#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ava n LYS 2 N 0.00 1.49 -0.18 0.00 4.76 -1.26 -4.79 118.16 118.17 2ava n LYS 2 Ca 0.00 0.55 0.10 0.00 -2.87 0.00 0.00 58.31 56.09 2ava n LYS 2 Cb 0.00 -2.46 0.40 0.00 -1.84 0.00 0.00 35.03 31.13 2ava n LYS 2 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2ava h LYS 3 N 1.21 0.62 -0.88 1.97 1.57 -2.01 -1.25 116.57 117.80 2ava h LYS 3 Ca -0.50 -0.04 0.14 0.00 -1.87 0.00 0.00 60.65 58.39 2ava h LYS 3 Cb 1.32 -0.14 -0.09 0.00 0.08 0.00 0.00 32.23 33.40 2ava h LYS 3 CO 0.56 0.41 0.48 1.05 -0.57 0.00 0.00 179.45 181.37 2ava h GLU 4 N 0.63 0.67 0.01 3.15 4.11 -2.00 -0.33 114.58 120.83 2ava h GLU 4 Ca 0.35 -0.04 -0.21 0.00 0.07 0.00 0.00 59.36 59.52 2ava h GLU 4 Cb 0.50 -0.15 0.02 0.00 0.50 0.00 0.00 28.75 29.61 2ava h GLU 4 CO -0.13 0.45 -0.84 1.79 0.07 0.00 0.00 179.01 180.35 2ava h THR 5 N 0.69 1.36 -0.94 -1.06 1.35 -1.60 -2.89 112.91 109.82 2ava h THR 5 Ca 0.47 -2.19 0.11 0.00 -0.55 0.00 0.00 66.41 64.25 2ava h THR 5 Cb 0.64 2.53 -0.07 0.00 -1.73 0.00 0.00 68.15 69.52 2ava h THR 5 CO -0.34 0.66 0.60 0.40 -0.25 0.00 0.00 175.52 176.58 2ava h ILE 6 N 0.13 0.94 -0.20 6.82 2.04 -0.76 0.16 117.51 126.64 2ava h ILE 6 Ca -0.11 -0.31 -0.13 0.00 1.00 0.00 0.00 64.86 65.31 2ava h ILE 6 Cb 1.53 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2ava h ILE 6 CO 0.16 0.17 -0.37 0.44 0.00 0.00 0.00 178.15 178.55 2ava h ASP 7 N 0.92 0.67 0.59 1.72 5.19 -1.13 -2.20 116.42 122.18 2ava h ASP 7 Ca 0.45 -0.54 -0.03 0.00 -0.62 0.00 0.00 57.03 56.29 2ava h ASP 7 Cb 0.46 -0.19 0.01 0.00 0.18 0.00 0.00 39.33 39.78 2ava h ASP 7 CO -0.21 1.09 -0.28 0.11 -3.12 0.00 0.00 179.24 176.83 2ava h LYS 8 N 0.28 -0.76 -0.33 3.56 1.79 -1.12 -2.60 116.57 117.39 2ava h LYS 8 Ca 0.01 0.05 0.07 0.00 -2.18 0.00 0.00 60.65 58.60 2ava h LYS 8 Cb 0.97 0.17 -0.07 0.00 -1.58 0.00 0.00 32.23 31.73 2ava h LYS 8 CO 0.08 -0.46 -0.10 0.28 -1.08 0.00 0.00 179.45 178.18 2ava h VAL 9 N -0.97 0.63 -0.43 0.50 2.07 -0.82 0.88 116.25 118.11 2ava h VAL 9 Ca -0.08 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.56 2ava h VAL 9 Cb 0.66 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2ava h VAL 9 CO 0.13 0.00 0.40 0.77 0.02 0.00 0.00 177.57 178.89 2ava h SER 10 N -0.02 0.00 -0.05 0.57 4.64 -1.39 -0.25 113.55 117.05 2ava h SER 10 Ca 0.16 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.32 2ava h SER 10 Cb 0.27 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.37 2ava h SER 10 CO -0.36 0.00 -0.59 -0.78 -0.87 0.00 0.00 176.83 174.23 2ava h ASP 11 N 0.00 0.60 -0.96 4.97 3.58 -0.43 -3.05 116.42 121.13 2ava h ASP 11 Ca 0.21 -0.71 0.20 0.00 0.42 0.00 0.00 57.03 57.15 2ava h ASP 11 Cb 1.00 -0.18 -0.08 0.00 1.72 0.00 0.00 39.33 41.78 2ava h ASP 11 CO -0.00 1.22 0.61 0.40 -2.88 0.00 0.00 179.24 178.59 2ava h ILE 12 N 0.03 0.69 -0.20 2.25 5.03 -0.49 0.06 117.51 124.88 2ava h ILE 12 Ca -0.06 -0.19 -0.15 0.00 -0.12 0.00 0.00 64.86 64.34 2ava h ILE 12 Cb 1.27 0.08 0.00 0.00 -3.03 0.00 0.00 36.82 35.14 2ava h ILE 12 CO 0.12 0.10 -0.45 0.58 -0.68 0.00 0.00 178.15 177.82 2ava h VAL 13 N 0.56 1.32 -0.85 1.67 2.07 -1.55 -3.14 116.25 116.33 2ava h VAL 13 Ca 0.52 -1.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 2ava h VAL 13 Cb 1.08 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.66 2ava h VAL 13 CO -0.26 0.53 0.45 0.11 0.02 0.00 0.00 177.57 178.42 2ava h LYS 14 N 0.37 1.20 0.00 1.57 1.57 -0.96 -1.91 116.57 118.41 2ava h LYS 14 Ca 0.00 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2ava h LYS 14 Cb 1.06 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 2ava h LYS 14 CO 0.10 0.89 -0.01 0.93 -0.57 0.00 0.00 179.45 180.79 2ava h GLU 15 N 1.19 0.00 -0.99 3.15 5.08 -1.07 0.37 114.58 122.31 2ava h GLU 15 Ca 0.30 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.84 2ava h GLU 15 Cb 0.05 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.20 2ava h GLU 15 CO -0.05 0.01 0.60 0.87 -1.00 0.00 0.00 179.01 179.45 2ava h LYS 16 N 0.00 0.76 0.00 2.33 1.79 -1.29 -2.59 116.57 117.57 2ava h LYS 16 Ca -0.00 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.39 2ava h LYS 16 Cb 0.02 -0.17 -0.07 0.00 -1.58 0.00 0.00 32.23 30.44 2ava h LYS 16 CO 0.00 0.50 -0.42 1.47 -1.08 0.00 0.00 179.45 179.93 2ava n LEU 17 N -4.76 1.64 -3.00 2.94 -0.00 -0.82 -5.04 117.00 107.95 2ava n LEU 17 Ca 0.22 -2.60 -0.15 0.00 -0.00 0.00 0.00 56.01 53.49 2ava n LEU 17 Cb 0.54 -0.28 0.02 0.00 -0.00 0.00 0.00 43.42 43.70 2ava n LEU 17 CO 0.22 0.73 -0.06 0.00 -0.00 0.00 0.00 177.39 178.29 2ava n ALA 18 N -0.68 -2.86 -4.08 1.47 0.00 0.92 -5.05 120.51 110.23 2ava n ALA 18 Ca 0.11 0.95 -0.16 0.00 0.00 0.00 0.00 53.44 54.34 2ava n ALA 18 Cb 0.75 -3.30 -0.04 0.00 0.00 0.00 0.00 19.45 16.86 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 -0.21 0.00 0.00 0.00 4.32 0.88 -4.91 117.00 117.08 2ava n LEU 19 Ca 0.07 -1.82 0.00 0.00 -0.02 0.00 0.00 56.01 54.24 2ava n LEU 19 Cb 0.49 0.57 0.00 0.00 -1.62 0.00 0.00 43.42 42.87 2ava n LEU 19 CO 0.49 -0.28 0.00 0.61 -1.22 0.00 0.00 177.39 176.99 2ava n GLY 20 N 0.59 0.98 0.01 -0.72 0.00 -1.26 -4.65 105.19 100.13 2ava n GLY 20 Ca -0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 46.02 45.96 2ava n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ava n ALA 21 N -1.89 0.04 -1.38 4.61 0.00 -1.26 -4.73 120.51 115.90 2ava n ALA 21 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 53.44 53.27 2ava n ALA 21 Cb 0.00 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.65 2ava n ALA 21 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ava n ASP 22 N -2.51 2.33 -4.50 0.00 2.03 -1.26 -5.02 116.55 107.62 2ava n ASP 22 Ca -0.01 -3.60 -0.29 0.00 0.52 0.00 0.00 54.79 51.41 2ava n ASP 22 Cb 0.03 -0.54 -0.11 0.00 -0.72 0.00 0.00 41.12 39.77 2ava n ASP 22 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2ava s VAL 23 N -3.12 2.89 0.14 5.18 1.01 -1.26 -5.12 120.40 120.12 2ava s VAL 23 Ca 0.39 -1.47 -0.24 0.00 0.00 0.00 0.00 61.98 60.66 2ava s VAL 23 Cb 0.36 -2.33 -0.08 0.00 0.00 0.00 0.00 36.38 34.34 2ava s VAL 23 CO -0.01 0.11 0.75 -0.69 0.00 0.00 0.00 175.10 175.25 2ava s VAL 24 N -1.14 4.45 -0.15 2.92 1.01 -1.26 -4.75 120.40 121.47 2ava s VAL 24 Ca 0.18 1.63 -0.05 0.00 0.00 0.00 0.00 61.98 63.74 2ava s VAL 24 Cb -0.11 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2ava s VAL 24 CO 0.10 0.52 0.02 0.54 0.00 0.00 0.00 175.10 176.28 2ava s VAL 25 N -1.06 4.46 0.12 2.92 0.11 -1.26 -5.07 120.40 120.62 2ava s VAL 25 Ca 0.35 -0.16 -0.01 0.00 -2.93 0.00 0.00 61.98 59.22 2ava s VAL 25 Cb -0.22 -2.96 -0.04 0.00 -1.53 0.00 0.00 36.38 31.63 2ava s VAL 25 CO 0.25 0.51 0.05 0.42 -3.33 0.00 0.00 175.10 173.00 2ava s THR 26 N 0.02 0.12 -0.12 5.04 -4.23 -1.26 -5.06 115.64 110.16 2ava s THR 26 Ca 0.04 -1.87 0.17 0.00 -1.18 0.00 0.00 61.69 58.84 2ava s THR 26 Cb -0.13 -1.96 -0.18 0.00 1.34 0.00 0.00 72.50 71.57 2ava s THR 26 CO 0.02 -0.53 0.67 0.00 -0.54 0.00 0.00 174.62 174.24 2ava n ALA 27 N -0.07 1.88 1.25 3.99 0.00 -1.26 -3.95 120.51 122.34 2ava n ALA 27 Ca -0.07 -0.68 0.13 0.00 0.00 0.00 0.00 53.44 52.83 2ava n ALA 27 Cb 0.63 -0.82 0.46 0.00 0.00 0.00 0.00 19.45 19.72 2ava n ALA 27 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ava n ASP 28 N -2.84 0.65 -4.56 0.00 5.75 -1.26 -0.06 116.55 114.23 2ava n ASP 28 Ca -0.13 -0.56 -0.30 0.00 -0.01 0.00 0.00 54.79 53.78 2ava n ASP 28 Cb 0.89 0.03 -0.04 0.00 -1.03 0.00 0.00 41.12 40.97 2ava n ASP 28 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2ava s SER 29 N -2.61 5.03 -0.34 -1.12 0.15 -1.25 -4.83 113.70 108.72 2ava s SER 29 Ca 0.23 -0.13 -0.35 0.00 0.70 0.00 0.00 55.95 56.40 2ava s SER 29 Cb 0.19 -2.54 -0.11 0.00 -1.71 0.00 0.00 66.02 61.84 2ava s SER 29 CO 0.53 -2.72 2.18 -0.62 1.20 0.00 0.00 173.24 173.81 2ava n GLU 30 N 8.98 1.10 0.18 5.44 1.02 -1.26 -4.27 120.64 131.83 2ava n GLU 30 Ca 0.33 0.30 0.02 0.00 -0.02 0.00 0.00 57.16 57.80 2ava n GLU 30 Cb 0.49 -2.46 0.33 0.00 -0.02 0.00 0.00 31.44 29.78 2ava n GLU 30 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2ava h PHE 31 N 12.25 0.00 -3.73 -0.32 -5.15 -1.90 -3.40 116.94 114.70 2ava h PHE 31 Ca -0.28 0.00 -0.66 0.00 -0.20 0.00 0.00 57.97 56.83 2ava h PHE 31 Cb 1.32 0.00 -0.37 0.00 0.22 0.00 0.00 35.95 37.12 2ava h PHE 31 CO 0.95 0.42 -0.81 -1.54 -2.00 0.00 0.00 178.31 175.34 2ava s SER 32 N -6.81 4.17 -0.12 -0.68 1.04 -1.26 -4.97 113.70 105.07 2ava s SER 32 Ca -0.02 -1.26 0.03 0.00 0.48 0.00 0.00 55.95 55.18 2ava s SER 32 Cb 0.13 -1.48 -0.24 0.00 0.10 0.00 0.00 66.02 64.54 2ava s SER 32 CO 0.72 -0.17 0.35 0.29 0.98 0.00 0.00 173.24 175.41 2ava n LYS 33 N 4.49 0.70 -2.49 4.02 4.76 -1.26 -4.96 118.16 123.41 2ava n LYS 33 Ca -0.15 0.23 -0.24 0.00 -2.87 0.00 0.00 58.31 55.28 2ava n LYS 33 Cb 0.43 -1.69 0.10 0.00 -1.84 0.00 0.00 35.03 32.03 2ava n LYS 33 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2ava s LEU 34 N -6.49 2.99 -1.16 -0.35 1.43 -1.26 -5.01 118.68 108.82 2ava s LEU 34 Ca -0.17 -0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 52.70 2ava s LEU 34 Cb 0.07 -2.29 0.25 0.00 0.03 0.00 0.00 46.19 44.24 2ava s LEU 34 CO 0.77 -1.78 1.56 0.61 0.23 0.00 0.00 176.35 177.74 2ava n GLY 35 N -2.84 4.74 3.92 -3.19 0.00 -1.26 -4.65 105.19 101.91 2ava n GLY 35 Ca 0.13 -2.41 -0.30 0.00 0.00 0.00 0.00 46.02 43.44 2ava n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ava n ALA 36 N 2.75 -1.34 -0.06 4.61 0.00 -1.26 -4.90 120.51 120.30 2ava n ALA 36 Ca 0.31 0.16 -0.05 0.00 0.00 0.00 0.00 53.44 53.86 2ava n ALA 36 Cb 0.36 -4.24 -0.02 0.00 0.00 0.00 0.00 19.45 15.55 2ava n ALA 36 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2ava n ASP 37 N -2.84 1.51 -0.11 0.00 -0.08 -1.26 -4.81 116.55 108.95 2ava n ASP 37 Ca 0.02 0.50 -0.22 0.00 -1.51 0.00 0.00 54.79 53.57 2ava n ASP 37 Cb 0.54 -0.78 -0.09 0.00 2.34 0.00 0.00 41.12 43.12 2ava n ASP 37 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2ava n SER 38 N -4.17 1.90 -4.75 1.67 2.88 -1.26 -4.96 113.62 104.93 2ava n SER 38 Ca -0.07 0.41 -0.35 0.00 -1.33 0.00 0.00 58.87 57.52 2ava n SER 38 Cb 0.27 -0.89 0.05 0.00 -0.75 0.00 0.00 64.21 62.89 2ava n SER 38 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2ava s LEU 39 N -7.78 3.55 -0.29 2.46 1.43 -1.26 -5.01 118.68 111.78 2ava s LEU 39 Ca -0.31 2.34 -0.08 0.00 -1.03 0.00 0.00 54.13 55.05 2ava s LEU 39 Cb 0.09 -4.59 -0.01 0.00 0.03 0.00 0.00 46.19 41.71 2ava s LEU 39 CO 0.51 -1.76 0.10 -1.81 0.23 0.00 0.00 176.35 173.61 2ava s ASP 40 N -1.81 5.24 0.01 2.29 1.01 -1.26 -4.71 116.67 117.44 2ava s ASP 40 Ca 0.75 -0.52 -0.25 0.00 0.71 0.00 0.00 52.55 53.24 2ava s ASP 40 Cb -0.29 -1.93 -0.18 0.00 1.01 0.00 0.00 42.92 41.54 2ava s ASP 40 CO 0.37 -0.15 1.33 0.74 0.21 0.00 0.00 175.17 177.67 2ava h THR 41 N 5.72 0.97 -0.90 -1.27 2.02 -1.94 -2.48 112.91 115.03 2ava h THR 41 Ca -0.34 -0.67 0.23 0.00 0.77 0.00 0.00 66.41 66.40 2ava h THR 41 Cb 1.15 1.37 -0.05 0.00 -1.74 0.00 0.00 68.15 68.87 2ava h THR 41 CO 0.60 0.15 0.62 0.58 0.37 0.00 0.00 175.52 177.84 2ava h VAL 42 N -0.54 0.61 0.14 3.16 2.07 -1.94 0.45 116.25 120.20 2ava h VAL 42 Ca -0.02 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2ava h VAL 42 Cb 0.42 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2ava h VAL 42 CO 0.04 0.04 -0.07 -0.08 0.02 0.00 0.00 177.57 177.52 2ava h GLU 43 N 0.22 -0.18 0.22 1.57 4.81 -1.95 -1.81 114.58 117.46 2ava h GLU 43 Ca 0.45 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.70 2ava h GLU 43 Cb 1.42 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.83 2ava h GLU 43 CO -0.11 0.26 -0.17 0.82 -0.73 0.00 0.00 179.01 179.08 2ava h ILE 44 N -0.73 0.62 -0.39 2.32 1.08 -0.81 -0.63 117.51 118.97 2ava h ILE 44 Ca -0.02 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.50 2ava h ILE 44 Cb 0.52 0.62 -0.02 0.00 -3.07 0.00 0.00 36.82 34.88 2ava h ILE 44 CO 0.03 0.00 0.26 1.62 -0.69 0.00 0.00 178.15 179.37 2ava h VAL 45 N -0.40 0.98 -0.18 1.67 3.04 -1.06 -2.04 116.25 118.25 2ava h VAL 45 Ca -0.01 -0.11 -0.06 0.00 -1.01 0.00 0.00 66.70 65.50 2ava h VAL 45 Cb 0.36 0.62 -0.00 0.00 -2.01 0.00 0.00 31.29 30.26 2ava h VAL 45 CO -0.02 0.06 -0.14 0.24 -1.01 0.00 0.00 177.57 176.70 2ava h MET 46 N 0.33 0.42 0.21 4.17 2.86 -0.69 -0.55 114.93 121.67 2ava h MET 46 Ca 0.17 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2ava h MET 46 Cb 0.25 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2ava h MET 46 CO -0.04 0.75 -0.16 -0.91 1.06 0.00 0.00 176.91 177.61 2ava h ASN 47 N 0.08 -0.42 0.25 1.22 4.21 -0.47 0.28 115.58 120.73 2ava h ASN 47 Ca 0.03 0.03 -0.01 0.00 1.21 0.00 0.00 56.30 57.57 2ava h ASN 47 Cb 0.66 0.14 0.00 0.00 -1.12 0.00 0.00 38.32 38.00 2ava h ASN 47 CO 0.04 -0.26 -0.12 -0.07 -1.29 0.00 0.00 177.43 175.73 2ava h LEU 48 N -0.39 -0.29 -2.03 1.61 3.38 -1.45 0.24 115.31 116.39 2ava h LEU 48 Ca -0.01 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 57.96 2ava h LEU 48 Cb 0.34 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2ava h LEU 48 CO -0.01 -0.13 0.14 -0.08 0.09 0.00 0.00 178.44 178.45 2ava h GLU 49 N -0.43 0.00 0.05 1.13 4.81 -1.02 0.35 114.58 119.47 2ava h GLU 49 Ca -0.03 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2ava h GLU 49 Cb 0.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2ava h GLU 49 CO 0.06 0.00 -0.02 1.49 -0.73 0.00 0.00 179.01 179.80 2ava h GLU 50 N 0.00 -0.07 0.02 1.92 4.57 0.02 -0.98 114.58 120.06 2ava h GLU 50 Ca 0.09 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.30 2ava h GLU 50 Cb 0.36 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.91 2ava h GLU 50 CO -0.00 -0.04 -0.41 1.49 -1.18 0.00 0.00 179.01 178.86 2ava h GLU 51 N -0.75 -0.56 0.00 1.92 4.57 -0.44 -0.39 114.58 118.94 2ava h GLU 51 Ca -0.01 0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 2ava h GLU 51 Cb 0.05 0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2ava h GLU 51 CO 0.01 -0.37 -0.13 0.74 -1.18 0.00 0.00 179.01 178.08 2ava h PHE 52 N -0.58 0.00 -4.22 0.92 0.04 -1.11 -3.47 116.94 108.53 2ava h PHE 52 Ca 0.04 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.58 2ava h PHE 52 Cb 0.65 0.00 0.10 0.00 2.20 0.00 0.00 35.95 38.90 2ava h PHE 52 CO -0.41 0.13 -0.46 0.41 -0.60 0.00 0.00 178.31 177.37 2ava n GLY 53 N -0.59 -0.04 2.54 -1.45 0.00 -0.16 -4.29 105.19 101.20 2ava n GLY 53 Ca -0.02 -0.10 -0.17 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.50 0.00 -3.87 -0.61 -5.35 -0.47 -2.37 119.36 103.18 2ava n ILE 54 Ca -0.10 -1.46 -0.31 0.00 -0.27 0.00 0.00 62.75 60.61 2ava n ILE 54 Cb 0.58 -0.18 -0.12 0.00 -1.74 0.00 0.00 39.64 38.18 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 -3.15 4.72 0.22 7.28 6.03 -1.26 -4.79 114.94 124.00 2ava s ASN 55 Ca 0.20 -3.24 -0.07 0.00 -1.03 0.00 0.00 52.86 48.72 2ava s ASN 55 Cb -0.02 -1.70 -0.06 0.00 -3.03 0.00 0.00 41.25 36.44 2ava s ASN 55 CO 0.13 -0.22 0.50 -0.69 -2.03 0.00 0.00 177.10 174.79 2ava s VAL 56 N -0.61 5.03 0.21 3.54 1.01 -1.26 -5.05 120.40 123.26 2ava s VAL 56 Ca 0.20 0.21 0.09 0.00 0.00 0.00 0.00 61.98 62.48 2ava s VAL 56 Cb -0.19 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2ava s VAL 56 CO -0.05 -0.12 -0.07 -0.62 0.00 0.00 0.00 175.10 174.23 2ava s ASP 57 N -2.64 4.30 0.28 3.32 -1.08 -1.26 -5.03 116.67 114.57 2ava s ASP 57 Ca 0.44 -0.62 -0.03 0.00 -0.52 0.00 0.00 52.55 51.82 2ava s ASP 57 Cb -0.11 -0.73 0.40 0.00 -1.46 0.00 0.00 42.92 41.01 2ava s ASP 57 CO 0.25 0.07 1.94 1.05 0.52 0.00 0.00 175.17 179.00 2ava h GLU 58 N 2.57 1.16 0.00 4.34 4.11 -1.99 0.23 114.58 124.99 2ava h GLU 58 Ca -0.46 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 58.91 2ava h GLU 58 Cb 1.22 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2ava h GLU 58 CO 0.56 0.77 0.00 0.22 0.07 0.00 0.00 179.01 180.63 2ava h ASP 59 N 1.19 0.00 0.50 3.06 3.58 -1.99 0.60 116.42 123.35 2ava h ASP 59 Ca 0.35 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.80 2ava h ASP 59 Cb -0.07 0.00 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2ava h ASP 59 CO -0.09 0.00 -1.45 1.17 -2.88 0.00 0.00 179.24 175.99 2ava n LYS 60 N -2.69 0.60 -0.19 0.28 3.00 -0.09 -4.17 118.16 114.90 2ava n LYS 60 Ca 0.01 -0.03 0.09 0.00 -0.00 0.00 0.00 58.31 58.38 2ava n LYS 60 Cb 0.27 -1.67 0.17 0.00 0.00 0.00 0.00 35.03 33.80 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 -2.18 2.53 0.05 3.14 0.00 -0.25 -4.68 120.51 119.12 2ava n ALA 61 Ca -0.02 -2.64 -0.02 0.00 0.00 0.00 0.00 53.44 50.77 2ava n ALA 61 Cb 0.55 -0.44 0.25 0.00 0.00 0.00 0.00 19.45 19.80 2ava n ALA 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2ava h GLN 62 N 0.40 0.39 -0.94 0.00 3.07 -1.05 -3.40 115.11 113.58 2ava h GLN 62 Ca 0.00 -0.14 -0.14 0.00 0.09 0.00 0.00 58.65 58.47 2ava h GLN 62 Cb 1.09 -0.03 -0.16 0.00 0.08 0.00 0.00 27.48 28.46 2ava h GLN 62 CO 0.05 0.61 -0.46 -0.51 0.09 0.00 0.00 178.83 178.61 2ava s ASP 63 N -6.83 -1.36 -0.12 0.06 1.11 -1.26 -5.05 116.67 103.22 2ava s ASP 63 Ca -0.06 -1.62 -0.21 0.00 0.18 0.00 0.00 52.55 50.83 2ava s ASP 63 Cb 0.14 1.78 -0.03 0.00 1.07 0.00 0.00 42.92 45.88 2ava s ASP 63 CO 0.77 -0.05 0.63 -0.63 1.18 0.00 0.00 175.17 177.07 2ava s ILE 64 N 0.89 5.07 0.16 0.77 -1.09 -1.26 -5.06 121.20 120.68 2ava s ILE 64 Ca 0.29 1.25 -0.03 0.00 -2.23 0.00 0.00 60.65 59.94 2ava s ILE 64 Cb 0.01 -3.96 0.04 0.00 -1.58 0.00 0.00 42.46 36.97 2ava s ILE 64 CO -0.05 0.23 0.09 -0.24 -1.23 0.00 0.00 174.94 173.74 2ava n SER 65 N 4.12 -2.22 -3.67 3.58 2.88 -1.26 -4.91 113.62 112.15 2ava n SER 65 Ca -0.03 -0.10 -0.22 0.00 -1.33 0.00 0.00 58.87 57.20 2ava n SER 65 Cb 0.51 -0.11 0.18 0.00 -0.75 0.00 0.00 64.21 64.03 2ava n SER 65 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2ava n THR 66 N -3.30 0.00 -0.27 2.46 5.66 -1.26 -4.13 114.28 113.43 2ava n THR 66 Ca 0.02 -0.08 0.30 0.00 -3.05 0.00 0.00 64.05 61.23 2ava n THR 66 Cb 0.07 -0.59 0.68 0.00 -1.55 0.00 0.00 70.33 68.93 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 -2.74 0.49 -0.13 1.09 5.03 -1.63 -0.60 117.51 119.03 2ava h ILE 67 Ca -0.32 -0.04 0.05 0.00 -0.12 0.00 0.00 64.86 64.43 2ava h ILE 67 Cb 0.95 0.37 -0.06 0.00 -3.03 0.00 0.00 36.82 35.06 2ava h ILE 67 CO 0.21 0.02 -0.25 1.56 -0.68 0.00 0.00 178.15 179.01 2ava h GLN 68 N 0.11 -0.30 -0.11 2.37 1.08 -0.77 0.18 115.11 117.66 2ava h GLN 68 Ca 0.52 0.02 -0.22 0.00 -1.45 0.00 0.00 58.65 57.52 2ava h GLN 68 Cb 1.87 0.07 0.01 0.00 -0.05 0.00 0.00 27.48 29.38 2ava h GLN 68 CO -0.08 -0.20 -0.82 0.37 -0.95 0.00 0.00 178.83 177.15 2ava h GLN 69 N -0.31 0.69 0.02 1.46 4.15 -1.40 -3.02 115.11 116.70 2ava h GLN 69 Ca 0.10 -0.60 0.03 0.00 0.77 0.00 0.00 58.65 58.95 2ava h GLN 69 Cb 0.46 0.13 -0.04 0.00 0.21 0.00 0.00 27.48 28.25 2ava h GLN 69 CO -0.31 1.21 -0.21 0.00 -1.93 0.00 0.00 178.83 177.59 2ava h ALA 70 N 0.61 -0.29 -0.85 3.38 0.00 -0.89 0.01 119.26 121.23 2ava h ALA 70 Ca -0.06 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2ava h ALA 70 Cb 1.44 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 19.55 2ava h ALA 70 CO 0.16 -0.72 0.56 0.00 0.00 0.00 0.00 179.25 179.25 2ava h ALA 71 N 0.51 1.48 -0.01 0.00 0.00 -0.74 -1.67 119.26 118.84 2ava h ALA 71 Ca 0.05 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2ava h ALA 71 Cb 0.42 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2ava h ALA 71 CO -0.18 0.43 0.00 0.22 0.00 0.00 0.00 179.25 179.72 2ava h ASP 72 N 1.04 0.01 0.35 0.00 1.82 -1.24 -1.70 116.42 116.70 2ava h ASP 72 Ca 0.34 -0.17 -0.01 0.00 -0.39 0.00 0.00 57.03 56.80 2ava h ASP 72 Cb 0.04 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.04 2ava h ASP 72 CO -0.10 0.18 -0.27 0.58 -1.61 0.00 0.00 179.24 178.02 2ava h VAL 73 N -0.15 0.43 -0.99 2.25 2.07 -0.64 -2.46 116.25 116.76 2ava h VAL 73 Ca 0.00 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.68 2ava h VAL 73 Cb 0.17 0.43 -0.09 0.00 -1.52 0.00 0.00 31.29 30.28 2ava h VAL 73 CO -0.00 0.00 0.62 0.40 0.02 0.00 0.00 177.57 178.61 2ava h ILE 74 N -0.62 0.79 -0.57 4.57 2.04 -1.32 -1.18 117.51 121.23 2ava h ILE 74 Ca -0.03 -0.28 0.11 0.00 1.00 0.00 0.00 64.86 65.66 2ava h ILE 74 Cb 0.54 -0.10 -0.09 0.00 -0.74 0.00 0.00 36.82 36.44 2ava h ILE 74 CO -0.01 0.15 0.08 -0.33 0.00 0.00 0.00 178.15 178.04 2ava h GLU 75 N 0.82 0.20 0.00 2.37 5.08 -0.82 0.20 114.58 122.43 2ava h GLU 75 Ca 0.53 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.85 2ava h GLU 75 Cb 0.75 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 2ava h GLU 75 CO -0.31 0.13 -0.13 0.78 -1.00 0.00 0.00 179.01 178.48 2ava h GLY 76 N 0.20 0.00 1.31 -3.84 0.00 -1.08 -1.97 103.07 97.70 2ava h GLY 76 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 2ava h GLY 76 CO -0.41 0.00 -0.53 1.41 0.00 0.00 0.00 176.54 177.01 2ava h LEU 77 N 0.00 0.00 0.00 3.11 3.38 -0.50 -3.27 115.31 118.03 2ava h LEU 77 Ca -0.00 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2ava h LEU 77 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2ava h LEU 77 CO 0.02 0.08 -0.65 0.18 0.09 0.00 0.00 178.44 178.16 2ava n LEU 78 N -2.20 0.64 -0.22 1.67 4.77 0.20 -2.44 117.00 119.42 2ava n LEU 78 Ca 0.03 -0.13 -0.08 0.00 -0.03 0.00 0.00 56.01 55.80 2ava n LEU 78 Cb 0.45 -0.18 0.03 0.00 -2.33 0.00 0.00 43.42 41.39 2ava n LEU 78 CO 0.36 0.16 0.93 -0.33 -1.33 0.00 0.00 177.39 177.17 2ava h GLU 79 N 0.00 0.97 -0.00 3.23 5.08 -1.53 -3.25 114.58 119.08 2ava h GLU 79 Ca 0.00 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 2ava h GLU 79 Cb 0.51 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2ava h GLU 79 CO 0.00 0.88 -0.27 0.36 -1.00 0.00 0.00 179.01 178.98 2ava n LYS 80 N -4.36 3.57 -4.46 2.33 -0.00 -1.26 -5.03 118.16 108.95 2ava n LYS 80 Ca 0.03 -0.23 -0.22 0.00 -0.00 0.00 0.00 58.31 57.89 2ava n LYS 80 Cb 0.23 -0.92 -0.11 0.00 -0.00 0.00 0.00 35.03 34.24 2ava n LYS 80 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2ava s LYS 81 N -1.46 1.64 0.00 -1.58 2.47 -1.02 -5.13 119.74 114.66 2ava s LYS 81 Ca 0.04 -1.88 0.00 0.00 -1.56 0.00 0.00 55.97 52.58 2ava s LYS 81 Cb 0.06 -1.13 0.00 0.00 -1.46 0.00 0.00 37.83 35.30 2ava s LYS 81 CO 0.26 -0.05 0.00 0.00 0.16 0.00 0.00 175.35 175.71