#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dls s SER 2 N 0.00 4.26 -0.11 1.61 0.15 -1.26 -5.10 113.70 113.25 2dls s SER 2 Ca 0.00 -0.61 0.03 0.00 0.70 0.00 0.00 55.95 56.07 2dls s SER 2 Cb 0.00 -1.70 -0.00 0.00 -1.71 0.00 0.00 66.02 62.61 2dls s SER 2 CO 0.00 -0.07 -0.21 -0.94 1.20 0.00 0.00 173.24 173.21 2dls s SER 3 N 1.41 3.28 -0.43 5.45 1.04 -1.26 -5.05 113.70 118.15 2dls s SER 3 Ca 0.04 -0.52 0.09 0.00 0.48 0.00 0.00 55.95 56.04 2dls s SER 3 Cb -0.15 -1.46 0.29 0.00 0.10 0.00 0.00 66.02 64.80 2dls s SER 3 CO -0.04 0.15 0.65 0.61 0.98 0.00 0.00 173.24 175.59 2dls n GLY 4 N 3.59 3.56 3.42 7.32 0.00 -1.26 -5.09 105.19 116.73 2dls n GLY 4 Ca -0.19 -1.85 -0.56 0.00 0.00 0.00 0.00 46.02 43.42 2dls n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dls n SER 5 N 0.83 1.58 -4.32 1.61 7.64 -1.26 -4.88 113.62 114.81 2dls n SER 5 Ca 0.24 0.64 -0.43 0.00 1.01 0.00 0.00 58.87 60.33 2dls n SER 5 Cb 0.55 -1.09 -0.08 0.00 -1.01 0.00 0.00 64.21 62.58 2dls n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dls s SER 6 N 6.10 5.97 0.00 6.43 0.15 -1.26 -4.99 113.70 126.10 2dls s SER 6 Ca 1.12 -1.51 0.00 0.00 0.70 0.00 0.00 55.95 56.26 2dls s SER 6 Cb -1.17 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 61.03 2dls s SER 6 CO 0.59 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.99 2dls n GLY 7 N 5.10 1.50 3.12 9.45 0.00 -1.26 -5.08 105.19 118.02 2dls n GLY 7 Ca -0.12 -0.57 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 2dls n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dls s VAL 8 N -2.01 1.67 0.29 1.61 0.11 -1.26 -5.04 120.40 115.77 2dls s VAL 8 Ca 0.00 -0.78 -0.25 0.00 -2.93 0.00 0.00 61.98 58.02 2dls s VAL 8 Cb 0.00 -1.49 -0.09 0.00 -1.53 0.00 0.00 36.38 33.27 2dls s VAL 8 CO 0.00 0.47 0.90 0.00 -3.33 0.00 0.00 175.10 173.14 2dls s GLN 9 N 0.66 4.56 0.40 1.54 -2.07 -1.26 -4.02 119.66 119.47 2dls s GLN 9 Ca -0.13 1.26 0.07 0.00 -1.82 0.00 0.00 55.36 54.74 2dls s GLN 9 Cb -0.16 -2.88 -0.06 0.00 -1.09 0.00 0.00 33.01 28.81 2dls s GLN 9 CO 0.03 0.34 0.09 0.50 -1.32 0.00 0.00 175.29 174.94 2dls s ARG 10 N -1.91 2.10 -0.11 9.60 3.52 -0.23 -4.98 118.95 126.94 2dls s ARG 10 Ca 0.47 -1.94 0.02 0.00 -0.13 0.00 0.00 55.73 54.15 2dls s ARG 10 Cb -0.19 -1.84 -0.01 0.00 -1.56 0.00 0.00 34.95 31.35 2dls s ARG 10 CO 0.24 -0.06 -0.17 0.00 -0.81 0.00 0.00 175.30 174.49 2dls s VAL 12 N 0.28 0.62 -0.12 0.00 0.11 -0.58 -5.02 120.40 115.69 2dls s VAL 12 Ca -0.12 -0.29 0.03 0.00 -2.93 0.00 0.00 61.98 58.67 2dls s VAL 12 Cb -0.16 -0.56 0.01 0.00 -1.53 0.00 0.00 36.38 34.14 2dls s VAL 12 CO 0.07 0.20 -0.21 -0.63 -3.33 0.00 0.00 175.10 171.20 2dls s ILE 13 N 0.15 1.88 -0.08 7.04 1.01 -1.26 -1.15 121.20 128.79 2dls s ILE 13 Ca -0.02 -0.89 0.05 0.00 0.00 0.00 0.00 60.65 59.79 2dls s ILE 13 Cb -0.07 -1.66 -0.00 0.00 0.01 0.00 0.00 42.46 40.74 2dls s ILE 13 CO 0.00 0.52 -0.24 -0.63 0.00 0.00 0.00 174.94 174.59 2dls s ILE 14 N 0.69 1.98 -0.18 2.92 1.01 -1.11 -4.92 121.20 121.58 2dls s ILE 14 Ca -0.11 -1.00 -0.02 0.00 0.00 0.00 0.00 60.65 59.52 2dls s ILE 14 Cb -0.16 -1.69 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 2dls s ILE 14 CO 0.02 0.55 -0.09 0.00 0.00 0.00 0.00 174.94 175.42 2dls s GLN 15 N 0.11 3.34 0.35 2.79 -2.07 -1.26 -1.97 119.66 120.96 2dls s GLN 15 Ca -0.11 -0.67 -0.15 0.00 -1.82 0.00 0.00 55.36 52.61 2dls s GLN 15 Cb -0.16 -2.83 -0.12 0.00 -1.09 0.00 0.00 33.01 28.81 2dls s GLN 15 CO 0.06 -0.06 -0.02 0.36 -1.32 0.00 0.00 175.29 174.31 2dls n LYS 16 N 4.33 0.00 0.00 9.60 2.85 -1.22 -4.92 118.16 128.80 2dls n LYS 16 Ca -0.18 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.08 2dls n LYS 16 Cb 0.51 -0.77 0.00 0.00 -0.65 0.00 0.00 35.03 34.12 2dls n LYS 16 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2dls n ASP 17 N 1.88 1.74 -3.62 -5.58 2.03 -1.16 -4.97 116.55 106.87 2dls n ASP 17 Ca 0.07 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.10 2dls n ASP 17 Cb 0.34 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.62 2dls n ASP 17 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2dls s GLN 18 N -1.74 1.37 -1.86 -0.67 2.00 -1.26 -4.89 119.66 112.61 2dls s GLN 18 Ca 0.00 -2.30 -0.22 0.00 -2.00 0.00 0.00 55.36 50.84 2dls s GLN 18 Cb 0.00 -2.19 0.22 0.00 0.80 0.00 0.00 33.01 31.84 2dls s GLN 18 CO 0.00 -1.27 0.56 0.72 -0.50 0.00 0.00 175.29 174.80 2dls n HIS 19 N 2.97 -1.18 0.00 1.67 8.25 -1.26 -4.76 115.22 120.92 2dls n HIS 19 Ca 0.19 0.69 0.00 0.00 -0.26 0.00 0.00 57.72 58.33 2dls n HIS 19 Cb 0.39 -1.95 0.00 0.00 1.12 0.00 0.00 29.99 29.56 2dls n HIS 19 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dls n GLY 20 N -1.18 2.96 0.15 -1.41 0.00 -1.26 -5.04 105.19 99.41 2dls n GLY 20 Ca 0.09 -0.90 -0.06 0.00 0.00 0.00 0.00 46.02 45.15 2dls n GLY 20 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2dls h PHE 21 N 0.00 -0.26 0.00 1.61 0.04 -1.94 -3.07 116.94 113.31 2dls h PHE 21 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2dls h PHE 21 Cb 0.00 0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.24 2dls h PHE 21 CO 0.00 -0.05 0.00 0.41 -0.60 0.00 0.00 178.31 178.07 2dls n GLY 22 N 0.93 3.64 3.77 -1.45 0.00 -1.26 -3.89 105.19 106.93 2dls n GLY 22 Ca -0.05 -0.87 -0.39 0.00 0.00 0.00 0.00 46.02 44.70 2dls n GLY 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2dls s PHE 23 N 0.00 3.89 0.20 1.61 -0.71 -1.26 -3.73 117.98 117.98 2dls s PHE 23 Ca 0.00 1.63 0.10 0.00 -1.04 0.00 0.00 56.93 57.62 2dls s PHE 23 Cb 0.00 -2.78 -0.04 0.00 -1.21 0.00 0.00 43.02 38.99 2dls s PHE 23 CO 0.00 0.49 -0.15 0.95 -1.34 0.00 0.00 175.22 175.17 2dls s THR 24 N -1.02 2.87 0.04 -4.49 -4.23 -0.21 -4.98 115.64 103.62 2dls s THR 24 Ca 0.36 -1.87 0.05 0.00 -1.18 0.00 0.00 61.69 59.06 2dls s THR 24 Cb -0.23 -2.43 -0.02 0.00 1.34 0.00 0.00 72.50 71.16 2dls s THR 24 CO 0.26 -0.16 -0.15 0.68 -0.54 0.00 0.00 174.62 174.71 2dls s VAL 25 N -1.82 1.22 -0.02 2.29 -7.23 -1.26 0.43 120.40 114.00 2dls s VAL 25 Ca 0.24 -1.06 -0.04 0.00 -1.81 0.00 0.00 61.98 59.32 2dls s VAL 25 Cb -0.08 -1.10 0.00 0.00 0.56 0.00 0.00 36.38 35.77 2dls s VAL 25 CO 0.14 0.03 0.10 -0.55 -0.31 0.00 0.00 175.10 174.51 2dls s SER 26 N -1.18 -0.03 0.00 4.85 0.15 -1.14 -4.85 113.70 111.49 2dls s SER 26 Ca 0.03 0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.69 2dls s SER 26 Cb -0.08 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 2dls s SER 26 CO 0.01 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.90 2dls n GLY 27 N 2.40 3.09 0.40 9.45 0.00 -1.26 -3.39 105.19 115.88 2dls n GLY 27 Ca -0.17 -1.17 -0.18 0.00 0.00 0.00 0.00 46.02 44.50 2dls n GLY 27 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dls n ASP 28 N 0.00 1.44 -0.06 1.61 5.75 -1.26 -3.41 116.55 120.62 2dls n ASP 28 Ca 0.00 0.18 -0.13 0.00 -0.01 0.00 0.00 54.79 54.83 2dls n ASP 28 Cb 0.00 -0.50 -0.05 0.00 -1.03 0.00 0.00 41.12 39.55 2dls n ASP 28 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 2dls n ARG 29 N -3.71 0.27 -3.54 0.11 0.63 -1.26 -3.95 116.66 105.21 2dls n ARG 29 Ca -0.35 0.11 -0.41 0.00 -0.92 0.00 0.00 57.85 56.28 2dls n ARG 29 Cb 0.76 -0.99 -0.07 0.00 0.45 0.00 0.00 32.46 32.61 2dls n ARG 29 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2dls s ILE 30 N -2.23 4.46 0.27 5.15 -1.09 -1.26 -4.56 121.20 121.94 2dls s ILE 30 Ca -0.17 -2.41 -0.29 0.00 -2.23 0.00 0.00 60.65 55.54 2dls s ILE 30 Cb 0.06 -3.86 -0.10 0.00 -1.58 0.00 0.00 42.46 36.99 2dls s ILE 30 CO 0.23 -0.89 1.28 -0.69 -1.23 0.00 0.00 174.94 173.64 2dls s VAL 31 N 0.49 3.02 0.02 2.92 1.01 -1.26 -4.73 120.40 121.87 2dls s VAL 31 Ca 0.13 0.94 -0.05 0.00 0.00 0.00 0.00 61.98 63.00 2dls s VAL 31 Cb -0.19 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 2dls s VAL 31 CO -0.04 0.19 0.07 -0.76 0.00 0.00 0.00 175.10 174.56 2dls s LEU 32 N -1.03 1.85 -0.43 3.92 1.43 -1.22 -3.40 118.68 119.79 2dls s LEU 32 Ca 0.52 -0.42 -0.27 0.00 -1.03 0.00 0.00 54.13 52.93 2dls s LEU 32 Cb -0.37 0.48 -0.05 0.00 0.03 0.00 0.00 46.19 46.28 2dls s LEU 32 CO 0.45 -0.40 2.19 -0.69 0.23 0.00 0.00 176.35 178.13 2dls s VAL 33 N -1.87 3.13 0.04 -1.59 1.01 -0.82 -2.89 120.40 117.41 2dls s VAL 33 Ca -0.11 0.10 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 2dls s VAL 33 Cb -0.06 -3.26 -0.15 0.00 0.00 0.00 0.00 36.38 32.90 2dls s VAL 33 CO -0.01 -0.23 1.36 -0.61 0.00 0.00 0.00 175.10 175.61 2dls h GLN 34 N 16.92 -0.97 -3.77 2.72 4.15 -0.36 -3.21 115.11 130.59 2dls h GLN 34 Ca -0.29 0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.11 2dls h GLN 34 Cb 1.23 0.22 -0.14 0.00 0.21 0.00 0.00 27.48 29.00 2dls h GLN 34 CO 1.11 -0.65 -0.35 -1.54 -1.93 0.00 0.00 178.83 175.47 2dls s SER 35 N -3.64 0.09 -0.18 -0.69 1.04 -1.13 -4.81 113.70 104.38 2dls s SER 35 Ca -0.15 -0.62 -0.04 0.00 0.48 0.00 0.00 55.95 55.62 2dls s SER 35 Cb 0.01 0.35 0.06 0.00 0.10 0.00 0.00 66.02 66.54 2dls s SER 35 CO 0.44 -0.73 0.07 -0.69 0.98 0.00 0.00 173.24 173.31 2dls s VAL 36 N -3.82 0.16 0.22 5.02 1.01 -1.26 -1.05 120.40 120.68 2dls s VAL 36 Ca 0.04 -0.34 -0.22 0.00 0.00 0.00 0.00 61.98 61.47 2dls s VAL 36 Cb 0.04 -0.77 -0.14 0.00 0.00 0.00 0.00 36.38 35.51 2dls s VAL 36 CO -0.11 -0.27 0.33 -1.14 0.00 0.00 0.00 175.10 173.91 2dls n ARG 37 N 5.19 0.00 -2.05 2.72 0.63 -1.24 -4.69 116.66 117.21 2dls n ARG 37 Ca -0.08 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.59 2dls n ARG 37 Cb 0.48 -0.84 -0.05 0.00 0.45 0.00 0.00 32.46 32.50 2dls n ARG 37 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2dls s PRO 38 N -0.84 2.55 0.00 -0.14 0.04 -1.26 -3.24 135.00 132.12 2dls s PRO 38 Ca 0.52 -0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.23 2dls s PRO 38 Cb -0.70 -5.07 0.00 0.00 0.04 0.00 0.00 34.50 28.76 2dls s PRO 38 CO 0.49 -3.41 0.00 0.41 0.04 0.00 0.00 177.00 174.53 2dls n GLY 39 N 6.80 0.48 0.00 0.56 0.00 -1.26 -5.08 105.19 106.68 2dls n GLY 39 Ca 0.40 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2dls n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dls n GLY 40 N -0.79 0.27 0.80 -0.02 0.00 -1.20 -5.00 105.19 99.24 2dls n GLY 40 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2dls n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dls n ALA 41 N -3.00 2.78 0.08 4.61 0.00 -1.25 -4.61 120.51 119.12 2dls n ALA 41 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 53.44 53.29 2dls n ALA 41 Cb 0.00 0.49 -0.06 0.00 0.00 0.00 0.00 19.45 19.88 2dls n ALA 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dls h ALA 42 N -0.02 -0.17 -0.26 0.00 0.00 -1.93 -2.95 119.26 113.93 2dls h ALA 42 Ca -0.01 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.94 2dls h ALA 42 Cb 1.01 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 2dls h ALA 42 CO -0.01 -0.62 -0.32 1.98 0.00 0.00 0.00 179.25 180.29 2dls h MET 43 N -0.21 -0.31 -0.81 0.00 -1.53 -1.85 -1.10 114.93 109.12 2dls h MET 43 Ca 0.01 0.02 0.14 0.00 -3.44 0.00 0.00 59.70 56.44 2dls h MET 43 Cb 0.21 0.07 -0.15 0.00 -0.55 0.00 0.00 31.60 31.19 2dls h MET 43 CO -0.05 -0.21 -0.30 0.87 0.14 0.00 0.00 176.91 177.37 2dls h LYS 44 N -0.32 -0.05 0.00 0.39 1.57 -1.78 1.01 116.57 117.39 2dls h LYS 44 Ca 0.13 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 2dls h LYS 44 Cb 0.54 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 2dls h LYS 44 CO -0.44 -0.03 -0.14 0.00 -0.57 0.00 0.00 179.45 178.27 2dls h ALA 45 N 1.45 1.66 0.00 3.86 0.00 -1.18 -3.46 119.26 121.60 2dls h ALA 45 Ca 0.33 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2dls h ALA 45 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2dls h ALA 45 CO -0.84 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.00 2dls n GLY 46 N -1.04 0.99 3.61 0.00 0.00 0.35 -5.03 105.19 104.06 2dls n GLY 46 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 2dls n GLY 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dls s VAL 47 N -1.82 3.84 0.35 1.61 1.01 -0.57 -4.97 120.40 119.85 2dls s VAL 47 Ca 0.00 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.41 2dls s VAL 47 Cb 0.00 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.78 2dls s VAL 47 CO 0.00 0.53 0.53 -0.54 0.00 0.00 0.00 175.10 175.62 2dls s LYS 48 N -1.04 1.96 0.51 2.72 1.02 -1.26 -3.88 119.74 119.78 2dls s LYS 48 Ca 0.14 -1.69 -0.21 0.00 0.02 0.00 0.00 55.97 54.23 2dls s LYS 48 Cb -0.11 0.47 -0.06 0.00 -0.52 0.00 0.00 37.83 37.61 2dls s LYS 48 CO 0.04 -0.83 1.15 -1.21 -0.92 0.00 0.00 175.35 173.57 2dls s GLU 49 N -2.95 3.49 0.00 1.68 2.02 -1.26 -3.36 118.70 118.31 2dls s GLU 49 Ca 0.28 1.69 0.00 0.00 0.02 0.00 0.00 54.97 56.95 2dls s GLU 49 Cb -0.01 -2.15 0.00 0.00 0.10 0.00 0.00 34.13 32.06 2dls s GLU 49 CO 0.19 -0.75 0.00 0.41 0.02 0.00 0.00 175.26 175.12 2dls n GLY 50 N 0.28 3.26 3.75 -1.39 0.00 -1.21 -4.96 105.19 104.92 2dls n GLY 50 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2dls n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dls s ASP 51 N -0.13 5.29 -0.08 1.61 1.01 -1.21 -4.79 116.67 118.37 2dls s ASP 51 Ca 0.00 2.53 0.03 0.00 0.71 0.00 0.00 52.55 55.82 2dls s ASP 51 Cb 0.00 -2.61 -0.02 0.00 1.01 0.00 0.00 42.92 41.30 2dls s ASP 51 CO 0.00 -1.53 -0.17 -0.60 0.21 0.00 0.00 175.17 173.08 2dls s ARG 52 N -3.09 2.82 -0.19 8.23 3.52 -1.26 -1.94 118.95 127.03 2dls s ARG 52 Ca 0.74 -0.75 -0.10 0.00 -0.13 0.00 0.00 55.73 55.49 2dls s ARG 52 Cb -0.34 -2.40 -0.05 0.00 -1.56 0.00 0.00 34.95 30.59 2dls s ARG 52 CO 0.39 0.41 0.14 0.42 -0.81 0.00 0.00 175.30 175.86 2dls s ILE 53 N -0.20 5.41 -0.16 4.11 1.01 -1.22 -3.62 121.20 126.54 2dls s ILE 53 Ca -0.01 0.22 -0.12 0.00 0.00 0.00 0.00 60.65 60.74 2dls s ILE 53 Cb -0.13 -3.48 -0.07 0.00 0.01 0.00 0.00 42.46 38.79 2dls s ILE 53 CO 0.03 0.45 -0.26 -0.38 0.00 0.00 0.00 174.94 174.78 2dls n ILE 54 N 3.45 1.27 -4.41 2.92 5.41 -0.93 -4.76 119.36 122.31 2dls n ILE 54 Ca -0.16 -0.05 -0.25 0.00 1.00 0.00 0.00 62.75 63.30 2dls n ILE 54 Cb 0.52 -1.95 -0.10 0.00 -0.71 0.00 0.00 39.64 37.40 2dls n ILE 54 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2dls s LYS 55 N -2.51 1.80 -0.23 0.38 2.20 -1.26 -1.54 119.74 118.57 2dls s LYS 55 Ca -0.25 -1.62 -0.03 0.00 -0.36 0.00 0.00 55.97 53.71 2dls s LYS 55 Cb 0.07 -1.89 0.12 0.00 -1.51 0.00 0.00 37.83 34.62 2dls s LYS 55 CO 0.34 0.36 0.36 0.08 -0.36 0.00 0.00 175.35 176.12 2dls s VAL 56 N -2.25 -0.57 -1.62 4.02 1.01 0.10 -2.78 120.40 118.32 2dls s VAL 56 Ca 0.28 -0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.19 2dls s VAL 56 Cb -0.06 -0.78 0.00 0.00 0.00 0.00 0.00 36.38 35.54 2dls s VAL 56 CO 0.15 -0.11 0.30 -3.20 0.00 0.00 0.00 175.10 172.24 2dls n ASN 57 N 5.36 -5.89 0.00 3.32 2.85 -0.87 -1.84 115.26 118.19 2dls n ASN 57 Ca -0.04 -0.15 0.00 0.00 -0.11 0.00 0.00 54.58 54.28 2dls n ASN 57 Cb 0.50 -4.81 0.00 0.00 1.24 0.00 0.00 39.78 36.71 2dls n ASN 57 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dls n GLY 58 N -1.27 2.78 3.65 8.20 0.00 -1.26 -5.01 105.19 112.28 2dls n GLY 58 Ca -0.17 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 2dls n GLY 58 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dls s THR 59 N -1.60 3.89 -1.01 2.61 2.01 -0.77 -4.93 115.64 115.84 2dls s THR 59 Ca 0.00 1.05 -0.23 0.00 0.31 0.00 0.00 61.69 62.82 2dls s THR 59 Cb 0.00 -3.79 0.02 0.00 0.01 0.00 0.00 72.50 68.74 2dls s THR 59 CO 0.00 -0.22 1.64 -0.32 -0.69 0.00 0.00 174.62 175.04 2dls s MET 60 N 4.12 3.26 -0.67 4.92 1.75 -1.26 -0.72 119.30 130.70 2dls s MET 60 Ca 0.65 -0.94 -0.18 0.00 -1.25 0.00 0.00 55.69 53.97 2dls s MET 60 Cb -0.25 -5.28 0.12 0.00 2.84 0.00 0.00 34.83 32.26 2dls s MET 60 CO 0.24 -2.64 0.79 0.14 -0.65 0.00 0.00 175.02 172.89 2dls s VAL 61 N 6.72 4.89 0.00 10.11 -7.23 -0.59 -4.74 120.40 129.56 2dls s VAL 61 Ca 0.55 -1.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 2dls s VAL 61 Cb -0.02 -4.54 0.00 0.00 0.56 0.00 0.00 36.38 32.38 2dls s VAL 61 CO -0.05 -1.19 0.00 0.35 -0.31 0.00 0.00 175.10 173.91 2dls n THR 62 N 5.35 0.00 -3.18 5.32 -2.24 -1.25 -4.48 114.28 113.80 2dls n THR 62 Ca -0.01 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.49 2dls n THR 62 Cb 0.44 -0.59 -0.06 0.00 -2.10 0.00 0.00 70.33 68.03 2dls n THR 62 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2dls n ASN 63 N -2.30 4.29 -3.18 3.42 6.94 -1.26 -4.66 115.26 118.51 2dls n ASN 63 Ca 0.00 -3.56 -0.17 0.00 -0.02 0.00 0.00 54.58 50.83 2dls n ASN 63 Cb 0.47 -0.66 -0.05 0.00 -2.36 0.00 0.00 39.78 37.18 2dls n ASN 63 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 2dls s SER 64 N -2.84 1.32 0.38 0.53 0.01 -1.26 -5.08 113.70 106.76 2dls s SER 64 Ca 0.43 -1.63 0.02 0.00 1.31 0.00 0.00 55.95 56.08 2dls s SER 64 Cb 0.20 0.65 -0.02 0.00 0.21 0.00 0.00 66.02 67.06 2dls s SER 64 CO -0.06 -1.25 0.58 -0.44 0.41 0.00 0.00 173.24 172.48 2dls s SER 65 N -3.31 6.04 0.03 2.44 0.01 -1.25 -4.25 113.70 113.40 2dls s SER 65 Ca 0.34 0.25 -0.28 0.00 1.31 0.00 0.00 55.95 57.57 2dls s SER 65 Cb 0.00 -1.67 -0.17 0.00 0.21 0.00 0.00 66.02 64.40 2dls s SER 65 CO 0.24 -0.48 1.31 -0.74 0.41 0.00 0.00 173.24 173.98 2dls h HIS 66 N 0.64 -0.75 -0.83 2.43 2.76 -1.83 -2.73 115.15 114.84 2dls h HIS 66 Ca -0.48 -0.02 0.28 0.00 -2.20 0.00 0.00 60.37 57.95 2dls h HIS 66 Cb 1.24 0.25 -0.15 0.00 1.55 0.00 0.00 27.41 30.30 2dls h HIS 66 CO 0.47 -0.42 0.20 -0.11 -1.30 0.00 0.00 177.93 176.77 2dls n LEU 67 N -5.36 0.07 0.32 0.26 0.00 -1.26 -0.27 117.00 110.75 2dls n LEU 67 Ca -0.12 1.39 -0.13 0.00 0.00 0.00 0.00 56.01 57.15 2dls n LEU 67 Cb 0.35 -0.58 -0.06 0.00 0.00 0.00 0.00 43.42 43.13 2dls n LEU 67 CO 0.32 -1.47 0.36 -0.33 0.00 0.00 0.00 177.39 176.27 2dls h GLU 68 N 0.00 -0.82 -0.96 1.96 5.08 -1.95 -3.02 114.58 114.87 2dls h GLU 68 Ca 0.59 0.06 0.28 0.00 -1.00 0.00 0.00 59.36 59.28 2dls h GLU 68 Cb 1.38 0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.78 2dls h GLU 68 CO -0.72 -0.55 0.74 0.28 -1.00 0.00 0.00 179.01 177.76 2dls h VAL 69 N -1.16 0.43 0.73 3.13 2.07 -0.33 -1.85 116.25 119.27 2dls h VAL 69 Ca -0.09 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2dls h VAL 69 Cb 0.65 0.47 0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2dls h VAL 69 CO 0.14 0.00 -0.35 0.58 0.02 0.00 0.00 177.57 177.96 2dls h VAL 70 N 0.00 0.00 -0.82 2.57 2.07 -0.55 -2.84 116.25 116.68 2dls h VAL 70 Ca 0.45 -0.03 0.20 0.00 0.82 0.00 0.00 66.70 68.14 2dls h VAL 70 Cb 1.93 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 31.57 2dls h VAL 70 CO -0.00 0.00 0.21 0.11 0.02 0.00 0.00 177.57 177.90 2dls h LYS 71 N -1.01 0.23 -0.88 1.57 6.56 -1.27 0.51 116.57 122.28 2dls h LYS 71 Ca -0.10 -0.01 0.19 0.00 -1.06 0.00 0.00 60.65 59.66 2dls h LYS 71 Cb 0.75 -0.05 -0.07 0.00 -0.57 0.00 0.00 32.23 32.29 2dls h LYS 71 CO 0.16 0.15 0.58 -0.07 -2.06 0.00 0.00 179.45 178.22 2dls h LEU 72 N 0.24 0.44 0.15 2.94 3.38 -1.41 -1.50 115.31 119.55 2dls h LEU 72 Ca 0.49 0.04 -0.20 0.00 0.09 0.00 0.00 57.88 58.30 2dls h LEU 72 Cb 0.92 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.66 2dls h LEU 72 CO -0.60 0.19 -0.88 0.40 0.09 0.00 0.00 178.44 177.65 2dls h ILE 73 N 0.45 1.49 -0.90 1.22 2.04 0.20 -3.33 117.51 118.67 2dls h ILE 73 Ca 0.46 -2.54 0.20 0.00 1.00 0.00 0.00 64.86 63.98 2dls h ILE 73 Cb 1.07 3.16 -0.17 0.00 -0.74 0.00 0.00 36.82 40.14 2dls h ILE 73 CO -0.18 0.72 -0.12 0.11 0.00 0.00 0.00 178.15 178.68 2dls h LYS 74 N -0.30 0.02 -6.22 2.37 1.79 -0.09 -3.37 116.57 110.77 2dls h LYS 74 Ca -0.15 -0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.76 2dls h LYS 74 Cb 1.69 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 32.30 2dls h LYS 74 CO 0.16 0.01 1.00 0.45 -1.08 0.00 0.00 179.45 180.00 2dls s SER 75 N -5.18 6.75 0.00 0.86 0.15 -1.07 -4.69 113.70 110.52 2dls s SER 75 Ca -0.14 1.83 0.00 0.00 0.70 0.00 0.00 55.95 58.34 2dls s SER 75 Cb 0.26 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 2dls s SER 75 CO 0.77 -0.91 0.00 0.61 1.20 0.00 0.00 173.24 174.91 2dls n GLY 76 N 3.99 1.61 0.40 9.45 0.00 -1.26 -4.90 105.19 114.48 2dls n GLY 76 Ca 0.16 -1.20 -0.07 0.00 0.00 0.00 0.00 46.02 44.91 2dls n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dls n ALA 77 N 2.63 -0.46 -2.21 4.61 0.00 -1.26 -4.58 120.51 119.24 2dls n ALA 77 Ca 0.00 0.88 -0.22 0.00 0.00 0.00 0.00 53.44 54.09 2dls n ALA 77 Cb 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 19.45 19.23 2dls n ALA 77 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2dls s TYR 78 N -5.63 1.82 -0.09 0.00 1.13 -1.26 -3.40 117.35 109.92 2dls s TYR 78 Ca -0.12 -0.71 -0.07 0.00 -1.41 0.00 0.00 57.07 54.75 2dls s TYR 78 Cb 0.14 -2.10 0.03 0.00 -1.10 0.00 0.00 41.96 38.93 2dls s TYR 78 CO 0.64 -0.65 0.23 0.54 -2.51 0.00 0.00 175.55 173.80 2dls s VAL 79 N -2.65 -0.01 -0.44 -3.49 0.11 -0.83 -4.97 120.40 108.12 2dls s VAL 79 Ca 0.48 0.03 -0.17 0.00 -2.93 0.00 0.00 61.98 59.38 2dls s VAL 79 Cb -0.04 -0.34 0.03 0.00 -1.53 0.00 0.00 36.38 34.50 2dls s VAL 79 CO 0.29 0.01 0.45 0.00 -3.33 0.00 0.00 175.10 172.53 2dls s ALA 80 N 0.34 3.44 0.04 1.54 0.00 -1.26 -2.74 121.76 123.11 2dls s ALA 80 Ca -0.02 -1.62 0.03 0.00 0.00 0.00 0.00 51.96 50.36 2dls s ALA 80 Cb -0.03 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.96 2dls s ALA 80 CO -0.01 -1.65 0.01 -0.51 0.00 0.00 0.00 175.76 173.59 2dls s LEU 81 N 2.12 3.51 -0.40 0.00 1.43 -0.30 -2.05 118.68 123.00 2dls s LEU 81 Ca 0.11 -0.08 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 2dls s LEU 81 Cb -0.18 -2.13 0.10 0.00 0.03 0.00 0.00 46.19 44.01 2dls s LEU 81 CO 0.12 0.23 0.20 -0.89 0.23 0.00 0.00 176.35 176.24 2dls s THR 82 N -1.21 3.38 -0.15 5.49 2.01 -1.12 -1.53 115.64 122.51 2dls s THR 82 Ca 0.23 -1.93 -0.07 0.00 0.31 0.00 0.00 61.69 60.24 2dls s THR 82 Cb -0.12 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 2dls s THR 82 CO 0.15 -0.62 0.09 -0.76 -0.69 0.00 0.00 174.62 172.78 2dls s LEU 83 N 1.19 4.04 -0.11 4.42 1.43 -1.06 -2.18 118.68 126.40 2dls s LEU 83 Ca 0.06 0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.42 2dls s LEU 83 Cb -0.23 -2.00 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 2dls s LEU 83 CO -0.03 0.28 -0.16 -0.22 0.23 0.00 0.00 176.35 176.46 2dls s LEU 84 N -0.28 2.58 0.00 1.79 0.20 -1.24 -1.07 118.68 120.66 2dls s LEU 84 Ca 0.09 -0.36 0.00 0.00 0.69 0.00 0.00 54.13 54.55 2dls s LEU 84 Cb -0.12 -1.56 0.00 0.00 -0.43 0.00 0.00 46.19 44.08 2dls s LEU 84 CO 0.01 0.19 0.00 0.61 -0.29 0.00 0.00 176.35 176.87 2dls n GLY 85 N 3.36 -2.57 3.45 7.98 0.00 -1.26 -4.57 105.19 111.58 2dls n GLY 85 Ca -0.18 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 2dls n GLY 85 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dls s SER 86 N 0.00 4.78 0.44 1.61 1.04 -1.26 -4.88 113.70 115.44 2dls s SER 86 Ca 0.00 -0.20 -0.24 0.00 0.48 0.00 0.00 55.95 55.99 2dls s SER 86 Cb 0.00 -1.81 -0.10 0.00 0.10 0.00 0.00 66.02 64.21 2dls s SER 86 CO 0.00 0.08 1.02 -1.20 0.98 0.00 0.00 173.24 174.12 2dls n SER 87 N 4.13 1.28 0.03 7.02 7.64 -1.26 -4.95 113.62 127.52 2dls n SER 87 Ca -0.17 1.01 -0.07 0.00 1.01 0.00 0.00 58.87 60.65 2dls n SER 87 Cb 0.52 -1.37 -0.05 0.00 -1.01 0.00 0.00 64.21 62.31 2dls n SER 87 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dls h SER 88 N 1.46 -0.17 0.00 6.43 0.87 -2.02 -3.49 113.55 116.63 2dls h SER 88 Ca -0.45 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 59.90 2dls h SER 88 Cb 1.34 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 2dls h SER 88 CO 0.56 0.39 0.00 0.61 -0.53 0.00 0.00 176.83 177.86 2dls n GLY 89 N 1.10 2.35 3.64 5.77 0.00 -1.26 -5.07 105.19 111.72 2dls n GLY 89 Ca -0.05 -0.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.95 2dls n GLY 89 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dls s PRO 90 N 0.00 -0.25 0.82 1.61 0.04 -1.26 -5.00 135.00 130.96 2dls s PRO 90 Ca 0.00 0.29 -0.13 0.00 0.04 0.00 0.00 61.00 61.20 2dls s PRO 90 Cb 0.00 -1.68 0.09 0.00 0.04 0.00 0.00 34.50 32.95 2dls s PRO 90 CO 0.00 -3.14 1.19 -1.54 0.04 0.00 0.00 177.00 173.55 2dls s SER 91 N -3.60 3.54 1.09 6.66 1.04 -1.26 -4.99 113.70 116.18 2dls s SER 91 Ca 0.67 2.30 -0.14 0.00 0.48 0.00 0.00 55.95 59.26 2dls s SER 91 Cb -0.16 -2.58 0.24 0.00 0.10 0.00 0.00 66.02 63.62 2dls s SER 91 CO 0.57 -2.70 1.08 -0.94 0.98 0.00 0.00 173.24 172.24 2dls s SER 92 N -2.32 1.80 0.00 7.02 1.04 -1.26 -5.18 113.70 114.81 2dls s SER 92 Ca 0.71 1.07 0.00 0.00 0.48 0.00 0.00 55.95 58.21 2dls s SER 92 Cb -0.27 -1.65 0.00 0.00 0.10 0.00 0.00 66.02 64.20 2dls s SER 92 CO 0.52 -3.63 0.00 0.61 0.98 0.00 0.00 173.24 171.72