#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2abd s GLN 2 N 0.00 3.79 0.00 4.33 2.00 -1.26 -4.91 119.66 123.61 2abd s GLN 2 Ca 0.00 -0.42 0.00 0.00 -2.00 0.00 0.00 55.36 52.94 2abd s GLN 2 Cb 0.00 -3.33 0.00 0.00 0.80 0.00 0.00 33.01 30.48 2abd s GLN 2 CO 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 175.29 174.75 2abd n ALA 3 N 4.50 0.00 -0.27 1.58 0.00 -1.26 -4.93 120.51 120.13 2abd n ALA 3 Ca -0.16 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.38 2abd n ALA 3 Cb 0.52 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.28 2abd n ALA 3 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2abd n GLU 4 N 0.00 2.86 -0.35 0.00 0.28 -1.26 -4.56 120.64 117.61 2abd n GLU 4 Ca 0.00 -2.54 0.06 0.00 -0.16 0.00 0.00 57.16 54.52 2abd n GLU 4 Cb 0.00 -1.62 0.13 0.00 1.43 0.00 0.00 31.44 31.38 2abd n GLU 4 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2abd n PHE 5 N 1.39 0.34 0.24 -1.84 -0.00 -1.26 0.20 117.46 116.53 2abd n PHE 5 Ca 0.23 1.18 0.07 0.00 -0.00 0.00 0.00 57.45 58.94 2abd n PHE 5 Cb 0.65 -1.06 0.57 0.00 -0.00 0.00 0.00 39.48 39.65 2abd n PHE 5 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 2abd h ASP 6 N 0.00 0.00 -0.05 -2.13 3.32 -1.97 0.35 116.42 115.94 2abd h ASP 6 Ca 0.46 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.49 2abd h ASP 6 Cb 0.70 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.25 2abd h ASP 6 CO -1.00 0.14 -0.06 0.50 -1.72 0.00 0.00 179.24 177.10 2abd h LYS 7 N 0.00 0.13 0.09 3.56 3.11 0.19 0.46 116.57 124.11 2abd h LYS 7 Ca -0.00 -0.07 0.02 0.00 -2.81 0.00 0.00 60.65 57.79 2abd h LYS 7 Cb 0.27 0.01 -0.05 0.00 -1.00 0.00 0.00 32.23 31.46 2abd h LYS 7 CO 0.02 0.61 -0.46 0.00 -2.81 0.00 0.00 179.45 176.81 2abd h ALA 8 N 0.51 -0.82 -0.10 5.00 0.00 0.13 0.27 119.26 124.25 2abd h ALA 8 Ca 0.01 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.87 2abd h ALA 8 Cb 0.60 0.79 -0.06 0.00 0.00 0.00 0.00 17.79 19.11 2abd h ALA 8 CO 0.01 -1.03 -0.51 0.00 0.00 0.00 0.00 179.25 177.72 2abd h ALA 9 N -0.27 -0.83 -0.82 0.00 0.00 -0.29 0.37 119.26 117.41 2abd h ALA 9 Ca 0.02 -0.05 0.20 0.00 0.00 0.00 0.00 54.91 55.08 2abd h ALA 9 Cb 0.71 0.94 -0.14 0.00 0.00 0.00 0.00 17.79 19.30 2abd h ALA 9 CO -0.28 -1.06 0.06 1.49 0.00 0.00 0.00 179.25 179.46 2abd h GLU 10 N -0.59 0.11 -0.01 0.00 4.81 0.53 -1.94 114.58 117.50 2abd h GLU 10 Ca 0.04 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 2abd h GLU 10 Cb 0.68 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.04 2abd h GLU 10 CO -0.41 0.08 -0.14 0.93 -0.73 0.00 0.00 179.01 178.73 2abd h GLU 11 N 0.12 0.12 -0.51 1.92 5.08 0.30 -3.32 114.58 118.27 2abd h GLU 11 Ca 0.47 -0.11 0.10 0.00 -1.00 0.00 0.00 59.36 58.83 2abd h GLU 11 Cb 0.89 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 30.07 2abd h GLU 11 CO -0.70 0.83 -0.13 -0.24 -1.00 0.00 0.00 179.01 177.77 2abd h VAL 12 N -0.56 0.49 0.00 3.13 3.04 0.29 0.89 116.25 123.53 2abd h VAL 12 Ca -0.02 -0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.67 2abd h VAL 12 Cb 0.87 0.49 0.00 0.00 -2.01 0.00 0.00 31.29 30.64 2abd h VAL 12 CO 0.03 0.00 0.54 0.11 -1.01 0.00 0.00 177.57 177.24 2abd h LYS 13 N 0.00 0.00 -0.05 4.17 1.57 -1.47 -0.16 116.57 120.63 2abd h LYS 13 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2abd h LYS 13 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2abd h LYS 13 CO -0.53 0.00 0.00 0.72 -0.57 0.00 0.00 179.45 179.07 2abd n HIS 14 N -2.56 0.05 -1.62 -1.35 8.25 0.29 -5.04 115.22 113.24 2abd n HIS 14 Ca -0.01 -0.06 -0.56 0.00 -0.26 0.00 0.00 57.72 56.83 2abd n HIS 14 Cb 0.56 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.60 2abd n HIS 14 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2abd n LEU 15 N 0.61 1.50 -0.23 2.41 4.77 -0.07 -4.71 117.00 121.27 2abd n LEU 15 Ca 0.07 1.12 0.22 0.00 -0.03 0.00 0.00 56.01 57.39 2abd n LEU 15 Cb 0.29 -1.10 0.41 0.00 -2.33 0.00 0.00 43.42 40.70 2abd n LEU 15 CO 0.07 -1.02 0.75 0.29 -1.33 0.00 0.00 177.39 176.16 2abd n LYS 16 N 3.25 -0.04 -4.26 3.23 4.76 0.14 -3.92 118.16 121.31 2abd n LYS 16 Ca 0.22 1.01 -0.28 0.00 -2.87 0.00 0.00 58.31 56.39 2abd n LYS 16 Cb 0.13 -1.79 -0.10 0.00 -1.84 0.00 0.00 35.03 31.43 2abd n LYS 16 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2abd s THR 17 N -5.14 3.27 -0.44 -0.18 2.01 -1.17 -5.04 115.64 108.94 2abd s THR 17 Ca -0.07 -1.48 -0.24 0.00 0.31 0.00 0.00 61.69 60.21 2abd s THR 17 Cb 0.24 -2.58 0.02 0.00 0.01 0.00 0.00 72.50 70.20 2abd s THR 17 CO 0.56 -0.01 0.86 -0.75 -0.69 0.00 0.00 174.62 174.60 2abd s LYS 18 N -2.54 3.53 0.54 4.92 2.20 -1.25 -4.77 119.74 122.36 2abd s LYS 18 Ca 0.23 0.10 -0.20 0.00 -0.36 0.00 0.00 55.97 55.74 2abd s LYS 18 Cb -0.10 -3.91 -0.07 0.00 -1.51 0.00 0.00 37.83 32.24 2abd s LYS 18 CO 0.14 -1.13 0.90 -2.30 -0.36 0.00 0.00 175.35 172.60 2abd n PRO 19 N 6.90 0.97 -0.81 4.03 -0.02 -1.26 -4.91 135.00 139.89 2abd n PRO 19 Ca 0.04 0.36 -0.31 0.00 -2.02 0.00 0.00 63.50 61.58 2abd n PRO 19 Cb 0.48 -2.04 0.15 0.00 -0.02 0.00 0.00 33.50 32.07 2abd n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2abd s ALA 20 N -1.48 1.62 0.07 3.55 0.00 -1.26 -4.60 121.76 119.67 2abd s ALA 20 Ca 0.71 0.54 -0.16 0.00 0.00 0.00 0.00 51.96 53.05 2abd s ALA 20 Cb -0.46 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.19 2abd s ALA 20 CO 0.51 -2.57 1.27 0.22 0.00 0.00 0.00 175.76 175.19 2abd h ASP 21 N -1.72 -1.00 -0.90 0.00 3.58 -1.96 0.02 116.42 114.44 2abd h ASP 21 Ca -0.43 0.14 0.22 0.00 0.42 0.00 0.00 57.03 57.38 2abd h ASP 21 Cb 1.26 0.43 -0.16 0.00 1.72 0.00 0.00 39.33 42.58 2abd h ASP 21 CO 0.43 -0.16 -0.02 -0.33 -2.88 0.00 0.00 179.24 176.28 2abd h GLU 22 N -0.11 0.05 -0.46 0.28 3.07 -1.99 0.54 114.58 115.96 2abd h GLU 22 Ca 0.06 -0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.83 2abd h GLU 22 Cb 0.26 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 2abd h GLU 22 CO -0.38 0.03 -0.05 0.93 -1.40 0.00 0.00 179.01 178.14 2abd h GLU 23 N 0.05 0.85 -0.76 2.33 5.08 -1.38 -2.62 114.58 118.12 2abd h GLU 23 Ca 0.51 -0.30 -0.04 0.00 -1.00 0.00 0.00 59.36 58.53 2abd h GLU 23 Cb 0.95 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 2abd h GLU 23 CO -0.83 0.92 0.33 0.52 -1.00 0.00 0.00 179.01 178.95 2abd h MET 24 N 0.69 1.12 -0.79 2.33 2.86 0.80 -3.10 114.93 118.83 2abd h MET 24 Ca 0.12 -0.18 0.15 0.00 -2.06 0.00 0.00 59.70 57.73 2abd h MET 24 Cb 0.58 -0.19 -0.15 0.00 0.06 0.00 0.00 31.60 31.90 2abd h MET 24 CO 0.03 0.89 -0.26 -0.07 1.06 0.00 0.00 176.91 178.56 2abd h LEU 25 N 1.10 -0.95 -0.00 1.22 3.38 0.31 0.24 115.31 120.62 2abd h LEU 25 Ca 0.26 0.25 0.02 0.00 0.09 0.00 0.00 57.88 58.50 2abd h LEU 25 Cb 0.17 0.56 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 2abd h LEU 25 CO -0.03 -0.28 -0.45 0.15 0.09 0.00 0.00 178.44 177.93 2abd h PHE 26 N -0.04 -1.31 0.08 1.13 3.57 -1.51 0.42 116.94 119.28 2abd h PHE 26 Ca 0.35 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.90 2abd h PHE 26 Cb 0.59 0.57 -0.05 0.00 2.79 0.00 0.00 35.95 39.85 2abd h PHE 26 CO -0.67 -0.48 -0.50 0.82 -2.23 0.00 0.00 178.31 175.25 2abd h ILE 27 N -0.56 0.00 -0.05 1.41 5.03 -1.45 -1.57 117.51 120.32 2abd h ILE 27 Ca 0.01 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.77 2abd h ILE 27 Cb 0.60 0.00 -0.06 0.00 -3.03 0.00 0.00 36.82 34.33 2abd h ILE 27 CO -0.30 0.00 -0.53 0.22 -0.68 0.00 0.00 178.15 176.86 2abd h TYR 28 N -0.69 -1.56 -0.13 1.37 3.20 -0.24 0.84 116.97 119.76 2abd h TYR 28 Ca -0.00 0.05 0.04 0.00 3.14 0.00 0.00 58.73 61.96 2abd h TYR 28 Cb 0.70 0.69 -0.07 0.00 1.54 0.00 0.00 36.73 39.60 2abd h TYR 28 CO -0.47 -0.55 -0.50 0.66 -1.64 0.00 0.00 178.16 175.66 2abd h SER 29 N -0.63 -1.59 -0.35 -2.11 4.64 -0.06 0.29 113.55 113.75 2abd h SER 29 Ca 0.02 0.20 -0.06 0.00 -0.47 0.00 0.00 61.79 61.47 2abd h SER 29 Cb 0.69 0.63 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 2abd h SER 29 CO -0.38 -0.47 -0.04 0.45 -0.87 0.00 0.00 176.83 175.53 2abd h HIS 30 N -0.56 0.71 -0.03 4.77 3.86 -1.17 -1.19 115.15 121.54 2abd h HIS 30 Ca 0.05 -0.14 0.01 0.00 -1.16 0.00 0.00 60.37 59.13 2abd h HIS 30 Cb 0.67 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 2abd h HIS 30 CO -0.55 0.77 -0.20 -0.92 0.86 0.00 0.00 177.93 177.89 2abd h TYR 31 N 0.44 -0.58 -0.58 2.45 3.20 0.12 0.27 116.97 122.29 2abd h TYR 31 Ca 0.09 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.10 2abd h TYR 31 Cb 0.51 0.26 -0.11 0.00 1.54 0.00 0.00 36.73 38.93 2abd h TYR 31 CO 0.04 -0.20 -0.22 0.87 -1.64 0.00 0.00 178.16 177.02 2abd h LYS 32 N -0.22 -0.07 -0.20 1.82 1.79 -0.44 0.33 116.57 119.57 2abd h LYS 32 Ca 0.01 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.53 2abd h LYS 32 Cb 0.25 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.87 2abd h LYS 32 CO -0.15 -0.05 -0.12 1.96 -1.08 0.00 0.00 179.45 180.02 2abd h GLN 33 N -0.07 -0.10 -0.17 3.15 1.08 0.09 0.48 115.11 119.56 2abd h GLN 33 Ca 0.27 0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.41 2abd h GLN 33 Cb 0.49 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 2abd h GLN 33 CO -0.63 -0.07 -0.16 0.00 -0.95 0.00 0.00 178.83 177.02 2abd h ALA 34 N 1.06 1.41 0.00 3.87 0.00 0.69 -2.52 119.26 123.77 2abd h ALA 34 Ca 0.11 -0.24 -0.30 0.00 0.00 0.00 0.00 54.91 54.48 2abd h ALA 34 Cb 0.27 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 2abd h ALA 34 CO -0.27 0.41 -2.15 0.25 0.00 0.00 0.00 179.25 177.50 2abd n THR 35 N -4.23 1.15 -0.12 0.00 -2.24 0.11 -4.80 114.28 104.15 2abd n THR 35 Ca -0.01 -0.52 -0.22 0.00 -2.27 0.00 0.00 64.05 61.03 2abd n THR 35 Cb 0.30 -1.02 -0.07 0.00 -2.10 0.00 0.00 70.33 67.45 2abd n THR 35 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2abd n VAL 36 N -2.94 1.46 0.00 2.28 0.31 0.13 -5.05 118.33 114.53 2abd n VAL 36 Ca -0.33 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 2abd n VAL 36 Cb 0.93 -2.00 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 2abd n VAL 36 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2abd n GLY 37 N 1.42 0.20 3.57 2.92 0.00 0.73 -4.99 105.19 109.04 2abd n GLY 37 Ca -0.40 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 43.42 2abd n GLY 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2abd s ASP 38 N -4.00 5.51 0.00 1.61 1.11 -1.26 -3.39 116.67 116.25 2abd s ASP 38 Ca 0.00 0.62 0.00 0.00 0.18 0.00 0.00 52.55 53.35 2abd s ASP 38 Cb 0.00 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.46 2abd s ASP 38 CO 0.00 -2.14 0.00 0.00 1.18 0.00 0.00 175.17 174.21 2abd n ILE 39 N 7.25 0.00 -2.15 0.77 3.06 -1.26 -4.82 119.36 122.21 2abd n ILE 39 Ca 0.21 0.00 -0.25 0.00 -2.50 0.00 0.00 62.75 60.21 2abd n ILE 39 Cb 0.50 0.00 0.01 0.00 0.54 0.00 0.00 39.64 40.70 2abd n ILE 39 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 2abd n ASN 40 N 0.00 4.88 -0.02 9.51 6.94 -1.26 -4.62 115.26 130.69 2abd n ASN 40 Ca 0.00 -3.74 -0.07 0.00 -0.02 0.00 0.00 54.58 50.75 2abd n ASN 40 Cb 0.00 -0.38 -0.02 0.00 -2.36 0.00 0.00 39.78 37.02 2abd n ASN 40 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2abd n THR 41 N -0.64 0.86 0.00 5.53 -2.24 -1.26 -5.14 114.28 111.38 2abd n THR 41 Ca 0.43 0.07 0.00 0.00 -2.27 0.00 0.00 64.05 62.28 2abd n THR 41 Cb 0.88 -1.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.39 2abd n THR 41 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2abd n GLU 42 N -3.58 0.00 -2.63 -0.78 1.02 -1.26 -5.06 120.64 108.34 2abd n GLU 42 Ca -0.12 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.59 2abd n GLU 42 Cb 0.42 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.82 2abd n GLU 42 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2abd s ARG 43 N -3.51 4.31 0.74 3.49 3.52 -1.26 -4.96 118.95 121.27 2abd s ARG 43 Ca 0.00 1.42 -0.10 0.00 -0.13 0.00 0.00 55.73 56.92 2abd s ARG 43 Cb 0.00 -3.62 -0.02 0.00 -1.56 0.00 0.00 34.95 29.75 2abd s ARG 43 CO 0.00 -0.53 -0.35 -2.30 -0.81 0.00 0.00 175.30 171.31 2abd n PRO 44 N 5.89 -0.44 -2.73 5.12 -0.02 -1.26 -5.01 135.00 136.55 2abd n PRO 44 Ca 0.11 -0.13 -0.22 0.00 -2.02 0.00 0.00 63.50 61.24 2abd n PRO 44 Cb 0.47 -1.10 0.09 0.00 -0.02 0.00 0.00 33.50 32.94 2abd n PRO 44 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2abd s GLY 45 N -1.19 1.75 0.00 -1.23 0.00 -1.26 -4.90 107.32 100.49 2abd s GLY 45 Ca 0.17 -1.85 0.00 0.00 0.00 0.00 0.00 44.72 43.04 2abd s GLY 45 CO 0.25 -1.32 0.00 1.03 0.00 0.00 0.00 173.10 173.06 2abd n MET 46 N -2.65 0.00 -1.34 2.90 2.81 -1.26 -0.56 117.12 117.03 2abd n MET 46 Ca 0.15 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.78 2abd n MET 46 Cb 0.61 0.00 -0.08 0.00 -0.71 0.00 0.00 33.22 33.03 2abd n MET 46 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2abd n LEU 47 N -2.64 6.81 -2.52 4.03 4.32 -1.26 -4.93 117.00 120.80 2abd n LEU 47 Ca 0.00 -3.94 -0.09 0.00 -0.02 0.00 0.00 56.01 51.97 2abd n LEU 47 Cb 0.00 -1.40 -0.09 0.00 -1.62 0.00 0.00 43.42 40.31 2abd n LEU 47 CO 0.00 1.85 1.01 0.47 -1.22 0.00 0.00 177.39 179.50 2abd n ASP 48 N 2.26 -0.96 -2.40 -1.43 8.00 0.28 -4.90 116.55 117.40 2abd n ASP 48 Ca 0.56 -0.48 0.00 0.00 0.71 0.00 0.00 54.79 55.58 2abd n ASP 48 Cb 0.57 -0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 2abd n ASP 48 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2abd n PHE 49 N 3.01 -2.00 -1.24 1.24 3.72 -1.26 -4.81 117.46 116.12 2abd n PHE 49 Ca 0.27 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.41 2abd n PHE 49 Cb 0.15 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.59 2abd n PHE 49 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2abd n LYS 50 N -0.51 2.87 0.07 -1.08 5.02 -1.26 -2.33 118.16 120.95 2abd n LYS 50 Ca 0.00 -1.77 0.00 0.00 -2.02 0.00 0.00 58.31 54.52 2abd n LYS 50 Cb 0.00 -2.36 0.00 0.00 -0.02 0.00 0.00 35.03 32.65 2abd n LYS 50 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2abd n GLY 51 N 2.67 -0.14 0.47 0.72 0.00 -1.26 -4.73 105.19 102.92 2abd n GLY 51 Ca 0.58 0.00 0.30 0.00 0.00 0.00 0.00 46.02 46.90 2abd n GLY 51 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2abd h LYS 52 N 0.00 0.17 -0.14 1.61 3.11 -1.78 0.17 116.57 119.71 2abd h LYS 52 Ca 0.00 -0.01 0.04 0.00 -2.81 0.00 0.00 60.65 57.87 2abd h LYS 52 Cb 0.00 -0.04 -0.05 0.00 -1.00 0.00 0.00 32.23 31.14 2abd h LYS 52 CO 0.00 0.11 -0.15 0.00 -2.81 0.00 0.00 179.45 176.61 2abd h ALA 53 N 1.51 -0.05 -0.54 5.00 0.00 -1.85 0.46 119.26 123.79 2abd h ALA 53 Ca 0.60 0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.68 2abd h ALA 53 Cb 1.97 0.30 -0.10 0.00 0.00 0.00 0.00 17.79 19.97 2abd h ALA 53 CO -0.17 -0.59 -0.07 0.87 0.00 0.00 0.00 179.25 179.29 2abd h LYS 54 N -0.17 0.05 0.10 0.00 6.56 -0.98 0.38 116.57 122.51 2abd h LYS 54 Ca 0.10 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.69 2abd h LYS 54 Cb 0.32 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 31.94 2abd h LYS 54 CO -0.25 0.03 -0.25 2.35 -2.06 0.00 0.00 179.45 179.28 2abd h TRP 55 N 0.05 -0.72 -0.31 -1.35 7.01 -0.97 0.12 115.95 119.78 2abd h TRP 55 Ca 0.27 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.33 2abd h TRP 55 Cb 0.42 0.30 -0.04 0.00 -2.10 0.00 0.00 29.16 27.75 2abd h TRP 55 CO -0.39 -0.29 0.08 -0.44 -2.79 0.00 0.00 178.44 174.61 2abd h ASP 56 N -0.39 0.06 -0.05 2.65 3.32 0.30 0.41 116.42 122.73 2abd h ASP 56 Ca -0.01 0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.12 2abd h ASP 56 Cb 0.37 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.92 2abd h ASP 56 CO -0.12 0.07 -0.28 0.00 -1.72 0.00 0.00 179.24 177.19 2abd h ALA 57 N 1.21 -0.36 0.25 3.45 0.00 -0.04 0.17 119.26 123.95 2abd h ALA 57 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2abd h ALA 57 Cb 0.13 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2abd h ALA 57 CO -0.17 -0.77 -0.15 2.35 0.00 0.00 0.00 179.25 180.51 2abd h TRP 58 N -0.40 -0.40 -0.78 0.00 7.01 -0.53 -2.57 115.95 118.28 2abd h TRP 58 Ca 0.08 -0.00 0.16 0.00 2.11 0.00 0.00 58.89 61.23 2abd h TRP 58 Cb 0.51 0.14 -0.15 0.00 -2.10 0.00 0.00 29.16 27.56 2abd h TRP 58 CO -0.33 -0.24 -0.20 -0.97 -2.79 0.00 0.00 178.44 173.90 2abd h ASN 59 N -0.39 -0.75 -1.64 2.65 -1.24 0.32 0.23 115.58 114.76 2abd h ASN 59 Ca -0.03 0.24 0.47 0.00 0.71 0.00 0.00 56.30 57.70 2abd h ASN 59 Cb 0.32 0.49 -0.07 0.00 0.73 0.00 0.00 38.32 39.80 2abd h ASN 59 CO 0.03 -0.26 1.32 -0.08 -1.29 0.00 0.00 177.43 177.14 2abd h GLU 60 N -0.01 0.00 0.12 6.67 4.81 -0.24 0.21 114.58 126.14 2abd h GLU 60 Ca 0.37 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.30 2abd h GLU 60 Cb 0.57 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 2abd h GLU 60 CO -0.81 0.00 -1.56 -0.07 -0.73 0.00 0.00 179.01 175.84 2abd h LEU 61 N 0.00 0.39 0.00 1.64 3.38 -0.62 -3.48 115.31 116.63 2abd h LEU 61 Ca 0.78 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2abd h LEU 61 Cb 3.40 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 44.02 2abd h LEU 61 CO -0.01 1.68 0.00 1.17 0.09 0.00 0.00 178.44 181.37 2abd n LYS 62 N -3.83 0.00 0.00 1.13 4.81 0.72 -0.22 118.16 120.77 2abd n LYS 62 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.17 2abd n LYS 62 Cb 0.94 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.99 2abd n LYS 62 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2abd n GLY 63 N 0.00 1.96 3.91 3.14 0.00 -1.26 -5.00 105.19 107.94 2abd n GLY 63 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2abd n GLY 63 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2abd s THR 64 N -2.00 3.25 -0.25 2.61 -1.32 0.70 -4.95 115.64 113.68 2abd s THR 64 Ca 0.00 0.04 -0.28 0.00 -1.21 0.00 0.00 61.69 60.25 2abd s THR 64 Cb 0.00 -3.34 -0.05 0.00 -1.51 0.00 0.00 72.50 67.60 2abd s THR 64 CO 0.00 -0.38 2.25 -0.24 -2.21 0.00 0.00 174.62 174.04 2abd n SER 65 N -2.78 3.14 -0.43 8.08 2.88 -1.26 -4.78 113.62 118.48 2abd n SER 65 Ca 0.06 0.10 0.35 0.00 -1.33 0.00 0.00 58.87 58.05 2abd n SER 65 Cb 0.58 -1.56 0.63 0.00 -0.75 0.00 0.00 64.21 63.11 2abd n SER 65 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2abd h LYS 66 N 15.72 0.12 0.12 -1.46 1.57 -1.92 0.63 116.57 131.35 2abd h LYS 66 Ca -0.39 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.38 2abd h LYS 66 Cb 1.24 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2abd h LYS 66 CO 0.99 0.08 -0.06 0.93 -0.57 0.00 0.00 179.45 180.82 2abd h GLU 67 N 0.13 -0.15 -0.28 3.15 3.07 -1.91 -2.45 114.58 116.13 2abd h GLU 67 Ca 0.79 0.01 0.07 0.00 -0.50 0.00 0.00 59.36 59.72 2abd h GLU 67 Cb 2.43 0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 30.30 2abd h GLU 67 CO -0.39 0.31 -0.19 -0.44 -1.40 0.00 0.00 179.01 176.90 2abd h ASP 68 N -0.70 -0.62 -0.66 1.42 3.32 -0.23 0.12 116.42 119.07 2abd h ASP 68 Ca -0.02 0.13 0.12 0.00 0.02 0.00 0.00 57.03 57.29 2abd h ASP 68 Cb 0.53 0.32 -0.13 0.00 0.22 0.00 0.00 39.33 40.27 2abd h ASP 68 CO 0.03 -0.23 -0.27 0.00 -1.72 0.00 0.00 179.24 177.05 2abd h ALA 69 N 0.99 0.19 0.42 3.45 0.00 -0.83 0.21 119.26 123.69 2abd h ALA 69 Ca 0.15 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 2abd h ALA 69 Cb 0.40 0.69 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2abd h ALA 69 CO -0.38 -0.56 -0.20 0.52 0.00 0.00 0.00 179.25 178.63 2abd h MET 70 N -0.09 -0.54 -0.05 0.00 2.86 -0.71 0.28 114.93 116.69 2abd h MET 70 Ca 0.29 0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.99 2abd h MET 70 Cb 0.54 0.12 -0.06 0.00 0.06 0.00 0.00 31.60 32.27 2abd h MET 70 CO -0.72 -0.30 -0.52 1.57 1.06 0.00 0.00 176.91 178.00 2abd h LYS 71 N -0.67 -0.60 -0.23 1.72 5.09 -0.22 -1.81 116.57 119.83 2abd h LYS 71 Ca -0.06 0.04 0.03 0.00 0.09 0.00 0.00 60.65 60.75 2abd h LYS 71 Cb 0.49 0.14 -0.05 0.00 0.10 0.00 0.00 32.23 32.91 2abd h LYS 71 CO 0.09 -0.40 -0.32 0.00 -2.09 0.00 0.00 179.45 176.73 2abd h ALA 72 N -0.30 -0.57 -0.55 0.07 0.00 -0.60 -0.27 119.26 117.03 2abd h ALA 72 Ca 0.03 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.99 2abd h ALA 72 Cb 0.70 0.95 -0.07 0.00 0.00 0.00 0.00 17.79 19.37 2abd h ALA 72 CO -0.38 -0.73 -0.32 0.98 0.00 0.00 0.00 179.25 178.80 2abd n TYR 73 N -4.23 -0.24 0.44 0.00 9.36 0.99 -0.22 117.16 123.26 2abd n TYR 73 Ca -0.02 0.69 -0.18 0.00 3.32 0.00 0.00 57.90 61.71 2abd n TYR 73 Cb 0.19 -0.51 -0.09 0.00 -0.63 0.00 0.00 39.34 38.31 2abd n TYR 73 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 2abd h ILE 74 N 0.00 0.00 -1.09 2.97 2.04 -0.82 0.20 117.51 120.81 2abd h ILE 74 Ca 0.09 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.35 2abd h ILE 74 Cb 0.23 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.16 2abd h ILE 74 CO -0.52 0.00 0.66 0.47 0.00 0.00 0.00 178.15 178.77 2abd n ASP 75 N -5.18 0.24 -0.04 1.72 8.00 -0.16 0.06 116.55 121.19 2abd n ASP 75 Ca -0.14 1.35 -0.22 0.00 0.71 0.00 0.00 54.79 56.49 2abd n ASP 75 Cb 0.46 -0.66 -0.13 0.00 -0.02 0.00 0.00 41.12 40.77 2abd n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2abd h LYS 76 N 0.00 0.15 -0.86 -1.24 1.79 -0.39 -3.39 116.57 112.63 2abd h LYS 76 Ca 0.78 -0.25 0.21 0.00 -2.18 0.00 0.00 60.65 59.20 2abd h LYS 76 Cb 2.32 0.09 -0.16 0.00 -1.58 0.00 0.00 32.23 32.91 2abd h LYS 76 CO -0.53 1.12 -0.08 0.28 -1.08 0.00 0.00 179.45 179.16 2abd n VAL 77 N -3.92 -0.36 -0.34 0.50 0.31 0.11 0.06 118.33 114.68 2abd n VAL 77 Ca -0.32 1.93 0.16 0.00 -0.01 0.00 0.00 64.34 66.10 2abd n VAL 77 Cb 0.88 -2.76 0.31 0.00 -0.91 0.00 0.00 33.84 31.36 2abd n VAL 77 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2abd n GLU 78 N -5.31 -0.08 -0.27 5.55 4.07 -1.14 0.12 120.64 123.57 2abd n GLU 78 Ca 0.18 1.48 0.09 0.00 -0.06 0.00 0.00 57.16 58.85 2abd n GLU 78 Cb 0.57 -2.37 0.23 0.00 -0.06 0.00 0.00 31.44 29.81 2abd n GLU 78 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 2abd h GLU 79 N 0.00 0.26 -0.05 5.31 5.08 -0.64 0.66 114.58 125.20 2abd h GLU 79 Ca 0.61 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.91 2abd h GLU 79 Cb 1.29 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2abd h GLU 79 CO -0.93 0.17 -0.15 -0.07 -1.00 0.00 0.00 179.01 177.04 2abd h LEU 80 N 0.27 0.21 -2.21 1.33 3.38 0.83 0.34 115.31 119.46 2abd h LEU 80 Ca 0.48 -0.62 0.04 0.00 0.09 0.00 0.00 57.88 57.87 2abd h LEU 80 Cb 0.88 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 2abd h LEU 80 CO -0.56 0.79 0.27 0.50 0.09 0.00 0.00 178.44 179.52 2abd h LYS 81 N -0.37 0.00 0.00 1.13 3.64 0.84 0.92 116.57 122.73 2abd h LYS 81 Ca -0.01 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.10 2abd h LYS 81 Cb 0.77 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.55 2abd h LYS 81 CO 0.03 0.00 -1.85 1.63 -2.27 0.00 0.00 179.45 176.99 2abd n LYS 82 N -3.32 0.56 0.04 1.90 5.02 0.21 -2.42 118.16 120.15 2abd n LYS 82 Ca 0.01 0.29 -0.12 0.00 -2.02 0.00 0.00 58.31 56.47 2abd n LYS 82 Cb 0.36 -1.51 -0.08 0.00 -0.02 0.00 0.00 35.03 33.78 2abd n LYS 82 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2abd h LYS 83 N -1.00 -0.02 0.01 1.97 3.64 0.02 -3.33 116.57 117.85 2abd h LYS 83 Ca -0.42 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 58.76 2abd h LYS 83 Cb 1.34 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.14 2abd h LYS 83 CO -0.26 0.08 -1.07 1.88 -2.27 0.00 0.00 179.45 177.82 2abd h TYR 84 N -0.12 0.02 0.00 1.91 0.05 0.57 -3.49 116.97 115.91 2abd h TYR 84 Ca -0.00 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.76 2abd h TYR 84 Cb 0.11 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.85 2abd h TYR 84 CO -0.04 1.42 0.00 0.41 -1.05 0.00 0.00 178.16 178.89 2abd n GLY 85 N 1.48 2.17 0.20 3.88 0.00 0.07 -3.04 105.19 109.94 2abd n GLY 85 Ca -0.28 -1.31 0.15 0.00 0.00 0.00 0.00 46.02 44.58 2abd n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71