#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dog s ARG 2 N 0.00 2.35 0.27 0.03 3.52 -1.26 -4.92 118.95 118.94 2dog s ARG 2 Ca 0.00 -0.10 0.11 0.00 -0.13 0.00 0.00 55.73 55.61 2dog s ARG 2 Cb 0.00 -4.99 -0.05 0.00 -1.56 0.00 0.00 34.95 28.36 2dog s ARG 2 CO 0.00 -3.59 -0.11 -0.51 -0.81 0.00 0.00 175.30 170.28 2dog s LEU 3 N 11.07 2.88 0.03 -0.88 1.43 -1.26 -3.70 118.68 128.23 2dog s LEU 3 Ca 0.75 -0.84 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 2dog s LEU 3 Cb -0.08 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 2dog s LEU 3 CO 0.02 0.03 -0.03 0.68 0.23 0.00 0.00 176.35 177.27 2dog s VAL 4 N -2.39 0.17 -0.16 -1.59 -7.23 -0.77 -4.92 120.40 103.52 2dog s VAL 4 Ca 0.30 -1.01 -0.28 0.00 -1.81 0.00 0.00 61.98 59.18 2dog s VAL 4 Cb -0.06 -0.41 -0.01 0.00 0.56 0.00 0.00 36.38 36.46 2dog s VAL 4 CO 0.17 -0.53 0.95 -0.70 -0.31 0.00 0.00 175.10 174.68 2dog s GLU 5 N -1.70 4.34 -0.16 4.82 2.12 -1.26 -0.78 118.70 126.08 2dog s GLU 5 Ca -0.13 1.25 0.02 0.00 0.36 0.00 0.00 54.97 56.46 2dog s GLU 5 Cb -0.08 -3.58 -0.11 0.00 0.26 0.00 0.00 34.13 30.62 2dog s GLU 5 CO -0.02 -0.40 -0.13 0.44 -0.54 0.00 0.00 175.26 174.61 2dog n ILE 6 N 4.81 0.91 -3.85 -3.70 -5.35 -1.17 -4.98 119.36 106.03 2dog n ILE 6 Ca 0.08 -0.36 -0.09 0.00 -0.27 0.00 0.00 62.75 62.11 2dog n ILE 6 Cb 0.48 -1.05 0.00 0.00 -1.74 0.00 0.00 39.64 37.34 2dog n ILE 6 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2dog s GLY 7 N -5.50 0.35 -0.01 3.28 0.00 -1.25 -1.09 107.32 103.11 2dog s GLY 7 Ca -0.21 -0.71 -0.01 0.00 0.00 0.00 0.00 44.72 43.79 2dog s GLY 7 CO 0.37 -0.32 0.03 -1.60 0.00 0.00 0.00 173.10 171.58 2dog s ARG 8 N -2.84 0.05 -0.02 2.90 3.00 -0.70 -1.74 118.95 119.61 2dog s ARG 8 Ca 0.16 0.01 -0.30 0.00 -1.00 0.00 0.00 55.73 54.60 2dog s ARG 8 Cb -0.05 0.02 -0.05 0.00 0.00 0.00 0.00 34.95 34.87 2dog s ARG 8 CO 0.11 -0.01 1.42 -0.06 0.00 0.00 0.00 175.30 176.76 2dog s PHE 9 N -0.06 2.75 0.00 5.12 0.08 -1.10 -2.04 117.98 122.74 2dog s PHE 9 Ca -0.01 0.76 0.00 0.00 0.12 0.00 0.00 56.93 57.80 2dog s PHE 9 Cb -0.01 -3.68 0.00 0.00 -0.57 0.00 0.00 43.02 38.76 2dog s PHE 9 CO 0.00 -2.57 0.00 0.41 -0.10 0.00 0.00 175.22 172.96 2dog n GLY 10 N 3.70 0.33 3.51 4.36 0.00 0.64 -2.67 105.19 115.06 2dog n GLY 10 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 2dog n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dog s ALA 11 N -4.21 2.76 -0.19 4.61 0.00 -1.26 -4.37 121.76 119.11 2dog s ALA 11 Ca 0.00 -1.38 -0.29 0.00 0.00 0.00 0.00 51.96 50.29 2dog s ALA 11 Cb 0.00 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 2dog s ALA 11 CO 0.00 0.56 1.59 -1.25 0.00 0.00 0.00 175.76 176.66 2dog s PRO 12 N -2.33 3.90 1.27 0.00 0.04 -1.26 -1.73 135.00 134.89 2dog s PRO 12 Ca 0.20 1.74 -0.19 0.00 0.04 0.00 0.00 61.00 62.80 2dog s PRO 12 Cb -0.10 -4.00 0.29 0.00 0.04 0.00 0.00 34.50 30.72 2dog s PRO 12 CO 0.12 -1.17 0.67 0.98 0.04 0.00 0.00 177.00 177.63 2dog n TYR 13 N 8.07 -2.67 -0.95 0.56 9.36 0.12 -4.90 117.16 126.75 2dog n TYR 13 Ca 0.18 -0.38 -0.37 0.00 3.32 0.00 0.00 57.90 60.65 2dog n TYR 13 Cb 0.45 -1.45 0.06 0.00 -0.63 0.00 0.00 39.34 37.77 2dog n TYR 13 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2dog n ALA 14 N -5.18 -5.28 -0.09 2.98 0.00 -1.26 -4.50 120.51 107.17 2dog n ALA 14 Ca 0.08 -1.06 0.26 0.00 0.00 0.00 0.00 53.44 52.72 2dog n ALA 14 Cb 0.53 -1.08 0.70 0.00 0.00 0.00 0.00 19.45 19.60 2dog n ALA 14 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2dog h LEU 15 N -1.16 0.00 -1.55 0.00 3.38 -1.94 -1.82 115.31 112.22 2dog h LEU 15 Ca -0.43 0.00 0.46 0.00 0.09 0.00 0.00 57.88 58.00 2dog h LEU 15 Cb 1.35 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.03 2dog h LEU 15 CO 0.25 0.00 1.11 0.29 0.09 0.00 0.00 178.44 180.18 2dog n LYS 16 N -3.81 -0.00 0.00 1.13 4.76 -1.26 -3.94 118.16 115.03 2dog n LYS 16 Ca 0.15 0.89 0.00 0.00 -2.87 0.00 0.00 58.31 56.48 2dog n LYS 16 Cb 0.95 -2.02 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 2dog n LYS 16 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dog n GLY 17 N -1.71 1.47 3.94 0.72 0.00 -0.68 -4.56 105.19 104.36 2dog n GLY 17 Ca 0.36 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.13 2dog n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dog s GLY 18 N -2.00 1.40 -0.09 -0.02 0.00 -1.24 -4.19 107.32 101.18 2dog s GLY 18 Ca 0.00 -0.85 0.01 0.00 0.00 0.00 0.00 44.72 43.88 2dog s GLY 18 CO 0.00 -0.78 -0.11 1.08 0.00 0.00 0.00 173.10 173.29 2dog s LEU 19 N -4.27 1.52 -0.50 0.66 1.43 -0.73 0.15 118.68 116.94 2dog s LEU 19 Ca 0.41 -0.33 -0.27 0.00 -1.03 0.00 0.00 54.13 52.90 2dog s LEU 19 Cb -0.10 -0.90 -0.03 0.00 0.03 0.00 0.00 46.19 45.19 2dog s LEU 19 CO 0.36 -0.02 2.00 -0.13 0.23 0.00 0.00 176.35 178.79 2dog s ARG 20 N 1.09 2.68 -0.30 1.70 0.52 -0.70 0.17 118.95 124.11 2dog s ARG 20 Ca -0.06 1.07 -0.10 0.00 -0.52 0.00 0.00 55.73 56.12 2dog s ARG 20 Cb -0.14 -4.39 -0.02 0.00 0.52 0.00 0.00 34.95 30.92 2dog s ARG 20 CO -0.02 -2.64 0.15 0.12 0.02 0.00 0.00 175.30 172.94 2dog s PHE 21 N 9.31 3.18 -0.60 -0.53 5.36 0.26 -0.26 117.98 134.70 2dog s PHE 21 Ca 0.79 -0.44 -0.12 0.00 -0.96 0.00 0.00 56.93 56.20 2dog s PHE 21 Cb -0.17 -2.35 0.15 0.00 -0.34 0.00 0.00 43.02 40.31 2dog s PHE 21 CO 0.26 -0.40 0.52 0.50 -1.46 0.00 0.00 175.22 174.63 2dog s ARG 22 N 1.64 2.96 0.17 10.12 3.00 -0.86 -3.57 118.95 132.39 2dog s ARG 22 Ca 0.05 -1.99 -0.03 0.00 -1.00 0.00 0.00 55.73 52.75 2dog s ARG 22 Cb -0.17 -4.17 -0.03 0.00 0.00 0.00 0.00 34.95 30.58 2dog s ARG 22 CO 0.07 -1.27 0.15 0.20 0.00 0.00 0.00 175.30 174.45 2dog s GLY 23 N 2.69 0.99 0.98 8.12 0.00 -1.26 -1.72 107.32 117.13 2dog s GLY 23 Ca 0.09 -1.38 -0.15 0.00 0.00 0.00 0.00 44.72 43.28 2dog s GLY 23 CO -0.02 -1.22 -0.17 -1.84 0.00 0.00 0.00 173.10 169.86 2dog n GLU 24 N -0.19 -0.24 0.05 2.90 0.28 -0.25 -4.82 120.64 118.37 2dog n GLU 24 Ca -0.03 -0.05 0.09 0.00 -0.16 0.00 0.00 57.16 57.01 2dog n GLU 24 Cb 0.64 -1.48 0.37 0.00 1.43 0.00 0.00 31.44 32.40 2dog n GLU 24 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 2dog n PRO 25 N 0.09 0.07 0.22 3.44 -0.04 -1.26 -2.61 135.00 134.91 2dog n PRO 25 Ca 0.03 0.32 0.16 0.00 -0.04 0.00 0.00 63.50 63.96 2dog n PRO 25 Cb 0.56 -1.63 0.71 0.00 -0.04 0.00 0.00 33.50 33.09 2dog n PRO 25 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2dog h VAL 26 N 0.00 0.00 0.00 0.52 3.04 -1.98 -2.38 116.25 115.45 2dog h VAL 26 Ca 0.00 -0.25 -0.00 0.00 -1.01 0.00 0.00 66.70 65.43 2dog h VAL 26 Cb 0.29 1.09 -0.00 0.00 -2.01 0.00 0.00 31.29 30.65 2dog h VAL 26 CO 0.00 0.00 -0.01 1.62 -1.01 0.00 0.00 177.57 178.17 2dog h VAL 27 N 0.00 0.09 0.00 1.51 3.04 -1.83 -1.19 116.25 117.86 2dog h VAL 27 Ca 0.00 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.48 2dog h VAL 27 Cb 0.30 1.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.77 2dog h VAL 27 CO 0.00 0.01 0.00 0.18 -1.01 0.00 0.00 177.57 176.75 2dog n LEU 28 N -3.18 0.18 -0.28 3.16 4.77 -0.90 -1.78 117.00 118.98 2dog n LEU 28 Ca -0.02 0.55 0.07 0.00 -0.03 0.00 0.00 56.01 56.58 2dog n LEU 28 Cb 0.16 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 40.72 2dog n LEU 28 CO 0.24 -0.36 0.22 1.41 -1.33 0.00 0.00 177.39 177.57 2dog n HIS 29 N -1.70 0.00 -1.98 -1.77 8.25 -0.45 -5.00 115.22 112.56 2dog n HIS 29 Ca 0.03 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.20 2dog n HIS 29 Cb 0.17 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.36 2dog n HIS 29 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2dog s LEU 30 N -1.93 2.64 0.00 2.41 1.43 -0.73 -4.93 118.68 117.57 2dog s LEU 30 Ca 0.11 0.76 0.00 0.00 -1.03 0.00 0.00 54.13 53.96 2dog s LEU 30 Cb 0.11 -3.33 0.00 0.00 0.03 0.00 0.00 46.19 43.00 2dog s LEU 30 CO 0.36 -1.74 0.00 1.21 0.23 0.00 0.00 176.35 176.41 2dog n GLU 31 N -3.17 0.13 -4.45 1.70 2.13 -1.26 -5.05 120.64 110.66 2dog n GLU 31 Ca 0.08 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.68 2dog n GLU 31 Cb 0.60 -0.86 -0.11 0.00 0.27 0.00 0.00 31.44 31.35 2dog n GLU 31 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2dog s ARG 32 N -1.72 1.66 0.27 5.31 1.70 -1.26 -2.29 118.95 122.62 2dog s ARG 32 Ca 0.00 -1.92 0.02 0.00 -0.47 0.00 0.00 55.73 53.37 2dog s ARG 32 Cb 0.00 -0.90 -0.03 0.00 -0.57 0.00 0.00 34.95 33.45 2dog s ARG 32 CO 0.00 -0.17 0.24 0.14 -1.08 0.00 0.00 175.30 174.42 2dog s VAL 33 N -3.27 0.00 -0.11 4.99 -7.23 0.19 -4.80 120.40 110.17 2dog s VAL 33 Ca 0.36 -1.94 -0.01 0.00 -1.81 0.00 0.00 61.98 58.58 2dog s VAL 33 Cb 0.09 -2.50 0.03 0.00 0.56 0.00 0.00 36.38 34.55 2dog s VAL 33 CO 0.15 0.00 -0.06 -0.47 -0.31 0.00 0.00 175.10 174.41 2dog s TYR 34 N -3.74 1.40 -0.80 2.82 5.04 -1.13 -1.22 117.35 119.72 2dog s TYR 34 Ca 0.39 -0.70 -0.22 0.00 -2.44 0.00 0.00 57.07 54.09 2dog s TYR 34 Cb 0.04 -1.19 0.08 0.00 0.35 0.00 0.00 41.96 41.24 2dog s TYR 34 CO 0.20 -0.50 1.14 0.08 -1.34 0.00 0.00 175.55 175.12 2dog s VAL 35 N 1.74 4.27 -0.52 3.14 1.01 -0.59 -2.03 120.40 127.42 2dog s VAL 35 Ca 0.05 -0.63 -0.26 0.00 0.00 0.00 0.00 61.98 61.13 2dog s VAL 35 Cb -0.13 -4.81 -0.08 0.00 0.00 0.00 0.00 36.38 31.37 2dog s VAL 35 CO -0.08 -1.61 2.43 1.21 0.00 0.00 0.00 175.10 177.05 2dog n GLU 36 N 7.85 0.99 0.00 2.72 2.13 -0.88 -2.16 120.64 131.29 2dog n GLU 36 Ca 0.11 -0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.89 2dog n GLU 36 Cb 0.48 -3.39 0.00 0.00 0.27 0.00 0.00 31.44 28.80 2dog n GLU 36 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dog n GLY 37 N 6.05 3.93 0.09 8.31 0.00 -1.26 -4.38 105.19 117.92 2dog n GLY 37 Ca 0.38 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2dog n GLY 37 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dog n HIS 38 N 0.00 0.00 -3.79 1.61 8.25 -0.92 -5.16 115.22 115.22 2dog n HIS 38 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 2dog n HIS 38 Cb 0.00 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.14 2dog n HIS 38 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dog n GLY 39 N 3.25 0.95 3.71 -1.41 0.00 -1.18 -5.04 105.19 105.46 2dog n GLY 39 Ca 0.00 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 2dog n GLY 39 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dog s TRP 40 N -2.35 3.44 0.06 1.61 0.52 -1.26 -1.54 118.94 119.42 2dog s TRP 40 Ca 0.16 1.39 0.09 0.00 0.02 0.00 0.00 56.10 57.76 2dog s TRP 40 Cb -0.04 -3.34 -0.03 0.00 -1.15 0.00 0.00 33.47 28.90 2dog s TRP 40 CO 0.11 -0.95 -0.25 1.03 0.02 0.00 0.00 176.95 176.90 2dog s ARG 41 N 1.34 1.76 0.10 4.98 1.81 -0.36 -4.86 118.95 123.71 2dog s ARG 41 Ca 0.56 -1.14 0.01 0.00 -1.72 0.00 0.00 55.73 53.44 2dog s ARG 41 Cb -0.26 -1.99 -0.04 0.00 -0.45 0.00 0.00 34.95 32.21 2dog s ARG 41 CO 0.27 0.50 0.23 0.00 -0.68 0.00 0.00 175.30 175.62 2dog s ALA 42 N -0.88 3.94 0.03 2.13 0.00 -1.26 0.56 121.76 126.28 2dog s ALA 42 Ca 0.13 -0.94 -0.21 0.00 0.00 0.00 0.00 51.96 50.94 2dog s ALA 42 Cb -0.10 -1.76 -0.06 0.00 0.00 0.00 0.00 23.12 21.20 2dog s ALA 42 CO 0.03 0.70 0.61 0.42 0.00 0.00 0.00 175.76 177.52 2dog s ILE 43 N -1.60 4.83 -0.11 0.00 1.01 -0.97 -0.96 121.20 123.40 2dog s ILE 43 Ca 0.34 1.28 0.04 0.00 0.00 0.00 0.00 60.65 62.31 2dog s ILE 43 Cb -0.12 -3.94 -0.09 0.00 0.01 0.00 0.00 42.46 38.32 2dog s ILE 43 CO 0.28 0.46 -0.05 -0.62 0.00 0.00 0.00 174.94 175.00 2dog n GLU 44 N 2.42 1.15 -3.64 2.79 1.02 -0.62 -4.86 120.64 118.90 2dog n GLU 44 Ca -0.07 0.04 -0.07 0.00 -0.02 0.00 0.00 57.16 57.03 2dog n GLU 44 Cb 0.51 -1.23 -0.07 0.00 -0.02 0.00 0.00 31.44 30.63 2dog n GLU 44 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2dog s ASP 45 N -4.74 -0.54 0.15 1.62 1.01 -1.24 -5.03 116.67 107.90 2dog s ASP 45 Ca -0.11 0.96 -0.14 0.00 0.71 0.00 0.00 52.55 53.96 2dog s ASP 45 Cb 0.04 1.08 0.02 0.00 1.01 0.00 0.00 42.92 45.06 2dog s ASP 45 CO 0.31 -0.16 0.39 -1.48 0.21 0.00 0.00 175.17 174.44 2dog s LEU 46 N 0.73 0.53 -0.26 1.23 0.05 -1.26 -0.56 118.68 119.13 2dog s LEU 46 Ca -0.02 -0.51 -0.26 0.00 0.05 0.00 0.00 54.13 53.39 2dog s LEU 46 Cb -0.05 1.71 0.12 0.00 -2.05 0.00 0.00 46.19 45.92 2dog s LEU 46 CO -0.10 -0.91 0.99 -0.72 -0.55 0.00 0.00 176.35 175.06 2dog s TYR 47 N -3.86 -0.50 -0.47 3.48 -0.85 -1.04 -5.00 117.35 109.10 2dog s TYR 47 Ca 0.08 1.17 -0.29 0.00 -0.52 0.00 0.00 57.07 57.51 2dog s TYR 47 Cb 0.02 0.36 0.02 0.00 0.38 0.00 0.00 41.96 42.75 2dog s TYR 47 CO -0.07 -0.27 1.23 -0.98 -1.52 0.00 0.00 175.55 173.94 2dog s ARG 48 N 0.04 3.64 -0.52 -3.49 3.03 -1.26 -2.08 118.95 118.31 2dog s ARG 48 Ca 0.02 0.63 -0.19 0.00 2.03 0.00 0.00 55.73 58.21 2dog s ARG 48 Cb -0.04 -3.96 0.06 0.00 -1.03 0.00 0.00 34.95 29.98 2dog s ARG 48 CO -0.04 -1.49 0.65 0.08 -1.13 0.00 0.00 175.30 173.37 2dog s VAL 49 N 4.84 4.85 0.00 4.99 1.01 0.24 -4.89 120.40 131.44 2dog s VAL 49 Ca 0.51 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.97 2dog s VAL 49 Cb -0.09 -4.33 0.00 0.00 0.00 0.00 0.00 36.38 31.96 2dog s VAL 49 CO 0.31 -0.86 0.00 0.61 0.00 0.00 0.00 175.10 175.17 2dog n GLY 50 N 5.18 0.97 1.31 4.51 0.00 -1.26 -0.97 105.19 114.94 2dog n GLY 50 Ca -0.07 0.48 -0.05 0.00 0.00 0.00 0.00 46.02 46.39 2dog n GLY 50 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dog n GLU 51 N 0.00 2.15 -4.06 1.61 1.02 -1.26 -5.00 120.64 115.11 2dog n GLU 51 Ca 0.00 -3.10 -0.13 0.00 -0.02 0.00 0.00 57.16 53.90 2dog n GLU 51 Cb 0.00 -1.89 -0.04 0.00 -0.02 0.00 0.00 31.44 29.49 2dog n GLU 51 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dog s GLU 52 N -3.18 1.85 0.02 3.49 2.02 -0.14 -5.14 118.70 117.62 2dog s GLU 52 Ca 0.46 -1.64 0.02 0.00 0.02 0.00 0.00 54.97 53.83 2dog s GLU 52 Cb 0.41 0.45 -0.02 0.00 0.10 0.00 0.00 34.13 35.08 2dog s GLU 52 CO 0.03 -0.77 -0.08 -0.51 0.02 0.00 0.00 175.26 173.96 2dog s LEU 53 N -3.18 2.14 -0.21 1.80 1.43 -1.23 0.79 118.68 120.21 2dog s LEU 53 Ca 0.28 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.05 2dog s LEU 53 Cb -0.00 -0.27 0.05 0.00 0.03 0.00 0.00 46.19 45.99 2dog s LEU 53 CO 0.17 -0.06 -0.09 -0.69 0.23 0.00 0.00 176.35 175.92 2dog s VAL 54 N -0.77 1.62 -0.15 -1.59 1.01 -0.88 0.90 120.40 120.53 2dog s VAL 54 Ca -0.03 -1.08 -0.07 0.00 0.00 0.00 0.00 61.98 60.80 2dog s VAL 54 Cb -0.06 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2dog s VAL 54 CO 0.00 0.09 0.08 -0.69 0.00 0.00 0.00 175.10 174.58 2dog s VAL 55 N 1.39 4.99 -0.53 2.92 1.01 0.13 -2.48 120.40 127.83 2dog s VAL 55 Ca -0.03 0.03 -0.10 0.00 0.00 0.00 0.00 61.98 61.87 2dog s VAL 55 Cb -0.17 -3.21 0.13 0.00 0.00 0.00 0.00 36.38 33.14 2dog s VAL 55 CO -0.07 0.53 0.42 -1.00 0.00 0.00 0.00 175.10 174.97 2dog s HIS 56 N -0.25 3.42 0.49 5.22 3.76 0.27 -1.77 115.29 126.43 2dog s HIS 56 Ca 0.09 -1.84 -0.22 0.00 -0.15 0.00 0.00 55.06 52.94 2dog s HIS 56 Cb -0.12 -3.56 -0.07 0.00 1.11 0.00 0.00 32.58 29.94 2dog s HIS 56 CO 0.01 -0.99 1.14 -0.51 -0.85 0.00 0.00 174.74 173.55 2dog s LEU 57 N 1.19 3.92 -0.03 0.89 1.43 -1.26 -1.59 118.68 123.23 2dog s LEU 57 Ca 0.07 2.24 -0.30 0.00 -1.03 0.00 0.00 54.13 55.11 2dog s LEU 57 Cb -0.25 -4.36 -0.06 0.00 0.03 0.00 0.00 46.19 41.54 2dog s LEU 57 CO -0.01 -1.00 1.70 0.00 0.23 0.00 0.00 176.35 177.27 2dog s ALA 58 N -1.64 3.62 0.00 4.21 0.00 -0.14 -2.50 121.76 125.31 2dog s ALA 58 Ca 0.67 1.01 0.00 0.00 0.00 0.00 0.00 51.96 53.64 2dog s ALA 58 Cb -0.26 -3.76 0.00 0.00 0.00 0.00 0.00 23.12 19.10 2dog s ALA 58 CO 0.31 -1.40 0.00 0.41 0.00 0.00 0.00 175.76 175.08 2dog n GLY 59 N 4.18 2.66 3.57 0.00 0.00 -1.26 -4.82 105.19 109.51 2dog n GLY 59 Ca 0.17 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 2dog n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dog s VAL 60 N -0.89 3.77 0.00 1.61 1.01 -1.04 -4.70 120.40 120.16 2dog s VAL 60 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 61.98 62.58 2dog s VAL 60 Cb 0.00 -4.60 0.00 0.00 0.00 0.00 0.00 36.38 31.78 2dog s VAL 60 CO 0.00 -1.40 0.00 0.35 0.00 0.00 0.00 175.10 174.05 2dog n THR 61 N 6.70 0.00 -4.21 3.92 -2.24 -1.26 -4.59 114.28 112.59 2dog n THR 61 Ca 0.09 -0.01 -0.30 0.00 -2.27 0.00 0.00 64.05 61.56 2dog n THR 61 Cb 0.49 0.40 -0.09 0.00 -2.10 0.00 0.00 70.33 69.03 2dog n THR 61 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2dog s ASP 62 N -1.54 4.78 0.23 3.42 1.47 -1.26 -2.73 116.67 121.04 2dog s ASP 62 Ca 0.00 -0.23 -0.10 0.00 1.18 0.00 0.00 52.55 53.40 2dog s ASP 62 Cb 0.00 -1.08 0.33 0.00 -0.34 0.00 0.00 42.92 41.83 2dog s ASP 62 CO 0.00 0.20 1.63 -0.09 0.68 0.00 0.00 175.17 177.59 2dog h ARG 63 N 3.69 0.05 -0.06 2.11 2.43 -1.88 -2.32 114.38 118.40 2dog h ARG 63 Ca -0.48 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.69 2dog h ARG 63 Cb 1.17 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.69 2dog h ARG 63 CO 0.56 0.03 -0.12 1.15 -1.51 0.00 0.00 179.97 180.09 2dog h THR 64 N 0.05 0.00 -0.93 0.20 2.02 -1.95 0.24 112.91 112.54 2dog h THR 64 Ca 0.36 0.00 0.27 0.00 0.77 0.00 0.00 66.41 67.80 2dog h THR 64 Cb 0.59 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.83 2dog h THR 64 CO -0.66 0.00 0.17 -0.07 0.37 0.00 0.00 175.52 175.32 2dog h LEU 65 N -0.10 -0.19 0.05 2.58 3.38 -1.86 0.23 115.31 119.41 2dog h LEU 65 Ca 0.01 0.24 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 2dog h LEU 65 Cb 0.13 0.36 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2dog h LEU 65 CO -0.11 -0.27 -0.03 0.00 0.09 0.00 0.00 178.44 178.12 2dog h ALA 66 N 1.88 -0.07 -0.36 1.53 0.00 -0.72 -2.12 119.26 119.39 2dog h ALA 66 Ca 0.60 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.57 2dog h ALA 66 Cb 1.26 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2dog h ALA 66 CO -0.78 -0.51 0.35 0.93 0.00 0.00 0.00 179.25 179.24 2dog h GLU 67 N -0.13 0.00 0.00 0.00 5.08 0.27 0.35 114.58 120.15 2dog h GLU 67 Ca -0.01 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 2dog h GLU 67 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2dog h GLU 67 CO 0.01 0.00 -0.44 0.00 -1.00 0.00 0.00 179.01 177.59 2dog h ALA 68 N 1.64 0.93 -0.41 3.43 0.00 -0.60 -3.00 119.26 121.26 2dog h ALA 68 Ca 0.17 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2dog h ALA 68 Cb 0.87 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2dog h ALA 68 CO -0.00 0.55 0.03 1.28 0.00 0.00 0.00 179.25 181.10 2dog n LEU 69 N -3.52 4.69 -4.70 0.00 4.77 0.12 -4.95 117.00 113.41 2dog n LEU 69 Ca -0.00 -3.06 -0.37 0.00 -0.03 0.00 0.00 56.01 52.55 2dog n LEU 69 Cb 0.56 -0.61 -0.08 0.00 -2.33 0.00 0.00 43.42 40.96 2dog n LEU 69 CO 0.38 0.71 -0.03 -0.69 -1.33 0.00 0.00 177.39 176.43 2dog s VAL 70 N -2.86 5.30 0.00 4.08 1.01 -0.83 -4.25 120.40 122.85 2dog s VAL 70 Ca 0.47 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.94 2dog s VAL 70 Cb 0.38 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2dog s VAL 70 CO 0.11 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2dog n GLY 71 N 3.76 2.43 3.67 4.51 0.00 -1.09 -5.03 105.19 113.43 2dog n GLY 71 Ca -0.12 -0.49 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 2dog n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dog s LEU 72 N 0.00 2.07 -0.01 0.99 1.43 -1.26 -4.74 118.68 117.16 2dog s LEU 72 Ca 0.00 1.59 -0.00 0.00 -1.03 0.00 0.00 54.13 54.68 2dog s LEU 72 Cb 0.00 -3.91 -0.04 0.00 0.03 0.00 0.00 46.19 42.28 2dog s LEU 72 CO 0.00 -3.00 0.07 -0.13 0.23 0.00 0.00 176.35 173.52 2dog s ARG 73 N -4.81 3.05 -0.20 1.70 0.52 -1.26 -2.70 118.95 115.25 2dog s ARG 73 Ca 0.65 -0.49 -0.09 0.00 -0.52 0.00 0.00 55.73 55.28 2dog s ARG 73 Cb -0.20 -2.85 -0.05 0.00 0.52 0.00 0.00 34.95 32.38 2dog s ARG 73 CO 0.58 0.65 0.11 0.08 0.02 0.00 0.00 175.30 176.74 2dog s VAL 74 N -1.18 5.15 0.34 3.52 1.01 -0.71 -2.07 120.40 126.46 2dog s VAL 74 Ca 0.22 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.37 2dog s VAL 74 Cb -0.12 -3.35 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 2dog s VAL 74 CO 0.13 0.43 0.36 -0.31 0.00 0.00 0.00 175.10 175.71 2dog s TYR 75 N 0.51 2.96 0.06 5.22 1.51 -0.86 -3.07 117.35 123.68 2dog s TYR 75 Ca 0.06 -0.29 0.03 0.00 -1.01 0.00 0.00 57.07 55.86 2dog s TYR 75 Cb -0.12 -1.90 -0.03 0.00 -0.11 0.00 0.00 41.96 39.80 2dog s TYR 75 CO -0.00 0.09 -0.09 0.00 -1.11 0.00 0.00 175.55 174.44 2dog s ALA 76 N -2.27 0.76 0.12 3.71 0.00 0.04 -2.84 121.76 121.28 2dog s ALA 76 Ca 0.43 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.47 2dog s ALA 76 Cb -0.07 0.03 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 2dog s ALA 76 CO 0.28 -0.01 0.32 -2.00 0.00 0.00 0.00 175.76 174.36 2dog s GLU 77 N -1.90 3.55 -0.05 0.00 2.12 -1.26 -1.84 118.70 119.32 2dog s GLU 77 Ca -0.05 -0.24 0.10 0.00 0.36 0.00 0.00 54.97 55.14 2dog s GLU 77 Cb -0.08 -2.91 0.36 0.00 0.26 0.00 0.00 34.13 31.76 2dog s GLU 77 CO 0.00 0.51 1.22 0.28 -0.54 0.00 0.00 175.26 176.73 2dog n VAL 78 N 0.05 0.85 0.14 3.70 0.31 -1.24 -3.56 118.33 118.58 2dog n VAL 78 Ca -0.03 -0.58 0.11 0.00 -0.01 0.00 0.00 64.34 63.82 2dog n VAL 78 Cb 0.52 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.30 2dog n VAL 78 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dog n ALA 79 N 0.49 3.04 -0.09 3.52 0.00 -1.26 -4.49 120.51 121.72 2dog n ALA 79 Ca 0.13 -0.50 -0.11 0.00 0.00 0.00 0.00 53.44 52.96 2dog n ALA 79 Cb 0.48 -0.79 -0.10 0.00 0.00 0.00 0.00 19.45 19.04 2dog n ALA 79 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2dog n ASP 80 N -2.19 2.13 -4.32 0.00 9.92 -1.24 -5.02 116.55 115.82 2dog n ASP 80 Ca -0.03 -0.06 -0.36 0.00 -0.53 0.00 0.00 54.79 53.81 2dog n ASP 80 Cb 0.54 0.13 0.06 0.00 -0.64 0.00 0.00 41.12 41.20 2dog n ASP 80 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2dog n LEU 81 N -2.86 -1.60 -4.74 0.64 4.77 -1.23 -4.94 117.00 107.03 2dog n LEU 81 Ca -0.30 0.49 -0.30 0.00 -0.03 0.00 0.00 56.01 55.87 2dog n LEU 81 Cb 0.90 -1.05 0.12 0.00 -2.33 0.00 0.00 43.42 41.06 2dog n LEU 81 CO 0.23 -4.11 0.68 -2.16 -1.33 0.00 0.00 177.39 170.70 2dog s PRO 82 N -2.34 1.73 0.71 3.23 0.04 -1.26 -5.02 135.00 132.08 2dog s PRO 82 Ca 0.58 0.98 -0.13 0.00 0.04 0.00 0.00 61.00 62.46 2dog s PRO 82 Cb -0.33 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 32.38 2dog s PRO 82 CO 0.66 -1.96 1.10 -1.25 0.04 0.00 0.00 177.00 175.59 2dog s PRO 83 N -4.92 2.56 -1.08 0.56 0.04 -1.26 -4.95 135.00 125.95 2dog s PRO 83 Ca 0.62 1.30 -0.19 0.00 0.04 0.00 0.00 61.00 62.78 2dog s PRO 83 Cb -0.18 -1.93 0.11 0.00 0.04 0.00 0.00 34.50 32.55 2dog s PRO 83 CO 0.56 -1.42 1.39 -0.48 0.04 0.00 0.00 177.00 177.09 2dog s LEU 84 N -5.32 4.42 0.00 -3.56 2.34 -1.26 -5.30 118.68 110.01 2dog s LEU 84 Ca 0.65 -2.16 0.27 0.00 0.06 0.00 0.00 54.13 52.94 2dog s LEU 84 Cb -0.19 -2.48 0.75 0.00 -0.56 0.00 0.00 46.19 43.71 2dog s LEU 84 CO 0.48 -1.13 1.57 -1.84 -1.06 0.00 0.00 176.35 174.37