#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fwl h GLY 4 N 0.00 0.25 1.19 6.12 0.00 -1.88 -3.14 103.07 105.61 2fwl h GLY 4 Ca 0.00 -0.31 -0.16 0.00 0.00 0.00 0.00 47.33 46.86 2fwl h GLY 4 CO 0.00 0.28 -0.42 0.00 0.00 0.00 0.00 176.54 176.40 2fwl h ALA 5 N 1.21 0.59 -0.99 3.60 0.00 -1.95 -1.09 119.26 120.63 2fwl h ALA 5 Ca -0.00 -0.47 0.01 0.00 0.00 0.00 0.00 54.91 54.45 2fwl h ALA 5 Cb 1.08 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 2fwl h ALA 5 CO 0.09 0.68 0.65 -0.22 0.00 0.00 0.00 179.25 180.45 2fwl h LYS 6 N 0.71 1.30 0.00 0.00 3.11 -2.00 -2.29 116.57 117.41 2fwl h LYS 6 Ca 0.05 -0.08 -0.15 0.00 -2.81 0.00 0.00 60.65 57.66 2fwl h LYS 6 Cb 1.01 -0.29 -0.02 0.00 -1.00 0.00 0.00 32.23 31.93 2fwl h LYS 6 CO 0.10 0.87 -0.72 0.82 -2.81 0.00 0.00 179.45 177.71 2fwl h ILE 7 N 1.34 1.17 -0.26 2.00 1.08 -1.49 -3.25 117.51 118.10 2fwl h ILE 7 Ca 0.36 -2.67 0.08 0.00 -0.39 0.00 0.00 64.86 62.24 2fwl h ILE 7 Cb -0.15 2.57 -0.01 0.00 -3.07 0.00 0.00 36.82 36.16 2fwl h ILE 7 CO -0.08 0.67 0.20 0.22 -0.69 0.00 0.00 178.15 178.47 2fwl h TYR 8 N 0.00 0.00 -0.12 1.37 3.20 -0.60 -0.15 116.97 120.68 2fwl h TYR 8 Ca -0.01 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.87 2fwl h TYR 8 Cb 1.54 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.80 2fwl h TYR 8 CO 0.00 0.00 0.08 0.00 -1.64 0.00 0.00 178.16 176.60 2fwl h ALA 9 N 1.85 1.98 -0.02 1.82 0.00 -1.57 -1.21 119.26 122.11 2fwl h ALA 9 Ca 0.12 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.81 2fwl h ALA 9 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2fwl h ALA 9 CO -0.00 0.00 -0.91 1.96 0.00 0.00 0.00 179.25 180.30 2fwl h GLN 10 N 0.11 0.45 -0.10 0.00 4.20 -1.23 -3.14 115.11 115.40 2fwl h GLN 10 Ca 0.05 -0.46 -0.09 0.00 0.06 0.00 0.00 58.65 58.22 2fwl h GLN 10 Cb 0.07 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2fwl h GLN 10 CO -0.01 1.11 -0.33 0.00 -0.67 0.00 0.00 178.83 178.93 2fwl h ALA 12 N 1.50 1.00 0.00 0.00 0.00 -1.27 0.13 119.26 120.62 2fwl h ALA 12 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2fwl h ALA 12 Cb 0.67 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2fwl h ALA 12 CO 0.05 0.00 -0.14 0.78 0.00 0.00 0.00 179.25 179.94 2fwl h GLY 13 N 1.11 0.00 0.00 0.00 0.00 -1.51 -2.35 103.07 100.33 2fwl h GLY 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2fwl h GLY 13 CO 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 176.54 176.01 2fwl n HIS 15 N -2.05 0.00 -1.09 0.00 8.25 0.43 -4.26 115.22 116.51 2fwl n HIS 15 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 2fwl n HIS 15 Cb 0.27 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 2fwl n HIS 15 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2fwl n GLN 16 N -0.99 -2.25 0.00 -0.41 1.13 -0.88 -2.22 117.38 111.76 2fwl n GLN 16 Ca 0.09 1.56 0.14 0.00 -1.94 0.00 0.00 57.00 56.85 2fwl n GLN 16 Cb 0.35 -2.72 0.65 0.00 0.11 0.00 0.00 30.24 28.63 2fwl n GLN 16 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2fwl n GLN 17 N -3.59 0.14 0.09 -1.09 3.00 -1.26 -2.94 117.38 111.72 2fwl n GLN 17 Ca -0.01 0.01 0.11 0.00 -0.01 0.00 0.00 57.00 57.11 2fwl n GLN 17 Cb 0.50 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 29.22 2fwl n GLN 17 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 2fwl n ASN 18 N -1.43 0.78 -0.69 1.08 0.23 -1.26 -4.96 115.26 109.01 2fwl n ASN 18 Ca 0.09 0.30 -0.08 0.00 -0.53 0.00 0.00 54.58 54.36 2fwl n ASN 18 Cb 0.30 0.57 -0.03 0.00 -2.08 0.00 0.00 39.78 38.54 2fwl n ASN 18 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2fwl n GLY 19 N 1.20 0.77 0.10 4.83 0.00 -0.94 -4.77 105.19 106.38 2fwl n GLY 19 Ca -0.01 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 2fwl n GLY 19 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2fwl n GLN 20 N -2.53 0.68 0.00 1.61 6.02 -1.12 0.19 117.38 122.22 2fwl n GLN 20 Ca -0.08 0.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2fwl n GLN 20 Cb 0.34 -1.57 0.00 0.00 1.02 0.00 0.00 30.24 30.03 2fwl n GLN 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2fwl n GLY 21 N 1.82 -0.89 2.98 1.08 0.00 -0.99 -2.87 105.19 106.33 2fwl n GLY 21 Ca -0.33 -1.20 -0.26 0.00 0.00 0.00 0.00 46.02 44.23 2fwl n GLY 21 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fwl s ILE 22 N 0.00 1.14 -0.16 -0.61 -1.09 0.38 -4.92 121.20 115.95 2fwl s ILE 22 Ca 0.00 -0.43 -0.32 0.00 -2.23 0.00 0.00 60.65 57.67 2fwl s ILE 22 Cb 0.00 -1.09 -0.09 0.00 -1.58 0.00 0.00 42.46 39.70 2fwl s ILE 22 CO 0.00 0.37 2.07 -2.65 -1.23 0.00 0.00 174.94 173.50 2fwl n PRO 23 N 4.31 2.00 -0.39 2.79 -0.02 -1.26 -0.20 135.00 142.23 2fwl n PRO 23 Ca -0.18 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2fwl n PRO 23 Cb 0.51 -2.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.13 2fwl n PRO 23 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fwl n GLY 24 N 5.29 0.74 1.99 -1.23 0.00 -1.24 -4.85 105.19 105.90 2fwl n GLY 24 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2fwl n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fwl n ALA 25 N -0.84 3.00 -3.74 4.61 0.00 -0.23 -2.60 120.51 120.71 2fwl n ALA 25 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 2fwl n ALA 25 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.29 2fwl n ALA 25 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2fwl s PHE 26 N -2.00 1.60 0.68 0.00 0.08 0.72 -3.93 117.98 115.13 2fwl s PHE 26 Ca 0.00 -0.74 -0.12 0.00 0.12 0.00 0.00 56.93 56.19 2fwl s PHE 26 Cb 0.00 -1.24 0.00 0.00 -0.57 0.00 0.00 43.02 41.22 2fwl s PHE 26 CO 0.00 -0.45 1.06 -1.25 -0.10 0.00 0.00 175.22 174.48 2fwl s PRO 27 N 1.26 2.97 0.61 0.24 0.04 -1.26 -0.47 135.00 138.40 2fwl s PRO 27 Ca -0.03 1.04 -0.12 0.00 0.04 0.00 0.00 61.00 61.93 2fwl s PRO 27 Cb -0.14 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 2fwl s PRO 27 CO -0.04 -1.08 1.03 -1.25 0.04 0.00 0.00 177.00 175.70 2fwl s PRO 28 N -4.78 3.53 -0.06 0.56 0.04 -1.14 -4.34 135.00 128.81 2fwl s PRO 28 Ca 0.60 0.85 0.01 0.00 0.04 0.00 0.00 61.00 62.50 2fwl s PRO 28 Cb -0.15 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 2fwl s PRO 28 CO 0.50 -0.63 -0.04 1.28 0.04 0.00 0.00 177.00 178.16 2fwl n LEU 29 N -2.57 2.41 -4.66 -3.56 4.77 0.13 -4.80 117.00 108.72 2fwl n LEU 29 Ca 0.07 -0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.60 2fwl n LEU 29 Cb 0.54 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 2fwl n LEU 29 CO 0.55 0.51 1.45 0.00 -1.33 0.00 0.00 177.39 178.57 2fwl s ALA 30 N -2.12 3.61 -0.54 -1.18 0.00 -1.13 -1.66 121.76 118.74 2fwl s ALA 30 Ca -0.07 1.09 -0.01 0.00 0.00 0.00 0.00 51.96 52.97 2fwl s ALA 30 Cb 0.02 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2fwl s ALA 30 CO 0.15 -1.44 0.13 0.41 0.00 0.00 0.00 175.76 175.01 2fwl n GLY 31 N 4.27 0.22 0.00 0.00 0.00 -1.26 -4.85 105.19 103.56 2fwl n GLY 31 Ca 0.18 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2fwl n GLY 31 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2fwl n HIS 32 N -3.77 0.00 -0.25 1.61 -0.00 -0.66 -4.80 115.22 107.34 2fwl n HIS 32 Ca -0.05 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.60 2fwl n HIS 32 Cb 0.55 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.59 2fwl n HIS 32 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2fwl h VAL 33 N 0.00 1.25 -0.47 3.57 2.07 -1.76 -2.34 116.25 118.57 2fwl h VAL 33 Ca 0.00 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 2fwl h VAL 33 Cb 0.00 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 2fwl h VAL 33 CO 0.00 0.32 0.19 0.00 0.02 0.00 0.00 177.57 178.10 2fwl h ALA 34 N 1.12 1.46 -0.69 1.67 0.00 -1.86 0.74 119.26 121.70 2fwl h ALA 34 Ca 0.23 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2fwl h ALA 34 Cb 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2fwl h ALA 34 CO -0.02 0.42 0.35 0.93 0.00 0.00 0.00 179.25 180.94 2fwl h GLU 35 N 0.67 0.96 0.22 0.00 5.08 -1.74 -1.61 114.58 118.16 2fwl h GLU 35 Ca 0.16 -0.11 -0.32 0.00 -1.00 0.00 0.00 59.36 58.09 2fwl h GLU 35 Cb 0.13 -0.19 0.03 0.00 0.50 0.00 0.00 28.75 29.22 2fwl h GLU 35 CO -0.02 0.72 -1.41 0.82 -1.00 0.00 0.00 179.01 178.12 2fwl h ILE 36 N 0.96 1.34 0.00 3.13 2.04 -1.14 -3.25 117.51 120.59 2fwl h ILE 36 Ca 0.24 -2.80 -0.01 0.00 1.00 0.00 0.00 64.86 63.29 2fwl h ILE 36 Cb 0.06 3.01 -0.00 0.00 -0.74 0.00 0.00 36.82 39.15 2fwl h ILE 36 CO -0.04 0.83 -0.05 -0.07 0.00 0.00 0.00 178.15 178.83 2fwl h LEU 37 N 0.13 0.00 0.00 1.44 3.38 -0.55 -0.53 115.31 119.18 2fwl h LEU 37 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2fwl h LEU 37 Cb 2.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.86 2fwl h LEU 37 CO 0.26 0.05 -0.14 0.00 0.09 0.00 0.00 178.44 178.70 2fwl n ALA 38 N -2.24 2.66 -2.43 1.53 0.00 -0.63 -4.79 120.51 114.61 2fwl n ALA 38 Ca -0.02 -0.17 -0.29 0.00 0.00 0.00 0.00 53.44 52.96 2fwl n ALA 38 Cb 0.16 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 2fwl n ALA 38 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2fwl s LYS 39 N -3.00 3.69 -0.54 0.00 -0.14 -0.21 -5.01 119.74 114.53 2fwl s LYS 39 Ca 0.13 0.15 -0.28 0.00 -1.36 0.00 0.00 55.97 54.61 2fwl s LYS 39 Cb 0.18 -2.59 0.01 0.00 -1.68 0.00 0.00 37.83 33.76 2fwl s LYS 39 CO 0.58 0.17 1.46 -1.21 -0.76 0.00 0.00 175.35 175.59 2fwl s GLU 40 N -3.51 3.28 0.00 1.68 2.02 -1.26 -2.14 118.70 118.77 2fwl s GLU 40 Ca 0.46 0.54 0.00 0.00 0.02 0.00 0.00 54.97 55.99 2fwl s GLU 40 Cb -0.11 -4.14 0.00 0.00 0.10 0.00 0.00 34.13 29.99 2fwl s GLU 40 CO 0.29 -1.96 0.00 0.41 0.02 0.00 0.00 175.26 174.02 2fwl n GLY 41 N 5.28 0.87 0.27 -1.39 0.00 -1.26 -4.97 105.19 103.99 2fwl n GLY 41 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 2fwl n GLY 41 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2fwl h GLY 42 N 0.00 0.60 1.54 -0.02 0.00 -1.54 -2.13 103.07 101.51 2fwl h GLY 42 Ca 0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 47.33 46.86 2fwl h GLY 42 CO 0.00 0.34 -0.27 0.07 0.00 0.00 0.00 176.54 176.68 2fwl h ARG 43 N 0.53 0.53 -0.56 4.80 0.11 -1.81 -2.00 114.38 115.98 2fwl h ARG 43 Ca 0.11 -0.21 -0.11 0.00 0.10 0.00 0.00 59.98 59.86 2fwl h ARG 43 Cb 0.38 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.41 2fwl h ARG 43 CO 0.01 0.76 -0.08 0.93 0.10 0.00 0.00 179.97 181.69 2fwl h GLU 44 N 0.46 1.05 -0.83 0.08 3.07 -1.84 -2.81 114.58 113.76 2fwl h GLU 44 Ca 0.06 -0.38 -0.02 0.00 -0.50 0.00 0.00 59.36 58.52 2fwl h GLU 44 Cb 0.72 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.52 2fwl h GLU 44 CO 0.06 1.07 0.43 -0.92 -1.40 0.00 0.00 179.01 178.25 2fwl h TYR 45 N 0.93 1.16 -0.45 4.33 3.20 -1.10 0.09 116.97 125.14 2fwl h TYR 45 Ca 0.15 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.00 2fwl h TYR 45 Cb 0.66 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 2fwl h TYR 45 CO 0.05 0.82 0.30 -0.07 -1.64 0.00 0.00 178.16 177.62 2fwl h LEU 46 N 1.16 0.47 0.15 2.82 3.38 -1.12 0.32 115.31 122.49 2fwl h LEU 46 Ca 0.29 -0.01 -0.25 0.00 0.09 0.00 0.00 57.88 58.00 2fwl h LEU 46 Cb 0.07 -0.11 0.03 0.00 0.09 0.00 0.00 40.66 40.74 2fwl h LEU 46 CO -0.04 0.33 -1.08 0.40 0.09 0.00 0.00 178.44 178.14 2fwl h ILE 47 N 0.54 1.38 -0.63 1.22 2.04 -1.17 -3.15 117.51 117.74 2fwl h ILE 47 Ca 0.17 -2.51 -0.05 0.00 1.00 0.00 0.00 64.86 63.48 2fwl h ILE 47 Cb 0.03 2.97 -0.03 0.00 -0.74 0.00 0.00 36.82 39.05 2fwl h ILE 47 CO -0.04 0.74 0.21 -0.07 0.00 0.00 0.00 178.15 178.99 2fwl h LEU 48 N -0.04 0.88 -0.73 1.44 3.38 -0.42 0.12 115.31 119.94 2fwl h LEU 48 Ca -0.18 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2fwl h LEU 48 Cb 1.82 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.34 2fwl h LEU 48 CO 0.20 0.82 0.00 1.62 0.09 0.00 0.00 178.44 181.17 2fwl h VAL 49 N 0.93 0.00 0.02 1.22 3.04 -0.46 -0.02 116.25 120.98 2fwl h VAL 49 Ca 0.21 -0.30 -0.39 0.00 -1.01 0.00 0.00 66.70 65.21 2fwl h VAL 49 Cb 0.24 1.10 -0.05 0.00 -2.01 0.00 0.00 31.29 30.56 2fwl h VAL 49 CO -0.01 0.00 -2.23 0.18 -1.01 0.00 0.00 177.57 174.50 2fwl n LEU 50 N -2.37 2.44 -0.05 3.16 4.32 -0.64 -2.88 117.00 120.97 2fwl n LEU 50 Ca 0.02 0.15 -0.12 0.00 -0.02 0.00 0.00 56.01 56.05 2fwl n LEU 50 Cb 0.26 -0.93 -0.06 0.00 -1.62 0.00 0.00 43.42 41.07 2fwl n LEU 50 CO 0.22 0.72 0.73 -0.07 -1.22 0.00 0.00 177.39 177.77 2fwl h LEU 51 N -0.44 0.29 0.00 2.23 3.38 -0.76 0.23 115.31 120.25 2fwl h LEU 51 Ca -0.56 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.00 2fwl h LEU 51 Cb 1.75 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 2fwl h LEU 51 CO -0.18 0.56 -0.91 -1.22 0.09 0.00 0.00 178.44 176.78 2fwl n TYR 52 N -4.72 0.00 0.00 1.13 4.01 -0.19 -3.51 117.16 113.89 2fwl n TYR 52 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 2fwl n TYR 52 Cb 0.24 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 2fwl n TYR 52 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2fwl n GLY 53 N 2.52 0.51 3.32 2.72 0.00 -0.21 -3.51 105.19 110.54 2fwl n GLY 53 Ca -0.13 -2.25 -0.15 0.00 0.00 0.00 0.00 46.02 43.49 2fwl n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fwl s LEU 54 N 0.00 0.42 -0.24 0.99 2.96 -1.26 -4.38 118.68 117.18 2fwl s LEU 54 Ca 0.00 0.26 -0.03 0.00 -0.22 0.00 0.00 54.13 54.14 2fwl s LEU 54 Cb 0.00 1.63 0.13 0.00 0.50 0.00 0.00 46.19 48.44 2fwl s LEU 54 CO 0.00 -0.49 0.37 0.00 -1.32 0.00 0.00 176.35 174.91 2fwl s GLN 55 N -1.29 0.34 0.00 1.98 -2.07 -1.20 -0.72 119.66 116.70 2fwl s GLN 55 Ca -0.13 0.58 0.00 0.00 -1.82 0.00 0.00 55.36 53.99 2fwl s GLN 55 Cb -0.04 -0.42 0.00 0.00 -1.09 0.00 0.00 33.01 31.47 2fwl s GLN 55 CO 0.06 -0.60 0.00 0.41 -1.32 0.00 0.00 175.29 173.84 2fwl n GLY 56 N 5.37 1.27 2.33 2.60 0.00 -1.23 -4.76 105.19 110.76 2fwl n GLY 56 Ca -0.04 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 2fwl n GLY 56 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2fwl n GLN 57 N 0.00 1.50 -1.59 1.61 3.00 -1.26 -3.86 117.38 116.79 2fwl n GLN 57 Ca 0.00 -3.80 -0.33 0.00 -0.01 0.00 0.00 57.00 52.86 2fwl n GLN 57 Cb 0.00 -1.69 0.07 0.00 0.00 0.00 0.00 30.24 28.62 2fwl n GLN 57 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.06 178.02 2fwl s ILE 58 N -2.15 2.88 -0.32 5.09 -4.36 -1.25 -4.61 121.20 116.47 2fwl s ILE 58 Ca 0.39 0.41 0.02 0.00 -0.26 0.00 0.00 60.65 61.21 2fwl s ILE 58 Cb 0.22 -2.92 0.10 0.00 1.25 0.00 0.00 42.46 41.10 2fwl s ILE 58 CO -0.08 -0.25 0.06 -0.70 0.24 0.00 0.00 174.94 174.20 2fwl s GLU 59 N -4.08 1.22 -0.33 0.37 2.12 -1.25 -1.01 118.70 115.73 2fwl s GLU 59 Ca 0.69 -1.54 -0.12 0.00 0.36 0.00 0.00 54.97 54.36 2fwl s GLU 59 Cb -0.23 -2.73 -0.02 0.00 0.26 0.00 0.00 34.13 31.41 2fwl s GLU 59 CO 0.44 -0.94 0.23 0.08 -0.54 0.00 0.00 175.26 174.53 2fwl s VAL 60 N 1.19 5.24 -1.76 3.70 1.01 0.36 -4.32 120.40 125.82 2fwl s VAL 60 Ca 0.09 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.88 2fwl s VAL 60 Cb -0.18 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.53 2fwl s VAL 60 CO -0.14 0.02 0.00 0.29 0.00 0.00 0.00 175.10 175.27 2fwl n LYS 61 N 5.09 -1.32 -0.03 2.72 4.76 -1.26 -1.31 118.16 126.81 2fwl n LYS 61 Ca -0.13 1.03 0.00 0.00 -2.87 0.00 0.00 58.31 56.34 2fwl n LYS 61 Cb 0.50 -5.38 0.00 0.00 -1.84 0.00 0.00 35.03 28.31 2fwl n LYS 61 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2fwl n GLY 62 N -0.87 0.49 3.61 0.72 0.00 -1.26 -5.04 105.19 102.83 2fwl n GLY 62 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 2fwl n GLY 62 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2fwl s MET 63 N -0.85 4.01 0.12 1.61 0.00 -0.43 -5.03 119.30 118.73 2fwl s MET 63 Ca 0.00 -0.10 -0.13 0.00 0.00 0.00 0.00 55.69 55.46 2fwl s MET 63 Cb 0.00 -3.63 -0.06 0.00 0.00 0.00 0.00 34.83 31.13 2fwl s MET 63 CO 0.00 -0.19 0.49 0.15 0.00 0.00 0.00 175.02 175.48 2fwl s LYS 64 N 1.79 3.91 0.49 4.11 1.02 -1.26 -0.49 119.74 129.30 2fwl s LYS 64 Ca 0.12 0.38 0.02 0.00 0.02 0.00 0.00 55.97 56.51 2fwl s LYS 64 Cb -0.16 -2.97 -0.02 0.00 -0.52 0.00 0.00 37.83 34.17 2fwl s LYS 64 CO 0.10 0.52 0.01 0.71 -0.92 0.00 0.00 175.35 175.76 2fwl s TYR 65 N -1.42 1.93 -0.48 3.18 2.02 -0.18 -3.69 117.35 118.70 2fwl s TYR 65 Ca 0.36 -0.96 0.06 0.00 -0.37 0.00 0.00 57.07 56.16 2fwl s TYR 65 Cb -0.15 -1.59 0.23 0.00 -0.40 0.00 0.00 41.96 40.06 2fwl s TYR 65 CO 0.19 0.20 0.79 -1.71 -1.57 0.00 0.00 175.55 173.45 2fwl n ASN 66 N -1.23 -2.47 -0.20 2.29 5.15 -1.07 -3.96 115.26 113.77 2fwl n ASN 66 Ca -0.16 -3.12 0.00 0.00 -0.60 0.00 0.00 54.58 50.69 2fwl n ASN 66 Cb 0.67 1.38 0.00 0.00 -0.53 0.00 0.00 39.78 41.30 2fwl n ASN 66 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2fwl n GLY 67 N 1.87 4.85 3.10 8.20 0.00 -1.25 -4.79 105.19 117.17 2fwl n GLY 67 Ca 0.13 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 2fwl n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fwl s VAL 68 N -1.29 -0.01 0.35 1.61 1.01 -1.26 -3.55 120.40 117.26 2fwl s VAL 68 Ca 0.00 0.05 -0.27 0.00 0.00 0.00 0.00 61.98 61.76 2fwl s VAL 68 Cb 0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 36.38 35.93 2fwl s VAL 68 CO 0.00 0.02 1.17 -0.32 0.00 0.00 0.00 175.10 175.97 2fwl s MET 69 N 0.54 4.31 -0.12 2.72 1.75 0.11 -4.92 119.30 123.68 2fwl s MET 69 Ca -0.03 1.89 -0.29 0.00 -1.25 0.00 0.00 55.69 56.00 2fwl s MET 69 Cb -0.05 -2.91 -0.01 0.00 2.84 0.00 0.00 34.83 34.70 2fwl s MET 69 CO -0.03 -0.12 1.08 -1.12 -0.65 0.00 0.00 175.02 174.19 2fwl s SER 70 N -0.94 7.15 -0.76 1.11 0.01 -1.26 -4.37 113.70 114.62 2fwl s SER 70 Ca 0.51 1.58 -0.26 0.00 1.31 0.00 0.00 55.95 59.10 2fwl s SER 70 Cb -0.32 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.33 2fwl s SER 70 CO 0.42 -0.55 1.85 -0.44 0.41 0.00 0.00 173.24 174.93 2fwl s SER 71 N 1.28 5.32 -0.17 2.44 0.01 -1.23 -4.73 113.70 116.61 2fwl s SER 71 Ca 0.50 -0.23 -0.03 0.00 1.31 0.00 0.00 55.95 57.50 2fwl s SER 71 Cb -0.19 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.46 2fwl s SER 71 CO 0.16 -2.47 2.74 0.49 0.41 0.00 0.00 173.24 174.58 2fwl n PHE 72 N 12.93 0.69 0.41 2.43 3.72 0.80 -4.38 117.46 134.06 2fwl n PHE 72 Ca 0.29 -1.59 0.13 0.00 -0.05 0.00 0.00 57.45 56.23 2fwl n PHE 72 Cb 0.50 -1.18 0.47 0.00 -0.94 0.00 0.00 39.48 38.33 2fwl n PHE 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fwl h ALA 73 N 2.26 1.00 0.00 4.37 0.00 -1.76 -2.75 119.26 122.38 2fwl h ALA 73 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2fwl h ALA 73 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2fwl h ALA 73 CO 0.44 0.00 0.00 -0.56 0.00 0.00 0.00 179.25 179.13 2fwl h GLN 74 N 0.00 0.00 -7.02 0.00 -0.00 -1.92 -3.45 115.11 102.73 2fwl h GLN 74 Ca 0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 58.65 58.16 2fwl h GLN 74 Cb 0.59 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 28.08 2fwl h GLN 74 CO 0.00 0.00 0.24 -0.51 -0.00 0.00 0.00 178.83 178.56 2fwl s LEU 75 N -5.77 3.70 0.61 0.06 1.43 -1.04 -5.05 118.68 112.63 2fwl s LEU 75 Ca 0.06 1.31 -0.16 0.00 -1.03 0.00 0.00 54.13 54.31 2fwl s LEU 75 Cb 0.08 -4.23 -0.02 0.00 0.03 0.00 0.00 46.19 42.05 2fwl s LEU 75 CO 0.59 -0.51 1.08 -0.54 0.23 0.00 0.00 176.35 177.20 2fwl s LYS 76 N -4.08 3.15 0.25 1.70 1.02 -1.26 -4.85 119.74 115.67 2fwl s LYS 76 Ca 0.54 1.27 -0.03 0.00 0.02 0.00 0.00 55.97 57.77 2fwl s LYS 76 Cb -0.10 -2.01 0.42 0.00 -0.52 0.00 0.00 37.83 35.62 2fwl s LYS 76 CO 0.34 -0.96 1.82 -0.44 -0.92 0.00 0.00 175.35 175.20 2fwl h ASP 77 N 0.32 0.76 -0.61 2.83 3.32 -1.95 -0.73 116.42 120.37 2fwl h ASP 77 Ca -0.47 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 56.58 2fwl h ASP 77 Cb 1.23 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.64 2fwl h ASP 77 CO 0.56 0.44 0.23 -0.33 -1.72 0.00 0.00 179.24 178.42 2fwl h GLU 78 N 0.87 0.96 -0.27 3.56 5.08 -1.92 -1.64 114.58 121.23 2fwl h GLU 78 Ca 0.42 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.55 2fwl h GLU 78 Cb 0.35 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2fwl h GLU 78 CO -0.24 0.80 -0.05 0.93 -1.00 0.00 0.00 179.01 179.46 2fwl h GLU 79 N 0.94 0.51 -0.74 2.33 5.08 -1.55 0.72 114.58 121.86 2fwl h GLU 79 Ca 0.21 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2fwl h GLU 79 Cb 0.22 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 2fwl h GLU 79 CO -0.01 0.71 0.47 0.82 -1.00 0.00 0.00 179.01 179.99 2fwl h ILE 80 N 0.27 1.20 -0.20 3.13 2.04 -1.01 -0.90 117.51 122.05 2fwl h ILE 80 Ca 0.07 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.38 2fwl h ILE 80 Cb 0.51 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2fwl h ILE 80 CO 0.02 0.20 -0.48 0.00 0.00 0.00 0.00 178.15 177.89 2fwl h ALA 81 N 1.25 0.80 -0.30 1.87 0.00 -1.20 -2.81 119.26 118.87 2fwl h ALA 81 Ca 0.27 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2fwl h ALA 81 Cb -0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2fwl h ALA 81 CO -0.05 0.67 0.13 0.00 0.00 0.00 0.00 179.25 179.99 2fwl h ALA 82 N 1.06 0.39 -0.30 0.00 0.00 -0.20 -0.61 119.26 119.60 2fwl h ALA 82 Ca 0.02 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2fwl h ALA 82 Cb 1.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2fwl h ALA 82 CO 0.09 -0.03 -0.17 -0.24 0.00 0.00 0.00 179.25 178.89 2fwl h VAL 83 N 0.34 1.25 -0.34 0.00 3.04 -1.19 0.34 116.25 119.69 2fwl h VAL 83 Ca 0.10 -1.14 -0.05 0.00 -1.01 0.00 0.00 66.70 64.60 2fwl h VAL 83 Cb 0.15 1.21 -0.01 0.00 -2.01 0.00 0.00 31.29 30.63 2fwl h VAL 83 CO -0.01 0.37 0.04 -0.07 -1.01 0.00 0.00 177.57 176.89 2fwl h LEU 84 N 0.48 0.56 -0.68 3.16 3.38 -1.22 -0.19 115.31 120.81 2fwl h LEU 84 Ca 0.08 -0.28 -0.10 0.00 0.09 0.00 0.00 57.88 57.68 2fwl h LEU 84 Cb 0.58 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2fwl h LEU 84 CO 0.04 0.70 -0.04 0.78 0.09 0.00 0.00 178.44 180.00 2fwl h ASN 85 N 0.40 0.96 0.06 -0.43 2.35 -0.89 -2.18 115.58 115.85 2fwl h ASN 85 Ca 0.10 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2fwl h ASN 85 Cb 0.39 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2fwl h ASN 85 CO 0.01 1.04 -0.03 -0.74 -1.65 0.00 0.00 177.43 176.06 2fwl h HIS 86 N 0.89 -0.08 -0.70 1.19 2.76 -0.68 -2.26 115.15 116.28 2fwl h HIS 86 Ca 0.15 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.26 2fwl h HIS 86 Cb 0.58 0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.53 2fwl h HIS 86 CO 0.04 0.13 0.18 -0.84 -1.30 0.00 0.00 177.93 176.13 2fwl h ILE 87 N -0.27 1.26 -0.49 6.26 3.07 -1.01 0.29 117.51 126.63 2fwl h ILE 87 Ca -0.01 -0.95 -0.05 0.00 1.55 0.00 0.00 64.86 65.40 2fwl h ILE 87 Cb 0.24 0.53 -0.02 0.00 -0.27 0.00 0.00 36.82 37.30 2fwl h ILE 87 CO 0.01 0.37 0.11 0.00 -1.05 0.00 0.00 178.15 177.59 2fwl h ALA 88 N 1.13 1.28 0.00 0.16 0.00 -1.35 -2.78 119.26 117.70 2fwl h ALA 88 Ca 0.22 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2fwl h ALA 88 Cb 0.36 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2fwl h ALA 88 CO 0.00 0.50 -1.18 1.79 0.00 0.00 0.00 179.25 180.36 2fwl h THR 89 N 0.72 0.33 0.37 0.00 1.35 -1.13 -0.58 112.91 113.96 2fwl h THR 89 Ca 0.16 -1.63 -0.02 0.00 -0.55 0.00 0.00 66.41 64.37 2fwl h THR 89 Cb 0.28 1.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 2fwl h THR 89 CO -0.00 0.19 -0.18 0.00 -0.25 0.00 0.00 175.52 175.28 2fwl h ALA 90 N 1.64 -0.49 -0.00 6.62 0.00 -0.15 -2.83 119.26 124.04 2fwl h ALA 90 Ca -0.09 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2fwl h ALA 90 Cb 1.35 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2fwl h ALA 90 CO 0.03 -0.74 -0.27 0.91 0.00 0.00 0.00 179.25 179.18 2fwl n TRP 91 N -5.27 0.00 -1.06 0.00 8.01 -1.14 -4.92 117.44 113.06 2fwl n TRP 91 Ca -0.11 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.06 2fwl n TRP 91 Cb 0.23 -0.29 -0.01 0.00 -2.01 0.00 0.00 31.31 29.24 2fwl n TRP 91 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2fwl n GLY 92 N 1.44 0.55 0.24 6.99 0.00 -1.07 -4.91 105.19 108.43 2fwl n GLY 92 Ca 0.08 -0.76 0.09 0.00 0.00 0.00 0.00 46.02 45.43 2fwl n GLY 92 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2fwl h ASP 93 N 0.00 0.00 0.51 1.61 5.19 -1.54 -1.03 116.42 121.16 2fwl h ASP 93 Ca -0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 2fwl h ASP 93 Cb 0.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 2fwl h ASP 93 CO 0.06 0.19 0.00 0.00 -3.12 0.00 0.00 179.24 176.38 2fwl n ALA 94 N -2.36 2.00 0.92 3.45 0.00 -0.34 -2.11 120.51 122.07 2fwl n ALA 94 Ca -0.02 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.46 2fwl n ALA 94 Cb 0.29 -1.33 0.17 0.00 0.00 0.00 0.00 19.45 18.59 2fwl n ALA 94 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2fwl n LYS 95 N -1.38 2.28 -0.36 0.00 5.02 -0.39 -4.00 118.16 119.34 2fwl n LYS 95 Ca 0.08 -1.88 0.10 0.00 -2.02 0.00 0.00 58.31 54.58 2fwl n LYS 95 Cb 0.19 -1.47 0.28 0.00 -0.02 0.00 0.00 35.03 34.01 2fwl n LYS 95 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2fwl n LYS 96 N 1.23 2.94 -4.37 1.97 5.02 -0.90 -4.95 118.16 119.11 2fwl n LYS 96 Ca 0.16 -2.53 -0.20 0.00 -2.02 0.00 0.00 58.31 53.72 2fwl n LYS 96 Cb 0.57 -1.54 -0.10 0.00 -0.02 0.00 0.00 35.03 33.94 2fwl n LYS 96 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2fwl s VAL 97 N -1.19 1.89 -0.38 -0.18 -7.23 -1.26 -5.04 120.40 107.01 2fwl s VAL 97 Ca 0.42 -2.24 -0.19 0.00 -1.81 0.00 0.00 61.98 58.16 2fwl s VAL 97 Cb 0.23 -2.09 0.01 0.00 0.56 0.00 0.00 36.38 35.09 2fwl s VAL 97 CO 0.26 -0.54 0.56 -1.59 -0.31 0.00 0.00 175.10 173.48 2fwl s LYS 98 N -3.58 3.47 -0.40 4.82 -2.85 -1.26 -4.47 119.74 115.48 2fwl s LYS 98 Ca 0.24 -0.26 -0.01 0.00 -1.00 0.00 0.00 55.97 54.94 2fwl s LYS 98 Cb -0.02 -3.87 -0.01 0.00 -2.06 0.00 0.00 37.83 31.88 2fwl s LYS 98 CO 0.08 -0.79 0.37 0.41 0.10 0.00 0.00 175.35 175.53 2fwl n GLY 99 N 4.88 -0.66 3.69 0.59 0.00 -1.26 -4.96 105.19 107.47 2fwl n GLY 99 Ca -0.04 0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2fwl n GLY 99 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2fwl s PHE 100 N -3.03 2.99 -0.31 1.61 5.36 -1.26 -5.00 117.98 118.33 2fwl s PHE 100 Ca 0.04 1.00 -0.13 0.00 -0.96 0.00 0.00 56.93 56.88 2fwl s PHE 100 Cb -0.01 -3.54 -0.03 0.00 -0.34 0.00 0.00 43.02 39.10 2fwl s PHE 100 CO 0.37 -1.89 0.27 0.15 -1.46 0.00 0.00 175.22 172.66 2fwl s LYS 101 N 2.43 3.74 0.43 10.12 1.02 -1.26 -5.06 119.74 131.16 2fwl s LYS 101 Ca 0.60 -0.38 -0.26 0.00 0.02 0.00 0.00 55.97 55.95 2fwl s LYS 101 Cb -0.28 -3.74 -0.09 0.00 -0.52 0.00 0.00 37.83 33.21 2fwl s LYS 101 CO 0.23 -0.35 1.44 -2.30 -0.92 0.00 0.00 175.35 173.45 2fwl n PRO 102 N 5.19 2.36 -2.19 -1.68 -0.02 -1.26 -4.92 135.00 132.49 2fwl n PRO 102 Ca -0.12 0.84 -0.42 0.00 -2.02 0.00 0.00 63.50 61.78 2fwl n PRO 102 Cb 0.51 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.33 2fwl n PRO 102 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2fwl s PHE 103 N -1.17 2.94 0.13 6.00 0.40 -1.26 -5.02 117.98 120.01 2fwl s PHE 103 Ca 0.59 0.83 0.06 0.00 -0.60 0.00 0.00 56.93 57.80 2fwl s PHE 103 Cb -0.46 -3.69 -0.04 0.00 0.51 0.00 0.00 43.02 39.34 2fwl s PHE 103 CO 0.60 -2.52 0.02 0.95 0.70 0.00 0.00 175.22 174.96 2fwl s THR 104 N 2.02 3.97 0.60 0.64 -4.23 -1.26 -4.75 115.64 112.63 2fwl s THR 104 Ca 0.65 -1.17 0.31 0.00 -1.18 0.00 0.00 61.69 60.30 2fwl s THR 104 Cb -0.34 -2.95 0.37 0.00 1.34 0.00 0.00 72.50 70.92 2fwl s THR 104 CO 0.28 -0.00 2.18 0.00 -0.54 0.00 0.00 174.62 176.54 2fwl h ALA 105 N 3.00 1.58 -0.64 3.99 0.00 -1.93 -1.49 119.26 123.77 2fwl h ALA 105 Ca -0.47 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2fwl h ALA 105 Cb 1.18 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2fwl h ALA 105 CO 0.59 -0.16 0.38 0.93 0.00 0.00 0.00 179.25 181.00 2fwl h GLU 106 N 0.00 0.88 0.00 0.00 4.39 -1.94 0.70 114.58 118.61 2fwl h GLU 106 Ca 0.04 -0.08 -0.09 0.00 0.34 0.00 0.00 59.36 59.57 2fwl h GLU 106 Cb 0.27 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2fwl h GLU 106 CO -0.00 0.63 -0.42 0.93 -1.16 0.00 0.00 179.01 178.99 2fwl h GLU 107 N 0.87 0.00 0.06 2.33 5.08 -1.68 -2.02 114.58 119.23 2fwl h GLU 107 Ca 0.23 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.32 2fwl h GLU 107 Cb -0.02 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.26 2fwl h GLU 107 CO -0.04 0.42 -1.10 0.28 -1.00 0.00 0.00 179.01 177.57 2fwl h VAL 108 N 0.00 1.30 -0.48 3.13 2.07 -1.35 -3.22 116.25 117.70 2fwl h VAL 108 Ca -0.00 -2.34 -0.02 0.00 0.82 0.00 0.00 66.70 65.15 2fwl h VAL 108 Cb 0.76 2.58 -0.02 0.00 -1.52 0.00 0.00 31.29 33.09 2fwl h VAL 108 CO 0.05 0.71 0.20 0.50 0.02 0.00 0.00 177.57 179.06 2fwl h LYS 109 N 0.27 0.70 -0.20 1.57 1.63 -0.68 0.84 116.57 120.71 2fwl h LYS 109 Ca -0.16 -0.12 -0.00 0.00 -0.85 0.00 0.00 60.65 59.52 2fwl h LYS 109 Cb 1.77 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 33.27 2fwl h LYS 109 CO 0.21 0.62 0.10 1.57 -3.45 0.00 0.00 179.45 178.51 2fwl h LYS 110 N 0.63 0.26 0.01 1.90 2.10 -1.46 -1.78 116.57 118.22 2fwl h LYS 110 Ca 0.16 -0.02 -0.28 0.00 -2.00 0.00 0.00 60.65 58.52 2fwl h LYS 110 Cb 0.17 -0.06 -0.04 0.00 -0.90 0.00 0.00 32.23 31.40 2fwl h LYS 110 CO -0.02 0.20 -1.54 -0.07 -2.00 0.00 0.00 179.45 176.02 2fwl h LEU 111 N 0.27 0.03 -1.27 7.07 3.38 -1.49 -3.31 115.31 120.00 2fwl h LEU 111 Ca 0.07 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 2fwl h LEU 111 Cb 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2fwl h LEU 111 CO -0.01 1.04 -0.30 -0.09 0.09 0.00 0.00 178.44 179.17 2fwl h ARG 112 N 0.00 0.11 0.00 1.13 2.43 -0.28 -2.35 114.38 115.43 2fwl h ARG 112 Ca -0.22 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 58.79 2fwl h ARG 112 Cb 1.96 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 31.48 2fwl h ARG 112 CO 0.09 0.41 -0.57 0.00 -1.51 0.00 0.00 179.97 178.39 2fwl h ALA 113 N 1.60 1.05 -1.84 2.80 0.00 -1.45 -3.38 119.26 118.04 2fwl h ALA 113 Ca 0.01 -0.52 -0.67 0.00 0.00 0.00 0.00 54.91 53.73 2fwl h ALA 113 Cb 0.58 -0.09 -0.17 0.00 0.00 0.00 0.00 17.79 18.11 2fwl h ALA 113 CO 0.04 0.72 0.76 0.21 0.00 0.00 0.00 179.25 180.97 2fwl s LYS 114 N -3.72 3.47 -0.20 0.00 2.20 -0.88 -4.99 119.74 115.61 2fwl s LYS 114 Ca -0.02 -1.52 -0.29 0.00 -0.36 0.00 0.00 55.97 53.79 2fwl s LYS 114 Cb 0.13 -4.75 -0.04 0.00 -1.51 0.00 0.00 37.83 31.66 2fwl s LYS 114 CO 0.76 -1.78 1.82 0.21 -0.36 0.00 0.00 175.35 175.99 2fwl s LYS 115 N 3.05 3.62 0.23 4.03 2.47 -1.26 -4.94 119.74 126.95 2fwl s LYS 115 Ca 0.30 1.83 0.01 0.00 -1.56 0.00 0.00 55.97 56.55 2fwl s LYS 115 Cb -0.08 -4.15 -0.00 0.00 -1.46 0.00 0.00 37.83 32.13 2fwl s LYS 115 CO -0.04 -1.52 0.05 1.28 0.16 0.00 0.00 175.35 175.28 2fwl n LEU 116 N 9.32 0.00 -4.14 5.43 4.77 -1.26 -5.17 117.00 125.95 2fwl n LEU 116 Ca 0.22 -1.64 -0.18 0.00 -0.03 0.00 0.00 56.01 54.38 2fwl n LEU 116 Cb 0.45 0.41 -0.13 0.00 -2.33 0.00 0.00 43.42 41.82 2fwl n LEU 116 CO 0.66 -0.25 -0.45 0.42 -1.33 0.00 0.00 177.39 176.44 2fwl s THR 117 N -2.20 1.03 0.57 -5.08 -4.23 -1.26 -4.99 115.64 99.49 2fwl s THR 117 Ca 0.07 -1.12 0.26 0.00 -1.18 0.00 0.00 61.69 59.72 2fwl s THR 117 Cb 0.00 -0.98 0.35 0.00 1.34 0.00 0.00 72.50 73.21 2fwl s THR 117 CO 0.05 -0.14 2.14 -0.65 -0.54 0.00 0.00 174.62 175.48 2fwl h PRO 118 N 4.63 0.00 0.00 3.99 0.11 -1.81 -0.07 132.00 138.85 2fwl h PRO 118 Ca -0.39 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.60 2fwl h PRO 118 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2fwl h PRO 118 CO 0.42 0.00 -0.56 0.37 -0.21 0.00 0.00 178.00 178.02 2fwl h GLN 119 N 0.00 0.00 0.08 1.05 5.75 -1.86 -2.91 115.11 117.22 2fwl h GLN 119 Ca 0.06 0.00 -0.25 0.00 -0.15 0.00 0.00 58.65 58.31 2fwl h GLN 119 Cb 0.32 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 2fwl h GLN 119 CO -0.00 0.56 -1.15 1.96 -2.65 0.00 0.00 178.83 177.55 2fwl h GLN 120 N 0.00 0.16 0.00 1.69 4.20 -1.42 -3.21 115.11 116.54 2fwl h GLN 120 Ca -0.01 -0.28 -0.02 0.00 0.06 0.00 0.00 58.65 58.40 2fwl h GLN 120 Cb 1.00 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.88 2fwl h GLN 120 CO 0.07 1.13 -0.09 0.28 -0.67 0.00 0.00 178.83 179.55 2fwl h VAL 121 N 0.04 0.64 -0.95 -0.54 2.07 -1.21 -2.01 116.25 114.29 2fwl h VAL 121 Ca -0.09 -0.38 0.06 0.00 0.82 0.00 0.00 66.70 67.12 2fwl h VAL 121 Cb 1.89 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 32.83 2fwl h VAL 121 CO 0.17 0.09 0.61 0.25 0.02 0.00 0.00 177.57 178.71 2fwl h LEU 122 N 0.00 0.97 -0.27 2.57 5.85 -1.51 0.31 115.31 123.23 2fwl h LEU 122 Ca -0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 2fwl h LEU 122 Cb 0.23 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2fwl h LEU 122 CO 0.01 0.62 -0.10 0.00 -0.34 0.00 0.00 178.44 178.64 2fwl h ALA 123 N 1.43 0.37 -0.96 1.25 0.00 -1.53 -1.91 119.26 117.92 2fwl h ALA 123 Ca 0.41 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 55.07 2fwl h ALA 123 Cb 0.15 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 2fwl h ALA 123 CO -0.17 0.22 0.62 0.93 0.00 0.00 0.00 179.25 180.85 2fwl h GLU 124 N 0.28 1.14 -0.25 0.00 4.39 -1.29 0.17 114.58 119.02 2fwl h GLU 124 Ca 0.06 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2fwl h GLU 124 Cb 0.59 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2fwl h GLU 124 CO 0.03 0.75 0.04 -0.09 -1.16 0.00 0.00 179.01 178.58 2fwl h ARG 125 N 1.17 0.42 0.00 2.33 2.43 -0.85 -2.81 114.38 117.08 2fwl h ARG 125 Ca 0.39 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 59.39 2fwl h ARG 125 Cb 0.07 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2fwl h ARG 125 CO -0.14 0.55 -0.30 0.87 -1.51 0.00 0.00 179.97 179.44 2fwl h LYS 126 N 0.23 0.00 0.00 0.20 1.57 -0.71 -2.14 116.57 115.72 2fwl h LYS 126 Ca 0.08 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2fwl h LYS 126 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2fwl h LYS 126 CO 0.01 0.30 -0.26 0.87 -0.57 0.00 0.00 179.45 179.79 2fwl h LYS 127 N 0.00 0.00 0.00 3.15 1.57 -0.43 -0.69 116.57 120.17 2fwl h LYS 127 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2fwl h LYS 127 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2fwl h LYS 127 CO 0.04 0.26 0.00 1.28 -0.57 0.00 0.00 179.45 180.46 2fwl n LEU 128 N -4.18 0.00 0.00 2.94 4.77 -0.83 -4.85 117.00 114.86 2fwl n LEU 128 Ca -0.02 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2fwl n LEU 128 Cb 0.32 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2fwl n LEU 128 CO 0.37 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2fwl n GLY 129 N 0.90 0.45 3.61 -0.72 0.00 -0.26 -5.04 105.19 104.12 2fwl n GLY 129 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2fwl n GLY 129 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fwl s LEU 130 N 0.00 3.80 0.00 0.99 1.43 -1.08 -4.99 118.68 118.84 2fwl s LEU 130 Ca 0.00 0.59 0.11 0.00 -1.03 0.00 0.00 54.13 53.80 2fwl s LEU 130 Cb 0.00 -3.47 0.68 0.00 0.03 0.00 0.00 46.19 43.43 2fwl s LEU 130 CO 0.00 -1.08 1.11 0.29 0.23 0.00 0.00 176.35 176.90