 O ATOM 0 H GLU B 8 -12.523 -4.585 -8.437 1.00 0.92 H new ATOM 0 HA GLU B 8 -10.649 -6.608 -7.843 1.00 0.85 H new ATOM 0 HB2 GLU B 8 -11.282 -5.500 -10.057 1.00 1.02 H new ATOM 0 HB3 GLU B 8 -10.347 -4.107 -9.550 1.00 1.02 H new ATOM 0 HG2 GLU B 8 -8.320 -5.566 -9.303 1.00 1.15 H new ATOM 0 HG3 GLU B 8 -9.258 -6.949 -9.832 1.00 1.15 H new ATOM 1758 N LEU B 9 -9.521 -3.612 -6.975 1.00 0.80 N ATOM 1759 CA LEU B 9 -8.607 -3.007 -6.010 1.00 0.84 C ATOM 1760 C LEU B 9 -8.910 -3.468 -4.574 1.00 0.82 C ATOM 1761 O LEU B 9 -7.982 -3.817 -3.846 1.00 0.86 O ATOM 1762 CB LEU B 9 -8.571 -1.476 -6.165 1.00 0.89 C ATOM 1763 CG LEU B 9 -7.563 -1.073 -7.260 1.00 0.98 C ATOM 1764 CD1 LEU B 9 -7.783 0.352 -7.771 1.00 1.21 C ATOM 1765 CD2 LEU B 9 -6.126 -1.093 -6.725 1.00 1.28 C ATOM 0 H LEU B 9 -10.007 -2.951 -7.582 1.00 0.80 H new ATOM 0 HA LEU B 9 -7.599 -3.361 -6.227 1.00 0.84 H new ATOM 0 HB2 LEU B 9 -9.564 -1.106 -6.421 1.00 0.89 H new ATOM 0 HB3 LEU B 9 -8.293 -1.014 -5.218 1.00 0.89 H new ATOM 0 HG LEU B 9 -7.717 -1.798 -8.060 1.00 0.98 H new ATOM 0 HD11 LEU B 9 -7.045 0.581 -8.540 1.00 1.21 H new ATOM 0 HD12 LEU B 9 -8.785 0.437 -8.193 1.00 1.21 H new ATOM 0 HD13 LEU B 9 -7.676 1.055 -6.945 1.00 1.21 H new ATOM 0 HD21 LEU B 9 -5.438 -0.805 -7.520 1.00 1.28 H new ATOM 0 HD22 LEU B 9 -6.037 -0.392 -5.895 1.00 1.28 H new ATOM 0 HD23 LEU B 9 -5.880 -2.097 -6.379 1.00 1.28 H new ATOM 1777 N GLU B 10 -10.189 -3.514 -4.183 1.00 0.79 N ATOM 1778 CA GLU B 10 -10.647 -4.017 -2.891 1.00 0.85 C ATOM 1779 C GLU B 10 -10.120 -5.452 -2.611 1.00 1.00 C ATOM 1780 O GLU B 10 -9.544 -5.703 -1.551 1.00 1.37 O ATOM 1781 CB GLU B 10 -12.181 -3.858 -2.757 1.00 0.91 C ATOM 1782 CG GLU B 10 -12.680 -2.381 -2.778 1.00 1.61 C ATOM 1783 CD GLU B 10 -14.142 -2.032 -3.168 1.00 2.40 C ATOM 1784 OE1 GLU B 10 -14.845 -2.908 -3.707 1.00 2.92 O ATOM 1785 OE2 GLU B 10 -14.543 -0.852 -3.002 1.00 3.54 O ATOM 0 H GLU B 10 -10.953 -3.192 -4.777 1.00 0.79 H new ATOM 0 HA GLU B 10 -10.214 -3.407 -2.099 1.00 0.85 H new ATOM 0 HB2 GLU B 10 -12.663 -4.403 -3.569 1.00 0.91 H new ATOM 0 HB3 GLU B 10 -12.502 -4.324 -1.825 1.00 0.91 H new ATOM 0 HG2 GLU B 10 -12.510 -1.973 -1.781 1.00 1.61 H new ATOM 0 HG3 GLU B 10 -12.029 -1.835 -3.461 1.00 1.61 H new ATOM 1792 N GLU B 11 -10.238 -6.388 -3.561 1.00 0.88 N ATOM 1793 CA GLU B 11 -9.653 -7.724 -3.440 1.00 0.84 C ATOM 1794 C GLU B 11 -8.133 -7.611 -3.263 1.00 0.85 C ATOM 1795 O GLU B 11 -7.534 -8.275 -2.415 1.00 0.91 O ATOM 1796 CB GLU B 11 -9.912 -8.567 -4.702 1.00 0.84 C ATOM 1797 CG GLU B 11 -11.378 -8.886 -5.014 1.00 1.82 C ATOM 1798 CD GLU B 11 -12.005 -9.825 -3.989 1.00 3.16 C ATOM 1799 OE1 GLU B 11 -11.707 -11.035 -4.082 1.00 3.50 O ATOM 1800 OE2 GLU B 11 -12.764 -9.321 -3.131 1.00 4.52 O ATOM 0 H GLU B 11 -10.743 -6.238 -4.435 1.00 0.88 H new ATOM 0 HA GLU B 11 -10.116 -8.205 -2.578 1.00 0.84 H new ATOM 0 HB2 GLU B 11 -9.486 -8.043 -5.557 1.00 0.84 H new ATOM 0 HB3 GLU B 11 -9.370 -9.508 -4.603 1.00 0.84 H new ATOM 0 HG2 GLU B 11 -11.949 -7.958 -5.048 1.00 1.82 H new ATOM 0 HG3 GLU B 11 -11.445 -9.338 -6.004 1.00 1.82 H new ATOM 1807 N SER B 12 -7.505 -6.783 -4.107 1.00 0.82 N ATOM 1808 CA SER B 12 -6.055 -6.624 -4.149 1.00 0.83 C ATOM 1809 C SER B 12 -5.511 -6.194 -2.784 1.00 0.81 C ATOM 1810 O SER B 12 -4.501 -6.723 -2.321 1.00 0.85 O ATOM 1811 CB SER B 12 -5.644 -5.639 -5.249 1.00 1.00 C ATOM 1812 OG SER B 12 -6.221 -5.997 -6.491 1.00 1.67 O ATOM 0 H SER B 12 -7.998 -6.201 -4.784 1.00 0.82 H new ATOM 0 HA SER B 12 -5.615 -7.592 -4.390 1.00 0.83 H new ATOM 0 HB2 SER B 12 -5.957 -4.631 -4.975 1.00 1.00 H new ATOM 0 HB3 SER B 12 -4.558 -5.622 -5.340 1.00 1.00 H new ATOM 0 HG SER B 12 -7.182 -5.805 -6.473 1.00 1.67 H new ATOM 1818 N ILE B 13 -6.178 -5.241 -2.125 1.00 0.81 N ATOM 1819 CA ILE B 13 -5.831 -4.895 -0.751 1.00 0.87 C ATOM 1820 C ILE B 13 -6.144 -6.043 0.209 1.00 0.88 C ATOM 1821 O ILE B 13 -5.314 -6.329 1.073 1.00 0.92 O ATOM 1822 CB ILE B 13 -6.350 -3.512 -0.301 1.00 0.96 C ATOM 1823 CG1 ILE B 13 -7.825 -3.222 -0.600 1.00 0.89 C ATOM 1824 CG2 ILE B 13 -5.485 -2.461 -1.012 1.00 1.05 C ATOM 1825 CD1 ILE B 13 -8.777 -3.576 0.535 1.00 0.97 C ATOM 0 H ILE B 13 -6.951 -4.704 -2.518 1.00 0.81 H new ATOM 0 HA ILE B 13 -4.749 -4.767 -0.720 1.00 0.87 H new ATOM 0 HB ILE B 13 -6.278 -3.487 0.786 1.00 0.96 H new ATOM 0 HG12 ILE B 13 -7.935 -2.163 -0.833 1.00 0.89 H new ATOM 0 HG13 ILE B 13 -8.119 -3.777 -1.491 1.00 0.89 H new ATOM 0 HG21 ILE B 13 -5.815 -1.463 -0.724 1.00 1.05 H new ATOM 0 HG22 ILE B 13 -4.442 -2.595 -0.726 1.00 1.05 H new ATOM 0 HG23 ILE B 13 -5.583 -2.579 -2.091 1.00 1.05 H new ATOM 0 HD11 ILE B 13 -9.799 -3.339 0.240 1.00 0.97 H new ATOM 0 HD12 ILE B 13 -8.700 -4.641 0.755 1.00 0.97 H new ATOM 0 HD13 ILE B 13 -8.514 -3.002 1.423 1.00 0.97 H new ATOM 1837 N GLU B 14 -7.281 -6.732 0.056 1.00 0.88 N ATOM 1838 CA GLU B 14 -7.587 -7.854 0.936 1.00 0.91 C ATOM 1839 C GLU B 14 -6.432 -8.863 0.948 1.00 0.92 C ATOM 1840 O GLU B 14 -5.871 -9.102 2.013 1.00 0.96 O ATOM 1841 CB GLU B 14 -8.940 -8.508 0.617 1.00 0.96 C ATOM 1842 CG GLU B 14 -9.576 -9.111 1.887 1.00 1.12 C ATOM 1843 CD GLU B 14 -8.746 -10.210 2.549 1.00 1.61 C ATOM 1844 OE1 GLU B 14 -8.266 -11.092 1.806 1.00 2.40 O ATOM 1845 OE2 GLU B 14 -8.600 -10.148 3.790 1.00 2.34 O ATOM 0 H GLU B 14 -7.987 -6.535 -0.653 1.00 0.88 H new ATOM 0 HA GLU B 14 -7.690 -7.459 1.946 1.00 0.91 H new ATOM 0 HB2 GLU B 14 -9.613 -7.767 0.185 1.00 0.96 H new ATOM 0 HB3 GLU B 14 -8.803 -9.289 -0.131 1.00 0.96 H new ATOM 0 HG2 GLU B 14 -9.741 -8.312 2.610 1.00 1.12 H new ATOM 0 HG3 GLU B 14 -10.555 -9.516 1.631 1.00 1.12 H new ATOM 1852 N THR B 15 -6.025 -9.400 -0.213 1.00 0.90 N ATOM 1853 CA THR B 15 -5.009 -10.460 -0.255 1.00 0.94 C ATOM 1854 C THR B 15 -3.765 -10.101 0.585 1.00 0.98 C ATOM 1855 O THR B 15 -3.302 -10.888 1.412 1.00 1.15 O ATOM 1856 CB THR B 15 -4.696 -10.934 -1.688 1.00 0.96 C ATOM 1857 OG1 THR B 15 -3.729 -11.965 -1.647 1.00 1.30 O ATOM 1858 CG2 THR B 15 -4.200 -9.841 -2.630 1.00 1.03 C ATOM 0 H THR B 15 -6.381 -9.120 -1.127 1.00 0.90 H new ATOM 0 HA THR B 15 -5.439 -11.337 0.229 1.00 0.94 H new ATOM 0 HB THR B 15 -5.647 -11.282 -2.091 1.00 0.96 H new ATOM 0 HG1 THR B 15 -3.533 -12.266 -2.559 1.00 1.30 H new ATOM 0 HG21 THR B 15 -4.006 -10.269 -3.614 1.00 1.03 H new ATOM 0 HG22 THR B 15 -4.958 -9.063 -2.716 1.00 1.03 H new ATOM 0 HG23 THR B 15 -3.280 -9.410 -2.235 1.00 1.03 H new ATOM 1866 N VAL B 16 -3.258 -8.873 0.451 1.00 0.88 N ATOM 1867 CA VAL B 16 -2.090 -8.442 1.215 1.00 0.88 C ATOM 1868 C VAL B 16 -2.440 -8.214 2.692 1.00 0.88 C ATOM 1869 O VAL B 16 -1.647 -8.551 3.573 1.00 0.92 O ATOM 1870 CB VAL B 16 -1.368 -7.248 0.563 1.00 0.83 C ATOM 1871 CG1 VAL B 16 -0.959 -7.580 -0.877 1.00 0.88 C ATOM 1872 CG2 VAL B 16 -2.186 -5.955 0.547 1.00 0.82 C ATOM 0 H VAL B 16 -3.637 -8.164 -0.177 1.00 0.88 H new ATOM 0 HA VAL B 16 -1.366 -9.257 1.194 1.00 0.88 H new ATOM 0 HB VAL B 16 -0.492 -7.074 1.188 1.00 0.83 H new ATOM 0 HG11 VAL B 16 -0.451 -6.722 -1.318 1.00 0.88 H new ATOM 0 HG12 VAL B 16 -0.287 -8.439 -0.876 1.00 0.88 H new ATOM 0 HG13 VAL B 16 -1.848 -7.815 -1.463 1.00 0.88 H new ATOM 0 HG21 VAL B 16 -1.607 -5.164 0.071 1.00 0.82 H new ATOM 0 HG22 VAL B 16 -3.108 -6.115 -0.011 1.00 0.82 H new ATOM 0 HG23 VAL B 16 -2.427 -5.664 1.570 1.00 0.82 H new ATOM 1882 N VAL B 17 -3.625 -7.664 2.982 1.00 0.88 N ATOM 1883 CA VAL B 17 -4.106 -7.519 4.352 1.00 0.90 C ATOM 1884 C VAL B 17 -4.168 -8.889 5.040 1.00 0.95 C ATOM 1885 O VAL B 17 -3.773 -9.000 6.200 1.00 1.06 O ATOM 1886 CB VAL B 17 -5.447 -6.756 4.390 1.00 0.92 C ATOM 1887 CG1 VAL B 17 -6.132 -6.846 5.760 1.00 0.98 C ATOM 1888 CG2 VAL B 17 -5.212 -5.271 4.076 1.00 0.91 C ATOM 0 H VAL B 17 -4.270 -7.310 2.276 1.00 0.88 H new ATOM 0 HA VAL B 17 -3.400 -6.913 4.919 1.00 0.90 H new ATOM 0 HB VAL B 17 -6.093 -7.220 3.645 1.00 0.92 H new ATOM 0 HG11 VAL B 17 -7.071 -6.293 5.734 1.00 0.98 H new ATOM 0 HG12 VAL B 17 -6.332 -7.891 5.999 1.00 0.98 H new ATOM 0 HG13 VAL B 17 -5.480 -6.418 6.522 1.00 0.98 H new ATOM 0 HG21 VAL B 17 -6.163 -4.738 4.104 1.00 0.91 H new ATOM 0 HG22 VAL B 17 -4.535 -4.845 4.817 1.00 0.91 H new ATOM 0 HG23 VAL B 17 -4.771 -5.174 3.084 1.00 0.91 H new ATOM 1898 N THR B 18 -4.623 -9.939 4.355 1.00 0.91 N ATOM 1899 CA THR B 18 -4.632 -11.275 4.933 1.00 0.97 C ATOM 1900 C THR B 18 -3.206 -11.834 5.067 1.00 0.92 C ATOM 1901 O THR B 18 -2.892 -12.382 6.126 1.00 0.96 O ATOM 1902 CB THR B 18 -5.662 -12.200 4.262 1.00 1.07 C ATOM 1903 OG1 THR B 18 -5.717 -13.443 4.933 1.00 1.14 O ATOM 1904 CG2 THR B 18 -5.400 -12.441 2.782 1.00 1.19 C ATOM 0 H THR B 18 -4.988 -9.887 3.404 1.00 0.91 H new ATOM 0 HA THR B 18 -4.995 -11.210 5.959 1.00 0.97 H new ATOM 0 HB THR B 18 -6.617 -11.681 4.335 1.00 1.07 H new ATOM 0 HG1 THR B 18 -6.377 -14.021 4.497 1.00 1.14 H new ATOM 0 HG21 THR B 18 -6.167 -13.102 2.380 1.00 1.19 H new ATOM 0 HG22 THR B 18 -5.424 -11.491 2.249 1.00 1.19 H new ATOM 0 HG23 THR B 18 -4.421 -12.903 2.656 1.00 1.19 H new ATOM 1912 N THR B 19 -2.302 -11.651 4.086 1.00 0.90 N ATOM 1913 CA THR B 19 -0.893 -12.015 4.276 1.00 0.94 C ATOM 1914 C THR B 19 -0.360 -11.391 5.574 1.00 1.00 C ATOM 1915 O THR B 19 0.156 -12.088 6.449 1.00 1.07 O ATOM 1916 CB THR B 19 -0.042 -11.578 3.070 1.00 1.00 C ATOM 1917 OG1 THR B 19 -0.715 -11.844 1.862 1.00 1.09 O ATOM 1918 CG2 THR B 19 1.314 -12.294 3.025 1.00 0.96 C ATOM 0 H THR B 19 -2.521 -11.260 3.170 1.00 0.90 H new ATOM 0 HA THR B 19 -0.823 -13.100 4.354 1.00 0.94 H new ATOM 0 HB THR B 19 0.125 -10.507 3.188 1.00 1.00 H new ATOM 0 HG1 THR B 19 -0.159 -11.558 1.108 1.00 1.09 H new ATOM 0 HG21 THR B 19 1.877 -11.952 2.157 1.00 0.96 H new ATOM 0 HG22 THR B 19 1.874 -12.069 3.933 1.00 0.96 H new ATOM 0 HG23 THR B 19 1.155 -13.370 2.954 1.00 0.96 H new ATOM 1926 N PHE B 20 -0.544 -10.074 5.717 1.00 1.00 N ATOM 1927 CA PHE B 20 -0.200 -9.345 6.928 1.00 1.07 C ATOM 1928 C PHE B 20 -0.829 -10.024 8.147 1.00 1.08 C ATOM 1929 O PHE B 20 -0.117 -10.452 9.048 1.00 1.12 O ATOM 1930 CB PHE B 20 -0.635 -7.877 6.787 1.00 1.14 C ATOM 1931 CG PHE B 20 -0.470 -7.019 8.030 1.00 1.94 C ATOM 1932 CD1 PHE B 20 -1.435 -7.051 9.053 1.00 3.33 C ATOM 1933 CD2 PHE B 20 0.622 -6.142 8.144 1.00 2.54 C ATOM 1934 CE1 PHE B 20 -1.260 -6.274 10.207 1.00 4.23 C ATOM 1935 CE2 PHE B 20 0.700 -5.240 9.220 1.00 3.51 C ATOM 1936 CZ PHE B 20 -0.256 -5.294 10.248 1.00 4.06 C ATOM 0 H PHE B 20 -0.940 -9.485 4.985 1.00 1.00 H new ATOM 0 HA PHE B 20 0.880 -9.357 7.076 1.00 1.07 H new ATOM 0 HB2 PHE B 20 -0.064 -7.424 5.977 1.00 1.14 H new ATOM 0 HB3 PHE B 20 -1.683 -7.855 6.489 1.00 1.14 H new ATOM 0 HD1 PHE B 20 -2.311 -7.674 8.950 1.00 3.33 H new ATOM 0 HD2 PHE B 20 1.406 -6.161 7.401 1.00 2.54 H new ATOM 0 HE1 PHE B 20 -1.898 -6.430 11.064 1.00 4.23 H new ATOM 0 HE2 PHE B 20 1.493 -4.508 9.256 1.00 3.51 H new ATOM 0 HZ PHE B 20 -0.219 -4.587 11.064 1.00 4.06 H new ATOM 1946 N PHE B 21 -2.159 -10.112 8.188 1.00 1.09 N ATOM 1947 CA PHE B 21 -2.903 -10.506 9.380 1.00 1.19 C ATOM 1948 C PHE B 21 -2.543 -11.921 9.822 1.00 1.31 C ATOM 1949 O PHE B 21 -2.377 -12.174 11.014 1.00 1.43 O ATOM 1950 CB PHE B 21 -4.407 -10.334 9.128 1.00 1.34 C ATOM 1951 CG PHE B 21 -5.264 -10.412 10.378 1.00 1.50 C ATOM 1952 CD1 PHE B 21 -5.171 -9.398 11.351 1.00 2.93 C ATOM 1953 CD2 PHE B 21 -6.102 -11.521 10.605 1.00 1.95 C ATOM 1954 CE1 PHE B 21 -5.886 -9.505 12.556 1.00 3.31 C ATOM 1955 CE2 PHE B 21 -6.833 -11.619 11.803 1.00 2.20 C ATOM 1956 CZ PHE B 21 -6.720 -10.614 12.781 1.00 2.38 C ATOM 0 H PHE B 21 -2.754 -9.909 7.385 1.00 1.09 H new ATOM 0 HA PHE B 21 -2.623 -9.853 10.207 1.00 1.19 H new ATOM 0 HB2 PHE B 21 -4.575 -9.371 8.647 1.00 1.34 H new ATOM 0 HB3 PHE B 21 -4.736 -11.102 8.428 1.00 1.34 H new ATOM 0 HD1 PHE B 21 -4.548 -8.535 11.170 1.00 2.93 H new ATOM 0 HD2 PHE B 21 -6.184 -12.297 9.858 1.00 1.95 H new ATOM 0 HE1 PHE B 21 -5.795 -8.736 13.309 1.00 3.31 H new ATOM 0 HE2 PHE B 21 -7.481 -12.466 11.972 1.00 2.20 H new ATOM 0 HZ PHE B 21 -7.274 -10.695 13.705 1.00 2.38 H new ATOM 1966 N THR B 22 -2.391 -12.842 8.868 1.00 1.32 N ATOM 1967 CA THR B 22 -1.905 -14.172 9.183 1.00 1.41 C ATOM 1968 C THR B 22 -0.498 -14.073 9.784 1.00 1.42 C ATOM 1969 O THR B 22 -0.299 -14.464 10.930 1.00 1.73 O ATOM 1970 CB THR B 22 -1.973 -15.094 7.956 1.00 1.46 C ATOM 1971 OG1 THR B 22 -1.302 -14.533 6.852 1.00 2.00 O ATOM 1972 CG2 THR B 22 -3.424 -15.386 7.558 1.00 2.25 C ATOM 0 H THR B 22 -2.597 -12.686 7.881 1.00 1.32 H new ATOM 0 HA THR B 22 -2.551 -14.630 9.932 1.00 1.41 H new ATOM 0 HB THR B 22 -1.482 -16.025 8.238 1.00 1.46 H new ATOM 0 HG1 THR B 22 -1.819 -13.776 6.505 1.00 2.00 H new ATOM 0 HG21 THR B 22 -3.438 -16.041 6.687 1.00 2.25 H new ATOM 0 HG22 THR B 22 -3.937 -15.874 8.387 1.00 2.25 H new ATOM 0 HG23 THR B 22 -3.930 -14.451 7.317 1.00 2.25 H new ATOM 1980 N PHE B 23 0.471 -13.522 9.047 1.00 1.20 N ATOM 1981 CA PHE B 23 1.868 -13.480 9.487 1.00 1.14 C ATOM 1982 C PHE B 23 2.009 -12.751 10.832 1.00 0.99 C ATOM 1983 O PHE B 23 2.819 -13.123 11.674 1.00 0.98 O ATOM 1984 CB PHE B 23 2.752 -12.815 8.418 1.00 1.20 C ATOM 1985 CG PHE B 23 3.123 -13.656 7.201 1.00 1.45 C ATOM 1986 CD1 PHE B 23 2.218 -14.574 6.629 1.00 3.02 C ATOM 1987 CD2 PHE B 23 4.391 -13.482 6.607 1.00 1.64 C ATOM 1988 CE1 PHE B 23 2.570 -15.303 5.483 1.00 3.66 C ATOM 1989 CE2 PHE B 23 4.749 -14.226 5.469 1.00 2.25 C ATOM 1990 CZ PHE B 23 3.837 -15.131 4.905 1.00 2.97 C ATOM 0 H PHE B 23 0.311 -13.095 8.135 1.00 1.20 H new ATOM 0 HA PHE B 23 2.204 -14.507 9.627 1.00 1.14 H new ATOM 0 HB2 PHE B 23 2.241 -11.919 8.067 1.00 1.20 H new ATOM 0 HB3 PHE B 23 3.675 -12.489 8.898 1.00 1.20 H new ATOM 0 HD1 PHE B 23 1.246 -14.717 7.077 1.00 3.02 H new ATOM 0 HD2 PHE B 23 5.090 -12.774 7.028 1.00 1.64 H new ATOM 0 HE1 PHE B 23 1.866 -15.996 5.046 1.00 3.66 H new ATOM 0 HE2 PHE B 23 5.727 -14.101 5.028 1.00 2.25 H new ATOM 0 HZ PHE B 23 4.110 -15.695 4.026 1.00 2.97 H new ATOM 2000 N ALA B 24 1.193 -11.723 11.052 1.00 0.96 N ATOM 2001 CA ALA B 24 1.181 -10.845 12.206 1.00 0.90 C ATOM 2002 C ALA B 24 1.071 -11.640 13.489 1.00 0.96 C ATOM 2003 O ALA B 24 1.548 -11.172 14.527 1.00 0.95 O ATOM 2004 CB ALA B 24 0.004 -9.864 12.142 1.00 1.06 C ATOM 0 H ALA B 24 0.473 -11.468 10.376 1.00 0.96 H new ATOM 0 HA ALA B 24 2.120 -10.291 12.194 1.00 0.90 H new ATOM 0 HB1 ALA B 24 0.020 -9.218 13.020 1.00 1.06 H new ATOM 0 HB2 ALA B 24 0.087 -9.255 11.242 1.00 1.06 H new ATOM 0 HB3 ALA B 24 -0.933 -10.421 12.118 1.00 1.06 H new ATOM 2010 N ARG B 25 0.424 -12.809 13.418 1.00 1.10 N ATOM 2011 CA ARG B 25 0.308 -13.736 14.524 1.00 1.26 C ATOM 2012 C ARG B 25 1.647 -13.966 15.215 1.00 1.32 C ATOM 2013 O ARG B 25 1.657 -14.212 16.418 1.00 1.57 O ATOM 2014 CB ARG B 25 -0.333 -15.050 14.043 1.00 1.46 C ATOM 2015 CG ARG B 25 0.668 -15.979 13.334 1.00 1.90 C ATOM 2016 CD ARG B 25 -0.010 -17.140 12.602 1.00 1.78 C ATOM 2017 NE ARG B 25 -0.619 -18.096 13.539 1.00 2.25 N ATOM 2018 CZ ARG B 25 -1.221 -19.237 13.169 1.00 3.06 C ATOM 2019 NH1 ARG B 25 -1.322 -19.543 11.871 1.00 3.30 N ATOM 2020 NH2 ARG B 25 -1.720 -20.065 14.095 1.00 4.53 N ATOM 0 H ARG B 25 -0.039 -13.133 12.569 1.00 1.10 H new ATOM 0 HA ARG B 25 -0.347 -13.296 15.276 1.00 1.26 H new ATOM 0 HB2 ARG B 25 -0.764 -15.572 14.897 1.00 1.46 H new ATOM 0 HB3 ARG B 25 -1.153 -14.821 13.363 1.00 1.46 H new ATOM 0 HG2 ARG B 25 1.252 -15.398 12.620 1.00 1.90 H new ATOM 0 HG3 ARG B 25 1.368 -16.378 14.068 1.00 1.90 H new ATOM 0 HD2 ARG B 25 -0.776 -16.749 11.932 1.00 1.78 H new ATOM 0 HD3 ARG B 25 0.723 -17.656 11.982 1.00 1.78 H new ATOM 0 HE ARG B 25 -0.581 -17.878 14.535 1.00 2.25 H new ATOM 0 HH11 ARG B 25 -0.942 -18.910 11.167 1.00 3.30 H new ATOM 0 HH12 ARG B 25 -1.779 -20.409 11.585 1.00 3.30 H new ATOM 0 HH21 ARG B 25 -1.643 -19.829 15.084 1.00 4.53 H new ATOM 0 HH22 ARG B 25 -2.177 -20.932 13.811 1.00 4.53 H new ATOM 2034 N GLN B 26 2.746 -13.952 14.451 1.00 1.19 N ATOM 2035 CA GLN B 26 3.855 -14.817 14.809 1.00 1.24 C ATOM 2036 C GLN B 26 4.454 -14.599 16.207 1.00 1.46 C ATOM 2037 O GLN B 26 4.405 -15.523 17.018 1.00 1.68 O ATOM 2038 CB GLN B 26 4.944 -14.652 13.745 1.00 1.01 C ATOM 2039 CG GLN B 26 5.561 -15.951 13.283 1.00 1.07 C ATOM 2040 CD GLN B 26 4.695 -16.644 12.230 1.00 1.26 C ATOM 2041 OE1 GLN B 26 3.626 -17.168 12.538 1.00 1.71 O ATOM 2042 NE2 GLN B 26 5.124 -16.631 10.974 1.00 1.67 N ATOM 0 H GLN B 26 2.882 -13.377 13.620 1.00 1.19 H new ATOM 0 HA GLN B 26 3.452 -15.829 14.847 1.00 1.24 H new ATOM 0 HB2 GLN B 26 4.519 -14.138 12.883 1.00 1.01 H new ATOM 0 HB3 GLN B 26 5.730 -14.011 14.143 1.00 1.01 H new ATOM 0 HG2 GLN B 26 6.551 -15.757 12.870 1.00 1.07 H new ATOM 0 HG3 GLN B 26 5.696 -16.614 14.137 1.00 1.07 H new ATOM 0 HE21 GLN B 26 6.014 -16.190 10.744 1.00 1.67 H new ATOM 0 HE22 GLN B 26 4.563 -17.062 10.239 1.00 1.67 H new ATOM 2051 N GLU B 27 5.090 -13.450 16.471 1.00 1.48 N ATOM 2052 CA GLU B 27 5.889 -13.341 17.686 1.00 1.66 C ATOM 2053 C GLU B 27 5.095 -12.804 18.881 1.00 1.84 C ATOM 2054 O GLU B 27 4.669 -13.550 19.759 1.00 1.78 O ATOM 2055 CB GLU B 27 7.077 -12.423 17.368 1.00 1.78 C ATOM 2056 CG GLU B 27 8.084 -13.006 16.368 1.00 1.88 C ATOM 2057 CD GLU B 27 9.066 -11.912 15.962 1.00 2.44 C ATOM 2058 OE1 GLU B 27 8.607 -10.769 15.762 1.00 3.03 O ATOM 2059 OE2 GLU B 27 10.278 -12.187 15.845 1.00 2.90 O ATOM 0 H GLU B 27 5.067 -12.617 15.883 1.00 1.48 H new ATOM 0 HA GLU B 27 6.222 -14.336 17.982 1.00 1.66 H new ATOM 0 HB2 GLU B 27 6.696 -11.481 16.973 1.00 1.78 H new ATOM 0 HB3 GLU B 27 7.599 -12.191 18.296 1.00 1.78 H new ATOM 0 HG2 GLU B 27 8.618 -13.844 16.816 1.00 1.88 H new ATOM 0 HG3 GLU B 27 7.564 -13.391 15.491 1.00 1.88 H new ATOM 2066 N GLY B 28 4.848 -11.489 18.878 1.00 2.22 N ATOM 2067 CA GLY B 28 3.824 -10.785 19.621 1.00 2.39 C ATOM 2068 C GLY B 28 2.573 -10.657 18.771 1.00 1.75 C ATOM 2069 O GLY B 28 2.705 -10.525 17.552 1.00 1.56 O ATOM 0 H GLY B 28 5.406 -10.852 18.310 1.00 2.22 H new ATOM 0 HA2 GLY B 28 3.596 -11.321 20.542 1.00 2.39 H new ATOM 0 HA3 GLY B 28 4.183 -9.797 19.908 1.00 2.39 H new ATOM 2073 N ARG B 29 1.412 -10.494 19.413 1.00 1.77 N ATOM 2074 CA ARG B 29 0.312 -9.662 18.925 1.00 1.52 C ATOM 2075 C ARG B 29 -0.054 -9.879 17.443 1.00 1.30 C ATOM 2076 O ARG B 29 0.616 -9.369 16.530 1.00 1.05 O ATOM 2077 CB ARG B 29 0.599 -8.181 19.234 1.00 1.50 C ATOM 2078 CG ARG B 29 -0.515 -7.481 20.024 1.00 1.78 C ATOM 2079 CD ARG B 29 -0.492 -7.853 21.512 1.00 2.36 C ATOM 2080 NE ARG B 29 -1.550 -7.139 22.245 1.00 2.73 N ATOM 2081 CZ ARG B 29 -1.753 -7.207 23.571 1.00 3.56 C ATOM 2082 NH1 ARG B 29 -0.951 -7.962 24.329 1.00 4.61 N ATOM 2083 NH2 ARG B 29 -2.759 -6.525 24.130 1.00 4.05 N ATOM 0 H ARG B 29 1.208 -10.947 20.304 1.00 1.77 H new ATOM 0 HA ARG B 29 -0.578 -9.982 19.467 1.00 1.52 H new ATOM 0 HB2 ARG B 29 1.529 -8.112 19.798 1.00 1.50 H new ATOM 0 HB3 ARG B 29 0.755 -7.648 18.296 1.00 1.50 H new ATOM 0 HG2 ARG B 29 -0.409 -6.401 19.920 1.00 1.78 H new ATOM 0 HG3 ARG B 29 -1.483 -7.749 19.599 1.00 1.78 H new ATOM 0 HD2 ARG B 29 -0.627 -8.929 21.625 1.00 2.36 H new ATOM 0 HD3 ARG B 29 0.481 -7.608 21.938 1.00 2.36 H new ATOM 0 HE ARG B 29 -2.179 -6.546 21.703 1.00 2.73 H new ATOM 0 HH11 ARG B 29 -0.187 -8.485 23.900 1.00 4.61 H new ATOM 0 HH12 ARG B 29 -1.103 -8.015 25.336 1.00 4.61 H new ATOM 0 HH21 ARG B 29 -3.372 -5.953 23.549 1.00 4.05 H new ATOM 0 HH22 ARG B 29 -2.913 -6.577 25.137 1.00 4.05 H new ATOM 2097 N LYS B 30 -1.146 -10.616 17.216 1.00 1.51 N ATOM 2098 CA LYS B 30 -1.717 -10.888 15.901 1.00 1.50 C ATOM 2099 C LYS B 30 -2.391 -9.653 15.274 1.00 1.48 C ATOM 2100 O LYS B 30 -3.516 -9.737 14.789 1.00 2.08 O ATOM 2101 CB LYS B 30 -2.671 -12.098 16.007 1.00 1.94 C ATOM 2102 CG LYS B 30 -3.939 -11.880 16.855 1.00 2.37 C ATOM 2103 CD LYS B 30 -4.728 -13.197 16.932 1.00 2.73 C ATOM 2104 CE LYS B 30 -6.154 -13.011 17.473 1.00 3.21 C ATOM 2105 NZ LYS B 30 -6.183 -12.468 18.847 1.00 4.17 N ATOM 0 H LYS B 30 -1.672 -11.053 17.972 1.00 1.51 H new ATOM 0 HA LYS B 30 -0.908 -11.138 15.215 1.00 1.50 H new ATOM 0 HB2 LYS B 30 -2.975 -12.386 15.001 1.00 1.94 H new ATOM 0 HB3 LYS B 30 -2.117 -12.938 16.426 1.00 1.94 H new ATOM 0 HG2 LYS B 30 -3.668 -11.545 17.856 1.00 2.37 H new ATOM 0 HG3 LYS B 30 -4.556 -11.098 16.413 1.00 2.37 H new ATOM 0 HD2 LYS B 30 -4.777 -13.643 15.939 1.00 2.73 H new ATOM 0 HD3 LYS B 30 -4.192 -13.899 17.571 1.00 2.73 H new ATOM 0 HE2 LYS B 30 -6.703 -12.341 16.812 1.00 3.21 H new ATOM 0 HE3 LYS B 30 -6.671 -13.970 17.456 1.00 3.21 H new ATOM 0 HZ1 LYS B 30 -7.170 -12.364 19.158 1.00 4.17 H new ATOM 0 HZ2 LYS B 30 -5.684 -13.118 19.488 1.00 4.17 H new ATOM 0 HZ3 LYS B 30 -5.715 -11.539 18.863 1.00 4.17 H new ATOM 2119 N ASP B 31 -1.715 -8.502 15.297 1.00 1.30 N ATOM 2120 CA ASP B 31 -2.276 -7.227 14.870 1.00 1.37 C ATOM 2121 C ASP B 31 -1.141 -6.273 14.488 1.00 1.23 C ATOM 2122 O ASP B 31 -1.123 -5.752 13.377 1.00 1.40 O ATOM 2123 CB ASP B 31 -3.183 -6.668 15.977 1.00 1.66 C ATOM 2124 CG ASP B 31 -3.931 -5.422 15.525 1.00 2.15 C ATOM 2125 OD1 ASP B 31 -4.832 -5.553 14.662 1.00 3.17 O ATOM 2126 OD2 ASP B 31 -3.587 -4.342 16.047 1.00 3.13 O ATOM 0 H ASP B 31 -0.749 -8.433 15.618 1.00 1.30 H new ATOM 0 HA ASP B 31 -2.898 -7.357 13.984 1.00 1.37 H new ATOM 0 HB2 ASP B 31 -3.900 -7.432 16.279 1.00 1.66 H new ATOM 0 HB3 ASP B 31 -2.581 -6.431 16.854 1.00 1.66 H new ATOM 2131 N SER B 32 -0.153 -6.096 15.371 1.00 1.15 N ATOM 2132 CA SER B 32 1.059 -5.345 15.070 1.00 1.11 C ATOM 2133 C SER B 32 2.091 -6.249 14.390 1.00 1.09 C ATOM 2134 O SER B 32 2.204 -7.442 14.720 1.00 1.06 O ATOM 2135 CB SER B 32 1.634 -4.781 16.371 1.00 1.22 C ATOM 2136 OG SER B 32 1.781 -5.830 17.305 1.00 1.63 O ATOM 0 H SER B 32 -0.177 -6.474 16.318 1.00 1.15 H new ATOM 0 HA SER B 32 0.817 -4.528 14.391 1.00 1.11 H new ATOM 0 HB2 SER B 32 2.598 -4.308 16.182 1.00 1.22 H new ATOM 0 HB3 SER B 32 0.974 -4.011 16.771 1.00 1.22 H new ATOM 0 HG SER B 32 2.305 -5.515 18.071 1.00 1.63 H new ATOM 2142 N LEU B 33 2.879 -5.671 13.478 1.00 1.20 N ATOM 2143 CA LEU B 33 4.112 -6.286 12.995 1.00 1.22 C ATOM 2144 C LEU B 33 5.267 -5.780 13.857 1.00 1.27 C ATOM 2145 O LEU B 33 5.058 -5.057 14.832 1.00 1.51 O ATOM 2146 CB LEU B 33 4.302 -6.071 11.483 1.00 1.29 C ATOM 2147 CG LEU B 33 3.543 -7.086 10.611 1.00 1.16 C ATOM 2148 CD1 LEU B 33 4.389 -8.337 10.369 1.00 1.69 C ATOM 2149 CD2 LEU B 33 2.180 -7.491 11.167 1.00 2.08 C ATOM 0 H LEU B 33 2.677 -4.764 13.056 1.00 1.20 H new ATOM 0 HA LEU B 33 4.069 -7.370 13.101 1.00 1.22 H new ATOM 0 HB2 LEU B 33 3.972 -5.065 11.224 1.00 1.29 H new ATOM 0 HB3 LEU B 33 5.365 -6.128 11.248 1.00 1.29 H new ATOM 0 HG LEU B 33 3.356 -6.570 9.669 1.00 1.16 H new ATOM 0 HD11 LEU B 33 3.831 -9.040 9.750 1.00 1.69 H new ATOM 0 HD12 LEU B 33 5.312 -8.059 9.860 1.00 1.69 H new ATOM 0 HD13 LEU B 33 4.628 -8.805 11.324 1.00 1.69 H new ATOM 0 HD21 LEU B 33 1.711 -8.208 10.494 1.00 2.08 H new ATOM 0 HD22 LEU B 33 2.308 -7.946 12.149 1.00 2.08 H new ATOM 0 HD23 LEU B 33 1.546 -6.609 11.256 1.00 2.08 H new ATOM 2161 N SER B 34 6.468 -6.267 13.575 1.00 1.70 N ATOM 2162 CA SER B 34 7.449 -6.554 14.603 1.00 1.36 C ATOM 2163 C SER B 34 8.870 -6.479 14.025 1.00 1.54 C ATOM 2164 O SER B 34 9.081 -6.216 12.842 1.00 2.18 O ATOM 2165 CB SER B 34 7.040 -7.870 15.311 1.00 1.74 C ATOM 2166 OG SER B 34 5.710 -7.768 15.819 1.00 2.90 O ATOM 0 H SER B 34 6.785 -6.473 12.628 1.00 1.70 H new ATOM 0 HA SER B 34 7.468 -5.800 15.390 1.00 1.36 H new ATOM 0 HB2 SER B 34 7.106 -8.703 14.611 1.00 1.74 H new ATOM 0 HB3 SER B 34 7.732 -8.083 16.126 1.00 1.74 H new ATOM 0 HG SER B 34 5.114 -8.340 15.292 1.00 2.90 H new ATOM 2172 N VAL B 35 9.814 -6.815 14.896 1.00 1.23 N ATOM 2173 CA VAL B 35 11.004 -7.591 14.549 1.00 1.03 C ATOM 2174 C VAL B 35 10.391 -8.991 14.364 1.00 1.54 C ATOM 2175 O VAL B 35 9.285 -9.029 13.835 1.00 3.37 O ATOM 2176 CB VAL B 35 12.088 -7.478 15.641 1.00 1.45 C ATOM 2177 CG1 VAL B 35 13.411 -8.125 15.204 1.00 1.51 C ATOM 2178 CG2 VAL B 35 12.386 -6.002 15.931 1.00 2.57 C ATOM 0 H VAL B 35 9.776 -6.553 15.881 1.00 1.23 H new ATOM 0 HA VAL B 35 11.550 -7.263 13.664 1.00 1.03 H new ATOM 0 HB VAL B 35 11.701 -7.991 16.521 1.00 1.45 H new ATOM 0 HG11 VAL B 35 14.147 -8.023 16.002 1.00 1.51 H new ATOM 0 HG12 VAL B 35 13.247 -9.182 14.994 1.00 1.51 H new ATOM 0 HG13 VAL B 35 13.779 -7.629 14.306 1.00 1.51 H new ATOM 0 HG21 VAL B 35 13.152 -5.930 16.703 1.00 2.57 H new ATOM 0 HG22 VAL B 35 12.741 -5.517 15.022 1.00 2.57 H new ATOM 0 HG23 VAL B 35 11.477 -5.508 16.275 1.00 2.57 H new ATOM 2188 N ASN B 36 11.121 -10.096 14.299 1.00 0.91 N ATOM 2189 CA ASN B 36 11.280 -10.893 13.086 1.00 1.33 C ATOM 2190 C ASN B 36 10.103 -11.876 12.844 1.00 1.07 C ATOM 2191 O ASN B 36 10.312 -13.002 12.408 1.00 2.02 O ATOM 2192 CB ASN B 36 12.596 -11.671 13.301 1.00 2.13 C ATOM 2193 CG ASN B 36 13.282 -12.204 12.048 1.00 3.04 C ATOM 2194 OD1 ASN B 36 14.307 -11.662 11.632 1.00 3.71 O ATOM 2195 ND2 ASN B 36 12.773 -13.273 11.448 1.00 3.35 N ATOM 0 H ASN B 36 11.629 -10.472 15.100 1.00 0.91 H new ATOM 0 HA ASN B 36 11.296 -10.253 12.204 1.00 1.33 H new ATOM 0 HB2 ASN B 36 13.297 -11.019 13.823 1.00 2.13 H new ATOM 0 HB3 ASN B 36 12.391 -12.513 13.962 1.00 2.13 H new ATOM 0 HD21 ASN B 36 13.232 -13.662 10.624 1.00 3.35 H new ATOM 0 HD22 ASN B 36 11.923 -13.705 11.811 1.00 3.35 H new ATOM 2202 N GLU B 37 8.868 -11.371 12.872 1.00 0.81 N ATOM 2203 CA GLU B 37 7.858 -11.484 11.834 1.00 0.73 C ATOM 2204 C GLU B 37 8.374 -10.820 10.573 1.00 0.76 C ATOM 2205 O GLU B 37 8.420 -11.433 9.516 1.00 0.95 O ATOM 2206 CB GLU B 37 6.593 -10.714 12.245 1.00 0.98 C ATOM 2207 CG GLU B 37 5.802 -11.535 13.243 1.00 0.75 C ATOM 2208 CD GLU B 37 4.827 -10.739 14.100 1.00 0.89 C ATOM 2209 OE1 GLU B 37 4.180 -9.776 13.634 1.00 1.63 O ATOM 2210 OE2 GLU B 37 4.567 -11.069 15.276 1.00 1.45 O ATOM 0 H GLU B 37 8.532 -10.839 13.675 1.00 0.81 H new ATOM 0 HA GLU B 37 7.637 -12.540 11.678 1.00 0.73 H new ATOM 0 HB2 GLU B 37 6.865 -9.754 12.683 1.00 0.98 H new ATOM 0 HB3 GLU B 37 5.982 -10.502 11.367 1.00 0.98 H new ATOM 0 HG2 GLU B 37 5.246 -12.300 12.702 1.00 0.75 H new ATOM 0 HG3 GLU B 37 6.501 -12.053 13.900 1.00 0.75 H new ATOM 2217 N PHE B 38 8.688 -9.525 10.650 1.00 0.68 N ATOM 2218 CA PHE B 38 8.834 -8.743 9.429 1.00 0.66 C ATOM 2219 C PHE B 38 9.851 -9.374 8.466 1.00 0.68 C ATOM 2220 O PHE B 38 9.571 -9.529 7.277 1.00 0.71 O ATOM 2221 CB PHE B 38 9.149 -7.293 9.797 1.00 0.74 C ATOM 2222 CG PHE B 38 8.664 -6.206 8.856 1.00 0.81 C ATOM 2223 CD1 PHE B 38 8.267 -6.475 7.530 1.00 1.93 C ATOM 2224 CD2 PHE B 38 8.423 -4.934 9.403 1.00 1.81 C ATOM 2225 CE1 PHE B 38 7.631 -5.483 6.769 1.00 2.09 C ATOM 2226 CE2 PHE B 38 7.747 -3.961 8.652 1.00 2.22 C ATOM 2227 CZ PHE B 38 7.404 -4.212 7.314 1.00 1.69 C ATOM 0 H PHE B 38 8.841 -9.012 11.518 1.00 0.68 H new ATOM 0 HA PHE B 38 7.894 -8.744 8.876 1.00 0.66 H new ATOM 0 HB2 PHE B 38 8.726 -7.097 10.782 1.00 0.74 H new ATOM 0 HB3 PHE B 38 10.231 -7.198 9.890 1.00 0.74 H new ATOM 0 HD1 PHE B 38 8.453 -7.448 7.099 1.00 1.93 H new ATOM 0 HD2 PHE B 38 8.759 -4.705 10.404 1.00 1.81 H new ATOM 0 HE1 PHE B 38 7.315 -5.700 5.759 1.00 2.09 H new ATOM 0 HE2 PHE B 38 7.489 -3.015 9.105 1.00 2.22 H new ATOM 0 HZ PHE B 38 6.968 -3.431 6.709 1.00 1.69 H new ATOM 2237 N LYS B 39 11.005 -9.820 8.976 1.00 0.74 N ATOM 2238 CA LYS B 39 11.986 -10.489 8.128 1.00 0.86 C ATOM 2239 C LYS B 39 11.386 -11.716 7.418 1.00 0.84 C ATOM 2240 O LYS B 39 11.729 -11.981 6.265 1.00 0.90 O ATOM 2241 CB LYS B 39 13.275 -10.827 8.883 1.00 1.00 C ATOM 2242 CG LYS B 39 14.474 -10.902 7.918 1.00 1.06 C ATOM 2243 CD LYS B 39 15.741 -11.530 8.520 1.00 1.55 C ATOM 2244 CE LYS B 39 16.651 -10.552 9.278 1.00 1.49 C ATOM 2245 NZ LYS B 39 15.994 -9.948 10.449 1.00 2.90 N ATOM 0 H LYS B 39 11.275 -9.730 9.955 1.00 0.74 H new ATOM 0 HA LYS B 39 12.266 -9.779 7.350 1.00 0.86 H new ATOM 0 HB2 LYS B 39 13.463 -10.071 9.645 1.00 1.00 H new ATOM 0 HB3 LYS B 39 13.159 -11.779 9.400 1.00 1.00 H new ATOM 0 HG2 LYS B 39 14.181 -11.477 7.040 1.00 1.06 H new ATOM 0 HG3 LYS B 39 14.711 -9.895 7.575 1.00 1.06 H new ATOM 0 HD2 LYS B 39 15.445 -12.329 9.200 1.00 1.55 H new ATOM 0 HD3 LYS B 39 16.317 -11.991 7.718 1.00 1.55 H new ATOM 0 HE2 LYS B 39 17.550 -11.077 9.602 1.00 1.49 H new ATOM 0 HE3 LYS B 39 16.971 -9.761 8.599 1.00 1.49 H new ATOM 0 HZ1 LYS B 39 16.656 -9.936 11.251 1.00 2.90 H new ATOM 0 HZ2 LYS B 39 15.707 -8.974 10.222 1.00 2.90 H new ATOM 0 HZ3 LYS B 39 15.154 -10.506 10.702 1.00 2.90 H new ATOM 2259 N GLU B 40 10.478 -12.450 8.071 1.00 0.81 N ATOM 2260 CA GLU B 40 9.801 -13.591 7.473 1.00 0.83 C ATOM 2261 C GLU B 40 9.076 -13.206 6.178 1.00 0.83 C ATOM 2262 O GLU B 40 9.020 -14.016 5.258 1.00 0.95 O ATOM 2263 CB GLU B 40 8.873 -14.301 8.481 1.00 0.85 C ATOM 2264 CG GLU B 40 9.681 -14.979 9.592 1.00 1.03 C ATOM 2265 CD GLU B 40 8.794 -15.835 10.490 1.00 1.82 C ATOM 2266 OE1 GLU B 40 7.560 -15.620 10.458 1.00 3.10 O ATOM 2267 OE2 GLU B 40 9.359 -16.715 11.170 1.00 2.49 O ATOM 0 H GLU B 40 10.196 -12.263 9.033 1.00 0.81 H new ATOM 0 HA GLU B 40 10.568 -14.315 7.197 1.00 0.83 H new ATOM 0 HB2 GLU B 40 8.184 -13.578 8.918 1.00 0.85 H new ATOM 0 HB3 GLU B 40 8.268 -15.044 7.962 1.00 0.85 H new ATOM 0 HG2 GLU B 40 10.459 -15.601 9.149 1.00 1.03 H new ATOM 0 HG3 GLU B 40 10.183 -14.220 10.192 1.00 1.03 H new ATOM 2274 N LEU B 41 8.566 -11.974 6.054 1.00 0.77 N ATOM 2275 CA LEU B 41 7.879 -11.543 4.840 1.00 0.77 C ATOM 2276 C LEU B 41 8.881 -11.541 3.686 1.00 0.79 C ATOM 2277 O LEU B 41 8.678 -12.173 2.644 1.00 0.83 O ATOM 2278 CB LEU B 41 7.282 -10.142 5.078 1.00 0.81 C ATOM 2279 CG LEU B 41 6.337 -9.592 3.994 1.00 0.85 C ATOM 2280 CD1 LEU B 41 6.989 -9.370 2.627 1.00 2.66 C ATOM 2281 CD2 LEU B 41 5.068 -10.442 3.856 1.00 2.13 C ATOM 0 H LEU B 41 8.619 -11.262 6.782 1.00 0.77 H new ATOM 0 HA LEU B 41 7.064 -12.221 4.585 1.00 0.77 H new ATOM 0 HB2 LEU B 41 6.739 -10.161 6.023 1.00 0.81 H new ATOM 0 HB3 LEU B 41 8.106 -9.439 5.198 1.00 0.81 H new ATOM 0 HG LEU B 41 6.063 -8.601 4.355 1.00 0.85 H new ATOM 0 HD11 LEU B 41 6.247 -8.982 1.929 1.00 2.66 H new ATOM 0 HD12 LEU B 41 7.805 -8.654 2.725 1.00 2.66 H new ATOM 0 HD13 LEU B 41 7.380 -10.316 2.252 1.00 2.66 H new ATOM 0 HD21 LEU B 41 4.429 -10.019 3.081 1.00 2.13 H new ATOM 0 HD22 LEU B 41 5.341 -11.462 3.585 1.00 2.13 H new ATOM 0 HD23 LEU B 41 4.531 -10.450 4.804 1.00 2.13 H new ATOM 2293 N VAL B 42 9.975 -10.810 3.905 1.00 0.82 N ATOM 2294 CA VAL B 42 10.954 -10.501 2.878 1.00 0.87 C ATOM 2295 C VAL B 42 11.700 -11.777 2.493 1.00 0.91 C ATOM 2296 O VAL B 42 11.962 -12.028 1.319 1.00 0.94 O ATOM 2297 CB VAL B 42 11.860 -9.327 3.301 1.00 0.89 C ATOM 2298 CG1 VAL B 42 11.076 -8.007 3.286 1.00 0.86 C ATOM 2299 CG2 VAL B 42 12.507 -9.484 4.672 1.00 0.90 C ATOM 0 H VAL B 42 10.203 -10.413 4.816 1.00 0.82 H new ATOM 0 HA VAL B 42 10.457 -10.146 1.975 1.00 0.87 H new ATOM 0 HB VAL B 42 12.665 -9.322 2.566 1.00 0.89 H new ATOM 0 HG11 VAL B 42 11.732 -7.191 3.587 1.00 0.86 H new ATOM 0 HG12 VAL B 42 10.700 -7.818 2.280 1.00 0.86 H new ATOM 0 HG13 VAL B 42 10.238 -8.074 3.980 1.00 0.86 H new ATOM 0 HG21 VAL B 42 13.125 -8.612 4.885 1.00 0.90 H new ATOM 0 HG22 VAL B 42 11.731 -9.573 5.432 1.00 0.90 H new ATOM 0 HG23 VAL B 42 13.128 -10.380 4.681 1.00 0.90 H new ATOM 2309 N THR B 43 11.981 -12.607 3.497 1.00 0.96 N ATOM 2310 CA THR B 43 12.570 -13.920 3.331 1.00 1.06 C ATOM 2311 C THR B 43 11.636 -14.844 2.542 1.00 1.10 C ATOM 2312 O THR B 43 12.040 -15.411 1.530 1.00 1.23 O ATOM 2313 CB THR B 43 12.869 -14.473 4.730 1.00 1.07 C ATOM 2314 OG1 THR B 43 13.742 -13.591 5.402 1.00 1.07 O ATOM 2315 CG2 THR B 43 13.516 -15.861 4.699 1.00 1.19 C ATOM 0 H THR B 43 11.797 -12.371 4.472 1.00 0.96 H new ATOM 0 HA THR B 43 13.493 -13.856 2.755 1.00 1.06 H new ATOM 0 HB THR B 43 11.913 -14.563 5.246 1.00 1.07 H new ATOM 0 HG1 THR B 43 13.221 -12.892 5.849 1.00 1.07 H new ATOM 0 HG21 THR B 43 13.703 -16.198 5.719 1.00 1.19 H new ATOM 0 HG22 THR B 43 12.847 -16.563 4.202 1.00 1.19 H new ATOM 0 HG23 THR B 43 14.459 -15.811 4.155 1.00 1.19 H new ATOM 2323 N GLN B 44 10.408 -15.049 3.030 1.00 1.04 N ATOM 2324 CA GLN B 44 9.551 -16.120 2.546 1.00 1.09 C ATOM 2325 C GLN B 44 8.952 -15.770 1.186 1.00 1.14 C ATOM 2326 O GLN B 44 9.124 -16.509 0.221 1.00 1.21 O ATOM 2327 CB GLN B 44 8.448 -16.395 3.582 1.00 1.12 C ATOM 2328 CG GLN B 44 7.634 -17.660 3.275 1.00 1.25 C ATOM 2329 CD GLN B 44 6.293 -17.653 4.005 1.00 1.57 C ATOM 2330 OE1 GLN B 44 5.258 -17.928 3.406 1.00 2.46 O ATOM 2331 NE2 GLN B 44 6.286 -17.304 5.288 1.00 1.46 N ATOM 0 H GLN B 44 9.989 -14.479 3.765 1.00 1.04 H new ATOM 0 HA GLN B 44 10.148 -17.022 2.413 1.00 1.09 H new ATOM 0 HB2 GLN B 44 8.901 -16.492 4.569 1.00 1.12 H new ATOM 0 HB3 GLN B 44 7.775 -15.538 3.623 1.00 1.12 H new ATOM 0 HG2 GLN B 44 7.464 -17.733 2.201 1.00 1.25 H new ATOM 0 HG3 GLN B 44 8.205 -18.541 3.568 1.00 1.25 H new ATOM 0 HE21 GLN B 44 7.162 -17.081 5.761 1.00 1.46 H new ATOM 0 HE22 GLN B 44 5.405 -17.260 5.800 1.00 1.46 H new ATOM 2340 N GLN B 45 8.178 -14.683 1.124 1.00 1.15 N ATOM 2341 CA GLN B 45 7.413 -14.357 -0.071 1.00 1.18 C ATOM 2342 C GLN B 45 8.284 -13.654 -1.105 1.00 1.09 C ATOM 2343 O GLN B 45 8.167 -13.924 -2.296 1.00 1.17 O ATOM 2344 CB GLN B 45 6.185 -13.495 0.282 1.00 1.32 C ATOM 2345 CG GLN B 45 4.855 -14.187 -0.060 1.00 2.00 C ATOM 2346 CD GLN B 45 4.423 -15.181 1.012 1.00 1.81 C ATOM 2347 OE1 GLN B 45 3.479 -14.921 1.748 1.00 3.06 O ATOM 2348 NE2 GLN B 45 5.114 -16.312 1.129 1.00 2.39 N ATOM 0 H GLN B 45 8.068 -14.018 1.889 1.00 1.15 H new ATOM 0 HA GLN B 45 7.061 -15.292 -0.507 1.00 1.18 H new ATOM 0 HB2 GLN B 45 6.205 -13.261 1.346 1.00 1.32 H new ATOM 0 HB3 GLN B 45 6.245 -12.548 -0.254 1.00 1.32 H new ATOM 0 HG2 GLN B 45 4.078 -13.433 -0.186 1.00 2.00 H new ATOM 0 HG3 GLN B 45 4.953 -14.706 -1.014 1.00 2.00 H new ATOM 0 HE21 GLN B 45 5.895 -16.500 0.501 1.00 2.39 H new ATOM 0 HE22 GLN B 45 4.862 -16.991 1.847 1.00 2.39 H new ATOM 2357 N LEU B 46 9.036 -12.656 -0.640 1.00 1.00 N ATOM 2358 CA LEU B 46 9.461 -11.502 -1.425 1.00 0.89 C ATOM 2359 C LEU B 46 10.716 -11.572 -2.322 1.00 0.96 C ATOM 2360 O LEU B 46 10.924 -10.604 -3.049 1.00 1.34 O ATOM 2361 CB LEU B 46 9.508 -10.280 -0.501 1.00 1.27 C ATOM 2362 CG LEU B 46 8.977 -8.999 -1.159 1.00 1.35 C ATOM 2363 CD1 LEU B 46 7.444 -8.992 -1.220 1.00 2.07 C ATOM 2364 CD2 LEU B 46 9.472 -7.786 -0.365 1.00 1.57 C ATOM 0 H LEU B 46 9.375 -12.630 0.322 1.00 1.00 H new ATOM 0 HA LEU B 46 8.697 -11.448 -2.200 1.00 0.89 H new ATOM 0 HB2 LEU B 46 8.924 -10.489 0.395 1.00 1.27 H new ATOM 0 HB3 LEU B 46 10.537 -10.116 -0.180 1.00 1.27 H new ATOM 0 HG LEU B 46 9.349 -8.956 -2.182 1.00 1.35 H new ATOM 0 HD11 LEU B 46 7.103 -8.071 -1.692 1.00 2.07 H new ATOM 0 HD12 LEU B 46 7.099 -9.847 -1.802 1.00 2.07 H new ATOM 0 HD13 LEU B 46 7.039 -9.054 -0.210 1.00 2.07 H new ATOM 0 HD21 LEU B 46 9.099 -6.872 -0.827 1.00 1.57 H new ATOM 0 HD22 LEU B 46 9.108 -7.849 0.661 1.00 1.57 H new ATOM 0 HD23 LEU B 46 10.562 -7.772 -0.363 1.00 1.57 H new ATOM 2376 N PRO B 47 11.645 -12.539 -2.191 1.00 1.16 N ATOM 2377 CA PRO B 47 13.079 -12.312 -2.375 1.00 1.22 C ATOM 2378 C PRO B 47 13.477 -11.469 -3.594 1.00 1.21 C ATOM 2379 O PRO B 47 14.232 -10.508 -3.449 1.00 1.66 O ATOM 2380 CB PRO B 47 13.745 -13.695 -2.371 1.00 1.47 C ATOM 2381 CG PRO B 47 12.591 -14.668 -2.591 1.00 1.63 C ATOM 2382 CD PRO B 47 11.406 -13.951 -1.950 1.00 1.87 C ATOM 0 HA PRO B 47 13.432 -11.688 -1.554 1.00 1.22 H new ATOM 0 HB2 PRO B 47 14.492 -13.779 -3.160 1.00 1.47 H new ATOM 0 HB3 PRO B 47 14.255 -13.889 -1.427 1.00 1.47 H new ATOM 0 HG2 PRO B 47 12.421 -14.859 -3.651 1.00 1.63 H new ATOM 0 HG3 PRO B 47 12.781 -15.632 -2.120 1.00 1.63 H new ATOM 0 HD2 PRO B 47 10.464 -14.273 -2.393 1.00 1.87 H new ATOM 0 HD3 PRO B 47 11.346 -14.164 -0.883 1.00 1.87 H new ATOM 2390 N HIS B 48 12.988 -11.800 -4.792 1.00 1.21 N ATOM 2391 CA HIS B 48 13.363 -11.112 -6.028 1.00 1.52 C ATOM 2392 C HIS B 48 12.660 -9.748 -6.172 1.00 1.74 C ATOM 2393 O HIS B 48 12.115 -9.428 -7.223 1.00 3.31 O ATOM 2394 CB HIS B 48 13.086 -12.049 -7.212 1.00 1.60 C ATOM 2395 CG HIS B 48 13.599 -11.542 -8.539 1.00 2.06 C ATOM 2396 ND1 HIS B 48 12.819 -11.090 -9.581 1.00 3.30 N ATOM 2397 CD2 HIS B 48 14.909 -11.401 -8.903 1.00 2.10 C ATOM 2398 CE1 HIS B 48 13.656 -10.706 -10.563 1.00 3.41 C ATOM 2399 NE2 HIS B 48 14.939 -10.875 -10.199 1.00 2.59 N ATOM 0 H HIS B 48 12.318 -12.556 -4.931 1.00 1.21 H new ATOM 0 HA HIS B 48 14.428 -10.879 -6.004 1.00 1.52 H new ATOM 0 HB2 HIS B 48 13.540 -13.019 -7.007 1.00 1.60 H new ATOM 0 HB3 HIS B 48 12.011 -12.210 -7.289 1.00 1.60 H new ATOM 0 HD2 HIS B 48 15.768 -11.651 -8.298 1.00 2.10 H new ATOM 0 HE1 HIS B 48 13.338 -10.314 -11.518 1.00 3.41 H new ATOM 0 HE2 HIS B 48 15.767 -10.663 -10.755 1.00 2.59 H new ATOM 2407 N LEU B 49 12.695 -8.918 -5.126 1.00 0.75 N ATOM 2408 CA LEU B 49 12.101 -7.598 -5.113 1.00 0.66 C ATOM 2409 C LEU B 49 12.879 -6.691 -4.159 1.00 0.74 C ATOM 2410 O LEU B 49 13.474 -5.708 -4.595 1.00 0.96 O ATOM 2411 CB LEU B 49 10.615 -7.721 -4.743 1.00 0.57 C ATOM 2412 CG LEU B 49 9.780 -6.523 -5.204 1.00 0.58 C ATOM 2413 CD1 LEU B 49 9.731 -6.470 -6.728 1.00 0.67 C ATOM 2414 CD2 LEU B 49 8.339 -6.679 -4.720 1.00 0.70 C ATOM 0 H LEU B 49 13.151 -9.161 -4.247 1.00 0.75 H new ATOM 0 HA LEU B 49 12.156 -7.138 -6.100 1.00 0.66 H new ATOM 0 HB2 LEU B 49 10.210 -8.631 -5.187 1.00 0.57 H new ATOM 0 HB3 LEU B 49 10.523 -7.826 -3.662 1.00 0.57 H new ATOM 0 HG LEU B 49 10.237 -5.620 -4.799 1.00 0.58 H new ATOM 0 HD11 LEU B 49 9.134 -5.614 -7.043 1.00 0.67 H new ATOM 0 HD12 LEU B 49 10.743 -6.372 -7.121 1.00 0.67 H new ATOM 0 HD13 LEU B 49 9.281 -7.386 -7.110 1.00 0.67 H new ATOM 0 HD21 LEU B 49 7.749 -5.824 -5.051 1.00 0.70 H new ATOM 0 HD22 LEU B 49 7.914 -7.594 -5.132 1.00 0.70 H new ATOM 0 HD23 LEU B 49 8.324 -6.730 -3.631 1.00 0.70 H new ATOM 2426 N LEU B 50 12.918 -7.039 -2.867 1.00 0.79 N ATOM 2427 CA LEU B 50 13.800 -6.399 -1.899 1.00 0.94 C ATOM 2428 C LEU B 50 14.884 -7.392 -1.508 1.00 1.07 C ATOM 2429 O LEU B 50 14.609 -8.396 -0.854 1.00 1.69 O ATOM 2430 CB LEU B 50 13.047 -5.924 -0.652 1.00 1.11 C ATOM 2431 CG LEU B 50 12.085 -4.765 -0.941 1.00 0.70 C ATOM 2432 CD1 LEU B 50 11.268 -4.483 0.325 1.00 1.08 C ATOM 2433 CD2 LEU B 50 12.810 -3.475 -1.348 1.00 0.97 C ATOM 0 H LEU B 50 12.335 -7.775 -2.468 1.00 0.79 H new ATOM 0 HA LEU B 50 14.235 -5.513 -2.360 1.00 0.94 H new ATOM 0 HB2 LEU B 50 12.486 -6.759 -0.232 1.00 1.11 H new ATOM 0 HB3 LEU B 50 13.767 -5.612 0.104 1.00 1.11 H new ATOM 0 HG LEU B 50 11.453 -5.065 -1.777 1.00 0.70 H new ATOM 0 HD11 LEU B 50 10.578 -3.661 0.137 1.00 1.08 H new ATOM 0 HD12 LEU B 50 10.704 -5.374 0.600 1.00 1.08 H new ATOM 0 HD13 LEU B 50 11.940 -4.213 1.139 1.00 1.08 H new ATOM 0 HD21 LEU B 50 12.077 -2.691 -1.540 1.00 0.97 H new ATOM 0 HD22 LEU B 50 13.475 -3.162 -0.543 1.00 0.97 H new ATOM 0 HD23 LEU B 50 13.393 -3.655 -2.251 1.00 0.97 H new ATOM 2445 N LYS B 51 16.114 -7.082 -1.909 1.00 1.04 N ATOM 2446 CA LYS B 51 17.300 -7.800 -1.467 1.00 1.29 C ATOM 2447 C LYS B 51 17.682 -7.307 -0.062 1.00 1.40 C ATOM 2448 O LYS B 51 16.893 -6.631 0.597 1.00 2.15 O ATOM 2449 CB LYS B 51 18.402 -7.644 -2.538 1.00 1.64 C ATOM 2450 CG LYS B 51 19.339 -6.442 -2.333 1.00 2.26 C ATOM 2451 CD LYS B 51 19.786 -5.777 -3.640 1.00 2.74 C ATOM 2452 CE LYS B 51 21.218 -5.208 -3.605 1.00 3.98 C ATOM 2453 NZ LYS B 51 21.578 -4.559 -2.326 1.00 5.03 N ATOM 0 H LYS B 51 16.314 -6.319 -2.555 1.00 1.04 H new ATOM 0 HA LYS B 51 17.128 -8.872 -1.370 1.00 1.29 H new ATOM 0 HB2 LYS B 51 19.001 -8.554 -2.557 1.00 1.64 H new ATOM 0 HB3 LYS B 51 17.928 -7.554 -3.515 1.00 1.64 H new ATOM 0 HG2 LYS B 51 18.834 -5.701 -1.713 1.00 2.26 H new ATOM 0 HG3 LYS B 51 20.221 -6.770 -1.783 1.00 2.26 H new ATOM 0 HD2 LYS B 51 19.717 -6.506 -4.447 1.00 2.74 H new ATOM 0 HD3 LYS B 51 19.093 -4.970 -3.879 1.00 2.74 H new ATOM 0 HE2 LYS B 51 21.923 -6.015 -3.802 1.00 3.98 H new ATOM 0 HE3 LYS B 51 21.330 -4.484 -4.412 1.00 3.98 H new ATOM 0 HZ1 LYS B 51 22.341 -3.872 -2.488 1.00 5.03 H new ATOM 0 HZ2 LYS B 51 20.746 -4.068 -1.940 1.00 5.03 H new ATOM 0 HZ3 LYS B 51 21.900 -5.280 -1.649 1.00 5.03 H new ATOM 2467 N ASP B 52 18.904 -7.617 0.387 1.00 1.35 N ATOM 2468 CA ASP B 52 19.517 -7.063 1.598 1.00 1.36 C ATOM 2469 C ASP B 52 18.737 -7.493 2.842 1.00 1.36 C ATOM 2470 O ASP B 52 18.806 -6.852 3.889 1.00 1.86 O ATOM 2471 CB ASP B 52 19.667 -5.529 1.515 1.00 1.59 C ATOM 2472 CG ASP B 52 20.506 -5.050 0.346 1.00 2.70 C ATOM 2473 OD1 ASP B 52 21.509 -5.717 0.002 1.00 3.97 O ATOM 2474 OD2 ASP B 52 20.117 -4.057 -0.310 1.00 3.48 O ATOM 0 H ASP B 52 19.510 -8.279 -0.097 1.00 1.35 H new ATOM 0 HA ASP B 52 20.525 -7.469 1.679 1.00 1.36 H new ATOM 0 HB2 ASP B 52 18.676 -5.081 1.444 1.00 1.59 H new ATOM 0 HB3 ASP B 52 20.114 -5.168 2.441 1.00 1.59 H new ATOM 2479 N VAL B 53 18.031 -8.623 2.736 1.00 1.08 N ATOM 2480 CA VAL B 53 17.046 -9.085 3.701 1.00 1.06 C ATOM 2481 C VAL B 53 17.642 -9.345 5.088 1.00 1.58 C ATOM 2482 O VAL B 53 16.912 -9.389 6.076 1.00 1.76 O ATOM 2483 CB VAL B 53 16.314 -10.313 3.134 1.00 0.99 C ATOM 2484 CG1 VAL B 53 15.596 -9.976 1.821 1.00 1.24 C ATOM 2485 CG2 VAL B 53 17.242 -11.518 2.923 1.00 1.56 C ATOM 0 H VAL B 53 18.138 -9.259 1.946 1.00 1.08 H new ATOM 0 HA VAL B 53 16.321 -8.286 3.857 1.00 1.06 H new ATOM 0 HB VAL B 53 15.577 -10.594 3.886 1.00 0.99 H new ATOM 0 HG11 VAL B 53 15.088 -10.864 1.446 1.00 1.24 H new ATOM 0 HG12 VAL B 53 14.864 -9.188 1.998 1.00 1.24 H new ATOM 0 HG13 VAL B 53 16.324 -9.636 1.085 1.00 1.24 H new ATOM 0 HG21 VAL B 53 16.668 -12.353 2.521 1.00 1.56 H new ATOM 0 HG22 VAL B 53 18.032 -11.250 2.222 1.00 1.56 H new ATOM 0 HG23 VAL B 53 17.685 -11.807 3.876 1.00 1.56 H new ATOM 2495 N GLY B 54 18.964 -9.509 5.179 1.00 2.16 N ATOM 2496 CA GLY B 54 19.662 -9.508 6.452 1.00 2.77 C ATOM 2497 C GLY B 54 19.477 -8.163 7.158 1.00 2.39 C ATOM 2498 O GLY B 54 19.024 -8.122 8.302 1.00 2.69 O ATOM 0 H GLY B 54 19.572 -9.645 4.372 1.00 2.16 H new ATOM 0 HA2 GLY B 54 19.284 -10.313 7.083 1.00 2.77 H new ATOM 0 HA3 GLY B 54 20.723 -9.700 6.293 1.00 2.77 H new ATOM 2502 N SER B 55 19.782 -7.063 6.462 1.00 1.88 N ATOM 2503 CA SER B 55 19.849 -5.714 7.021 1.00 1.60 C ATOM 2504 C SER B 55 18.455 -5.081 7.134 1.00 1.22 C ATOM 2505 O SER B 55 18.292 -3.872 6.952 1.00 1.25 O ATOM 2506 CB SER B 55 20.772 -4.862 6.135 1.00 1.78 C ATOM 2507 OG SER B 55 21.015 -3.602 6.723 1.00 2.39 O ATOM 0 H SER B 55 19.995 -7.090 5.465 1.00 1.88 H new ATOM 0 HA SER B 55 20.253 -5.764 8.032 1.00 1.60 H new ATOM 0 HB2 SER B 55 21.717 -5.383 5.980 1.00 1.78 H new ATOM 0 HB3 SER B 55 20.318 -4.728 5.153 1.00 1.78 H new ATOM 0 HG SER B 55 20.166 -3.206 7.011 1.00 2.39 H new ATOM 2513 N LEU B 56 17.438 -5.895 7.428 1.00 1.03 N ATOM 2514 CA LEU B 56 16.043 -5.509 7.462 1.00 0.79 C ATOM 2515 C LEU B 56 15.824 -4.398 8.500 1.00 0.79 C ATOM 2516 O LEU B 56 14.915 -3.581 8.358 1.00 0.81 O ATOM 2517 CB LEU B 56 15.266 -6.815 7.707 1.00 0.88 C ATOM 2518 CG LEU B 56 13.736 -6.791 7.639 1.00 0.95 C ATOM 2519 CD1 LEU B 56 13.149 -6.415 8.999 1.00 1.22 C ATOM 2520 CD2 LEU B 56 13.213 -5.898 6.518 1.00 0.86 C ATOM 0 H LEU B 56 17.580 -6.879 7.657 1.00 1.03 H new ATOM 0 HA LEU B 56 15.682 -5.062 6.536 1.00 0.79 H new ATOM 0 HB2 LEU B 56 15.617 -7.548 6.980 1.00 0.88 H new ATOM 0 HB3 LEU B 56 15.546 -7.185 8.693 1.00 0.88 H new ATOM 0 HG LEU B 56 13.400 -7.798 7.393 1.00 0.95 H new ATOM 0 HD11 LEU B 56 12.061 -6.402 8.935 1.00 1.22 H new ATOM 0 HD12 LEU B 56 13.460 -7.147 9.744 1.00 1.22 H new ATOM 0 HD13 LEU B 56 13.507 -5.427 9.289 1.00 1.22 H new ATOM 0 HD21 LEU B 56 12.123 -5.918 6.515 1.00 0.86 H new ATOM 0 HD22 LEU B 56 13.557 -4.876 6.677 1.00 0.86 H new ATOM 0 HD23 LEU B 56 13.585 -6.261 5.560 1.00 0.86 H new ATOM 2532 N ASP B 57 16.692 -4.319 9.510 1.00 0.90 N ATOM 2533 CA ASP B 57 16.729 -3.257 10.497 1.00 1.00 C ATOM 2534 C ASP B 57 16.775 -1.854 9.875 1.00 0.90 C ATOM 2535 O ASP B 57 16.180 -0.936 10.451 1.00 0.91 O ATOM 2536 CB ASP B 57 17.896 -3.487 11.463 1.00 1.32 C ATOM 2537 CG ASP B 57 19.212 -3.616 10.718 1.00 2.15 C ATOM 2538 OD1 ASP B 57 19.310 -4.617 9.973 1.00 2.77 O ATOM 2539 OD2 ASP B 57 20.062 -2.719 10.891 1.00 3.37 O ATOM 0 H ASP B 57 17.413 -5.024 9.662 1.00 0.90 H new ATOM 0 HA ASP B 57 15.793 -3.295 11.053 1.00 1.00 H new ATOM 0 HB2 ASP B 57 17.955 -2.659 12.169 1.00 1.32 H new ATOM 0 HB3 ASP B 57 17.716 -4.390 12.046 1.00 1.32 H new ATOM 2544 N GLU B 58 17.415 -1.655 8.708 1.00 0.99 N ATOM 2545 CA GLU B 58 17.358 -0.333 8.076 1.00 1.01 C ATOM 2546 C GLU B 58 15.895 0.036 7.821 1.00 0.83 C ATOM 2547 O GLU B 58 15.451 1.153 8.109 1.00 0.86 O ATOM 2548 CB GLU B 58 18.238 -0.188 6.811 1.00 1.19 C ATOM 2549 CG GLU B 58 17.704 -0.776 5.486 1.00 2.25 C ATOM 2550 CD GLU B 58 18.152 0.010 4.253 1.00 2.03 C ATOM 2551 OE1 GLU B 58 19.370 0.249 4.132 1.00 2.24 O ATOM 2552 OE2 GLU B 58 17.250 0.379 3.462 1.00 2.58 O ATOM 0 H GLU B 58 17.954 -2.360 8.205 1.00 0.99 H new ATOM 0 HA GLU B 58 17.797 0.381 8.773 1.00 1.01 H new ATOM 0 HB2 GLU B 58 18.425 0.874 6.654 1.00 1.19 H new ATOM 0 HB3 GLU B 58 19.201 -0.654 7.019 1.00 1.19 H new ATOM 0 HG2 GLU B 58 18.041 -1.808 5.393 1.00 2.25 H new ATOM 0 HG3 GLU B 58 16.615 -0.798 5.519 1.00 2.25 H new ATOM 2559 N LYS B 59 15.132 -0.931 7.302 1.00 0.79 N ATOM 2560 CA LYS B 59 13.742 -0.714 6.992 1.00 0.78 C ATOM 2561 C LYS B 59 12.994 -0.599 8.311 1.00 0.66 C ATOM 2562 O LYS B 59 12.286 0.378 8.478 1.00 0.70 O ATOM 2563 CB LYS B 59 13.158 -1.779 6.054 1.00 0.94 C ATOM 2564 CG LYS B 59 13.902 -1.995 4.723 1.00 1.09 C ATOM 2565 CD LYS B 59 13.534 -1.031 3.576 1.00 1.76 C ATOM 2566 CE LYS B 59 13.885 0.444 3.838 1.00 2.77 C ATOM 2567 NZ LYS B 59 13.903 1.254 2.601 1.00 4.08 N ATOM 0 H LYS B 59 15.469 -1.871 7.092 1.00 0.79 H new ATOM 0 HA LYS B 59 13.631 0.210 6.425 1.00 0.78 H new ATOM 0 HB2 LYS B 59 13.130 -2.728 6.589 1.00 0.94 H new ATOM 0 HB3 LYS B 59 12.126 -1.509 5.830 1.00 0.94 H new ATOM 0 HG2 LYS B 59 14.972 -1.912 4.911 1.00 1.09 H new ATOM 0 HG3 LYS B 59 13.715 -3.015 4.387 1.00 1.09 H new ATOM 0 HD2 LYS B 59 14.044 -1.356 2.669 1.00 1.76 H new ATOM 0 HD3 LYS B 59 12.464 -1.107 3.385 1.00 1.76 H new ATOM 0 HE2 LYS B 59 13.161 0.867 4.534 1.00 2.77 H new ATOM 0 HE3 LYS B 59 14.861 0.501 4.319 1.00 2.77 H new ATOM 0 HZ1 LYS B 59 14.243 2.213 2.819 1.00 4.08 H new ATOM 0 HZ2 LYS B 59 14.537 0.811 1.905 1.00 4.08 H new ATOM 0 HZ3 LYS B 59 12.942 1.308 2.208 1.00 4.08 H new ATOM 2581 N MET B 60 13.184 -1.521 9.264 1.00 0.65 N ATOM 2582 CA MET B 60 12.571 -1.443 10.593 1.00 0.73 C ATOM 2583 C MET B 60 12.580 0.002 11.108 1.00 0.71 C ATOM 2584 O MET B 60 11.529 0.565 11.417 1.00 0.73 O ATOM 2585 CB MET B 60 13.318 -2.364 11.569 1.00 0.96 C ATOM 2586 CG MET B 60 12.641 -2.477 12.938 1.00 1.11 C ATOM 2587 SD MET B 60 11.225 -3.598 13.011 1.00 2.54 S ATOM 2588 CE MET B 60 10.651 -3.195 14.677 1.00 2.37 C ATOM 0 H MET B 60 13.770 -2.345 9.132 1.00 0.65 H new ATOM 0 HA MET B 60 11.534 -1.772 10.520 1.00 0.73 H new ATOM 0 HB2 MET B 60 13.399 -3.358 11.129 1.00 0.96 H new ATOM 0 HB3 MET B 60 14.333 -1.991 11.704 1.00 0.96 H new ATOM 0 HG2 MET B 60 13.383 -2.807 13.665 1.00 1.11 H new ATOM 0 HG3 MET B 60 12.313 -1.484 13.246 1.00 1.11 H new ATOM 0 HE1 MET B 60 9.814 -3.842 14.940 1.00 2.37 H new ATOM 0 HE2 MET B 60 11.463 -3.345 15.388 1.00 2.37 H new ATOM 0 HE3 MET B 60 10.329 -2.154 14.709 1.00 2.37 H new ATOM 2598 N LYS B 61 13.767 0.610 11.161 1.00 0.77 N ATOM 2599 CA LYS B 61 13.917 1.989 11.597 1.00 0.90 C ATOM 2600 C LYS B 61 13.140 2.945 10.682 1.00 0.85 C ATOM 2601 O LYS B 61 12.355 3.755 11.171 1.00 0.92 O ATOM 2602 CB LYS B 61 15.410 2.329 11.681 1.00 1.10 C ATOM 2603 CG LYS B 61 15.650 3.714 12.300 1.00 2.35 C ATOM 2604 CD LYS B 61 17.147 4.048 12.393 1.00 2.82 C ATOM 2605 CE LYS B 61 17.941 3.143 13.351 1.00 2.81 C ATOM 2606 NZ LYS B 61 17.508 3.278 14.759 1.00 3.32 N ATOM 0 H LYS B 61 14.644 0.158 10.903 1.00 0.77 H new ATOM 0 HA LYS B 61 13.487 2.112 12.591 1.00 0.90 H new ATOM 0 HB2 LYS B 61 15.921 1.572 12.276 1.00 1.10 H new ATOM 0 HB3 LYS B 61 15.846 2.298 10.682 1.00 1.10 H new ATOM 0 HG2 LYS B 61 15.145 4.472 11.701 1.00 2.35 H new ATOM 0 HG3 LYS B 61 15.208 3.748 13.296 1.00 2.35 H new ATOM 0 HD2 LYS B 61 17.585 3.976 11.398 1.00 2.82 H new ATOM 0 HD3 LYS B 61 17.257 5.083 12.716 1.00 2.82 H new ATOM 0 HE2 LYS B 61 17.829 2.105 13.039 1.00 2.81 H new ATOM 0 HE3 LYS B 61 19.001 3.385 13.277 1.00 2.81 H new ATOM 0 HZ1 LYS B 61 17.978 2.553 15.338 1.00 3.32 H new ATOM 0 HZ2 LYS B 61 17.764 4.222 15.112 1.00 3.32 H new ATOM 0 HZ3 LYS B 61 16.477 3.154 14.819 1.00 3.32 H new ATOM 2620 N SER B 62 13.359 2.866 9.365 1.00 0.82 N ATOM 2621 CA SER B 62 12.696 3.739 8.396 1.00 0.89 C ATOM 2622 C SER B 62 11.164 3.637 8.443 1.00 0.86 C ATOM 2623 O SER B 62 10.468 4.581 8.081 1.00 1.06 O ATOM 2624 CB SER B 62 13.170 3.402 6.980 1.00 0.93 C ATOM 2625 OG SER B 62 14.580 3.465 6.876 1.00 1.68 O ATOM 0 H SER B 62 14.001 2.195 8.943 1.00 0.82 H new ATOM 0 HA SER B 62 12.967 4.760 8.664 1.00 0.89 H new ATOM 0 HB2 SER B 62 12.828 2.403 6.709 1.00 0.93 H new ATOM 0 HB3 SER B 62 12.720 4.096 6.270 1.00 0.93 H new ATOM 0 HG SER B 62 14.970 2.630 7.209 1.00 1.68 H new ATOM 2631 N LEU B 63 10.646 2.465 8.804 1.00 0.71 N ATOM 2632 CA LEU B 63 9.236 2.129 8.847 1.00 0.69 C ATOM 2633 C LEU B 63 8.620 2.644 10.144 1.00 0.74 C ATOM 2634 O LEU B 63 7.632 3.374 10.123 1.00 0.80 O ATOM 2635 CB LEU B 63 9.088 0.604 8.739 1.00 0.67 C ATOM 2636 CG LEU B 63 9.551 0.037 7.385 1.00 0.85 C ATOM 2637 CD1 LEU B 63 9.724 -1.473 7.487 1.00 1.03 C ATOM 2638 CD2 LEU B 63 8.507 0.303 6.319 1.00 1.25 C ATOM 0 H LEU B 63 11.238 1.685 9.089 1.00 0.71 H new ATOM 0 HA LEU B 63 8.712 2.599 8.015 1.00 0.69 H new ATOM 0 HB2 LEU B 63 9.663 0.134 9.537 1.00 0.67 H new ATOM 0 HB3 LEU B 63 8.044 0.336 8.898 1.00 0.67 H new ATOM 0 HG LEU B 63 10.493 0.518 7.123 1.00 0.85 H new ATOM 0 HD11 LEU B 63 10.052 -1.867 6.525 1.00 1.03 H new ATOM 0 HD12 LEU B 63 10.471 -1.703 8.247 1.00 1.03 H new ATOM 0 HD13 LEU B 63 8.774 -1.930 7.762 1.00 1.03 H new ATOM 0 HD21 LEU B 63 8.848 -0.103 5.367 1.00 1.25 H new ATOM 0 HD22 LEU B 63 7.568 -0.174 6.602 1.00 1.25 H new ATOM 0 HD23 LEU B 63 8.353 1.378 6.221 1.00 1.25 H new ATOM 2650 N ASP B 64 9.200 2.245 11.279 1.00 0.76 N ATOM 2651 CA ASP B 64 8.632 2.465 12.602 1.00 0.94 C ATOM 2652 C ASP B 64 8.606 3.923 13.062 1.00 1.08 C ATOM 2653 O ASP B 64 8.058 4.165 14.122 1.00 1.27 O ATOM 2654 CB ASP B 64 9.175 1.506 13.676 1.00 1.02 C ATOM 2655 CG ASP B 64 8.096 1.278 14.729 1.00 1.38 C ATOM 2656 OD1 ASP B 64 7.044 0.710 14.380 1.00 1.44 O ATOM 2657 OD2 ASP B 64 8.136 1.794 15.866 1.00 2.23 O ATOM 0 H ASP B 64 10.093 1.752 11.299 1.00 0.76 H new ATOM 0 HA ASP B 64 7.581 2.206 12.471 1.00 0.94 H new ATOM 0 HB2 ASP B 64 9.465 0.558 13.223 1.00 1.02 H new ATOM 0 HB3 ASP B 64 10.069 1.925 14.138 1.00 1.02 H new ATOM 2662 N VAL B 65 9.271 4.868 12.382 1.00 1.09 N ATOM 2663 CA VAL B 65 10.137 5.954 12.874 1.00 1.21 C ATOM 2664 C VAL B 65 9.854 6.609 14.243 1.00 1.39 C ATOM 2665 O VAL B 65 10.793 7.132 14.840 1.00 1.52 O ATOM 2666 CB VAL B 65 10.149 7.086 11.823 1.00 1.40 C ATOM 2667 CG1 VAL B 65 10.584 6.601 10.438 1.00 1.55 C ATOM 2668 CG2 VAL B 65 8.779 7.768 11.679 1.00 1.71 C ATOM 0 H VAL B 65 9.210 4.895 11.364 1.00 1.09 H new ATOM 0 HA VAL B 65 11.082 5.434 13.032 1.00 1.21 H new ATOM 0 HB VAL B 65 10.877 7.804 12.200 1.00 1.40 H new ATOM 0 HG11 VAL B 65 10.574 7.438 9.740 1.00 1.55 H new ATOM 0 HG12 VAL B 65 11.592 6.189 10.497 1.00 1.55 H new ATOM 0 HG13 VAL B 65 9.897 5.830 10.090 1.00 1.55 H new ATOM 0 HG21 VAL B 65 8.842 8.556 10.928 1.00 1.71 H new ATOM 0 HG22 VAL B 65 8.037 7.032 11.371 1.00 1.71 H new ATOM 0 HG23 VAL B 65 8.486 8.201 12.635 1.00 1.71 H new ATOM 2678 N ASN B 66 8.632 6.578 14.784 1.00 1.50 N ATOM 2679 CA ASN B 66 8.444 6.738 16.232 1.00 1.61 C ATOM 2680 C ASN B 66 9.351 5.765 16.995 1.00 1.52 C ATOM 2681 O ASN B 66 9.861 6.107 18.058 1.00 1.81 O ATOM 2682 CB ASN B 66 6.976 6.561 16.661 1.00 1.75 C ATOM 2683 CG ASN B 66 6.302 5.357 16.013 1.00 1.82 C ATOM 2684 OD1 ASN B 66 6.474 4.205 16.416 1.00 1.63 O ATOM 2685 ND2 ASN B 66 5.560 5.611 14.942 1.00 2.98 N ATOM 0 H ASN B 66 7.771 6.446 14.253 1.00 1.50 H new ATOM 0 HA ASN B 66 8.723 7.762 16.482 1.00 1.61 H new ATOM 0 HB2 ASN B 66 6.931 6.455 17.745 1.00 1.75 H new ATOM 0 HB3 ASN B 66 6.418 7.462 16.406 1.00 1.75 H new ATOM 0 HD21 ASN B 66 5.118 4.845 14.434 1.00 2.98 H new ATOM 0 HD22 ASN B 66 5.432 6.573 14.627 1.00 2.98 H new ATOM 2692 N GLN B 67 9.573 4.573 16.436 1.00 1.26 N ATOM 2693 CA GLN B 67 10.495 3.572 16.946 1.00 1.31 C ATOM 2694 C GLN B 67 9.993 3.071 18.300 1.00 1.29 C ATOM 2695 O GLN B 67 10.754 2.953 19.259 1.00 1.37 O ATOM 2696 CB GLN B 67 11.934 4.116 16.942 1.00 1.78 C ATOM 2697 CG GLN B 67 12.972 2.985 16.926 1.00 2.23 C ATOM 2698 CD GLN B 67 14.395 3.534 16.901 1.00 2.15 C ATOM 2699 OE1 GLN B 67 15.153 3.307 15.955 1.00 2.38 O ATOM 2700 NE2 GLN B 67 14.779 4.264 17.943 1.00 2.93 N ATOM 0 H GLN B 67 9.095 4.274 15.586 1.00 1.26 H new ATOM 0 HA GLN B 67 10.529 2.698 16.295 1.00 1.31 H new ATOM 0 HB2 GLN B 67 12.079 4.754 16.070 1.00 1.78 H new ATOM 0 HB3 GLN B 67 12.089 4.739 17.823 1.00 1.78 H new ATOM 0 HG2 GLN B 67 12.839 2.355 17.806 1.00 2.23 H new ATOM 0 HG3 GLN B 67 12.809 2.352 16.053 1.00 2.23 H new ATOM 0 HE21 GLN B 67 14.131 4.436 18.712 1.00 2.93 H new ATOM 0 HE22 GLN B 67 15.722 4.652 17.974 1.00 2.93 H new ATOM 2709 N ASP B 68 8.697 2.748 18.342 1.00 1.47 N ATOM 2710 CA ASP B 68 8.089 2.023 19.450 1.00 1.52 C ATOM 2711 C ASP B 68 8.460 0.534 19.332 1.00 1.44 C ATOM 2712 O ASP B 68 8.620 -0.133 20.350 1.00 1.93 O ATOM 2713 CB ASP B 68 6.572 2.310 19.560 1.00 1.58 C ATOM 2714 CG ASP B 68 5.770 1.862 18.355 1.00 1.40 C ATOM 2715 OD1 ASP B 68 6.182 0.899 17.695 1.00 1.32 O ATOM 2716 OD2 ASP B 68 4.864 2.547 17.839 1.00 1.72 O ATOM 0 H ASP B 68 8.039 2.986 17.600 1.00 1.47 H new ATOM 0 HA ASP B 68 8.488 2.376 20.401 1.00 1.52 H new ATOM 0 HB2 ASP B 68 6.182 1.813 20.448 1.00 1.58 H new ATOM 0 HB3 ASP B 68 6.425 3.380 19.704 1.00 1.58 H new ATOM 2721 N SER B 69 8.680 0.044 18.100 1.00 1.44 N ATOM 2722 CA SER B 69 9.064 -1.321 17.720 1.00 1.33 C ATOM 2723 C SER B 69 7.873 -2.202 17.315 1.00 1.23 C ATOM 2724 O SER B 69 8.083 -3.325 16.857 1.00 1.40 O ATOM 2725 CB SER B 69 9.927 -2.039 18.770 1.00 1.42 C ATOM 2726 OG SER B 69 10.933 -1.186 19.280 1.00 2.36 O ATOM 0 H SER B 69 8.585 0.643 17.280 1.00 1.44 H new ATOM 0 HA SER B 69 9.684 -1.176 16.835 1.00 1.33 H new ATOM 0 HB2 SER B 69 9.295 -2.388 19.587 1.00 1.42 H new ATOM 0 HB3 SER B 69 10.387 -2.921 18.324 1.00 1.42 H new ATOM 0 HG SER B 69 11.465 -1.669 19.947 1.00 2.36 H new ATOM 2732 N GLU B 70 6.643 -1.706 17.461 1.00 1.15 N ATOM 2733 CA GLU B 70 5.429 -2.318 16.949 1.00 1.13 C ATOM 2734 C GLU B 70 5.044 -1.560 15.686 1.00 1.09 C ATOM 2735 O GLU B 70 4.767 -0.359 15.749 1.00 1.12 O ATOM 2736 CB GLU B 70 4.275 -2.209 17.953 1.00 1.25 C ATOM 2737 CG GLU B 70 4.297 -3.285 19.046 1.00 1.45 C ATOM 2738 CD GLU B 70 2.885 -3.520 19.572 1.00 2.12 C ATOM 2739 OE1 GLU B 70 2.207 -2.511 19.858 1.00 2.77 O ATOM 2740 OE2 GLU B 70 2.475 -4.703 19.593 1.00 2.74 O ATOM 0 H GLU B 70 6.465 -0.834 17.959 1.00 1.15 H new ATOM 0 HA GLU B 70 5.610 -3.376 16.759 1.00 1.13 H new ATOM 0 HB2 GLU B 70 4.308 -1.226 18.424 1.00 1.25 H new ATOM 0 HB3 GLU B 70 3.330 -2.273 17.413 1.00 1.25 H new ATOM 0 HG2 GLU B 70 4.705 -4.213 18.646 1.00 1.45 H new ATOM 0 HG3 GLU B 70 4.951 -2.975 19.861 1.00 1.45 H new ATOM 2747 N LEU B 71 5.001 -2.258 14.555 1.00 1.12 N ATOM 2748 CA LEU B 71 4.626 -1.681 13.279 1.00 1.11 C ATOM 2749 C LEU B 71 3.098 -1.721 13.181 1.00 1.19 C ATOM 2750 O LEU B 71 2.505 -2.800 13.104 1.00 1.27 O ATOM 2751 CB LEU B 71 5.267 -2.463 12.127 1.00 1.12 C ATOM 2752 CG LEU B 71 6.786 -2.344 11.937 1.00 1.04 C ATOM 2753 CD1 LEU B 71 7.179 -1.036 11.240 1.00 0.98 C ATOM 2754 CD2 LEU B 71 7.609 -2.536 13.211 1.00 1.08 C ATOM 0 H LEU B 71 5.229 -3.251 14.504 1.00 1.12 H new ATOM 0 HA LEU B 71 4.979 -0.652 13.208 1.00 1.11 H new ATOM 0 HB2 LEU B 71 5.029 -3.518 12.265 1.00 1.12 H new ATOM 0 HB3 LEU B 71 4.788 -2.147 11.200 1.00 1.12 H new ATOM 0 HG LEU B 71 7.037 -3.183 11.288 1.00 1.04 H new ATOM 0 HD11 LEU B 71 8.262 -0.995 11.127 1.00 0.98 H new ATOM 0 HD12 LEU B 71 6.710 -0.992 10.257 1.00 0.98 H new ATOM 0 HD13 LEU B 71 6.845 -0.189 11.840 1.00 0.98 H new ATOM 0 HD21 LEU B 71 8.669 -2.434 12.978 1.00 1.08 H new ATOM 0 HD22 LEU B 71 7.325 -1.782 13.945 1.00 1.08 H new ATOM 0 HD23 LEU B 71 7.421 -3.529 13.619 1.00 1.08 H new ATOM 2766 N LYS B 72 2.478 -0.541 13.202 1.00 1.25 N ATOM 2767 CA LYS B 72 1.039 -0.307 13.184 1.00 1.44 C ATOM 2768 C LYS B 72 0.500 -0.344 11.745 1.00 1.32 C ATOM 2769 O LYS B 72 1.284 -0.319 10.792 1.00 1.13 O ATOM 2770 CB LYS B 72 0.872 1.094 13.799 1.00 1.74 C ATOM 2771 CG LYS B 72 -0.533 1.565 14.172 1.00 1.89 C ATOM 2772 CD LYS B 72 -1.228 0.648 15.200 1.00 2.47 C ATOM 2773 CE LYS B 72 -0.355 0.153 16.376 1.00 2.45 C ATOM 2774 NZ LYS B 72 0.286 1.237 17.153 1.00 2.95 N ATOM 0 H LYS B 72 3.005 0.332 13.234 1.00 1.25 H new ATOM 0 HA LYS B 72 0.485 -1.068 13.734 1.00 1.44 H new ATOM 0 HB2 LYS B 72 1.485 1.136 14.699 1.00 1.74 H new ATOM 0 HB3 LYS B 72 1.288 1.816 13.096 1.00 1.74 H new ATOM 0 HG2 LYS B 72 -0.475 2.575 14.577 1.00 1.89 H new ATOM 0 HG3 LYS B 72 -1.143 1.617 13.270 1.00 1.89 H new ATOM 0 HD2 LYS B 72 -2.085 1.182 15.611 1.00 2.47 H new ATOM 0 HD3 LYS B 72 -1.618 -0.223 14.673 1.00 2.47 H new ATOM 0 HE2 LYS B 72 -0.973 -0.443 17.047 1.00 2.45 H new ATOM 0 HE3 LYS B 72 0.420 -0.507 15.986 1.00 2.45 H new ATOM 0 HZ1 LYS B 72 1.319 1.118 17.128 1.00 2.95 H new ATOM 0 HZ2 LYS B 72 0.034 2.157 16.739 1.00 2.95 H new ATOM 0 HZ3 LYS B 72 -0.043 1.199 18.139 1.00 2.95 H new ATOM 2788 N PHE B 73 -0.830 -0.282 11.552 1.00 1.53 N ATOM 2789 CA PHE B 73 -1.409 -0.240 10.206 1.00 1.53 C ATOM 2790 C PHE B 73 -1.396 1.186 9.647 1.00 1.60 C ATOM 2791 O PHE B 73 -2.392 1.642 9.090 1.00 1.87 O ATOM 2792 CB PHE B 73 -2.879 -0.697 10.209 1.00 1.97 C ATOM 2793 CG PHE B 73 -3.167 -2.062 10.778 1.00 1.42 C ATOM 2794 CD1 PHE B 73 -3.371 -2.198 12.159 1.00 2.55 C ATOM 2795 CD2 PHE B 73 -3.376 -3.162 9.925 1.00 2.33 C ATOM 2796 CE1 PHE B 73 -3.640 -3.459 12.699 1.00 3.59 C ATOM 2797 CE2 PHE B 73 -3.755 -4.403 10.462 1.00 3.42 C ATOM 2798 CZ PHE B 73 -3.816 -4.568 11.856 1.00 3.85 C ATOM 0 H PHE B 73 -1.515 -0.260 12.307 1.00 1.53 H new ATOM 0 HA PHE B 73 -0.802 -0.907 9.594 1.00 1.53 H new ATOM 0 HB2 PHE B 73 -3.460 0.034 10.770 1.00 1.97 H new ATOM 0 HB3 PHE B 73 -3.244 -0.674 9.182 1.00 1.97 H new ATOM 0 HD1 PHE B 73 -3.320 -1.332 12.802 1.00 2.55 H new ATOM 0 HD2 PHE B 73 -3.245 -3.052 8.859 1.00 2.33 H new ATOM 0 HE1 PHE B 73 -3.713 -3.581 13.770 1.00 3.59 H new ATOM 0 HE2 PHE B 73 -3.998 -5.226 9.807 1.00 3.42 H new ATOM 0 HZ PHE B 73 -3.998 -5.545 12.278 1.00 3.85 H new ATOM 2808 N ASN B 74 -0.219 1.807 9.672 1.00 1.50 N ATOM 2809 CA ASN B 74 0.441 2.414 8.529 1.00 1.35 C ATOM 2810 C ASN B 74 1.872 2.765 8.985 1.00 1.23 C ATOM 2811 O ASN B 74 2.349 3.875 8.770 1.00 1.53 O ATOM 2812 CB ASN B 74 -0.366 3.680 8.165 1.00 1.60 C ATOM 2813 CG ASN B 74 -0.022 4.340 6.842 1.00 2.03 C ATOM 2814 OD1 ASN B 74 -0.792 4.270 5.885 1.00 2.54 O ATOM 2815 ND2 ASN B 74 1.094 5.040 6.798 1.00 2.35 N ATOM 0 H ASN B 74 0.322 1.903 10.532 1.00 1.50 H new ATOM 0 HA ASN B 74 0.491 1.765 7.655 1.00 1.35 H new ATOM 0 HB2 ASN B 74 -1.424 3.419 8.152 1.00 1.60 H new ATOM 0 HB3 ASN B 74 -0.228 4.414 8.959 1.00 1.60 H new ATOM 0 HD21 ASN B 74 1.344 5.548 5.950 1.00 2.35 H new ATOM 0 HD22 ASN B 74 1.707 5.074 7.612 1.00 2.35 H new ATOM 2822 N GLU B 75 2.595 1.844 9.628 1.00 1.00 N ATOM 2823 CA GLU B 75 4.044 1.788 9.623 1.00 0.86 C ATOM 2824 C GLU B 75 4.505 0.783 8.573 1.00 0.88 C ATOM 2825 O GLU B 75 5.083 1.135 7.550 1.00 0.92 O ATOM 2826 CB GLU B 75 4.542 1.536 11.047 1.00 0.82 C ATOM 2827 CG GLU B 75 4.039 2.674 11.950 1.00 0.99 C ATOM 2828 CD GLU B 75 4.449 2.483 13.389 1.00 1.01 C ATOM 2829 OE1 GLU B 75 3.934 1.594 14.088 1.00 1.44 O ATOM 2830 OE2 GLU B 75 5.326 3.202 13.894 1.00 1.98 O ATOM 0 H GLU B 75 2.168 1.100 10.179 1.00 1.00 H new ATOM 0 HA GLU B 75 4.492 2.736 9.326 1.00 0.86 H new ATOM 0 HB2 GLU B 75 4.178 0.575 11.411 1.00 0.82 H new ATOM 0 HB3 GLU B 75 5.631 1.492 11.065 1.00 0.82 H new ATOM 0 HG2 GLU B 75 4.430 3.624 11.586 1.00 0.99 H new ATOM 0 HG3 GLU B 75 2.952 2.731 11.888 1.00 0.99 H new ATOM 2837 N TYR B 76 4.135 -0.482 8.823 1.00 0.86 N ATOM 2838 CA TYR B 76 4.496 -1.643 8.014 1.00 0.85 C ATOM 2839 C TYR B 76 4.220 -1.365 6.550 1.00 0.87 C ATOM 2840 O TYR B 76 5.055 -1.625 5.684 1.00 0.91 O ATOM 2841 CB TYR B 76 3.666 -2.861 8.456 1.00 0.88 C ATOM 2842 CG TYR B 76 3.781 -4.094 7.568 1.00 1.15 C ATOM 2843 CD1 TYR B 76 3.005 -4.207 6.397 1.00 2.15 C ATOM 2844 CD2 TYR B 76 4.589 -5.175 7.960 1.00 2.17 C ATOM 2845 CE1 TYR B 76 3.097 -5.356 5.593 1.00 2.71 C ATOM 2846 CE2 TYR B 76 4.611 -6.360 7.204 1.00 2.76 C ATOM 2847 CZ TYR B 76 3.872 -6.446 6.014 1.00 2.63 C ATOM 2848 OH TYR B 76 3.817 -7.616 5.319 1.00 3.45 O ATOM 0 H TYR B 76 3.555 -0.727 9.625 1.00 0.86 H new ATOM 0 HA TYR B 76 5.558 -1.848 8.151 1.00 0.85 H new ATOM 0 HB2 TYR B 76 3.966 -3.135 9.468 1.00 0.88 H new ATOM 0 HB3 TYR B 76 2.618 -2.566 8.503 1.00 0.88 H new ATOM 0 HD1 TYR B 76 2.336 -3.407 6.116 1.00 2.15 H new ATOM 0 HD2 TYR B 76 5.198 -5.095 8.849 1.00 2.17 H new ATOM 0 HE1 TYR B 76 2.571 -5.399 4.651 1.00 2.71 H new ATOM 0 HE2 TYR B 76 5.196 -7.204 7.539 1.00 2.76 H new ATOM 0 HH TYR B 76 4.412 -8.273 5.737 1.00 3.45 H new ATOM 2858 N TRP B 77 3.009 -0.861 6.301 1.00 0.85 N ATOM 2859 CA TRP B 77 2.462 -0.727 4.969 1.00 0.80 C ATOM 2860 C TRP B 77 3.426 0.040 4.057 1.00 0.71 C ATOM 2861 O TRP B 77 3.501 -0.280 2.877 1.00 0.71 O ATOM 2862 CB TRP B 77 1.035 -0.162 5.070 1.00 0.87 C ATOM 2863 CG TRP B 77 0.623 0.775 3.989 1.00 0.75 C ATOM 2864 CD1 TRP B 77 0.702 2.119 4.083 1.00 1.93 C ATOM 2865 CD2 TRP B 77 0.181 0.491 2.627 1.00 1.84 C ATOM 2866 NE1 TRP B 77 0.355 2.688 2.885 1.00 1.88 N ATOM 2867 CE2 TRP B 77 0.068 1.732 1.940 1.00 1.37 C ATOM 2868 CE3 TRP B 77 -0.112 -0.675 1.885 1.00 3.83 C ATOM 2869 CZ2 TRP B 77 -0.268 1.818 0.586 1.00 2.31 C ATOM 2870 CZ3 TRP B 77 -0.456 -0.594 0.521 1.00 4.76 C ATOM 2871 CH2 TRP B 77 -0.503 0.641 -0.131 1.00 3.99 C ATOM 0 H TRP B 77 2.381 -0.533 7.035 1.00 0.85 H new ATOM 0 HA TRP B 77 2.363 -1.696 4.479 1.00 0.80 H new ATOM 0 HB2 TRP B 77 0.335 -0.998 5.084 1.00 0.87 H new ATOM 0 HB3 TRP B 77 0.937 0.353 6.026 1.00 0.87 H new ATOM 0 HD1 TRP B 77 0.994 2.664 4.968 1.00 1.93 H new ATOM 0 HE1 TRP B 77 0.315 3.693 2.716 1.00 1.88 H new ATOM 0 HE3 TRP B 77 -0.072 -1.640 2.369 1.00 3.83 H new ATOM 0 HZ2 TRP B 77 -0.345 2.780 0.101 1.00 2.31 H new ATOM 0 HZ3 TRP B 77 -0.686 -1.496 -0.026 1.00 4.76 H new ATOM 0 HH2 TRP B 77 -0.721 0.686 -1.188 1.00 3.99 H new ATOM 2882 N ARG B 78 4.213 0.988 4.590 1.00 0.70 N ATOM 2883 CA ARG B 78 5.304 1.651 3.865 1.00 0.68 C ATOM 2884 C ARG B 78 6.095 0.675 2.985 1.00 0.64 C ATOM 2885 O ARG B 78 6.354 0.978 1.820 1.00 0.70 O ATOM 2886 CB ARG B 78 6.264 2.288 4.861 1.00 0.68 C ATOM 2887 CG ARG B 78 5.698 3.479 5.647 1.00 0.86 C ATOM 2888 CD ARG B 78 5.820 4.779 4.848 1.00 1.95 C ATOM 2889 NE ARG B 78 5.478 5.937 5.688 1.00 2.55 N ATOM 2890 CZ ARG B 78 5.741 7.216 5.375 1.00 3.47 C ATOM 2891 NH1 ARG B 78 6.290 7.514 4.192 1.00 4.07 N ATOM 2892 NH2 ARG B 78 5.452 8.190 6.246 1.00 4.49 N ATOM 0 H ARG B 78 4.107 1.318 5.549 1.00 0.70 H new ATOM 0 HA ARG B 78 4.851 2.404 3.220 1.00 0.68 H new ATOM 0 HB2 ARG B 78 6.585 1.525 5.570 1.00 0.68 H new ATOM 0 HB3 ARG B 78 7.153 2.618 4.324 1.00 0.68 H new ATOM 0 HG2 ARG B 78 4.651 3.294 5.888 1.00 0.86 H new ATOM 0 HG3 ARG B 78 6.230 3.579 6.593 1.00 0.86 H new ATOM 0 HD2 ARG B 78 6.836 4.885 4.469 1.00 1.95 H new ATOM 0 HD3 ARG B 78 5.159 4.743 3.982 1.00 1.95 H new ATOM 0 HE ARG B 78 5.006 5.755 6.574 1.00 2.55 H new ATOM 0 HH11 ARG B 78 6.508 6.770 3.529 1.00 4.07 H new ATOM 0 HH12 ARG B 78 6.490 8.485 3.953 1.00 4.07 H new ATOM 0 HH21 ARG B 78 5.032 7.961 7.147 1.00 4.49 H new ATOM 0 HH22 ARG B 78 5.651 9.162 6.009 1.00 4.49 H new ATOM 2906 N LEU B 79 6.472 -0.492 3.525 1.00 0.62 N ATOM 2907 CA LEU B 79 7.246 -1.476 2.786 1.00 0.63 C ATOM 2908 C LEU B 79 6.556 -1.836 1.471 1.00 0.63 C ATOM 2909 O LEU B 79 7.234 -2.018 0.464 1.00 0.67 O ATOM 2910 CB LEU B 79 7.476 -2.742 3.626 1.00 0.74 C ATOM 2911 CG LEU B 79 8.631 -3.571 3.028 1.00 0.83 C ATOM 2912 CD1 LEU B 79 9.943 -3.213 3.727 1.00 0.75 C ATOM 2913 CD2 LEU B 79 8.390 -5.078 3.132 1.00 0.98 C ATOM 0 H LEU B 79 6.247 -0.771 4.480 1.00 0.62 H new ATOM 0 HA LEU B 79 8.215 -1.031 2.560 1.00 0.63 H new ATOM 0 HB2 LEU B 79 7.709 -2.468 4.655 1.00 0.74 H new ATOM 0 HB3 LEU B 79 6.565 -3.340 3.654 1.00 0.74 H new ATOM 0 HG LEU B 79 8.687 -3.323 1.968 1.00 0.83 H new ATOM 0 HD11 LEU B 79 10.755 -3.802 3.300 1.00 0.75 H new ATOM 0 HD12 LEU B 79 10.152 -2.152 3.588 1.00 0.75 H new ATOM 0 HD13 LEU B 79 9.859 -3.429 4.792 1.00 0.75 H new ATOM 0 HD21 LEU B 79 9.234 -5.612 2.696 1.00 0.98 H new ATOM 0 HD22 LEU B 79 8.286 -5.358 4.180 1.00 0.98 H new ATOM 0 HD23 LEU B 79 7.478 -5.339 2.594 1.00 0.98 H new ATOM 2925 N ILE B 80 5.219 -1.912 1.464 1.00 0.68 N ATOM 2926 CA ILE B 80 4.472 -2.268 0.266 1.00 0.78 C ATOM 2927 C ILE B 80 4.704 -1.181 -0.786 1.00 0.98 C ATOM 2928 O ILE B 80 4.781 -1.461 -1.977 1.00 1.08 O ATOM 2929 CB ILE B 80 2.989 -2.559 0.585 1.00 0.86 C ATOM 2930 CG1 ILE B 80 2.908 -3.847 1.429 1.00 1.10 C ATOM 2931 CG2 ILE B 80 2.192 -2.740 -0.718 1.00 1.36 C ATOM 2932 CD1 ILE B 80 1.556 -4.041 2.121 1.00 1.30 C ATOM 0 H ILE B 80 4.637 -1.730 2.281 1.00 0.68 H new ATOM 0 HA ILE B 80 4.834 -3.207 -0.153 1.00 0.78 H new ATOM 0 HB ILE B 80 2.563 -1.723 1.139 1.00 0.86 H new ATOM 0 HG12 ILE B 80 3.105 -4.705 0.787 1.00 1.10 H new ATOM 0 HG13 ILE B 80 3.694 -3.827 2.184 1.00 1.10 H new ATOM 0 HG21 ILE B 80 1.148 -2.945 -0.481 1.00 1.36 H new ATOM 0 HG22 ILE B 80 2.257 -1.829 -1.314 1.00 1.36 H new ATOM 0 HG23 ILE B 80 2.606 -3.574 -1.285 1.00 1.36 H new ATOM 0 HD11 ILE B 80 1.571 -4.967 2.696 1.00 1.30 H new ATOM 0 HD12 ILE B 80 1.366 -3.201 2.789 1.00 1.30 H new ATOM 0 HD13 ILE B 80 0.767 -4.093 1.370 1.00 1.30 H new ATOM 2944 N GLY B 81 4.872 0.062 -0.337 1.00 1.14 N ATOM 2945 CA GLY B 81 5.095 1.214 -1.180 1.00 1.36 C ATOM 2946 C GLY B 81 6.467 1.183 -1.762 1.00 1.27 C ATOM 2947 O GLY B 81 6.651 1.512 -2.933 1.00 1.46 O ATOM 0 H GLY B 81 4.854 0.292 0.657 1.00 1.14 H new ATOM 0 HA2 GLY B 81 4.355 1.234 -1.980 1.00 1.36 H new ATOM 0 HA3 GLY B 81 4.961 2.127 -0.600 1.00 1.36 H new ATOM 2951 N GLU B 82 7.424 0.791 -0.931 1.00 1.06 N ATOM 2952 CA GLU B 82 8.767 0.668 -1.415 1.00 1.07 C ATOM 2953 C GLU B 82 8.741 -0.444 -2.450 1.00 1.01 C ATOM 2954 O GLU B 82 8.810 -0.148 -3.633 1.00 1.01 O ATOM 2955 CB GLU B 82 9.725 0.425 -0.257 1.00 1.00 C ATOM 2956 CG GLU B 82 9.510 1.507 0.816 1.00 0.99 C ATOM 2957 CD GLU B 82 10.693 2.461 0.826 1.00 1.32 C ATOM 2958 OE1 GLU B 82 10.591 3.438 0.044 1.00 2.01 O ATOM 2959 OE2 GLU B 82 11.679 2.168 1.541 1.00 2.25 O ATOM 0 H GLU B 82 7.289 0.561 0.054 1.00 1.06 H new ATOM 0 HA GLU B 82 9.135 1.579 -1.887 1.00 1.07 H new ATOM 0 HB2 GLU B 82 9.556 -0.564 0.169 1.00 1.00 H new ATOM 0 HB3 GLU B 82 10.755 0.448 -0.611 1.00 1.00 H new ATOM 0 HG2 GLU B 82 8.590 2.055 0.614 1.00 0.99 H new ATOM 0 HG3 GLU B 82 9.396 1.043 1.796 1.00 0.99 H new ATOM 2966 N LEU B 83 8.452 -1.681 -2.048 1.00 1.00 N ATOM 2967 CA LEU B 83 8.538 -2.811 -2.960 1.00 1.08 C ATOM 2968 C LEU B 83 7.690 -2.608 -4.221 1.00 1.03 C ATOM 2969 O LEU B 83 8.117 -3.000 -5.305 1.00 1.09 O ATOM 2970 CB LEU B 83 8.295 -4.133 -2.221 1.00 1.61 C ATOM 2971 CG LEU B 83 6.878 -4.324 -1.668 1.00 0.58 C ATOM 2972 CD1 LEU B 83 5.960 -5.047 -2.649 1.00 1.82 C ATOM 2973 CD2 LEU B 83 6.897 -5.131 -0.365 1.00 1.43 C ATOM 0 H LEU B 83 8.158 -1.921 -1.101 1.00 1.00 H new ATOM 0 HA LEU B 83 9.558 -2.874 -3.339 1.00 1.08 H new ATOM 0 HB2 LEU B 83 8.516 -4.956 -2.901 1.00 1.61 H new ATOM 0 HB3 LEU B 83 9.002 -4.204 -1.395 1.00 1.61 H new ATOM 0 HG LEU B 83 6.494 -3.319 -1.492 1.00 0.58 H new ATOM 0 HD11 LEU B 83 4.969 -5.156 -2.208 1.00 1.82 H new ATOM 0 HD12 LEU B 83 5.885 -4.470 -3.570 1.00 1.82 H new ATOM 0 HD13 LEU B 83 6.369 -6.033 -2.871 1.00 1.82 H new ATOM 0 HD21 LEU B 83 5.878 -5.251 0.004 1.00 1.43 H new ATOM 0 HD22 LEU B 83 7.333 -6.112 -0.551 1.00 1.43 H new ATOM 0 HD23 LEU B 83 7.493 -4.605 0.380 1.00 1.43 H new ATOM 2985 N ALA B 84 6.532 -1.941 -4.109 1.00 1.05 N ATOM 2986 CA ALA B 84 5.785 -1.528 -5.285 1.00 1.10 C ATOM 2987 C ALA B 84 6.609 -0.582 -6.153 1.00 1.09 C ATOM 2988 O ALA B 84 6.906 -0.909 -7.300 1.00 1.49 O ATOM 2989 CB ALA B 84 4.453 -0.876 -4.895 1.00 1.12 C ATOM 0 H ALA B 84 6.103 -1.682 -3.220 1.00 1.05 H new ATOM 0 HA ALA B 84 5.567 -2.423 -5.867 1.00 1.10 H new ATOM 0 HB1 ALA B 84 3.917 -0.577 -5.796 1.00 1.12 H new ATOM 0 HB2 ALA B 84 3.850 -1.589 -4.333 1.00 1.12 H new ATOM 0 HB3 ALA B 84 4.645 0.003 -4.279 1.00 1.12 H new ATOM 2995 N LYS B 85 6.992 0.592 -5.632 1.00 0.75 N ATOM 2996 CA LYS B 85 7.656 1.575 -6.473 1.00 0.77 C ATOM 2997 C LYS B 85 8.998 1.053 -6.990 1.00 0.70 C ATOM 2998 O LYS B 85 9.375 1.420 -8.097 1.00 0.72 O ATOM 2999 CB LYS B 85 7.651 3.007 -5.881 1.00 1.09 C ATOM 3000 CG LYS B 85 9.002 3.645 -5.504 1.00 0.93 C ATOM 3001 CD LYS B 85 9.398 3.463 -4.036 1.00 1.83 C ATOM 3002 CE LYS B 85 8.548 4.341 -3.093 1.00 1.01 C ATOM 3003 NZ LYS B 85 9.192 4.593 -1.779 1.00 1.31 N ATOM 0 H LYS B 85 6.855 0.871 -4.661 1.00 0.75 H new ATOM 0 HA LYS B 85 7.054 1.709 -7.371 1.00 0.77 H new ATOM 0 HB2 LYS B 85 7.163 3.663 -6.602 1.00 1.09 H new ATOM 0 HB3 LYS B 85 7.028 2.995 -4.987 1.00 1.09 H new ATOM 0 HG2 LYS B 85 9.781 3.216 -6.134 1.00 0.93 H new ATOM 0 HG3 LYS B 85 8.962 4.711 -5.728 1.00 0.93 H new ATOM 0 HD2 LYS B 85 9.283 2.416 -3.757 1.00 1.83 H new ATOM 0 HD3 LYS B 85 10.452 3.712 -3.911 1.00 1.83 H new ATOM 0 HE2 LYS B 85 8.348 5.295 -3.580 1.00 1.01 H new ATOM 0 HE3 LYS B 85 7.584 3.858 -2.930 1.00 1.01 H new ATOM 0 HZ1 LYS B 85 8.562 5.173 -1.189 1.00 1.31 H new ATOM 0 HZ2 LYS B 85 9.375 3.687 -1.303 1.00 1.31 H new ATOM 0 HZ3 LYS B 85 10.091 5.096 -1.924 1.00 1.31 H new ATOM 3017 N GLU B 86 9.697 0.192 -6.243 1.00 0.76 N ATOM 3018 CA GLU B 86 10.958 -0.418 -6.658 1.00 0.89 C ATOM 3019 C GLU B 86 10.834 -1.126 -8.015 1.00 0.92 C ATOM 3020 O GLU B 86 11.820 -1.209 -8.741 1.00 1.10 O ATOM 3021 CB GLU B 86 11.516 -1.355 -5.566 1.00 0.97 C ATOM 3022 CG GLU B 86 11.880 -0.625 -4.256 1.00 1.12 C ATOM 3023 CD GLU B 86 12.873 0.523 -4.418 1.00 1.69 C ATOM 3024 OE1 GLU B 86 14.088 0.250 -4.305 1.00 2.86 O ATOM 3025 OE2 GLU B 86 12.396 1.669 -4.601 1.00 2.47 O ATOM 0 H GLU B 86 9.393 -0.104 -5.315 1.00 0.76 H new ATOM 0 HA GLU B 86 11.679 0.388 -6.792 1.00 0.89 H new ATOM 0 HB2 GLU B 86 10.778 -2.127 -5.349 1.00 0.97 H new ATOM 0 HB3 GLU B 86 12.403 -1.860 -5.950 1.00 0.97 H new ATOM 0 HG2 GLU B 86 10.966 -0.236 -3.807 1.00 1.12 H new ATOM 0 HG3 GLU B 86 12.295 -1.350 -3.556 1.00 1.12 H new ATOM 3032 N ILE B 87 9.641 -1.592 -8.418 1.00 0.86 N ATOM 3033 CA ILE B 87 9.476 -2.118 -9.769 1.00 0.92 C ATOM 3034 C ILE B 87 9.814 -1.043 -10.821 1.00 1.01 C ATOM 3035 O ILE B 87 10.398 -1.332 -11.861 1.00 1.24 O ATOM 3036 CB ILE B 87 8.063 -2.726 -9.918 1.00 0.87 C ATOM 3037 CG1 ILE B 87 8.106 -3.918 -10.888 1.00 0.93 C ATOM 3038 CG2 ILE B 87 7.009 -1.708 -10.378 1.00 0.98 C ATOM 3039 CD1 ILE B 87 6.913 -4.843 -10.651 1.00 0.84 C ATOM 0 H ILE B 87 8.801 -1.613 -7.840 1.00 0.86 H new ATOM 0 HA ILE B 87 10.184 -2.927 -9.948 1.00 0.92 H new ATOM 0 HB ILE B 87 7.759 -3.060 -8.926 1.00 0.87 H new ATOM 0 HG12 ILE B 87 8.096 -3.558 -11.917 1.00 0.93 H new ATOM 0 HG13 ILE B 87 9.035 -4.471 -10.753 1.00 0.93 H new ATOM 0 HG21 ILE B 87 6.040 -2.200 -10.462 1.00 0.98 H new ATOM 0 HG22 ILE B 87 6.943 -0.899 -9.651 1.00 0.98 H new ATOM 0 HG23 ILE B 87 7.295 -1.301 -11.348 1.00 0.98 H new ATOM 0 HD11 ILE B 87 6.959 -5.681 -11.346 1.00 0.84 H new ATOM 0 HD12 ILE B 87 6.941 -5.218 -9.628 1.00 0.84 H new ATOM 0 HD13 ILE B 87 5.987 -4.290 -10.810 1.00 0.84 H new ATOM 3051 N ARG B 88 9.428 0.206 -10.538 1.00 0.92 N ATOM 3052 CA ARG B 88 9.688 1.398 -11.336 1.00 1.18 C ATOM 3053 C ARG B 88 11.099 1.949 -11.044 1.00 1.26 C ATOM 3054 O ARG B 88 11.786 2.443 -11.937 1.00 1.70 O ATOM 3055 CB ARG B 88 8.579 2.417 -10.997 1.00 1.20 C ATOM 3056 CG ARG B 88 8.255 3.472 -12.063 1.00 1.78 C ATOM 3057 CD ARG B 88 9.462 4.321 -12.465 1.00 1.89 C ATOM 3058 NE ARG B 88 9.050 5.637 -12.978 1.00 2.21 N ATOM 3059 CZ ARG B 88 9.837 6.491 -13.644 1.00 2.89 C ATOM 3060 NH1 ARG B 88 11.087 6.144 -13.973 1.00 3.78 N ATOM 3061 NH2 ARG B 88 9.355 7.694 -13.955 1.00 3.66 N ATOM 0 H ARG B 88 8.895 0.419 -9.695 1.00 0.92 H new ATOM 0 HA ARG B 88 9.668 1.175 -12.403 1.00 1.18 H new ATOM 0 HB2 ARG B 88 7.665 1.864 -10.779 1.00 1.20 H new ATOM 0 HB3 ARG B 88 8.864 2.936 -10.082 1.00 1.20 H new ATOM 0 HG2 ARG B 88 7.860 2.974 -12.948 1.00 1.78 H new ATOM 0 HG3 ARG B 88 7.468 4.127 -11.688 1.00 1.78 H new ATOM 0 HD2 ARG B 88 10.117 4.454 -11.604 1.00 1.89 H new ATOM 0 HD3 ARG B 88 10.039 3.797 -13.227 1.00 1.89 H new ATOM 0 HE ARG B 88 8.085 5.922 -12.813 1.00 2.21 H new ATOM 0 HH11 ARG B 88 11.445 5.224 -13.716 1.00 3.78 H new ATOM 0 HH12 ARG B 88 11.681 6.799 -14.480 1.00 3.78 H new ATOM 0 HH21 ARG B 88 8.404 7.948 -13.686 1.00 3.66 H new ATOM 0 HH22 ARG B 88 9.937 8.361 -14.462 1.00 3.66 H new ATOM 3075 N LYS B 89 11.483 1.959 -9.764 1.00 1.00 N ATOM 3076 CA LYS B 89 12.623 2.676 -9.208 1.00 1.15 C ATOM 3077 C LYS B 89 13.837 1.755 -9.072 1.00 1.46 C ATOM 3078 O LYS B 89 13.856 0.876 -8.220 1.00 1.75 O ATOM 3079 CB LYS B 89 12.241 3.213 -7.815 1.00 1.20 C ATOM 3080 CG LYS B 89 11.855 4.685 -7.718 1.00 1.99 C ATOM 3081 CD LYS B 89 10.652 5.048 -8.576 1.00 3.38 C ATOM 3082 CE LYS B 89 10.795 6.454 -9.184 1.00 4.81 C ATOM 3083 NZ LYS B 89 10.893 7.506 -8.152 1.00 5.05 N ATOM 0 H LYS B 89 10.974 1.436 -9.052 1.00 1.00 H new ATOM 0 HA LYS B 89 12.883 3.495 -9.879 1.00 1.15 H new ATOM 0 HB2 LYS B 89 11.407 2.620 -7.441 1.00 1.20 H new ATOM 0 HB3 LYS B 89 13.082 3.039 -7.144 1.00 1.20 H new ATOM 0 HG2 LYS B 89 11.638 4.929 -6.678 1.00 1.99 H new ATOM 0 HG3 LYS B 89 12.705 5.297 -8.018 1.00 1.99 H new ATOM 0 HD2 LYS B 89 10.539 4.315 -9.375 1.00 3.38 H new ATOM 0 HD3 LYS B 89 9.746 5.002 -7.972 1.00 3.38 H new ATOM 0 HE2 LYS B 89 11.682 6.485 -9.816 1.00 4.81 H new ATOM 0 HE3 LYS B 89 9.939 6.658 -9.827 1.00 4.81 H new ATOM 0 HZ1 LYS B 89 11.547 8.248 -8.473 1.00 5.05 H new ATOM 0 HZ2 LYS B 89 9.953 7.921 -7.989 1.00 5.05 H new ATOM 0 HZ3 LYS B 89 11.247 7.092 -7.266 1.00 5.05 H new ATOM 3097 N LYS B 90 14.906 2.026 -9.826 1.00 1.72 N ATOM 3098 CA LYS B 90 16.186 1.371 -9.578 1.00 1.99 C ATOM 3099 C LYS B 90 16.735 1.761 -8.194 1.00 1.95 C ATOM 3100 O LYS B 90 17.337 0.934 -7.516 1.00 2.15 O ATOM 3101 CB LYS B 90 17.174 1.706 -10.706 1.00 2.29 C ATOM 3102 CG LYS B 90 18.427 0.820 -10.621 1.00 2.76 C ATOM 3103 CD LYS B 90 19.341 0.957 -11.847 1.00 3.29 C ATOM 3104 CE LYS B 90 19.988 2.348 -11.940 1.00 4.23 C ATOM 3105 NZ LYS B 90 20.957 2.436 -13.055 1.00 5.25 N ATOM 0 H LYS B 90 14.908 2.687 -10.603 1.00 1.72 H new ATOM 0 HA LYS B 90 16.042 0.291 -9.572 1.00 1.99 H new ATOM 0 HB2 LYS B 90 16.690 1.566 -11.672 1.00 2.29 H new ATOM 0 HB3 LYS B 90 17.461 2.756 -10.643 1.00 2.29 H new ATOM 0 HG2 LYS B 90 18.989 1.080 -9.724 1.00 2.76 H new ATOM 0 HG3 LYS B 90 18.123 -0.221 -10.516 1.00 2.76 H new ATOM 0 HD2 LYS B 90 20.122 0.198 -11.802 1.00 3.29 H new ATOM 0 HD3 LYS B 90 18.763 0.766 -12.751 1.00 3.29 H new ATOM 0 HE2 LYS B 90 19.211 3.101 -12.075 1.00 4.23 H new ATOM 0 HE3 LYS B 90 20.494 2.576 -11.002 1.00 4.23 H new ATOM 0 HZ1 LYS B 90 21.370 3.390 -13.082 1.00 5.25 H new ATOM 0 HZ2 LYS B 90 21.713 1.736 -12.914 1.00 5.25 H new ATOM 0 HZ3 LYS B 90 20.470 2.244 -13.954 1.00 5.25 H new ATOM 3119 N LYS B 91 16.572 3.034 -7.808 1.00 1.89 N ATOM 3120 CA LYS B 91 17.019 3.568 -6.517 1.00 1.97 C ATOM 3121 C LYS B 91 16.360 4.906 -6.148 1.00 1.81 C ATOM 3122 O LYS B 91 16.616 5.417 -5.056 1.00 2.07 O ATOM 3123 CB LYS B 91 18.561 3.690 -6.499 1.00 2.64 C ATOM 3124 CG LYS B 91 19.234 2.692 -5.542 1.00 3.50 C ATOM 3125 CD LYS B 91 19.071 3.106 -4.071 1.00 3.96 C ATOM 3126 CE LYS B 91 19.540 1.974 -3.140 1.00 5.12 C ATOM 3127 NZ LYS B 91 19.284 2.265 -1.712 1.00 6.23 N ATOM 0 H LYS B 91 16.117 3.733 -8.396 1.00 1.89 H new ATOM 0 HA LYS B 91 16.700 2.857 -5.755 1.00 1.97 H new ATOM 0 HB2 LYS B 91 18.944 3.532 -7.507 1.00 2.64 H new ATOM 0 HB3 LYS B 91 18.836 4.704 -6.209 1.00 2.64 H new ATOM 0 HG2 LYS B 91 18.804 1.701 -5.690 1.00 3.50 H new ATOM 0 HG3 LYS B 91 20.295 2.618 -5.782 1.00 3.50 H new ATOM 0 HD2 LYS B 91 19.648 4.010 -3.875 1.00 3.96 H new ATOM 0 HD3 LYS B 91 18.027 3.344 -3.867 1.00 3.96 H new ATOM 0 HE2 LYS B 91 19.032 1.050 -3.415 1.00 5.12 H new ATOM 0 HE3 LYS B 91 20.607 1.807 -3.287 1.00 5.12 H new ATOM 0 HZ1 LYS B 91 19.619 1.471 -1.130 1.00 6.23 H new ATOM 0 HZ2 LYS B 91 19.789 3.132 -1.438 1.00 6.23 H new ATOM 0 HZ3 LYS B 91 18.263 2.397 -1.562 1.00 6.23 H new ATOM 3141 N ASP B 92 15.512 5.491 -7.004 1.00 1.80 N ATOM 3142 CA ASP B 92 14.903 6.790 -6.732 1.00 2.05 C ATOM 3143 C ASP B 92 13.698 6.663 -5.787 1.00 2.55 C ATOM 3144 O ASP B 92 12.581 7.064 -6.112 1.00 3.24 O ATOM 3145 CB ASP B 92 14.600 7.524 -8.046 1.00 2.35 C ATOM 3146 CG ASP B 92 13.985 8.889 -7.777 1.00 3.73 C ATOM 3147 OD1 ASP B 92 14.626 9.641 -7.008 1.00 4.59 O ATOM 3148 OD2 ASP B 92 12.876 9.123 -8.308 1.00 4.75 O ATOM 0 H ASP B 92 15.234 5.079 -7.894 1.00 1.80 H new ATOM 0 HA ASP B 92 15.616 7.414 -6.193 1.00 2.05 H new ATOM 0 HB2 ASP B 92 15.518 7.642 -8.621 1.00 2.35 H new ATOM 0 HB3 ASP B 92 13.918 6.927 -8.652 1.00 2.35 H new ATOM 3153 N LEU B 93 13.931 6.081 -4.610 1.00 2.79 N ATOM 3154 CA LEU B 93 12.988 6.078 -3.501 1.00 3.48 C ATOM 3155 C LEU B 93 13.167 7.386 -2.732 1.00 3.32 C ATOM 3156 O LEU B 93 12.615 8.407 -3.135 1.00 3.63 O ATOM 3157 CB LEU B 93 13.168 4.823 -2.626 1.00 3.91 C ATOM 3158 CG LEU B 93 14.636 4.456 -2.308 1.00 4.28 C ATOM 3159 CD1 LEU B 93 14.783 4.086 -0.825 1.00 5.28 C ATOM 3160 CD2 LEU B 93 15.030 3.227 -3.130 1.00 5.14 C ATOM 0 H LEU B 93 14.800 5.589 -4.401 1.00 2.79 H new ATOM 0 HA LEU B 93 11.961 6.027 -3.862 1.00 3.48 H new ATOM 0 HB2 LEU B 93 12.635 4.973 -1.687 1.00 3.91 H new ATOM 0 HB3 LEU B 93 12.698 3.977 -3.128 1.00 3.91 H new ATOM 0 HG LEU B 93 15.268 5.312 -2.544 1.00 4.28 H new ATOM 0 HD11 LEU B 93 15.821 3.830 -0.615 1.00 5.28 H new ATOM 0 HD12 LEU B 93 14.486 4.934 -0.207 1.00 5.28 H new ATOM 0 HD13 LEU B 93 14.146 3.231 -0.598 1.00 5.28 H new ATOM 0 HD21 LEU B 93 16.064 2.960 -2.913 1.00 5.14 H new ATOM 0 HD22 LEU B 93 14.378 2.392 -2.872 1.00 5.14 H new ATOM 0 HD23 LEU B 93 14.929 3.452 -4.192 1.00 5.14 H new ATOM 3172 N LYS B 94 13.995 7.350 -1.682 1.00 3.15 N ATOM 3173 CA LYS B 94 14.397 8.460 -0.837 1.00 3.19 C ATOM 3174 C LYS B 94 13.226 8.978 0.012 1.00 3.98 C ATOM 3175 O LYS B 94 12.059 8.743 -0.293 1.00 5.08 O ATOM 3176 CB LYS B 94 15.064 9.575 -1.655 1.00 3.49 C ATOM 3177 CG LYS B 94 16.435 9.259 -2.270 1.00 3.97 C ATOM 3178 CD LYS B 94 16.359 8.483 -3.595 1.00 5.44 C ATOM 3179 CE LYS B 94 17.260 9.098 -4.680 1.00 7.08 C ATOM 3180 NZ LYS B 94 16.598 10.228 -5.373 1.00 8.21 N ATOM 0 H LYS B 94 14.429 6.476 -1.386 1.00 3.15 H new ATOM 0 HA LYS B 94 15.148 8.089 -0.139 1.00 3.19 H new ATOM 0 HB2 LYS B 94 14.387 9.856 -2.462 1.00 3.49 H new ATOM 0 HB3 LYS B 94 15.174 10.448 -1.012 1.00 3.49 H new ATOM 0 HG2 LYS B 94 16.971 10.193 -2.438 1.00 3.97 H new ATOM 0 HG3 LYS B 94 17.019 8.680 -1.554 1.00 3.97 H new ATOM 0 HD2 LYS B 94 16.653 7.447 -3.425 1.00 5.44 H new ATOM 0 HD3 LYS B 94 15.327 8.468 -3.947 1.00 5.44 H new ATOM 0 HE2 LYS B 94 18.189 9.444 -4.227 1.00 7.08 H new ATOM 0 HE3 LYS B 94 17.526 8.332 -5.408 1.00 7.08 H new ATOM 0 HZ1 LYS B 94 17.307 10.771 -5.906 1.00 8.21 H new ATOM 0 HZ2 LYS B 94 15.879 9.860 -6.028 1.00 8.21 H new ATOM 0 HZ3 LYS B 94 16.143 10.847 -4.672 1.00 8.21 H new ATOM 3194 N ILE B 95 13.557 9.673 1.104 1.00 4.05 N ATOM 3195 CA ILE B 95 12.623 10.364 1.979 1.00 5.18 C ATOM 3196 C ILE B 95 13.331 11.622 2.480 1.00 4.66 C ATOM 3197 O ILE B 95 14.553 11.609 2.632 1.00 4.57 O ATOM 3198 CB ILE B 95 12.141 9.478 3.150 1.00 6.75 C ATOM 3199 CG1 ILE B 95 13.197 9.132 4.222 1.00 7.24 C ATOM 3200 CG2 ILE B 95 11.413 8.216 2.667 1.00 7.89 C ATOM 3201 CD1 ILE B 95 14.399 8.308 3.748 1.00 7.27 C ATOM 0 H ILE B 95 14.525 9.770 1.410 1.00 4.05 H new ATOM 0 HA ILE B 95 11.719 10.621 1.427 1.00 5.18 H new ATOM 0 HB ILE B 95 11.430 10.123 3.666 1.00 6.75 H new ATOM 0 HG12 ILE B 95 13.568 10.063 4.650 1.00 7.24 H new ATOM 0 HG13 ILE B 95 12.703 8.586 5.026 1.00 7.24 H new ATOM 0 HG21 ILE B 95 11.095 7.628 3.528 1.00 7.89 H new ATOM 0 HG22 ILE B 95 10.540 8.502 2.080 1.00 7.89 H new ATOM 0 HG23 ILE B 95 12.086 7.621 2.050 1.00 7.89 H new ATOM 0 HD11 ILE B 95 15.071 8.128 4.587 1.00 7.27 H new ATOM 0 HD12 ILE B 95 14.052 7.354 3.350 1.00 7.27 H new ATOM 0 HD13 ILE B 95 14.930 8.855 2.969 1.00 7.27 H new ATOM 3213 N ARG B 96 12.585 12.705 2.712 1.00 4.80 N ATOM 3214 CA ARG B 96 13.110 13.961 3.226 1.00 4.65 C ATOM 3215 C ARG B 96 11.917 14.814 3.652 1.00 4.95 C ATOM 3216 O ARG B 96 11.080 15.139 2.814 1.00 5.69 O ATOM 3217 CB ARG B 96 13.938 14.671 2.138 1.00 5.27 C ATOM 3218 CG ARG B 96 14.565 16.000 2.588 1.00 5.91 C ATOM 3219 CD ARG B 96 15.652 15.807 3.655 1.00 5.40 C ATOM 3220 NE ARG B 96 16.354 17.073 3.926 1.00 5.75 N ATOM 3221 CZ ARG B 96 17.415 17.207 4.738 1.00 5.64 C ATOM 3222 NH1 ARG B 96 17.895 16.142 5.389 1.00 5.54 N ATOM 3223 NH2 ARG B 96 17.992 18.405 4.896 1.00 6.31 N ATOM 0 H ARG B 96 11.579 12.728 2.543 1.00 4.80 H new ATOM 0 HA ARG B 96 13.769 13.791 4.077 1.00 4.65 H new ATOM 0 HB2 ARG B 96 14.732 14.002 1.807 1.00 5.27 H new ATOM 0 HB3 ARG B 96 13.299 14.858 1.275 1.00 5.27 H new ATOM 0 HG2 ARG B 96 14.995 16.506 1.724 1.00 5.91 H new ATOM 0 HG3 ARG B 96 13.785 16.651 2.983 1.00 5.91 H new ATOM 0 HD2 ARG B 96 15.202 15.432 4.574 1.00 5.40 H new ATOM 0 HD3 ARG B 96 16.366 15.055 3.320 1.00 5.40 H new ATOM 0 HE ARG B 96 16.008 17.912 3.461 1.00 5.75 H new ATOM 0 HH11 ARG B 96 17.455 15.230 5.268 1.00 5.54 H new ATOM 0 HH12 ARG B 96 18.701 16.242 6.006 1.00 5.54 H new ATOM 0 HH21 ARG B 96 17.626 19.217 4.399 1.00 6.31 H new ATOM 0 HH22 ARG B 96 18.798 18.506 5.513 1.00 6.31 H new ATOM 3237 N LYS B 97 11.841 15.181 4.935 1.00 4.75 N ATOM 3238 CA LYS B 97 10.758 15.962 5.520 1.00 5.18 C ATOM 3239 C LYS B 97 11.147 16.204 6.980 1.00 4.92 C ATOM 3240 O LYS B 97 11.640 15.292 7.638 1.00 5.06 O ATOM 3241 CB LYS B 97 9.400 15.218 5.416 1.00 6.19 C ATOM 3242 CG LYS B 97 8.185 16.158 5.291 1.00 7.20 C ATOM 3243 CD LYS B 97 7.692 16.700 6.642 1.00 7.81 C ATOM 3244 CE LYS B 97 6.793 17.937 6.471 1.00 8.64 C ATOM 3245 NZ LYS B 97 6.770 18.774 7.691 1.00 8.72 N ATOM 0 H LYS B 97 12.559 14.931 5.615 1.00 4.75 H new ATOM 0 HA LYS B 97 10.624 16.903 4.987 1.00 5.18 H new ATOM 0 HB2 LYS B 97 9.425 14.554 4.552 1.00 6.19 H new ATOM 0 HB3 LYS B 97 9.272 14.589 6.297 1.00 6.19 H new ATOM 0 HG2 LYS B 97 8.448 16.996 4.646 1.00 7.20 H new ATOM 0 HG3 LYS B 97 7.370 15.624 4.803 1.00 7.20 H new ATOM 0 HD2 LYS B 97 7.140 15.920 7.166 1.00 7.81 H new ATOM 0 HD3 LYS B 97 8.549 16.957 7.264 1.00 7.81 H new ATOM 0 HE2 LYS B 97 7.149 18.531 5.629 1.00 8.64 H new ATOM 0 HE3 LYS B 97 5.779 17.618 6.230 1.00 8.64 H new ATOM 0 HZ1 LYS B 97 6.019 19.488 7.608 1.00 8.72 H new ATOM 0 HZ2 LYS B 97 6.587 18.174 8.520 1.00 8.72 H new ATOM 0 HZ3 LYS B 97 7.688 19.249 7.803 1.00 8.72 H new ATOM 3259 N LYS B 98 10.961 17.433 7.459 1.00 4.97 N ATOM 3260 CA LYS B 98 10.990 17.813 8.858 1.00 5.02 C ATOM 3261 C LYS B 98 9.819 18.789 9.011 1.00 5.54 C ATOM 3262 O LYS B 98 9.340 19.267 7.957 1.00 5.94 O ATOM 3263 CB LYS B 98 12.360 18.429 9.198 1.00 4.86 C ATOM 3264 CG LYS B 98 12.395 19.232 10.507 1.00 5.35 C ATOM 3265 CD LYS B 98 12.104 18.386 11.760 1.00 5.83 C ATOM 3266 CE LYS B 98 11.467 19.252 12.857 1.00 6.01 C ATOM 3267 NZ LYS B 98 10.035 19.499 12.583 1.00 6.28 N ATOM 3268 OXT LYS B 98 9.356 19.000 10.153 1.00 6.04 O ATOM 0 H LYS B 98 10.777 18.226 6.845 1.00 4.97 H new ATOM 0 HA LYS B 98 10.877 16.979 9.551 1.00 5.02 H new ATOM 0 HB2 LYS B 98 13.098 17.629 9.258 1.00 4.86 H new ATOM 0 HB3 LYS B 98 12.663 19.081 8.379 1.00 4.86 H new ATOM 0 HG2 LYS B 98 13.376 19.696 10.612 1.00 5.35 H new ATOM 0 HG3 LYS B 98 11.665 20.040 10.447 1.00 5.35 H new ATOM 0 HD2 LYS B 98 11.436 17.564 11.504 1.00 5.83 H new ATOM 0 HD3 LYS B 98 13.029 17.942 12.129 1.00 5.83 H new ATOM 0 HE2 LYS B 98 11.575 18.757 13.822 1.00 6.01 H new ATOM 0 HE3 LYS B 98 11.996 20.203 12.925 1.00 6.01 H new ATOM 0 HZ1 LYS B 98 9.743 20.387 13.038 1.00 6.28 H new ATOM 0 HZ2 LYS B 98 9.885 19.570 11.556 1.00 6.28 H new ATOM 0 HZ3 LYS B 98 9.469 18.713 12.962 1.00 6.28 H new TER 3282 LYS B 98 HETATM 3283 CA CA A 197 -1.485 12.981 -14.640 1.00 1.35 CA HETATM 3284 CA CA A 198 2.271 16.154 -5.382 1.00 1.13 CA HETATM 3285 CA CA B 199 2.886 -9.532 15.480 1.00 0.91 CA HETATM 3286 CA CA B 200 5.658 1.875 15.722 1.00 1.10 CA