#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fsw s LYS 4 N 0.00 4.16 0.50 5.56 2.20 -1.26 -4.96 119.74 125.94 2fsw s LYS 4 Ca 0.00 2.48 -0.22 0.00 -0.36 0.00 0.00 55.97 57.87 2fsw s LYS 4 Cb 0.00 -3.71 -0.07 0.00 -1.51 0.00 0.00 37.83 32.55 2fsw s LYS 4 CO 0.00 -0.82 1.17 0.96 -0.36 0.00 0.00 175.35 176.30 2fsw s ILE 5 N 3.04 3.01 -1.31 5.43 -4.36 -1.26 -4.94 121.20 120.82 2fsw s ILE 5 Ca 0.79 0.72 -0.16 0.00 -0.26 0.00 0.00 60.65 61.74 2fsw s ILE 5 Cb -0.43 -3.34 0.10 0.00 1.25 0.00 0.00 42.46 40.04 2fsw s ILE 5 CO 0.35 -0.05 1.77 -1.20 0.24 0.00 0.00 174.94 176.05 2fsw n SER 6 N -0.80 4.82 -2.09 4.36 7.64 -1.26 -4.72 113.62 121.57 2fsw n SER 6 Ca 0.09 -2.94 0.00 0.00 1.01 0.00 0.00 58.87 57.03 2fsw n SER 6 Cb 0.49 -1.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.02 2fsw n SER 6 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2fsw n ASP 7 N 6.96 0.00 0.00 6.43 8.00 -1.26 -4.91 116.55 131.77 2fsw n ASP 7 Ca 0.46 -0.85 0.12 0.00 0.71 0.00 0.00 54.79 55.23 2fsw n ASP 7 Cb 0.43 0.00 0.62 0.00 -0.02 0.00 0.00 41.12 42.15 2fsw n ASP 7 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2fsw n GLU 8 N -0.85 0.41 -0.00 -1.24 -0.58 -1.26 -2.67 120.64 114.45 2fsw n GLU 8 Ca 0.00 0.05 0.04 0.00 -0.42 0.00 0.00 57.16 56.83 2fsw n GLU 8 Cb 0.00 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.32 2fsw n GLU 8 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2fsw n GLU 9 N -1.23 2.85 -1.61 3.49 -0.58 -1.26 -4.73 120.64 117.56 2fsw n GLU 9 Ca 0.12 -0.03 -0.63 0.00 -0.42 0.00 0.00 57.16 56.21 2fsw n GLU 9 Cb 0.17 -0.98 -0.09 0.00 -0.57 0.00 0.00 31.44 29.97 2fsw n GLU 9 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2fsw h PRO 11 N 4.11 0.16 -0.10 0.00 0.13 -1.94 0.95 132.00 135.31 2fsw h PRO 11 Ca -0.46 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 64.57 2fsw h PRO 11 Cb 1.36 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2fsw h PRO 11 CO 0.83 0.34 -0.19 0.28 -0.23 0.00 0.00 178.00 179.02 2fsw h VAL 12 N 0.15 1.39 -0.38 1.56 2.07 -1.96 -2.15 116.25 116.94 2fsw h VAL 12 Ca 0.03 -1.48 0.00 0.00 0.82 0.00 0.00 66.70 66.07 2fsw h VAL 12 Cb 0.41 2.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 2fsw h VAL 12 CO 0.03 0.42 0.25 -0.09 0.02 0.00 0.00 177.57 178.20 2fsw h ARG 13 N -0.14 0.49 -0.63 1.57 2.43 -1.78 -2.38 114.38 113.95 2fsw h ARG 13 Ca 0.00 -0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.23 2fsw h ARG 13 Cb 0.78 -0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 30.15 2fsw h ARG 13 CO 0.04 0.33 0.27 0.87 -1.51 0.00 0.00 179.97 179.97 2fsw h LYS 14 N 0.51 0.46 -1.82 0.20 1.57 -0.84 -2.79 116.57 113.85 2fsw h LYS 14 Ca 0.14 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2fsw h LYS 14 Cb -0.05 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.15 2fsw h LYS 14 CO -0.03 0.30 0.00 0.43 -0.57 0.00 0.00 179.45 179.58 2fsw n SER 15 N -4.95 0.89 0.00 0.86 7.64 -0.81 -3.83 113.62 113.42 2fsw n SER 15 Ca 0.09 -0.72 0.00 0.00 1.01 0.00 0.00 58.87 59.25 2fsw n SER 15 Cb 0.26 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2fsw n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fsw n GLN 17 N 1.15 0.00 -0.03 1.43 1.13 -1.06 -1.20 117.38 118.80 2fsw n GLN 17 Ca 0.00 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.84 2fsw n GLN 17 Cb 0.12 -0.22 -0.13 0.00 0.11 0.00 0.00 30.24 30.12 2fsw n GLN 17 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 2fsw h ILE 18 N 0.00 0.80 -0.01 5.09 2.04 -1.88 -3.42 117.51 120.13 2fsw h ILE 18 Ca 0.00 -2.30 0.00 0.00 1.00 0.00 0.00 64.86 63.56 2fsw h ILE 18 Cb 0.00 2.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 2fsw h ILE 18 CO 0.00 0.66 -0.25 0.49 0.00 0.00 0.00 178.15 179.05 2fsw n PHE 19 N -3.90 0.00 0.30 1.37 0.99 -0.34 -4.33 117.46 111.55 2fsw n PHE 19 Ca -0.31 0.00 0.16 0.00 -0.00 0.00 0.00 57.45 57.31 2fsw n PHE 19 Cb 0.89 -0.09 0.95 0.00 -1.00 0.00 0.00 39.48 40.24 2fsw n PHE 19 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2fsw h ALA 20 N 3.83 1.35 -2.63 4.37 0.00 -1.81 -3.42 119.26 120.94 2fsw h ALA 20 Ca 0.00 -0.02 -0.58 0.00 0.00 0.00 0.00 54.91 54.31 2fsw h ALA 20 Cb 0.55 -0.00 0.16 0.00 0.00 0.00 0.00 17.79 18.50 2fsw h ALA 20 CO 0.00 0.03 -0.11 0.41 0.00 0.00 0.00 179.25 179.57 2fsw n GLY 21 N -1.12 -0.86 0.28 0.00 0.00 -1.26 -4.88 105.19 97.36 2fsw n GLY 21 Ca -0.03 -0.12 0.17 0.00 0.00 0.00 0.00 46.02 46.04 2fsw n GLY 21 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2fsw h LYS 22 N 0.47 0.00 0.00 1.61 -0.00 -1.99 -3.34 116.57 113.32 2fsw h LYS 22 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.18 2fsw h LYS 22 Cb 1.38 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.61 2fsw h LYS 22 CO 0.50 0.05 -0.96 0.91 -0.00 0.00 0.00 179.45 179.95 2fsw n TRP 23 N -3.26 0.00 0.26 0.07 7.02 -1.26 -4.75 117.44 115.53 2fsw n TRP 23 Ca -0.01 0.00 -0.16 0.00 -1.02 0.00 0.00 57.50 56.31 2fsw n TRP 23 Cb 0.25 -0.10 -0.08 0.00 -2.42 0.00 0.00 31.31 28.96 2fsw n TRP 23 CO 0.00 0.00 0.00 1.15 -2.02 0.00 0.00 177.69 176.82 2fsw h THR 24 N 0.00 0.31 -0.19 -0.99 2.02 -1.87 -0.93 112.91 111.27 2fsw h THR 24 Ca 0.00 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.05 2fsw h THR 24 Cb 0.27 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2fsw h THR 24 CO 0.00 0.00 -0.43 -0.07 0.37 0.00 0.00 175.52 175.39 2fsw h LEU 25 N -0.76 0.47 -0.53 2.58 3.38 -1.82 -2.32 115.31 116.31 2fsw h LEU 25 Ca -0.04 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.73 2fsw h LEU 25 Cb 0.65 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 2fsw h LEU 25 CO 0.00 0.85 0.34 -0.07 0.09 0.00 0.00 178.44 179.65 2fsw h LEU 26 N 0.36 0.58 -0.18 1.67 4.07 -1.80 -0.68 115.31 119.34 2fsw h LEU 26 Ca 0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 2fsw h LEU 26 Cb 0.90 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.50 2fsw h LEU 26 CO 0.08 0.41 0.07 0.40 -1.08 0.00 0.00 178.44 178.32 2fsw h ILE 27 N 0.69 1.16 -0.44 1.22 2.04 -1.08 -1.14 117.51 119.96 2fsw h ILE 27 Ca 0.20 -0.49 0.04 0.00 1.00 0.00 0.00 64.86 65.61 2fsw h ILE 27 Cb -0.04 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 2fsw h ILE 27 CO -0.06 0.16 0.21 0.40 0.00 0.00 0.00 178.15 178.86 2fsw h ILE 28 N 0.13 0.95 -0.96 -0.67 2.04 -1.35 -1.17 117.51 116.47 2fsw h ILE 28 Ca 0.06 -0.15 0.11 0.00 1.00 0.00 0.00 64.86 65.89 2fsw h ILE 28 Cb 0.18 0.49 -0.08 0.00 -0.74 0.00 0.00 36.82 36.67 2fsw h ILE 28 CO -0.00 0.08 0.59 0.15 0.00 0.00 0.00 178.15 178.97 2fsw h PHE 29 N 0.43 1.08 0.10 1.37 3.57 -1.02 0.33 116.94 122.79 2fsw h PHE 29 Ca 0.19 0.03 -0.29 0.00 3.53 0.00 0.00 57.97 61.44 2fsw h PHE 29 Cb 0.12 -0.34 0.02 0.00 2.79 0.00 0.00 35.95 38.54 2fsw h PHE 29 CO -0.11 0.43 -1.19 1.96 -2.23 0.00 0.00 178.31 177.17 2fsw h GLN 30 N 0.95 0.57 0.07 1.11 1.08 -0.83 -3.28 115.11 114.79 2fsw h GLN 30 Ca 0.47 -0.75 -0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2fsw h GLN 30 Cb 0.46 0.24 0.00 0.00 -0.05 0.00 0.00 27.48 28.13 2fsw h GLN 30 CO -0.26 1.33 -0.03 0.82 -0.95 0.00 0.00 178.83 179.73 2fsw h ILE 31 N 0.26 1.04 0.00 2.54 2.04 -1.14 -3.47 117.51 118.78 2fsw h ILE 31 Ca -0.17 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.32 2fsw h ILE 31 Cb 1.86 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 39.23 2fsw h ILE 31 CO 0.22 0.09 0.00 -3.20 0.00 0.00 0.00 178.15 175.27 2fsw n ASN 32 N -5.05 0.00 -1.55 1.72 2.85 0.10 -2.13 115.26 111.20 2fsw n ASN 32 Ca -0.08 0.00 0.05 0.00 -0.11 0.00 0.00 54.58 54.44 2fsw n ASN 32 Cb 0.13 0.00 0.30 0.00 1.24 0.00 0.00 39.78 41.45 2fsw n ASN 32 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2fsw n ARG 33 N 12.50 3.86 -3.31 1.20 1.74 -1.26 -4.30 116.66 127.09 2fsw n ARG 33 Ca 0.00 -2.34 -0.17 0.00 -0.77 0.00 0.00 57.85 54.57 2fsw n ARG 33 Cb 0.00 -2.07 -0.03 0.00 -1.02 0.00 0.00 32.46 29.34 2fsw n ARG 33 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2fsw n ARG 34 N 0.44 1.27 -4.40 5.56 -4.01 -0.91 -5.03 116.66 109.59 2fsw n ARG 34 Ca 0.21 -1.99 -0.34 0.00 -1.04 0.00 0.00 57.85 54.70 2fsw n ARG 34 Cb 0.97 0.47 -0.12 0.00 -3.04 0.00 0.00 32.46 30.74 2fsw n ARG 34 CO 0.00 0.00 0.00 0.42 -3.04 0.00 0.00 177.63 175.01 2fsw s ILE 35 N -1.89 3.96 -0.02 8.89 1.01 -1.26 -4.47 121.20 127.42 2fsw s ILE 35 Ca 0.04 -0.34 0.01 0.00 0.00 0.00 0.00 60.65 60.36 2fsw s ILE 35 Cb -0.00 -2.72 0.01 0.00 0.01 0.00 0.00 42.46 39.75 2fsw s ILE 35 CO 0.02 0.51 -0.04 -0.51 0.00 0.00 0.00 174.94 174.92 2fsw s ILE 36 N 0.16 0.44 0.47 2.92 2.07 -0.48 -4.95 121.20 121.83 2fsw s ILE 36 Ca -0.01 -0.15 -0.20 0.00 -1.41 0.00 0.00 60.65 58.88 2fsw s ILE 36 Cb -0.14 -0.43 -0.09 0.00 0.13 0.00 0.00 42.46 41.93 2fsw s ILE 36 CO 0.03 0.17 1.01 -0.13 -1.91 0.00 0.00 174.94 174.10 2fsw s ARG 37 N 0.42 3.95 0.26 3.50 0.52 -1.26 -0.62 118.95 125.72 2fsw s ARG 37 Ca -0.05 1.26 -0.08 0.00 -0.52 0.00 0.00 55.73 56.35 2fsw s ARG 37 Cb -0.09 -2.12 0.45 0.00 0.52 0.00 0.00 34.95 33.71 2fsw s ARG 37 CO -0.00 -0.29 1.59 -0.92 0.02 0.00 0.00 175.30 175.70 2fsw h TYR 38 N 1.66 -0.30 -0.48 -0.53 3.20 -1.93 -1.19 116.97 117.40 2fsw h TYR 38 Ca -0.49 0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.36 2fsw h TYR 38 Cb 1.21 0.27 -0.02 0.00 1.54 0.00 0.00 36.73 39.72 2fsw h TYR 38 CO 0.59 -0.35 -0.06 0.78 -1.64 0.00 0.00 178.16 177.48 2fsw h GLY 39 N 0.02 0.92 2.00 1.82 0.00 -1.93 0.48 103.07 106.38 2fsw h GLY 39 Ca 0.44 -0.67 -0.13 0.00 0.00 0.00 0.00 47.33 46.98 2fsw h GLY 39 CO -0.84 0.62 -0.61 -2.09 0.00 0.00 0.00 176.54 173.61 2fsw h GLU 40 N 0.78 0.00 -0.05 4.80 4.81 -1.73 -2.53 114.58 120.65 2fsw h GLU 40 Ca 0.14 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.14 2fsw h GLU 40 Cb 0.55 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.94 2fsw h GLU 40 CO 0.03 0.61 -0.88 1.25 -0.73 0.00 0.00 179.01 179.29 2fsw h LEU 41 N 0.00 0.72 -0.73 1.64 5.85 -0.89 -1.25 115.31 120.65 2fsw h LEU 41 Ca -0.01 -0.53 -0.01 0.00 0.84 0.00 0.00 57.88 58.18 2fsw h LEU 41 Cb 1.09 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 2fsw h LEU 41 CO 0.08 1.32 0.43 0.50 -0.34 0.00 0.00 178.44 180.43 2fsw h LYS 42 N 0.36 1.00 -0.00 1.25 3.11 -0.89 -2.74 116.57 118.66 2fsw h LYS 42 Ca -0.08 -0.10 -0.16 0.00 -2.81 0.00 0.00 60.65 57.51 2fsw h LYS 42 Cb 1.51 -0.21 -0.02 0.00 -1.00 0.00 0.00 32.23 32.51 2fsw h LYS 42 CO 0.17 0.72 -0.75 0.00 -2.81 0.00 0.00 179.45 176.77 2fsw h ARG 43 N 1.00 0.03 0.00 1.90 2.47 -1.43 -3.20 114.38 115.15 2fsw h ARG 43 Ca 0.26 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.96 2fsw h ARG 43 Cb -0.02 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 2fsw h ARG 43 CO -0.05 0.76 0.00 0.00 0.56 0.00 0.00 179.97 181.25 2fsw h ALA 44 N 1.23 1.00 -2.95 0.04 0.00 -0.93 -3.29 119.26 114.36 2fsw h ALA 44 Ca -0.01 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.28 2fsw h ALA 44 Cb 1.33 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.71 2fsw h ALA 44 CO 0.10 0.00 -0.69 0.42 0.00 0.00 0.00 179.25 179.08 2fsw s ILE 45 N -3.56 2.07 0.33 0.00 1.01 -1.12 -5.07 121.20 114.86 2fsw s ILE 45 Ca 0.01 -3.54 -0.29 0.00 0.00 0.00 0.00 60.65 56.83 2fsw s ILE 45 Cb 0.09 -2.39 -0.11 0.00 0.01 0.00 0.00 42.46 40.06 2fsw s ILE 45 CO 0.41 -1.01 1.55 -2.84 0.00 0.00 0.00 174.94 173.05 2fsw s PRO 46 N -0.70 4.12 0.00 2.79 0.02 -1.24 -2.88 135.00 137.10 2fsw s PRO 46 Ca 0.24 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.84 2fsw s PRO 46 Cb -0.09 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.43 2fsw s PRO 46 CO -0.12 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.36 2fsw n GLY 47 N 1.46 0.70 3.73 0.52 0.00 -1.26 -5.06 105.19 105.28 2fsw n GLY 47 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 2fsw n GLY 47 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2fsw s ILE 48 N -2.60 5.07 0.65 -0.61 2.07 -1.14 -5.07 121.20 119.57 2fsw s ILE 48 Ca 0.00 1.19 -0.11 0.00 -1.41 0.00 0.00 60.65 60.32 2fsw s ILE 48 Cb 0.00 -3.92 -0.02 0.00 0.13 0.00 0.00 42.46 38.65 2fsw s ILE 48 CO 0.00 0.33 1.05 -0.94 -1.91 0.00 0.00 174.94 173.47 2fsw s SER 49 N 0.44 5.95 0.21 4.50 1.04 -1.26 -4.90 113.70 119.70 2fsw s SER 49 Ca 0.31 1.39 -0.08 0.00 0.48 0.00 0.00 55.95 58.05 2fsw s SER 49 Cb -0.17 -2.37 0.29 0.00 0.10 0.00 0.00 66.02 63.88 2fsw s SER 49 CO 0.15 -1.04 1.77 -0.08 0.98 0.00 0.00 173.24 175.01 2fsw h GLU 50 N -0.44 0.53 -0.57 4.02 4.81 -2.01 -1.06 114.58 119.86 2fsw h GLU 50 Ca -0.44 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2fsw h GLU 50 Cb 1.21 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2fsw h GLU 50 CO 0.62 0.35 0.00 1.17 -0.73 0.00 0.00 179.01 180.41 2fsw n LYS 51 N -4.90 0.24 0.00 1.92 4.81 -1.26 -1.58 118.16 117.39 2fsw n LYS 51 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 2fsw n LYS 51 Cb 0.25 -1.18 0.00 0.00 0.02 0.00 0.00 35.03 34.13 2fsw n LYS 51 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2fsw n LEU 53 N 0.49 0.00 -0.02 3.14 0.00 -0.40 -1.61 117.00 118.60 2fsw n LEU 53 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 56.01 55.86 2fsw n LEU 53 Cb 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.39 2fsw n LEU 53 CO 0.00 0.00 0.40 -0.29 0.00 0.00 0.00 177.39 177.50 2fsw h ILE 54 N 0.00 1.44 -0.74 1.96 -0.00 -1.54 -0.60 117.51 118.03 2fsw h ILE 54 Ca 0.00 -1.82 0.02 0.00 -0.00 0.00 0.00 64.86 63.06 2fsw h ILE 54 Cb 0.00 2.44 -0.04 0.00 -0.00 0.00 0.00 36.82 39.22 2fsw h ILE 54 CO 0.00 0.52 0.48 0.44 -0.00 0.00 0.00 178.15 179.59 2fsw h ASP 55 N -0.19 0.82 -0.27 2.19 3.45 -1.56 -0.75 116.42 120.10 2fsw h ASP 55 Ca -0.03 -0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.35 2fsw h ASP 55 Cb 1.03 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.60 2fsw h ASP 55 CO 0.07 0.58 -0.09 -0.08 -1.57 0.00 0.00 179.24 178.16 2fsw h GLU 56 N 0.97 0.54 -0.79 3.56 4.57 -1.79 0.89 114.58 122.53 2fsw h GLU 56 Ca 0.28 -0.22 0.04 0.00 -1.18 0.00 0.00 59.36 58.28 2fsw h GLU 56 Cb -0.06 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.45 2fsw h GLU 56 CO -0.08 0.76 0.50 -0.07 -1.18 0.00 0.00 179.01 178.94 2fsw h LEU 57 N 0.29 0.81 0.02 1.64 3.38 -0.96 0.98 115.31 121.47 2fsw h LEU 57 Ca 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2fsw h LEU 57 Cb 0.58 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2fsw h LEU 57 CO 0.03 0.54 -0.01 0.50 0.09 0.00 0.00 178.44 179.60 2fsw h LYS 58 N 0.95 -0.03 -0.37 1.13 3.64 -0.93 -0.82 116.57 120.14 2fsw h LYS 58 Ca 0.33 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.78 2fsw h LYS 58 Cb 0.06 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.82 2fsw h LYS 58 CO -0.13 0.09 -0.07 0.35 -2.27 0.00 0.00 179.45 177.41 2fsw h PHE 59 N -0.14 -0.16 -0.40 1.91 3.57 -0.48 -0.12 116.94 121.12 2fsw h PHE 59 Ca -0.00 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.42 2fsw h PHE 59 Cb 0.13 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2fsw h PHE 59 CO -0.04 -0.14 -0.21 -0.07 -2.23 0.00 0.00 178.31 175.62 2fsw h LEU 60 N 0.02 0.79 -0.13 0.59 3.38 -0.71 0.13 115.31 119.38 2fsw h LEU 60 Ca 0.18 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2fsw h LEU 60 Cb 0.27 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2fsw h LEU 60 CO -0.36 0.98 0.08 0.00 0.09 0.00 0.00 178.44 179.22 2fsw h GLY 62 N 0.16 0.80 1.03 0.00 0.00 -0.62 -0.90 103.07 103.54 2fsw h GLY 62 Ca 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2fsw h GLY 62 CO -0.02 0.24 -0.03 0.28 0.00 0.00 0.00 176.54 177.00 2fsw n LYS 63 N -4.47 0.79 -1.95 4.80 4.76 -0.00 -4.92 118.16 117.18 2fsw n LYS 63 Ca 0.08 -0.14 -0.08 0.00 -2.87 0.00 0.00 58.31 55.29 2fsw n LYS 63 Cb 0.15 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 31.83 2fsw n LYS 63 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2fsw n GLY 64 N 1.18 0.25 0.07 0.72 0.00 -0.34 -4.95 105.19 102.13 2fsw n GLY 64 Ca 0.18 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2fsw n GLY 64 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fsw n LEU 65 N -1.06 0.36 -4.19 0.99 4.77 -0.33 -4.38 117.00 113.14 2fsw n LEU 65 Ca -0.09 0.16 -0.15 0.00 -0.03 0.00 0.00 56.01 55.89 2fsw n LEU 65 Cb 0.50 0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 41.67 2fsw n LEU 65 CO 0.11 0.21 -0.43 0.27 -1.33 0.00 0.00 177.39 176.22 2fsw s ILE 66 N -2.96 1.04 -0.14 -0.08 -4.36 -1.22 -2.20 121.20 111.28 2fsw s ILE 66 Ca -0.06 -1.63 -0.04 0.00 -0.26 0.00 0.00 60.65 58.65 2fsw s ILE 66 Cb 0.09 -1.37 -0.03 0.00 1.25 0.00 0.00 42.46 42.40 2fsw s ILE 66 CO 0.84 -0.50 0.01 -0.54 0.24 0.00 0.00 174.94 174.99 2fsw s LYS 67 N -2.69 3.55 -0.11 0.37 1.02 0.18 -4.46 119.74 117.60 2fsw s LYS 67 Ca 0.06 -0.41 -0.09 0.00 0.02 0.00 0.00 55.97 55.55 2fsw s LYS 67 Cb -0.04 -2.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 2fsw s LYS 67 CO 0.01 0.42 0.19 0.21 -0.92 0.00 0.00 175.35 175.26 2fsw s LYS 68 N -0.08 3.61 -0.08 1.68 2.36 -1.26 -2.02 119.74 123.94 2fsw s LYS 68 Ca 0.04 -0.03 -0.02 0.00 -2.55 0.00 0.00 55.97 53.41 2fsw s LYS 68 Cb -0.13 -3.22 0.04 0.00 -1.05 0.00 0.00 37.83 33.47 2fsw s LYS 68 CO 0.02 0.71 0.05 0.21 1.55 0.00 0.00 175.35 177.89 2fsw s LYS 69 N -0.88 0.18 0.08 4.03 2.20 -0.06 -4.99 119.74 120.30 2fsw s LYS 69 Ca 0.16 0.19 -0.15 0.00 -0.36 0.00 0.00 55.97 55.81 2fsw s LYS 69 Cb -0.13 -0.93 -0.06 0.00 -1.51 0.00 0.00 37.83 35.19 2fsw s LYS 69 CO 0.05 -0.39 0.49 -0.65 -0.36 0.00 0.00 175.35 174.49 2fsw s GLN 70 N 2.09 3.98 -0.36 4.03 -1.52 -1.26 -1.20 119.66 125.41 2fsw s GLN 70 Ca 0.04 0.48 0.03 0.00 -1.95 0.00 0.00 55.36 53.96 2fsw s GLN 70 Cb -0.13 -3.08 0.11 0.00 -0.22 0.00 0.00 33.01 29.68 2fsw s GLN 70 CO -0.05 0.58 0.10 0.71 -0.25 0.00 0.00 175.29 176.38 2fsw s TYR 71 N -1.28 3.10 -1.03 0.91 1.51 -0.10 -5.01 117.35 115.44 2fsw s TYR 71 Ca 0.31 -2.70 -0.09 0.00 -1.01 0.00 0.00 57.07 53.59 2fsw s TYR 71 Cb -0.16 -2.57 -0.07 0.00 -0.11 0.00 0.00 41.96 39.05 2fsw s TYR 71 CO 0.17 -0.90 2.23 -0.35 -1.11 0.00 0.00 175.55 175.59 2fsw n PRO 72 N 4.20 2.30 -2.29 -1.71 -0.04 -1.26 -2.80 135.00 133.39 2fsw n PRO 72 Ca 0.03 -1.67 -0.04 0.00 -0.04 0.00 0.00 63.50 61.78 2fsw n PRO 72 Cb 0.40 -2.60 -0.01 0.00 -0.04 0.00 0.00 33.50 31.26 2fsw n PRO 72 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2fsw n GLU 73 N 4.54 1.82 -3.99 0.54 0.28 -1.26 -5.02 120.64 117.55 2fsw n GLU 73 Ca 0.51 -0.45 -0.34 0.00 -0.16 0.00 0.00 57.16 56.72 2fsw n GLU 73 Cb 0.19 0.11 -0.15 0.00 1.43 0.00 0.00 31.44 33.03 2fsw n GLU 73 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 2fsw s VAL 74 N -1.16 2.82 0.50 3.84 1.01 -1.26 -1.77 120.40 124.39 2fsw s VAL 74 Ca 0.00 -0.72 -0.18 0.00 0.00 0.00 0.00 61.98 61.08 2fsw s VAL 74 Cb -0.00 -2.27 -0.08 0.00 0.00 0.00 0.00 36.38 34.03 2fsw s VAL 74 CO 0.00 0.44 1.00 -2.16 0.00 0.00 0.00 175.10 174.38 2fsw s PRO 75 N 1.39 3.88 0.69 2.72 0.04 -1.26 -5.12 135.00 137.34 2fsw s PRO 75 Ca 0.05 1.10 -0.12 0.00 0.04 0.00 0.00 61.00 62.07 2fsw s PRO 75 Cb -0.14 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.29 2fsw s PRO 75 CO -0.07 -0.34 1.07 -1.25 0.04 0.00 0.00 177.00 176.45 2fsw s PRO 76 N -3.74 2.85 -0.02 0.56 0.04 -0.73 -5.03 135.00 128.94 2fsw s PRO 76 Ca 0.62 1.06 -0.16 0.00 0.04 0.00 0.00 61.00 62.55 2fsw s PRO 76 Cb -0.12 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.47 2fsw s PRO 76 CO 0.26 -1.17 0.35 -0.98 0.04 0.00 0.00 177.00 175.49 2fsw s ARG 77 N -4.83 0.70 -0.07 4.56 1.70 -1.12 -4.99 118.95 114.90 2fsw s ARG 77 Ca 0.60 -0.14 0.01 0.00 -0.47 0.00 0.00 55.73 55.73 2fsw s ARG 77 Cb -0.15 0.31 -0.03 0.00 -0.57 0.00 0.00 34.95 34.51 2fsw s ARG 77 CO 0.52 -0.20 -0.07 0.14 -1.08 0.00 0.00 175.30 174.61 2fsw s VAL 78 N -1.29 3.71 0.05 4.99 -7.23 -1.26 -0.93 120.40 118.43 2fsw s VAL 78 Ca -0.13 -0.47 0.08 0.00 -1.81 0.00 0.00 61.98 59.64 2fsw s VAL 78 Cb -0.05 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.35 2fsw s VAL 78 CO 0.05 0.59 -0.21 -1.61 -0.31 0.00 0.00 175.10 173.61 2fsw s GLU 79 N -0.72 1.41 0.02 4.82 2.02 -0.34 -2.95 118.70 122.95 2fsw s GLU 79 Ca 0.11 -0.97 0.08 0.00 0.02 0.00 0.00 54.97 54.21 2fsw s GLU 79 Cb -0.11 -1.54 -0.02 0.00 0.10 0.00 0.00 34.13 32.55 2fsw s GLU 79 CO 0.02 0.39 -0.24 0.71 0.02 0.00 0.00 175.26 176.16 2fsw s TYR 80 N -0.82 2.12 0.14 1.61 2.02 0.21 -0.88 117.35 121.75 2fsw s TYR 80 Ca 0.08 -0.40 -0.04 0.00 -0.37 0.00 0.00 57.07 56.33 2fsw s TYR 80 Cb -0.09 -1.31 -0.03 0.00 -0.40 0.00 0.00 41.96 40.13 2fsw s TYR 80 CO 0.02 0.05 0.15 -1.54 -1.57 0.00 0.00 175.55 172.66 2fsw s SER 81 N -0.92 0.20 0.33 2.29 1.04 -0.86 -1.38 113.70 114.40 2fsw s SER 81 Ca 0.10 -1.05 -0.25 0.00 0.48 0.00 0.00 55.95 55.23 2fsw s SER 81 Cb -0.09 0.35 -0.10 0.00 0.10 0.00 0.00 66.02 66.28 2fsw s SER 81 CO 0.01 -0.79 0.93 -0.76 0.98 0.00 0.00 173.24 173.61 2fsw s LEU 82 N -3.01 4.29 0.84 2.42 1.43 -1.26 0.50 118.68 123.89 2fsw s LEU 82 Ca 0.20 1.79 -0.12 0.00 -1.03 0.00 0.00 54.13 54.97 2fsw s LEU 82 Cb 0.06 -4.06 0.10 0.00 0.03 0.00 0.00 46.19 42.32 2fsw s LEU 82 CO 0.00 -0.10 1.14 0.42 0.23 0.00 0.00 176.35 178.05 2fsw s THR 83 N -1.69 2.26 0.36 5.49 -4.23 -0.94 -4.73 115.64 112.17 2fsw s THR 83 Ca 0.51 0.08 0.06 0.00 -1.18 0.00 0.00 61.69 61.17 2fsw s THR 83 Cb -0.17 -2.94 0.30 0.00 1.34 0.00 0.00 72.50 71.02 2fsw s THR 83 CO 0.22 -0.11 1.94 -0.65 -0.54 0.00 0.00 174.62 175.48 2fsw h PRO 84 N -1.22 0.73 0.07 3.99 0.11 -1.90 -1.20 132.00 132.58 2fsw h PRO 84 Ca -0.48 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.60 2fsw h PRO 84 Cb 1.32 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2fsw h PRO 84 CO 0.63 0.48 -0.12 1.25 -0.21 0.00 0.00 178.00 180.03 2fsw h LEU 85 N 0.75 -0.34 -0.98 2.35 5.85 -1.89 -2.92 115.31 118.13 2fsw h LEU 85 Ca 0.34 0.04 0.16 0.00 0.84 0.00 0.00 57.88 59.27 2fsw h LEU 85 Cb 0.36 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.43 2fsw h LEU 85 CO -0.13 -0.18 0.59 1.23 -0.34 0.00 0.00 178.44 179.61 2fsw h GLY 86 N -0.24 1.68 2.00 3.75 0.00 -1.48 -2.03 103.07 106.75 2fsw h GLY 86 Ca 0.02 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 2fsw h GLY 86 CO -0.08 0.01 -0.07 0.83 0.00 0.00 0.00 176.54 177.23 2fsw h GLU 87 N 0.81 0.00 0.00 4.80 5.08 -1.09 -1.47 114.58 122.72 2fsw h GLU 87 Ca 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 2fsw h GLU 87 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2fsw h GLU 87 CO -0.34 0.07 0.00 1.63 -1.00 0.00 0.00 179.01 179.37 2fsw n LYS 88 N -3.85 0.12 0.18 2.33 5.02 -0.76 -2.14 118.16 119.06 2fsw n LYS 88 Ca -0.02 0.09 0.12 0.00 -2.02 0.00 0.00 58.31 56.47 2fsw n LYS 88 Cb 0.17 -1.50 0.13 0.00 -0.02 0.00 0.00 35.03 33.80 2fsw n LYS 88 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2fsw h VAL 89 N 0.00 0.00 -0.82 -0.18 2.07 -1.31 -3.38 116.25 112.62 2fsw h VAL 89 Ca 0.00 -0.98 0.01 0.00 0.82 0.00 0.00 66.70 66.55 2fsw h VAL 89 Cb 0.34 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 2fsw h VAL 89 CO 0.00 0.00 0.54 -0.07 0.02 0.00 0.00 177.57 178.06 2fsw h LEU 90 N 0.00 0.93 -1.56 2.57 3.38 -1.53 -2.07 115.31 117.03 2fsw h LEU 90 Ca 0.00 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2fsw h LEU 90 Cb 0.99 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 2fsw h LEU 90 CO 0.00 0.67 0.30 -0.65 0.09 0.00 0.00 178.44 178.85 2fsw h PRO 91 N 1.10 0.59 0.13 1.13 0.11 -1.77 0.38 132.00 133.67 2fsw h PRO 91 Ca 0.30 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.38 2fsw h PRO 91 Cb -0.11 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 30.86 2fsw h PRO 91 CO -0.07 0.39 -0.10 0.82 -0.21 0.00 0.00 178.00 178.82 2fsw h ILE 92 N 0.60 0.77 -0.64 4.15 2.04 -1.64 -2.89 117.51 119.91 2fsw h ILE 92 Ca 0.16 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.97 2fsw h ILE 92 Cb -0.07 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 2fsw h ILE 92 CO -0.04 0.00 0.18 0.40 0.00 0.00 0.00 178.15 178.69 2fsw h ILE 93 N -0.25 1.24 -0.86 -0.67 2.04 -1.17 -1.55 117.51 116.30 2fsw h ILE 93 Ca -0.00 -0.87 0.10 0.00 1.00 0.00 0.00 64.86 65.08 2fsw h ILE 93 Cb 0.22 0.56 -0.08 0.00 -0.74 0.00 0.00 36.82 36.79 2fsw h ILE 93 CO -0.01 0.33 0.50 0.44 0.00 0.00 0.00 178.15 179.41 2fsw h ASP 94 N 0.96 0.71 -0.05 1.72 3.32 -0.92 0.53 116.42 122.69 2fsw h ASP 94 Ca 0.21 0.05 -0.12 0.00 0.02 0.00 0.00 57.03 57.19 2fsw h ASP 94 Cb 0.31 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 2fsw h ASP 94 CO -0.00 0.40 -0.35 -0.33 -1.72 0.00 0.00 179.24 177.24 2fsw h GLU 95 N 0.82 0.54 -0.51 3.56 4.39 -1.09 -1.81 114.58 120.49 2fsw h GLU 95 Ca 0.42 -0.25 -0.08 0.00 0.34 0.00 0.00 59.36 59.78 2fsw h GLU 95 Cb 0.39 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 2fsw h GLU 95 CO -0.25 0.82 0.01 0.82 -1.16 0.00 0.00 179.01 179.24 2fsw h ILE 96 N 0.46 1.26 -0.55 3.13 2.04 -0.87 -1.15 117.51 121.84 2fsw h ILE 96 Ca 0.05 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 64.81 2fsw h ILE 96 Cb 0.83 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2fsw h ILE 96 CO 0.07 0.38 0.24 0.00 0.00 0.00 0.00 178.15 178.83 2fsw h ALA 97 N 0.94 0.71 -0.27 1.87 0.00 -0.82 -0.58 119.26 121.11 2fsw h ALA 97 Ca 0.14 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2fsw h ALA 97 Cb 0.51 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2fsw h ALA 97 CO 0.03 0.30 0.10 -0.22 0.00 0.00 0.00 179.25 179.46 2fsw h LYS 98 N 0.74 0.22 -0.67 0.00 3.64 -1.24 -2.44 116.57 116.82 2fsw h LYS 98 Ca 0.18 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 2fsw h LYS 98 Cb 0.17 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 2fsw h LYS 98 CO -0.02 0.14 0.41 0.35 -2.27 0.00 0.00 179.45 178.07 2fsw h PHE 99 N 0.22 0.76 0.00 1.91 3.57 -0.92 -2.22 116.94 120.28 2fsw h PHE 99 Ca 0.12 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2fsw h PHE 99 Cb 0.08 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.57 2fsw h PHE 99 CO -0.12 0.43 0.00 0.41 -2.23 0.00 0.00 178.31 176.79 2fsw n GLY 100 N -1.28 0.23 0.00 2.40 0.00 -0.25 -1.91 105.19 104.38 2fsw n GLY 100 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2fsw n GLY 100 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2fsw n GLU 102 N 0.44 0.00 0.00 1.61 1.02 -0.83 -1.65 120.64 121.22 2fsw n GLU 102 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2fsw n GLU 102 Cb 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.46 2fsw n GLU 102 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2fsw n ASN 103 N 0.00 0.13 -0.06 1.62 4.13 -0.80 -5.23 115.26 115.05 2fsw n ASN 103 Ca 0.00 -0.53 0.01 0.00 1.68 0.00 0.00 54.58 55.74 2fsw n ASN 103 Cb 0.00 0.75 0.01 0.00 -1.54 0.00 0.00 39.78 39.00 2fsw n ASN 103 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72