#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 1.04 1.49 6.12 0.00 -1.92 -2.23 103.07 107.57 2fwl h GLY 4 Ca 0.00 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 46.84 2fwl h GLY 4 CO 0.00 0.39 -0.20 0.00 0.00 0.00 0.00 176.54 176.73 2fwl h ALA 5 N 1.52 1.05 -0.30 3.60 0.00 -1.96 -1.71 119.26 121.47 2fwl h ALA 5 Ca 0.27 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2fwl h ALA 5 Cb -0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2fwl h ALA 5 CO -0.06 0.57 -0.16 -0.22 0.00 0.00 0.00 179.25 179.39 2fwl h LYS 6 N 0.53 0.53 -0.15 0.00 3.11 -1.87 -2.67 116.57 116.06 2fwl h LYS 6 Ca 0.08 -0.17 -0.20 0.00 -2.81 0.00 0.00 60.65 57.55 2fwl h LYS 6 Cb 0.64 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 31.83 2fwl h LYS 6 CO 0.05 0.67 -0.72 0.82 -2.81 0.00 0.00 179.45 177.46 2fwl h ILE 7 N 0.48 1.31 0.00 2.00 1.08 -1.16 -3.00 117.51 118.23 2fwl h ILE 7 Ca 0.08 -1.98 -0.01 0.00 -0.39 0.00 0.00 64.86 62.57 2fwl h ILE 7 Cb 0.55 1.96 -0.00 0.00 -3.07 0.00 0.00 36.82 36.27 2fwl h ILE 7 CO 0.04 0.62 -0.03 0.22 -0.69 0.00 0.00 178.15 178.31 2fwl h TYR 8 N 0.46 0.00 -0.36 1.37 3.20 -1.02 -1.97 116.97 118.65 2fwl h TYR 8 Ca -0.03 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.90 2fwl h TYR 8 Cb 1.32 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.57 2fwl h TYR 8 CO 0.07 0.03 0.25 0.00 -1.64 0.00 0.00 178.16 176.86 2fwl h ALA 9 N 1.97 2.05 0.02 1.82 0.00 -1.33 0.36 119.26 124.14 2fwl h ALA 9 Ca -0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 2fwl h ALA 9 Cb 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2fwl h ALA 9 CO 0.00 -0.12 -0.94 1.96 0.00 0.00 0.00 179.25 180.15 2fwl h GLN 10 N 0.23 0.14 0.00 0.00 4.20 -1.53 -3.12 115.11 115.03 2fwl h GLN 10 Ca 0.16 -0.18 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 2fwl h GLN 10 Cb 0.35 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 2fwl h GLN 10 CO -0.03 0.98 -0.51 0.00 -0.67 0.00 0.00 178.83 178.60 2fwl h ALA 12 N 1.49 1.00 0.00 0.00 0.00 -0.98 0.23 119.26 121.01 2fwl h ALA 12 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fwl h ALA 12 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2fwl h ALA 12 CO 0.07 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.73 2fwl n GLY 13 N -0.45 -0.82 2.02 0.00 0.00 -1.01 -2.85 105.19 102.08 2fwl n GLY 13 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2fwl n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fwl n HIS 15 N -2.61 0.21 -4.93 0.00 8.25 0.77 -4.55 115.22 112.35 2fwl n HIS 15 Ca 0.00 -0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 2fwl n HIS 15 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 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 0.02 0.00 0.00 -0.41 1.13 -1.13 -2.65 117.38 114.33 2fwl n GLN 16 Ca 0.12 0.00 0.08 0.00 -1.94 0.00 0.00 57.00 55.26 2fwl n GLN 16 Cb 0.21 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.54 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 -1.52 1.58 0.00 -1.09 6.02 -1.26 -3.96 117.38 117.15 2fwl n GLN 17 Ca 0.00 -0.71 0.15 0.00 -0.01 0.00 0.00 57.00 56.42 2fwl n GLN 17 Cb 0.00 -1.31 0.69 0.00 1.02 0.00 0.00 30.24 30.64 2fwl n GLN 17 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2fwl n ASN 18 N -0.31 0.29 -0.32 1.08 0.23 -1.26 -4.89 115.26 110.08 2fwl n ASN 18 Ca 0.07 -0.50 -0.04 0.00 -0.53 0.00 0.00 54.58 53.58 2fwl n ASN 18 Cb 0.35 -0.13 -0.02 0.00 -2.08 0.00 0.00 39.78 37.90 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 1.25 0.70 0.00 4.83 0.00 -1.25 -4.86 105.19 105.86 2fwl n GLY 19 Ca 0.15 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.81 0.00 0.00 1.61 6.02 -1.14 -0.38 117.38 120.67 2fwl n GLN 20 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2fwl n GLN 20 Cb 0.14 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.40 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 3.30 0.27 2.89 1.08 0.00 -1.09 -3.85 105.19 107.80 2fwl n GLY 21 Ca 0.00 -1.32 -0.28 0.00 0.00 0.00 0.00 46.02 44.42 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 1.08 -0.56 -0.61 -1.09 -1.25 -4.93 121.20 113.84 2fwl s ILE 22 Ca 0.00 -0.57 -0.26 0.00 -2.23 0.00 0.00 60.65 57.58 2fwl s ILE 22 Cb 0.00 -1.24 -0.09 0.00 -1.58 0.00 0.00 42.46 39.55 2fwl s ILE 22 CO 0.00 0.16 2.45 -2.65 -1.23 0.00 0.00 174.94 173.67 2fwl n PRO 23 N 4.89 0.90 0.00 2.79 -0.02 -1.26 -0.42 135.00 141.87 2fwl n PRO 23 Ca -0.12 -0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 2fwl n PRO 23 Cb 0.48 -3.25 0.00 0.00 -0.02 0.00 0.00 33.50 30.71 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 6.10 1.51 0.00 -1.23 0.00 -1.26 -4.87 105.19 105.45 2fwl n GLY 24 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 0.00 1.92 -3.70 4.61 0.00 0.40 -0.60 120.51 123.14 2fwl n ALA 25 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 2fwl n ALA 25 Cb 0.00 0.32 -0.17 0.00 0.00 0.00 0.00 19.45 19.60 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 -1.78 0.55 0.15 0.00 0.08 0.44 -4.48 117.98 112.94 2fwl s PHE 26 Ca 0.00 -0.11 -0.30 0.00 0.12 0.00 0.00 56.93 56.64 2fwl s PHE 26 Cb 0.00 -0.61 -0.07 0.00 -0.57 0.00 0.00 43.02 41.77 2fwl s PHE 26 CO 0.00 -0.21 1.10 -1.25 -0.10 0.00 0.00 175.22 174.76 2fwl s PRO 27 N 1.33 4.57 0.52 0.24 0.04 -1.26 -3.85 135.00 136.59 2fwl s PRO 27 Ca -0.05 1.70 -0.21 0.00 0.04 0.00 0.00 61.00 62.48 2fwl s PRO 27 Cb -0.13 -3.30 -0.06 0.00 0.04 0.00 0.00 34.50 31.05 2fwl s PRO 27 CO -0.02 0.03 1.19 -2.14 0.04 0.00 0.00 177.00 176.10 2fwl s PRO 28 N -0.10 3.42 -0.22 0.56 0.02 -1.25 -4.85 135.00 132.57 2fwl s PRO 28 Ca 0.51 1.81 -0.00 0.00 0.02 0.00 0.00 61.00 63.33 2fwl s PRO 28 Cb -0.29 -2.19 -0.20 0.00 0.02 0.00 0.00 34.50 31.84 2fwl s PRO 28 CO 0.34 -0.84 -0.05 1.28 -0.33 0.00 0.00 177.00 177.39 2fwl n LEU 29 N -0.98 2.85 -4.64 -5.54 4.77 0.49 -4.58 117.00 109.36 2fwl n LEU 29 Ca 0.10 -0.04 -0.43 0.00 -0.03 0.00 0.00 56.01 55.62 2fwl n LEU 29 Cb 0.49 -0.95 -0.03 0.00 -2.33 0.00 0.00 43.42 40.60 2fwl n LEU 29 CO 0.46 0.91 1.42 0.00 -1.33 0.00 0.00 177.39 178.86 2fwl s ALA 30 N -2.53 3.36 0.00 -1.18 0.00 -1.07 -1.63 121.76 118.71 2fwl s ALA 30 Ca -0.31 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.35 2fwl s ALA 30 Cb 0.08 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.37 2fwl s ALA 30 CO 0.65 -1.82 0.00 0.41 0.00 0.00 0.00 175.76 175.00 2fwl n GLY 31 N 4.57 0.44 0.00 0.00 0.00 -1.26 -4.87 105.19 104.07 2fwl n GLY 31 Ca 0.19 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.82 0.00 -0.21 1.61 -0.00 -0.74 -4.82 115.22 107.23 2fwl n HIS 32 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.65 2fwl n HIS 32 Cb 0.45 0.00 0.03 0.00 -0.00 0.00 0.00 29.99 30.47 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 1.21 -0.53 3.57 2.07 -1.60 -2.49 116.25 118.49 2fwl h VAL 33 Ca 0.00 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 2fwl h VAL 33 Cb 0.00 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2fwl h VAL 33 CO 0.00 0.24 0.24 0.00 0.02 0.00 0.00 177.57 178.08 2fwl h ALA 34 N 1.11 1.44 -0.60 1.67 0.00 -1.84 0.19 119.26 121.22 2fwl h ALA 34 Ca 0.20 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2fwl h ALA 34 Cb 0.13 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2fwl h ALA 34 CO -0.02 0.44 0.19 0.93 0.00 0.00 0.00 179.25 180.78 2fwl h GLU 35 N 0.74 0.91 0.24 0.00 5.08 -1.77 -2.09 114.58 117.69 2fwl h GLU 35 Ca 0.18 -0.17 -0.33 0.00 -1.00 0.00 0.00 59.36 58.04 2fwl h GLU 35 Cb 0.10 -0.14 0.03 0.00 0.50 0.00 0.00 28.75 29.24 2fwl h GLU 35 CO -0.02 0.79 -1.47 0.82 -1.00 0.00 0.00 179.01 178.13 2fwl h ILE 36 N 0.88 1.30 0.00 3.13 2.04 -1.08 -3.27 117.51 120.51 2fwl h ILE 36 Ca 0.20 -2.74 -0.01 0.00 1.00 0.00 0.00 64.86 63.31 2fwl h ILE 36 Cb 0.26 3.03 -0.00 0.00 -0.74 0.00 0.00 36.82 39.36 2fwl h ILE 36 CO -0.01 0.82 -0.05 -0.07 0.00 0.00 0.00 178.15 178.85 2fwl h LEU 37 N 0.14 0.00 -0.09 1.44 3.38 -0.48 -0.42 115.31 119.28 2fwl h LEU 37 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2fwl h LEU 37 Cb 2.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.90 2fwl h LEU 37 CO 0.27 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.84 2fwl n ALA 38 N -2.31 2.20 -2.23 1.53 0.00 -0.80 -4.71 120.51 114.18 2fwl n ALA 38 Ca -0.03 -0.02 -0.31 0.00 0.00 0.00 0.00 53.44 53.08 2fwl n ALA 38 Cb 0.14 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.09 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 -3.11 3.87 -0.26 0.00 -0.14 -0.17 -4.99 119.74 114.94 2fwl s LYS 39 Ca 0.10 0.49 -0.29 0.00 -1.36 0.00 0.00 55.97 54.92 2fwl s LYS 39 Cb 0.13 -2.47 -0.03 0.00 -1.68 0.00 0.00 37.83 33.78 2fwl s LYS 39 CO 0.55 0.13 1.82 -1.21 -0.76 0.00 0.00 175.35 175.88 2fwl s GLU 40 N -3.27 3.48 0.00 1.68 2.02 -1.26 -1.15 118.70 120.20 2fwl s GLU 40 Ca 0.51 1.65 0.00 0.00 0.02 0.00 0.00 54.97 57.15 2fwl s GLU 40 Cb -0.10 -4.18 0.00 0.00 0.10 0.00 0.00 34.13 29.95 2fwl s GLU 40 CO 0.23 -1.68 0.00 0.41 0.02 0.00 0.00 175.26 174.24 2fwl n GLY 41 N 5.21 0.53 0.36 -1.39 0.00 -1.26 -4.94 105.19 103.70 2fwl n GLY 41 Ca 0.23 -0.43 -0.03 0.00 0.00 0.00 0.00 46.02 45.78 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 1.29 1.44 -0.02 0.00 -1.25 -1.08 103.07 103.45 2fwl h GLY 42 Ca 0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 47.33 46.67 2fwl h GLY 42 CO 0.00 0.56 -0.03 0.07 0.00 0.00 0.00 176.54 177.14 2fwl h ARG 43 N 1.21 0.69 -0.51 4.80 0.11 -1.80 -1.67 114.38 117.22 2fwl h ARG 43 Ca 0.31 -0.18 -0.12 0.00 0.10 0.00 0.00 59.98 60.08 2fwl h ARG 43 Cb 0.03 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.01 2fwl h ARG 43 CO -0.05 0.73 -0.16 0.93 0.10 0.00 0.00 179.97 181.51 2fwl h GLU 44 N 0.64 1.00 -0.58 0.08 3.07 -1.81 -2.45 114.58 114.53 2fwl h GLU 44 Ca 0.13 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.59 2fwl h GLU 44 Cb 0.44 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.28 2fwl h GLU 44 CO 0.02 1.07 0.38 -0.92 -1.40 0.00 0.00 179.01 178.16 2fwl h TYR 45 N 0.87 0.74 -0.93 4.33 3.20 -0.75 -1.16 116.97 123.28 2fwl h TYR 45 Ca 0.12 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 2fwl h TYR 45 Cb 0.73 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.71 2fwl h TYR 45 CO 0.05 0.47 0.57 -0.07 -1.64 0.00 0.00 178.16 177.54 2fwl h LEU 46 N 0.79 1.10 -0.55 2.82 3.38 -1.13 -1.41 115.31 120.31 2fwl h LEU 46 Ca 0.21 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 2fwl h LEU 46 Cb -0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 2fwl h LEU 46 CO -0.04 0.84 0.11 0.40 0.09 0.00 0.00 178.44 179.83 2fwl h ILE 47 N 1.27 1.25 -0.47 1.22 2.04 -0.94 -2.58 117.51 119.30 2fwl h ILE 47 Ca 0.33 -0.92 -0.03 0.00 1.00 0.00 0.00 64.86 65.25 2fwl h ILE 47 Cb -0.08 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2fwl h ILE 47 CO -0.07 0.34 0.19 -0.07 0.00 0.00 0.00 178.15 178.54 2fwl h LEU 48 N 0.79 0.61 -1.13 1.44 3.38 -0.68 0.14 115.31 119.86 2fwl h LEU 48 Ca 0.17 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 2fwl h LEU 48 Cb 0.38 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2fwl h LEU 48 CO 0.01 0.56 -0.20 0.58 0.09 0.00 0.00 178.44 179.48 2fwl h VAL 49 N 0.67 1.23 0.07 1.22 2.07 -0.91 0.93 116.25 121.54 2fwl h VAL 49 Ca 0.16 -1.08 -0.28 0.00 0.82 0.00 0.00 66.70 66.33 2fwl h VAL 49 Cb 0.14 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2fwl h VAL 49 CO -0.02 0.34 -1.39 -0.07 0.02 0.00 0.00 177.57 176.45 2fwl h LEU 50 N 0.33 0.23 0.28 2.57 4.07 -0.97 -1.83 115.31 120.00 2fwl h LEU 50 Ca 0.06 -0.31 -0.01 0.00 0.08 0.00 0.00 57.88 57.69 2fwl h LEU 50 Cb 0.54 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.21 2fwl h LEU 50 CO 0.04 1.25 -0.13 -0.07 -1.08 0.00 0.00 178.44 178.45 2fwl h LEU 51 N 0.04 -0.32 0.00 1.67 3.38 -0.53 0.26 115.31 119.81 2fwl h LEU 51 Ca -0.18 -0.17 -0.29 0.00 0.09 0.00 0.00 57.88 57.34 2fwl h LEU 51 Cb 1.95 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 42.73 2fwl h LEU 51 CO 0.15 0.17 -2.09 -1.22 0.09 0.00 0.00 178.44 175.54 2fwl n TYR 52 N -5.03 0.00 0.00 1.13 4.01 0.28 -3.42 117.16 114.13 2fwl n TYR 52 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 2fwl n TYR 52 Cb 0.24 -0.74 0.00 0.00 -0.31 0.00 0.00 39.34 38.52 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 2.47 0.03 3.33 2.72 0.00 -0.69 -3.99 105.19 109.06 2fwl n GLY 53 Ca -0.32 -2.28 -0.15 0.00 0.00 0.00 0.00 46.02 43.28 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 0.38 0.03 0.99 2.96 -1.21 -4.27 118.68 117.56 2fwl s LEU 54 Ca 0.00 0.27 -0.27 0.00 -0.22 0.00 0.00 54.13 53.91 2fwl s LEU 54 Cb 0.00 1.67 0.09 0.00 0.50 0.00 0.00 46.19 48.45 2fwl s LEU 54 CO 0.00 -0.51 0.77 0.00 -1.32 0.00 0.00 176.35 175.30 2fwl s GLN 55 N -1.34 0.98 0.00 1.98 -2.07 -1.26 0.49 119.66 118.44 2fwl s GLN 55 Ca -0.12 -0.23 0.00 0.00 -1.82 0.00 0.00 55.36 53.19 2fwl s GLN 55 Cb -0.03 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.34 2fwl s GLN 55 CO 0.06 -0.40 0.00 0.41 -1.32 0.00 0.00 175.29 174.03 2fwl n GLY 56 N -0.02 0.69 2.86 2.60 0.00 -1.22 -4.78 105.19 105.32 2fwl n GLY 56 Ca -0.13 -0.68 -0.03 0.00 0.00 0.00 0.00 46.02 45.18 2fwl n GLY 56 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2fwl s GLN 57 N 0.00 0.92 0.09 1.61 2.00 -1.26 -4.31 119.66 118.71 2fwl s GLN 57 Ca 0.00 -0.77 -0.05 0.00 -2.00 0.00 0.00 55.36 52.54 2fwl s GLN 57 Cb 0.00 -0.01 -0.05 0.00 0.80 0.00 0.00 33.01 33.75 2fwl s GLN 57 CO 0.00 -1.17 0.33 0.96 -0.50 0.00 0.00 175.29 174.91 2fwl s ILE 58 N 1.16 5.22 -0.29 -2.34 -4.36 -1.07 -4.89 121.20 114.62 2fwl s ILE 58 Ca 0.26 0.06 0.03 0.00 -0.26 0.00 0.00 60.65 60.73 2fwl s ILE 58 Cb 0.00 -3.61 0.08 0.00 1.25 0.00 0.00 42.46 40.18 2fwl s ILE 58 CO -0.06 0.16 -0.02 -0.70 0.24 0.00 0.00 174.94 174.55 2fwl s GLU 59 N -2.34 1.75 -0.04 0.37 2.12 -1.26 -0.38 118.70 118.93 2fwl s GLU 59 Ca 0.36 -1.51 0.04 0.00 0.36 0.00 0.00 54.97 54.23 2fwl s GLU 59 Cb -0.13 -2.93 -0.00 0.00 0.26 0.00 0.00 34.13 31.33 2fwl s GLU 59 CO 0.22 -0.75 -0.16 0.08 -0.54 0.00 0.00 175.26 174.11 2fwl s VAL 60 N 1.09 1.36 -1.87 3.70 1.01 -0.67 -4.72 120.40 120.30 2fwl s VAL 60 Ca 0.01 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2fwl s VAL 60 Cb -0.19 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.02 2fwl s VAL 60 CO -0.08 0.39 0.00 0.29 0.00 0.00 0.00 175.10 175.71 2fwl n LYS 61 N 3.12 -1.63 -1.23 2.72 4.76 -1.26 -1.02 118.16 123.62 2fwl n LYS 61 Ca -0.18 1.06 -0.05 0.00 -2.87 0.00 0.00 58.31 56.27 2fwl n LYS 61 Cb 0.53 -5.67 -0.02 0.00 -1.84 0.00 0.00 35.03 28.03 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 -0.91 0.71 3.18 0.72 0.00 -1.26 -5.02 105.19 102.62 2fwl n GLY 62 Ca -0.24 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.62 2fwl n GLY 62 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fwl s MET 63 N -2.59 3.10 -0.63 1.61 -1.94 -0.19 -5.08 119.30 113.57 2fwl s MET 63 Ca 0.00 -0.78 -0.21 0.00 -1.71 0.00 0.00 55.69 52.98 2fwl s MET 63 Cb 0.00 -2.64 0.08 0.00 2.01 0.00 0.00 34.83 34.28 2fwl s MET 63 CO 0.00 -0.15 0.87 0.15 -0.01 0.00 0.00 175.02 175.88 2fwl s LYS 64 N 1.20 3.09 0.14 2.03 1.02 -1.26 -1.67 119.74 124.29 2fwl s LYS 64 Ca 0.02 -0.99 -0.24 0.00 0.02 0.00 0.00 55.97 54.78 2fwl s LYS 64 Cb -0.14 -4.24 -0.08 0.00 -0.52 0.00 0.00 37.83 32.86 2fwl s LYS 64 CO -0.08 -1.71 0.73 0.71 -0.92 0.00 0.00 175.35 174.08 2fwl s TYR 65 N 3.58 3.89 -0.40 3.18 2.02 0.48 -4.21 117.35 125.88 2fwl s TYR 65 Ca 0.19 1.56 0.03 0.00 -0.37 0.00 0.00 57.07 58.48 2fwl s TYR 65 Cb -0.19 -2.71 0.17 0.00 -0.40 0.00 0.00 41.96 38.82 2fwl s TYR 65 CO 0.09 0.53 0.32 1.21 -1.57 0.00 0.00 175.55 176.13 2fwl s ASN 66 N -1.11 1.69 0.00 2.29 3.04 0.23 -2.61 114.94 118.46 2fwl s ASN 66 Ca 0.34 -2.94 0.00 0.00 0.04 0.00 0.00 52.86 50.31 2fwl s ASN 66 Cb -0.22 -0.44 0.00 0.00 -1.54 0.00 0.00 41.25 39.05 2fwl s ASN 66 CO 0.25 -0.19 0.00 0.61 -3.04 0.00 0.00 177.10 174.73 2fwl n GLY 67 N 3.02 3.69 2.67 1.21 0.00 -1.26 -4.83 105.19 109.68 2fwl n GLY 67 Ca 0.27 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.32 0.07 -0.22 1.61 1.01 -1.26 -3.44 120.40 115.85 2fwl s VAL 68 Ca 0.00 -0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 2fwl s VAL 68 Cb 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 2fwl s VAL 68 CO 0.00 -0.07 1.61 -0.32 0.00 0.00 0.00 175.10 176.32 2fwl s MET 69 N 2.08 3.80 0.27 2.72 1.75 0.18 -4.93 119.30 125.16 2fwl s MET 69 Ca 0.03 1.66 -0.30 0.00 -1.25 0.00 0.00 55.69 55.82 2fwl s MET 69 Cb -0.15 -4.03 -0.11 0.00 2.84 0.00 0.00 34.83 33.38 2fwl s MET 69 CO -0.07 -1.29 1.50 -1.12 -0.65 0.00 0.00 175.02 173.39 2fwl s SER 70 N 4.22 6.54 0.02 1.11 0.01 -1.26 -3.30 113.70 121.04 2fwl s SER 70 Ca 0.71 2.78 -0.30 0.00 1.31 0.00 0.00 55.95 60.45 2fwl s SER 70 Cb -0.25 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.30 2fwl s SER 70 CO 0.29 -0.78 1.32 -0.44 0.41 0.00 0.00 173.24 174.04 2fwl s SER 71 N 0.41 6.93 -0.39 2.44 0.01 -1.26 -4.72 113.70 117.12 2fwl s SER 71 Ca 0.61 2.07 0.05 0.00 1.31 0.00 0.00 55.95 59.99 2fwl s SER 71 Cb -0.44 -2.57 0.50 0.00 0.21 0.00 0.00 66.02 63.72 2fwl s SER 71 CO 0.45 -0.63 1.58 0.49 0.41 0.00 0.00 173.24 175.53 2fwl n PHE 72 N 4.84 2.14 0.52 2.43 3.72 0.92 -4.66 117.46 127.36 2fwl n PHE 72 Ca 0.12 -2.08 0.06 0.00 -0.05 0.00 0.00 57.45 55.50 2fwl n PHE 72 Cb 0.44 -0.71 0.30 0.00 -0.94 0.00 0.00 39.48 38.57 2fwl n PHE 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fwl n ALA 73 N -0.99 1.67 0.26 4.37 0.00 -1.22 -2.23 120.51 122.37 2fwl n ALA 73 Ca 0.45 -0.05 0.16 0.00 0.00 0.00 0.00 53.44 54.00 2fwl n ALA 73 Cb 1.02 -1.22 0.57 0.00 0.00 0.00 0.00 19.45 19.83 2fwl n ALA 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2fwl h GLN 74 N 0.00 0.00 -7.21 0.00 -0.00 -1.91 -3.44 115.11 102.55 2fwl h GLN 74 Ca 0.00 0.00 -0.50 0.00 -0.00 0.00 0.00 58.65 58.15 2fwl h GLN 74 Cb 0.19 0.00 0.05 0.00 -0.00 0.00 0.00 27.48 27.72 2fwl h GLN 74 CO 0.00 0.01 0.32 -0.51 -0.00 0.00 0.00 178.83 178.66 2fwl s LEU 75 N -6.21 3.40 0.65 0.06 1.43 -0.95 -5.04 118.68 112.02 2fwl s LEU 75 Ca 0.02 1.30 -0.15 0.00 -1.03 0.00 0.00 54.13 54.28 2fwl s LEU 75 Cb 0.08 -4.31 -0.00 0.00 0.03 0.00 0.00 46.19 41.99 2fwl s LEU 75 CO 0.57 -0.74 1.10 -0.54 0.23 0.00 0.00 176.35 176.98 2fwl s LYS 76 N -4.87 2.85 0.31 1.70 1.02 -1.26 -4.82 119.74 114.67 2fwl s LYS 76 Ca 0.53 1.36 -0.00 0.00 0.02 0.00 0.00 55.97 57.88 2fwl s LYS 76 Cb -0.11 -1.96 0.49 0.00 -0.52 0.00 0.00 37.83 35.74 2fwl s LYS 76 CO 0.48 -1.21 1.93 -0.44 -0.92 0.00 0.00 175.35 175.19 2fwl h ASP 77 N 0.05 0.80 0.93 2.83 3.32 -1.94 0.52 116.42 122.93 2fwl h ASP 77 Ca -0.47 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.51 2fwl h ASP 77 Cb 1.24 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2fwl h ASP 77 CO 0.54 0.66 0.00 -0.33 -1.72 0.00 0.00 179.24 178.40 2fwl h GLU 78 N 0.90 0.00 0.11 3.56 5.08 -1.92 -1.91 114.58 120.41 2fwl h GLU 78 Ca 0.23 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.25 2fwl h GLU 78 Cb 0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2fwl h GLU 78 CO -0.03 0.00 -1.80 0.93 -1.00 0.00 0.00 179.01 177.10 2fwl h GLU 79 N 0.00 0.24 -0.73 2.33 5.08 -1.44 -3.09 114.58 116.97 2fwl h GLU 79 Ca 0.00 -0.41 -0.04 0.00 -1.00 0.00 0.00 59.36 57.91 2fwl h GLU 79 Cb 0.46 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 2fwl h GLU 79 CO 0.00 1.20 0.30 0.82 -1.00 0.00 0.00 179.01 180.32 2fwl h ILE 80 N -0.12 1.24 0.00 3.13 2.04 -0.85 -1.29 117.51 121.66 2fwl h ILE 80 Ca -0.39 -0.76 -0.09 0.00 1.00 0.00 0.00 64.86 64.61 2fwl h ILE 80 Cb 1.91 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 2fwl h ILE 80 CO 0.05 0.31 -0.44 0.00 0.00 0.00 0.00 178.15 178.07 2fwl h ALA 81 N 1.27 1.11 -0.15 1.87 0.00 -1.50 -2.72 119.26 119.14 2fwl h ALA 81 Ca 0.25 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2fwl h ALA 81 Cb 0.19 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2fwl h ALA 81 CO -0.02 0.55 -0.11 0.00 0.00 0.00 0.00 179.25 179.67 2fwl h ALA 82 N 1.56 0.22 -0.47 0.00 0.00 -1.18 -1.27 119.26 118.12 2fwl h ALA 82 Ca -0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 2fwl h ALA 82 Cb 0.87 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2fwl h ALA 82 CO 0.06 0.07 -0.01 -0.24 0.00 0.00 0.00 179.25 179.12 2fwl h VAL 83 N -0.01 1.24 -0.47 0.00 3.04 -1.27 0.91 116.25 119.69 2fwl h VAL 83 Ca 0.03 -1.01 -0.03 0.00 -1.01 0.00 0.00 66.70 64.68 2fwl h VAL 83 Cb 0.62 0.90 -0.02 0.00 -2.01 0.00 0.00 31.29 30.77 2fwl h VAL 83 CO 0.03 0.35 0.18 -0.07 -1.01 0.00 0.00 177.57 177.06 2fwl h LEU 84 N 0.73 0.66 -0.50 3.16 3.38 -1.42 -0.03 115.31 121.29 2fwl h LEU 84 Ca 0.14 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 2fwl h LEU 84 Cb 0.46 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2fwl h LEU 84 CO 0.02 0.66 0.13 0.78 0.09 0.00 0.00 178.44 180.12 2fwl h ASN 85 N 0.63 0.75 0.50 -0.43 2.35 -0.85 -2.63 115.58 115.90 2fwl h ASN 85 Ca 0.16 -0.23 -0.02 0.00 -0.55 0.00 0.00 56.30 55.65 2fwl h ASN 85 Cb 0.21 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.39 2fwl h ASN 85 CO -0.01 0.78 -0.24 -0.74 -1.65 0.00 0.00 177.43 175.57 2fwl h HIS 86 N 0.68 -0.63 -0.55 1.19 2.76 -0.48 -1.72 115.15 116.40 2fwl h HIS 86 Ca 0.16 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.31 2fwl h HIS 86 Cb 0.32 0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 2fwl h HIS 86 CO 0.02 -0.36 0.33 -0.84 -1.30 0.00 0.00 177.93 175.78 2fwl h ILE 87 N -0.73 1.16 -0.07 6.26 3.07 -1.03 0.34 117.51 126.50 2fwl h ILE 87 Ca -0.07 -0.35 -0.18 0.00 1.55 0.00 0.00 64.86 65.82 2fwl h ILE 87 Cb 0.55 0.38 -0.01 0.00 -0.27 0.00 0.00 36.82 37.47 2fwl h ILE 87 CO 0.11 0.16 -0.71 0.00 -1.05 0.00 0.00 178.15 176.66 2fwl h ALA 88 N 1.61 0.65 0.07 0.16 0.00 -1.38 -3.20 119.26 117.17 2fwl h ALA 88 Ca 0.20 -0.61 -0.33 0.00 0.00 0.00 0.00 54.91 54.18 2fwl h ALA 88 Cb -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2fwl h ALA 88 CO -0.04 0.77 -1.83 1.79 0.00 0.00 0.00 179.25 179.94 2fwl h THR 89 N 0.23 0.76 -0.57 0.00 1.35 -0.87 0.14 112.91 113.95 2fwl h THR 89 Ca -0.03 -2.54 0.02 0.00 -0.55 0.00 0.00 66.41 63.31 2fwl h THR 89 Cb 1.28 2.48 -0.03 0.00 -1.73 0.00 0.00 68.15 70.15 2fwl h THR 89 CO 0.12 0.70 0.36 0.00 -0.25 0.00 0.00 175.52 176.45 2fwl h ALA 90 N 0.53 0.73 -0.11 6.62 0.00 -0.43 -1.79 119.26 124.81 2fwl h ALA 90 Ca -0.35 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2fwl h ALA 90 Cb 2.02 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2fwl h ALA 90 CO 0.09 0.11 0.00 0.91 0.00 0.00 0.00 179.25 180.36 2fwl n TRP 91 N -4.72 0.13 -1.81 0.00 8.01 -1.21 -4.92 117.44 112.91 2fwl n TRP 91 Ca 0.04 -0.06 -0.16 0.00 -1.31 0.00 0.00 57.50 56.01 2fwl n TRP 91 Cb 0.05 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 29.30 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 1.19 0.86 0.13 6.99 0.00 -0.67 -4.87 105.19 108.82 2fwl n GLY 92 Ca 0.17 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 2fwl n GLY 92 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2fwl h ASP 93 N 0.00 0.00 0.43 1.61 3.58 -1.38 -2.77 116.42 117.89 2fwl h ASP 93 Ca -0.36 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.09 2fwl h ASP 93 Cb 1.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.20 2fwl h ASP 93 CO 0.48 0.67 0.00 0.00 -2.88 0.00 0.00 179.24 177.50 2fwl n ALA 94 N -2.36 2.04 1.13 -0.78 0.00 0.32 -1.86 120.51 119.00 2fwl n ALA 94 Ca -0.00 -0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.47 2fwl n ALA 94 Cb 0.70 -1.33 0.29 0.00 0.00 0.00 0.00 19.45 19.11 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 -1.32 0.50 -0.36 0.00 5.02 -1.04 -3.79 118.16 117.16 2fwl n LYS 95 Ca 0.09 -0.31 0.09 0.00 -2.02 0.00 0.00 58.31 56.17 2fwl n LYS 95 Cb 0.17 -1.49 0.28 0.00 -0.02 0.00 0.00 35.03 33.97 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 -0.98 2.64 -4.27 1.97 5.02 -0.78 -4.89 118.16 116.86 2fwl n LYS 96 Ca 0.09 -2.26 -0.22 0.00 -2.02 0.00 0.00 58.31 53.90 2fwl n LYS 96 Cb 0.35 -1.56 -0.12 0.00 -0.02 0.00 0.00 35.03 33.68 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 -1.33 1.62 -0.19 -0.18 -7.23 -1.25 -5.00 120.40 106.84 2fwl s VAL 97 Ca 0.42 -1.58 -0.23 0.00 -1.81 0.00 0.00 61.98 58.78 2fwl s VAL 97 Cb 0.23 -1.53 -0.02 0.00 0.56 0.00 0.00 36.38 35.62 2fwl s VAL 97 CO 0.26 -0.14 0.75 -1.59 -0.31 0.00 0.00 175.10 174.07 2fwl s LYS 98 N -2.06 4.24 -0.77 4.82 -2.85 -1.26 -4.31 119.74 117.55 2fwl s LYS 98 Ca 0.07 0.84 -0.04 0.00 -1.00 0.00 0.00 55.97 55.84 2fwl s LYS 98 Cb -0.09 -3.59 -0.04 0.00 -2.06 0.00 0.00 37.83 32.05 2fwl s LYS 98 CO 0.04 -0.33 0.68 0.41 0.10 0.00 0.00 175.35 176.26 2fwl n GLY 99 N 3.66 -0.77 3.67 0.59 0.00 -1.26 -4.94 105.19 106.14 2fwl n GLY 99 Ca 0.02 0.38 -0.42 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.24 2.77 -0.22 1.61 5.36 -1.26 -5.00 117.98 118.00 2fwl s PHE 100 Ca 0.28 0.85 -0.14 0.00 -0.96 0.00 0.00 56.93 56.97 2fwl s PHE 100 Cb -0.04 -3.61 -0.04 0.00 -0.34 0.00 0.00 43.02 38.99 2fwl s PHE 100 CO 0.58 -2.22 0.30 0.15 -1.46 0.00 0.00 175.22 172.57 2fwl s LYS 101 N 2.98 4.13 0.23 10.12 1.02 -1.26 -5.05 119.74 131.91 2fwl s LYS 101 Ca 0.61 0.01 -0.32 0.00 0.02 0.00 0.00 55.97 56.29 2fwl s LYS 101 Cb -0.27 -3.54 -0.13 0.00 -0.52 0.00 0.00 37.83 33.37 2fwl s LYS 101 CO 0.22 0.00 1.57 -2.30 -0.92 0.00 0.00 175.35 173.92 2fwl n PRO 102 N 4.40 2.39 -1.83 -1.68 -0.02 -1.26 -4.91 135.00 132.09 2fwl n PRO 102 Ca -0.11 0.86 -0.42 0.00 -2.02 0.00 0.00 63.50 61.81 2fwl n PRO 102 Cb 0.51 -2.62 -0.02 0.00 -0.02 0.00 0.00 33.50 31.36 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 0.45 2.90 0.17 6.00 0.08 -1.26 -5.01 117.98 121.31 2fwl s PHE 103 Ca 0.71 0.66 0.08 0.00 0.12 0.00 0.00 56.93 58.50 2fwl s PHE 103 Cb -0.59 -4.02 -0.04 0.00 -0.57 0.00 0.00 43.02 37.80 2fwl s PHE 103 CO 0.43 -3.63 -0.07 0.95 -0.10 0.00 0.00 175.22 172.80 2fwl s THR 104 N 0.57 3.34 0.45 0.64 -4.23 -1.26 -4.81 115.64 110.34 2fwl s THR 104 Ca 0.67 -1.55 0.14 0.00 -1.18 0.00 0.00 61.69 59.77 2fwl s THR 104 Cb -0.47 -2.65 0.19 0.00 1.34 0.00 0.00 72.50 70.92 2fwl s THR 104 CO 0.39 -0.08 2.00 0.00 -0.54 0.00 0.00 174.62 176.39 2fwl h ALA 105 N 2.96 1.70 -0.19 3.99 0.00 -1.93 -1.85 119.26 123.94 2fwl h ALA 105 Ca -0.47 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 2fwl h ALA 105 Cb 1.20 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2fwl h ALA 105 CO 0.55 0.22 0.06 0.93 0.00 0.00 0.00 179.25 181.01 2fwl h GLU 106 N 0.04 0.26 -0.21 0.00 4.39 -1.95 -0.27 114.58 116.85 2fwl h GLU 106 Ca 0.01 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.62 2fwl h GLU 106 Cb 0.29 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 2fwl h GLU 106 CO 0.02 0.24 -0.09 0.93 -1.16 0.00 0.00 179.01 178.94 2fwl h GLU 107 N 0.27 0.43 -0.25 2.33 5.08 -1.75 -0.51 114.58 120.18 2fwl h GLU 107 Ca 0.07 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 2fwl h GLU 107 Cb 0.08 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2fwl h GLU 107 CO -0.01 0.71 0.05 0.28 -1.00 0.00 0.00 179.01 179.04 2fwl h VAL 108 N 0.14 1.22 -0.50 3.13 2.07 -1.41 -1.99 116.25 118.92 2fwl h VAL 108 Ca 0.05 -0.75 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 2fwl h VAL 108 Cb 0.58 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 2fwl h VAL 108 CO 0.03 0.24 0.16 0.50 0.02 0.00 0.00 177.57 178.51 2fwl h LYS 109 N 0.22 0.73 -0.17 1.57 3.64 -1.07 0.43 116.57 121.92 2fwl h LYS 109 Ca 0.08 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2fwl h LYS 109 Cb 0.31 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2fwl h LYS 109 CO 0.00 0.64 0.06 -0.22 -2.27 0.00 0.00 179.45 177.66 2fwl h LYS 110 N 0.72 0.27 0.00 1.90 3.64 -0.81 -2.71 116.57 119.57 2fwl h LYS 110 Ca 0.17 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 2fwl h LYS 110 Cb 0.21 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2fwl h LYS 110 CO -0.01 0.38 -0.40 -0.07 -2.27 0.00 0.00 179.45 177.08 2fwl h LEU 111 N 0.11 0.00 0.00 5.20 3.38 -1.14 -2.73 115.31 120.13 2fwl h LEU 111 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2fwl h LEU 111 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2fwl h LEU 111 CO -0.00 0.40 0.00 -1.14 0.09 0.00 0.00 178.44 177.79 2fwl n ARG 112 N -3.44 0.06 -0.04 1.13 0.63 0.12 -2.61 116.66 112.51 2fwl n ARG 112 Ca 0.00 0.16 -0.10 0.00 -0.92 0.00 0.00 57.85 57.00 2fwl n ARG 112 Cb 0.57 -1.50 0.04 0.00 0.45 0.00 0.00 32.46 32.02 2fwl n ARG 112 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2fwl h ALA 113 N 2.70 0.70 -1.96 5.13 0.00 -1.17 -3.39 119.26 121.26 2fwl h ALA 113 Ca 0.00 -0.47 -0.67 0.00 0.00 0.00 0.00 54.91 53.77 2fwl h ALA 113 Cb 0.29 -0.10 -0.17 0.00 0.00 0.00 0.00 17.79 17.80 2fwl h ALA 113 CO 0.00 0.67 0.19 0.15 0.00 0.00 0.00 179.25 180.26 2fwl s LYS 114 N -4.22 3.14 -0.60 0.00 3.01 -1.07 -4.99 119.74 115.00 2fwl s LYS 114 Ca -0.09 -0.88 -0.26 0.00 -1.01 0.00 0.00 55.97 53.73 2fwl s LYS 114 Cb 0.12 -4.14 -0.03 0.00 -1.01 0.00 0.00 37.83 32.76 2fwl s LYS 114 CO 0.85 -1.39 1.95 0.21 0.51 0.00 0.00 175.35 177.48 2fwl s LYS 115 N 3.00 2.53 0.27 1.68 2.47 -1.26 -4.94 119.74 123.49 2fwl s LYS 115 Ca 0.17 0.71 0.03 0.00 -1.56 0.00 0.00 55.97 55.32 2fwl s LYS 115 Cb -0.19 -4.44 0.03 0.00 -1.46 0.00 0.00 37.83 31.77 2fwl s LYS 115 CO 0.12 -2.85 0.22 1.28 0.16 0.00 0.00 175.35 174.28 2fwl n LEU 116 N 13.32 0.00 -4.15 5.43 4.77 -1.26 -5.16 117.00 129.95 2fwl n LEU 116 Ca 0.24 -1.38 -0.10 0.00 -0.03 0.00 0.00 56.01 54.74 2fwl n LEU 116 Cb 0.52 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.47 2fwl n LEU 116 CO 0.71 -0.44 -0.33 0.42 -1.33 0.00 0.00 177.39 176.42 2fwl s THR 117 N -1.27 0.32 0.28 -5.08 -4.23 -1.26 -4.90 115.64 99.51 2fwl s THR 117 Ca 0.17 -1.90 0.03 0.00 -1.18 0.00 0.00 61.69 58.80 2fwl s THR 117 Cb -0.01 -1.87 0.27 0.00 1.34 0.00 0.00 72.50 72.23 2fwl s THR 117 CO 0.11 -0.66 1.75 -0.65 -0.54 0.00 0.00 174.62 174.62 2fwl h PRO 118 N 2.92 0.60 -0.16 3.99 0.11 -1.74 0.84 132.00 138.57 2fwl h PRO 118 Ca -0.35 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.66 2fwl h PRO 118 Cb 1.18 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2fwl h PRO 118 CO 0.62 0.40 -0.20 0.37 -0.21 0.00 0.00 178.00 178.98 2fwl h GLN 119 N 0.62 0.27 -0.08 1.05 5.75 -1.87 -1.93 115.11 118.92 2fwl h GLN 119 Ca 0.53 -0.08 -0.19 0.00 -0.15 0.00 0.00 58.65 58.76 2fwl h GLN 119 Cb 0.84 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 29.36 2fwl h GLN 119 CO -0.41 0.46 -0.73 1.96 -2.65 0.00 0.00 178.83 177.47 2fwl h GLN 120 N 0.25 0.42 -0.40 1.69 4.20 -1.28 -2.95 115.11 117.04 2fwl h GLN 120 Ca 0.04 -0.34 -0.09 0.00 0.06 0.00 0.00 58.65 58.32 2fwl h GLN 120 Cb 0.50 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 2fwl h GLN 120 CO 0.03 0.98 -0.13 0.28 -0.67 0.00 0.00 178.83 179.33 2fwl h VAL 121 N 0.29 1.25 -0.62 -0.54 2.07 -0.76 -2.36 116.25 115.59 2fwl h VAL 121 Ca -0.03 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.32 2fwl h VAL 121 Cb 1.31 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 32.14 2fwl h VAL 121 CO 0.13 0.39 0.34 0.25 0.02 0.00 0.00 177.57 178.70 2fwl h LEU 122 N 0.64 0.75 -0.80 2.57 5.85 -1.27 -1.70 115.31 121.35 2fwl h LEU 122 Ca 0.11 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 2fwl h LEU 122 Cb 0.59 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 2fwl h LEU 122 CO 0.04 0.60 0.09 0.00 -0.34 0.00 0.00 178.44 178.84 2fwl h ALA 123 N 1.52 1.01 -0.75 1.25 0.00 -1.26 -2.38 119.26 118.66 2fwl h ALA 123 Ca 0.22 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2fwl h ALA 123 Cb 0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2fwl h ALA 123 CO -0.04 0.63 0.31 0.93 0.00 0.00 0.00 179.25 181.08 2fwl h GLU 124 N 0.94 1.11 -0.70 0.00 4.39 -1.03 -0.84 114.58 118.44 2fwl h GLU 124 Ca 0.19 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2fwl h GLU 124 Cb 0.41 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.84 2fwl h GLU 124 CO 0.01 0.89 0.36 -0.09 -1.16 0.00 0.00 179.01 179.03 2fwl h ARG 125 N 1.08 0.98 0.00 2.33 2.43 -1.03 -1.76 114.38 118.42 2fwl h ARG 125 Ca 0.25 -0.13 -0.07 0.00 -0.81 0.00 0.00 59.98 59.23 2fwl h ARG 125 Cb 0.19 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2fwl h ARG 125 CO -0.02 0.75 -0.33 0.87 -1.51 0.00 0.00 179.97 179.73 2fwl h LYS 126 N 0.96 0.00 0.00 0.20 1.57 -0.93 -1.75 116.57 116.62 2fwl h LYS 126 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2fwl h LYS 126 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2fwl h LYS 126 CO -0.04 0.33 0.00 0.87 -0.57 0.00 0.00 179.45 180.05 2fwl h LYS 127 N 0.00 0.00 -0.01 3.15 1.57 -0.29 -1.90 116.57 119.09 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 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2fwl h LYS 127 CO 0.04 0.00 -0.06 1.28 -0.57 0.00 0.00 179.45 180.14 2fwl n LEU 128 N -2.34 1.14 0.00 2.94 4.77 -0.68 -4.89 117.00 117.94 2fwl n LEU 128 Ca 0.03 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 2fwl n LEU 128 Cb 0.31 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2fwl n LEU 128 CO 0.24 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2fwl n GLY 129 N 1.20 0.26 3.51 -0.72 0.00 -0.71 -5.03 105.19 103.69 2fwl n GLY 129 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 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 4.30 0.00 0.99 1.43 -1.08 -4.99 118.68 119.33 2fwl s LEU 130 Ca 0.00 -0.41 0.18 0.00 -1.03 0.00 0.00 54.13 52.87 2fwl s LEU 130 Cb 0.00 -2.78 1.07 0.00 0.03 0.00 0.00 46.19 44.51 2fwl s LEU 130 CO 0.00 -1.10 1.47 0.29 0.23 0.00 0.00 176.35 177.24