#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dog n ARG 2 N 0.00 0.23 -4.32 0.03 1.74 -1.26 -4.87 116.66 108.21 2dog n ARG 2 Ca 0.00 -1.37 -0.28 0.00 -0.77 0.00 0.00 57.85 55.43 2dog n ARG 2 Cb 0.00 -3.75 -0.11 0.00 -1.02 0.00 0.00 32.46 27.58 2dog n ARG 2 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dog s LEU 3 N 16.00 2.75 -0.01 0.55 1.43 -1.26 -3.74 118.68 134.41 2dog s LEU 3 Ca 0.84 -0.64 -0.05 0.00 -1.03 0.00 0.00 54.13 53.25 2dog s LEU 3 Cb -0.08 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.63 2dog s LEU 3 CO 0.16 0.14 0.10 0.68 0.23 0.00 0.00 176.35 177.65 2dog s VAL 4 N -1.49 0.06 -0.47 -1.59 -7.23 -0.74 -4.92 120.40 104.03 2dog s VAL 4 Ca 0.21 -0.53 -0.26 0.00 -1.81 0.00 0.00 61.98 59.59 2dog s VAL 4 Cb -0.09 -0.32 0.03 0.00 0.56 0.00 0.00 36.38 36.55 2dog s VAL 4 CO 0.12 -0.29 0.99 -0.70 -0.31 0.00 0.00 175.10 174.91 2dog s GLU 5 N -0.98 3.57 -0.19 4.82 2.12 -1.26 -0.03 118.70 126.75 2dog s GLU 5 Ca -0.11 0.26 0.05 0.00 0.36 0.00 0.00 54.97 55.53 2dog s GLU 5 Cb -0.06 -3.93 -0.21 0.00 0.26 0.00 0.00 34.13 30.18 2dog s GLU 5 CO 0.01 -1.29 0.06 0.44 -0.54 0.00 0.00 175.26 173.93 2dog n ILE 6 N 6.55 1.54 -3.92 -3.70 -5.35 -1.19 -4.99 119.36 108.30 2dog n ILE 6 Ca 0.08 -0.68 -0.11 0.00 -0.27 0.00 0.00 62.75 61.77 2dog n ILE 6 Cb 0.49 -1.22 -0.00 0.00 -1.74 0.00 0.00 39.64 37.16 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 -5.93 0.81 -0.03 3.28 0.00 -1.24 -1.18 107.32 103.03 2dog s GLY 7 Ca -0.23 -1.05 -0.06 0.00 0.00 0.00 0.00 44.72 43.38 2dog s GLY 7 CO 0.71 -0.58 0.13 -1.60 0.00 0.00 0.00 173.10 171.76 2dog s ARG 8 N -2.67 0.30 -0.14 2.90 3.00 -0.64 -0.37 118.95 121.34 2dog s ARG 8 Ca 0.21 -0.08 -0.29 0.00 -1.00 0.00 0.00 55.73 54.57 2dog s ARG 8 Cb -0.03 0.13 -0.02 0.00 0.00 0.00 0.00 34.95 35.03 2dog s ARG 8 CO 0.15 -0.06 1.32 -0.06 0.00 0.00 0.00 175.30 176.65 2dog s PHE 9 N -0.58 2.74 0.00 5.12 0.08 -0.44 -1.86 117.98 123.05 2dog s PHE 9 Ca -0.07 0.90 0.00 0.00 0.12 0.00 0.00 56.93 57.88 2dog s PHE 9 Cb -0.04 -3.56 0.00 0.00 -0.57 0.00 0.00 43.02 38.85 2dog s PHE 9 CO 0.01 -2.01 0.00 0.41 -0.10 0.00 0.00 175.22 173.53 2dog n GLY 10 N 3.67 0.83 3.48 4.36 0.00 0.66 -2.35 105.19 115.84 2dog n GLY 10 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 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 -4.12 2.68 -0.07 4.61 0.00 -1.26 -4.01 121.76 119.59 2dog s ALA 11 Ca 0.00 -1.52 -0.30 0.00 0.00 0.00 0.00 51.96 50.15 2dog s ALA 11 Cb 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.55 2dog s ALA 11 CO 0.00 0.48 1.50 -1.25 0.00 0.00 0.00 175.76 176.49 2dog s PRO 12 N -2.57 4.22 1.38 0.00 0.04 -1.26 -1.45 135.00 135.36 2dog s PRO 12 Ca 0.21 2.01 -0.22 0.00 0.04 0.00 0.00 61.00 63.04 2dog s PRO 12 Cb -0.09 -3.83 0.35 0.00 0.04 0.00 0.00 34.50 30.98 2dog s PRO 12 CO 0.11 -0.75 0.96 -0.47 0.04 0.00 0.00 177.00 176.89 2dog s TYR 13 N 3.50 -0.41 1.01 0.56 5.04 0.21 -4.88 117.35 122.39 2dog s TYR 13 Ca 0.66 0.58 -0.22 0.00 -2.44 0.00 0.00 57.07 55.66 2dog s TYR 13 Cb -0.30 -2.99 -0.12 0.00 0.35 0.00 0.00 41.96 38.90 2dog s TYR 13 CO 0.25 -4.80 -0.94 0.00 -1.34 0.00 0.00 175.55 168.72 2dog n ALA 14 N -5.49 -5.22 0.15 3.97 0.00 -1.26 -4.48 120.51 108.18 2dog n ALA 14 Ca 0.12 -1.10 0.18 0.00 0.00 0.00 0.00 53.44 52.64 2dog n ALA 14 Cb 0.60 -1.09 0.69 0.00 0.00 0.00 0.00 19.45 19.64 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 -1.21 0.00 -1.10 0.00 3.38 -1.94 -1.36 115.31 113.09 2dog h LEU 15 Ca -0.43 0.00 0.21 0.00 0.09 0.00 0.00 57.88 57.75 2dog h LEU 15 Cb 1.35 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 2dog h LEU 15 CO 0.25 0.00 1.01 0.11 0.09 0.00 0.00 178.44 179.90 2dog h LYS 16 N 0.00 0.00 0.00 1.13 6.56 -1.90 -3.34 116.57 119.02 2dog h LYS 16 Ca 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.74 2dog h LYS 16 Cb 1.22 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.88 2dog h LYS 16 CO -0.00 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.80 2dog n GLY 17 N -1.62 1.11 3.87 3.86 0.00 -0.51 -4.46 105.19 107.44 2dog n GLY 17 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 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 1.68 -0.07 -0.02 0.00 -1.23 -4.57 107.32 101.12 2dog s GLY 18 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.61 2dog s GLY 18 CO 0.00 0.15 -0.04 1.08 0.00 0.00 0.00 173.10 174.29 2dog s LEU 19 N -5.04 1.07 -0.45 0.66 1.43 -0.53 0.66 118.68 116.47 2dog s LEU 19 Ca 0.55 -0.16 -0.27 0.00 -1.03 0.00 0.00 54.13 53.22 2dog s LEU 19 Cb -0.11 -0.54 -0.04 0.00 0.03 0.00 0.00 46.19 45.53 2dog s LEU 19 CO 0.51 -0.11 2.12 -0.13 0.23 0.00 0.00 176.35 178.97 2dog s ARG 20 N 1.41 2.64 -0.34 1.70 0.52 -0.53 -0.21 118.95 124.13 2dog s ARG 20 Ca -0.03 1.30 -0.10 0.00 -0.52 0.00 0.00 55.73 56.38 2dog s ARG 20 Cb -0.13 -4.42 0.01 0.00 0.52 0.00 0.00 34.95 30.92 2dog s ARG 20 CO -0.03 -2.67 0.17 0.12 0.02 0.00 0.00 175.30 172.91 2dog s PHE 21 N 9.73 3.21 -0.62 -0.53 5.36 0.25 -0.25 117.98 135.14 2dog s PHE 21 Ca 0.86 -0.83 -0.14 0.00 -0.96 0.00 0.00 56.93 55.86 2dog s PHE 21 Cb -0.19 -2.38 0.15 0.00 -0.34 0.00 0.00 43.02 40.26 2dog s PHE 21 CO 0.27 -0.57 0.56 0.50 -1.46 0.00 0.00 175.22 174.52 2dog s ARG 22 N 1.57 3.10 0.26 10.12 3.52 -0.77 -3.79 118.95 132.95 2dog s ARG 22 Ca 0.03 -1.95 0.00 0.00 -0.13 0.00 0.00 55.73 53.69 2dog s ARG 22 Cb -0.18 -4.28 -0.03 0.00 -1.56 0.00 0.00 34.95 28.90 2dog s ARG 22 CO 0.06 -1.30 0.25 0.20 -0.81 0.00 0.00 175.30 173.69 2dog s GLY 23 N 3.03 1.63 0.89 8.12 0.00 -1.26 -1.62 107.32 118.12 2dog s GLY 23 Ca 0.08 -1.72 -0.14 0.00 0.00 0.00 0.00 44.72 42.95 2dog s GLY 23 CO -0.01 -1.30 0.45 1.18 0.00 0.00 0.00 173.10 173.42 2dog n GLU 24 N -0.42 -0.13 0.15 2.90 1.02 -0.32 -4.86 120.64 118.97 2dog n GLU 24 Ca 0.03 0.01 0.13 0.00 -0.02 0.00 0.00 57.16 57.30 2dog n GLU 24 Cb 0.64 -1.87 0.52 0.00 -0.02 0.00 0.00 31.44 30.71 2dog n GLU 24 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2dog h PRO 25 N -1.26 0.00 0.00 3.49 0.13 -2.01 -2.80 132.00 129.55 2dog h PRO 25 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2dog h PRO 25 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2dog h PRO 25 CO 0.36 0.00 0.00 1.55 -0.23 0.00 0.00 178.00 179.68 2dog n VAL 26 N -2.34 1.09 0.28 1.56 3.14 -1.26 -2.12 118.33 118.68 2dog n VAL 26 Ca 0.02 0.37 0.16 0.00 -2.96 0.00 0.00 64.34 61.93 2dog n VAL 26 Cb 0.23 -1.27 0.82 0.00 -1.06 0.00 0.00 33.84 32.56 2dog n VAL 26 CO 0.00 0.00 0.00 1.62 -6.46 0.00 0.00 176.83 171.99 2dog h VAL 27 N 0.00 0.26 0.00 1.55 3.04 -1.84 -1.96 116.25 117.29 2dog h VAL 27 Ca 0.00 -0.44 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 2dog h VAL 27 Cb 0.21 1.34 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 2dog h VAL 27 CO 0.00 0.06 0.00 0.18 -1.01 0.00 0.00 177.57 176.80 2dog n LEU 28 N -3.32 0.00 -0.22 3.16 4.77 -0.90 -1.21 117.00 119.27 2dog n LEU 28 Ca -0.01 0.26 0.05 0.00 -0.03 0.00 0.00 56.01 56.27 2dog n LEU 28 Cb 0.23 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2dog n LEU 28 CO 0.27 -0.17 0.21 1.41 -1.33 0.00 0.00 177.39 177.79 2dog n HIS 29 N -1.26 0.00 -2.14 -1.77 8.25 -0.74 -5.02 115.22 112.54 2dog n HIS 29 Ca 0.05 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.24 2dog n HIS 29 Cb 0.08 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.30 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 -1.55 2.77 0.00 2.41 1.43 -0.35 -4.96 118.68 118.42 2dog s LEU 30 Ca 0.08 0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 2dog s LEU 30 Cb 0.08 -2.72 0.00 0.00 0.03 0.00 0.00 46.19 43.57 2dog s LEU 30 CO 0.23 -2.01 0.00 -0.62 0.23 0.00 0.00 176.35 174.18 2dog n GLU 31 N -3.21 0.00 -4.63 1.70 1.02 -1.26 -5.07 120.64 109.19 2dog n GLU 31 Ca 0.11 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.96 2dog n GLU 31 Cb 0.60 -0.65 -0.10 0.00 -0.02 0.00 0.00 31.44 31.28 2dog n GLU 31 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2dog s ARG 32 N -1.69 2.05 0.23 3.49 1.70 -1.26 -2.16 118.95 121.31 2dog s ARG 32 Ca 0.00 -2.19 -0.05 0.00 -0.47 0.00 0.00 55.73 53.02 2dog s ARG 32 Cb 0.00 -1.63 -0.02 0.00 -0.57 0.00 0.00 34.95 32.73 2dog s ARG 32 CO 0.00 -0.16 0.28 0.14 -1.08 0.00 0.00 175.30 174.48 2dog s VAL 33 N -2.76 0.00 -0.13 4.99 -7.23 0.89 -4.80 120.40 111.36 2dog s VAL 33 Ca 0.26 -1.76 -0.01 0.00 -1.81 0.00 0.00 61.98 58.66 2dog s VAL 33 Cb 0.07 -2.41 0.03 0.00 0.56 0.00 0.00 36.38 34.63 2dog s VAL 33 CO 0.13 0.00 -0.06 -0.47 -0.31 0.00 0.00 175.10 174.40 2dog s TYR 34 N -3.99 1.45 -0.83 2.82 5.04 -1.14 -0.68 117.35 120.01 2dog s TYR 34 Ca 0.33 -0.79 -0.24 0.00 -2.44 0.00 0.00 57.07 53.93 2dog s TYR 34 Cb 0.04 -1.20 0.06 0.00 0.35 0.00 0.00 41.96 41.20 2dog s TYR 34 CO 0.12 -0.53 1.24 0.08 -1.34 0.00 0.00 175.55 175.12 2dog s VAL 35 N 1.72 4.05 -0.50 3.14 1.01 -0.53 -1.81 120.40 127.48 2dog s VAL 35 Ca 0.03 -0.38 -0.26 0.00 0.00 0.00 0.00 61.98 61.37 2dog s VAL 35 Cb -0.14 -4.89 -0.07 0.00 0.00 0.00 0.00 36.38 31.29 2dog s VAL 35 CO -0.08 -1.75 2.39 -0.70 0.00 0.00 0.00 175.10 174.97 2dog s GLU 36 N 4.72 2.10 0.00 2.72 2.56 -0.27 -2.09 118.70 128.44 2dog s GLU 36 Ca 0.35 1.35 0.00 0.00 0.00 0.00 0.00 54.97 56.67 2dog s GLU 36 Cb -0.07 -4.58 0.00 0.00 2.00 0.00 0.00 34.13 31.47 2dog s GLU 36 CO 0.03 -3.30 0.00 0.41 -0.56 0.00 0.00 175.26 171.85 2dog n GLY 37 N 6.01 3.86 0.16 -1.50 0.00 -1.26 -4.09 105.19 108.37 2dog n GLY 37 Ca 0.36 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.78 1.61 8.25 -0.89 -5.16 115.22 115.25 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 3.72 0.96 3.76 -1.41 0.00 -1.17 -5.04 105.19 106.01 2dog n GLY 39 Ca 0.00 -1.23 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.36 3.60 0.25 1.61 0.52 -1.26 -1.46 118.94 119.84 2dog s TRP 40 Ca 0.16 1.74 0.05 0.00 0.02 0.00 0.00 56.10 58.07 2dog s TRP 40 Cb -0.04 -3.16 -0.05 0.00 -1.15 0.00 0.00 33.47 29.06 2dog s TRP 40 CO 0.11 -0.31 -0.02 1.03 0.02 0.00 0.00 176.95 177.78 2dog s ARG 41 N -1.69 1.43 0.18 4.98 1.81 0.14 -4.83 118.95 120.97 2dog s ARG 41 Ca 0.47 -1.73 0.10 0.00 -1.72 0.00 0.00 55.73 52.85 2dog s ARG 41 Cb -0.27 -0.83 -0.04 0.00 -0.45 0.00 0.00 34.95 33.36 2dog s ARG 41 CO 0.35 -0.05 -0.15 0.00 -0.68 0.00 0.00 175.30 174.76 2dog s ALA 42 N -3.26 2.77 -0.09 2.13 0.00 -1.26 -0.08 121.76 121.97 2dog s ALA 42 Ca 0.29 -1.52 -0.14 0.00 0.00 0.00 0.00 51.96 50.59 2dog s ALA 42 Cb 0.05 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 2dog s ALA 42 CO 0.10 0.47 0.35 0.42 0.00 0.00 0.00 175.76 177.10 2dog s ILE 43 N -1.63 5.21 -0.11 0.00 1.01 -0.92 -0.08 121.20 124.68 2dog s ILE 43 Ca 0.23 0.69 -0.01 0.00 0.00 0.00 0.00 60.65 61.56 2dog s ILE 43 Cb -0.09 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.65 2dog s ILE 43 CO 0.13 0.47 -0.11 -0.62 0.00 0.00 0.00 174.94 174.81 2dog n GLU 44 N 2.82 0.25 -3.64 2.79 1.02 -0.52 -4.87 120.64 118.48 2dog n GLU 44 Ca -0.12 0.07 -0.06 0.00 -0.02 0.00 0.00 57.16 57.03 2dog n GLU 44 Cb 0.52 -1.10 -0.06 0.00 -0.02 0.00 0.00 31.44 30.78 2dog n GLU 44 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2dog s ASP 45 N -5.33 -0.99 0.07 1.62 2.15 -1.24 -5.03 116.67 107.93 2dog s ASP 45 Ca -0.14 1.52 -0.05 0.00 0.43 0.00 0.00 52.55 54.31 2dog s ASP 45 Cb 0.04 1.61 -0.02 0.00 -0.30 0.00 0.00 42.92 44.25 2dog s ASP 45 CO 0.22 -0.23 0.08 -1.48 -0.17 0.00 0.00 175.17 173.58 2dog s LEU 46 N 1.95 1.97 -0.24 -1.34 0.05 -1.26 -1.10 118.68 118.70 2dog s LEU 46 Ca -0.09 -0.83 -0.27 0.00 0.05 0.00 0.00 54.13 52.99 2dog s LEU 46 Cb -0.07 0.61 0.13 0.00 -2.05 0.00 0.00 46.19 44.81 2dog s LEU 46 CO -0.20 -0.66 1.07 -0.72 -0.55 0.00 0.00 176.35 175.29 2dog s TYR 47 N -3.89 -0.38 -0.54 3.48 -0.85 -1.18 -5.01 117.35 108.98 2dog s TYR 47 Ca 0.06 0.84 -0.28 0.00 -0.52 0.00 0.00 57.07 57.17 2dog s TYR 47 Cb 0.06 0.41 0.02 0.00 0.38 0.00 0.00 41.96 42.84 2dog s TYR 47 CO -0.10 -0.24 1.28 -0.98 -1.52 0.00 0.00 175.55 173.99 2dog s ARG 48 N -0.31 3.47 -0.57 -3.49 1.70 -1.26 -2.14 118.95 116.35 2dog s ARG 48 Ca 0.02 0.43 -0.22 0.00 -0.47 0.00 0.00 55.73 55.49 2dog s ARG 48 Cb -0.03 -4.04 0.06 0.00 -0.57 0.00 0.00 34.95 30.37 2dog s ARG 48 CO -0.04 -1.72 0.83 0.08 -1.08 0.00 0.00 175.30 173.36 2dog s VAL 49 N 5.32 4.56 0.00 4.99 1.01 0.28 -4.85 120.40 131.71 2dog s VAL 49 Ca 0.49 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.25 2dog s VAL 49 Cb -0.09 -4.49 0.00 0.00 0.00 0.00 0.00 36.38 31.79 2dog s VAL 49 CO 0.27 -1.10 0.00 0.61 0.00 0.00 0.00 175.10 174.88 2dog n GLY 50 N 5.20 0.84 0.48 4.51 0.00 -1.26 -1.52 105.19 113.44 2dog n GLY 50 Ca -0.03 0.43 0.07 0.00 0.00 0.00 0.00 46.02 46.48 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 1.64 -4.11 1.61 1.02 -1.26 -5.03 120.64 114.51 2dog n GLU 51 Ca 0.00 -2.94 -0.15 0.00 -0.02 0.00 0.00 57.16 54.06 2dog n GLU 51 Cb 0.00 -1.62 -0.05 0.00 -0.02 0.00 0.00 31.44 29.75 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 -3.04 1.80 -0.00 3.49 2.02 -0.58 -5.15 118.70 117.23 2dog s GLU 52 Ca 0.37 -1.73 0.04 0.00 0.02 0.00 0.00 54.97 53.67 2dog s GLU 52 Cb 0.33 0.42 -0.01 0.00 0.10 0.00 0.00 34.13 34.97 2dog s GLU 52 CO -0.00 -0.72 -0.12 -0.51 0.02 0.00 0.00 175.26 173.92 2dog s LEU 53 N -3.23 2.05 -0.30 1.80 1.43 -1.25 0.99 118.68 120.18 2dog s LEU 53 Ca 0.32 -0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 2dog s LEU 53 Cb 0.01 -0.62 0.09 0.00 0.03 0.00 0.00 46.19 45.70 2dog s LEU 53 CO 0.19 0.13 0.03 -0.69 0.23 0.00 0.00 176.35 176.24 2dog s VAL 54 N -0.39 1.68 -0.04 -1.59 1.01 -0.91 0.87 120.40 121.03 2dog s VAL 54 Ca 0.04 -1.74 -0.14 0.00 0.00 0.00 0.00 61.98 60.14 2dog s VAL 54 Cb -0.05 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 2dog s VAL 54 CO -0.00 -0.45 0.38 -0.69 0.00 0.00 0.00 175.10 174.34 2dog s VAL 55 N 1.24 5.12 -0.46 2.92 1.01 0.70 -3.08 120.40 127.87 2dog s VAL 55 Ca 0.05 0.77 -0.09 0.00 0.00 0.00 0.00 61.98 62.70 2dog s VAL 55 Cb -0.19 -3.69 0.11 0.00 0.00 0.00 0.00 36.38 32.61 2dog s VAL 55 CO -0.12 0.53 0.32 -1.00 0.00 0.00 0.00 175.10 174.83 2dog s HIS 56 N -0.69 3.39 0.49 5.22 3.76 -0.26 -1.46 115.29 125.75 2dog s HIS 56 Ca 0.22 -1.75 -0.22 0.00 -0.15 0.00 0.00 55.06 53.17 2dog s HIS 56 Cb -0.16 -3.33 -0.07 0.00 1.11 0.00 0.00 32.58 30.13 2dog s HIS 56 CO 0.11 -0.95 1.15 -0.51 -0.85 0.00 0.00 174.74 173.69 2dog s LEU 57 N 1.39 3.91 0.20 0.89 1.43 -1.26 -1.44 118.68 123.79 2dog s LEU 57 Ca 0.05 2.24 -0.31 0.00 -1.03 0.00 0.00 54.13 55.08 2dog s LEU 57 Cb -0.25 -4.38 -0.10 0.00 0.03 0.00 0.00 46.19 41.49 2dog s LEU 57 CO 0.00 -1.02 1.50 0.00 0.23 0.00 0.00 176.35 177.06 2dog s ALA 58 N -1.64 3.70 0.00 4.21 0.00 0.89 -2.97 121.76 125.94 2dog s ALA 58 Ca 0.67 1.33 0.00 0.00 0.00 0.00 0.00 51.96 53.96 2dog s ALA 58 Cb -0.26 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.27 2dog s ALA 58 CO 0.31 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.73 2dog n GLY 59 N 3.06 2.91 3.55 0.00 0.00 -1.26 -4.76 105.19 108.69 2dog n GLY 59 Ca 0.11 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.16 3.08 -0.14 1.61 1.01 -1.16 -4.73 120.40 119.91 2dog s VAL 60 Ca 0.00 0.03 0.15 0.00 0.00 0.00 0.00 61.98 62.16 2dog s VAL 60 Cb 0.00 -3.20 0.40 0.00 0.00 0.00 0.00 36.38 33.58 2dog s VAL 60 CO 0.00 -0.19 1.20 0.35 0.00 0.00 0.00 175.10 176.45 2dog n THR 61 N 7.94 1.52 -3.54 3.92 -2.24 -1.26 -4.61 114.28 116.01 2dog n THR 61 Ca 0.35 -2.48 -0.17 0.00 -2.27 0.00 0.00 64.05 59.48 2dog n THR 61 Cb 0.53 0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.82 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 -2.82 -0.64 0.37 3.42 1.47 -1.26 -4.59 116.67 112.62 2dog s ASP 62 Ca 0.36 0.76 0.12 0.00 1.18 0.00 0.00 52.55 54.97 2dog s ASP 62 Cb 0.36 0.61 0.92 0.00 -0.34 0.00 0.00 42.92 44.47 2dog s ASP 62 CO -0.09 -0.55 1.84 -0.09 0.68 0.00 0.00 175.17 176.96 2dog h ARG 63 N 3.15 0.56 0.77 2.11 2.43 -1.86 -1.59 114.38 119.95 2dog h ARG 63 Ca -0.27 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 58.84 2dog h ARG 63 Cb 1.14 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2dog h ARG 63 CO 0.35 0.37 -0.46 1.15 -1.51 0.00 0.00 179.97 179.87 2dog h THR 64 N 0.58 0.00 -0.51 0.20 2.02 -1.96 0.20 112.91 113.45 2dog h THR 64 Ca 0.49 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.75 2dog h THR 64 Cb 0.96 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.31 2dog h THR 64 CO -0.23 0.00 0.13 -0.07 0.37 0.00 0.00 175.52 175.72 2dog h LEU 65 N -1.15 0.07 0.41 2.58 3.38 -1.85 -2.04 115.31 116.72 2dog h LEU 65 Ca -0.10 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2dog h LEU 65 Cb 0.91 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 2dog h LEU 65 CO 0.11 0.06 -0.30 0.00 0.09 0.00 0.00 178.44 178.41 2dog h ALA 66 N 1.38 -0.70 -1.04 1.53 0.00 -1.18 -2.33 119.26 116.92 2dog h ALA 66 Ca 0.25 -0.13 0.27 0.00 0.00 0.00 0.00 54.91 55.31 2dog h ALA 66 Cb 0.32 0.39 -0.11 0.00 0.00 0.00 0.00 17.79 18.39 2dog h ALA 66 CO -0.30 -0.91 0.64 0.93 0.00 0.00 0.00 179.25 179.60 2dog h GLU 67 N -0.70 0.44 -0.07 0.00 5.08 -0.22 0.71 114.58 119.83 2dog h GLU 67 Ca -0.04 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2dog h GLU 67 Cb 0.59 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 2dog h GLU 67 CO 0.01 0.29 0.01 0.00 -1.00 0.00 0.00 179.01 178.33 2dog h ALA 68 N 1.68 1.90 -0.62 3.43 0.00 -0.81 -1.01 119.26 123.83 2dog h ALA 68 Ca 0.64 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.37 2dog h ALA 68 Cb 1.46 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 19.13 2dog h ALA 68 CO -0.40 0.08 0.16 1.28 0.00 0.00 0.00 179.25 180.38 2dog n LEU 69 N -4.49 5.61 -4.80 0.00 4.77 0.24 -4.95 117.00 113.38 2dog n LEU 69 Ca -0.02 -3.18 -0.37 0.00 -0.03 0.00 0.00 56.01 52.41 2dog n LEU 69 Cb 0.11 -0.70 -0.07 0.00 -2.33 0.00 0.00 43.42 40.43 2dog n LEU 69 CO 0.35 0.79 -0.09 -0.69 -1.33 0.00 0.00 177.39 176.42 2dog s VAL 70 N -2.95 5.36 0.00 4.08 1.01 -0.38 -4.28 120.40 123.23 2dog s VAL 70 Ca 0.53 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.90 2dog s VAL 70 Cb 0.42 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2dog s VAL 70 CO 0.12 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.35 2dog n GLY 71 N 2.64 2.74 3.77 4.51 0.00 -0.99 -5.03 105.19 112.84 2dog n GLY 71 Ca -0.16 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 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 2.50 0.20 0.99 1.43 -1.26 -4.76 118.68 117.79 2dog s LEU 72 Ca 0.00 1.40 0.05 0.00 -1.03 0.00 0.00 54.13 54.55 2dog s LEU 72 Cb 0.00 -3.95 -0.03 0.00 0.03 0.00 0.00 46.19 42.24 2dog s LEU 72 CO 0.00 -2.20 0.24 -0.13 0.23 0.00 0.00 176.35 174.49 2dog s ARG 73 N -5.06 3.17 -0.07 1.70 3.00 -1.26 -1.32 118.95 119.11 2dog s ARG 73 Ca 0.62 -0.82 -0.01 0.00 0.00 0.00 0.00 55.73 55.51 2dog s ARG 73 Cb -0.16 -2.76 -0.03 0.00 0.00 0.00 0.00 34.95 31.99 2dog s ARG 73 CO 0.55 0.46 0.01 0.08 0.00 0.00 0.00 175.30 176.40 2dog s VAL 74 N -1.89 4.35 0.20 3.52 1.01 0.51 -1.11 120.40 126.99 2dog s VAL 74 Ca 0.33 -0.29 0.10 0.00 0.00 0.00 0.00 61.98 62.12 2dog s VAL 74 Cb -0.10 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2dog s VAL 74 CO 0.26 0.56 -0.14 -0.31 0.00 0.00 0.00 175.10 175.47 2dog s TYR 75 N -0.94 2.50 0.24 5.22 1.51 -0.75 -3.16 117.35 121.98 2dog s TYR 75 Ca 0.15 -0.27 0.10 0.00 -1.01 0.00 0.00 57.07 56.04 2dog s TYR 75 Cb -0.11 -1.21 -0.05 0.00 -0.11 0.00 0.00 41.96 40.48 2dog s TYR 75 CO 0.04 0.53 -0.18 0.00 -1.11 0.00 0.00 175.55 174.83 2dog s ALA 76 N -1.80 2.44 -0.25 3.71 0.00 0.96 -2.86 121.76 123.95 2dog s ALA 76 Ca 0.24 -1.77 0.02 0.00 0.00 0.00 0.00 51.96 50.46 2dog s ALA 76 Cb -0.08 -0.20 0.06 0.00 0.00 0.00 0.00 23.12 22.90 2dog s ALA 76 CO 0.14 0.21 -0.08 -2.00 0.00 0.00 0.00 175.76 174.03 2dog s GLU 77 N -3.46 1.94 0.46 0.00 2.12 -1.26 -1.78 118.70 116.71 2dog s GLU 77 Ca 0.26 -1.17 0.30 0.00 0.36 0.00 0.00 54.97 54.72 2dog s GLU 77 Cb -0.04 -2.74 1.40 0.00 0.26 0.00 0.00 34.13 33.01 2dog s GLU 77 CO 0.11 -0.58 1.68 0.28 -0.54 0.00 0.00 175.26 176.21 2dog h VAL 78 N 6.72 0.25 -1.65 3.70 2.07 -1.95 0.10 116.25 125.49 2dog h VAL 78 Ca -0.18 -0.05 0.51 0.00 0.82 0.00 0.00 66.70 67.80 2dog h VAL 78 Cb 1.06 0.10 -0.10 0.00 -1.52 0.00 0.00 31.29 30.82 2dog h VAL 78 CO 0.44 0.03 1.14 0.00 0.02 0.00 0.00 177.57 179.19 2dog n ALA 79 N -2.59 1.60 -0.04 1.67 0.00 -1.26 0.81 120.51 120.69 2dog n ALA 79 Ca 0.33 0.73 -0.20 0.00 0.00 0.00 0.00 53.44 54.31 2dog n ALA 79 Cb 1.33 -1.07 -0.13 0.00 0.00 0.00 0.00 19.45 19.58 2dog n ALA 79 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2dog n ASP 80 N -4.22 1.99 -3.80 0.00 2.03 0.36 -4.98 116.55 107.93 2dog n ASP 80 Ca 0.41 0.10 -0.35 0.00 0.52 0.00 0.00 54.79 55.47 2dog n ASP 80 Cb 1.75 -0.65 0.01 0.00 -0.72 0.00 0.00 41.12 41.52 2dog n ASP 80 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2dog n LEU 81 N -3.38 -3.54 -4.77 -2.67 4.77 0.24 -4.89 117.00 102.76 2dog n LEU 81 Ca -0.36 0.54 -0.31 0.00 -0.03 0.00 0.00 56.01 55.85 2dog n LEU 81 Cb 1.03 -0.76 0.09 0.00 -2.33 0.00 0.00 43.42 41.46 2dog n LEU 81 CO 0.37 -4.44 0.70 -2.16 -1.33 0.00 0.00 177.39 170.53 2dog s PRO 82 N -1.01 2.25 1.20 3.23 0.04 -1.26 -5.01 135.00 134.44 2dog s PRO 82 Ca 0.50 1.18 -0.19 0.00 0.04 0.00 0.00 61.00 62.52 2dog s PRO 82 Cb -0.42 -1.90 0.28 0.00 0.04 0.00 0.00 34.50 32.51 2dog s PRO 82 CO 0.61 -1.65 1.11 -1.25 0.04 0.00 0.00 177.00 175.86 2dog s PRO 83 N -4.89 -1.20 0.64 0.56 0.04 -1.26 -4.83 135.00 124.05 2dog s PRO 83 Ca 0.61 -0.06 0.23 0.00 0.04 0.00 0.00 61.00 61.82 2dog s PRO 83 Cb -0.17 -1.60 1.13 0.00 0.04 0.00 0.00 34.50 33.90 2dog s PRO 83 CO 0.56 -3.70 1.62 1.37 0.04 0.00 0.00 177.00 176.89 2dog h LEU 84 N -2.57 0.00 -1.04 -3.56 8.10 -2.05 -3.56 115.31 110.63 2dog h LEU 84 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.54 2dog h LEU 84 Cb 1.29 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.51 2dog h LEU 84 CO 0.35 0.00 0.00 -1.84 -4.11 0.00 0.00 178.44 172.84