#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iyv s GLU 2 N 0.00 0.23 0.28 4.33 2.02 -1.22 -5.05 118.70 119.29 1iyv s GLU 2 Ca 0.00 -0.17 -0.10 0.00 0.02 0.00 0.00 54.97 54.72 1iyv s GLU 2 Cb 0.00 -0.18 -0.07 0.00 0.10 0.00 0.00 34.13 33.98 1iyv s GLU 2 CO 0.00 0.05 0.62 -1.50 0.02 0.00 0.00 175.26 174.44 1iyv s ILE 3 N -0.23 4.88 -0.31 -1.63 2.07 -1.26 -3.20 121.20 121.51 1iyv s ILE 3 Ca -0.01 0.51 -0.01 0.00 -1.41 0.00 0.00 60.65 59.74 1iyv s ILE 3 Cb -0.02 -3.65 0.06 0.00 0.13 0.00 0.00 42.46 38.98 1iyv s ILE 3 CO -0.00 -0.20 0.01 -0.63 -1.91 0.00 0.00 174.94 172.21 1iyv s ILE 4 N -1.97 2.84 0.54 2.00 -1.09 -0.76 -5.00 121.20 117.75 1iyv s ILE 4 Ca 0.49 -1.60 0.00 0.00 -2.23 0.00 0.00 60.65 57.31 1iyv s ILE 4 Cb -0.11 -2.72 0.02 0.00 -1.58 0.00 0.00 42.46 38.08 1iyv s ILE 4 CO 0.23 -0.21 0.77 0.00 -1.23 0.00 0.00 174.94 174.50 1iyv s ARG 5 N 1.18 2.68 0.31 2.79 1.70 -1.26 -1.50 118.95 124.85 1iyv s ARG 5 Ca -0.03 -0.62 -0.26 0.00 -0.47 0.00 0.00 55.73 54.36 1iyv s ARG 5 Cb -0.20 -2.47 -0.15 0.00 -0.57 0.00 0.00 34.95 31.56 1iyv s ARG 5 CO -0.03 -0.63 0.61 0.28 -1.08 0.00 0.00 175.30 174.45 1iyv n VAL 6 N -2.33 1.79 -0.97 4.99 0.31 -0.74 -4.83 118.33 116.56 1iyv n VAL 6 Ca 0.06 -0.50 -0.02 0.00 -0.01 0.00 0.00 64.34 63.87 1iyv n VAL 6 Cb 0.59 -0.40 0.01 0.00 -0.91 0.00 0.00 33.84 33.13 1iyv n VAL 6 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1iyv n PRO 7 N 0.85 -0.27 -2.75 5.55 -0.04 -1.26 -4.51 135.00 132.57 1iyv n PRO 7 Ca 0.13 -0.13 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 1iyv n PRO 7 Cb 0.32 -0.09 -0.04 0.00 -0.04 0.00 0.00 33.50 33.66 1iyv n PRO 7 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1iyv s ASP 8 N -1.38 6.23 -0.09 3.54 2.15 -1.26 -4.82 116.67 121.03 1iyv s ASP 8 Ca 0.05 -0.60 -0.11 0.00 0.43 0.00 0.00 52.55 52.32 1iyv s ASP 8 Cb -0.00 -2.47 -0.04 0.00 -0.30 0.00 0.00 42.92 40.11 1iyv s ASP 8 CO 0.03 -1.50 -0.21 2.30 -0.17 0.00 0.00 175.17 175.62 1iyv n ILE 9 N 6.17 1.19 0.00 4.11 -5.35 -1.26 -5.05 119.36 119.18 1iyv n ILE 9 Ca 0.00 0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.72 1iyv n ILE 9 Cb 0.47 -2.02 0.00 0.00 -1.74 0.00 0.00 39.64 36.35 1iyv n ILE 9 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1iyv n GLY 10 N 2.01 1.62 0.00 3.28 0.00 -1.26 -5.07 105.19 105.76 1iyv n GLY 10 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1iyv n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iyv n GLY 11 N -0.03 3.27 3.53 -0.02 0.00 -1.26 -5.15 105.19 105.53 1iyv n GLY 11 Ca 0.00 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 1iyv n GLY 11 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iyv s ASP 12 N 2.00 4.51 -0.09 1.61 2.15 -1.26 -4.34 116.67 121.24 1iyv s ASP 12 Ca 0.00 -0.10 -0.03 0.00 0.43 0.00 0.00 52.55 52.85 1iyv s ASP 12 Cb 0.00 -1.30 -0.03 0.00 -0.30 0.00 0.00 42.92 41.29 1iyv s ASP 12 CO 0.00 0.30 0.03 -0.83 -0.17 0.00 0.00 175.17 174.50 1iyv s GLY 13 N -0.44 1.91 -0.05 2.66 0.00 -1.15 -4.69 107.32 105.56 1iyv s GLY 13 Ca 0.06 -0.77 0.05 0.00 0.00 0.00 0.00 44.72 44.06 1iyv s GLY 13 CO 0.02 -0.52 -0.22 -0.54 0.00 0.00 0.00 173.10 171.85 1iyv s GLU 14 N -0.88 2.24 -0.00 2.90 2.02 -1.21 -2.21 118.70 121.57 1iyv s GLU 14 Ca 0.13 -0.78 -0.28 0.00 0.02 0.00 0.00 54.97 54.06 1iyv s GLU 14 Cb -0.11 -1.91 -0.04 0.00 0.10 0.00 0.00 34.13 32.17 1iyv s GLU 14 CO 0.03 0.31 0.91 0.08 0.02 0.00 0.00 175.26 176.61 1iyv s VAL 15 N -0.06 4.86 -0.23 2.63 1.01 -0.94 -1.08 120.40 126.59 1iyv s VAL 15 Ca -0.04 1.92 -0.05 0.00 0.00 0.00 0.00 61.98 63.81 1iyv s VAL 15 Cb -0.13 -4.26 -0.18 0.00 0.00 0.00 0.00 36.38 31.81 1iyv s VAL 15 CO 0.03 0.20 -0.09 -0.38 0.00 0.00 0.00 175.10 174.87 1iyv n ILE 16 N 3.72 1.57 -3.52 2.22 2.08 -0.87 -3.22 119.36 121.33 1iyv n ILE 16 Ca 0.04 -0.51 -0.15 0.00 0.56 0.00 0.00 62.75 62.69 1iyv n ILE 16 Cb 0.51 -1.63 -0.05 0.00 -0.75 0.00 0.00 39.64 37.72 1iyv n ILE 16 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1iyv s GLU 17 N -2.51 0.96 -0.33 0.38 2.12 -1.26 -4.29 118.70 113.77 1iyv s GLU 17 Ca -0.33 0.13 -0.05 0.00 0.36 0.00 0.00 54.97 55.09 1iyv s GLU 17 Cb 0.09 0.45 0.04 0.00 0.26 0.00 0.00 34.13 34.98 1iyv s GLU 17 CO 0.61 -0.32 0.07 -1.17 -0.54 0.00 0.00 175.26 173.92 1iyv s LEU 18 N -1.39 4.18 -0.81 2.70 2.96 -1.26 -3.93 118.68 121.13 1iyv s LEU 18 Ca -0.07 -1.15 -0.01 0.00 -0.22 0.00 0.00 54.13 52.68 1iyv s LEU 18 Cb -0.00 -1.83 0.36 0.00 0.50 0.00 0.00 46.19 45.22 1iyv s LEU 18 CO 0.05 -0.30 1.94 0.00 -1.32 0.00 0.00 176.35 176.72 1iyv n LEU 19 N 4.76 7.26 -3.85 -0.68 -0.00 -1.24 -4.95 117.00 118.31 1iyv n LEU 19 Ca -0.13 -4.86 -0.10 0.00 -0.00 0.00 0.00 56.01 50.92 1iyv n LEU 19 Cb 0.44 -1.01 -0.08 0.00 -0.00 0.00 0.00 43.42 42.78 1iyv n LEU 19 CO 0.30 1.80 -0.09 0.68 -0.00 0.00 0.00 177.39 180.08 1iyv s VAL 20 N -5.12 0.13 0.43 1.47 -7.23 -1.26 -4.92 120.40 103.90 1iyv s VAL 20 Ca 0.52 -1.04 0.04 0.00 -1.81 0.00 0.00 61.98 59.69 1iyv s VAL 20 Cb 0.44 -1.13 -0.05 0.00 0.56 0.00 0.00 36.38 36.20 1iyv s VAL 20 CO -0.39 -0.57 0.03 -0.75 -0.31 0.00 0.00 175.10 173.11 1iyv s LYS 21 N -3.23 1.98 0.29 4.82 2.47 -1.26 -5.11 119.74 119.69 1iyv s LYS 21 Ca 0.00 -2.18 -0.18 0.00 -1.56 0.00 0.00 55.97 52.05 1iyv s LYS 21 Cb 0.02 -1.34 -0.09 0.00 -1.46 0.00 0.00 37.83 34.96 1iyv s LYS 21 CO -0.08 -0.23 0.76 -0.08 0.16 0.00 0.00 175.35 175.89 1iyv s THR 22 N -2.93 4.59 0.00 3.43 -1.32 -1.26 -3.52 115.64 114.63 1iyv s THR 22 Ca 0.25 1.18 0.00 0.00 -1.21 0.00 0.00 61.69 61.90 1iyv s THR 22 Cb 0.06 -3.74 0.00 0.00 -1.51 0.00 0.00 72.50 67.31 1iyv s THR 22 CO 0.12 -0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.14 1iyv n GLY 23 N 0.15 0.34 3.72 6.08 0.00 -0.19 -4.89 105.19 110.39 1iyv n GLY 23 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1iyv n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1iyv s ASP 24 N -2.12 7.09 -0.43 1.61 1.11 -1.23 -4.58 116.67 118.12 1iyv s ASP 24 Ca 0.00 1.32 -0.24 0.00 0.18 0.00 0.00 52.55 53.80 1iyv s ASP 24 Cb 0.00 -2.45 0.02 0.00 1.07 0.00 0.00 42.92 41.56 1iyv s ASP 24 CO 0.00 -0.13 0.85 -0.22 1.18 0.00 0.00 175.17 176.86 1iyv s LEU 25 N 0.72 4.10 0.00 1.23 0.20 -1.26 -1.67 118.68 122.01 1iyv s LEU 25 Ca 0.41 0.16 0.00 0.00 0.69 0.00 0.00 54.13 55.39 1iyv s LEU 25 Cb -0.19 -3.10 0.02 0.00 -0.43 0.00 0.00 46.19 42.49 1iyv s LEU 25 CO 0.21 -0.92 0.14 -0.38 -0.29 0.00 0.00 176.35 175.11 1iyv n ILE 26 N 6.15 0.00 -3.74 6.68 5.41 -0.41 -4.96 119.36 128.51 1iyv n ILE 26 Ca 0.04 -0.24 -0.12 0.00 1.00 0.00 0.00 62.75 63.43 1iyv n ILE 26 Cb 0.48 -1.21 -0.11 0.00 -0.71 0.00 0.00 39.64 38.09 1iyv n ILE 26 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1iyv s GLU 27 N -2.68 0.34 -0.87 0.38 2.02 -1.26 -3.87 118.70 112.76 1iyv s GLU 27 Ca 0.10 0.56 -0.19 0.00 0.02 0.00 0.00 54.97 55.45 1iyv s GLU 27 Cb -0.01 0.05 -0.22 0.00 0.10 0.00 0.00 34.13 34.05 1iyv s GLU 27 CO 0.06 -0.10 2.33 1.55 0.02 0.00 0.00 175.26 179.12 1iyv n VAL 28 N 3.59 -0.01 0.00 2.63 3.14 -1.25 -2.44 118.33 123.98 1iyv n VAL 28 Ca -0.19 -0.49 0.00 0.00 -2.96 0.00 0.00 64.34 60.70 1iyv n VAL 28 Cb 0.56 -1.12 0.00 0.00 -1.06 0.00 0.00 33.84 32.21 1iyv n VAL 28 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1iyv n GLU 29 N 7.43 0.00 -0.66 1.45 -0.58 -1.25 -5.01 120.64 122.02 1iyv n GLU 29 Ca 0.56 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.99 1iyv n GLU 29 Cb 0.29 0.00 0.18 0.00 -0.57 0.00 0.00 31.44 31.34 1iyv n GLU 29 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 1iyv n GLN 30 N 0.00 -0.95 -1.77 3.49 7.27 -1.02 -4.73 117.38 119.67 1iyv n GLN 30 Ca 0.00 -0.23 -0.27 0.00 0.07 0.00 0.00 57.00 56.57 1iyv n GLN 30 Cb 0.00 -2.13 0.19 0.00 2.41 0.00 0.00 30.24 30.71 1iyv n GLN 30 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1iyv n GLY 31 N 0.92 -1.47 0.09 1.69 0.00 -1.26 -2.22 105.19 102.94 1iyv n GLY 31 Ca 0.08 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.39 1iyv n GLY 31 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1iyv n LEU 32 N 0.00 0.00 -3.87 0.99 0.00 -0.22 -4.29 117.00 109.61 1iyv n LEU 32 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 56.01 56.08 1iyv n LEU 32 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 43.42 43.95 1iyv n LEU 32 CO 0.39 -0.02 0.45 0.68 0.00 0.00 0.00 177.39 178.89 1iyv s VAL 33 N -1.05 0.00 -0.26 1.96 -7.23 -0.69 -3.64 120.40 109.49 1iyv s VAL 33 Ca 0.00 -1.07 -0.01 0.00 -1.81 0.00 0.00 61.98 59.09 1iyv s VAL 33 Cb 0.00 -2.37 0.08 0.00 0.56 0.00 0.00 36.38 34.65 1iyv s VAL 33 CO 0.00 0.00 0.06 -0.69 -0.31 0.00 0.00 175.10 174.16 1iyv s VAL 34 N -3.29 0.81 0.52 1.32 1.01 -1.25 -1.51 120.40 118.00 1iyv s VAL 34 Ca 0.15 -1.07 -0.03 0.00 0.00 0.00 0.00 61.98 61.03 1iyv s VAL 34 Cb -0.05 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.89 1iyv s VAL 34 CO 0.09 -0.45 0.78 -0.76 0.00 0.00 0.00 175.10 174.77 1iyv s LEU 35 N 1.68 3.44 0.26 3.92 1.02 -1.13 -2.05 118.68 125.82 1iyv s LEU 35 Ca 0.04 0.48 0.11 0.00 0.02 0.00 0.00 54.13 54.78 1iyv s LEU 35 Cb -0.17 -3.34 -0.05 0.00 0.02 0.00 0.00 46.19 42.65 1iyv s LEU 35 CO -0.17 -0.88 -0.13 -0.70 0.02 0.00 0.00 176.35 174.48 1iyv s GLU 36 N -4.77 1.90 0.43 1.70 2.12 -0.24 -1.92 118.70 117.91 1iyv s GLU 36 Ca 0.51 -1.58 0.04 0.00 0.36 0.00 0.00 54.97 54.30 1iyv s GLU 36 Cb -0.10 -1.94 -0.02 0.00 0.26 0.00 0.00 34.13 32.33 1iyv s GLU 36 CO 0.41 0.36 0.14 0.45 -0.54 0.00 0.00 175.26 176.09 1iyv s SER 37 N -3.40 2.95 0.15 -1.70 0.15 0.43 -3.29 113.70 108.99 1iyv s SER 37 Ca 0.29 -1.74 -0.30 0.00 0.70 0.00 0.00 55.95 54.89 1iyv s SER 37 Cb -0.06 0.62 -0.06 0.00 -1.71 0.00 0.00 66.02 64.81 1iyv s SER 37 CO 0.16 -1.00 1.55 0.00 1.20 0.00 0.00 173.24 175.15 1iyv h ALA 38 N 1.70 -0.61 -1.39 5.45 0.00 -2.02 -3.28 119.26 119.11 1iyv h ALA 38 Ca -0.34 0.06 -0.41 0.00 0.00 0.00 0.00 54.91 54.22 1iyv h ALA 38 Cb 1.28 1.15 -0.39 0.00 0.00 0.00 0.00 17.79 19.82 1iyv h ALA 38 CO 0.54 -0.97 -1.17 0.36 0.00 0.00 0.00 179.25 178.01 1iyv n LYS 39 N -5.36 1.07 -3.63 0.00 0.00 -1.26 -5.09 118.16 103.90 1iyv n LYS 39 Ca -0.01 -3.25 -0.05 0.00 -0.00 0.00 0.00 58.31 55.00 1iyv n LYS 39 Cb 0.33 -1.41 -0.05 0.00 -0.00 0.00 0.00 35.03 33.89 1iyv n LYS 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1iyv s ALA 40 N -2.68 -2.08 -0.12 0.58 0.00 -1.24 -5.16 121.76 111.08 1iyv s ALA 40 Ca 0.32 1.76 -0.04 0.00 0.00 0.00 0.00 51.96 54.01 1iyv s ALA 40 Cb 0.41 -1.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 1iyv s ALA 40 CO -0.02 -0.22 0.03 -1.54 0.00 0.00 0.00 175.76 174.01 1iyv s SER 41 N -0.61 5.46 0.51 0.00 1.04 -1.26 -0.43 113.70 118.41 1iyv s SER 41 Ca 0.05 0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.65 1iyv s SER 41 Cb -0.02 -1.69 -0.01 0.00 0.10 0.00 0.00 66.02 64.40 1iyv s SER 41 CO -0.07 0.33 0.01 -0.04 0.98 0.00 0.00 173.24 174.45 1iyv s MET 42 N -0.56 2.19 0.09 4.02 -1.94 -0.81 -4.98 119.30 117.31 1iyv s MET 42 Ca 0.10 -2.40 -0.00 0.00 -1.71 0.00 0.00 55.69 51.68 1iyv s MET 42 Cb -0.12 -1.46 -0.04 0.00 2.01 0.00 0.00 34.83 35.22 1iyv s MET 42 CO 0.02 -0.38 -0.02 -1.21 -0.01 0.00 0.00 175.02 173.42 1iyv s GLU 43 N -3.87 0.77 -0.31 2.03 2.02 -1.26 -2.82 118.70 115.26 1iyv s GLU 43 Ca 0.05 -1.32 -0.02 0.00 0.02 0.00 0.00 54.97 53.70 1iyv s GLU 43 Cb 0.01 0.06 0.12 0.00 0.10 0.00 0.00 34.13 34.42 1iyv s GLU 43 CO 0.03 -0.12 0.19 0.08 0.02 0.00 0.00 175.26 175.47 1iyv s VAL 44 N -3.84 -0.09 0.00 2.63 1.01 -0.57 -4.89 120.40 114.65 1iyv s VAL 44 Ca 0.13 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1iyv s VAL 44 Cb 0.07 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1iyv s VAL 44 CO -0.05 -0.74 0.00 -0.81 0.00 0.00 0.00 175.10 173.50 1iyv n PRO 45 N 4.91 -0.05 -2.86 2.72 -0.04 -1.26 -1.06 135.00 137.37 1iyv n PRO 45 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.04 1iyv n PRO 45 Cb 0.42 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.83 1iyv n PRO 45 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1iyv s SER 46 N -1.12 6.61 0.00 3.54 0.15 -0.94 -4.52 113.70 117.42 1iyv s SER 46 Ca 0.00 0.44 0.24 0.00 0.70 0.00 0.00 55.95 57.33 1iyv s SER 46 Cb 0.00 -2.44 1.40 0.00 -1.71 0.00 0.00 66.02 63.27 1iyv s SER 46 CO 0.00 -0.85 1.85 -0.81 1.20 0.00 0.00 173.24 174.63 1iyv n PRO 47 N 6.72 0.91 -3.63 5.44 -0.04 -1.26 -3.76 135.00 139.38 1iyv n PRO 47 Ca 0.06 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 1iyv n PRO 47 Cb 0.48 -1.41 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 1iyv n PRO 47 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1iyv s LYS 48 N -2.00 0.81 -0.66 0.54 2.47 -1.26 -4.96 119.74 114.68 1iyv s LYS 48 Ca 0.35 1.03 -0.26 0.00 -1.56 0.00 0.00 55.97 55.54 1iyv s LYS 48 Cb 0.16 0.36 0.04 0.00 -1.46 0.00 0.00 37.83 36.93 1iyv s LYS 48 CO 0.27 -0.11 1.13 0.00 0.16 0.00 0.00 175.35 176.81 1iyv s ALA 49 N 0.61 2.95 0.00 3.13 0.00 -1.26 -4.42 121.76 122.77 1iyv s ALA 49 Ca -0.02 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.59 1iyv s ALA 49 Cb -0.05 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 19.03 1iyv s ALA 49 CO -0.03 -2.90 0.00 0.41 0.00 0.00 0.00 175.76 173.24 1iyv n GLY 50 N 5.26 2.31 3.56 0.00 0.00 -1.25 -4.69 105.19 110.37 1iyv n GLY 50 Ca 0.02 -0.98 -0.34 0.00 0.00 0.00 0.00 46.02 44.72 1iyv n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iyv s VAL 51 N -2.95 3.67 -0.01 1.61 0.11 -1.18 -1.28 120.40 120.37 1iyv s VAL 51 Ca 0.00 -0.48 -0.33 0.00 -2.93 0.00 0.00 61.98 58.24 1iyv s VAL 51 Cb 0.00 -2.51 -0.12 0.00 -1.53 0.00 0.00 36.38 32.22 1iyv s VAL 51 CO 0.00 0.58 1.84 0.52 -3.33 0.00 0.00 175.10 174.72 1iyv n VAL 52 N 2.45 0.50 -0.12 2.04 0.31 -0.67 -1.93 118.33 120.91 1iyv n VAL 52 Ca -0.18 -0.09 -0.25 0.00 -0.01 0.00 0.00 64.34 63.81 1iyv n VAL 52 Cb 0.53 -1.91 -0.11 0.00 -0.91 0.00 0.00 33.84 31.44 1iyv n VAL 52 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1iyv n LYS 53 N 6.17 0.59 -3.86 5.55 0.00 -0.70 -1.03 118.16 124.89 1iyv n LYS 53 Ca 0.21 0.42 -0.09 0.00 0.00 0.00 0.00 58.31 58.84 1iyv n LYS 53 Cb 0.32 -1.63 -0.06 0.00 0.00 0.00 0.00 35.03 33.66 1iyv n LYS 53 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1iyv s SER 54 N -7.14 -0.04 -0.08 3.14 0.15 -1.25 -4.81 113.70 103.67 1iyv s SER 54 Ca -0.33 -0.69 0.04 0.00 0.70 0.00 0.00 55.95 55.68 1iyv s SER 54 Cb 0.10 0.46 -0.00 0.00 -1.71 0.00 0.00 66.02 64.86 1iyv s SER 54 CO 0.55 -0.90 -0.23 -0.69 1.20 0.00 0.00 173.24 173.18 1iyv s VAL 55 N -3.91 1.92 -0.17 4.45 1.01 -1.26 -2.85 120.40 119.59 1iyv s VAL 55 Ca 0.12 -0.95 0.17 0.00 0.00 0.00 0.00 61.98 61.31 1iyv s VAL 55 Cb 0.02 -1.65 0.41 0.00 0.00 0.00 0.00 36.38 35.16 1iyv s VAL 55 CO -0.04 0.53 1.28 -1.20 0.00 0.00 0.00 175.10 175.68 1iyv n SER 56 N 3.37 2.90 -3.88 3.32 7.64 -0.77 -5.01 113.62 121.18 1iyv n SER 56 Ca -0.19 -3.17 -0.09 0.00 1.01 0.00 0.00 58.87 56.43 1iyv n SER 56 Cb 0.53 -0.50 -0.07 0.00 -1.01 0.00 0.00 64.21 63.16 1iyv n SER 56 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1iyv s VAL 57 N -2.92 0.10 0.18 0.44 -7.23 -1.22 -4.81 120.40 104.94 1iyv s VAL 57 Ca 0.37 -1.20 0.09 0.00 -1.81 0.00 0.00 61.98 59.44 1iyv s VAL 57 Cb 0.32 -1.56 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 1iyv s VAL 57 CO 0.04 -0.44 -0.20 -0.75 -0.31 0.00 0.00 175.10 173.45 1iyv s LYS 58 N -3.90 1.34 0.28 4.82 2.20 -1.26 -5.09 119.74 118.13 1iyv s LYS 58 Ca 0.10 -1.45 -0.29 0.00 -0.36 0.00 0.00 55.97 53.98 1iyv s LYS 58 Cb 0.04 -1.46 -0.10 0.00 -1.51 0.00 0.00 37.83 34.80 1iyv s LYS 58 CO -0.06 0.30 1.17 -0.48 -0.36 0.00 0.00 175.35 175.92 1iyv s LEU 59 N -2.69 4.50 0.00 5.43 0.05 -1.26 -2.52 118.68 122.19 1iyv s LEU 59 Ca 0.17 2.38 0.00 0.00 0.05 0.00 0.00 54.13 56.73 1iyv s LEU 59 Cb -0.06 -3.63 0.00 0.00 -2.05 0.00 0.00 46.19 40.45 1iyv s LEU 59 CO 0.08 -0.28 0.00 0.61 -0.55 0.00 0.00 176.35 176.21 1iyv n GLY 60 N 1.24 2.46 3.83 -3.48 0.00 -1.20 -4.99 105.19 103.04 1iyv n GLY 60 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1iyv n GLY 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1iyv s ASP 61 N -2.44 6.93 -0.08 1.61 1.01 -1.05 -4.75 116.67 117.91 1iyv s ASP 61 Ca 0.00 1.52 -0.03 0.00 0.71 0.00 0.00 52.55 54.75 1iyv s ASP 61 Cb 0.00 -2.47 -0.04 0.00 1.01 0.00 0.00 42.92 41.43 1iyv s ASP 61 CO 0.00 -0.23 0.05 -1.59 0.21 0.00 0.00 175.17 173.62 1iyv s LYS 62 N -2.85 3.12 0.22 8.23 -2.85 -1.26 -2.23 119.74 122.12 1iyv s LYS 62 Ca 0.56 -0.35 0.04 0.00 -1.00 0.00 0.00 55.97 55.22 1iyv s LYS 62 Cb -0.11 -2.91 -0.05 0.00 -2.06 0.00 0.00 37.83 32.70 1iyv s LYS 62 CO 0.17 0.71 -0.03 -0.51 0.10 0.00 0.00 175.35 175.78 1iyv s LEU 63 N -1.10 2.31 0.18 2.77 1.02 -0.94 -4.97 118.68 117.95 1iyv s LEU 63 Ca 0.16 -1.17 0.09 0.00 0.02 0.00 0.00 54.13 53.23 1iyv s LEU 63 Cb -0.12 -0.35 -0.04 0.00 0.02 0.00 0.00 46.19 45.70 1iyv s LEU 63 CO 0.05 -0.44 -0.12 -0.75 0.02 0.00 0.00 176.35 175.11 1iyv s LYS 64 N -3.81 1.97 0.04 1.70 2.36 -1.26 -2.92 119.74 117.82 1iyv s LYS 64 Ca 0.26 -1.30 -0.38 0.00 -2.55 0.00 0.00 55.97 52.00 1iyv s LYS 64 Cb 0.05 -2.11 -0.19 0.00 -1.05 0.00 0.00 37.83 34.53 1iyv s LYS 64 CO 0.08 0.43 1.12 0.39 1.55 0.00 0.00 175.35 178.92 1iyv n GLU 65 N 0.12 0.38 0.00 4.03 1.02 -1.26 -1.21 120.64 123.72 1iyv n GLU 65 Ca -0.11 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1iyv n GLU 65 Cb 0.55 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 1iyv n GLU 65 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iyv n GLY 66 N 1.83 1.21 3.72 0.62 0.00 -1.26 -5.02 105.19 106.29 1iyv n GLY 66 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1iyv n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1iyv s ASP 67 N -1.84 7.15 0.46 1.61 1.11 -0.35 -4.84 116.67 119.97 1iyv s ASP 67 Ca 0.00 1.39 -0.22 0.00 0.18 0.00 0.00 52.55 53.89 1iyv s ASP 67 Cb 0.00 -2.47 -0.08 0.00 1.07 0.00 0.00 42.92 41.44 1iyv s ASP 67 CO 0.00 -0.13 1.13 0.00 1.18 0.00 0.00 175.17 177.35 1iyv s ALA 68 N 0.67 2.95 0.00 5.23 0.00 -1.26 -1.79 121.76 127.55 1iyv s ALA 68 Ca 0.42 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1iyv s ALA 68 Cb -0.19 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1iyv s ALA 68 CO 0.22 -0.56 0.00 -0.89 0.00 0.00 0.00 175.76 174.54 1iyv n ILE 69 N -0.56 0.00 -4.17 0.00 2.08 -0.56 -4.60 119.36 111.55 1iyv n ILE 69 Ca 0.08 0.36 -0.12 0.00 0.56 0.00 0.00 62.75 63.62 1iyv n ILE 69 Cb 0.49 -1.34 -0.09 0.00 -0.75 0.00 0.00 39.64 37.95 1iyv n ILE 69 CO 0.00 0.00 0.00 0.27 0.56 0.00 0.00 176.55 177.38 1iyv s ILE 70 N -0.85 0.00 -0.18 1.39 -4.36 -1.24 -1.84 121.20 114.11 1iyv s ILE 70 Ca 0.00 -1.89 0.01 0.00 -0.26 0.00 0.00 60.65 58.51 1iyv s ILE 70 Cb 0.00 -2.46 0.03 0.00 1.25 0.00 0.00 42.46 41.28 1iyv s ILE 70 CO 0.00 0.00 -0.14 -1.61 0.24 0.00 0.00 174.94 173.43 1iyv s GLU 71 N -4.03 2.41 0.10 0.37 8.01 -1.13 -1.83 118.70 122.60 1iyv s GLU 71 Ca 0.36 -0.80 -0.17 0.00 0.01 0.00 0.00 54.97 54.38 1iyv s GLU 71 Cb 0.05 -2.41 -0.07 0.00 -4.31 0.00 0.00 34.13 27.39 1iyv s GLU 71 CO 0.13 -0.32 0.55 -1.17 0.01 0.00 0.00 175.26 174.46 1iyv s LEU 72 N 1.37 4.44 -0.55 1.80 0.20 -1.19 -1.71 118.68 123.03 1iyv s LEU 72 Ca 0.02 1.16 -0.00 0.00 0.69 0.00 0.00 54.13 56.00 1iyv s LEU 72 Cb -0.15 -3.04 0.14 0.00 -0.43 0.00 0.00 46.19 42.72 1iyv s LEU 72 CO -0.10 0.20 0.33 -0.70 -0.29 0.00 0.00 176.35 175.79 1iyv s GLU 73 N -1.48 2.24 0.00 1.98 2.12 -0.81 -3.45 118.70 119.29 1iyv s GLU 73 Ca 0.32 -2.46 0.20 0.00 0.36 0.00 0.00 54.97 53.40 1iyv s GLU 73 Cb -0.17 -3.54 1.22 0.00 0.26 0.00 0.00 34.13 31.90 1iyv s GLU 73 CO 0.19 -1.13 1.73 -0.35 -0.54 0.00 0.00 175.26 175.15 1iyv n PRO 74 N 3.51 0.90 0.00 4.30 -0.04 -1.26 -3.13 135.00 139.28 1iyv n PRO 74 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1iyv n PRO 74 Cb 0.36 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1iyv n PRO 74 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iyv n ALA 75 N -0.85 0.00 -0.04 0.55 0.00 -1.26 -4.30 120.51 114.61 1iyv n ALA 75 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.46 1iyv n ALA 75 Cb 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.41 1iyv n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iyv h ALA 76 N -0.49 0.02 -2.73 0.00 0.00 -2.05 -3.45 119.26 110.57 1iyv h ALA 76 Ca 0.00 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 1iyv h ALA 76 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.67 1iyv h ALA 76 CO 0.00 -0.08 -0.34 0.20 0.00 0.00 0.00 179.25 179.02 1iyv s GLY 77 N -3.67 1.00 -0.00 0.00 0.00 -1.26 -5.14 107.32 98.26 1iyv s GLY 77 Ca -0.17 -1.28 -0.02 0.00 0.00 0.00 0.00 44.72 43.25 1iyv s GLY 77 CO 0.70 -0.99 0.04 0.00 0.00 0.00 0.00 173.10 172.85 1iyv s ALA 78 N -4.02 -0.08 0.00 3.20 0.00 -1.26 -5.10 121.76 114.50 1iyv s ALA 78 Ca 0.30 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1iyv s ALA 78 Cb 0.03 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1iyv s ALA 78 CO 0.11 -0.12 0.00 -2.13 0.00 0.00 0.00 175.76 173.62