#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vbw s ARG 2 N 0.00 1.41 0.00 1.43 0.52 -1.26 -4.48 118.95 116.57 1vbw s ARG 2 Ca 0.00 -0.54 0.00 0.00 -0.52 0.00 0.00 55.73 54.67 1vbw s ARG 2 Cb 0.00 -2.07 0.00 0.00 0.52 0.00 0.00 34.95 33.40 1vbw s ARG 2 CO 0.00 -1.79 0.00 0.00 0.02 0.00 0.00 175.30 173.53 1vbw s GLN 4 N -0.12 2.18 0.17 0.00 -0.21 -1.26 -4.88 119.66 115.54 1vbw s GLN 4 Ca 0.00 0.42 0.00 0.00 0.02 0.00 0.00 55.36 55.80 1vbw s GLN 4 Cb 0.00 -1.95 0.00 0.00 1.00 0.00 0.00 33.01 32.06 1vbw s GLN 4 CO 0.00 -1.50 0.00 0.41 -2.12 0.00 0.00 175.29 172.08 1vbw n GLY 5 N -2.68 -2.56 3.75 3.09 0.00 -1.26 -4.89 105.19 100.64 1vbw n GLY 5 Ca 0.07 -1.91 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 1vbw n GLY 5 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vbw s LYS 6 N -0.38 4.21 0.00 1.61 2.20 -1.26 -4.90 119.74 121.22 1vbw s LYS 6 Ca 0.00 2.41 0.00 0.00 -0.36 0.00 0.00 55.97 58.02 1vbw s LYS 6 Cb 0.00 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.24 1vbw s LYS 6 CO 0.00 -0.51 0.25 -1.13 -0.36 0.00 0.00 175.35 173.60 1vbw n SER 7 N 2.35 0.51 -3.88 1.43 3.41 -1.26 -4.81 113.62 111.36 1vbw n SER 7 Ca 0.08 -0.96 -0.12 0.00 -0.26 0.00 0.00 58.87 57.60 1vbw n SER 7 Cb 0.39 0.03 -0.14 0.00 -0.26 0.00 0.00 64.21 64.23 1vbw n SER 7 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1vbw s SER 8 N -0.03 0.05 -0.52 4.04 0.01 -1.26 -1.14 113.70 114.85 1vbw s SER 8 Ca 0.00 -0.01 0.07 0.00 1.31 0.00 0.00 55.95 57.32 1vbw s SER 8 Cb 0.00 -0.00 0.29 0.00 0.21 0.00 0.00 66.02 66.52 1vbw s SER 8 CO 0.00 0.00 0.75 0.79 0.41 0.00 0.00 173.24 175.19 1vbw n TRP 9 N 3.06 2.28 0.27 2.43 8.01 0.20 -4.95 117.44 128.73 1vbw n TRP 9 Ca -0.12 -3.93 0.12 0.00 -1.31 0.00 0.00 57.50 52.26 1vbw n TRP 9 Cb 0.60 -0.47 0.75 0.00 -2.01 0.00 0.00 31.31 30.18 1vbw n TRP 9 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1vbw h PRO 10 N 3.60 0.00 0.00 -0.99 0.13 -1.92 -1.74 132.00 131.09 1vbw h PRO 10 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1vbw h PRO 10 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1vbw h PRO 10 CO 0.69 0.08 0.00 1.04 -0.23 0.00 0.00 178.00 179.58 1vbw n GLN 11 N -3.93 0.14 0.04 0.86 6.02 -1.26 -3.19 117.38 116.06 1vbw n GLN 11 Ca -0.02 0.11 0.13 0.00 -0.01 0.00 0.00 57.00 57.21 1vbw n GLN 11 Cb 0.17 -1.50 0.52 0.00 1.02 0.00 0.00 30.24 30.45 1vbw n GLN 11 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1vbw n LEU 12 N -1.40 0.30 -4.77 1.08 7.99 -0.65 -4.79 117.00 114.75 1vbw n LEU 12 Ca 0.08 0.53 -0.41 0.00 -0.01 0.00 0.00 56.01 56.20 1vbw n LEU 12 Cb 0.21 -0.44 -0.01 0.00 -0.11 0.00 0.00 43.42 43.07 1vbw n LEU 12 CO 0.18 -0.10 1.10 0.68 -1.51 0.00 0.00 177.39 177.74 1vbw s VAL 13 N -3.05 2.24 0.00 4.08 -7.23 -1.19 -1.52 120.40 113.73 1vbw s VAL 13 Ca 0.12 0.24 0.00 0.00 -1.81 0.00 0.00 61.98 60.53 1vbw s VAL 13 Cb 0.16 -3.15 0.00 0.00 0.56 0.00 0.00 36.38 33.95 1vbw s VAL 13 CO 0.53 0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.98 1vbw n GLY 14 N 0.67 2.35 3.90 2.32 0.00 -0.04 -4.98 105.19 109.41 1vbw n GLY 14 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1vbw n GLY 14 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vbw s SER 15 N -2.31 5.18 0.58 1.61 0.15 -0.58 -4.75 113.70 113.58 1vbw s SER 15 Ca 0.00 0.93 -0.16 0.00 0.70 0.00 0.00 55.95 57.42 1vbw s SER 15 Cb 0.00 -1.66 -0.04 0.00 -1.71 0.00 0.00 66.02 62.61 1vbw s SER 15 CO 0.00 -1.46 1.05 0.28 1.20 0.00 0.00 173.24 174.31 1vbw s THR 16 N -3.35 3.89 0.26 6.45 -1.32 -1.26 -0.36 115.64 119.95 1vbw s THR 16 Ca 0.59 0.90 -0.04 0.00 -1.21 0.00 0.00 61.69 61.93 1vbw s THR 16 Cb -0.11 -3.42 0.27 0.00 -1.51 0.00 0.00 72.50 67.73 1vbw s THR 16 CO 0.49 -0.53 1.91 1.23 -2.21 0.00 0.00 174.62 175.52 1vbw h GLY 17 N 0.49 1.46 0.96 6.08 0.00 -1.20 -0.98 103.07 109.88 1vbw h GLY 17 Ca -0.47 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 46.33 1vbw h GLY 17 CO 0.58 0.42 0.14 0.00 0.00 0.00 0.00 176.54 177.68 1vbw h ALA 18 N 1.42 0.61 -0.54 3.60 0.00 -1.93 0.14 119.26 122.57 1vbw h ALA 18 Ca 0.40 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1vbw h ALA 18 Cb 0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1vbw h ALA 18 CO -0.13 0.26 0.32 0.00 0.00 0.00 0.00 179.25 179.71 1vbw h ALA 19 N 1.00 0.68 -0.37 0.00 0.00 -1.86 -2.42 119.26 116.30 1vbw h ALA 19 Ca 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1vbw h ALA 19 Cb 0.27 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1vbw h ALA 19 CO -0.00 0.17 0.23 0.00 0.00 0.00 0.00 179.25 179.64 1vbw h ALA 20 N 1.16 0.47 -0.53 0.00 0.00 -0.91 -1.58 119.26 117.87 1vbw h ALA 20 Ca 0.19 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.14 1vbw h ALA 20 Cb -0.01 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.56 1vbw h ALA 20 CO -0.04 -0.05 0.15 -0.22 0.00 0.00 0.00 179.25 179.09 1vbw h LYS 21 N 0.48 0.29 -0.56 0.00 3.64 -0.73 0.39 116.57 120.08 1vbw h LYS 21 Ca 0.13 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.39 1vbw h LYS 21 Cb -0.01 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1vbw h LYS 21 CO -0.03 0.19 -0.07 0.00 -2.27 0.00 0.00 179.45 177.27 1vbw h ALA 22 N 1.39 0.80 -0.18 5.00 0.00 -1.24 -1.22 119.26 123.81 1vbw h ALA 22 Ca 0.26 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1vbw h ALA 22 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1vbw h ALA 22 CO -0.31 0.67 0.07 0.28 0.00 0.00 0.00 179.25 179.96 1vbw h VAL 23 N 0.93 1.17 -0.13 0.00 2.07 -0.78 -1.94 116.25 117.57 1vbw h VAL 23 Ca 0.15 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.17 1vbw h VAL 23 Cb 0.64 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1vbw h VAL 23 CO 0.04 0.16 0.04 0.40 0.02 0.00 0.00 177.57 178.23 1vbw h ILE 24 N 0.14 0.97 0.00 4.57 2.04 -0.81 -0.04 117.51 124.37 1vbw h ILE 24 Ca 0.06 -0.03 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 1vbw h ILE 24 Cb 0.19 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1vbw h ILE 24 CO -0.00 0.02 -0.32 -0.33 0.00 0.00 0.00 178.15 177.51 1vbw h GLU 25 N 0.10 0.00 -0.02 2.37 5.08 -1.18 -0.82 114.58 120.11 1vbw h GLU 25 Ca 0.05 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 1vbw h GLU 25 Cb 0.03 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.29 1vbw h GLU 25 CO -0.06 0.32 -0.55 0.00 -1.00 0.00 0.00 179.01 177.72 1vbw h ARG 26 N 0.00 0.41 -0.09 2.33 3.08 -1.12 -3.31 114.38 115.69 1vbw h ARG 26 Ca -0.00 -0.41 -0.19 0.00 0.07 0.00 0.00 59.98 59.44 1vbw h ARG 26 Cb 0.90 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.05 1vbw h ARG 26 CO 0.04 1.07 -0.73 0.93 -1.07 0.00 0.00 179.97 180.22 1vbw h GLU 27 N -0.08 0.44 -4.09 0.04 5.08 -0.76 -3.38 114.58 111.83 1vbw h GLU 27 Ca -0.06 -0.36 -0.62 0.00 -1.00 0.00 0.00 59.36 57.32 1vbw h GLU 27 Cb 1.25 0.07 -0.40 0.00 0.50 0.00 0.00 28.75 30.17 1vbw h GLU 27 CO 0.11 1.00 -0.74 1.21 -1.00 0.00 0.00 179.01 179.58 1vbw s ASN 28 N -6.98 4.32 0.00 1.42 3.84 -0.33 -4.70 114.94 112.50 1vbw s ASN 28 Ca -0.06 -1.82 0.13 0.00 0.21 0.00 0.00 52.86 51.32 1vbw s ASN 28 Cb 0.10 -1.21 0.67 0.00 -0.55 0.00 0.00 41.25 40.26 1vbw s ASN 28 CO 0.85 -0.39 1.34 -0.81 -2.79 0.00 0.00 177.10 175.30 1vbw n PRO 29 N 4.59 0.19 -0.49 0.43 -0.04 -1.24 -2.32 135.00 136.11 1vbw n PRO 29 Ca -0.00 0.16 0.08 0.00 -0.04 0.00 0.00 63.50 63.70 1vbw n PRO 29 Cb 0.42 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.69 1vbw n PRO 29 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1vbw n ARG 30 N -1.28 3.17 -4.24 0.54 1.74 -1.26 -4.91 116.66 110.42 1vbw n ARG 30 Ca 0.06 -2.42 -0.17 0.00 -0.77 0.00 0.00 57.85 54.55 1vbw n ARG 30 Cb 0.10 -1.74 -0.11 0.00 -1.02 0.00 0.00 32.46 29.69 1vbw n ARG 30 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1vbw s VAL 31 N -1.67 1.26 -0.10 1.55 -7.23 -0.98 -4.45 120.40 108.77 1vbw s VAL 31 Ca 0.44 -1.82 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 1vbw s VAL 31 Cb 0.27 -1.61 -0.01 0.00 0.56 0.00 0.00 36.38 35.60 1vbw s VAL 31 CO 0.23 -0.53 -0.21 -0.60 -0.31 0.00 0.00 175.10 173.68 1vbw s ARG 32 N -3.00 3.05 0.00 4.82 3.52 -0.36 -4.70 118.95 122.28 1vbw s ARG 32 Ca 0.11 -0.84 -0.19 0.00 -0.13 0.00 0.00 55.73 54.69 1vbw s ARG 32 Cb -0.03 -2.36 -0.06 0.00 -1.56 0.00 0.00 34.95 30.95 1vbw s ARG 32 CO 0.02 0.22 0.54 0.00 -0.81 0.00 0.00 175.30 175.27 1vbw s ALA 33 N 0.26 3.55 -0.14 6.12 0.00 -1.26 -1.45 121.76 128.84 1vbw s ALA 33 Ca -0.15 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.78 1vbw s ALA 33 Cb -0.17 -2.64 0.02 0.00 0.00 0.00 0.00 23.12 20.33 1vbw s ALA 33 CO 0.07 0.26 -0.15 0.14 0.00 0.00 0.00 175.76 176.08 1vbw s VAL 34 N -0.50 1.62 -0.07 0.00 -7.23 -0.12 -4.95 120.40 109.15 1vbw s VAL 34 Ca 0.28 -0.68 -0.25 0.00 -1.81 0.00 0.00 61.98 59.52 1vbw s VAL 34 Cb -0.18 -1.50 -0.03 0.00 0.56 0.00 0.00 36.38 35.23 1vbw s VAL 34 CO 0.16 0.47 0.77 -0.63 -0.31 0.00 0.00 175.10 175.56 1vbw s ILE 35 N 1.29 4.99 -0.02 -0.62 1.09 -1.26 -0.51 121.20 126.16 1vbw s ILE 35 Ca 0.01 1.58 -0.01 0.00 -1.10 0.00 0.00 60.65 61.13 1vbw s ILE 35 Cb -0.14 -4.10 0.02 0.00 -1.06 0.00 0.00 42.46 37.18 1vbw s ILE 35 CO -0.08 0.20 0.04 -0.63 -0.10 0.00 0.00 174.94 174.37 1vbw s ILE 36 N 1.04 -0.03 0.21 2.92 1.01 -0.34 -4.94 121.20 121.07 1vbw s ILE 36 Ca 0.40 0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.86 1vbw s ILE 36 Cb -0.18 -0.08 -0.09 0.00 0.01 0.00 0.00 42.46 42.12 1vbw s ILE 36 CO 0.19 0.05 1.26 -0.54 0.00 0.00 0.00 174.94 175.89 1vbw s LYS 37 N 0.59 4.44 0.16 2.79 -0.14 -1.26 -0.96 119.74 125.36 1vbw s LYS 37 Ca -0.05 1.99 -0.33 0.00 -1.36 0.00 0.00 55.97 56.22 1vbw s LYS 37 Cb -0.07 -3.20 -0.15 0.00 -1.68 0.00 0.00 37.83 32.73 1vbw s LYS 37 CO -0.02 -0.16 1.25 1.33 -0.76 0.00 0.00 175.35 176.99 1vbw n VAL 38 N 2.34 0.68 -0.29 3.17 0.24 0.18 -1.57 118.33 123.08 1vbw n VAL 38 Ca 0.04 -0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 1vbw n VAL 38 Cb 0.43 -0.95 0.00 0.00 -1.47 0.00 0.00 33.84 31.85 1vbw n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vbw n GLY 39 N 2.20 1.03 0.18 7.63 0.00 -1.26 -4.92 105.19 110.05 1vbw n GLY 39 Ca 0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.25 1vbw n GLY 39 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1vbw h SER 40 N 0.00 0.00 -3.77 1.61 0.02 -1.67 -3.50 113.55 106.24 1vbw h SER 40 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1vbw h SER 40 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1vbw h SER 40 CO 0.00 0.26 0.00 0.61 -1.14 0.00 0.00 176.83 176.56 1vbw n GLY 41 N 1.08 -1.88 3.48 -3.77 0.00 -1.26 -5.07 105.19 97.76 1vbw n GLY 41 Ca 0.03 -1.33 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 1vbw n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vbw s ALA 42 N -2.83 -1.73 0.32 4.61 0.00 -1.26 -5.04 121.76 115.83 1vbw s ALA 42 Ca 0.00 0.94 -0.29 0.00 0.00 0.00 0.00 51.96 52.61 1vbw s ALA 42 Cb 0.00 0.38 -0.12 0.00 0.00 0.00 0.00 23.12 23.38 1vbw s ALA 42 CO 0.00 -0.60 1.44 2.41 0.00 0.00 0.00 175.76 179.01 1vbw n THR 43 N 0.10 1.61 -1.35 0.00 -1.04 -1.26 -4.86 114.28 107.48 1vbw n THR 43 Ca -0.15 -0.40 -0.25 0.00 -2.04 0.00 0.00 64.05 61.21 1vbw n THR 43 Cb 0.61 -1.76 -0.04 0.00 -1.82 0.00 0.00 70.33 67.33 1vbw n THR 43 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1vbw n LYS 44 N 1.13 2.27 -3.57 -2.82 4.76 -1.26 -4.86 118.16 113.81 1vbw n LYS 44 Ca 0.06 -2.17 -0.22 0.00 -2.87 0.00 0.00 58.31 53.11 1vbw n LYS 44 Cb 0.36 -2.03 -0.01 0.00 -1.84 0.00 0.00 35.03 31.51 1vbw n LYS 44 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1vbw n ASP 45 N 0.76 2.59 -4.05 4.39 3.85 -1.26 -5.14 116.55 117.70 1vbw n ASP 45 Ca 0.45 -2.59 -0.28 0.00 -0.71 0.00 0.00 54.79 51.66 1vbw n ASP 45 Cb 0.57 0.05 -0.17 0.00 -1.35 0.00 0.00 41.12 40.22 1vbw n ASP 45 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 1vbw s PHE 46 N -2.26 1.84 -0.03 2.11 2.19 -1.26 -5.01 117.98 115.55 1vbw s PHE 46 Ca 0.19 -0.82 0.01 0.00 0.33 0.00 0.00 56.93 56.64 1vbw s PHE 46 Cb -0.01 -1.33 0.02 0.00 -1.31 0.00 0.00 43.02 40.38 1vbw s PHE 46 CO 0.12 -0.42 -0.02 1.03 1.83 0.00 0.00 175.22 177.76 1vbw s ARG 47 N 0.90 0.45 0.19 10.12 1.81 -1.26 -5.03 118.95 126.13 1vbw s ARG 47 Ca -0.09 -0.00 0.25 0.00 -1.72 0.00 0.00 55.73 54.17 1vbw s ARG 47 Cb -0.15 -0.56 0.90 0.00 -0.45 0.00 0.00 34.95 34.69 1vbw s ARG 47 CO 0.00 -0.09 1.76 0.00 -0.68 0.00 0.00 175.30 176.28 1vbw n ASP 49 N -2.13 3.36 -4.27 0.00 3.85 -1.26 -4.51 116.55 111.59 1vbw n ASP 49 Ca 0.05 -1.96 -0.30 0.00 -0.71 0.00 0.00 54.79 51.87 1vbw n ASP 49 Cb 0.34 -0.26 -0.16 0.00 -1.35 0.00 0.00 41.12 39.70 1vbw n ASP 49 CO 0.00 0.00 0.00 -0.60 -1.01 0.00 0.00 177.20 175.59 1vbw s ARG 50 N -1.34 2.24 -0.23 0.11 3.52 -1.21 -1.23 118.95 120.81 1vbw s ARG 50 Ca 0.36 -0.87 -0.00 0.00 -0.13 0.00 0.00 55.73 55.09 1vbw s ARG 50 Cb 0.21 -2.01 0.06 0.00 -1.56 0.00 0.00 34.95 31.65 1vbw s ARG 50 CO 0.29 0.44 -0.02 0.08 -0.81 0.00 0.00 175.30 175.28 1vbw s VAL 51 N -0.34 1.25 0.10 7.11 1.01 -0.53 -1.08 120.40 127.92 1vbw s VAL 51 Ca 0.02 -1.09 -0.30 0.00 0.00 0.00 0.00 61.98 60.61 1vbw s VAL 51 Cb -0.12 -1.62 -0.06 0.00 0.00 0.00 0.00 36.38 34.58 1vbw s VAL 51 CO 0.01 -0.18 1.18 -0.13 0.00 0.00 0.00 175.10 175.98 1vbw s ARG 52 N 1.51 4.47 -0.41 2.72 0.52 -1.26 -0.94 118.95 125.56 1vbw s ARG 52 Ca -0.03 1.77 -0.02 0.00 -0.52 0.00 0.00 55.73 56.92 1vbw s ARG 52 Cb -0.18 -3.32 0.11 0.00 0.52 0.00 0.00 34.95 32.07 1vbw s ARG 52 CO -0.08 -0.17 0.19 0.08 0.02 0.00 0.00 175.30 175.34 1vbw s VAL 53 N 0.69 3.16 -0.16 3.52 1.01 0.33 -4.28 120.40 124.69 1vbw s VAL 53 Ca 0.56 -2.14 -0.24 0.00 0.00 0.00 0.00 61.98 60.16 1vbw s VAL 53 Cb -0.30 -3.18 -0.02 0.00 0.00 0.00 0.00 36.38 32.88 1vbw s VAL 53 CO 0.31 -0.69 0.78 0.26 0.00 0.00 0.00 175.10 175.76 1vbw s TRP 54 N 1.05 3.44 0.18 5.22 0.52 -1.26 -1.20 118.94 126.89 1vbw s TRP 54 Ca 0.09 1.20 0.09 0.00 0.02 0.00 0.00 56.10 57.50 1vbw s TRP 54 Cb -0.22 -2.95 -0.04 0.00 -1.15 0.00 0.00 33.47 29.11 1vbw s TRP 54 CO -0.05 -0.18 -0.18 0.14 0.02 0.00 0.00 176.95 176.71 1vbw s VAL 55 N 1.88 1.87 1.13 4.03 -7.23 -0.13 -0.76 120.40 121.20 1vbw s VAL 55 Ca 0.37 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.35 1vbw s VAL 55 Cb -0.17 -1.92 0.26 0.00 0.56 0.00 0.00 36.38 35.12 1vbw s VAL 55 CO 0.13 -0.36 1.18 0.42 -0.31 0.00 0.00 175.10 176.16 1vbw s THR 56 N -2.22 1.72 0.34 5.32 -4.23 0.13 -0.65 115.64 116.05 1vbw s THR 56 Ca 0.18 0.00 0.38 0.00 -1.18 0.00 0.00 61.69 61.07 1vbw s THR 56 Cb -0.05 -2.65 0.39 0.00 1.34 0.00 0.00 72.50 71.53 1vbw s THR 56 CO 0.07 0.00 2.14 -0.08 -0.54 0.00 0.00 174.62 176.22 1vbw h GLU 57 N -2.31 0.00 -0.22 3.99 4.57 -1.95 -0.11 114.58 118.56 1vbw h GLU 57 Ca -0.44 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.74 1vbw h GLU 57 Cb 1.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1vbw h GLU 57 CO 0.35 0.00 0.00 0.54 -1.18 0.00 0.00 179.01 178.72 1vbw n ARG 58 N -2.93 2.21 -0.73 1.92 1.74 -1.26 -4.96 116.66 112.66 1vbw n ARG 58 Ca -0.02 -1.81 0.00 0.00 -0.77 0.00 0.00 57.85 55.26 1vbw n ARG 58 Cb 0.14 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 1vbw n ARG 58 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vbw n GLY 59 N 1.35 0.56 3.80 -0.13 0.00 -0.05 -4.98 105.19 105.73 1vbw n GLY 59 Ca 0.17 -0.68 -0.38 0.00 0.00 0.00 0.00 46.02 45.14 1vbw n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vbw s ILE 60 N -2.00 5.14 0.08 -0.61 -1.09 -1.26 -0.62 121.20 120.84 1vbw s ILE 60 Ca 0.00 0.77 -0.31 0.00 -2.23 0.00 0.00 60.65 58.88 1vbw s ILE 60 Cb 0.00 -3.70 -0.08 0.00 -1.58 0.00 0.00 42.46 37.10 1vbw s ILE 60 CO 0.00 0.50 1.56 -0.69 -1.23 0.00 0.00 174.94 175.08 1vbw s VAL 61 N -0.45 3.10 0.00 2.92 1.01 0.52 -0.69 120.40 126.81 1vbw s VAL 61 Ca 0.22 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.84 1vbw s VAL 61 Cb -0.15 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1vbw s VAL 61 CO 0.10 0.01 0.53 0.00 0.00 0.00 0.00 175.10 175.75 1vbw n ALA 62 N 5.06 2.16 -2.88 5.51 0.00 0.07 -0.86 120.51 129.56 1vbw n ALA 62 Ca 0.14 -0.53 -0.10 0.00 0.00 0.00 0.00 53.44 52.96 1vbw n ALA 62 Cb 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 1vbw n ALA 62 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1vbw s ARG 63 N -0.15 0.47 -0.20 0.00 1.81 -1.24 -5.03 118.95 114.62 1vbw s ARG 63 Ca 0.00 -0.63 -0.29 0.00 -1.72 0.00 0.00 55.73 53.09 1vbw s ARG 63 Cb 0.00 0.18 -0.03 0.00 -0.45 0.00 0.00 34.95 34.66 1vbw s ARG 63 CO 0.00 -0.11 1.57 -1.25 -0.68 0.00 0.00 175.30 174.84 1vbw s PRO 64 N -1.96 3.89 0.25 3.54 0.04 -1.26 -4.65 135.00 134.86 1vbw s PRO 64 Ca -0.11 1.71 -0.30 0.00 0.04 0.00 0.00 61.00 62.34 1vbw s PRO 64 Cb -0.05 -4.00 -0.11 0.00 0.04 0.00 0.00 34.50 30.38 1vbw s PRO 64 CO -0.02 -1.17 1.52 -2.14 0.04 0.00 0.00 177.00 175.23 1vbw s PRO 65 N 4.46 4.20 0.00 0.56 0.02 -1.26 -4.82 135.00 138.17 1vbw s PRO 65 Ca 0.69 2.42 -0.02 0.00 0.02 0.00 0.00 61.00 64.12 1vbw s PRO 65 Cb -0.25 -3.08 -0.01 0.00 0.02 0.00 0.00 34.50 31.18 1vbw s PRO 65 CO 0.28 -0.53 0.03 0.99 -0.33 0.00 0.00 177.00 177.44 1vbw s THR 66 N 0.17 0.07 0.31 0.99 2.01 -1.26 -0.63 115.64 117.31 1vbw s THR 66 Ca 0.63 -0.59 -0.29 0.00 0.31 0.00 0.00 61.69 61.74 1vbw s THR 66 Cb -0.45 -0.25 -0.12 0.00 0.01 0.00 0.00 72.50 71.70 1vbw s THR 66 CO 0.43 -0.33 1.53 -0.38 -0.69 0.00 0.00 174.62 175.19 1vbw n ILE 67 N 1.99 1.33 0.00 1.82 5.41 -0.29 -4.06 119.36 125.56 1vbw n ILE 67 Ca -0.20 -0.33 0.00 0.00 1.00 0.00 0.00 62.75 63.22 1vbw n ILE 67 Cb 0.56 -1.89 0.00 0.00 -0.71 0.00 0.00 39.64 37.60 1vbw n ILE 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16