#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 1.82 -0.02 4.33 -6.30 -1.26 -4.87 118.70 112.40 1iyv s GLU 2 Ca 0.00 -0.16 0.00 0.00 -2.50 0.00 0.00 54.97 52.32 1iyv s GLU 2 Cb 0.00 -2.03 -0.04 0.00 0.00 0.00 0.00 34.13 32.07 1iyv s GLU 2 CO 0.00 -1.60 0.02 0.42 0.02 0.00 0.00 175.26 174.12 1iyv s ILE 3 N -3.49 4.30 -0.26 -3.70 -1.09 -1.26 -3.62 121.20 112.07 1iyv s ILE 3 Ca 0.63 -0.49 -0.07 0.00 -2.23 0.00 0.00 60.65 58.49 1iyv s ILE 3 Cb -0.09 -2.90 -0.02 0.00 -1.58 0.00 0.00 42.46 37.86 1iyv s ILE 3 CO 0.48 0.42 0.06 -0.63 -1.23 0.00 0.00 174.94 174.04 1iyv s ILE 4 N -1.07 4.15 0.07 2.92 -1.09 -0.86 -5.01 121.20 120.31 1iyv s ILE 4 Ca 0.19 -0.34 0.01 0.00 -2.23 0.00 0.00 60.65 58.28 1iyv s ILE 4 Cb -0.12 -2.99 0.01 0.00 -1.58 0.00 0.00 42.46 37.78 1iyv s ILE 4 CO 0.09 0.27 0.08 0.54 -1.23 0.00 0.00 174.94 174.69 1iyv n ARG 5 N 4.90 1.12 -2.74 2.79 3.00 -1.26 -0.21 116.66 124.26 1iyv n ARG 5 Ca -0.16 -0.38 -0.38 0.00 -0.01 0.00 0.00 57.85 56.92 1iyv n ARG 5 Cb 0.50 -0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.90 1iyv n ARG 5 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1iyv s VAL 6 N 0.24 4.10 0.00 1.55 1.01 -0.28 -4.73 120.40 122.30 1iyv s VAL 6 Ca 0.06 1.88 0.00 0.00 0.00 0.00 0.00 61.98 63.91 1iyv s VAL 6 Cb -0.00 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.27 1iyv s VAL 6 CO 0.04 0.27 0.00 -0.81 0.00 0.00 0.00 175.10 174.60 1iyv n PRO 7 N 0.88 -0.05 -2.73 2.72 -0.04 -1.26 -2.52 135.00 132.00 1iyv n PRO 7 Ca 0.01 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.04 1iyv n PRO 7 Cb 0.49 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.92 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 -1.10 6.60 -0.00 3.54 2.15 -1.26 -4.48 116.67 122.12 1iyv s ASP 8 Ca 0.00 0.38 0.15 0.00 0.43 0.00 0.00 52.55 53.51 1iyv s ASP 8 Cb 0.00 -2.49 -0.17 0.00 -0.30 0.00 0.00 42.92 39.96 1iyv s ASP 8 CO 0.00 -1.08 0.61 2.30 -0.17 0.00 0.00 175.17 176.82 1iyv n ILE 9 N 6.47 0.00 -2.91 4.11 -5.35 -1.26 -4.99 119.36 115.43 1iyv n ILE 9 Ca 0.09 -0.17 -0.10 0.00 -0.27 0.00 0.00 62.75 62.31 1iyv n ILE 9 Cb 0.49 0.92 0.03 0.00 -1.74 0.00 0.00 39.64 39.34 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 1.38 0.34 0.00 3.28 0.00 -1.26 -4.90 105.19 104.03 1iyv n GLY 10 Ca 0.02 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.11 -0.36 3.97 -0.02 0.00 -1.26 -5.07 105.19 101.34 1iyv n GLY 11 Ca 0.00 -0.98 -0.24 0.00 0.00 0.00 0.00 46.02 44.80 1iyv n GLY 11 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1iyv s ASP 12 N -4.00 4.53 -0.26 1.61 1.47 -1.26 -4.32 116.67 114.45 1iyv s ASP 12 Ca 0.00 -0.02 -0.02 0.00 1.18 0.00 0.00 52.55 53.69 1iyv s ASP 12 Cb 0.00 -0.50 0.12 0.00 -0.34 0.00 0.00 42.92 42.20 1iyv s ASP 12 CO 0.00 -1.73 0.29 -0.83 0.68 0.00 0.00 175.17 173.58 1iyv s GLY 13 N -4.63 -0.16 -0.38 2.12 0.00 -1.01 -4.69 107.32 98.56 1iyv s GLY 13 Ca 0.64 0.10 -0.19 0.00 0.00 0.00 0.00 44.72 45.26 1iyv s GLY 13 CO 0.44 2.52 0.57 -0.54 0.00 0.00 0.00 173.10 176.09 1iyv s GLU 14 N 2.39 3.48 0.24 2.90 8.01 -1.15 -1.83 118.70 132.73 1iyv s GLU 14 Ca 0.09 -0.24 -0.31 0.00 0.01 0.00 0.00 54.97 54.52 1iyv s GLU 14 Cb -0.15 -3.87 -0.14 0.00 -4.31 0.00 0.00 34.13 25.67 1iyv s GLU 14 CO -0.24 -0.79 1.39 0.28 0.01 0.00 0.00 175.26 175.91 1iyv n VAL 15 N 5.59 0.95 -0.08 2.63 0.31 -0.53 -2.28 118.33 124.92 1iyv n VAL 15 Ca -0.03 -0.24 -0.16 0.00 -0.01 0.00 0.00 64.34 63.90 1iyv n VAL 15 Cb 0.48 -1.43 -0.05 0.00 -0.91 0.00 0.00 33.84 31.93 1iyv n VAL 15 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1iyv n ILE 16 N 1.87 0.92 -3.90 2.52 2.08 -0.65 -2.88 119.36 119.32 1iyv n ILE 16 Ca 0.12 -0.18 -0.10 0.00 0.56 0.00 0.00 62.75 63.15 1iyv n ILE 16 Cb 0.31 -1.74 -0.09 0.00 -0.75 0.00 0.00 39.64 37.36 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 -2.31 0.55 -0.21 0.38 2.12 -1.25 -4.35 118.70 113.63 1iyv s GLU 17 Ca -0.22 -0.62 0.02 0.00 0.36 0.00 0.00 54.97 54.51 1iyv s GLU 17 Cb 0.08 0.22 0.04 0.00 0.26 0.00 0.00 34.13 34.73 1iyv s GLU 17 CO 0.28 -0.14 -0.16 -1.17 -0.54 0.00 0.00 175.26 173.53 1iyv s LEU 18 N -1.85 2.55 -0.76 2.70 2.96 -1.26 -3.36 118.68 119.65 1iyv s LEU 18 Ca -0.09 -0.91 0.00 0.00 -0.22 0.00 0.00 54.13 52.91 1iyv s LEU 18 Cb -0.04 -1.45 0.36 0.00 0.50 0.00 0.00 46.19 45.56 1iyv s LEU 18 CO -0.02 -0.08 1.71 0.00 -1.32 0.00 0.00 176.35 176.63 1iyv n LEU 19 N 4.58 6.64 -4.19 -0.68 -0.00 -1.21 -4.98 117.00 117.15 1iyv n LEU 19 Ca -0.18 -5.07 -0.12 0.00 -0.00 0.00 0.00 56.01 50.65 1iyv n LEU 19 Cb 0.47 -0.91 -0.10 0.00 -0.00 0.00 0.00 43.42 42.89 1iyv n LEU 19 CO 0.23 1.96 -0.24 0.68 -0.00 0.00 0.00 177.39 180.02 1iyv s VAL 20 N -5.04 0.01 0.21 1.47 -7.23 -1.26 -4.88 120.40 103.68 1iyv s VAL 20 Ca 0.49 -1.98 -0.05 0.00 -1.81 0.00 0.00 61.98 58.62 1iyv s VAL 20 Cb 0.38 -2.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.85 1iyv s VAL 20 CO -0.30 -0.05 0.25 -0.75 -0.31 0.00 0.00 175.10 173.94 1iyv s LYS 21 N -4.15 1.29 0.01 4.82 2.47 -1.26 -5.10 119.74 117.82 1iyv s LYS 21 Ca 0.37 -1.46 -0.26 0.00 -1.56 0.00 0.00 55.97 53.06 1iyv s LYS 21 Cb 0.07 0.34 -0.05 0.00 -1.46 0.00 0.00 37.83 36.73 1iyv s LYS 21 CO 0.11 -0.46 0.80 -0.08 0.16 0.00 0.00 175.35 175.87 1iyv s THR 22 N -4.09 4.82 0.00 3.43 -1.32 -1.26 -3.32 115.64 113.90 1iyv s THR 22 Ca 0.31 1.68 0.00 0.00 -1.21 0.00 0.00 61.69 62.47 1iyv s THR 22 Cb 0.04 -4.14 0.00 0.00 -1.51 0.00 0.00 72.50 66.89 1iyv s THR 22 CO 0.09 0.30 0.00 0.61 -2.21 0.00 0.00 174.62 173.41 1iyv n GLY 23 N 2.66 1.10 3.74 6.08 0.00 -1.10 -4.94 105.19 112.73 1iyv n GLY 23 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.08 7.25 -0.33 1.61 1.11 -1.21 -4.64 116.67 117.38 1iyv s ASP 24 Ca 0.00 1.49 -0.17 0.00 0.18 0.00 0.00 52.55 54.05 1iyv s ASP 24 Cb 0.00 -2.48 -0.01 0.00 1.07 0.00 0.00 42.92 41.49 1iyv s ASP 24 CO 0.00 -0.01 0.47 -0.22 1.18 0.00 0.00 175.17 176.59 1iyv s LEU 25 N 0.01 4.28 0.00 1.23 0.20 -1.26 -1.74 118.68 121.40 1iyv s LEU 25 Ca 0.40 0.06 -0.00 0.00 0.69 0.00 0.00 54.13 55.27 1iyv s LEU 25 Cb -0.21 -2.53 0.02 0.00 -0.43 0.00 0.00 46.19 43.04 1iyv s LEU 25 CO 0.24 -0.39 0.15 -0.38 -0.29 0.00 0.00 176.35 175.67 1iyv n ILE 26 N 5.32 0.00 -3.87 6.68 5.41 -0.29 -4.92 119.36 127.68 1iyv n ILE 26 Ca -0.06 -0.21 -0.09 0.00 1.00 0.00 0.00 62.75 63.40 1iyv n ILE 26 Cb 0.49 -1.41 -0.08 0.00 -0.71 0.00 0.00 39.64 37.94 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 -2.86 0.81 -1.13 0.38 2.02 -1.26 -3.84 118.70 112.82 1iyv s GLU 27 Ca 0.09 -0.95 -0.22 0.00 0.02 0.00 0.00 54.97 53.92 1iyv s GLU 27 Cb -0.00 0.33 -0.03 0.00 0.10 0.00 0.00 34.13 34.52 1iyv s GLU 27 CO 0.06 -0.25 1.85 0.54 0.02 0.00 0.00 175.26 177.48 1iyv s VAL 28 N -3.73 3.68 0.00 2.63 0.11 -1.26 -2.81 120.40 119.02 1iyv s VAL 28 Ca 0.04 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.10 1iyv s VAL 28 Cb 0.04 -4.63 0.00 0.00 -1.53 0.00 0.00 36.38 30.27 1iyv s VAL 28 CO -0.10 -1.30 0.00 -1.84 -3.33 0.00 0.00 175.10 168.53 1iyv n GLU 29 N 8.49 0.00 -2.61 1.54 0.28 -1.26 -5.03 120.64 122.05 1iyv n GLU 29 Ca 0.43 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 57.09 1iyv n GLU 29 Cb 0.47 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.30 1iyv n GLU 29 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 177.13 175.83 1iyv s GLN 30 N 0.00 4.02 0.84 3.44 0.74 -1.12 -4.88 119.66 122.71 1iyv s GLN 30 Ca 0.00 1.35 -0.14 0.00 0.05 0.00 0.00 55.36 56.62 1iyv s GLN 30 Cb 0.00 -2.27 0.22 0.00 1.10 0.00 0.00 33.01 32.06 1iyv s GLN 30 CO 0.00 -0.24 0.50 0.41 -0.55 0.00 0.00 175.29 175.42 1iyv n GLY 31 N -0.13 -3.82 2.01 2.59 0.00 -1.26 -1.68 105.19 102.91 1iyv n GLY 31 Ca 0.07 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.28 -4.39 0.99 7.94 0.63 -3.86 117.00 118.04 1iyv n LEU 32 Ca 0.08 0.10 -0.20 0.00 -1.11 0.00 0.00 56.01 54.88 1iyv n LEU 32 Cb 0.35 0.45 -0.10 0.00 0.53 0.00 0.00 43.42 44.65 1iyv n LEU 32 CO 0.23 -0.48 -0.25 0.68 -1.11 0.00 0.00 177.39 176.46 1iyv s VAL 33 N -1.14 0.77 -0.37 1.96 -7.23 -0.87 -3.32 120.40 110.19 1iyv s VAL 33 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1iyv s VAL 33 Cb 0.00 -2.65 0.13 0.00 0.56 0.00 0.00 36.38 34.42 1iyv s VAL 33 CO 0.00 0.00 0.19 -0.69 -0.31 0.00 0.00 175.10 174.29 1iyv s VAL 34 N -3.51 0.79 0.24 1.32 1.01 -1.21 -1.57 120.40 117.46 1iyv s VAL 34 Ca 0.35 -1.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.31 1iyv s VAL 34 Cb 0.07 -1.57 -0.07 0.00 0.00 0.00 0.00 36.38 34.81 1iyv s VAL 34 CO 0.15 -0.87 0.58 -0.76 0.00 0.00 0.00 175.10 174.20 1iyv s LEU 35 N 0.97 4.16 -0.05 3.92 1.02 -1.24 -1.63 118.68 125.82 1iyv s LEU 35 Ca 0.15 0.98 0.04 0.00 0.02 0.00 0.00 54.13 55.33 1iyv s LEU 35 Cb -0.22 -3.73 -0.02 0.00 0.02 0.00 0.00 46.19 42.23 1iyv s LEU 35 CO -0.07 -0.09 -0.16 -0.70 0.02 0.00 0.00 176.35 175.35 1iyv s GLU 36 N -2.81 2.51 0.41 1.70 2.12 -0.96 -2.03 118.70 119.63 1iyv s GLU 36 Ca 0.48 -0.74 0.03 0.00 0.36 0.00 0.00 54.97 55.11 1iyv s GLU 36 Cb -0.11 -2.34 -0.01 0.00 0.26 0.00 0.00 34.13 31.93 1iyv s GLU 36 CO 0.20 0.58 0.12 -1.13 -0.54 0.00 0.00 175.26 174.49 1iyv n SER 37 N 2.44 1.49 0.06 -1.70 3.41 -1.11 -2.95 113.62 115.25 1iyv n SER 37 Ca -0.17 -3.11 0.09 0.00 -0.26 0.00 0.00 58.87 55.42 1iyv n SER 37 Cb 0.52 0.91 0.38 0.00 -0.26 0.00 0.00 64.21 65.77 1iyv n SER 37 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iyv n ALA 38 N -1.17 1.65 -0.11 7.33 0.00 -1.26 -3.15 120.51 123.80 1iyv n ALA 38 Ca -0.16 0.01 -0.24 0.00 0.00 0.00 0.00 53.44 53.05 1iyv n ALA 38 Cb 0.60 -1.30 -0.11 0.00 0.00 0.00 0.00 19.45 18.64 1iyv n ALA 38 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1iyv n LYS 39 N -1.81 0.58 0.00 0.00 5.02 -1.26 -5.09 118.16 115.60 1iyv n LYS 39 Ca 0.03 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 1iyv n LYS 39 Cb 0.19 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1iyv n LYS 39 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1iyv n ALA 40 N -3.59 0.00 -2.71 7.82 0.00 -1.19 -5.12 120.51 115.72 1iyv n ALA 40 Ca -0.37 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.65 1iyv n ALA 40 Cb 0.74 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.16 1iyv n ALA 40 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1iyv s SER 41 N 0.00 7.25 -0.27 0.00 0.01 -1.26 -2.74 113.70 116.69 1iyv s SER 41 Ca 0.00 1.51 0.01 0.00 1.31 0.00 0.00 55.95 58.78 1iyv s SER 41 Cb 0.00 -2.53 0.08 0.00 0.21 0.00 0.00 66.02 63.78 1iyv s SER 41 CO 0.00 -0.27 0.01 -0.04 0.41 0.00 0.00 173.24 173.36 1iyv s MET 42 N 1.18 1.27 0.56 12.44 1.00 -0.86 -5.02 119.30 129.87 1iyv s MET 42 Ca 0.48 -1.11 -0.14 0.00 0.00 0.00 0.00 55.69 54.92 1iyv s MET 42 Cb -0.20 -2.49 -0.06 0.00 0.00 0.00 0.00 34.83 32.08 1iyv s MET 42 CO 0.24 -0.76 1.00 -1.83 0.00 0.00 0.00 175.02 173.67 1iyv s GLU 43 N 1.41 3.80 -0.00 2.03 -1.05 -1.26 -3.63 118.70 120.01 1iyv s GLU 43 Ca 0.02 0.87 0.02 0.00 -0.15 0.00 0.00 54.97 55.73 1iyv s GLU 43 Cb -0.18 -2.11 -0.01 0.00 -0.44 0.00 0.00 34.13 31.39 1iyv s GLU 43 CO -0.12 -0.39 -0.08 0.08 0.95 0.00 0.00 175.26 175.70 1iyv s VAL 44 N -2.86 0.63 0.00 1.83 1.01 -0.61 -4.97 120.40 115.43 1iyv s VAL 44 Ca 0.57 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1iyv s VAL 44 Cb -0.10 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.74 1iyv s VAL 44 CO 0.41 0.15 0.00 -0.81 0.00 0.00 0.00 175.10 174.85 1iyv n PRO 45 N 2.82 0.03 -2.98 2.72 -0.04 -1.26 0.23 135.00 136.52 1iyv n PRO 45 Ca -0.14 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.92 1iyv n PRO 45 Cb 0.57 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.99 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 -1.08 7.07 0.00 3.54 0.15 -0.67 -4.32 113.70 118.38 1iyv s SER 46 Ca 0.00 1.28 0.29 0.00 0.70 0.00 0.00 55.95 58.23 1iyv s SER 46 Cb 0.00 -2.44 1.66 0.00 -1.71 0.00 0.00 66.02 63.52 1iyv s SER 46 CO 0.00 -0.15 2.06 -0.81 1.20 0.00 0.00 173.24 175.54 1iyv n PRO 47 N 3.82 0.75 -3.64 5.44 -0.04 -1.26 -4.51 135.00 135.56 1iyv n PRO 47 Ca 0.00 0.01 -0.06 0.00 -0.04 0.00 0.00 63.50 63.41 1iyv n PRO 47 Cb 0.51 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.41 1iyv n PRO 47 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1iyv s LYS 48 N -2.19 0.69 -1.12 0.54 1.02 -1.26 -5.06 119.74 112.36 1iyv s LYS 48 Ca 0.39 1.25 -0.21 0.00 0.02 0.00 0.00 55.97 57.42 1iyv s LYS 48 Cb 0.20 0.24 0.06 0.00 -0.52 0.00 0.00 37.83 37.81 1iyv s LYS 48 CO 0.37 -0.16 1.55 0.00 -0.92 0.00 0.00 175.35 176.20 1iyv s ALA 49 N 1.81 2.94 0.00 5.17 0.00 -1.26 -4.64 121.76 125.78 1iyv s ALA 49 Ca -0.09 -2.51 0.00 0.00 0.00 0.00 0.00 51.96 49.36 1iyv s ALA 49 Cb -0.06 -4.57 0.00 0.00 0.00 0.00 0.00 23.12 18.49 1iyv s ALA 49 CO -0.20 -3.50 0.00 0.41 0.00 0.00 0.00 175.76 172.48 1iyv n GLY 50 N 6.33 3.79 3.73 0.00 0.00 -1.25 -4.90 105.19 112.89 1iyv n GLY 50 Ca 0.39 -1.35 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.07 4.66 0.13 1.61 0.11 -1.26 -1.13 120.40 122.45 1iyv s VAL 51 Ca 0.00 -0.11 -0.33 0.00 -2.93 0.00 0.00 61.98 58.61 1iyv s VAL 51 Cb 0.00 -2.99 -0.13 0.00 -1.53 0.00 0.00 36.38 31.73 1iyv s VAL 51 CO 0.00 0.60 1.69 0.52 -3.33 0.00 0.00 175.10 174.59 1iyv n VAL 52 N 2.17 0.14 0.39 2.04 0.31 -0.71 -1.68 118.33 120.99 1iyv n VAL 52 Ca -0.19 -0.03 0.10 0.00 -0.01 0.00 0.00 64.34 64.22 1iyv n VAL 52 Cb 0.54 -1.77 -0.14 0.00 -0.91 0.00 0.00 33.84 31.55 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 4.35 0.48 0.00 5.55 3.00 -0.89 -2.72 118.16 127.92 1iyv n LYS 53 Ca 0.18 -0.11 0.00 0.00 -0.00 0.00 0.00 58.31 58.37 1iyv n LYS 53 Cb 0.32 -1.49 0.00 0.00 0.00 0.00 0.00 35.03 33.86 1iyv n LYS 53 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1iyv n SER 54 N -1.93 0.00 -4.86 3.14 7.64 -1.26 -4.96 113.62 111.40 1iyv n SER 54 Ca -0.01 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.52 1iyv n SER 54 Cb 0.46 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.59 1iyv n SER 54 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1iyv s VAL 55 N -1.53 5.30 -0.04 0.44 1.01 -1.26 -1.57 120.40 122.74 1iyv s VAL 55 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 61.98 62.05 1iyv s VAL 55 Cb 0.00 -3.36 0.09 0.00 0.00 0.00 0.00 36.38 33.12 1iyv s VAL 55 CO 0.00 0.51 1.02 -1.20 0.00 0.00 0.00 175.10 175.43 1iyv n SER 56 N 1.64 1.93 -4.00 3.32 7.64 -1.09 -4.99 113.62 118.07 1iyv n SER 56 Ca -0.17 -2.30 -0.10 0.00 1.01 0.00 0.00 58.87 57.32 1iyv n SER 56 Cb 0.54 -0.15 -0.07 0.00 -1.01 0.00 0.00 64.21 63.52 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 -1.52 0.04 0.37 0.44 -7.23 -1.24 -4.85 120.40 106.41 1iyv s VAL 57 Ca 0.10 -1.46 0.04 0.00 -1.81 0.00 0.00 61.98 58.86 1iyv s VAL 57 Cb 0.09 -2.01 -0.06 0.00 0.56 0.00 0.00 36.38 34.96 1iyv s VAL 57 CO 0.01 -0.18 0.05 -0.75 -0.31 0.00 0.00 175.10 173.91 1iyv s LYS 58 N -4.00 1.80 -0.25 4.82 2.20 -1.26 -5.08 119.74 117.97 1iyv s LYS 58 Ca 0.21 -2.02 -0.29 0.00 -0.36 0.00 0.00 55.97 53.51 1iyv s LYS 58 Cb 0.03 -1.10 0.01 0.00 -1.51 0.00 0.00 37.83 35.26 1iyv s LYS 58 CO 0.04 -0.19 1.10 -0.48 -0.36 0.00 0.00 175.35 175.46 1iyv s LEU 59 N -3.58 4.06 0.00 5.43 2.34 -1.26 -2.91 118.68 122.75 1iyv s LEU 59 Ca 0.33 1.33 0.00 0.00 0.06 0.00 0.00 54.13 55.85 1iyv s LEU 59 Cb 0.08 -3.54 0.00 0.00 -0.56 0.00 0.00 46.19 42.17 1iyv s LEU 59 CO 0.15 -0.76 0.00 0.61 -1.06 0.00 0.00 176.35 175.29 1iyv n GLY 60 N 3.57 0.87 3.78 -3.48 0.00 -1.14 -4.99 105.19 103.80 1iyv n GLY 60 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.90 5.75 -0.28 1.61 1.01 -1.15 -4.64 116.67 117.08 1iyv s ASP 61 Ca 0.00 2.09 -0.11 0.00 0.71 0.00 0.00 52.55 55.24 1iyv s ASP 61 Cb 0.00 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 1iyv s ASP 61 CO 0.00 -1.20 0.18 -0.75 0.21 0.00 0.00 175.17 173.62 1iyv s LYS 62 N -3.43 3.95 0.02 8.23 2.20 -1.26 -1.46 119.74 127.99 1iyv s LYS 62 Ca 0.71 -0.32 0.04 0.00 -0.36 0.00 0.00 55.97 56.03 1iyv s LYS 62 Cb -0.22 -3.64 -0.02 0.00 -1.51 0.00 0.00 37.83 32.44 1iyv s LYS 62 CO 0.28 -0.17 -0.12 -0.51 -0.36 0.00 0.00 175.35 174.47 1iyv s LEU 63 N 1.72 2.12 0.13 5.43 2.01 -0.76 -4.98 118.68 124.35 1iyv s LEU 63 Ca 0.07 -0.37 0.04 0.00 0.01 0.00 0.00 54.13 53.88 1iyv s LEU 63 Cb -0.16 -0.55 -0.04 0.00 0.01 0.00 0.00 46.19 45.45 1iyv s LEU 63 CO 0.10 0.05 0.13 -0.75 1.01 0.00 0.00 176.35 176.90 1iyv s LYS 64 N -0.84 2.95 0.33 1.70 2.20 -1.26 -2.42 119.74 122.40 1iyv s LYS 64 Ca 0.02 -0.78 -0.24 0.00 -0.36 0.00 0.00 55.97 54.60 1iyv s LYS 64 Cb -0.07 -2.71 -0.15 0.00 -1.51 0.00 0.00 37.83 33.40 1iyv s LYS 64 CO 0.01 0.52 0.45 -0.85 -0.36 0.00 0.00 175.35 175.11 1iyv n GLU 65 N -0.09 0.31 0.00 4.03 0.28 -1.26 -1.36 120.64 122.55 1iyv n GLU 65 Ca -0.08 0.11 0.00 0.00 -0.16 0.00 0.00 57.16 57.03 1iyv n GLU 65 Cb 0.54 -1.24 0.00 0.00 1.43 0.00 0.00 31.44 32.17 1iyv n GLU 65 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1iyv n GLY 66 N 1.95 2.86 3.72 -1.84 0.00 -1.05 -4.93 105.19 105.91 1iyv n GLY 66 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.25 7.07 1.00 1.61 1.11 -0.46 -4.71 116.67 121.04 1iyv s ASP 67 Ca 0.00 1.29 -0.16 0.00 0.18 0.00 0.00 52.55 53.87 1iyv s ASP 67 Cb 0.00 -2.45 0.10 0.00 1.07 0.00 0.00 42.92 41.64 1iyv s ASP 67 CO 0.00 -0.15 -0.02 0.00 1.18 0.00 0.00 175.17 176.18 1iyv n ALA 68 N 3.81 -1.85 0.00 5.23 0.00 -1.26 -1.12 120.51 125.31 1iyv n ALA 68 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.37 1iyv n ALA 68 Cb 0.51 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.00 1iyv n ALA 68 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1iyv n ILE 69 N -4.21 0.00 -3.61 0.00 2.08 0.70 -4.46 119.36 109.87 1iyv n ILE 69 Ca 0.03 0.00 -0.07 0.00 0.56 0.00 0.00 62.75 63.27 1iyv n ILE 69 Cb 0.45 -0.26 0.02 0.00 -0.75 0.00 0.00 39.64 39.09 1iyv n ILE 69 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 1iyv n ILE 70 N -2.30 0.00 -4.35 1.39 -5.35 -1.08 -2.66 119.36 105.02 1iyv n ILE 70 Ca 0.00 -0.78 -0.18 0.00 -0.27 0.00 0.00 62.75 61.52 1iyv n ILE 70 Cb 0.00 0.72 -0.10 0.00 -1.74 0.00 0.00 39.64 38.52 1iyv n ILE 70 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1iyv s GLU 71 N -2.13 1.34 -0.05 6.28 2.02 -0.61 -2.03 118.70 123.52 1iyv s GLU 71 Ca 0.13 -1.62 -0.03 0.00 0.02 0.00 0.00 54.97 53.46 1iyv s GLU 71 Cb -0.03 -0.98 0.02 0.00 0.10 0.00 0.00 34.13 33.24 1iyv s GLU 71 CO 0.09 0.10 0.12 -1.17 0.02 0.00 0.00 175.26 174.42 1iyv s LEU 72 N -3.32 1.22 -0.60 1.80 0.20 -1.24 -2.10 118.68 114.65 1iyv s LEU 72 Ca 0.24 0.25 -0.01 0.00 0.69 0.00 0.00 54.13 55.30 1iyv s LEU 72 Cb 0.02 0.36 0.15 0.00 -0.43 0.00 0.00 46.19 46.29 1iyv s LEU 72 CO 0.07 -0.08 0.39 -0.70 -0.29 0.00 0.00 176.35 175.74 1iyv s GLU 73 N 0.52 2.40 -0.42 1.98 2.12 -0.67 -3.99 118.70 120.64 1iyv s GLU 73 Ca -0.04 -2.57 -0.29 0.00 0.36 0.00 0.00 54.97 52.43 1iyv s GLU 73 Cb -0.05 -3.61 0.02 0.00 0.26 0.00 0.00 34.13 30.74 1iyv s GLU 73 CO -0.02 -1.16 1.23 -1.25 -0.54 0.00 0.00 175.26 173.52 1iyv s PRO 74 N -0.15 3.74 0.00 4.30 0.04 -1.26 -4.01 135.00 137.65 1iyv s PRO 74 Ca 0.17 0.80 0.00 0.00 0.04 0.00 0.00 61.00 62.02 1iyv s PRO 74 Cb -0.22 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1iyv s PRO 74 CO -0.02 -1.36 0.00 0.00 0.04 0.00 0.00 177.00 175.66 1iyv n ALA 75 N 8.00 2.04 -3.32 8.56 0.00 -1.26 -4.94 120.51 129.59 1iyv n ALA 75 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.31 1iyv n ALA 75 Cb 0.48 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.96 1iyv n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iyv n ALA 76 N -1.06 -2.44 0.00 0.00 0.00 -1.26 -4.44 120.51 111.31 1iyv n ALA 76 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1iyv n ALA 76 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.17 1iyv n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iyv n GLY 77 N 0.02 0.68 3.66 0.00 0.00 -1.26 -5.00 105.19 103.29 1iyv n GLY 77 Ca -0.03 -1.23 -0.04 0.00 0.00 0.00 0.00 46.02 44.72 1iyv n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iyv s ALA 78 N -2.00 -1.83 0.00 4.61 0.00 -1.26 -5.23 121.76 116.05 1iyv s ALA 78 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1iyv s ALA 78 Cb 0.00 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.60 1iyv s ALA 78 CO 0.00 -0.93 0.00 -2.13 0.00 0.00 0.00 175.76 172.70