#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2joy s PRO 2 N 0.00 3.22 0.25 0.03 0.02 -1.26 -4.95 135.00 132.30 2joy s PRO 2 Ca 0.00 0.49 -0.11 0.00 0.02 0.00 0.00 61.00 61.40 2joy s PRO 2 Cb 0.00 -4.16 -0.01 0.00 0.02 0.00 0.00 34.50 30.35 2joy s PRO 2 CO 0.00 -2.04 0.44 0.00 -0.33 0.00 0.00 177.00 175.08 2joy s ALA 3 N 6.44 -0.06 -0.55 -1.55 0.00 -1.26 -5.10 121.76 119.67 2joy s ALA 3 Ca 0.55 -0.99 -0.16 0.00 0.00 0.00 0.00 51.96 51.36 2joy s ALA 3 Cb -0.11 1.10 0.13 0.00 0.00 0.00 0.00 23.12 24.24 2joy s ALA 3 CO 0.24 -0.83 0.52 0.42 0.00 0.00 0.00 175.76 176.11 2joy s ILE 4 N -3.99 5.20 0.17 0.00 1.09 -1.26 -4.91 121.20 117.51 2joy s ILE 4 Ca 0.24 -1.50 0.10 0.00 -1.10 0.00 0.00 60.65 58.39 2joy s ILE 4 Cb 0.00 -4.35 -0.04 0.00 -1.06 0.00 0.00 42.46 37.01 2joy s ILE 4 CO 0.10 -0.89 -0.20 -1.61 -0.10 0.00 0.00 174.94 172.24 2joy s GLU 5 N 1.61 1.68 0.20 2.79 0.41 -1.26 -5.08 118.70 119.05 2joy s GLU 5 Ca 0.04 -1.38 -0.32 0.00 -0.41 0.00 0.00 54.97 52.90 2joy s GLU 5 Cb -0.29 -1.97 -0.12 0.00 -1.78 0.00 0.00 34.13 29.97 2joy s GLU 5 CO 0.03 0.43 1.72 0.14 -0.49 0.00 0.00 175.26 177.08 2joy s VAL 6 N -1.52 2.12 0.00 2.63 -7.23 -1.26 -1.77 120.40 113.38 2joy s VAL 6 Ca 0.20 0.06 0.00 0.00 -1.81 0.00 0.00 61.98 60.44 2joy s VAL 6 Cb -0.09 -3.04 0.00 0.00 0.56 0.00 0.00 36.38 33.81 2joy s VAL 6 CO 0.11 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 2joy n GLY 7 N 3.98 0.86 3.61 2.32 0.00 -0.48 -4.50 105.19 110.98 2joy n GLY 7 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2joy n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2joy s ARG 8 N -0.55 4.04 0.05 1.61 3.52 -0.73 -4.01 118.95 122.88 2joy s ARG 8 Ca 0.00 0.35 -0.31 0.00 -0.13 0.00 0.00 55.73 55.65 2joy s ARG 8 Cb 0.00 -3.67 -0.07 0.00 -1.56 0.00 0.00 34.95 29.65 2joy s ARG 8 CO 0.00 -0.41 1.47 0.42 -0.81 0.00 0.00 175.30 175.97 2joy s ILE 9 N 2.40 3.39 0.03 4.11 1.01 -1.26 -4.22 121.20 126.66 2joy s ILE 9 Ca 0.23 0.88 0.05 0.00 0.00 0.00 0.00 60.65 61.80 2joy s ILE 9 Cb -0.15 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.73 2joy s ILE 9 CO 0.09 0.02 -0.14 0.00 0.00 0.00 0.00 174.94 174.92 2joy s VAL 11 N -0.81 0.02 0.20 0.00 0.11 -0.06 -0.66 120.40 119.20 2joy s VAL 11 Ca 0.01 -0.15 0.00 0.00 -2.93 0.00 0.00 61.98 58.92 2joy s VAL 11 Cb -0.08 -0.57 0.00 0.00 -1.53 0.00 0.00 36.38 34.21 2joy s VAL 11 CO 0.01 -0.08 0.00 2.29 -3.33 0.00 0.00 175.10 173.99 2joy n LYS 12 N 2.32 -1.38 0.05 1.54 -0.00 -1.25 -1.45 118.16 118.00 2joy n LYS 12 Ca -0.16 0.99 0.00 0.00 -0.00 0.00 0.00 58.31 59.14 2joy n LYS 12 Cb 0.57 -1.85 0.00 0.00 -0.00 0.00 0.00 35.03 33.75 2joy n LYS 12 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2joy n VAL 13 N -2.76 0.19 -4.33 0.58 0.31 -1.26 -0.58 118.33 110.48 2joy n VAL 13 Ca -0.01 0.06 -0.29 0.00 -0.01 0.00 0.00 64.34 64.09 2joy n VAL 13 Cb 0.58 -0.58 -0.05 0.00 -0.91 0.00 0.00 33.84 32.89 2joy n VAL 13 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2joy s LYS 14 N -1.44 2.22 -0.04 5.55 2.20 -1.26 -4.99 119.74 121.98 2joy s LYS 14 Ca 0.00 -2.19 0.02 0.00 -0.36 0.00 0.00 55.97 53.44 2joy s LYS 14 Cb 0.00 -1.82 0.11 0.00 -1.51 0.00 0.00 37.83 34.61 2joy s LYS 14 CO 0.00 -0.45 0.79 0.41 -0.36 0.00 0.00 175.35 175.74 2joy n GLY 15 N -1.48 1.87 2.91 5.54 0.00 -1.26 -4.62 105.19 108.15 2joy n GLY 15 Ca -0.10 -0.13 -0.15 0.00 0.00 0.00 0.00 46.02 45.64 2joy n GLY 15 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2joy s ARG 16 N -1.04 0.19 0.23 1.61 3.52 -1.26 -3.26 118.95 118.94 2joy s ARG 16 Ca 0.08 0.53 0.00 0.00 -0.13 0.00 0.00 55.73 56.21 2joy s ARG 16 Cb 0.06 -0.50 0.00 0.00 -1.56 0.00 0.00 34.95 32.95 2joy s ARG 16 CO 0.02 -0.46 0.00 -1.91 -0.81 0.00 0.00 175.30 172.14 2joy n GLU 17 N 5.34 -1.55 -2.45 5.12 0.00 -1.26 -5.00 120.64 120.85 2joy n GLU 17 Ca -0.06 1.21 -0.03 0.00 0.00 0.00 0.00 57.16 58.29 2joy n GLU 17 Cb 0.50 -1.54 -0.02 0.00 0.00 0.00 0.00 31.44 30.37 2joy n GLU 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2joy n ALA 18 N -2.06 -3.53 -1.41 4.31 0.00 -1.26 -4.52 120.51 112.04 2joy n ALA 18 Ca -0.01 1.34 0.01 0.00 0.00 0.00 0.00 53.44 54.79 2joy n ALA 18 Cb 0.20 -2.62 0.02 0.00 0.00 0.00 0.00 19.45 17.04 2joy n ALA 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2joy n GLY 19 N 1.05 0.34 3.62 0.00 0.00 -1.26 -4.26 105.19 104.68 2joy n GLY 19 Ca -0.20 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 2joy n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2joy s SER 20 N -0.98 4.62 0.12 1.61 1.04 -1.26 -2.31 113.70 116.54 2joy s SER 20 Ca 0.05 -0.33 -0.12 0.00 0.48 0.00 0.00 55.95 56.03 2joy s SER 20 Cb 0.04 -0.96 -0.06 0.00 0.10 0.00 0.00 66.02 65.14 2joy s SER 20 CO 0.00 0.17 0.47 -0.54 0.98 0.00 0.00 173.24 174.32 2joy s LYS 21 N -2.33 3.86 0.03 4.02 1.02 -1.26 -3.79 119.74 121.28 2joy s LYS 21 Ca 0.23 0.31 -0.02 0.00 0.02 0.00 0.00 55.97 56.52 2joy s LYS 21 Cb -0.11 -2.94 -0.02 0.00 -0.52 0.00 0.00 37.83 34.24 2joy s LYS 21 CO 0.16 0.51 0.00 0.00 -0.92 0.00 0.00 175.35 175.10 2joy s VAL 23 N -2.19 1.80 -0.07 0.00 1.01 -1.09 -1.26 120.40 118.60 2joy s VAL 23 Ca -0.09 -0.80 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 2joy s VAL 23 Cb -0.04 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2joy s VAL 23 CO -0.03 0.50 1.35 -0.63 0.00 0.00 0.00 175.10 176.29 2joy s ILE 24 N 1.17 3.97 -0.13 2.22 1.09 -1.26 -0.04 121.20 128.23 2joy s ILE 24 Ca -0.00 1.28 0.13 0.00 -1.10 0.00 0.00 60.65 60.95 2joy s ILE 24 Cb -0.14 -3.82 -0.18 0.00 -1.06 0.00 0.00 42.46 37.26 2joy s ILE 24 CO -0.07 -0.05 0.08 0.55 -0.10 0.00 0.00 174.94 175.35 2joy n VAL 25 N 4.97 0.87 -3.72 2.92 3.14 -0.07 -1.38 118.33 125.06 2joy n VAL 25 Ca 0.13 -0.57 -0.12 0.00 -2.96 0.00 0.00 64.34 60.82 2joy n VAL 25 Cb 0.44 -0.54 -0.11 0.00 -1.06 0.00 0.00 33.84 32.58 2joy n VAL 25 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2joy s ASP 26 N -4.63 -0.43 -0.44 6.55 -1.08 -0.87 -3.48 116.67 112.28 2joy s ASP 26 Ca -0.07 0.79 -0.18 0.00 -0.52 0.00 0.00 52.55 52.57 2joy s ASP 26 Cb 0.05 0.71 0.03 0.00 -1.46 0.00 0.00 42.92 42.25 2joy s ASP 26 CO 0.59 -0.17 0.50 -0.63 0.52 0.00 0.00 175.17 175.98 2joy s ILE 27 N 0.94 5.02 0.00 4.11 1.01 -1.26 -0.61 121.20 130.40 2joy s ILE 27 Ca -0.06 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.24 2joy s ILE 27 Cb -0.07 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.29 2joy s ILE 27 CO -0.07 -0.53 0.00 -0.38 0.00 0.00 0.00 174.94 173.96 2joy n ILE 28 N 5.52 0.00 -4.27 2.92 5.41 -1.26 -4.98 119.36 122.71 2joy n ILE 28 Ca -0.07 0.43 -0.26 0.00 1.00 0.00 0.00 62.75 63.85 2joy n ILE 28 Cb 0.47 -1.41 -0.08 0.00 -0.71 0.00 0.00 39.64 37.91 2joy n ILE 28 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2joy s ASP 29 N -3.47 4.30 0.19 4.38 1.01 0.30 -5.00 116.67 118.38 2joy s ASP 29 Ca 0.00 -1.21 0.26 0.00 0.71 0.00 0.00 52.55 52.32 2joy s ASP 29 Cb 0.00 -0.30 0.86 0.00 1.01 0.00 0.00 42.92 44.49 2joy s ASP 29 CO 0.00 -0.60 1.79 0.47 0.21 0.00 0.00 175.17 177.04 2joy n ASP 30 N -1.23 0.73 -0.06 0.27 9.92 -1.26 -3.69 116.55 121.23 2joy n ASP 30 Ca -0.04 0.57 -0.20 0.00 -0.53 0.00 0.00 54.79 54.59 2joy n ASP 30 Cb 0.65 -0.77 -0.13 0.00 -0.64 0.00 0.00 41.12 40.24 2joy n ASP 30 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2joy n ASN 31 N -2.18 2.05 -3.71 -2.24 4.13 -1.26 -4.36 115.26 107.68 2joy n ASN 31 Ca 0.06 0.09 -0.20 0.00 1.68 0.00 0.00 54.58 56.21 2joy n ASN 31 Cb 0.42 -0.69 -0.17 0.00 -1.54 0.00 0.00 39.78 37.79 2joy n ASN 31 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2joy s PHE 32 N -2.53 0.18 0.43 3.10 0.08 -1.24 -3.28 117.98 114.72 2joy s PHE 32 Ca -0.28 0.15 0.06 0.00 0.12 0.00 0.00 56.93 56.98 2joy s PHE 32 Cb 0.08 -0.50 -0.06 0.00 -0.57 0.00 0.00 43.02 41.97 2joy s PHE 32 CO 0.69 -0.20 0.07 0.14 -0.10 0.00 0.00 175.22 175.82 2joy s VAL 33 N 1.89 1.94 -0.34 -0.44 -7.23 -1.26 -0.54 120.40 114.42 2joy s VAL 33 Ca 0.02 -1.90 -0.17 0.00 -1.81 0.00 0.00 61.98 58.12 2joy s VAL 33 Cb -0.12 -2.84 -0.01 0.00 0.56 0.00 0.00 36.38 33.97 2joy s VAL 33 CO -0.03 0.00 0.44 -0.22 -0.31 0.00 0.00 175.10 174.97 2joy s LEU 34 N -3.81 4.38 0.09 1.32 2.96 0.22 -3.89 118.68 119.95 2joy s LEU 34 Ca 0.32 -0.11 0.07 0.00 -0.22 0.00 0.00 54.13 54.20 2joy s LEU 34 Cb 0.07 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.25 2joy s LEU 34 CO 0.17 -0.40 -0.14 0.68 -1.32 0.00 0.00 176.35 175.34 2joy s VAL 35 N 2.20 3.12 0.01 1.68 -7.23 -1.25 -0.89 120.40 118.04 2joy s VAL 35 Ca 0.15 -1.31 0.00 0.00 -1.81 0.00 0.00 61.98 59.01 2joy s VAL 35 Cb -0.16 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.34 2joy s VAL 35 CO 0.12 0.16 -0.02 0.28 -0.31 0.00 0.00 175.10 175.33 2joy s THR 36 N -1.14 0.10 0.07 5.32 -1.32 0.94 -4.27 115.64 115.34 2joy s THR 36 Ca 0.19 -0.64 0.06 0.00 -1.21 0.00 0.00 61.69 60.10 2joy s THR 36 Cb -0.11 -0.20 -0.03 0.00 -1.51 0.00 0.00 72.50 70.65 2joy s THR 36 CO 0.11 -0.33 -0.18 -0.83 -2.21 0.00 0.00 174.62 171.18 2joy s GLY 37 N -1.01 1.02 -0.26 6.08 0.00 -1.26 -2.68 107.32 109.21 2joy s GLY 37 Ca -0.11 -1.04 -0.31 0.00 0.00 0.00 0.00 44.72 43.26 2joy s GLY 37 CO -0.01 -1.03 2.19 -1.05 0.00 0.00 0.00 173.10 173.21 2joy n PRO 38 N 1.51 1.62 0.22 2.90 -0.02 -1.26 -4.61 135.00 135.36 2joy n PRO 38 Ca -0.19 0.45 0.06 0.00 -2.02 0.00 0.00 63.50 61.81 2joy n PRO 38 Cb 0.54 -2.89 0.50 0.00 -0.02 0.00 0.00 33.50 31.63 2joy n PRO 38 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2joy h LYS 39 N 13.68 0.00 0.00 -0.52 1.57 -1.94 0.30 116.57 129.66 2joy h LYS 39 Ca -0.36 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.29 2joy h LYS 39 Cb 1.28 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.56 2joy h LYS 39 CO 0.98 0.25 -0.87 0.22 -0.57 0.00 0.00 179.45 179.47 2joy h ASP 40 N 0.00 0.00 0.00 0.86 3.58 -1.97 -3.25 116.42 115.64 2joy h ASP 40 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2joy h ASP 40 Cb 0.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2joy h ASP 40 CO 0.03 0.54 -0.62 -0.38 -2.88 0.00 0.00 179.24 175.94 2joy n ILE 41 N -3.10 0.97 -0.03 2.25 5.41 -0.84 -4.80 119.36 119.22 2joy n ILE 41 Ca -0.02 0.27 -0.20 0.00 1.00 0.00 0.00 62.75 63.80 2joy n ILE 41 Cb 0.78 -2.06 -0.13 0.00 -0.71 0.00 0.00 39.64 37.52 2joy n ILE 41 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2joy n THR 42 N -3.78 1.69 -2.50 1.39 -2.24 0.79 -4.86 114.28 104.78 2joy n THR 42 Ca -0.09 -0.65 -0.06 0.00 -2.27 0.00 0.00 64.05 60.99 2joy n THR 42 Cb 0.32 -1.59 0.03 0.00 -2.10 0.00 0.00 70.33 66.99 2joy n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2joy n GLY 43 N 2.03 -0.49 3.69 3.38 0.00 0.27 -4.99 105.19 109.08 2joy n GLY 43 Ca -0.35 0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 2joy n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2joy s VAL 44 N -3.15 4.11 -0.28 1.61 0.11 -1.26 -5.02 120.40 116.52 2joy s VAL 44 Ca 0.18 -0.76 -0.29 0.00 -2.93 0.00 0.00 61.98 58.19 2joy s VAL 44 Cb -0.02 -2.89 -0.01 0.00 -1.53 0.00 0.00 36.38 31.93 2joy s VAL 44 CO 0.44 0.27 1.47 -0.75 -3.33 0.00 0.00 175.10 173.20 2joy s LYS 45 N -1.87 3.79 -0.52 1.54 2.20 -1.26 -4.74 119.74 118.88 2joy s LYS 45 Ca 0.22 1.39 -0.29 0.00 -0.36 0.00 0.00 55.97 56.94 2joy s LYS 45 Cb -0.12 -3.98 0.03 0.00 -1.51 0.00 0.00 37.83 32.25 2joy s LYS 45 CO 0.14 -1.29 1.16 0.50 -0.36 0.00 0.00 175.35 175.50 2joy s ARG 46 N 4.55 3.64 0.33 4.03 3.52 -1.26 -4.97 118.95 128.79 2joy s ARG 46 Ca 0.64 0.44 0.01 0.00 -0.13 0.00 0.00 55.73 56.70 2joy s ARG 46 Cb -0.20 -3.95 -0.01 0.00 -1.56 0.00 0.00 34.95 29.22 2joy s ARG 46 CO 0.27 -1.51 0.37 1.03 -0.81 0.00 0.00 175.30 174.66 2joy s ARG 47 N 4.66 1.80 -0.43 5.12 0.52 -1.26 -5.06 118.95 124.30 2joy s ARG 47 Ca 0.46 -1.84 -0.18 0.00 -0.52 0.00 0.00 55.73 53.64 2joy s ARG 47 Cb -0.07 0.39 0.02 0.00 0.52 0.00 0.00 34.95 35.81 2joy s ARG 47 CO 0.29 -0.71 0.50 1.03 0.02 0.00 0.00 175.30 176.43 2joy s ARG 48 N -3.30 3.14 -0.46 3.54 0.52 -1.26 -3.92 118.95 117.21 2joy s ARG 48 Ca 0.35 -0.68 0.08 0.00 -0.52 0.00 0.00 55.73 54.96 2joy s ARG 48 Cb 0.01 -3.97 0.38 0.00 0.52 0.00 0.00 34.95 31.89 2joy s ARG 48 CO 0.23 -0.91 0.94 0.28 0.02 0.00 0.00 175.30 175.85 2joy n VAL 49 N 5.55 1.88 -2.59 3.52 0.31 -1.25 -4.85 118.33 120.88 2joy n VAL 49 Ca -0.06 -4.83 0.09 0.00 -0.01 0.00 0.00 64.34 59.53 2joy n VAL 49 Cb 0.47 -0.81 -0.02 0.00 -0.91 0.00 0.00 33.84 32.57 2joy n VAL 49 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2joy n ASN 50 N -0.16 -5.84 -0.02 4.52 5.03 -1.21 -4.67 115.26 112.91 2joy n ASN 50 Ca 0.28 0.72 -0.05 0.00 0.87 0.00 0.00 54.58 56.41 2joy n ASN 50 Cb 0.58 -2.03 -0.02 0.00 -1.02 0.00 0.00 39.78 37.29 2joy n ASN 50 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 2joy n ILE 51 N -2.72 0.23 0.29 2.41 5.41 -1.25 -4.10 119.36 119.62 2joy n ILE 51 Ca 0.00 -0.06 -0.00 0.00 1.00 0.00 0.00 62.75 63.69 2joy n ILE 51 Cb 0.31 -1.53 0.00 0.00 -0.71 0.00 0.00 39.64 37.71 2joy n ILE 51 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2joy n LEU 52 N -3.17 4.11 -0.77 1.39 7.94 -1.26 -3.35 117.00 121.89 2joy n LEU 52 Ca -0.08 -1.93 0.08 0.00 -1.11 0.00 0.00 56.01 52.96 2joy n LEU 52 Cb 0.56 -0.80 0.14 0.00 0.53 0.00 0.00 43.42 43.86 2joy n LEU 52 CO 0.01 0.74 0.59 1.57 -1.11 0.00 0.00 177.39 179.19 2joy n HIS 53 N 0.96 0.34 -3.83 1.96 -0.00 -1.26 -4.99 115.22 108.41 2joy n HIS 53 Ca 0.00 -0.26 -0.09 0.00 0.46 0.00 0.00 57.72 57.83 2joy n HIS 53 Cb 0.50 -0.01 -0.04 0.00 -0.12 0.00 0.00 29.99 30.32 2joy n HIS 53 CO 0.00 0.00 0.00 -0.48 0.46 0.00 0.00 176.34 176.32 2joy s LEU 54 N -1.14 0.18 -0.10 0.27 0.05 -1.21 -4.38 118.68 112.35 2joy s LEU 54 Ca 0.26 -0.62 -0.01 0.00 0.05 0.00 0.00 54.13 53.80 2joy s LEU 54 Cb 0.15 2.03 -0.03 0.00 -2.05 0.00 0.00 46.19 46.29 2joy s LEU 54 CO 0.21 -1.08 -0.05 -1.61 -0.55 0.00 0.00 176.35 173.27 2joy s GLU 55 N -3.92 3.08 0.23 1.48 2.02 0.25 -4.80 118.70 117.04 2joy s GLU 55 Ca 0.13 -0.52 -0.30 0.00 0.02 0.00 0.00 54.97 54.31 2joy s GLU 55 Cb -0.01 -2.72 -0.09 0.00 0.10 0.00 0.00 34.13 31.41 2joy s GLU 55 CO 0.01 0.54 1.12 -1.25 0.02 0.00 0.00 175.26 175.70 2joy s PRO 56 N -0.46 4.60 0.78 0.39 0.04 -1.26 -0.88 135.00 138.20 2joy s PRO 56 Ca 0.07 1.79 -0.10 0.00 0.04 0.00 0.00 61.00 62.80 2joy s PRO 56 Cb -0.12 -3.23 0.08 0.00 0.04 0.00 0.00 34.50 31.27 2joy s PRO 56 CO 0.02 0.11 1.12 0.95 0.04 0.00 0.00 177.00 179.24 2joy s THR 57 N -0.62 2.11 -0.15 1.26 -4.23 -1.09 -4.97 115.64 107.95 2joy s THR 57 Ca 0.48 -0.13 -0.21 0.00 -1.18 0.00 0.00 61.69 60.65 2joy s THR 57 Cb -0.31 -2.99 -0.24 0.00 1.34 0.00 0.00 72.50 70.30 2joy s THR 57 CO 0.38 0.00 0.50 -2.24 -0.54 0.00 0.00 174.62 172.72 2joy h ASP 58 N -0.91 0.17 -3.43 3.99 2.03 -1.96 -3.46 116.42 112.85 2joy h ASP 58 Ca -0.45 -0.78 -0.54 0.00 -0.73 0.00 0.00 57.03 54.53 2joy h ASP 58 Cb 1.31 -0.05 -0.03 0.00 -0.83 0.00 0.00 39.33 39.72 2joy h ASP 58 CO 0.60 1.43 0.01 -0.54 -1.03 0.00 0.00 179.24 179.71 2joy s LYS 59 N -2.38 4.11 0.14 4.15 1.02 -1.26 -4.88 119.74 120.64 2joy s LYS 59 Ca -0.22 0.67 0.05 0.00 0.02 0.00 0.00 55.97 56.48 2joy s LYS 59 Cb 0.03 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.38 2joy s LYS 59 CO 0.69 0.44 -0.11 -1.59 -0.92 0.00 0.00 175.35 173.87 2joy s LYS 60 N -1.94 1.03 -0.35 1.68 -2.85 -1.26 -4.75 119.74 111.29 2joy s LYS 60 Ca 0.40 -1.38 -0.03 0.00 -1.00 0.00 0.00 55.97 53.96 2joy s LYS 60 Cb -0.16 -0.66 0.07 0.00 -2.06 0.00 0.00 37.83 35.02 2joy s LYS 60 CO 0.20 0.09 0.11 0.96 0.10 0.00 0.00 175.35 176.81 2joy s ILE 61 N -3.00 3.32 -0.54 3.79 -4.36 -1.26 -5.07 121.20 114.08 2joy s ILE 61 Ca 0.14 -1.57 -0.28 0.00 -0.26 0.00 0.00 60.65 58.67 2joy s ILE 61 Cb 0.01 -3.04 0.03 0.00 1.25 0.00 0.00 42.46 40.70 2joy s ILE 61 CO 0.01 -0.35 1.16 -0.62 0.24 0.00 0.00 174.94 175.38 2joy s ASP 62 N 1.53 6.53 0.20 4.36 2.15 -1.26 -4.50 116.67 125.68 2joy s ASP 62 Ca 0.01 0.25 0.01 0.00 0.43 0.00 0.00 52.55 53.25 2joy s ASP 62 Cb -0.21 -2.55 0.01 0.00 -0.30 0.00 0.00 42.92 39.87 2joy s ASP 62 CO -0.01 -1.38 0.09 2.30 -0.17 0.00 0.00 175.17 176.00 2joy n ILE 63 N 6.74 0.00 -3.19 4.11 -5.35 -1.26 -5.06 119.36 115.35 2joy n ILE 63 Ca 0.10 -0.86 -0.23 0.00 -0.27 0.00 0.00 62.75 61.49 2joy n ILE 63 Cb 0.49 -0.13 -0.00 0.00 -1.74 0.00 0.00 39.64 38.26 2joy n ILE 63 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2joy s GLN 64 N -2.79 3.31 -0.10 6.28 -0.21 -1.26 -4.91 119.66 119.98 2joy s GLN 64 Ca 0.07 -0.40 -0.30 0.00 0.02 0.00 0.00 55.36 54.76 2joy s GLN 64 Cb -0.01 -2.61 -0.01 0.00 1.00 0.00 0.00 33.01 31.38 2joy s GLN 64 CO 0.05 -0.04 1.02 0.21 -2.12 0.00 0.00 175.29 174.41 2joy s LYS 65 N -4.42 4.42 0.00 2.91 2.20 -1.26 -3.65 119.74 119.94 2joy s LYS 65 Ca 0.44 1.41 0.00 0.00 -0.36 0.00 0.00 55.97 57.46 2joy s LYS 65 Cb -0.10 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.68 2joy s LYS 65 CO 0.37 -0.32 0.00 0.41 -0.36 0.00 0.00 175.35 175.45 2joy n GLY 66 N 3.10 0.48 3.45 5.54 0.00 -1.23 -5.11 105.19 111.43 2joy n GLY 66 Ca 0.09 -0.28 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 2joy n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2joy n ALA 67 N -0.57 1.04 -3.00 4.61 0.00 -1.24 -5.14 120.51 116.22 2joy n ALA 67 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 53.44 51.57 2joy n ALA 67 Cb 0.28 0.55 0.00 0.00 0.00 0.00 0.00 19.45 20.28 2joy n ALA 67 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2joy n SER 68 N -2.32 0.00 -0.28 0.00 3.41 -1.26 -5.01 113.62 108.15 2joy n SER 68 Ca 0.12 -0.91 -0.00 0.00 -0.26 0.00 0.00 58.87 57.82 2joy n SER 68 Cb 0.53 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.61 2joy n SER 68 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2joy h ASP 69 N 0.00 0.74 0.02 4.04 1.82 -1.99 -0.72 116.42 120.33 2joy h ASP 69 Ca 0.00 0.02 0.02 0.00 -0.39 0.00 0.00 57.03 56.68 2joy h ASP 69 Cb 0.00 -0.13 -0.03 0.00 0.68 0.00 0.00 39.33 39.85 2joy h ASP 69 CO 0.00 0.48 -0.17 -0.33 -1.61 0.00 0.00 179.24 177.61 2joy h GLU 70 N 0.87 -0.27 -0.29 0.28 3.07 -1.98 0.22 114.58 116.47 2joy h GLU 70 Ca 0.35 0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 59.20 2joy h GLU 70 Cb 0.17 0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 2joy h GLU 70 CO -0.17 -0.18 0.08 1.49 -1.40 0.00 0.00 179.01 178.82 2joy h GLU 71 N -0.28 0.47 -0.86 2.33 4.57 -1.85 -1.01 114.58 117.95 2joy h GLU 71 Ca 0.05 -0.11 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2joy h GLU 71 Cb 0.34 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.83 2joy h GLU 71 CO -0.14 0.54 0.53 0.28 -1.18 0.00 0.00 179.01 179.03 2joy h VAL 72 N 0.31 1.24 -0.52 0.32 2.07 -0.97 -2.17 116.25 116.52 2joy h VAL 72 Ca 0.09 -0.51 -0.10 0.00 0.82 0.00 0.00 66.70 67.00 2joy h VAL 72 Cb 0.28 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 2joy h VAL 72 CO 0.00 0.25 -0.09 0.50 0.02 0.00 0.00 177.57 178.25 2joy h LYS 73 N 1.18 0.96 0.34 1.57 3.64 -0.29 0.30 116.57 124.27 2joy h LYS 73 Ca 0.31 -0.33 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2joy h LYS 73 Cb -0.06 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2joy h LYS 73 CO -0.06 1.00 -0.24 0.87 -2.27 0.00 0.00 179.45 178.75 2joy h LYS 74 N 0.86 -0.55 -0.65 1.90 1.79 -0.79 0.13 116.57 119.27 2joy h LYS 74 Ca 0.14 0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.56 2joy h LYS 74 Cb 0.63 0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 31.38 2joy h LYS 74 CO 0.04 -0.37 0.08 0.87 -1.08 0.00 0.00 179.45 178.99 2joy h LYS 75 N -0.57 1.08 -0.43 3.15 6.56 -1.27 -1.10 116.57 123.99 2joy h LYS 75 Ca -0.03 -0.30 -0.07 0.00 -1.06 0.00 0.00 60.65 59.18 2joy h LYS 75 Cb 0.49 -0.12 -0.02 0.00 -0.57 0.00 0.00 32.23 32.01 2joy h LYS 75 CO 0.01 1.01 -0.04 1.25 -2.06 0.00 0.00 179.45 179.62 2joy h LEU 76 N 1.01 0.69 -0.21 2.94 5.85 -0.23 0.99 115.31 126.35 2joy h LEU 76 Ca 0.19 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 2joy h LEU 76 Cb 0.47 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2joy h LEU 76 CO 0.02 0.79 -0.26 -0.08 -0.34 0.00 0.00 178.44 178.57 2joy h GLU 77 N 0.67 0.54 -0.74 1.25 4.81 -0.53 0.15 114.58 120.72 2joy h GLU 77 Ca 0.13 -0.31 0.01 0.00 -0.13 0.00 0.00 59.36 59.06 2joy h GLU 77 Cb 0.48 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 2joy h GLU 77 CO 0.02 0.90 0.49 1.49 -0.73 0.00 0.00 179.01 181.19 2joy h GLU 78 N 0.22 0.98 -0.00 1.92 4.81 -0.80 -1.95 114.58 119.76 2joy h GLU 78 Ca 0.03 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2joy h GLU 78 Cb 0.83 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.99 2joy h GLU 78 CO 0.06 0.65 -0.31 0.45 -0.73 0.00 0.00 179.01 179.13 2joy n SER 79 N -4.57 0.34 -3.29 1.04 2.88 0.31 -4.93 113.62 105.41 2joy n SER 79 Ca 0.07 -0.03 -0.24 0.00 -1.33 0.00 0.00 58.87 57.35 2joy n SER 79 Cb 0.02 -0.02 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 2joy n SER 79 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2joy n ASN 80 N -1.46 -5.91 -1.30 -3.46 2.85 0.33 -4.88 115.26 101.44 2joy n ASN 80 Ca 0.07 -0.41 0.09 0.00 -0.11 0.00 0.00 54.58 54.21 2joy n ASN 80 Cb 0.33 -4.74 0.31 0.00 1.24 0.00 0.00 39.78 36.92 2joy n ASN 80 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2joy n LEU 81 N -4.35 4.28 -0.26 1.20 7.94 -0.09 -4.55 117.00 121.17 2joy n LEU 81 Ca -0.06 -2.45 0.06 0.00 -1.11 0.00 0.00 56.01 52.46 2joy n LEU 81 Cb 0.59 -0.51 0.30 0.00 0.53 0.00 0.00 43.42 44.33 2joy n LEU 81 CO 0.55 0.78 1.23 0.74 -1.11 0.00 0.00 177.39 179.59 2joy h THR 82 N 3.36 1.02 -0.48 1.96 2.02 -1.90 -1.99 112.91 116.91 2joy h THR 82 Ca 0.00 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 2joy h THR 82 Cb 1.31 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 2joy h THR 82 CO 0.18 0.16 0.22 -0.33 0.37 0.00 0.00 175.52 176.13 2joy h GLU 83 N 0.89 0.67 0.00 6.66 5.08 -1.94 -2.35 114.58 123.59 2joy h GLU 83 Ca 0.37 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.63 2joy h GLU 83 Cb 0.30 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2joy h GLU 83 CO -0.14 0.53 -0.09 -0.92 -1.00 0.00 0.00 179.01 177.38 2joy h TYR 84 N 0.67 0.00 -0.17 4.33 3.20 -1.71 -1.98 116.97 121.32 2joy h TYR 84 Ca 0.17 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.83 2joy h TYR 84 Cb 0.08 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.36 2joy h TYR 84 CO 0.01 0.09 -0.71 0.52 -1.64 0.00 0.00 178.16 176.42 2joy h MET 85 N 0.00 0.74 -1.49 1.82 2.86 -1.51 -3.27 114.93 114.09 2joy h MET 85 Ca -0.00 -0.57 -0.21 0.00 -2.06 0.00 0.00 59.70 56.86 2joy h MET 85 Cb 0.16 0.11 -0.10 0.00 0.06 0.00 0.00 31.60 31.83 2joy h MET 85 CO 0.01 1.18 0.28 1.17 1.06 0.00 0.00 176.91 180.61 2joy n LYS 86 N -3.94 1.53 -4.53 1.72 4.81 -0.74 -4.77 118.16 112.24 2joy n LYS 86 Ca -0.06 -1.08 -0.22 0.00 -0.87 0.00 0.00 58.31 56.08 2joy n LYS 86 Cb 0.71 -1.42 -0.15 0.00 0.02 0.00 0.00 35.03 34.18 2joy n LYS 86 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2joy s GLU 87 N -1.24 1.14 0.12 1.64 2.56 -1.23 -5.05 118.70 116.63 2joy s GLU 87 Ca 0.21 -0.41 0.09 0.00 0.00 0.00 0.00 54.97 54.86 2joy s GLU 87 Cb 0.17 -1.06 -0.04 0.00 2.00 0.00 0.00 34.13 35.20 2joy s GLU 87 CO 0.01 0.18 -0.18 -1.59 -0.56 0.00 0.00 175.26 173.13 2joy s LYS 88 N 0.02 1.80 0.34 4.30 -2.85 -1.26 -4.83 119.74 117.25 2joy s LYS 88 Ca -0.01 -1.17 -0.25 0.00 -1.00 0.00 0.00 55.97 53.54 2joy s LYS 88 Cb -0.08 -2.12 -0.10 0.00 -2.06 0.00 0.00 37.83 33.47 2joy s LYS 88 CO 0.01 0.48 0.93 0.42 0.10 0.00 0.00 175.35 177.29 2joy s ILE 89 N -1.15 4.27 -0.75 3.79 1.09 -0.98 -4.99 121.20 122.49 2joy s ILE 89 Ca 0.18 1.72 -0.20 0.00 -1.10 0.00 0.00 60.65 61.25 2joy s ILE 89 Cb -0.11 -3.92 0.10 0.00 -1.06 0.00 0.00 42.46 37.48 2joy s ILE 89 CO 0.10 0.05 0.97 -0.54 -0.10 0.00 0.00 174.94 175.42 2joy s LYS 90 N -2.28 3.28 -0.66 2.79 3.01 -1.26 -4.86 119.74 119.77 2joy s LYS 90 Ca 0.52 -1.30 -0.27 0.00 -1.01 0.00 0.00 55.97 53.92 2joy s LYS 90 Cb -0.17 -4.49 -0.01 0.00 -1.01 0.00 0.00 37.83 32.16 2joy s LYS 90 CO 0.21 -1.74 1.69 0.42 0.51 0.00 0.00 175.35 176.45 2joy s ILE 91 N 3.21 3.47 0.10 2.17 -1.09 -1.26 -4.97 121.20 122.83 2joy s ILE 91 Ca 0.24 0.25 -0.30 0.00 -2.23 0.00 0.00 60.65 58.60 2joy s ILE 91 Cb -0.14 -4.24 -0.06 0.00 -1.58 0.00 0.00 42.46 36.45 2joy s ILE 91 CO 0.02 -1.20 1.02 0.00 -1.23 0.00 0.00 174.94 173.54 2joy s ARG 92 N 6.64 4.62 -0.41 2.79 1.70 -1.20 -5.00 118.95 128.09 2joy s ARG 92 Ca 0.58 1.53 -0.18 0.00 -0.47 0.00 0.00 55.73 57.18 2joy s ARG 92 Cb -0.11 -3.37 0.02 0.00 -0.57 0.00 0.00 34.95 30.91 2joy s ARG 92 CO 0.18 0.09 0.49 1.41 -1.08 0.00 0.00 175.30 176.39 2joy s MET 93 N 0.24 3.24 0.62 3.89 -2.45 -1.26 -4.68 119.30 118.90 2joy s MET 93 Ca 0.50 -0.56 -0.03 0.00 -1.25 0.00 0.00 55.69 54.34 2joy s MET 93 Cb -0.25 -3.93 0.13 0.00 1.25 0.00 0.00 34.83 32.03 2joy s MET 93 CO 0.30 -0.84 0.85 -0.35 1.05 0.00 0.00 175.02 176.04 2joy n PRO 94 N 5.76 -0.23 0.09 4.11 -0.04 -1.26 -5.01 135.00 138.41 2joy n PRO 94 Ca -0.06 -2.01 0.01 0.00 -0.04 0.00 0.00 63.50 61.40 2joy n PRO 94 Cb 0.48 -0.66 -0.03 0.00 -0.04 0.00 0.00 33.50 33.24 2joy n PRO 94 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 2joy h THR 95 N -0.82 0.68 0.00 0.52 1.35 -2.06 -3.55 112.91 109.03 2joy h THR 95 Ca -0.28 -2.10 0.00 0.00 -0.55 0.00 0.00 66.41 63.48 2joy h THR 95 Cb 0.96 2.22 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 2joy h THR 95 CO 0.27 0.39 0.00 -0.11 -0.25 0.00 0.00 175.52 175.82