#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2joy n PRO 2 N 0.00 1.12 -3.98 2.12 -0.02 -1.26 -4.93 135.00 128.04 2joy n PRO 2 Ca 0.00 0.19 -0.27 0.00 -2.02 0.00 0.00 63.50 61.40 2joy n PRO 2 Cb 0.00 -2.88 -0.17 0.00 -0.02 0.00 0.00 33.50 30.43 2joy n PRO 2 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2joy s ALA 3 N 9.61 1.44 -0.30 3.55 0.00 -1.26 -4.95 121.76 129.84 2joy s ALA 3 Ca 1.07 -0.61 -0.03 0.00 0.00 0.00 0.00 51.96 52.39 2joy s ALA 3 Cb -0.54 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 21.67 2joy s ALA 3 CO 0.37 -0.37 0.10 -0.89 0.00 0.00 0.00 175.76 174.97 2joy n ILE 4 N 4.82-11.01 -4.28 0.00 2.08 -1.26 -5.07 119.36 104.64 2joy n ILE 4 Ca -0.14 1.59 -0.18 0.00 0.56 0.00 0.00 62.75 64.57 2joy n ILE 4 Cb 0.50 -6.63 -0.09 0.00 -0.75 0.00 0.00 39.64 32.68 2joy n ILE 4 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 2joy s GLU 5 N -1.74 1.66 -0.09 0.38 1.03 -1.26 -5.10 118.70 113.58 2joy s GLU 5 Ca 0.04 -1.95 -0.30 0.00 0.03 0.00 0.00 54.97 52.79 2joy s GLU 5 Cb -0.01 0.26 -0.03 0.00 -0.80 0.00 0.00 34.13 33.55 2joy s GLU 5 CO 0.72 -0.59 1.37 0.14 -1.33 0.00 0.00 175.26 175.57 2joy s VAL 6 N -3.57 3.99 0.00 1.83 -7.23 -1.26 -2.61 120.40 111.56 2joy s VAL 6 Ca 0.40 1.26 0.00 0.00 -1.81 0.00 0.00 61.98 61.83 2joy s VAL 6 Cb 0.03 -3.81 0.00 0.00 0.56 0.00 0.00 36.38 33.16 2joy s VAL 6 CO 0.24 -0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.57 2joy n GLY 7 N 3.70 0.78 3.66 2.32 0.00 0.32 -3.74 105.19 112.23 2joy n GLY 7 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.85 4.26 0.06 1.61 3.52 -1.07 -0.49 118.95 125.99 2joy s ARG 8 Ca 0.00 1.07 -0.29 0.00 -0.13 0.00 0.00 55.73 56.38 2joy s ARG 8 Cb 0.00 -3.61 -0.05 0.00 -1.56 0.00 0.00 34.95 29.73 2joy s ARG 8 CO 0.00 -0.45 0.92 0.42 -0.81 0.00 0.00 175.30 175.38 2joy s ILE 9 N 2.58 4.67 0.04 4.11 1.09 -1.26 -1.01 121.20 131.43 2joy s ILE 9 Ca 0.39 1.95 0.07 0.00 -1.10 0.00 0.00 60.65 61.96 2joy s ILE 9 Cb -0.16 -4.27 -0.02 0.00 -1.06 0.00 0.00 42.46 36.95 2joy s ILE 9 CO 0.10 0.28 -0.19 0.00 -0.10 0.00 0.00 174.94 175.03 2joy s VAL 11 N -0.81 4.97 0.10 0.00 0.11 0.10 -1.56 120.40 123.32 2joy s VAL 11 Ca 0.06 -0.56 -0.30 0.00 -2.93 0.00 0.00 61.98 58.24 2joy s VAL 11 Cb -0.08 -3.41 -0.06 0.00 -1.53 0.00 0.00 36.38 31.30 2joy s VAL 11 CO 0.02 0.14 1.08 -0.54 -3.33 0.00 0.00 175.10 172.47 2joy s LYS 12 N -2.42 4.56 -0.19 1.54 -0.14 -1.20 -2.21 119.74 119.67 2joy s LYS 12 Ca 0.32 1.63 -0.01 0.00 -1.36 0.00 0.00 55.97 56.54 2joy s LYS 12 Cb -0.13 -3.35 0.08 0.00 -1.68 0.00 0.00 37.83 32.76 2joy s LYS 12 CO 0.25 -0.02 2.22 0.28 -0.76 0.00 0.00 175.35 177.31 2joy n VAL 13 N 3.20 2.58 -2.86 3.17 0.31 -1.20 -4.47 118.33 119.05 2joy n VAL 13 Ca 0.05 -1.36 -0.44 0.00 -0.01 0.00 0.00 64.34 62.58 2joy n VAL 13 Cb 0.48 -1.47 -0.01 0.00 -0.91 0.00 0.00 33.84 31.93 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 -0.93 3.98 0.00 5.55 2.20 -1.26 -4.76 119.74 124.52 2joy s LYS 14 Ca 0.26 -2.30 0.00 0.00 -0.36 0.00 0.00 55.97 53.57 2joy s LYS 14 Cb 0.18 -5.14 0.00 0.00 -1.51 0.00 0.00 37.83 31.36 2joy s LYS 14 CO -0.02 -1.87 0.00 0.41 -0.36 0.00 0.00 175.35 173.51 2joy n GLY 15 N 4.65 0.94 0.22 5.54 0.00 -1.26 -4.21 105.19 111.07 2joy n GLY 15 Ca 0.37 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.38 2joy n GLY 15 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2joy n ARG 16 N 0.00 0.00 0.00 1.61 0.00 -1.26 -5.02 116.66 111.99 2joy n ARG 16 Ca 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 57.85 57.79 2joy n ARG 16 Cb 0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 32.46 32.42 2joy n ARG 16 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2joy n GLU 17 N 0.00 0.00 -0.93 2.89 4.07 -1.26 -5.12 120.64 120.29 2joy n GLU 17 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2joy n GLU 17 Cb 0.51 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.89 2joy n GLU 17 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2joy n ALA 18 N -2.50 -2.52 -1.07 4.31 0.00 -1.26 -4.80 120.51 112.67 2joy n ALA 18 Ca 0.00 0.24 -0.05 0.00 0.00 0.00 0.00 53.44 53.63 2joy n ALA 18 Cb 0.00 -0.98 0.30 0.00 0.00 0.00 0.00 19.45 18.77 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 0.01 3.77 2.84 0.00 0.00 -1.26 -4.66 105.19 105.89 2joy n GLY 19 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 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 -1.19 3.75 -0.03 1.61 0.01 -1.26 -4.48 113.70 112.11 2joy s SER 20 Ca 0.54 -1.30 -0.02 0.00 1.31 0.00 0.00 55.95 56.48 2joy s SER 20 Cb 0.43 -0.99 -0.04 0.00 0.21 0.00 0.00 66.02 65.63 2joy s SER 20 CO 0.12 -0.31 0.10 -0.54 0.41 0.00 0.00 173.24 173.02 2joy s LYS 21 N 1.52 3.17 0.03 12.44 1.02 -1.26 -3.25 119.74 133.42 2joy s LYS 21 Ca 0.01 -0.40 -0.00 0.00 0.02 0.00 0.00 55.97 55.60 2joy s LYS 21 Cb -0.18 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.17 2joy s LYS 21 CO -0.12 0.67 -0.03 0.00 -0.92 0.00 0.00 175.35 174.95 2joy s VAL 23 N -2.14 3.35 -0.47 0.00 1.01 0.33 0.16 120.40 122.64 2joy s VAL 23 Ca -0.09 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.03 2joy s VAL 23 Cb -0.05 -2.41 0.03 0.00 0.00 0.00 0.00 36.38 33.95 2joy s VAL 23 CO -0.03 0.53 1.20 -0.63 0.00 0.00 0.00 175.10 176.17 2joy s ILE 24 N 0.07 4.12 -0.14 2.22 1.01 -0.18 -1.62 121.20 126.69 2joy s ILE 24 Ca -0.04 1.14 0.17 0.00 0.00 0.00 0.00 60.65 61.92 2joy s ILE 24 Cb -0.14 -4.53 -0.25 0.00 0.01 0.00 0.00 42.46 37.56 2joy s ILE 24 CO 0.04 -0.98 0.15 0.52 0.00 0.00 0.00 174.94 174.67 2joy n VAL 25 N 6.90 0.96 -3.86 2.92 0.31 -1.04 -0.52 118.33 124.00 2joy n VAL 25 Ca 0.13 -0.70 -0.16 0.00 -0.01 0.00 0.00 64.34 63.60 2joy n VAL 25 Cb 0.49 -0.38 -0.16 0.00 -0.91 0.00 0.00 33.84 32.88 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 -5.02 0.26 -0.60 4.52 2.15 -1.19 -3.88 116.67 112.91 2joy s ASP 26 Ca -0.09 0.00 -0.16 0.00 0.43 0.00 0.00 52.55 52.74 2joy s ASP 26 Cb 0.07 -0.15 0.15 0.00 -0.30 0.00 0.00 42.92 42.69 2joy s ASP 26 CO 0.77 -0.11 0.57 -0.63 -0.17 0.00 0.00 175.17 175.60 2joy s ILE 27 N 1.04 5.26 -0.06 4.11 1.01 -1.26 -0.19 121.20 131.10 2joy s ILE 27 Ca -0.10 -1.66 -0.14 0.00 0.00 0.00 0.00 60.65 58.76 2joy s ILE 27 Cb -0.13 -4.38 -0.10 0.00 0.01 0.00 0.00 42.46 37.86 2joy s ILE 27 CO -0.02 -0.92 0.55 0.40 0.00 0.00 0.00 174.94 174.94 2joy h ILE 28 N 5.67 0.38 -4.91 2.92 2.04 -1.87 -3.48 117.51 118.27 2joy h ILE 28 Ca -0.22 -0.99 -0.49 0.00 1.00 0.00 0.00 64.86 64.16 2joy h ILE 28 Cb 1.09 0.67 -0.09 0.00 -0.74 0.00 0.00 36.82 37.75 2joy h ILE 28 CO 0.99 0.11 -0.34 0.47 0.00 0.00 0.00 178.15 179.38 2joy n ASP 29 N -4.94 2.95 0.06 1.72 9.92 0.11 -5.01 116.55 121.35 2joy n ASP 29 Ca -0.06 -2.65 -0.21 0.00 -0.53 0.00 0.00 54.79 51.34 2joy n ASP 29 Cb 0.19 0.22 -0.12 0.00 -0.64 0.00 0.00 41.12 40.78 2joy n ASP 29 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 2joy h ASP 30 N 0.86 0.89 0.35 -2.24 1.82 -2.03 -3.31 116.42 112.76 2joy h ASP 30 Ca -0.31 -0.77 0.00 0.00 -0.39 0.00 0.00 57.03 55.55 2joy h ASP 30 Cb 0.97 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 40.70 2joy h ASP 30 CO 0.51 1.56 -1.11 0.59 -1.61 0.00 0.00 179.24 179.18 2joy n ASN 31 N -3.85 0.60 -4.07 2.28 3.02 -1.26 -4.89 115.26 107.09 2joy n ASN 31 Ca -0.12 -0.27 -0.30 0.00 -0.03 0.00 0.00 54.58 53.86 2joy n ASN 31 Cb 0.92 0.92 -0.17 0.00 -0.61 0.00 0.00 39.78 40.84 2joy n ASN 31 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2joy s PHE 32 N -3.21 2.19 0.35 3.10 5.36 -1.25 -1.11 117.98 123.41 2joy s PHE 32 Ca 0.03 -1.12 0.05 0.00 -0.96 0.00 0.00 56.93 54.93 2joy s PHE 32 Cb 0.14 -1.57 -0.07 0.00 -0.34 0.00 0.00 43.02 41.19 2joy s PHE 32 CO 0.82 -0.58 0.04 0.14 -1.46 0.00 0.00 175.22 174.18 2joy s VAL 33 N 1.13 1.49 -0.26 3.12 -7.23 0.10 0.05 120.40 118.80 2joy s VAL 33 Ca -0.02 -2.01 -0.04 0.00 -1.81 0.00 0.00 61.98 58.10 2joy s VAL 33 Cb -0.14 -2.85 0.01 0.00 0.56 0.00 0.00 36.38 33.96 2joy s VAL 33 CO -0.05 -0.01 -0.00 -0.22 -0.31 0.00 0.00 175.10 174.50 2joy s LEU 34 N -3.56 3.36 0.09 1.32 2.96 0.73 -1.63 118.68 121.94 2joy s LEU 34 Ca 0.36 -0.69 0.07 0.00 -0.22 0.00 0.00 54.13 53.64 2joy s LEU 34 Cb 0.09 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 2joy s LEU 34 CO 0.16 -0.12 -0.10 0.68 -1.32 0.00 0.00 176.35 175.65 2joy s VAL 35 N 1.43 3.37 0.17 1.68 -7.23 -0.94 -2.49 120.40 116.39 2joy s VAL 35 Ca 0.02 -1.22 -0.15 0.00 -1.81 0.00 0.00 61.98 58.83 2joy s VAL 35 Cb -0.16 -2.56 0.05 0.00 0.56 0.00 0.00 36.38 34.27 2joy s VAL 35 CO -0.02 0.15 0.71 1.07 -0.31 0.00 0.00 175.10 176.71 2joy n THR 36 N 0.83 0.00 -3.97 5.32 5.66 -0.64 -2.35 114.28 119.13 2joy n THR 36 Ca -0.14 -0.48 -0.10 0.00 -3.05 0.00 0.00 64.05 60.29 2joy n THR 36 Cb 0.52 0.60 -0.06 0.00 -1.55 0.00 0.00 70.33 69.84 2joy n THR 36 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2joy s GLY 37 N -2.91 0.51 0.08 1.09 0.00 -1.00 -0.51 107.32 104.58 2joy s GLY 37 Ca 0.16 -0.86 -0.31 0.00 0.00 0.00 0.00 44.72 43.71 2joy s GLY 37 CO 0.05 -0.71 1.69 -4.14 0.00 0.00 0.00 173.10 169.99 2joy s PRO 38 N -3.99 4.19 0.30 2.90 0.02 -1.26 -4.28 135.00 132.88 2joy s PRO 38 Ca 0.20 2.39 0.16 0.00 0.02 0.00 0.00 61.00 63.77 2joy s PRO 38 Cb 0.01 -3.58 0.25 0.00 0.02 0.00 0.00 34.50 31.21 2joy s PRO 38 CO 0.05 -0.75 1.53 0.87 -0.33 0.00 0.00 177.00 178.37 2joy h LYS 39 N 8.31 0.00 0.00 5.54 6.56 -1.91 0.54 116.57 135.61 2joy h LYS 39 Ca -0.43 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.16 2joy h LYS 39 Cb 1.20 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.86 2joy h LYS 39 CO 0.93 0.48 -0.27 0.22 -2.06 0.00 0.00 179.45 178.75 2joy h ASP 40 N 0.00 0.00 0.00 0.86 3.58 -1.95 -3.28 116.42 115.63 2joy h ASP 40 Ca -0.00 -0.06 -0.23 0.00 0.42 0.00 0.00 57.03 57.15 2joy h ASP 40 Cb 1.25 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.27 2joy h ASP 40 CO 0.06 0.03 -1.71 -0.38 -2.88 0.00 0.00 179.24 174.36 2joy n ILE 41 N -2.45 0.97 -0.05 2.25 5.41 -1.10 -4.92 119.36 119.46 2joy n ILE 41 Ca 0.04 -0.16 -0.11 0.00 1.00 0.00 0.00 62.75 63.53 2joy n ILE 41 Cb 0.47 -1.77 -0.04 0.00 -0.71 0.00 0.00 39.64 37.59 2joy n ILE 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2joy n THR 42 N -3.78 0.57 0.00 1.39 -1.04 0.16 -4.82 114.28 106.75 2joy n THR 42 Ca -0.28 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.57 2joy n THR 42 Cb 0.66 -1.53 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 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 2.44 1.33 3.66 3.41 0.00 0.72 -4.96 105.19 111.80 2joy n GLY 43 Ca -0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 2joy n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2joy s VAL 44 N -2.00 4.94 0.99 1.61 1.01 -1.26 -4.92 120.40 120.77 2joy s VAL 44 Ca 0.00 1.44 -0.17 0.00 0.00 0.00 0.00 61.98 63.26 2joy s VAL 44 Cb 0.00 -4.06 0.22 0.00 0.00 0.00 0.00 36.38 32.55 2joy s VAL 44 CO 0.00 0.06 1.35 -0.54 0.00 0.00 0.00 175.10 175.97 2joy s LYS 45 N 2.08 0.41 -0.16 2.72 3.01 -1.26 -2.37 119.74 124.16 2joy s LYS 45 Ca 0.34 -0.50 -0.20 0.00 -1.01 0.00 0.00 55.97 54.60 2joy s LYS 45 Cb -0.16 -1.83 -0.03 0.00 -1.01 0.00 0.00 37.83 34.80 2joy s LYS 45 CO 0.11 -2.56 0.59 0.50 0.51 0.00 0.00 175.35 174.51 2joy s ARG 46 N -5.94 4.27 0.02 1.68 3.52 -1.26 -4.25 118.95 116.98 2joy s ARG 46 Ca 0.76 0.60 -0.14 0.00 -0.13 0.00 0.00 55.73 56.82 2joy s ARG 46 Cb -0.03 -3.52 0.02 0.00 -1.56 0.00 0.00 34.95 29.86 2joy s ARG 46 CO 0.54 -0.09 0.29 -0.98 -0.81 0.00 0.00 175.30 174.25 2joy s ARG 47 N 1.41 0.73 0.13 5.12 1.70 -0.99 -5.05 118.95 121.99 2joy s ARG 47 Ca 0.29 -0.37 -0.14 0.00 -0.47 0.00 0.00 55.73 55.04 2joy s ARG 47 Cb -0.16 0.32 -0.07 0.00 -0.57 0.00 0.00 34.95 34.47 2joy s ARG 47 CO 0.12 -0.22 0.53 1.03 -1.08 0.00 0.00 175.30 175.68 2joy s ARG 48 N -1.95 3.97 0.08 3.89 0.52 -1.26 -2.21 118.95 121.98 2joy s ARG 48 Ca -0.09 0.47 -0.16 0.00 -0.52 0.00 0.00 55.73 55.42 2joy s ARG 48 Cb -0.03 -2.97 0.03 0.00 0.52 0.00 0.00 34.95 32.50 2joy s ARG 48 CO 0.00 0.51 0.38 0.54 0.02 0.00 0.00 175.30 176.75 2joy s VAL 49 N -1.42 0.07 0.45 3.52 0.11 -0.65 -4.96 120.40 117.52 2joy s VAL 49 Ca 0.36 -0.57 -0.02 0.00 -2.93 0.00 0.00 61.98 58.82 2joy s VAL 49 Cb -0.15 -1.05 -0.02 0.00 -1.53 0.00 0.00 36.38 33.62 2joy s VAL 49 CO 0.19 -0.31 0.70 0.54 -3.33 0.00 0.00 175.10 172.89 2joy s ASN 50 N -2.35 6.10 0.00 3.54 2.20 -1.26 -0.72 114.94 122.45 2joy s ASN 50 Ca -0.02 0.62 0.16 0.00 -0.94 0.00 0.00 52.86 52.68 2joy s ASN 50 Cb 0.00 -1.97 0.76 0.00 -2.00 0.00 0.00 41.25 38.05 2joy s ASN 50 CO -0.06 -0.57 1.51 2.30 -2.94 0.00 0.00 177.10 177.33 2joy n ILE 51 N -2.12 0.10 0.94 0.54 -5.35 -0.27 -3.81 119.36 109.40 2joy n ILE 51 Ca -0.00 -0.14 0.13 0.00 -0.27 0.00 0.00 62.75 62.46 2joy n ILE 51 Cb 0.56 -0.01 0.40 0.00 -1.74 0.00 0.00 39.64 38.85 2joy n ILE 51 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2joy n LEU 52 N -0.31 0.34 -1.24 7.28 4.32 -1.26 -3.72 117.00 122.41 2joy n LEU 52 Ca 0.12 0.24 0.04 0.00 -0.02 0.00 0.00 56.01 56.39 2joy n LEU 52 Cb 0.15 -0.35 0.09 0.00 -1.62 0.00 0.00 43.42 41.70 2joy n LEU 52 CO 0.09 0.05 0.17 1.57 -1.22 0.00 0.00 177.39 178.05 2joy n HIS 53 N -1.59 0.14 -4.60 -1.77 -0.00 -1.25 -5.05 115.22 101.10 2joy n HIS 53 Ca 0.06 -1.01 -0.22 0.00 0.46 0.00 0.00 57.72 57.01 2joy n HIS 53 Cb 0.35 -0.20 -0.15 0.00 -0.12 0.00 0.00 29.99 29.87 2joy n HIS 53 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 2joy s LEU 54 N -1.51 2.05 -0.00 0.27 1.43 -1.24 -3.28 118.68 116.39 2joy s LEU 54 Ca 0.36 -0.28 0.08 0.00 -1.03 0.00 0.00 54.13 53.26 2joy s LEU 54 Cb 0.38 -0.70 -0.02 0.00 0.03 0.00 0.00 46.19 45.87 2joy s LEU 54 CO -0.12 0.15 -0.26 -1.61 0.23 0.00 0.00 176.35 174.75 2joy s GLU 55 N -0.43 1.99 0.27 1.70 2.02 -0.94 -4.97 118.70 118.33 2joy s GLU 55 Ca 0.05 -0.96 -0.29 0.00 0.02 0.00 0.00 54.97 53.79 2joy s GLU 55 Cb -0.06 -1.98 -0.09 0.00 0.10 0.00 0.00 34.13 32.10 2joy s GLU 55 CO -0.00 0.54 0.96 -1.25 0.02 0.00 0.00 175.26 175.52 2joy s PRO 56 N -0.76 4.76 0.83 0.39 0.04 -1.26 0.01 135.00 139.01 2joy s PRO 56 Ca 0.10 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.50 2joy s PRO 56 Cb -0.10 -3.14 0.12 0.00 0.04 0.00 0.00 34.50 31.41 2joy s PRO 56 CO -0.00 0.42 1.18 0.95 0.04 0.00 0.00 177.00 179.59 2joy s THR 57 N -1.29 2.06 0.27 1.26 -4.23 -1.11 -4.86 115.64 107.74 2joy s THR 57 Ca 0.44 -0.08 0.01 0.00 -1.18 0.00 0.00 61.69 60.87 2joy s THR 57 Cb -0.25 -2.98 0.07 0.00 1.34 0.00 0.00 72.50 70.69 2joy s THR 57 CO 0.31 0.00 1.72 -0.78 -0.54 0.00 0.00 174.62 175.33 2joy h ASP 58 N -1.12 0.57 -4.24 3.99 3.58 -1.97 -3.45 116.42 113.79 2joy h ASP 58 Ca -0.45 -0.18 -0.68 0.00 0.42 0.00 0.00 57.03 56.14 2joy h ASP 58 Cb 1.29 -0.15 -0.26 0.00 1.72 0.00 0.00 39.33 41.93 2joy h ASP 58 CO 0.55 0.77 -0.87 -0.54 -2.88 0.00 0.00 179.24 176.27 2joy s LYS 59 N -4.61 1.68 0.24 0.28 1.02 -1.26 -5.13 119.74 111.95 2joy s LYS 59 Ca -0.08 -1.13 0.04 0.00 0.02 0.00 0.00 55.97 54.82 2joy s LYS 59 Cb 0.14 -1.90 -0.02 0.00 -0.52 0.00 0.00 37.83 35.53 2joy s LYS 59 CO 0.80 0.48 0.24 0.36 -0.92 0.00 0.00 175.35 176.31 2joy n LYS 60 N 1.63 0.35 -4.65 1.68 -0.00 -1.26 -4.40 118.16 111.51 2joy n LYS 60 Ca -0.17 -2.33 -0.29 0.00 -0.00 0.00 0.00 58.31 55.51 2joy n LYS 60 Cb 0.52 1.98 -0.09 0.00 -0.00 0.00 0.00 35.03 37.45 2joy n LYS 60 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 2joy s ILE 61 N -2.92 1.24 -0.23 0.58 -4.36 0.36 -4.98 121.20 110.89 2joy s ILE 61 Ca 0.27 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.67 2joy s ILE 61 Cb 0.01 -2.45 0.06 0.00 1.25 0.00 0.00 42.46 41.33 2joy s ILE 61 CO 0.19 0.00 -0.07 -0.62 0.24 0.00 0.00 174.94 174.68 2joy s ASP 62 N -3.75 3.91 0.35 4.36 -1.08 -1.26 -4.28 116.67 114.93 2joy s ASP 62 Ca 0.19 -1.18 0.07 0.00 -0.52 0.00 0.00 52.55 51.11 2joy s ASP 62 Cb 0.04 -1.27 -0.03 0.00 -1.46 0.00 0.00 42.92 40.21 2joy s ASP 62 CO 0.10 -0.21 0.25 2.30 0.52 0.00 0.00 175.17 178.13 2joy n ILE 63 N 4.62 0.00 -4.06 4.11 -6.64 -1.25 -4.98 119.36 111.17 2joy n ILE 63 Ca -0.13 -2.45 -0.26 0.00 -1.77 0.00 0.00 62.75 58.15 2joy n ILE 63 Cb 0.44 1.15 -0.05 0.00 -1.44 0.00 0.00 39.64 39.74 2joy n ILE 63 CO 0.00 0.00 0.00 -1.58 -1.77 0.00 0.00 176.55 173.20 2joy s GLN 64 N -3.41 3.00 0.31 6.28 -0.44 -1.26 -4.77 119.66 119.37 2joy s GLN 64 Ca 0.36 -0.84 -0.30 0.00 -2.50 0.00 0.00 55.36 52.09 2joy s GLN 64 Cb 0.02 -2.70 -0.12 0.00 -1.64 0.00 0.00 33.01 28.57 2joy s GLN 64 CO 0.25 0.48 1.56 1.17 0.50 0.00 0.00 175.29 179.26 2joy n LYS 65 N -0.46 2.67 -1.06 1.67 4.81 -1.26 -3.04 118.16 121.49 2joy n LYS 65 Ca -0.08 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 2joy n LYS 65 Cb 0.55 -2.71 0.00 0.00 0.02 0.00 0.00 35.03 32.88 2joy n LYS 65 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2joy n GLY 66 N 1.74 1.14 3.76 3.14 0.00 -1.25 -5.05 105.19 108.66 2joy n GLY 66 Ca 0.07 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.03 3.32 0.76 4.61 0.00 -1.17 -5.05 121.76 122.19 2joy s ALA 67 Ca 0.00 0.73 -0.08 0.00 0.00 0.00 0.00 51.96 52.61 2joy s ALA 67 Cb 0.00 -3.26 0.09 0.00 0.00 0.00 0.00 23.12 19.95 2joy s ALA 67 CO 0.00 -0.00 1.08 -1.54 0.00 0.00 0.00 175.76 175.30 2joy s SER 68 N -1.16 4.45 0.36 0.00 1.04 -1.26 -4.81 113.70 112.32 2joy s SER 68 Ca 0.46 0.36 0.06 0.00 0.48 0.00 0.00 55.95 57.31 2joy s SER 68 Cb -0.27 -0.87 0.74 0.00 0.10 0.00 0.00 66.02 65.72 2joy s SER 68 CO 0.34 -1.85 1.94 -0.78 0.98 0.00 0.00 173.24 173.88 2joy h ASP 69 N -0.81 0.68 0.01 7.02 1.82 -1.96 0.11 116.42 123.28 2joy h ASP 69 Ca -0.44 0.01 -0.25 0.00 -0.39 0.00 0.00 57.03 55.96 2joy h ASP 69 Cb 1.30 -0.14 0.01 0.00 0.68 0.00 0.00 39.33 41.19 2joy h ASP 69 CO 0.55 0.43 -0.95 -0.08 -1.61 0.00 0.00 179.24 177.58 2joy h GLU 70 N 0.76 0.68 -0.23 0.28 4.22 -1.97 -0.63 114.58 117.70 2joy h GLU 70 Ca 0.34 -0.67 -0.03 0.00 0.08 0.00 0.00 59.36 59.07 2joy h GLU 70 Cb 0.32 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2joy h GLU 70 CO -0.12 1.27 0.03 1.49 -2.18 0.00 0.00 179.01 179.50 2joy h GLU 71 N 0.41 0.39 -0.75 1.92 4.57 -1.73 0.18 114.58 119.57 2joy h GLU 71 Ca -0.10 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 57.95 2joy h GLU 71 Cb 1.59 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 30.10 2joy h GLU 71 CO 0.18 0.54 0.37 0.28 -1.18 0.00 0.00 179.01 179.21 2joy h VAL 72 N 0.18 1.23 -0.61 0.32 2.07 -0.86 -2.18 116.25 116.40 2joy h VAL 72 Ca 0.07 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2joy h VAL 72 Cb 0.35 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 2joy h VAL 72 CO 0.01 0.27 0.40 0.50 0.02 0.00 0.00 177.57 178.77 2joy h LYS 73 N 1.06 0.81 0.50 1.57 3.64 -0.65 0.26 116.57 123.77 2joy h LYS 73 Ca 0.26 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 2joy h LYS 73 Cb 0.09 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2joy h LYS 73 CO -0.04 0.54 -0.43 0.87 -2.27 0.00 0.00 179.45 178.13 2joy h LYS 74 N 0.83 -0.89 -0.45 1.90 1.57 -0.14 -0.90 116.57 118.49 2joy h LYS 74 Ca 0.22 0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.97 2joy h LYS 74 Cb -0.09 0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2joy h LYS 74 CO -0.05 -0.59 -0.09 0.87 -0.57 0.00 0.00 179.45 179.02 2joy h LYS 75 N -0.92 0.80 -0.73 3.15 1.79 -1.25 0.28 116.57 119.69 2joy h LYS 75 Ca -0.05 -0.26 -0.02 0.00 -2.18 0.00 0.00 60.65 58.14 2joy h LYS 75 Cb 0.79 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 31.34 2joy h LYS 75 CO -0.03 0.86 0.36 1.25 -1.08 0.00 0.00 179.45 180.82 2joy h LEU 76 N 0.73 0.94 -0.13 2.94 5.85 -0.41 0.14 115.31 125.37 2joy h LEU 76 Ca 0.13 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2joy h LEU 76 Cb 0.57 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 2joy h LEU 76 CO 0.03 0.80 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.78 2joy h GLU 77 N 1.01 0.27 -0.27 1.25 4.22 -0.80 -0.21 114.58 120.05 2joy h GLU 77 Ca 0.25 -0.12 0.04 0.00 0.08 0.00 0.00 59.36 59.61 2joy h GLU 77 Cb 0.10 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 2joy h GLU 77 CO -0.03 0.62 0.03 1.49 -2.18 0.00 0.00 179.01 178.94 2joy h GLU 78 N -0.08 0.12 0.00 1.92 4.22 -0.12 -0.31 114.58 120.32 2joy h GLU 78 Ca 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.46 2joy h GLU 78 Cb 0.54 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2joy h GLU 78 CO 0.02 0.08 0.00 0.43 -2.18 0.00 0.00 179.01 177.36 2joy n SER 79 N -5.12 0.00 -1.17 1.04 7.64 0.45 -4.89 113.62 111.58 2joy n SER 79 Ca -0.01 -0.04 -0.11 0.00 1.01 0.00 0.00 58.87 59.72 2joy n SER 79 Cb 0.13 -0.30 -0.02 0.00 -1.01 0.00 0.00 64.21 63.01 2joy n SER 79 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2joy n ASN 80 N -1.30 -3.83 -0.81 6.43 5.03 -0.13 -4.90 115.26 115.75 2joy n ASN 80 Ca 0.12 0.07 0.12 0.00 0.87 0.00 0.00 54.58 55.76 2joy n ASN 80 Cb 0.21 -2.86 0.26 0.00 -1.02 0.00 0.00 39.78 36.37 2joy n ASN 80 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2joy n LEU 81 N -1.52 2.51 -0.15 3.41 7.99 -0.14 -4.40 117.00 124.70 2joy n LEU 81 Ca -0.13 -0.88 -0.05 0.00 -0.01 0.00 0.00 56.01 54.94 2joy n LEU 81 Cb 0.54 -0.03 0.04 0.00 -0.11 0.00 0.00 43.42 43.86 2joy n LEU 81 CO 0.16 0.44 1.01 0.74 -1.51 0.00 0.00 177.39 178.23 2joy h THR 82 N 3.81 0.97 -0.01 -5.08 2.02 -1.84 0.53 112.91 113.31 2joy h THR 82 Ca 0.00 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 2joy h THR 82 Cb 0.81 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 67.67 2joy h THR 82 CO 0.00 0.09 0.01 -0.08 0.37 0.00 0.00 175.52 175.90 2joy h GLU 83 N 0.48 0.02 0.00 6.66 4.57 -1.91 -0.56 114.58 123.84 2joy h GLU 83 Ca 0.20 -0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.31 2joy h GLU 83 Cb 0.10 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 2joy h GLU 83 CO -0.14 0.13 -0.35 -0.92 -1.18 0.00 0.00 179.01 176.55 2joy h TYR 84 N -0.09 0.00 -0.05 0.92 3.20 -1.79 -1.39 116.97 117.77 2joy h TYR 84 Ca 0.01 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.74 2joy h TYR 84 Cb 0.12 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.39 2joy h TYR 84 CO -0.04 0.35 -0.49 1.98 -1.64 0.00 0.00 178.16 178.32 2joy h MET 85 N 0.00 0.42 0.00 1.82 4.05 -0.59 -3.23 114.93 117.40 2joy h MET 85 Ca -0.00 -0.38 -0.07 0.00 -0.28 0.00 0.00 59.70 58.96 2joy h MET 85 Cb 0.70 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.58 2joy h MET 85 CO 0.05 1.04 -0.34 -0.22 0.23 0.00 0.00 176.91 177.66 2joy h LYS 86 N -0.06 0.00 -6.38 0.39 3.64 -0.92 -3.44 116.57 109.79 2joy h LYS 86 Ca -0.05 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.78 2joy h LYS 86 Cb 1.17 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 33.01 2joy h LYS 86 CO 0.10 0.34 1.16 -1.91 -2.27 0.00 0.00 179.45 176.87 2joy n GLU 87 N -3.64 2.67 -4.14 1.90 2.13 -0.54 -4.98 120.64 114.05 2joy n GLU 87 Ca -0.01 0.98 -0.22 0.00 0.66 0.00 0.00 57.16 58.57 2joy n GLU 87 Cb 0.45 -2.89 -0.05 0.00 0.27 0.00 0.00 31.44 29.22 2joy n GLU 87 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 2joy s LYS 88 N 3.86 2.84 -0.02 5.31 0.00 -1.26 -4.97 119.74 125.49 2joy s LYS 88 Ca 0.88 -1.10 -0.09 0.00 0.00 0.00 0.00 55.97 55.66 2joy s LYS 88 Cb -0.51 -2.51 -0.05 0.00 0.00 0.00 0.00 37.83 34.76 2joy s LYS 88 CO 0.43 0.40 0.29 0.42 0.00 0.00 0.00 175.35 176.89 2joy s ILE 89 N -2.15 5.25 -0.01 3.79 -1.09 -1.26 -5.04 121.20 120.69 2joy s ILE 89 Ca 0.33 0.39 -0.30 0.00 -2.23 0.00 0.00 60.65 58.83 2joy s ILE 89 Cb -0.08 -3.57 -0.03 0.00 -1.58 0.00 0.00 42.46 37.20 2joy s ILE 89 CO 0.24 0.47 1.07 -0.54 -1.23 0.00 0.00 174.94 174.96 2joy s LYS 90 N -1.43 4.47 -0.21 2.79 1.02 -1.26 -4.73 119.74 120.40 2joy s LYS 90 Ca 0.24 1.54 -0.29 0.00 0.02 0.00 0.00 55.97 57.48 2joy s LYS 90 Cb -0.14 -3.46 0.00 0.00 -0.52 0.00 0.00 37.83 33.71 2joy s LYS 90 CO 0.13 -0.21 1.12 0.42 -0.92 0.00 0.00 175.35 175.89 2joy s ILE 91 N 1.38 4.53 -0.67 2.17 1.01 -1.26 -4.98 121.20 123.38 2joy s ILE 91 Ca 0.54 1.85 -0.17 0.00 0.00 0.00 0.00 60.65 62.87 2joy s ILE 91 Cb -0.23 -4.20 0.14 0.00 0.01 0.00 0.00 42.46 38.19 2joy s ILE 91 CO 0.26 -0.17 0.71 -0.60 0.00 0.00 0.00 174.94 175.14 2joy s ARG 92 N 3.32 3.23 0.07 2.79 6.06 -1.26 -5.03 118.95 128.12 2joy s ARG 92 Ca 0.48 -1.77 -0.30 0.00 -2.50 0.00 0.00 55.73 51.64 2joy s ARG 92 Cb -0.17 -4.38 -0.09 0.00 0.06 0.00 0.00 34.95 30.36 2joy s ARG 92 CO 0.09 -1.44 1.86 -1.64 -2.50 0.00 0.00 175.30 171.67 2joy s MET 93 N 1.75 4.15 0.34 5.12 -1.94 -1.26 -4.88 119.30 122.57 2joy s MET 93 Ca 0.13 2.55 0.04 0.00 -1.71 0.00 0.00 55.69 56.70 2joy s MET 93 Cb -0.20 -3.87 0.66 0.00 2.01 0.00 0.00 34.83 33.43 2joy s MET 93 CO -0.00 -0.88 1.96 -1.35 -0.01 0.00 0.00 175.02 174.74 2joy h PRO 94 N 9.51 0.83 -1.76 2.03 0.11 -2.05 -3.48 132.00 137.19 2joy h PRO 94 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2joy h PRO 94 Cb 1.22 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2joy h PRO 94 CO 0.94 0.55 -0.39 2.41 -0.21 0.00 0.00 178.00 181.30 2joy n THR 95 N -4.47 -3.41 1.69 -1.15 -1.04 -1.26 -5.36 114.28 99.28 2joy n THR 95 Ca 0.10 1.12 0.14 0.00 -2.04 0.00 0.00 64.05 63.37 2joy n THR 95 Cb 0.17 -2.18 0.80 0.00 -1.82 0.00 0.00 70.33 67.30 2joy n THR 95 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32