#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 2.73 -0.30 0.03 0.04 -1.26 -4.88 135.00 131.36 2joy s PRO 2 Ca 0.00 0.94 -0.13 0.00 0.04 0.00 0.00 61.00 61.85 2joy s PRO 2 Cb 0.00 -4.37 0.15 0.00 0.04 0.00 0.00 34.50 30.32 2joy s PRO 2 CO 0.00 -2.58 0.84 0.00 0.04 0.00 0.00 177.00 175.30 2joy s ALA 3 N 8.96 -2.41 -0.35 8.56 0.00 -1.26 -5.02 121.76 130.25 2joy s ALA 3 Ca 0.75 2.19 -0.06 0.00 0.00 0.00 0.00 51.96 54.83 2joy s ALA 3 Cb -0.16 -1.92 0.01 0.00 0.00 0.00 0.00 23.12 21.05 2joy s ALA 3 CO 0.25 -0.93 0.24 -0.89 0.00 0.00 0.00 175.76 174.43 2joy n ILE 4 N 5.15-11.33 -4.03 0.00 2.08 -1.26 -5.07 119.36 104.90 2joy n ILE 4 Ca -0.11 1.40 -0.09 0.00 0.56 0.00 0.00 62.75 64.52 2joy n ILE 4 Cb 0.51 -6.99 -0.08 0.00 -0.75 0.00 0.00 39.64 32.33 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 -1.98 0.97 -0.00 0.38 -1.05 -1.26 -5.11 118.70 110.64 2joy s GLU 5 Ca 0.10 -1.24 -0.30 0.00 -0.15 0.00 0.00 54.97 53.38 2joy s GLU 5 Cb -0.03 0.31 -0.05 0.00 -0.44 0.00 0.00 34.13 33.92 2joy s GLU 5 CO 0.75 -0.31 1.26 0.14 0.95 0.00 0.00 175.26 178.05 2joy s VAL 6 N -3.98 4.02 0.00 1.83 -7.23 -1.26 -2.95 120.40 110.83 2joy s VAL 6 Ca 0.17 1.39 0.00 0.00 -1.81 0.00 0.00 61.98 61.73 2joy s VAL 6 Cb 0.05 -3.90 0.00 0.00 0.56 0.00 0.00 36.38 33.10 2joy s VAL 6 CO -0.02 0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.41 2joy n GLY 7 N 3.41 0.38 3.49 2.32 0.00 -0.20 -4.37 105.19 110.22 2joy n GLY 7 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.93 3.19 -0.33 1.61 3.52 -1.15 -0.78 118.95 124.07 2joy s ARG 8 Ca 0.00 -0.71 -0.28 0.00 -0.13 0.00 0.00 55.73 54.61 2joy s ARG 8 Cb 0.00 -3.93 -0.02 0.00 -1.56 0.00 0.00 34.95 29.44 2joy s ARG 8 CO 0.00 -0.77 1.76 0.42 -0.81 0.00 0.00 175.30 175.90 2joy s ILE 9 N 2.07 3.52 -0.08 4.11 1.09 -1.26 -4.06 121.20 126.58 2joy s ILE 9 Ca 0.11 0.53 -0.04 0.00 -1.10 0.00 0.00 60.65 60.15 2joy s ILE 9 Cb -0.17 -3.69 -0.04 0.00 -1.06 0.00 0.00 42.46 37.51 2joy s ILE 9 CO 0.13 -0.43 0.08 0.00 -0.10 0.00 0.00 174.94 174.62 2joy s VAL 11 N -1.02 -0.01 0.23 0.00 0.11 -1.16 -0.16 120.40 118.39 2joy s VAL 11 Ca 0.16 0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.25 2joy s VAL 11 Cb -0.12 -0.48 0.00 0.00 -1.53 0.00 0.00 36.38 34.25 2joy s VAL 11 CO 0.06 0.02 0.00 2.29 -3.33 0.00 0.00 175.10 174.13 2joy n LYS 12 N 3.34 -1.70 0.00 1.54 -0.00 -1.25 -4.17 118.16 115.93 2joy n LYS 12 Ca -0.17 1.21 0.00 0.00 -0.00 0.00 0.00 58.31 59.35 2joy n LYS 12 Cb 0.57 -2.17 0.00 0.00 -0.00 0.00 0.00 35.03 33.42 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 -2.97 0.00 -1.50 0.58 0.31 -1.26 -0.60 118.33 112.88 2joy n VAL 13 Ca -0.01 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.39 2joy n VAL 13 Cb 0.60 -0.58 0.12 0.00 -0.91 0.00 0.00 33.84 33.07 2joy n VAL 13 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2joy n LYS 14 N -1.29 1.01 0.00 5.55 4.01 -1.26 -4.90 118.16 121.28 2joy n LYS 14 Ca 0.00 -2.42 0.00 0.00 -0.51 0.00 0.00 58.31 55.38 2joy n LYS 14 Cb 0.00 -1.21 0.00 0.00 -0.51 0.00 0.00 35.03 33.31 2joy n LYS 14 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2joy n GLY 15 N -0.92 0.18 5.20 0.72 0.00 -1.26 -4.96 105.19 104.14 2joy n GLY 15 Ca 0.13 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.84 2joy n GLY 15 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2joy n ARG 16 N 3.56 0.00 -0.36 1.61 0.00 -1.26 -3.00 116.66 117.20 2joy n ARG 16 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.85 57.92 2joy n ARG 16 Cb 0.00 0.00 0.18 0.00 0.00 0.00 0.00 32.46 32.64 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 1.54 -3.49 -0.14 4.07 -1.26 -4.93 120.64 116.43 2joy n GLU 17 Ca 0.00 -2.94 -0.13 0.00 -0.06 0.00 0.00 57.16 54.03 2joy n GLU 17 Cb 0.00 -1.59 -0.11 0.00 -0.06 0.00 0.00 31.44 29.68 2joy n GLU 17 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2joy s ALA 18 N -3.05 -0.73 -0.00 4.31 0.00 -1.16 -4.97 121.76 116.15 2joy s ALA 18 Ca 0.36 0.77 0.01 0.00 0.00 0.00 0.00 51.96 53.09 2joy s ALA 18 Cb 0.33 -1.40 0.01 0.00 0.00 0.00 0.00 23.12 22.06 2joy s ALA 18 CO -0.01 -1.07 0.89 0.41 0.00 0.00 0.00 175.76 175.98 2joy n GLY 19 N 5.35 -0.12 3.37 0.00 0.00 -1.26 -4.42 105.19 108.10 2joy n GLY 19 Ca -0.05 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.83 3.37 0.05 1.61 0.01 -1.26 -0.85 113.70 115.79 2joy s SER 20 Ca 0.01 -0.44 -0.14 0.00 1.31 0.00 0.00 55.95 56.68 2joy s SER 20 Cb 0.01 -0.46 -0.06 0.00 0.21 0.00 0.00 66.02 65.72 2joy s SER 20 CO 0.00 0.30 0.46 -0.54 0.41 0.00 0.00 173.24 173.87 2joy s LYS 21 N -0.92 3.94 0.01 12.44 1.02 -1.26 -3.82 119.74 131.15 2joy s LYS 21 Ca 0.11 0.43 0.03 0.00 0.02 0.00 0.00 55.97 56.56 2joy s LYS 21 Cb -0.10 -3.13 -0.01 0.00 -0.52 0.00 0.00 37.83 34.07 2joy s LYS 21 CO 0.01 0.62 -0.09 0.00 -0.92 0.00 0.00 175.35 174.97 2joy s VAL 23 N -0.55 4.00 -0.56 0.00 1.01 0.39 -0.79 120.40 123.91 2joy s VAL 23 Ca 0.00 -0.28 -0.28 0.00 0.00 0.00 0.00 61.98 61.42 2joy s VAL 23 Cb -0.05 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.49 2joy s VAL 23 CO 0.00 0.38 1.50 -0.63 0.00 0.00 0.00 175.10 176.35 2joy s ILE 24 N 1.41 3.70 -0.06 2.22 1.01 -1.26 -1.54 121.20 126.69 2joy s ILE 24 Ca 0.05 0.58 0.19 0.00 0.00 0.00 0.00 60.65 61.47 2joy s ILE 24 Cb -0.15 -4.33 -0.29 0.00 0.01 0.00 0.00 42.46 37.70 2joy s ILE 24 CO 0.01 -1.11 0.36 1.33 0.00 0.00 0.00 174.94 175.53 2joy n VAL 25 N 6.93 0.27 -3.88 2.92 0.24 -0.68 -1.03 118.33 123.09 2joy n VAL 25 Ca 0.14 -0.53 -0.09 0.00 -2.04 0.00 0.00 64.34 61.82 2joy n VAL 25 Cb 0.49 -0.08 -0.07 0.00 -1.47 0.00 0.00 33.84 32.72 2joy n VAL 25 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2joy s ASP 26 N -4.51 0.05 -0.24 -1.34 -1.08 -1.22 0.06 116.67 108.39 2joy s ASP 26 Ca -0.08 -0.72 0.02 0.00 -0.52 0.00 0.00 52.55 51.26 2joy s ASP 26 Cb 0.11 0.39 0.05 0.00 -1.46 0.00 0.00 42.92 42.02 2joy s ASP 26 CO 0.82 -0.81 -0.11 -0.63 0.52 0.00 0.00 175.17 174.95 2joy s ILE 27 N -3.90 1.97 -0.19 4.11 -1.09 -1.26 -1.22 121.20 119.62 2joy s ILE 27 Ca 0.10 -1.40 -0.17 0.00 -2.23 0.00 0.00 60.65 56.95 2joy s ILE 27 Cb 0.04 -2.07 -0.13 0.00 -1.58 0.00 0.00 42.46 38.72 2joy s ILE 27 CO -0.06 0.05 0.04 -0.38 -1.23 0.00 0.00 174.94 173.35 2joy n ILE 28 N 4.53 1.49 -4.37 2.92 2.08 -1.15 -4.95 119.36 119.91 2joy n ILE 28 Ca -0.15 0.05 -0.18 0.00 0.56 0.00 0.00 62.75 63.04 2joy n ILE 28 Cb 0.44 -2.17 -0.05 0.00 -0.75 0.00 0.00 39.64 37.11 2joy n ILE 28 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2joy n ASP 29 N -4.50 1.46 -0.19 4.38 8.00 0.72 -4.99 116.55 121.43 2joy n ASP 29 Ca -0.23 -2.49 0.14 0.00 0.71 0.00 0.00 54.79 52.92 2joy n ASP 29 Cb 0.53 0.63 0.61 0.00 -0.02 0.00 0.00 41.12 42.87 2joy n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2joy n ASP 30 N -1.61 0.67 -0.01 -2.24 8.00 -1.26 -4.12 116.55 115.98 2joy n ASP 30 Ca -0.06 -0.84 -0.02 0.00 0.71 0.00 0.00 54.79 54.58 2joy n ASP 30 Cb 0.42 -0.02 -0.01 0.00 -0.02 0.00 0.00 41.12 41.49 2joy n ASP 30 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2joy n ASN 31 N -0.71 0.14 -4.51 -2.24 5.15 -1.26 -4.94 115.26 106.89 2joy n ASN 31 Ca 0.16 0.02 -0.43 0.00 -0.60 0.00 0.00 54.58 53.74 2joy n ASN 31 Cb 0.28 -0.06 -0.05 0.00 -0.53 0.00 0.00 39.78 39.42 2joy n ASN 31 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2joy s PHE 32 N -2.03 2.90 0.22 1.20 0.08 -1.26 -1.65 117.98 117.44 2joy s PHE 32 Ca -0.03 -0.11 0.05 0.00 0.12 0.00 0.00 56.93 56.96 2joy s PHE 32 Cb 0.01 -3.84 -0.03 0.00 -0.57 0.00 0.00 43.02 38.59 2joy s PHE 32 CO 0.03 -1.19 0.28 0.14 -0.10 0.00 0.00 175.22 174.39 2joy s VAL 33 N 3.46 4.97 -0.36 -0.44 -7.23 -0.37 -0.20 120.40 120.23 2joy s VAL 33 Ca 0.26 -1.07 -0.18 0.00 -1.81 0.00 0.00 61.98 59.19 2joy s VAL 33 Cb -0.14 -3.66 -0.00 0.00 0.56 0.00 0.00 36.38 33.14 2joy s VAL 33 CO 0.18 -0.28 0.49 -0.22 -0.31 0.00 0.00 175.10 174.96 2joy s LEU 34 N -3.74 4.41 0.06 1.32 0.20 -0.36 -1.40 118.68 119.17 2joy s LEU 34 Ca 0.33 -0.12 0.07 0.00 0.69 0.00 0.00 54.13 55.10 2joy s LEU 34 Cb -0.09 -2.54 -0.04 0.00 -0.43 0.00 0.00 46.19 43.10 2joy s LEU 34 CO 0.27 -0.48 -0.14 0.68 -0.29 0.00 0.00 176.35 176.40 2joy s VAL 35 N 2.33 3.12 0.03 1.68 -7.23 -1.24 -1.69 120.40 117.40 2joy s VAL 35 Ca 0.17 -1.18 -0.14 0.00 -1.81 0.00 0.00 61.98 59.02 2joy s VAL 35 Cb -0.16 -2.38 0.02 0.00 0.56 0.00 0.00 36.38 34.42 2joy s VAL 35 CO 0.13 0.25 0.31 0.28 -0.31 0.00 0.00 175.10 175.76 2joy s THR 36 N -1.05 0.08 -0.04 5.32 -1.32 -0.59 -3.88 115.64 114.15 2joy s THR 36 Ca 0.17 -0.63 0.06 0.00 -1.21 0.00 0.00 61.69 60.09 2joy s THR 36 Cb -0.11 -0.86 -0.01 0.00 -1.51 0.00 0.00 72.50 70.00 2joy s THR 36 CO 0.09 -0.35 -0.24 -0.83 -2.21 0.00 0.00 174.62 171.09 2joy s GLY 37 N -1.89 1.20 -0.23 6.08 0.00 -1.20 -0.46 107.32 110.81 2joy s GLY 37 Ca -0.07 -1.00 -0.42 0.00 0.00 0.00 0.00 44.72 43.24 2joy s GLY 37 CO -0.02 -0.69 1.50 -1.05 0.00 0.00 0.00 173.10 172.85 2joy n PRO 38 N 2.79 0.57 -0.22 2.90 -0.02 -1.26 -3.38 135.00 136.38 2joy n PRO 38 Ca -0.17 0.21 -0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2joy n PRO 38 Cb 0.52 -1.79 0.07 0.00 -0.02 0.00 0.00 33.50 32.28 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 5.26 -0.01 0.02 -0.52 2.10 -1.94 0.49 116.57 121.96 2joy h LYS 39 Ca -0.47 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 57.86 2joy h LYS 39 Cb 1.36 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.64 2joy h LYS 39 CO 0.88 -0.00 -1.92 -0.40 -2.00 0.00 0.00 179.45 176.00 2joy n ASP 40 N -5.45 0.88 0.11 7.07 5.75 -1.26 -3.25 116.55 120.40 2joy n ASP 40 Ca 0.08 0.28 -0.23 0.00 -0.01 0.00 0.00 54.79 54.91 2joy n ASP 40 Cb 0.34 0.05 -0.15 0.00 -1.03 0.00 0.00 41.12 40.34 2joy n ASP 40 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 2joy h ILE 41 N 0.01 1.32 0.00 2.12 2.04 -1.80 -3.43 117.51 117.77 2joy h ILE 41 Ca -0.37 -2.57 0.00 0.00 1.00 0.00 0.00 64.86 62.92 2joy h ILE 41 Cb 2.06 2.94 0.00 0.00 -0.74 0.00 0.00 36.82 41.09 2joy h ILE 41 CO 0.06 0.77 -0.78 0.41 0.00 0.00 0.00 178.15 178.61 2joy n THR 42 N -3.83 0.00 -2.18 -0.27 -1.04 0.13 -4.33 114.28 102.76 2joy n THR 42 Ca -0.15 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.80 2joy n THR 42 Cb 1.01 -0.92 0.02 0.00 -1.82 0.00 0.00 70.33 68.62 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 2.83 0.02 3.42 3.41 0.00 0.11 -4.95 105.19 110.03 2joy n GLY 43 Ca 0.00 0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.14 3.53 0.40 1.61 1.01 -1.22 -4.97 120.40 117.63 2joy s VAL 44 Ca 0.16 -0.48 -0.26 0.00 0.00 0.00 0.00 61.98 61.40 2joy s VAL 44 Cb -0.02 -2.54 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 2joy s VAL 44 CO 0.29 0.49 1.28 -0.75 0.00 0.00 0.00 175.10 176.41 2joy s LYS 45 N 0.55 3.99 -0.16 2.72 2.20 -1.26 -3.26 119.74 124.52 2joy s LYS 45 Ca -0.05 2.10 -0.10 0.00 -0.36 0.00 0.00 55.97 57.57 2joy s LYS 45 Cb -0.15 -2.75 -0.05 0.00 -1.51 0.00 0.00 37.83 33.37 2joy s LYS 45 CO 0.03 -0.46 0.17 1.03 -0.36 0.00 0.00 175.35 175.77 2joy s ARG 46 N -2.23 3.97 0.08 4.03 3.00 -1.26 -4.77 118.95 121.76 2joy s ARG 46 Ca 0.57 -0.11 -0.27 0.00 0.00 0.00 0.00 55.73 55.91 2joy s ARG 46 Cb -0.37 -3.34 0.09 0.00 0.00 0.00 0.00 34.95 31.32 2joy s ARG 46 CO 0.47 0.45 1.08 0.50 0.00 0.00 0.00 175.30 177.80 2joy s ARG 47 N -0.09 0.88 -0.56 3.54 3.52 -1.25 -5.06 118.95 119.92 2joy s ARG 47 Ca 0.12 -0.48 -0.28 0.00 -0.13 0.00 0.00 55.73 54.96 2joy s ARG 47 Cb -0.12 0.30 0.02 0.00 -1.56 0.00 0.00 34.95 33.60 2joy s ARG 47 CO 0.01 -0.40 1.26 1.03 -0.81 0.00 0.00 175.30 176.39 2joy s ARG 48 N -2.96 3.48 0.02 5.12 0.52 -1.26 -3.63 118.95 120.23 2joy s ARG 48 Ca 0.13 0.35 0.04 0.00 -0.52 0.00 0.00 55.73 55.73 2joy s ARG 48 Cb 0.01 -4.04 -0.03 0.00 0.52 0.00 0.00 34.95 31.41 2joy s ARG 48 CO -0.00 -1.73 -0.09 0.08 0.02 0.00 0.00 175.30 173.58 2joy s VAL 49 N 5.23 3.45 0.51 3.52 1.01 -0.49 -4.83 120.40 128.78 2joy s VAL 49 Ca 0.46 -0.90 -0.22 0.00 0.00 0.00 0.00 61.98 61.32 2joy s VAL 49 Cb -0.09 -2.50 -0.06 0.00 0.00 0.00 0.00 36.38 33.74 2joy s VAL 49 CO 0.26 0.36 1.29 0.20 0.00 0.00 0.00 175.10 177.21 2joy s ASN 50 N -1.48 5.65 0.00 3.32 0.01 -1.26 -1.24 114.94 119.95 2joy s ASN 50 Ca 0.17 2.60 0.00 0.00 -0.71 0.00 0.00 52.86 54.92 2joy s ASN 50 Cb -0.11 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 38.93 2joy s ASN 50 CO 0.08 -1.29 0.45 2.30 -1.51 0.00 0.00 177.10 177.12 2joy n ILE 51 N -0.76 0.00 0.09 0.60 -5.35 -0.66 -2.42 119.36 110.85 2joy n ILE 51 Ca 0.09 0.00 0.04 0.00 -0.27 0.00 0.00 62.75 62.61 2joy n ILE 51 Cb 0.46 -0.28 0.08 0.00 -1.74 0.00 0.00 39.64 38.16 2joy n ILE 51 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2joy n LEU 52 N -0.05 2.25 0.05 7.28 7.94 -1.26 -4.47 117.00 128.73 2joy n LEU 52 Ca 0.00 -1.54 0.11 0.00 -1.11 0.00 0.00 56.01 53.47 2joy n LEU 52 Cb 0.11 -0.10 0.02 0.00 0.53 0.00 0.00 43.42 43.99 2joy n LEU 52 CO 0.00 0.52 -0.03 1.57 -1.11 0.00 0.00 177.39 178.34 2joy n HIS 53 N 0.37 0.46 -3.65 1.96 -0.00 -1.02 -4.95 115.22 108.40 2joy n HIS 53 Ca 0.07 0.14 -0.11 0.00 0.46 0.00 0.00 57.72 58.28 2joy n HIS 53 Cb 0.31 -0.61 -0.05 0.00 -0.12 0.00 0.00 29.99 29.51 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 -4.41 0.44 0.09 0.27 0.05 -1.26 -4.55 118.68 109.31 2joy s LEU 54 Ca 0.02 -0.28 0.08 0.00 0.05 0.00 0.00 54.13 54.00 2joy s LEU 54 Cb 0.13 1.79 -0.04 0.00 -2.05 0.00 0.00 46.19 46.02 2joy s LEU 54 CO 0.80 -0.82 -0.18 -1.61 -0.55 0.00 0.00 176.35 173.99 2joy s GLU 55 N -3.59 1.86 0.32 1.48 2.02 0.23 -4.94 118.70 116.08 2joy s GLU 55 Ca 0.02 -1.12 -0.29 0.00 0.02 0.00 0.00 54.97 53.60 2joy s GLU 55 Cb 0.02 -2.13 -0.10 0.00 0.10 0.00 0.00 34.13 32.01 2joy s GLU 55 CO -0.10 0.50 1.34 -2.14 0.02 0.00 0.00 175.26 174.88 2joy s PRO 56 N -1.92 4.32 0.19 0.39 0.02 -1.26 -2.99 135.00 133.76 2joy s PRO 56 Ca 0.17 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.44 2joy s PRO 56 Cb -0.11 -3.07 0.04 0.00 0.02 0.00 0.00 34.50 31.38 2joy s PRO 56 CO 0.08 -0.25 0.26 0.25 -0.33 0.00 0.00 177.00 177.02 2joy n THR 57 N 1.10 0.00 0.20 0.99 -2.24 -1.26 -4.96 114.28 108.12 2joy n THR 57 Ca 0.01 -0.42 0.09 0.00 -2.27 0.00 0.00 64.05 61.46 2joy n THR 57 Cb 0.41 -1.24 0.26 0.00 -2.10 0.00 0.00 70.33 67.67 2joy n THR 57 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2joy h ASP 58 N -0.15 0.00 -4.01 3.42 3.58 -1.96 -3.46 116.42 113.84 2joy h ASP 58 Ca -0.09 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.83 2joy h ASP 58 Cb 0.32 0.00 -0.20 0.00 1.72 0.00 0.00 39.33 41.17 2joy h ASP 58 CO 0.09 0.23 -0.81 -0.54 -2.88 0.00 0.00 179.24 175.34 2joy s LYS 59 N -3.31 1.14 0.03 0.28 1.02 -1.26 -5.14 119.74 112.50 2joy s LYS 59 Ca 0.03 -1.22 -0.00 0.00 0.02 0.00 0.00 55.97 54.80 2joy s LYS 59 Cb 0.08 -1.31 -0.03 0.00 -0.52 0.00 0.00 37.83 36.05 2joy s LYS 59 CO 0.67 0.29 -0.03 -1.59 -0.92 0.00 0.00 175.35 173.77 2joy s LYS 60 N -2.19 0.44 -0.32 1.68 -2.85 -1.26 -4.16 119.74 111.08 2joy s LYS 60 Ca 0.09 -0.84 -0.08 0.00 -1.00 0.00 0.00 55.97 54.13 2joy s LYS 60 Cb -0.08 0.11 0.02 0.00 -2.06 0.00 0.00 37.83 35.81 2joy s LYS 60 CO 0.05 -0.06 0.11 0.96 0.10 0.00 0.00 175.35 176.51 2joy s ILE 61 N -2.34 4.10 -0.64 3.79 -4.36 0.04 -4.99 121.20 116.81 2joy s ILE 61 Ca -0.07 -0.78 -0.26 0.00 -0.26 0.00 0.00 60.65 59.27 2joy s ILE 61 Cb -0.04 -3.18 -0.02 0.00 1.25 0.00 0.00 42.46 40.48 2joy s ILE 61 CO -0.04 -0.03 1.79 -0.62 0.24 0.00 0.00 174.94 176.28 2joy s ASP 62 N 1.50 5.38 0.05 4.36 2.15 -1.26 -4.43 116.67 124.43 2joy s ASP 62 Ca 0.02 0.20 0.00 0.00 0.43 0.00 0.00 52.55 53.20 2joy s ASP 62 Cb -0.18 -2.53 -0.00 0.00 -0.30 0.00 0.00 42.92 39.91 2joy s ASP 62 CO 0.04 -2.32 0.01 2.30 -0.17 0.00 0.00 175.17 175.02 2joy n ILE 63 N 7.12 0.00 -4.02 4.11 -5.35 -1.26 -5.10 119.36 114.86 2joy n ILE 63 Ca 0.19 -0.27 -0.24 0.00 -0.27 0.00 0.00 62.75 62.16 2joy n ILE 63 Cb 0.52 0.07 -0.06 0.00 -1.74 0.00 0.00 39.64 38.42 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 -2.20 2.30 0.02 6.28 -0.21 -1.26 -4.82 119.66 119.76 2joy s GLN 64 Ca 0.01 -1.75 -0.30 0.00 0.02 0.00 0.00 55.36 53.33 2joy s GLN 64 Cb 0.00 -2.07 -0.05 0.00 1.00 0.00 0.00 33.01 31.88 2joy s GLN 64 CO 0.01 -0.10 1.28 0.21 -2.12 0.00 0.00 175.29 174.56 2joy s LYS 65 N -3.94 4.36 0.00 2.91 2.20 -1.26 -3.49 119.74 120.52 2joy s LYS 65 Ca 0.42 1.83 0.00 0.00 -0.36 0.00 0.00 55.97 57.86 2joy s LYS 65 Cb 0.02 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 2joy s LYS 65 CO 0.23 -0.42 0.00 0.41 -0.36 0.00 0.00 175.35 175.22 2joy n GLY 66 N 3.41 1.54 3.78 5.54 0.00 0.11 -4.99 105.19 114.57 2joy n GLY 66 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.28 0.46 4.61 0.00 -1.23 -5.06 121.76 121.82 2joy s ALA 67 Ca 0.00 0.48 0.08 0.00 0.00 0.00 0.00 51.96 52.52 2joy s ALA 67 Cb 0.00 -3.12 0.02 0.00 0.00 0.00 0.00 23.12 20.02 2joy s ALA 67 CO 0.00 0.21 0.53 -1.54 0.00 0.00 0.00 175.76 174.96 2joy s SER 68 N -1.52 5.20 0.46 0.00 1.04 -1.26 -4.87 113.70 112.76 2joy s SER 68 Ca 0.47 -0.72 0.20 0.00 0.48 0.00 0.00 55.95 56.37 2joy s SER 68 Cb -0.20 -0.31 1.18 0.00 0.10 0.00 0.00 66.02 66.80 2joy s SER 68 CO 0.25 -0.88 1.93 -0.78 0.98 0.00 0.00 173.24 174.73 2joy h ASP 69 N 0.70 0.26 0.11 7.02 1.82 -1.99 -2.11 116.42 122.22 2joy h ASP 69 Ca -0.38 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.28 2joy h ASP 69 Cb 1.28 -0.03 -0.01 0.00 0.68 0.00 0.00 39.33 41.25 2joy h ASP 69 CO 0.50 0.13 -0.10 -0.33 -1.61 0.00 0.00 179.24 177.82 2joy h GLU 70 N 0.27 -0.22 -0.13 0.28 5.08 -2.00 -1.26 114.58 116.60 2joy h GLU 70 Ca 0.36 0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.59 2joy h GLU 70 Cb 1.02 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 2joy h GLU 70 CO -0.09 -0.15 -0.56 1.49 -1.00 0.00 0.00 179.01 178.70 2joy h GLU 71 N -0.23 0.39 -0.93 2.33 4.81 -1.80 -2.81 114.58 116.33 2joy h GLU 71 Ca 0.00 -0.25 0.04 0.00 -0.13 0.00 0.00 59.36 59.03 2joy h GLU 71 Cb 0.22 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.58 2joy h GLU 71 CO -0.03 0.84 0.61 0.28 -0.73 0.00 0.00 179.01 179.98 2joy h VAL 72 N 0.29 1.15 -0.32 0.32 2.07 -1.12 0.75 116.25 119.40 2joy h VAL 72 Ca 0.00 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.06 2joy h VAL 72 Cb 1.07 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 2joy h VAL 72 CO 0.10 0.21 -0.05 0.11 0.02 0.00 0.00 177.57 177.95 2joy h LYS 73 N 1.17 0.51 0.07 1.57 6.56 -0.99 0.19 116.57 125.65 2joy h LYS 73 Ca 0.38 -0.12 -0.19 0.00 -1.06 0.00 0.00 60.65 59.65 2joy h LYS 73 Cb 0.02 -0.07 0.02 0.00 -0.57 0.00 0.00 32.23 31.63 2joy h LYS 73 CO -0.13 0.58 -0.80 -0.22 -2.06 0.00 0.00 179.45 176.82 2joy h LYS 74 N 0.48 0.42 0.00 3.15 3.11 -1.10 -3.15 116.57 119.48 2joy h LYS 74 Ca 0.10 -0.54 -0.08 0.00 -2.81 0.00 0.00 60.65 57.31 2joy h LYS 74 Cb 0.40 0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 31.79 2joy h LYS 74 CO 0.02 1.20 -0.40 -0.22 -2.81 0.00 0.00 179.45 177.24 2joy h LYS 75 N -0.11 0.00 -0.58 1.90 3.64 -0.82 -2.47 116.57 118.13 2joy h LYS 75 Ca -0.12 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.21 2joy h LYS 75 Cb 1.54 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.33 2joy h LYS 75 CO 0.15 0.40 0.15 1.25 -2.27 0.00 0.00 179.45 179.13 2joy h LEU 76 N 0.00 0.83 0.15 5.20 5.85 -1.05 -0.23 115.31 126.05 2joy h LEU 76 Ca -0.00 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 2joy h LEU 76 Cb 1.26 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.07 2joy h LEU 76 CO 0.05 0.80 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.80 2joy h GLU 77 N 0.85 -0.19 -0.90 1.25 4.81 -1.44 -1.25 114.58 117.72 2joy h GLU 77 Ca 0.19 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.50 2joy h GLU 77 Cb 0.30 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.66 2joy h GLU 77 CO -0.00 -0.11 0.56 0.93 -0.73 0.00 0.00 179.01 179.66 2joy h GLU 78 N -0.22 0.98 0.00 1.92 5.08 -1.04 -0.19 114.58 121.11 2joy h GLU 78 Ca -0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2joy h GLU 78 Cb 0.17 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2joy h GLU 78 CO 0.03 0.65 0.00 0.43 -1.00 0.00 0.00 179.01 179.12 2joy n SER 79 N -4.60 0.25 -3.61 1.42 7.64 -0.14 -4.92 113.62 109.67 2joy n SER 79 Ca 0.13 0.53 -0.22 0.00 1.01 0.00 0.00 58.87 60.32 2joy n SER 79 Cb 0.19 -0.59 0.07 0.00 -1.01 0.00 0.00 64.21 62.87 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 -1.74 -3.49 -0.07 6.43 2.85 -0.08 -4.90 115.26 114.26 2joy n ASN 80 Ca 0.06 -0.66 0.02 0.00 -0.11 0.00 0.00 54.58 53.89 2joy n ASN 80 Cb 0.36 -4.70 0.04 0.00 1.24 0.00 0.00 39.78 36.72 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 -4.49 2.15 0.08 1.20 7.94 -0.69 -4.82 117.00 118.37 2joy n LEU 81 Ca -0.16 -2.17 -0.12 0.00 -1.11 0.00 0.00 56.01 52.46 2joy n LEU 81 Cb 0.62 -0.09 -0.05 0.00 0.53 0.00 0.00 43.42 44.43 2joy n LEU 81 CO 0.66 0.55 0.69 0.74 -1.11 0.00 0.00 177.39 178.92 2joy h THR 82 N 0.19 0.42 -0.37 1.96 2.02 -1.91 -1.08 112.91 114.14 2joy h THR 82 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 2joy h THR 82 Cb 0.60 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2joy h THR 82 CO 0.00 0.00 -0.03 -0.08 0.37 0.00 0.00 175.52 175.78 2joy h GLU 83 N -0.42 0.68 -0.17 6.66 4.81 -1.94 -2.30 114.58 121.89 2joy h GLU 83 Ca 0.05 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.04 2joy h GLU 83 Cb 0.49 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 2joy h GLU 83 CO -0.20 0.80 0.06 -0.92 -0.73 0.00 0.00 179.01 178.01 2joy h TYR 84 N 0.49 0.23 -0.03 0.92 3.20 -1.85 -1.62 116.97 118.30 2joy h TYR 84 Ca 0.10 -0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.75 2joy h TYR 84 Cb 0.51 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.71 2joy h TYR 84 CO 0.04 0.20 -0.89 1.98 -1.64 0.00 0.00 178.16 177.85 2joy h MET 85 N 0.24 0.49 -0.62 1.82 4.05 -0.91 -3.26 114.93 116.75 2joy h MET 85 Ca 0.06 -0.48 -0.02 0.00 -0.28 0.00 0.00 59.70 58.98 2joy h MET 85 Cb 0.07 0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 30.97 2joy h MET 85 CO -0.01 1.12 0.31 -0.22 0.23 0.00 0.00 176.91 178.34 2joy h LYS 86 N 0.30 0.89 -6.67 0.39 1.63 -0.75 -3.43 116.57 108.92 2joy h LYS 86 Ca -0.07 -0.13 -0.52 0.00 -0.85 0.00 0.00 60.65 59.08 2joy h LYS 86 Cb 1.52 -0.16 0.05 0.00 -0.60 0.00 0.00 32.23 33.04 2joy h LYS 86 CO 0.16 0.70 0.89 -2.00 -3.45 0.00 0.00 179.45 175.75 2joy s GLU 87 N -5.73 4.19 0.11 1.90 2.56 -0.89 -4.78 118.70 116.06 2joy s GLU 87 Ca -0.13 2.44 0.04 0.00 0.00 0.00 0.00 54.97 57.32 2joy s GLU 87 Cb 0.13 -3.11 -0.04 0.00 2.00 0.00 0.00 34.13 33.11 2joy s GLU 87 CO 0.79 -0.61 0.07 0.15 -0.56 0.00 0.00 175.26 175.10 2joy s LYS 88 N 0.63 2.78 -0.00 4.30 1.02 -1.26 -4.97 119.74 122.24 2joy s LYS 88 Ca 0.68 -0.79 -0.17 0.00 0.02 0.00 0.00 55.97 55.71 2joy s LYS 88 Cb -0.45 -2.64 -0.06 0.00 -0.52 0.00 0.00 37.83 34.16 2joy s LYS 88 CO 0.36 0.53 0.47 0.42 -0.92 0.00 0.00 175.35 176.22 2joy s ILE 89 N -1.48 4.97 0.01 2.17 1.01 -0.03 -5.07 121.20 122.78 2joy s ILE 89 Ca 0.29 0.98 0.01 0.00 0.00 0.00 0.00 60.65 61.93 2joy s ILE 89 Cb -0.11 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.56 2joy s ILE 89 CO 0.21 0.52 -0.03 -0.54 0.00 0.00 0.00 174.94 175.10 2joy s LYS 90 N -0.71 0.21 -0.13 2.79 1.02 -1.26 -4.44 119.74 117.22 2joy s LYS 90 Ca 0.26 -0.25 0.01 0.00 0.02 0.00 0.00 55.97 56.02 2joy s LYS 90 Cb -0.17 -0.10 0.02 0.00 -0.52 0.00 0.00 37.83 37.06 2joy s LYS 90 CO 0.14 0.02 -0.16 0.42 -0.92 0.00 0.00 175.35 174.85 2joy s ILE 91 N -0.47 1.67 0.00 2.17 1.01 -1.26 -5.05 121.20 119.27 2joy s ILE 91 Ca -0.04 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 59.89 2joy s ILE 91 Cb -0.04 -1.53 0.00 0.00 0.01 0.00 0.00 42.46 40.91 2joy s ILE 91 CO -0.00 0.48 0.00 -1.14 0.00 0.00 0.00 174.94 174.27 2joy n ARG 92 N 4.41 0.00 -4.34 2.79 0.63 -1.26 -4.95 116.66 113.93 2joy n ARG 92 Ca -0.19 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.56 2joy n ARG 92 Cb 0.51 0.00 -0.09 0.00 0.45 0.00 0.00 32.46 33.32 2joy n ARG 92 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 2joy s MET 93 N 0.00 1.55 0.56 -0.14 -1.94 -1.26 -5.02 119.30 113.05 2joy s MET 93 Ca 0.00 -1.87 0.37 0.00 -1.71 0.00 0.00 55.69 52.48 2joy s MET 93 Cb 0.00 -0.19 1.51 0.00 2.01 0.00 0.00 34.83 38.16 2joy s MET 93 CO 0.00 -0.40 1.72 -1.00 -0.01 0.00 0.00 175.02 175.33 2joy h PRO 94 N 2.25 0.00 -5.90 2.03 0.13 -2.06 -3.27 132.00 125.19 2joy h PRO 94 Ca -0.35 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.17 2joy h PRO 94 Cb 1.25 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.26 2joy h PRO 94 CO 0.55 0.00 0.60 0.99 -0.23 0.00 0.00 178.00 179.91 2joy s THR 95 N -4.83 4.35 -2.28 1.56 2.01 -1.26 -5.29 115.64 109.90 2joy s THR 95 Ca -0.05 0.29 0.30 0.00 0.31 0.00 0.00 61.69 62.55 2joy s THR 95 Cb 0.22 -4.56 0.71 0.00 0.01 0.00 0.00 72.50 68.87 2joy s THR 95 CO 0.75 -1.15 1.96 -0.11 -0.69 0.00 0.00 174.62 175.38