#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2avy n SER 3 N 0.00 -1.92 0.00 2.89 3.41 -1.26 -4.97 113.62 111.77 2avy n SER 3 Ca 0.00 -2.58 0.00 0.00 -0.26 0.00 0.00 58.87 56.03 2avy n SER 3 Cb 0.00 1.35 0.00 0.00 -0.26 0.00 0.00 64.21 65.30 2avy n SER 3 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2avy n LEU 4 N 1.11 0.00 0.00 1.04 4.77 -1.26 -5.03 117.00 117.63 2avy n LEU 4 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2avy n LEU 4 Cb 0.70 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 2avy n LEU 4 CO -0.05 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.30 2avy n LYS 5 N 0.00 0.00 -3.72 3.23 4.01 -1.26 -3.73 118.16 116.68 2avy n LYS 5 Ca 0.00 0.00 -0.37 0.00 -0.51 0.00 0.00 58.31 57.43 2avy n LYS 5 Cb 0.00 0.00 -0.11 0.00 -0.51 0.00 0.00 35.03 34.41 2avy n LYS 5 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2avy s LYS 6 N 0.00 2.16 0.00 1.97 -0.14 -1.26 -4.75 119.74 117.72 2avy s LYS 6 Ca 0.00 -1.88 0.00 0.00 -1.36 0.00 0.00 55.97 52.73 2avy s LYS 6 Cb 0.00 -3.67 0.00 0.00 -1.68 0.00 0.00 37.83 32.48 2avy s LYS 6 CO 0.00 -1.11 0.00 0.41 -0.76 0.00 0.00 175.35 173.89 2avy n GLY 7 N 4.55 0.14 3.54 -3.33 0.00 -1.24 -5.04 105.19 103.81 2avy n GLY 7 Ca -0.02 -0.57 -0.25 0.00 0.00 0.00 0.00 46.02 45.18 2avy n GLY 7 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2avy n PRO 8 N 0.00 0.54 -2.53 1.61 -0.02 -1.26 -4.90 135.00 128.44 2avy n PRO 8 Ca 0.00 -0.35 -0.33 0.00 -2.02 0.00 0.00 63.50 60.79 2avy n PRO 8 Cb 0.00 -2.91 -0.04 0.00 -0.02 0.00 0.00 33.50 30.53 2avy n PRO 8 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2avy s PHE 9 N 10.91 3.11 -0.04 6.00 2.19 -1.26 -5.04 117.98 133.86 2avy s PHE 9 Ca 1.06 1.57 -0.08 0.00 0.33 0.00 0.00 56.93 59.81 2avy s PHE 9 Cb -0.40 -2.98 0.01 0.00 -1.31 0.00 0.00 43.02 38.34 2avy s PHE 9 CO 0.27 -0.65 0.19 0.96 1.83 0.00 0.00 175.22 177.82 2avy s ILE 10 N -2.15 0.04 -0.08 3.12 -4.36 -1.26 -4.28 121.20 112.24 2avy s ILE 10 Ca 0.65 -0.36 -0.29 0.00 -0.26 0.00 0.00 60.65 60.39 2avy s ILE 10 Cb -0.14 -0.39 -0.06 0.00 1.25 0.00 0.00 42.46 43.12 2avy s ILE 10 CO 0.21 -0.20 1.78 -1.81 0.24 0.00 0.00 174.94 175.16 2avy s ASP 11 N -0.71 6.45 0.44 4.36 1.11 -1.26 -4.86 116.67 122.20 2avy s ASP 11 Ca -0.08 2.19 0.22 0.00 0.18 0.00 0.00 52.55 55.06 2avy s ASP 11 Cb -0.05 -2.53 1.19 0.00 1.07 0.00 0.00 42.92 42.60 2avy s ASP 11 CO 0.01 -1.12 1.83 0.25 1.18 0.00 0.00 175.17 177.33 2avy h LEU 12 N 11.06 0.32 -0.72 1.23 6.46 -1.99 -2.46 115.31 129.21 2avy h LEU 12 Ca -0.41 0.04 0.12 0.00 -0.12 0.00 0.00 57.88 57.51 2avy h LEU 12 Cb 1.19 -0.01 -0.13 0.00 -0.73 0.00 0.00 40.66 40.98 2avy h LEU 12 CO 0.96 0.10 -0.36 0.45 -0.62 0.00 0.00 178.44 178.97 2avy h HIS 13 N 0.31 -1.02 0.00 1.25 -0.00 -1.99 0.29 115.15 113.98 2avy h HIS 13 Ca 0.51 0.08 -0.08 0.00 -0.00 0.00 0.00 60.37 60.88 2avy h HIS 13 Cb 1.45 0.55 -0.01 0.00 -0.00 0.00 0.00 27.41 29.40 2avy h HIS 13 CO -0.00 -0.39 -0.38 1.37 -0.00 0.00 0.00 177.93 178.53 2avy h LEU 14 N -0.12 0.00 0.15 2.43 -0.00 -1.83 -3.34 115.31 112.61 2avy h LEU 14 Ca 0.26 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 58.14 2avy h LEU 14 Cb 0.56 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.22 2avy h LEU 14 CO -0.78 0.38 -0.17 0.25 -0.00 0.00 0.00 178.44 178.12 2avy h LEU 15 N 0.00 -0.48 -1.95 0.17 5.85 -0.25 -2.00 115.31 116.66 2avy h LEU 15 Ca -0.00 0.04 0.20 0.00 0.84 0.00 0.00 57.88 58.95 2avy h LEU 15 Cb 1.18 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.35 2avy h LEU 15 CO 0.05 -0.22 0.57 0.11 -0.34 0.00 0.00 178.44 178.61 2avy h LYS 16 N -0.33 0.00 0.21 1.25 1.79 -1.50 -2.67 116.57 115.32 2avy h LYS 16 Ca -0.02 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.44 2avy h LYS 16 Cb 0.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.94 2avy h LYS 16 CO -0.03 0.00 -0.10 0.87 -1.08 0.00 0.00 179.45 179.11 2avy h LYS 17 N 0.00 -0.27 -0.83 3.15 1.57 -1.59 -2.40 116.57 116.19 2avy h LYS 17 Ca 0.32 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 59.28 2avy h LYS 17 Cb 1.47 0.06 -0.10 0.00 0.08 0.00 0.00 32.23 33.74 2avy h LYS 17 CO -0.00 -0.04 0.39 -0.24 -0.57 0.00 0.00 179.45 178.99 2avy h VAL 18 N -1.03 0.67 0.00 0.50 3.04 -1.14 0.81 116.25 119.11 2avy h VAL 18 Ca -0.03 -0.19 -0.05 0.00 -1.01 0.00 0.00 66.70 65.43 2avy h VAL 18 Cb 0.36 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 29.72 2avy h VAL 18 CO 0.05 0.10 -0.23 -0.33 -1.01 0.00 0.00 177.57 176.15 2avy h GLU 19 N 0.54 0.00 0.23 4.17 5.08 -1.58 -1.44 114.58 121.58 2avy h GLU 19 Ca 0.46 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.51 2avy h GLU 19 Cb 0.70 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.99 2avy h GLU 19 CO -0.40 0.23 -1.38 -0.22 -1.00 0.00 0.00 179.01 176.24 2avy h LYS 20 N 0.00 0.49 0.30 2.33 3.11 0.60 -2.97 116.57 120.42 2avy h LYS 20 Ca -0.00 -0.83 -0.01 0.00 -2.81 0.00 0.00 60.65 56.99 2avy h LYS 20 Cb 0.45 0.31 -0.00 0.00 -1.00 0.00 0.00 32.23 31.99 2avy h LYS 20 CO 0.03 1.40 -0.16 0.00 -2.81 0.00 0.00 179.45 177.91 2avy h ALA 21 N 0.13 -0.42 -0.23 5.00 0.00 0.70 -2.10 119.26 122.34 2avy h ALA 21 Ca -0.24 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.61 2avy h ALA 21 Cb 2.07 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 20.03 2avy h ALA 21 CO 0.25 -0.74 0.15 0.28 0.00 0.00 0.00 179.25 179.19 2avy h VAL 22 N -0.43 0.99 -0.29 0.00 2.07 -1.19 0.47 116.25 117.87 2avy h VAL 22 Ca -0.04 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.48 2avy h VAL 22 Cb 0.34 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 2avy h VAL 22 CO 0.05 0.03 -0.07 -0.08 0.02 0.00 0.00 177.57 177.53 2avy h GLU 23 N 0.19 0.00 -0.60 1.57 4.57 -1.21 -1.09 114.58 118.01 2avy h GLU 23 Ca 0.10 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 2avy h GLU 23 Cb 0.15 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 2avy h GLU 23 CO -0.02 0.00 0.00 0.43 -1.18 0.00 0.00 179.01 178.25 2avy n SER 24 N -5.24 5.59 0.00 1.04 7.64 -0.79 -5.03 113.62 116.83 2avy n SER 24 Ca -0.00 -2.84 0.00 0.00 1.01 0.00 0.00 58.87 57.04 2avy n SER 24 Cb 0.16 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2avy n SER 24 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2avy n GLY 25 N 0.74 1.21 2.46 0.23 0.00 0.09 -4.93 105.19 104.99 2avy n GLY 25 Ca 0.28 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 45.45 2avy n GLY 25 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2avy n ASP 26 N 2.96 0.38 0.00 1.61 9.92 -1.24 -3.06 116.55 127.13 2avy n ASP 26 Ca 0.00 -2.63 0.00 0.00 -0.53 0.00 0.00 54.79 51.63 2avy n ASP 26 Cb 0.00 0.99 0.00 0.00 -0.64 0.00 0.00 41.12 41.47 2avy n ASP 26 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 2avy n LYS 27 N -0.59 -0.64 -1.73 -1.24 2.85 -1.26 -5.01 118.16 110.54 2avy n LYS 27 Ca 0.00 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.96 2avy n LYS 27 Cb 0.46 0.00 0.04 0.00 -0.65 0.00 0.00 35.03 34.88 2avy n LYS 27 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 2avy s LYS 28 N -0.50 2.99 0.71 -1.58 0.00 -1.26 -4.85 119.74 115.24 2avy s LYS 28 Ca 0.00 0.73 -0.16 0.00 0.00 0.00 0.00 55.97 56.54 2avy s LYS 28 Cb 0.00 -2.01 -0.02 0.00 0.00 0.00 0.00 37.83 35.80 2avy s LYS 28 CO 0.00 -1.01 0.75 -0.35 0.00 0.00 0.00 175.35 174.74 2avy n PRO 29 N -3.04 0.42 -3.85 1.78 -0.04 -1.26 -4.92 135.00 124.09 2avy n PRO 29 Ca 0.07 0.19 -0.36 0.00 -0.04 0.00 0.00 63.50 63.36 2avy n PRO 29 Cb 0.55 -2.02 -0.13 0.00 -0.04 0.00 0.00 33.50 31.86 2avy n PRO 29 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2avy s LEU 30 N -1.59 3.18 0.16 1.53 2.01 -1.18 -4.98 118.68 117.80 2avy s LEU 30 Ca 0.70 -0.40 -0.33 0.00 0.01 0.00 0.00 54.13 54.11 2avy s LEU 30 Cb -0.35 -1.80 -0.17 0.00 0.01 0.00 0.00 46.19 43.88 2avy s LEU 30 CO 0.54 -0.05 1.01 -1.14 1.01 0.00 0.00 176.35 177.72 2avy n ARG 31 N 4.84 0.76 -3.75 1.70 3.00 -1.26 -3.53 116.66 118.41 2avy n ARG 31 Ca -0.17 0.27 -0.12 0.00 -0.00 0.00 0.00 57.85 57.82 2avy n ARG 31 Cb 0.50 -1.66 -0.11 0.00 0.00 0.00 0.00 32.46 31.19 2avy n ARG 31 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2avy s THR 32 N -0.38 -0.01 -0.02 5.15 2.01 -1.23 -4.87 115.64 116.29 2avy s THR 32 Ca 0.73 0.04 0.08 0.00 0.31 0.00 0.00 61.69 62.85 2avy s THR 32 Cb -0.93 -0.45 -0.12 0.00 0.01 0.00 0.00 72.50 71.01 2avy s THR 32 CO 0.54 0.02 0.16 0.79 -0.69 0.00 0.00 174.62 175.44 2avy n TRP 33 N 3.34 0.00 -2.79 4.92 8.01 -1.26 -2.31 117.44 127.36 2avy n TRP 33 Ca -0.17 0.00 -0.43 0.00 -1.31 0.00 0.00 57.50 55.60 2avy n TRP 33 Cb 0.57 -0.20 -0.03 0.00 -2.01 0.00 0.00 31.31 29.63 2avy n TRP 33 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.69 175.14 2avy s SER 34 N -3.03 6.33 0.04 -0.99 1.04 -1.26 -4.60 113.70 111.22 2avy s SER 34 Ca -0.03 -1.25 0.06 0.00 0.48 0.00 0.00 55.95 55.21 2avy s SER 34 Cb 0.05 -2.46 -0.23 0.00 0.10 0.00 0.00 66.02 63.48 2avy s SER 34 CO 0.33 -1.41 0.98 0.03 0.98 0.00 0.00 173.24 174.15 2avy h ARG 35 N 9.48 0.07 0.00 4.02 3.08 -1.94 -3.34 114.38 125.75 2avy h ARG 35 Ca -0.10 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2avy h ARG 35 Cb 1.05 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.14 2avy h ARG 35 CO 1.21 0.88 0.09 0.54 -1.07 0.00 0.00 179.97 181.62 2avy n ARG 36 N -3.29 0.00 0.00 0.04 1.74 -1.26 -1.57 116.66 112.32 2avy n ARG 36 Ca -0.10 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2avy n ARG 36 Cb 1.00 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.85 2avy n ARG 36 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2avy n SER 37 N -1.07 0.00 -3.88 0.55 3.41 -1.26 -4.84 113.62 106.54 2avy n SER 37 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 2avy n SER 37 Cb 0.09 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.89 2avy n SER 37 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2avy s THR 38 N 0.00 0.21 -0.63 6.66 2.01 -1.26 -3.03 115.64 119.60 2avy s THR 38 Ca 0.00 -0.05 -0.26 0.00 0.31 0.00 0.00 61.69 61.70 2avy s THR 38 Cb 0.00 -0.23 -0.11 0.00 0.01 0.00 0.00 72.50 72.17 2avy s THR 38 CO 0.00 0.10 2.43 -0.38 -0.69 0.00 0.00 174.62 176.08 2avy n ILE 39 N 3.44 -0.05 -1.77 1.82 5.41 0.26 -4.72 119.36 123.74 2avy n ILE 39 Ca -0.18 -0.65 -0.35 0.00 1.00 0.00 0.00 62.75 62.57 2avy n ILE 39 Cb 0.56 -2.33 0.06 0.00 -0.71 0.00 0.00 39.64 37.22 2avy n ILE 39 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2avy s PHE 40 N 12.51 2.31 0.06 1.39 0.40 -1.26 -3.79 117.98 129.60 2avy s PHE 40 Ca 1.00 1.55 -0.27 0.00 -0.60 0.00 0.00 56.93 58.61 2avy s PHE 40 Cb -0.25 -3.42 -0.17 0.00 0.51 0.00 0.00 43.02 39.69 2avy s PHE 40 CO 0.23 -2.26 1.57 -1.00 0.70 0.00 0.00 175.22 174.46 2avy h PRO 41 N 0.34 -0.43 -0.38 0.24 0.13 -1.78 -2.92 132.00 127.21 2avy h PRO 41 Ca -0.49 0.03 0.11 0.00 -0.87 0.00 0.00 66.00 64.78 2avy h PRO 41 Cb 1.29 0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.50 2avy h PRO 41 CO 0.53 -0.23 0.31 -2.95 -0.23 0.00 0.00 178.00 175.44 2avy h ASN 42 N -0.54 0.00 0.10 1.44 7.08 -1.93 0.23 115.58 121.97 2avy h ASN 42 Ca -0.05 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.17 2avy h ASN 42 Cb 0.40 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.64 2avy h ASN 42 CO 0.07 0.00 0.00 0.23 -2.08 0.00 0.00 177.43 175.65 2avy n MET 43 N -4.13 0.24 -1.68 4.14 2.81 -1.10 -4.81 117.12 112.58 2avy n MET 43 Ca 0.06 0.10 -0.61 0.00 -1.81 0.00 0.00 57.70 55.44 2avy n MET 43 Cb 0.49 -1.50 -0.08 0.00 -0.71 0.00 0.00 33.22 31.42 2avy n MET 43 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 2avy n ILE 44 N -1.15 0.11 -2.00 2.02 0.13 0.81 -0.78 119.36 118.49 2avy n ILE 44 Ca 0.06 -0.02 -0.12 0.00 -1.10 0.00 0.00 62.75 61.57 2avy n ILE 44 Cb 0.06 -0.73 -0.02 0.00 -0.84 0.00 0.00 39.64 38.12 2avy n ILE 44 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2avy n GLY 45 N 3.55 0.25 0.00 4.50 0.00 0.16 -4.88 105.19 108.77 2avy n GLY 45 Ca 0.26 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2avy n GLY 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2avy n LEU 46 N -1.67 0.00 -4.01 0.99 7.99 0.04 -4.83 117.00 115.50 2avy n LEU 46 Ca -0.14 0.00 -0.29 0.00 -0.01 0.00 0.00 56.01 55.57 2avy n LEU 46 Cb 0.56 0.00 -0.17 0.00 -0.11 0.00 0.00 43.42 43.70 2avy n LEU 46 CO 0.17 -0.41 -0.48 -0.89 -1.51 0.00 0.00 177.39 174.27 2avy s THR 47 N 0.77 1.42 0.09 -5.08 2.01 -1.22 -3.75 115.64 109.88 2avy s THR 47 Ca 0.00 -0.57 0.02 0.00 0.31 0.00 0.00 61.69 61.46 2avy s THR 47 Cb 0.00 -1.33 -0.04 0.00 0.01 0.00 0.00 72.50 71.14 2avy s THR 47 CO 0.00 0.43 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.65 2avy s ILE 48 N 1.28 0.74 0.28 1.82 1.09 -0.76 -3.13 121.20 122.51 2avy s ILE 48 Ca -0.01 -1.71 0.07 0.00 -1.10 0.00 0.00 60.65 57.91 2avy s ILE 48 Cb -0.14 -1.41 -0.06 0.00 -1.06 0.00 0.00 42.46 39.80 2avy s ILE 48 CO -0.06 -0.70 -0.08 0.00 -0.10 0.00 0.00 174.94 174.00 2avy s ALA 49 N -2.90 2.38 -0.16 9.38 0.00 -1.22 -0.25 121.76 128.97 2avy s ALA 49 Ca 0.06 -1.89 -0.04 0.00 0.00 0.00 0.00 51.96 50.09 2avy s ALA 49 Cb 0.00 0.11 0.08 0.00 0.00 0.00 0.00 23.12 23.31 2avy s ALA 49 CO -0.02 -0.02 0.26 0.08 0.00 0.00 0.00 175.76 176.06 2avy s VAL 50 N -2.95 -0.41 -0.98 0.00 1.01 -1.18 -3.54 120.40 112.35 2avy s VAL 50 Ca 0.29 0.13 -0.24 0.00 0.00 0.00 0.00 61.98 62.15 2avy s VAL 50 Cb 0.03 -0.55 -0.07 0.00 0.00 0.00 0.00 36.38 35.78 2avy s VAL 50 CO 0.12 -0.00 1.99 -2.28 0.00 0.00 0.00 175.10 174.92 2avy s HIS 51 N 2.41 1.77 -0.38 5.22 2.46 -0.98 -2.91 115.29 122.89 2avy s HIS 51 Ca 0.04 0.76 0.00 0.00 0.47 0.00 0.00 55.06 56.33 2avy s HIS 51 Cb -0.13 -3.96 0.00 0.00 -0.13 0.00 0.00 32.58 28.36 2avy s HIS 51 CO -0.10 -1.53 0.64 0.27 -2.47 0.00 0.00 174.74 171.54 2avy n ASN 52 N 14.69 1.77 0.00 9.88 6.94 0.12 -4.75 115.26 143.90 2avy n ASN 52 Ca 0.42 -1.57 0.00 0.00 -0.02 0.00 0.00 54.58 53.41 2avy n ASN 52 Cb 0.46 -0.39 0.00 0.00 -2.36 0.00 0.00 39.78 37.49 2avy n ASN 52 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2avy n GLY 53 N 0.42 3.11 0.08 4.83 0.00 -1.26 -4.77 105.19 107.61 2avy n GLY 53 Ca 0.00 -0.84 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 2avy n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2avy n ARG 54 N 0.00 0.50 -0.18 1.61 1.74 -1.26 -5.09 116.66 113.98 2avy n ARG 54 Ca 0.00 0.38 0.00 0.00 -0.77 0.00 0.00 57.85 57.46 2avy n ARG 54 Cb 0.00 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 2avy n ARG 54 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2avy n GLN 55 N -4.52 0.00 -3.33 5.56 1.13 -1.26 -5.07 117.38 109.88 2avy n GLN 55 Ca -0.14 0.00 -0.20 0.00 -1.94 0.00 0.00 57.00 54.72 2avy n GLN 55 Cb 0.42 0.00 0.01 0.00 0.11 0.00 0.00 30.24 30.78 2avy n GLN 55 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2avy s HIS 56 N -1.40 2.21 0.00 1.08 3.76 -1.24 0.12 115.29 119.82 2avy s HIS 56 Ca 0.00 -0.59 0.00 0.00 -0.15 0.00 0.00 55.06 54.32 2avy s HIS 56 Cb 0.00 -2.19 -0.00 0.00 1.11 0.00 0.00 32.58 31.49 2avy s HIS 56 CO 0.00 -0.54 -0.02 0.14 -0.85 0.00 0.00 174.74 173.48 2avy s VAL 57 N -2.54 0.10 0.59 -0.90 -7.23 -1.15 -4.71 120.40 104.56 2avy s VAL 57 Ca 0.51 -0.23 -0.19 0.00 -1.81 0.00 0.00 61.98 60.26 2avy s VAL 57 Cb -0.05 -0.13 -0.03 0.00 0.56 0.00 0.00 36.38 36.72 2avy s VAL 57 CO 0.31 -0.08 1.26 -2.16 -0.31 0.00 0.00 175.10 174.12 2avy s PRO 58 N -0.33 2.96 -0.13 4.82 0.04 -1.25 -3.10 135.00 138.01 2avy s PRO 58 Ca -0.03 1.96 -0.04 0.00 0.04 0.00 0.00 61.00 62.94 2avy s PRO 58 Cb -0.02 -2.01 0.06 0.00 0.04 0.00 0.00 34.50 32.57 2avy s PRO 58 CO -0.00 -1.25 0.15 0.08 0.04 0.00 0.00 177.00 176.01 2avy s VAL 59 N -1.48 -0.22 -0.37 -0.36 1.01 0.65 -4.87 120.40 114.76 2avy s VAL 59 Ca 0.77 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.90 2avy s VAL 59 Cb -0.34 -0.44 0.11 0.00 0.00 0.00 0.00 36.38 35.70 2avy s VAL 59 CO 0.38 -0.04 0.09 -0.36 0.00 0.00 0.00 175.10 175.16 2avy s PHE 60 N 2.25 3.68 0.49 5.22 0.08 -1.25 -1.84 117.98 126.61 2avy s PHE 60 Ca 0.04 -3.00 -0.22 0.00 0.12 0.00 0.00 56.93 53.87 2avy s PHE 60 Cb -0.14 -2.94 -0.08 0.00 -0.57 0.00 0.00 43.02 39.30 2avy s PHE 60 CO -0.08 -0.92 1.09 0.28 -0.10 0.00 0.00 175.22 175.49 2avy n VAL 61 N 4.11 3.00 -4.36 -0.44 0.31 -1.25 -4.74 118.33 114.95 2avy n VAL 61 Ca 0.04 -0.50 -0.19 0.00 -0.01 0.00 0.00 64.34 63.68 2avy n VAL 61 Cb 0.41 -1.30 -0.10 0.00 -0.91 0.00 0.00 33.84 31.93 2avy n VAL 61 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2avy s THR 62 N -1.34 1.80 0.23 2.52 2.01 -1.26 -0.66 115.64 118.94 2avy s THR 62 Ca 0.67 -2.23 -0.16 0.00 0.31 0.00 0.00 61.69 60.28 2avy s THR 62 Cb -0.49 -2.09 0.25 0.00 0.01 0.00 0.00 72.50 70.19 2avy s THR 62 CO 0.53 -0.56 1.57 0.44 -0.69 0.00 0.00 174.62 175.91 2avy h ASP 63 N 2.52 -1.19 -0.97 3.53 3.32 -1.96 0.35 116.42 122.01 2avy h ASP 63 Ca -0.38 0.28 0.10 0.00 0.02 0.00 0.00 57.03 57.04 2avy h ASP 63 Cb 1.22 0.65 -0.07 0.00 0.22 0.00 0.00 39.33 41.35 2avy h ASP 63 CO 0.62 -0.29 0.62 1.05 -1.72 0.00 0.00 179.24 179.52 2avy h GLU 64 N -0.04 0.99 -5.45 3.56 -0.00 -2.02 -3.37 114.58 108.24 2avy h GLU 64 Ca 0.34 -0.06 -0.14 0.00 -0.00 0.00 0.00 59.36 59.50 2avy h GLU 64 Cb 0.60 -0.22 -0.00 0.00 -0.00 0.00 0.00 28.75 29.12 2avy h GLU 64 CO -0.89 0.65 0.44 -1.64 -0.00 0.00 0.00 179.01 177.58 2avy s MET 65 N -5.94 1.81 0.11 1.06 -1.94 0.12 -4.54 119.30 109.99 2avy s MET 65 Ca -0.12 0.59 0.00 0.00 -1.71 0.00 0.00 55.69 54.46 2avy s MET 65 Cb 0.21 -4.76 0.00 0.00 2.01 0.00 0.00 34.83 32.29 2avy s MET 65 CO 0.81 -4.08 0.00 0.28 -0.01 0.00 0.00 175.02 172.02 2avy n VAL 66 N 8.51 1.11 -1.34 -6.03 0.31 -1.25 -4.44 118.33 115.20 2avy n VAL 66 Ca 0.43 0.37 0.08 0.00 -0.01 0.00 0.00 64.34 65.21 2avy n VAL 66 Cb 0.46 -1.50 0.18 0.00 -0.91 0.00 0.00 33.84 32.07 2avy n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2avy n GLY 67 N 3.33 5.01 3.90 2.92 0.00 -1.26 -4.24 105.19 114.85 2avy n GLY 67 Ca 0.00 -1.23 -0.30 0.00 0.00 0.00 0.00 46.02 44.50 2avy n GLY 67 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2avy s HIS 68 N -3.07 3.46 -0.04 1.61 5.04 -1.26 -4.72 115.29 116.31 2avy s HIS 68 Ca 0.35 0.72 -0.30 0.00 -1.54 0.00 0.00 55.06 54.29 2avy s HIS 68 Cb 0.33 -2.16 -0.03 0.00 0.04 0.00 0.00 32.58 30.76 2avy s HIS 68 CO -0.02 0.19 1.08 0.15 -2.34 0.00 0.00 174.74 173.80 2avy s LYS 69 N -3.35 4.44 0.22 2.88 1.02 -1.26 0.89 119.74 124.57 2avy s LYS 69 Ca 0.45 1.52 -0.11 0.00 0.02 0.00 0.00 55.97 57.85 2avy s LYS 69 Cb -0.11 -3.50 0.30 0.00 -0.52 0.00 0.00 37.83 34.00 2avy s LYS 69 CO 0.28 -0.28 1.64 1.25 -0.92 0.00 0.00 175.35 177.32 2avy h LEU 70 N 7.59 -0.42 -1.24 3.17 5.85 -1.60 -0.13 115.31 128.53 2avy h LEU 70 Ca -0.36 0.18 0.28 0.00 0.84 0.00 0.00 57.88 58.82 2avy h LEU 70 Cb 1.18 0.34 -0.11 0.00 0.37 0.00 0.00 40.66 42.44 2avy h LEU 70 CO 0.83 -0.17 0.66 1.23 -0.34 0.00 0.00 178.44 180.65 2avy h GLY 71 N 0.06 1.49 -0.36 3.75 0.00 -1.54 -0.95 103.07 105.51 2avy h GLY 71 Ca 0.33 -0.23 0.27 0.00 0.00 0.00 0.00 47.33 47.70 2avy h GLY 71 CO -0.61 -0.22 0.49 0.83 0.00 0.00 0.00 176.54 177.04 2avy h GLU 72 N 0.41 0.37 0.00 4.80 4.39 -1.31 0.44 114.58 123.68 2avy h GLU 72 Ca 0.64 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.32 2avy h GLU 72 Cb 1.53 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.10 2avy h GLU 72 CO -0.38 0.25 0.00 0.34 -1.16 0.00 0.00 179.01 178.05 2avy n PHE 73 N -5.04 0.00 -4.07 4.33 -0.00 -0.36 -4.63 117.46 107.69 2avy n PHE 73 Ca 0.27 0.00 -0.32 0.00 -0.00 0.00 0.00 57.45 57.40 2avy n PHE 73 Cb 0.82 -0.18 -0.15 0.00 -0.00 0.00 0.00 39.48 39.97 2avy n PHE 73 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2avy s ALA 74 N -2.36 2.53 1.15 3.13 0.00 0.15 -5.04 121.76 121.33 2avy s ALA 74 Ca 0.29 -1.64 -0.08 0.00 0.00 0.00 0.00 51.96 50.52 2avy s ALA 74 Cb 0.17 -1.52 0.13 0.00 0.00 0.00 0.00 23.12 21.90 2avy s ALA 74 CO 0.35 -1.01 0.34 -0.35 0.00 0.00 0.00 175.76 175.08 2avy n PRO 75 N 4.48 -2.64 0.00 0.00 -0.04 -1.26 -4.94 135.00 130.60 2avy n PRO 75 Ca -0.16 -0.56 0.00 0.00 -0.04 0.00 0.00 63.50 62.75 2avy n PRO 75 Cb 0.44 -0.65 0.00 0.00 -0.04 0.00 0.00 33.50 33.25 2avy n PRO 75 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2avy n THR 76 N -3.81 0.00 -1.63 0.52 -1.04 -1.26 -4.82 114.28 102.24 2avy n THR 76 Ca 0.05 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.74 2avy n THR 76 Cb 0.21 -0.08 0.05 0.00 -1.82 0.00 0.00 70.33 68.69 2avy n THR 76 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2avy s ARG 77 N 0.00 2.78 0.38 -2.82 0.52 -1.26 -4.97 118.95 113.59 2avy s ARG 77 Ca 0.00 1.19 -0.08 0.00 -0.52 0.00 0.00 55.73 56.32 2avy s ARG 77 Cb 0.00 -1.96 -0.06 0.00 0.52 0.00 0.00 34.95 33.45 2avy s ARG 77 CO 0.00 -1.24 0.71 0.99 0.02 0.00 0.00 175.30 175.78 2avy s THR 78 N -2.68 4.87 -0.25 0.02 2.01 -1.26 -5.09 115.64 113.26 2avy s THR 78 Ca 0.63 0.40 -0.26 0.00 0.31 0.00 0.00 61.69 62.76 2avy s THR 78 Cb -0.17 -3.75 0.13 0.00 0.01 0.00 0.00 72.50 68.71 2avy s THR 78 CO 0.48 -0.51 1.05 -0.72 -0.69 0.00 0.00 174.62 174.22 2avy s TYR 79 N -2.35 -0.42 0.00 4.92 -0.85 -1.26 -5.31 117.35 112.09 2avy s TYR 79 Ca 0.49 0.96 0.00 0.00 -0.52 0.00 0.00 57.07 57.99 2avy s TYR 79 Cb -0.10 0.39 0.00 0.00 0.38 0.00 0.00 41.96 42.63 2avy s TYR 79 CO 0.33 -0.24 0.00 -2.13 -1.52 0.00 0.00 175.55 171.98