#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 4.16 -0.48 2.12 0.04 -1.26 -4.96 135.00 134.62 2joy s PRO 2 Ca 0.00 2.43 -0.18 0.00 0.04 0.00 0.00 61.00 63.29 2joy s PRO 2 Cb 0.00 -4.09 0.05 0.00 0.04 0.00 0.00 34.50 30.51 2joy s PRO 2 CO 0.00 -0.91 0.52 0.00 0.04 0.00 0.00 177.00 176.65 2joy s ALA 3 N 4.29 3.44 -0.78 8.56 0.00 -1.26 -5.00 121.76 131.01 2joy s ALA 3 Ca 0.82 -1.77 -0.15 0.00 0.00 0.00 0.00 51.96 50.86 2joy s ALA 3 Cb -0.38 -3.21 0.20 0.00 0.00 0.00 0.00 23.12 19.72 2joy s ALA 3 CO 0.36 -1.84 0.74 0.42 0.00 0.00 0.00 175.76 175.44 2joy s ILE 4 N 2.27 5.49 0.02 0.00 -1.09 -1.26 -4.75 121.20 121.88 2joy s ILE 4 Ca 0.12 -2.23 -0.01 0.00 -2.23 0.00 0.00 60.65 56.29 2joy s ILE 4 Cb -0.20 -4.46 0.00 0.00 -1.58 0.00 0.00 42.46 36.22 2joy s ILE 4 CO 0.11 -1.03 0.06 -1.84 -1.23 0.00 0.00 174.94 171.01 2joy n GLU 5 N 4.36 0.06 -2.21 2.79 0.28 -1.26 -5.09 120.64 119.57 2joy n GLU 5 Ca 0.09 -0.12 -0.41 0.00 -0.16 0.00 0.00 57.16 56.56 2joy n GLU 5 Cb 0.46 0.16 -0.03 0.00 1.43 0.00 0.00 31.44 33.46 2joy n GLU 5 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2joy s VAL 6 N -2.77 2.93 0.00 3.84 -7.23 -1.26 -2.57 120.40 113.34 2joy s VAL 6 Ca 0.01 0.93 0.00 0.00 -1.81 0.00 0.00 61.98 61.11 2joy s VAL 6 Cb -0.00 -3.59 0.00 0.00 0.56 0.00 0.00 36.38 33.34 2joy s VAL 6 CO 0.01 0.22 0.00 0.61 -0.31 0.00 0.00 175.10 175.63 2joy n GLY 7 N 0.94 0.70 3.58 2.32 0.00 0.57 -4.64 105.19 108.66 2joy n GLY 7 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.38 3.30 -0.21 1.61 3.00 -1.06 -1.57 118.95 123.64 2joy s ARG 8 Ca 0.00 0.73 -0.27 0.00 -1.00 0.00 0.00 55.73 55.20 2joy s ARG 8 Cb 0.00 -4.14 -0.00 0.00 0.00 0.00 0.00 34.95 30.81 2joy s ARG 8 CO 0.00 -1.92 0.92 0.42 0.00 0.00 0.00 175.30 174.72 2joy s ILE 9 N 6.35 4.78 0.04 4.11 1.01 -1.26 -2.23 121.20 134.01 2joy s ILE 9 Ca 0.60 1.79 -0.02 0.00 0.00 0.00 0.00 60.65 63.03 2joy s ILE 9 Cb -0.13 -4.21 -0.03 0.00 0.01 0.00 0.00 42.46 38.10 2joy s ILE 9 CO 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 174.94 175.13 2joy s VAL 11 N -3.17 2.56 -0.03 0.00 0.11 0.51 -0.33 120.40 120.06 2joy s VAL 11 Ca -0.00 -1.46 -0.30 0.00 -2.93 0.00 0.00 61.98 57.29 2joy s VAL 11 Cb 0.02 -2.11 -0.04 0.00 -1.53 0.00 0.00 36.38 32.72 2joy s VAL 11 CO -0.07 0.21 1.31 -0.75 -3.33 0.00 0.00 175.10 172.47 2joy s LYS 12 N -1.76 4.31 -0.78 1.54 2.47 0.16 -1.33 119.74 124.35 2joy s LYS 12 Ca 0.15 1.82 0.02 0.00 -1.56 0.00 0.00 55.97 56.41 2joy s LYS 12 Cb -0.10 -3.57 0.31 0.00 -1.46 0.00 0.00 37.83 33.01 2joy s LYS 12 CO 0.06 -0.52 1.21 1.55 0.16 0.00 0.00 175.35 177.82 2joy n VAL 13 N 4.65 4.05 0.73 4.02 3.14 -1.17 -4.38 118.33 129.36 2joy n VAL 13 Ca 0.12 -5.67 0.01 0.00 -2.96 0.00 0.00 64.34 55.84 2joy n VAL 13 Cb 0.45 -1.69 0.06 0.00 -1.06 0.00 0.00 33.84 31.59 2joy n VAL 13 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 2joy n LYS 14 N 0.27 1.55 0.00 1.45 2.85 -1.26 -4.95 118.16 118.07 2joy n LYS 14 Ca 0.34 -0.45 0.00 0.00 -1.05 0.00 0.00 58.31 57.15 2joy n LYS 14 Cb 0.35 -1.60 0.00 0.00 -0.65 0.00 0.00 35.03 33.14 2joy n LYS 14 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2joy n GLY 15 N 0.09 0.30 0.00 2.58 0.00 -1.26 -4.81 105.19 102.09 2joy n GLY 15 Ca 0.04 -1.15 0.12 0.00 0.00 0.00 0.00 46.02 45.03 2joy n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2joy n ARG 16 N 0.00 0.00 -3.00 1.61 1.74 -1.26 -4.69 116.66 111.06 2joy n ARG 16 Ca 0.00 -0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.64 2joy n ARG 16 Cb 0.00 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 29.90 2joy n ARG 16 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2joy s GLU 17 N -3.00 3.17 -0.46 5.56 2.12 -1.26 -4.97 118.70 119.86 2joy s GLU 17 Ca 0.11 -1.25 0.03 0.00 0.36 0.00 0.00 54.97 54.21 2joy s GLU 17 Cb 0.18 -4.35 0.14 0.00 0.26 0.00 0.00 34.13 30.35 2joy s GLU 17 CO 0.69 -1.67 0.25 0.00 -0.54 0.00 0.00 175.26 173.99 2joy s ALA 18 N 3.09 2.39 0.00 6.30 0.00 -1.26 -4.38 121.76 127.90 2joy s ALA 18 Ca 0.19 -2.74 0.00 0.00 0.00 0.00 0.00 51.96 49.40 2joy s ALA 18 Cb -0.18 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2joy s ALA 18 CO 0.05 -2.05 0.00 0.41 0.00 0.00 0.00 175.76 174.17 2joy n GLY 19 N 3.43 0.99 3.58 0.00 0.00 -1.26 -4.41 105.19 107.51 2joy n GLY 19 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2joy n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2joy s SER 20 N -0.58 6.21 -0.17 1.61 0.01 -1.26 -4.91 113.70 114.61 2joy s SER 20 Ca 0.00 0.24 -0.08 0.00 1.31 0.00 0.00 55.95 57.42 2joy s SER 20 Cb 0.00 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 2joy s SER 20 CO 0.00 -1.65 0.10 -0.54 0.41 0.00 0.00 173.24 171.56 2joy s LYS 21 N 5.36 3.86 0.01 12.44 1.02 -1.26 -0.67 119.74 140.51 2joy s LYS 21 Ca 0.50 -0.25 -0.02 0.00 0.02 0.00 0.00 55.97 56.22 2joy s LYS 21 Cb -0.10 -3.25 -0.01 0.00 -0.52 0.00 0.00 37.83 33.94 2joy s LYS 21 CO 0.25 0.43 0.01 0.00 -0.92 0.00 0.00 175.35 175.12 2joy s VAL 23 N -1.24 1.67 -0.35 0.00 1.01 -1.25 -0.86 120.40 119.39 2joy s VAL 23 Ca -0.13 -0.87 -0.28 0.00 0.00 0.00 0.00 61.98 60.69 2joy s VAL 23 Cb -0.08 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 2joy s VAL 23 CO -0.00 0.47 1.84 -0.63 0.00 0.00 0.00 175.10 176.78 2joy s ILE 24 N -0.21 3.43 -0.13 2.22 1.01 -0.95 -3.09 121.20 123.49 2joy s ILE 24 Ca 0.01 0.42 0.04 0.00 0.00 0.00 0.00 60.65 61.12 2joy s ILE 24 Cb -0.11 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.64 2joy s ILE 24 CO 0.01 -0.42 -0.06 0.52 0.00 0.00 0.00 174.94 174.99 2joy n VAL 25 N 7.43 0.76 -3.92 2.92 0.31 -0.99 -0.32 118.33 124.53 2joy n VAL 25 Ca 0.23 -0.35 -0.11 0.00 -0.01 0.00 0.00 64.34 64.10 2joy n VAL 25 Cb 0.47 -0.89 -0.13 0.00 -0.91 0.00 0.00 33.84 32.38 2joy n VAL 25 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2joy s ASP 26 N -4.96 0.11 -0.25 4.52 2.15 -0.89 -0.86 116.67 116.49 2joy s ASP 26 Ca -0.14 -0.17 -0.03 0.00 0.43 0.00 0.00 52.55 52.65 2joy s ASP 26 Cb 0.04 0.03 0.02 0.00 -0.30 0.00 0.00 42.92 42.71 2joy s ASP 26 CO 0.36 -0.10 -0.04 -0.63 -0.17 0.00 0.00 175.17 174.59 2joy s ILE 27 N -0.49 3.10 -0.10 4.11 1.01 -1.26 0.22 121.20 127.79 2joy s ILE 27 Ca -0.05 -0.91 -0.09 0.00 0.00 0.00 0.00 60.65 59.59 2joy s ILE 27 Cb -0.03 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 2joy s ILE 27 CO -0.00 0.20 -0.18 -0.38 0.00 0.00 0.00 174.94 174.58 2joy n ILE 28 N 4.71 0.90 -2.29 2.92 -0.00 -1.24 -4.96 119.36 119.41 2joy n ILE 28 Ca -0.16 0.30 0.00 0.00 -0.00 0.00 0.00 62.75 62.88 2joy n ILE 28 Cb 0.48 -2.03 0.00 0.00 -0.00 0.00 0.00 39.64 38.09 2joy n ILE 28 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2joy n ASP 29 N -3.70 0.69 -0.06 4.38 -0.08 0.03 -5.05 116.55 112.77 2joy n ASP 29 Ca -0.07 0.00 -0.04 0.00 -1.51 0.00 0.00 54.79 53.17 2joy n ASP 29 Cb 0.27 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.69 2joy n ASP 29 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 2joy h ASP 30 N 0.00 0.00 0.18 1.67 3.58 -2.03 -3.40 116.42 116.42 2joy h ASP 30 Ca 0.00 -0.26 -0.35 0.00 0.42 0.00 0.00 57.03 56.84 2joy h ASP 30 Cb 0.00 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.00 2joy h ASP 30 CO 0.00 0.63 -2.12 -3.20 -2.88 0.00 0.00 179.24 171.67 2joy n ASN 31 N -4.74 1.11 -4.53 2.28 2.85 -1.26 -4.82 115.26 106.16 2joy n ASN 31 Ca -0.03 0.14 -0.43 0.00 -0.11 0.00 0.00 54.58 54.16 2joy n ASN 31 Cb 0.12 -0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.11 2joy n ASN 31 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 2joy s PHE 32 N -2.54 2.68 0.42 1.20 0.08 -1.26 -2.38 117.98 116.18 2joy s PHE 32 Ca -0.16 -0.02 0.06 0.00 0.12 0.00 0.00 56.93 56.94 2joy s PHE 32 Cb 0.07 -4.26 -0.07 0.00 -0.57 0.00 0.00 43.02 38.20 2joy s PHE 32 CO 0.77 -1.53 0.03 0.14 -0.10 0.00 0.00 175.22 174.53 2joy s VAL 33 N 4.37 1.95 -0.33 -0.44 -7.23 -1.26 -0.79 120.40 116.66 2joy s VAL 33 Ca 0.32 -1.96 -0.13 0.00 -1.81 0.00 0.00 61.98 58.40 2joy s VAL 33 Cb -0.12 -2.92 -0.02 0.00 0.56 0.00 0.00 36.38 33.89 2joy s VAL 33 CO 0.19 0.00 0.23 -0.22 -0.31 0.00 0.00 175.10 174.99 2joy s LEU 34 N -3.75 4.45 0.12 1.32 2.96 0.13 -3.74 118.68 120.18 2joy s LEU 34 Ca 0.33 -0.39 0.07 0.00 -0.22 0.00 0.00 54.13 53.92 2joy s LEU 34 Cb 0.08 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 2joy s LEU 34 CO 0.17 -0.22 -0.08 0.68 -1.32 0.00 0.00 176.35 175.58 2joy s VAL 35 N 1.72 3.43 -0.09 1.68 -7.23 -0.78 -2.09 120.40 117.05 2joy s VAL 35 Ca 0.06 -1.30 -0.16 0.00 -1.81 0.00 0.00 61.98 58.78 2joy s VAL 35 Cb -0.17 -2.63 0.03 0.00 0.56 0.00 0.00 36.38 34.17 2joy s VAL 35 CO 0.10 0.07 0.39 0.28 -0.31 0.00 0.00 175.10 175.63 2joy s THR 36 N -1.31 0.02 0.05 5.32 -1.32 -1.18 -1.48 115.64 115.75 2joy s THR 36 Ca 0.23 -0.20 0.05 0.00 -1.21 0.00 0.00 61.69 60.56 2joy s THR 36 Cb -0.11 -0.62 -0.04 0.00 -1.51 0.00 0.00 72.50 70.23 2joy s THR 36 CO 0.15 -0.11 -0.10 -0.83 -2.21 0.00 0.00 174.62 171.52 2joy s GLY 37 N -0.53 1.74 -0.16 6.08 0.00 -0.21 -3.89 107.32 110.36 2joy s GLY 37 Ca -0.06 -1.14 -0.39 0.00 0.00 0.00 0.00 44.72 43.13 2joy s GLY 37 CO 0.03 -1.06 1.66 -1.05 0.00 0.00 0.00 173.10 172.69 2joy n PRO 38 N 1.19 1.29 0.26 2.90 -0.02 -1.26 -3.10 135.00 136.25 2joy n PRO 38 Ca -0.15 0.47 0.15 0.00 -2.02 0.00 0.00 63.50 61.95 2joy n PRO 38 Cb 0.52 -2.17 0.58 0.00 -0.02 0.00 0.00 33.50 32.42 2joy n PRO 38 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2joy h LYS 39 N 6.79 0.00 0.08 -0.52 2.10 -1.92 -2.87 116.57 120.23 2joy h LYS 39 Ca -0.47 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 57.89 2joy h LYS 39 Cb 1.32 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.63 2joy h LYS 39 CO 0.92 0.07 -1.48 0.22 -2.00 0.00 0.00 179.45 177.18 2joy h ASP 40 N 0.00 0.25 -3.39 7.07 1.82 -1.95 -3.41 116.42 116.81 2joy h ASP 40 Ca -0.00 -0.36 -0.57 0.00 -0.39 0.00 0.00 57.03 55.71 2joy h ASP 40 Cb 0.62 -0.08 -0.39 0.00 0.68 0.00 0.00 39.33 40.15 2joy h ASP 40 CO 0.01 1.30 -0.77 -0.63 -1.61 0.00 0.00 179.24 177.55 2joy s ILE 41 N -2.63 1.03 -0.15 2.25 1.01 -1.08 -4.89 121.20 116.73 2joy s ILE 41 Ca -0.07 -1.04 -0.03 0.00 0.00 0.00 0.00 60.65 59.51 2joy s ILE 41 Cb 0.08 -1.50 0.00 0.00 0.01 0.00 0.00 42.46 41.04 2joy s ILE 41 CO 0.84 -0.28 0.10 0.41 0.00 0.00 0.00 174.94 176.00 2joy n THR 42 N 4.84 -6.04 -1.88 2.92 -1.04 -1.25 -4.16 114.28 107.68 2joy n THR 42 Ca -0.08 0.62 -0.34 0.00 -2.04 0.00 0.00 64.05 62.21 2joy n THR 42 Cb 0.45 -5.29 -0.05 0.00 -1.82 0.00 0.00 70.33 63.62 2joy n THR 42 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2joy n GLY 43 N 0.01 1.64 0.14 3.41 0.00 -1.25 -4.10 105.19 105.05 2joy n GLY 43 Ca 0.02 -0.93 0.04 0.00 0.00 0.00 0.00 46.02 45.15 2joy n GLY 43 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2joy h VAL 44 N 5.62 0.59 -0.79 1.61 2.07 -1.75 -3.50 116.25 120.10 2joy h VAL 44 Ca 0.30 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.94 2joy h VAL 44 Cb 0.86 2.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 2joy h VAL 44 CO 1.45 0.34 0.00 0.29 0.02 0.00 0.00 177.57 179.67 2joy n LYS 45 N -3.10 0.00 -5.06 1.57 5.02 -1.18 -4.64 118.16 110.78 2joy n LYS 45 Ca -0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.00 2joy n LYS 45 Cb 0.71 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 35.56 2joy n LYS 45 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2joy s ARG 46 N 0.00 2.19 -0.04 1.97 1.70 -1.26 -1.04 118.95 122.47 2joy s ARG 46 Ca 0.00 -0.76 -0.30 0.00 -0.47 0.00 0.00 55.73 54.20 2joy s ARG 46 Cb 0.00 -1.87 0.11 0.00 -0.57 0.00 0.00 34.95 32.62 2joy s ARG 46 CO 0.00 0.31 0.99 0.50 -1.08 0.00 0.00 175.30 176.02 2joy s ARG 47 N -0.06 0.70 -0.23 3.89 3.52 -0.55 -5.01 118.95 121.22 2joy s ARG 47 Ca -0.04 -0.28 -0.15 0.00 -0.13 0.00 0.00 55.73 55.13 2joy s ARG 47 Cb -0.13 0.31 -0.04 0.00 -1.56 0.00 0.00 34.95 33.53 2joy s ARG 47 CO 0.03 -0.31 0.35 1.03 -0.81 0.00 0.00 175.30 175.59 2joy s ARG 48 N -2.93 4.12 -0.01 5.12 0.52 -1.26 -1.87 118.95 122.65 2joy s ARG 48 Ca 0.07 0.08 0.08 0.00 -0.52 0.00 0.00 55.73 55.44 2joy s ARG 48 Cb -0.01 -3.57 0.13 0.00 0.52 0.00 0.00 34.95 32.03 2joy s ARG 48 CO -0.07 -0.08 1.05 1.33 0.02 0.00 0.00 175.30 177.55 2joy n VAL 49 N 4.52 0.07 -1.01 3.52 0.24 -1.25 -4.98 118.33 119.45 2joy n VAL 49 Ca -0.09 -0.37 0.12 0.00 -2.04 0.00 0.00 64.34 61.96 2joy n VAL 49 Cb 0.51 0.61 -0.04 0.00 -1.47 0.00 0.00 33.84 33.45 2joy n VAL 49 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2joy n ASN 50 N 0.09 -5.51 -0.00 -1.34 0.23 -1.26 -4.81 115.26 102.66 2joy n ASN 50 Ca 0.02 0.51 0.00 0.00 -0.53 0.00 0.00 54.58 54.59 2joy n ASN 50 Cb 0.82 -3.25 -0.01 0.00 -2.08 0.00 0.00 39.78 35.26 2joy n ASN 50 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 2joy n ILE 51 N -3.17 0.00 -0.08 1.53 -5.35 -1.00 -4.69 119.36 106.60 2joy n ILE 51 Ca -0.01 -0.39 -0.12 0.00 -0.27 0.00 0.00 62.75 61.96 2joy n ILE 51 Cb 0.61 0.90 -0.05 0.00 -1.74 0.00 0.00 39.64 39.36 2joy n ILE 51 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 2joy h LEU 52 N 0.00 0.47 -3.24 7.28 6.46 -1.88 -2.95 115.31 121.45 2joy h LEU 52 Ca 0.00 -0.37 -0.25 0.00 -0.12 0.00 0.00 57.88 57.14 2joy h LEU 52 Cb 0.02 -0.13 -0.15 0.00 -0.73 0.00 0.00 40.66 39.68 2joy h LEU 52 CO 0.00 0.73 0.32 1.41 -0.62 0.00 0.00 178.44 180.28 2joy n HIS 53 N -4.56 1.98 -4.94 1.25 8.25 -1.26 -4.78 115.22 111.17 2joy n HIS 53 Ca -0.04 -1.16 -0.27 0.00 -0.26 0.00 0.00 57.72 55.99 2joy n HIS 53 Cb 0.30 -0.64 -0.16 0.00 1.12 0.00 0.00 29.99 30.61 2joy n HIS 53 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2joy s LEU 54 N -2.25 1.98 -0.16 2.41 1.02 -1.11 -3.04 118.68 117.53 2joy s LEU 54 Ca 0.40 -0.38 -0.03 0.00 0.02 0.00 0.00 54.13 54.15 2joy s LEU 54 Cb 0.33 -1.04 -0.02 0.00 0.02 0.00 0.00 46.19 45.48 2joy s LEU 54 CO 0.09 0.20 -0.05 -1.61 0.02 0.00 0.00 176.35 175.00 2joy s GLU 55 N -0.16 3.61 0.61 1.70 2.02 -0.44 -4.85 118.70 121.19 2joy s GLU 55 Ca 0.00 -0.55 -0.10 0.00 0.02 0.00 0.00 54.97 54.33 2joy s GLU 55 Cb -0.10 -2.89 -0.04 0.00 0.10 0.00 0.00 34.13 31.20 2joy s GLU 55 CO 0.01 0.20 1.01 -1.25 0.02 0.00 0.00 175.26 175.25 2joy s PRO 56 N 0.47 3.58 0.72 0.39 0.04 -1.26 -0.36 135.00 138.58 2joy s PRO 56 Ca -0.04 0.70 0.01 0.00 0.04 0.00 0.00 61.00 61.70 2joy s PRO 56 Cb -0.14 -2.11 0.13 0.00 0.04 0.00 0.00 34.50 32.42 2joy s PRO 56 CO 0.03 -0.55 0.99 0.95 0.04 0.00 0.00 177.00 178.47 2joy s THR 57 N -3.14 2.07 -1.54 1.26 -4.23 0.08 -4.89 115.64 105.24 2joy s THR 57 Ca 0.54 -0.65 0.29 0.00 -1.18 0.00 0.00 61.69 60.70 2joy s THR 57 Cb -0.11 -2.42 0.58 0.00 1.34 0.00 0.00 72.50 71.89 2joy s THR 57 CO 0.53 0.00 2.04 0.47 -0.54 0.00 0.00 174.62 177.12 2joy n ASP 58 N -2.81 0.00 -4.74 3.99 9.92 -1.26 -4.79 116.55 116.86 2joy n ASP 58 Ca 0.16 -0.29 -0.31 0.00 -0.53 0.00 0.00 54.79 53.82 2joy n ASP 58 Cb 0.61 -0.23 -0.07 0.00 -0.64 0.00 0.00 41.12 40.79 2joy n ASP 58 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2joy s LYS 59 N -2.46 2.78 0.03 -1.24 3.01 -1.26 -5.12 119.74 115.48 2joy s LYS 59 Ca 0.31 -0.71 -0.02 0.00 -1.01 0.00 0.00 55.97 54.54 2joy s LYS 59 Cb 0.20 -2.67 -0.02 0.00 -1.01 0.00 0.00 37.83 34.32 2joy s LYS 59 CO 0.43 0.57 0.01 0.21 0.51 0.00 0.00 175.35 177.08 2joy s LYS 60 N -2.23 0.48 0.24 1.68 2.20 -1.26 -4.15 119.74 116.70 2joy s LYS 60 Ca 0.27 -0.81 0.10 0.00 -0.36 0.00 0.00 55.97 55.17 2joy s LYS 60 Cb -0.12 0.17 -0.05 0.00 -1.51 0.00 0.00 37.83 36.33 2joy s LYS 60 CO 0.19 -0.10 -0.13 0.96 -0.36 0.00 0.00 175.35 175.92 2joy s ILE 61 N -2.46 2.90 -0.55 5.43 -4.36 -0.61 -5.03 121.20 116.53 2joy s ILE 61 Ca -0.07 -2.01 0.03 0.00 -0.26 0.00 0.00 60.65 58.34 2joy s ILE 61 Cb -0.02 -2.49 0.41 0.00 1.25 0.00 0.00 42.46 41.61 2joy s ILE 61 CO -0.04 -0.27 1.50 -0.67 0.24 0.00 0.00 174.94 175.70 2joy n ASP 62 N -0.37 5.92 -4.17 4.36 2.03 -1.26 -4.08 116.55 118.98 2joy n ASP 62 Ca -0.08 -3.77 -0.30 0.00 0.52 0.00 0.00 54.79 51.16 2joy n ASP 62 Cb 0.58 -0.67 0.20 0.00 -0.72 0.00 0.00 41.12 40.51 2joy n ASP 62 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2joy s ILE 63 N -5.13 1.82 0.06 5.18 -5.25 -1.26 -5.05 121.20 111.57 2joy s ILE 63 Ca 0.52 0.00 -0.05 0.00 -0.99 0.00 0.00 60.65 60.13 2joy s ILE 63 Cb 0.43 -2.67 -0.05 0.00 2.95 0.00 0.00 42.46 43.12 2joy s ILE 63 CO -0.18 0.00 0.31 -1.10 -1.79 0.00 0.00 174.94 172.18 2joy s GLN 64 N -5.46 3.59 -0.22 0.37 -0.21 -1.26 -4.72 119.66 111.75 2joy s GLN 64 Ca 0.70 -0.10 -0.29 0.00 0.02 0.00 0.00 55.36 55.69 2joy s GLN 64 Cb -0.10 -3.00 -0.04 0.00 1.00 0.00 0.00 33.01 30.88 2joy s GLN 64 CO 0.55 0.58 1.86 0.21 -2.12 0.00 0.00 175.29 176.37 2joy s LYS 65 N -2.14 3.55 0.00 2.91 2.20 -1.26 -2.24 119.74 122.75 2joy s LYS 65 Ca 0.33 1.81 0.00 0.00 -0.36 0.00 0.00 55.97 57.75 2joy s LYS 65 Cb -0.13 -4.18 0.00 0.00 -1.51 0.00 0.00 37.83 32.01 2joy s LYS 65 CO 0.20 -1.61 0.00 0.41 -0.36 0.00 0.00 175.35 173.99 2joy n GLY 66 N 5.13 1.07 3.89 5.54 0.00 -0.04 -4.97 105.19 115.81 2joy n GLY 66 Ca 0.23 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 2joy n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2joy s ALA 67 N -2.30 3.03 0.45 4.61 0.00 -0.95 -5.08 121.76 121.51 2joy s ALA 67 Ca 0.00 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.66 2joy s ALA 67 Cb 0.00 -2.96 0.01 0.00 0.00 0.00 0.00 23.12 20.17 2joy s ALA 67 CO 0.00 -0.94 0.64 -1.54 0.00 0.00 0.00 175.76 173.92 2joy s SER 68 N -4.30 5.68 0.40 0.00 1.04 -1.26 -4.95 113.70 110.31 2joy s SER 68 Ca 0.56 -0.01 0.10 0.00 0.48 0.00 0.00 55.95 57.08 2joy s SER 68 Cb -0.11 -1.15 0.89 0.00 0.10 0.00 0.00 66.02 65.75 2joy s SER 68 CO 0.51 -0.77 1.96 -0.78 0.98 0.00 0.00 173.24 175.14 2joy h ASP 69 N 0.45 0.52 0.08 7.02 3.58 -1.99 -1.50 116.42 124.58 2joy h ASP 69 Ca -0.44 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.02 2joy h ASP 69 Cb 1.27 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.22 2joy h ASP 69 CO 0.53 0.32 -0.04 -0.08 -2.88 0.00 0.00 179.24 177.09 2joy h GLU 70 N 0.58 -0.11 -0.74 0.28 4.57 -2.00 -2.59 114.58 114.57 2joy h GLU 70 Ca 0.31 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.51 2joy h GLU 70 Cb 0.44 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.01 2joy h GLU 70 CO -0.10 0.14 0.48 1.49 -1.18 0.00 0.00 179.01 179.84 2joy h GLU 71 N -0.34 0.94 -0.47 1.92 4.57 -1.79 -2.11 114.58 117.30 2joy h GLU 71 Ca -0.01 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2joy h GLU 71 Cb 0.29 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2joy h GLU 71 CO 0.02 0.62 0.29 0.28 -1.18 0.00 0.00 179.01 179.04 2joy h VAL 72 N 0.97 1.15 -0.46 0.32 2.07 -1.26 -1.67 116.25 117.36 2joy h VAL 72 Ca 0.28 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.40 2joy h VAL 72 Cb -0.06 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 2joy h VAL 72 CO -0.08 0.15 -0.05 0.11 0.02 0.00 0.00 177.57 177.71 2joy h LYS 73 N 0.63 0.80 0.68 1.57 1.57 -1.08 0.20 116.57 120.95 2joy h LYS 73 Ca 0.17 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 2joy h LYS 73 Cb -0.01 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.22 2joy h LYS 73 CO -0.03 0.84 -0.33 0.87 -0.57 0.00 0.00 179.45 180.23 2joy h LYS 74 N 0.74 -0.88 -0.18 3.15 1.57 -1.09 -0.17 116.57 119.71 2joy h LYS 74 Ca 0.13 0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 2joy h LYS 74 Cb 0.53 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 2joy h LYS 74 CO 0.03 -0.58 -0.03 0.87 -0.57 0.00 0.00 179.45 179.17 2joy h LYS 75 N -0.93 0.26 -0.57 3.15 1.79 -1.18 -0.80 116.57 118.28 2joy h LYS 75 Ca -0.09 -0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.26 2joy h LYS 75 Cb 0.71 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.29 2joy h LYS 75 CO 0.15 0.31 0.05 1.25 -1.08 0.00 0.00 179.45 180.14 2joy h LEU 76 N 0.26 0.95 -0.62 2.94 5.85 -0.40 -2.30 115.31 121.99 2joy h LEU 76 Ca 0.06 -0.28 -0.08 0.00 0.84 0.00 0.00 57.88 58.41 2joy h LEU 76 Cb 0.23 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2joy h LEU 76 CO 0.01 0.99 0.06 -0.08 -0.34 0.00 0.00 178.44 179.08 2joy h GLU 77 N 0.87 1.05 -0.69 1.25 4.22 -0.17 -0.12 114.58 120.99 2joy h GLU 77 Ca 0.17 -0.31 0.01 0.00 0.08 0.00 0.00 59.36 59.31 2joy h GLU 77 Cb 0.48 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 2joy h GLU 77 CO 0.02 1.00 0.46 0.93 -2.18 0.00 0.00 179.01 179.24 2joy h GLU 78 N 0.96 0.89 0.00 1.92 4.39 -0.99 -1.00 114.58 120.75 2joy h GLU 78 Ca 0.18 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.83 2joy h GLU 78 Cb 0.49 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2joy h GLU 78 CO 0.02 0.59 -0.41 0.43 -1.16 0.00 0.00 179.01 178.48 2joy n SER 79 N -4.44 0.42 -1.66 1.42 7.64 -0.88 -4.93 113.62 111.20 2joy n SER 79 Ca 0.07 -0.05 -0.17 0.00 1.01 0.00 0.00 58.87 59.73 2joy n SER 79 Cb 0.05 0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.29 2joy n SER 79 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2joy n ASN 80 N -1.57 -5.12 -0.70 6.43 2.85 -0.12 -4.85 115.26 112.19 2joy n ASN 80 Ca 0.06 0.22 0.07 0.00 -0.11 0.00 0.00 54.58 54.82 2joy n ASN 80 Cb 0.35 -4.18 0.21 0.00 1.24 0.00 0.00 39.78 37.40 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 -2.24 2.03 -0.37 1.20 7.94 -0.84 -4.16 117.00 120.56 2joy n LEU 81 Ca -0.19 -0.98 0.05 0.00 -1.11 0.00 0.00 56.01 53.78 2joy n LEU 81 Cb 0.61 -0.23 0.21 0.00 0.53 0.00 0.00 43.42 44.55 2joy n LEU 81 CO 0.25 0.49 1.25 0.74 -1.11 0.00 0.00 177.39 179.02 2joy h THR 82 N 2.31 0.99 0.05 1.96 2.02 -1.89 -2.35 112.91 116.00 2joy h THR 82 Ca 0.00 -0.37 0.01 0.00 0.77 0.00 0.00 66.41 66.82 2joy h THR 82 Cb 0.52 -0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2joy h THR 82 CO 0.00 0.20 -0.12 -0.08 0.37 0.00 0.00 175.52 175.89 2joy h GLU 83 N 1.08 -0.22 0.00 6.66 4.81 -1.95 -2.24 114.58 122.72 2joy h GLU 83 Ca 0.47 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.64 2joy h GLU 83 Cb 0.35 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2joy h GLU 83 CO -0.22 -0.15 -0.35 -0.92 -0.73 0.00 0.00 179.01 176.64 2joy h TYR 84 N -0.23 0.00 -0.23 0.92 3.20 -1.70 -1.38 116.97 117.56 2joy h TYR 84 Ca 0.03 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.69 2joy h TYR 84 Cb 0.25 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.53 2joy h TYR 84 CO -0.15 0.35 -0.66 0.52 -1.64 0.00 0.00 178.16 176.58 2joy h MET 85 N 0.00 0.84 0.15 1.82 2.86 -1.24 -3.37 114.93 115.99 2joy h MET 85 Ca -0.00 -0.61 -0.01 0.00 -2.06 0.00 0.00 59.70 57.02 2joy h MET 85 Cb 0.63 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.39 2joy h MET 85 CO 0.05 1.23 -0.07 -0.22 1.06 0.00 0.00 176.91 178.95 2joy h LYS 86 N 0.61 -0.19 -5.28 1.72 3.64 -0.94 -3.46 116.57 112.68 2joy h LYS 86 Ca -0.02 0.01 -0.61 0.00 -1.27 0.00 0.00 60.65 58.77 2joy h LYS 86 Cb 1.28 0.04 -0.14 0.00 -0.41 0.00 0.00 32.23 33.01 2joy h LYS 86 CO 0.14 0.01 -0.52 -2.00 -2.27 0.00 0.00 179.45 174.81 2joy s GLU 87 N -2.43 4.09 0.00 1.90 -6.30 -0.56 -4.99 118.70 110.42 2joy s GLU 87 Ca -0.06 -0.27 0.00 0.00 -2.50 0.00 0.00 54.97 52.14 2joy s GLU 87 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 34.13 30.80 2joy s GLU 87 CO 0.20 0.29 0.00 1.63 0.02 0.00 0.00 175.26 177.41 2joy n LYS 88 N 3.51 0.00 -1.55 4.30 4.76 -1.26 -4.63 118.16 123.29 2joy n LYS 88 Ca -0.16 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.86 2joy n LYS 88 Cb 0.52 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.72 2joy n LYS 88 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2joy n ILE 89 N 0.00 2.23 -1.61 -0.18 5.41 -1.26 -4.80 119.36 119.14 2joy n ILE 89 Ca 0.00 -0.50 -0.43 0.00 1.00 0.00 0.00 62.75 62.82 2joy n ILE 89 Cb 0.00 -0.90 -0.03 0.00 -0.71 0.00 0.00 39.64 37.99 2joy n ILE 89 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2joy n LYS 90 N 0.31 2.19 -4.78 0.38 5.02 -1.26 -4.52 118.16 115.49 2joy n LYS 90 Ca 0.11 0.68 -0.33 0.00 -2.02 0.00 0.00 58.31 56.75 2joy n LYS 90 Cb 0.39 -3.10 -0.13 0.00 -0.02 0.00 0.00 35.03 32.17 2joy n LYS 90 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 2joy s ILE 91 N 6.95 3.25 -1.11 -0.18 2.07 -1.26 -4.84 121.20 126.06 2joy s ILE 91 Ca 0.98 -0.64 -0.22 0.00 -1.41 0.00 0.00 60.65 59.36 2joy s ILE 91 Cb -0.41 -2.31 0.01 0.00 0.13 0.00 0.00 42.46 39.88 2joy s ILE 91 CO 0.39 0.57 1.72 0.00 -1.91 0.00 0.00 174.94 175.71 2joy s ARG 92 N -0.45 3.33 -0.51 3.50 1.70 -1.26 -4.93 118.95 120.33 2joy s ARG 92 Ca 0.06 -1.24 -0.21 0.00 -0.47 0.00 0.00 55.73 53.86 2joy s ARG 92 Cb -0.12 -5.34 0.05 0.00 -0.57 0.00 0.00 34.95 28.97 2joy s ARG 92 CO 0.02 -2.75 0.75 -1.64 -1.08 0.00 0.00 175.30 170.60 2joy s MET 93 N 5.39 3.23 0.14 3.89 -1.94 -1.26 -5.03 119.30 123.72 2joy s MET 93 Ca 0.57 -0.56 -0.31 0.00 -1.71 0.00 0.00 55.69 53.68 2joy s MET 93 Cb -0.00 -4.06 -0.10 0.00 2.01 0.00 0.00 34.83 32.68 2joy s MET 93 CO 0.01 -1.29 1.74 -2.14 -0.01 0.00 0.00 175.02 173.33 2joy s PRO 94 N 3.17 4.15 -1.38 2.03 0.02 -1.26 -4.88 135.00 136.86 2joy s PRO 94 Ca 0.22 2.52 -0.14 0.00 0.02 0.00 0.00 61.00 63.62 2joy s PRO 94 Cb -0.16 -3.42 -0.01 0.00 0.02 0.00 0.00 34.50 30.93 2joy s PRO 94 CO 0.16 -0.77 2.30 2.41 -0.33 0.00 0.00 177.00 180.77 2joy n THR 95 N 4.46 3.34 -0.22 0.99 -1.04 -1.26 -5.33 114.28 115.23 2joy n THR 95 Ca 0.16 -2.71 0.00 0.00 -2.04 0.00 0.00 64.05 59.47 2joy n THR 95 Cb 0.38 -2.56 0.00 0.00 -1.82 0.00 0.00 70.33 66.33 2joy n THR 95 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32