#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ava s LYS 2 N 0.00 3.42 0.29 0.00 -0.14 -1.26 -4.77 119.74 117.28 2ava s LYS 2 Ca 0.00 2.08 0.04 0.00 -1.36 0.00 0.00 55.97 56.73 2ava s LYS 2 Cb 0.00 -2.35 0.66 0.00 -1.68 0.00 0.00 37.83 34.46 2ava s LYS 2 CO 0.00 -0.92 1.79 0.87 -0.76 0.00 0.00 175.35 176.33 2ava h LYS 3 N 1.77 0.77 -0.90 1.68 1.57 -2.02 0.23 116.57 119.67 2ava h LYS 3 Ca -0.50 -0.05 0.16 0.00 -1.87 0.00 0.00 60.65 58.39 2ava h LYS 3 Cb 1.28 -0.17 -0.10 0.00 0.08 0.00 0.00 32.23 33.32 2ava h LYS 3 CO 0.59 0.51 0.49 1.05 -0.57 0.00 0.00 179.45 181.52 2ava h GLU 4 N 0.79 0.66 0.03 3.15 4.11 -1.99 0.17 114.58 121.50 2ava h GLU 4 Ca 0.54 -0.04 -0.12 0.00 0.07 0.00 0.00 59.36 59.81 2ava h GLU 4 Cb 0.77 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.88 2ava h GLU 4 CO -0.35 0.44 -0.50 1.15 0.07 0.00 0.00 179.01 179.82 2ava h THR 5 N 0.68 1.51 -0.72 -1.06 2.02 -1.37 -2.85 112.91 111.12 2ava h THR 5 Ca 0.50 -2.15 0.09 0.00 0.77 0.00 0.00 66.41 65.62 2ava h THR 5 Cb 0.71 2.83 -0.07 0.00 -1.74 0.00 0.00 68.15 69.88 2ava h THR 5 CO -0.36 0.61 0.38 0.40 0.37 0.00 0.00 175.52 176.91 2ava h ILE 6 N -0.34 0.88 -0.43 3.11 2.04 -0.54 -0.53 117.51 121.71 2ava h ILE 6 Ca -0.07 -0.22 -0.10 0.00 1.00 0.00 0.00 64.86 65.47 2ava h ILE 6 Cb 1.27 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2ava h ILE 6 CO 0.10 0.12 -0.14 0.44 0.00 0.00 0.00 178.15 178.66 2ava h ASP 7 N 0.65 0.79 0.46 1.72 5.19 -0.78 -2.37 116.42 122.08 2ava h ASP 7 Ca 0.35 -0.25 -0.02 0.00 -0.62 0.00 0.00 57.03 56.48 2ava h ASP 7 Cb 0.33 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.63 2ava h ASP 7 CO -0.25 0.94 -0.22 0.11 -3.12 0.00 0.00 179.24 176.71 2ava h LYS 8 N 0.71 -0.59 -0.74 3.56 1.79 -1.01 -2.66 116.57 117.63 2ava h LYS 8 Ca 0.11 0.04 0.10 0.00 -2.18 0.00 0.00 60.65 58.72 2ava h LYS 8 Cb 0.64 0.13 -0.07 0.00 -1.58 0.00 0.00 32.23 31.35 2ava h LYS 8 CO 0.04 -0.32 0.38 0.28 -1.08 0.00 0.00 179.45 178.75 2ava h VAL 9 N -0.76 0.85 -0.16 0.50 2.07 -1.14 0.61 116.25 118.22 2ava h VAL 9 Ca -0.06 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.29 2ava h VAL 9 Cb 0.54 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2ava h VAL 9 CO 0.10 0.12 0.14 0.28 0.02 0.00 0.00 177.57 178.22 2ava h SER 10 N 0.64 0.00 -0.07 0.57 0.02 -1.33 -1.89 113.55 111.49 2ava h SER 10 Ca 0.37 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.22 2ava h SER 10 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2ava h SER 10 CO -0.27 0.00 -0.34 -0.78 -1.14 0.00 0.00 176.83 174.29 2ava h ASP 11 N 0.00 0.42 -0.92 3.07 1.82 -0.52 -3.00 116.42 117.28 2ava h ASP 11 Ca 0.08 -0.66 0.21 0.00 -0.39 0.00 0.00 57.03 56.27 2ava h ASP 11 Cb 0.35 -0.12 -0.07 0.00 0.68 0.00 0.00 39.33 40.16 2ava h ASP 11 CO -0.00 1.01 0.61 0.40 -1.61 0.00 0.00 179.24 179.64 2ava h ILE 12 N -0.14 0.67 -0.20 2.25 5.03 -0.96 0.78 117.51 124.93 2ava h ILE 12 Ca -0.02 -0.15 -0.21 0.00 -0.12 0.00 0.00 64.86 64.36 2ava h ILE 12 Cb 1.00 0.20 0.01 0.00 -3.03 0.00 0.00 36.82 35.00 2ava h ILE 12 CO 0.07 0.08 -0.69 0.58 -0.68 0.00 0.00 178.15 177.51 2ava h VAL 13 N 0.43 1.28 -0.44 1.67 2.07 -1.52 -3.19 116.25 116.54 2ava h VAL 13 Ca 0.49 -1.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.08 2ava h VAL 13 Cb 1.18 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 32.78 2ava h VAL 13 CO -0.20 0.60 0.11 0.11 0.02 0.00 0.00 177.57 178.21 2ava h LYS 14 N 0.58 0.71 -0.22 1.57 1.57 -0.78 -2.42 116.57 117.58 2ava h LYS 14 Ca -0.03 -0.17 0.07 0.00 -1.87 0.00 0.00 60.65 58.65 2ava h LYS 14 Cb 1.30 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 2ava h LYS 14 CO 0.14 0.71 0.22 0.93 -0.57 0.00 0.00 179.45 180.89 2ava h GLU 15 N 0.59 0.00 -0.57 3.15 4.39 -1.13 0.34 114.58 121.35 2ava h GLU 15 Ca 0.14 0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.93 2ava h GLU 15 Cb 0.32 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.90 2ava h GLU 15 CO 0.00 0.00 0.19 0.87 -1.16 0.00 0.00 179.01 178.91 2ava h LYS 16 N 0.00 0.35 0.00 2.33 1.79 -1.42 -2.86 116.57 116.76 2ava h LYS 16 Ca 0.11 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 2ava h LYS 16 Cb 0.55 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 2ava h LYS 16 CO -0.00 0.23 -0.23 1.47 -1.08 0.00 0.00 179.45 179.84 2ava n LEU 17 N -5.03 2.30 -3.13 2.94 -0.00 -0.69 -5.02 117.00 108.37 2ava n LEU 17 Ca 0.08 -3.22 -0.07 0.00 -0.00 0.00 0.00 56.01 52.80 2ava n LEU 17 Cb 0.26 -0.43 0.00 0.00 -0.00 0.00 0.00 43.42 43.26 2ava n LEU 17 CO 0.22 0.91 0.16 0.00 -0.00 0.00 0.00 177.39 178.68 2ava n ALA 18 N -1.19 -2.65 -4.45 1.47 0.00 0.85 -5.04 120.51 109.49 2ava n ALA 18 Ca 0.16 0.26 -0.20 0.00 0.00 0.00 0.00 53.44 53.66 2ava n ALA 18 Cb 0.68 -1.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.10 2ava n ALA 18 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ava n LEU 19 N -1.45 0.00 0.00 0.00 4.32 0.75 -4.83 117.00 115.79 2ava n LEU 19 Ca -0.02 -1.98 0.00 0.00 -0.02 0.00 0.00 56.01 53.99 2ava n LEU 19 Cb 0.53 0.21 0.00 0.00 -1.62 0.00 0.00 43.42 42.54 2ava n LEU 19 CO 0.53 -0.29 0.00 0.61 -1.22 0.00 0.00 177.39 177.03 2ava n GLY 20 N 1.20 0.57 0.01 -0.72 0.00 -1.26 -4.63 105.19 100.36 2ava n GLY 20 Ca -0.13 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 2ava n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ava h ALA 21 N 0.00 0.00 -0.11 4.61 0.00 -2.00 -3.42 119.26 118.34 2ava h ALA 21 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2ava h ALA 21 Cb 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2ava h ALA 21 CO 0.00 0.07 -0.12 -0.25 0.00 0.00 0.00 179.25 178.95 2ava n ASP 22 N -2.72 2.55 -4.48 0.00 8.00 -1.26 -5.02 116.55 113.62 2ava n ASP 22 Ca -0.01 -3.36 -0.30 0.00 0.71 0.00 0.00 54.79 51.84 2ava n ASP 22 Cb 0.04 -0.51 -0.12 0.00 -0.02 0.00 0.00 41.12 40.52 2ava n ASP 22 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2ava s VAL 23 N -3.00 2.84 0.29 2.53 1.01 -1.26 -5.13 120.40 117.68 2ava s VAL 23 Ca 0.37 -1.46 -0.16 0.00 0.00 0.00 0.00 61.98 60.74 2ava s VAL 23 Cb 0.33 -2.29 -0.09 0.00 0.00 0.00 0.00 36.38 34.34 2ava s VAL 23 CO 0.02 0.13 0.72 0.54 0.00 0.00 0.00 175.10 176.51 2ava s VAL 24 N -1.11 4.67 -0.13 2.92 0.11 -1.26 -4.62 120.40 120.98 2ava s VAL 24 Ca 0.17 0.99 -0.00 0.00 -2.93 0.00 0.00 61.98 60.21 2ava s VAL 24 Cb -0.11 -3.67 -0.02 0.00 -1.53 0.00 0.00 36.38 31.06 2ava s VAL 24 CO 0.09 -0.09 -0.12 0.54 -3.33 0.00 0.00 175.10 172.20 2ava s VAL 25 N -1.87 3.15 0.02 2.04 0.11 -1.26 -5.02 120.40 117.57 2ava s VAL 25 Ca 0.51 -0.63 0.00 0.00 -2.93 0.00 0.00 61.98 58.93 2ava s VAL 25 Cb -0.12 -2.32 -0.02 0.00 -1.53 0.00 0.00 36.38 32.39 2ava s VAL 25 CO 0.18 0.53 -0.03 0.42 -3.33 0.00 0.00 175.10 172.87 2ava s THR 26 N 0.29 0.15 -0.15 5.04 -4.23 -1.26 -5.04 115.64 110.44 2ava s THR 26 Ca -0.09 -0.71 0.17 0.00 -1.18 0.00 0.00 61.69 59.88 2ava s THR 26 Cb -0.15 -0.25 0.11 0.00 1.34 0.00 0.00 72.50 73.54 2ava s THR 26 CO 0.05 -0.35 1.51 0.00 -0.54 0.00 0.00 174.62 175.29 2ava h ALA 27 N 5.01 0.75 -0.20 3.99 0.00 -1.96 -3.08 119.26 123.78 2ava h ALA 27 Ca -0.31 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2ava h ALA 27 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2ava h ALA 27 CO 0.43 0.53 0.00 -0.25 0.00 0.00 0.00 179.25 179.96 2ava n ASP 28 N -3.24 1.37 -4.55 0.00 9.92 -1.26 -0.99 116.55 117.80 2ava n ASP 28 Ca 0.02 -1.81 -0.41 0.00 -0.53 0.00 0.00 54.79 52.06 2ava n ASP 28 Cb 0.68 -0.13 -0.03 0.00 -0.64 0.00 0.00 41.12 41.00 2ava n ASP 28 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 2ava s SER 29 N -1.30 6.45 -0.28 -2.24 0.15 -1.17 -4.90 113.70 110.40 2ava s SER 29 Ca 0.25 -1.31 -0.37 0.00 0.70 0.00 0.00 55.95 55.23 2ava s SER 29 Cb 0.13 -2.56 -0.13 0.00 -1.71 0.00 0.00 66.02 61.75 2ava s SER 29 CO 0.19 -1.54 1.99 -0.62 1.20 0.00 0.00 173.24 174.46 2ava n GLU 30 N 8.85 1.29 -1.51 5.44 1.02 -1.26 -4.19 120.64 130.28 2ava n GLU 30 Ca 0.27 0.42 -0.30 0.00 -0.02 0.00 0.00 57.16 57.54 2ava n GLU 30 Cb 0.51 -2.37 0.19 0.00 -0.02 0.00 0.00 31.44 29.75 2ava n GLU 30 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 2ava s PHE 31 N 5.50 1.51 -0.46 -0.32 -0.71 -1.26 -4.86 117.98 117.38 2ava s PHE 31 Ca 1.03 0.55 -0.32 0.00 -1.04 0.00 0.00 56.93 57.15 2ava s PHE 31 Cb -0.91 -3.66 -0.11 0.00 -1.21 0.00 0.00 43.02 37.13 2ava s PHE 31 CO 0.55 -2.98 2.31 0.45 -1.34 0.00 0.00 175.22 174.21 2ava n SER 32 N -4.11 2.02 -3.50 1.98 2.88 -1.26 -4.93 113.62 106.70 2ava n SER 32 Ca 0.12 0.16 -0.20 0.00 -1.33 0.00 0.00 58.87 57.62 2ava n SER 32 Cb 0.59 -1.31 0.13 0.00 -0.75 0.00 0.00 64.21 62.87 2ava n SER 32 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2ava n LYS 33 N 8.47 -0.61 -1.17 -1.46 5.02 -1.26 -4.96 118.16 122.17 2ava n LYS 33 Ca 0.43 -1.61 -0.34 0.00 -2.02 0.00 0.00 58.31 54.77 2ava n LYS 33 Cb 0.29 -0.82 0.12 0.00 -0.02 0.00 0.00 35.03 34.60 2ava n LYS 33 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2ava s LEU 34 N 0.00 3.17 0.00 -0.35 2.96 -1.26 -4.72 118.68 118.48 2ava s LEU 34 Ca 0.52 2.38 0.00 0.00 -0.22 0.00 0.00 54.13 56.80 2ava s LEU 34 Cb -0.02 -4.59 0.00 0.00 0.50 0.00 0.00 46.19 42.08 2ava s LEU 34 CO 0.36 -2.60 0.00 0.61 -1.32 0.00 0.00 176.35 173.40 2ava n GLY 35 N 0.49 -0.00 0.23 7.98 0.00 -1.24 -4.87 105.19 107.77 2ava n GLY 35 Ca 0.14 -1.14 -0.08 0.00 0.00 0.00 0.00 46.02 44.94 2ava n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ava h ALA 36 N 0.00 -0.91 -0.42 4.61 0.00 -2.02 -2.76 119.26 117.76 2ava h ALA 36 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2ava h ALA 36 Cb 0.00 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2ava h ALA 36 CO 0.00 -0.93 0.00 -0.25 0.00 0.00 0.00 179.25 178.07 2ava n ASP 37 N -3.74 3.97 -1.11 0.00 8.00 -1.26 -4.04 116.55 118.37 2ava n ASP 37 Ca -0.05 -2.51 -0.03 0.00 0.71 0.00 0.00 54.79 52.91 2ava n ASP 37 Cb 0.21 -0.57 0.14 0.00 -0.02 0.00 0.00 41.12 40.88 2ava n ASP 37 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2ava n SER 38 N 0.54 2.57 -2.07 -2.24 7.64 -1.05 -4.72 113.62 114.30 2ava n SER 38 Ca 0.19 -3.71 -0.09 0.00 1.01 0.00 0.00 58.87 56.27 2ava n SER 38 Cb 0.81 -0.46 0.29 0.00 -1.01 0.00 0.00 64.21 63.84 2ava n SER 38 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2ava n LEU 39 N -0.90 6.27 -1.90 -3.43 7.94 -1.18 -3.67 117.00 120.14 2ava n LEU 39 Ca 0.25 -3.28 -0.11 0.00 -1.11 0.00 0.00 56.01 51.76 2ava n LEU 39 Cb 0.80 -0.77 0.22 0.00 0.53 0.00 0.00 43.42 44.20 2ava n LEU 39 CO 0.09 0.85 1.02 -0.90 -1.11 0.00 0.00 177.39 177.33 2ava n ASP 40 N -0.30 4.11 0.05 1.96 5.68 -1.26 -4.50 116.55 122.29 2ava n ASP 40 Ca 0.45 -3.14 0.17 0.00 -0.50 0.00 0.00 54.79 51.77 2ava n ASP 40 Cb 1.45 -0.74 0.67 0.00 -1.14 0.00 0.00 41.12 41.36 2ava n ASP 40 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 2ava h THR 41 N 1.73 0.79 -0.91 2.12 2.02 -1.93 -0.87 112.91 115.87 2ava h THR 41 Ca 0.34 -0.01 0.23 0.00 0.77 0.00 0.00 66.41 67.75 2ava h THR 41 Cb 2.27 0.78 -0.06 0.00 -1.74 0.00 0.00 68.15 69.40 2ava h THR 41 CO 0.74 0.00 0.62 0.58 0.37 0.00 0.00 175.52 177.83 2ava h VAL 42 N 0.02 0.61 -0.08 3.16 2.07 -1.91 0.93 116.25 121.05 2ava h VAL 42 Ca 0.20 -0.08 -0.05 0.00 0.82 0.00 0.00 66.70 67.59 2ava h VAL 42 Cb 0.79 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2ava h VAL 42 CO -0.01 0.04 -0.15 -0.33 0.02 0.00 0.00 177.57 177.15 2ava h GLU 43 N 0.24 0.25 0.26 1.57 5.08 -1.53 -2.02 114.58 118.44 2ava h GLU 43 Ca 0.46 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 2ava h GLU 43 Cb 1.41 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.68 2ava h GLU 43 CO -0.12 0.74 -0.13 0.82 -1.00 0.00 0.00 179.01 179.32 2ava h ILE 44 N -0.21 0.78 -0.40 3.13 1.08 -1.19 -2.03 117.51 118.66 2ava h ILE 44 Ca 0.00 -0.34 0.07 0.00 -0.39 0.00 0.00 64.86 64.20 2ava h ILE 44 Cb 0.73 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 35.43 2ava h ILE 44 CO 0.03 0.07 0.28 1.62 -0.69 0.00 0.00 178.15 179.46 2ava h VAL 45 N -0.53 0.93 -0.16 1.67 3.04 -0.99 -2.01 116.25 118.20 2ava h VAL 45 Ca -0.04 -0.09 -0.04 0.00 -1.01 0.00 0.00 66.70 65.52 2ava h VAL 45 Cb 0.39 0.64 -0.00 0.00 -2.01 0.00 0.00 31.29 30.31 2ava h VAL 45 CO 0.06 0.05 -0.04 0.24 -1.01 0.00 0.00 177.57 176.87 2ava h MET 46 N 0.27 0.32 0.35 4.17 2.86 -1.11 -0.33 114.93 121.45 2ava h MET 46 Ca 0.18 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2ava h MET 46 Cb 0.37 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 2ava h MET 46 CO -0.04 0.59 -0.31 -0.91 1.06 0.00 0.00 176.91 177.31 2ava h ASN 47 N 0.02 -0.82 0.12 1.22 4.21 -0.65 0.27 115.58 119.94 2ava h ASN 47 Ca 0.04 0.07 -0.00 0.00 1.21 0.00 0.00 56.30 57.62 2ava h ASN 47 Cb 0.48 0.27 -0.00 0.00 -1.12 0.00 0.00 38.32 37.95 2ava h ASN 47 CO 0.02 -0.45 -0.08 -0.07 -1.29 0.00 0.00 177.43 175.56 2ava h LEU 48 N -0.68 -0.20 -2.03 1.61 3.38 -1.50 0.27 115.31 116.17 2ava h LEU 48 Ca -0.02 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.02 2ava h LEU 48 Cb 0.60 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 2ava h LEU 48 CO -0.03 -0.13 0.14 -0.08 0.09 0.00 0.00 178.44 178.43 2ava h GLU 49 N -0.20 0.00 0.02 1.13 4.81 -0.93 0.64 114.58 120.06 2ava h GLU 49 Ca -0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2ava h GLU 49 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2ava h GLU 49 CO 0.01 0.00 -0.01 1.49 -0.73 0.00 0.00 179.01 179.76 2ava h GLU 50 N 0.00 -0.03 -0.19 1.92 4.22 0.28 0.38 114.58 121.16 2ava h GLU 50 Ca 0.09 0.00 0.05 0.00 0.08 0.00 0.00 59.36 59.59 2ava h GLU 50 Cb 0.38 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.57 2ava h GLU 50 CO -0.00 -0.02 -0.29 1.49 -2.18 0.00 0.00 179.01 178.01 2ava h GLU 51 N -0.74 -0.32 0.00 1.92 4.57 -0.39 0.19 114.58 119.81 2ava h GLU 51 Ca -0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2ava h GLU 51 Cb 0.02 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2ava h GLU 51 CO 0.01 -0.21 0.00 1.19 -1.18 0.00 0.00 179.01 178.81 2ava n PHE 52 N -5.40 0.62 -3.45 0.92 3.72 0.21 -4.92 117.46 109.16 2ava n PHE 52 Ca -0.02 0.24 -0.22 0.00 -0.05 0.00 0.00 57.45 57.40 2ava n PHE 52 Cb 0.31 -0.88 0.05 0.00 -0.94 0.00 0.00 39.48 38.02 2ava n PHE 52 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ava n GLY 53 N 0.09 -1.10 1.52 1.37 0.00 0.68 -4.96 105.19 102.79 2ava n GLY 53 Ca 0.03 0.52 -0.12 0.00 0.00 0.00 0.00 46.02 46.45 2ava n GLY 53 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ava n ILE 54 N -3.59 0.00 -3.97 -0.61 -5.35 0.05 -5.00 119.36 100.88 2ava n ILE 54 Ca -0.08 -1.06 -0.30 0.00 -0.27 0.00 0.00 62.75 61.04 2ava n ILE 54 Cb 0.60 0.34 -0.14 0.00 -1.74 0.00 0.00 39.64 38.69 2ava n ILE 54 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2ava s ASN 55 N -2.15 4.50 0.09 7.28 6.03 -1.26 -4.78 114.94 124.65 2ava s ASN 55 Ca 0.07 -2.62 0.02 0.00 -1.03 0.00 0.00 52.86 49.30 2ava s ASN 55 Cb 0.00 -1.61 -0.04 0.00 -3.03 0.00 0.00 41.25 36.57 2ava s ASN 55 CO 0.05 -0.30 0.16 -0.69 -2.03 0.00 0.00 177.10 174.28 2ava s VAL 56 N 0.27 4.92 0.16 3.54 1.01 -1.26 -4.75 120.40 124.30 2ava s VAL 56 Ca 0.14 -0.66 0.09 0.00 0.00 0.00 0.00 61.98 61.56 2ava s VAL 56 Cb -0.23 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2ava s VAL 56 CO -0.04 0.08 -0.14 -0.62 0.00 0.00 0.00 175.10 174.38 2ava s ASP 57 N -2.61 4.06 0.25 3.32 2.15 -1.26 -5.02 116.67 117.56 2ava s ASP 57 Ca 0.32 -0.61 -0.03 0.00 0.43 0.00 0.00 52.55 52.66 2ava s ASP 57 Cb -0.12 -0.62 0.45 0.00 -0.30 0.00 0.00 42.92 42.33 2ava s ASP 57 CO 0.25 0.13 1.78 -0.08 -0.17 0.00 0.00 175.17 177.08 2ava h GLU 58 N 3.18 0.66 0.00 4.34 4.81 -2.00 0.33 114.58 125.90 2ava h GLU 58 Ca -0.47 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 2ava h GLU 58 Cb 1.19 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 2ava h GLU 58 CO 0.51 0.44 -0.07 -0.44 -0.73 0.00 0.00 179.01 178.72 2ava h ASP 59 N 0.68 0.00 0.05 1.04 5.19 -2.00 -0.74 116.42 120.64 2ava h ASP 59 Ca 0.42 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.83 2ava h ASP 59 Cb 0.50 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.01 2ava h ASP 59 CO -0.31 0.07 -0.71 1.17 -3.12 0.00 0.00 179.24 176.34 2ava n LYS 60 N -3.43 0.51 -0.59 3.56 3.00 0.83 -4.21 118.16 117.84 2ava n LYS 60 Ca -0.02 -0.41 0.06 0.00 -0.00 0.00 0.00 58.31 57.95 2ava n LYS 60 Cb 0.21 -1.49 0.16 0.00 0.00 0.00 0.00 35.03 33.91 2ava n LYS 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ava n ALA 61 N -0.89 3.14 -0.01 3.14 0.00 0.66 -4.63 120.51 121.93 2ava n ALA 61 Ca 0.07 -2.95 -0.00 0.00 0.00 0.00 0.00 53.44 50.55 2ava n ALA 61 Cb 0.38 -0.41 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 2ava n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ava n GLN 62 N -0.95 2.17 -2.14 0.00 -0.00 -0.40 -4.71 117.38 111.35 2ava n GLN 62 Ca 0.16 -0.01 -0.21 0.00 -0.00 0.00 0.00 57.00 56.94 2ava n GLN 62 Cb 0.73 -1.08 0.02 0.00 -0.00 0.00 0.00 30.24 29.92 2ava n GLN 62 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2ava n ASP 63 N -1.92 4.50 -4.68 2.61 -0.08 -1.26 -4.81 116.55 110.91 2ava n ASP 63 Ca -0.03 -3.54 -0.40 0.00 -1.51 0.00 0.00 54.79 49.31 2ava n ASP 63 Cb 0.40 -0.36 -0.05 0.00 2.34 0.00 0.00 41.12 43.45 2ava n ASP 63 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2ava s ILE 64 N -4.53 5.01 0.07 5.18 -1.09 -1.26 -5.06 121.20 119.52 2ava s ILE 64 Ca 0.48 1.30 -0.01 0.00 -2.23 0.00 0.00 60.65 60.19 2ava s ILE 64 Cb 0.40 -3.99 0.02 0.00 -1.58 0.00 0.00 42.46 37.31 2ava s ILE 64 CO 0.02 0.13 0.05 -1.20 -1.23 0.00 0.00 174.94 172.72 2ava n SER 65 N 4.77 -1.70 -3.49 3.58 7.64 -1.26 -4.91 113.62 118.25 2ava n SER 65 Ca -0.01 -0.24 -0.20 0.00 1.01 0.00 0.00 58.87 59.44 2ava n SER 65 Cb 0.50 -0.05 0.18 0.00 -1.01 0.00 0.00 64.21 63.83 2ava n SER 65 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2ava n THR 66 N -2.94 0.00 -0.30 0.44 5.66 -1.26 -4.02 114.28 111.85 2ava n THR 66 Ca 0.01 -0.02 0.25 0.00 -3.05 0.00 0.00 64.05 61.24 2ava n THR 66 Cb 0.03 -0.61 0.57 0.00 -1.55 0.00 0.00 70.33 68.78 2ava n THR 66 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 2ava h ILE 67 N -2.96 0.52 -0.06 1.09 2.04 -1.70 0.03 117.51 116.48 2ava h ILE 67 Ca -0.27 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.54 2ava h ILE 67 Cb 0.86 0.21 -0.06 0.00 -0.74 0.00 0.00 36.82 37.09 2ava h ILE 67 CO 0.16 0.05 -0.36 1.56 0.00 0.00 0.00 178.15 179.56 2ava h GLN 68 N 0.29 -0.46 -0.02 2.37 1.08 -1.36 -0.42 115.11 116.58 2ava h GLN 68 Ca 0.56 0.03 -0.18 0.00 -1.45 0.00 0.00 58.65 57.61 2ava h GLN 68 Cb 1.62 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 29.14 2ava h GLN 68 CO -0.20 -0.31 -0.77 0.37 -0.95 0.00 0.00 178.83 176.97 2ava h GLN 69 N -0.48 0.21 -0.83 1.46 4.15 -1.48 -3.10 115.11 115.04 2ava h GLN 69 Ca 0.07 -0.19 0.09 0.00 0.77 0.00 0.00 58.65 59.39 2ava h GLN 69 Cb 0.59 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 28.26 2ava h GLN 69 CO -0.33 0.88 0.48 0.00 -1.93 0.00 0.00 178.83 177.93 2ava h ALA 70 N 1.06 1.19 -0.27 3.38 0.00 -0.45 -0.72 119.26 123.45 2ava h ALA 70 Ca -0.03 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 2ava h ALA 70 Cb 1.36 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2ava h ALA 70 CO 0.12 0.11 -0.55 0.00 0.00 0.00 0.00 179.25 178.92 2ava h ALA 71 N 1.46 0.50 -0.21 0.00 0.00 -1.10 -2.81 119.26 117.10 2ava h ALA 71 Ca 0.40 -0.52 0.01 0.00 0.00 0.00 0.00 54.91 54.80 2ava h ALA 71 Cb 0.36 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2ava h ALA 71 CO -0.24 0.68 0.11 0.22 0.00 0.00 0.00 179.25 180.02 2ava h ASP 72 N 0.63 0.18 0.39 0.00 3.58 -1.26 -1.30 116.42 118.63 2ava h ASP 72 Ca 0.01 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 2ava h ASP 72 Cb 1.15 -0.03 -0.00 0.00 1.72 0.00 0.00 39.33 42.17 2ava h ASP 72 CO 0.12 0.13 -0.23 0.58 -2.88 0.00 0.00 179.24 176.97 2ava h VAL 73 N 0.24 0.53 -0.97 2.25 2.07 -1.19 -2.65 116.25 116.53 2ava h VAL 73 Ca 0.08 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.76 2ava h VAL 73 Cb 0.01 0.53 -0.10 0.00 -1.52 0.00 0.00 31.29 30.21 2ava h VAL 73 CO -0.05 0.00 0.58 0.40 0.02 0.00 0.00 177.57 178.52 2ava h ILE 74 N -0.58 0.77 -0.77 4.57 2.04 -1.39 -0.62 117.51 121.54 2ava h ILE 74 Ca -0.04 -0.27 0.13 0.00 1.00 0.00 0.00 64.86 65.67 2ava h ILE 74 Cb 0.47 -0.09 -0.09 0.00 -0.74 0.00 0.00 36.82 36.37 2ava h ILE 74 CO 0.05 0.15 0.35 -0.33 0.00 0.00 0.00 178.15 178.37 2ava h GLU 75 N 0.80 0.52 -0.07 2.37 5.08 -0.88 0.93 114.58 123.34 2ava h GLU 75 Ca 0.53 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.82 2ava h GLU 75 Cb 0.72 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2ava h GLU 75 CO -0.34 0.35 -0.14 0.78 -1.00 0.00 0.00 179.01 178.66 2ava h GLY 76 N 0.54 0.11 1.39 -3.84 0.00 -0.97 -1.45 103.07 98.86 2ava h GLY 76 Ca 0.41 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.67 2ava h GLY 76 CO -0.35 0.06 -0.31 1.04 0.00 0.00 0.00 176.54 176.98 2ava n LEU 77 N -4.32 0.32 0.02 3.11 4.77 0.13 -3.48 117.00 117.55 2ava n LEU 77 Ca -0.02 0.20 0.11 0.00 -0.03 0.00 0.00 56.01 56.28 2ava n LEU 77 Cb 0.24 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2ava n LEU 77 CO 0.37 0.07 -0.04 0.18 -1.33 0.00 0.00 177.39 176.64 2ava n LEU 78 N -1.52 0.61 0.26 2.23 4.77 -0.09 -2.38 117.00 120.87 2ava n LEU 78 Ca 0.06 -0.06 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 2ava n LEU 78 Cb 0.34 -0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.29 2ava n LEU 78 CO 0.32 0.06 0.29 -0.33 -1.33 0.00 0.00 177.39 176.39 2ava h GLU 79 N 0.00 -0.68 0.00 3.23 5.08 -1.44 -3.42 114.58 117.35 2ava h GLU 79 Ca 0.00 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2ava h GLU 79 Cb 0.72 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2ava h GLU 79 CO 0.00 -0.45 -0.85 0.36 -1.00 0.00 0.00 179.01 177.06 2ava n LYS 80 N -5.17 1.47 -2.18 2.33 -0.00 -1.26 -5.10 118.16 108.25 2ava n LYS 80 Ca -0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.21 2ava n LYS 80 Cb 0.28 -0.93 -0.01 0.00 -0.00 0.00 0.00 35.03 34.37 2ava n LYS 80 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2ava n LYS 81 N -1.39 -2.25 0.00 -1.58 4.81 -1.00 -5.11 118.16 111.63 2ava n LYS 81 Ca 0.00 1.97 0.00 0.00 -0.87 0.00 0.00 58.31 59.41 2ava n LYS 81 Cb 0.10 -3.49 0.00 0.00 0.02 0.00 0.00 35.03 31.66 2ava n LYS 81 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57