#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2abd n GLN 2 N 0.00 3.34 -0.10 4.33 10.64 -1.26 -5.12 117.38 129.21 2abd n GLN 2 Ca 0.00 0.00 -0.03 0.00 -1.83 0.00 0.00 57.00 55.14 2abd n GLN 2 Cb 0.00 0.00 0.02 0.00 -0.86 0.00 0.00 30.24 29.40 2abd n GLN 2 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2abd n ALA 3 N -3.00 -0.26 0.10 2.61 0.00 -1.26 -4.95 120.51 113.75 2abd n ALA 3 Ca 0.00 -0.14 0.04 0.00 0.00 0.00 0.00 53.44 53.35 2abd n ALA 3 Cb 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 19.45 19.44 2abd n ALA 3 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2abd h GLU 4 N 0.00 0.00 -0.90 0.00 4.11 -2.00 -3.40 114.58 112.40 2abd h GLU 4 Ca -0.03 0.00 0.09 0.00 0.07 0.00 0.00 59.36 59.49 2abd h GLU 4 Cb 0.10 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.24 2abd h GLU 4 CO 0.02 0.26 -0.50 0.34 0.07 0.00 0.00 179.01 179.21 2abd n PHE 5 N -2.98 -0.32 -0.19 2.06 7.35 -1.26 -0.24 117.46 121.88 2abd n PHE 5 Ca -0.02 1.12 -0.05 0.00 -0.76 0.00 0.00 57.45 57.73 2abd n PHE 5 Cb 0.71 -0.62 0.12 0.00 0.35 0.00 0.00 39.48 40.05 2abd n PHE 5 CO 0.00 0.00 0.00 0.22 -0.76 0.00 0.00 176.76 176.22 2abd h ASP 6 N 0.00 0.92 -0.63 -2.13 3.58 -1.98 0.40 116.42 116.58 2abd h ASP 6 Ca 0.17 -0.19 0.10 0.00 0.42 0.00 0.00 57.03 57.53 2abd h ASP 6 Cb 0.40 -0.24 -0.07 0.00 1.72 0.00 0.00 39.33 41.13 2abd h ASP 6 CO -0.85 0.90 0.24 0.50 -2.88 0.00 0.00 179.24 177.15 2abd h LYS 7 N 0.93 0.41 0.69 0.28 1.63 -1.15 0.31 116.57 119.69 2abd h LYS 7 Ca 0.20 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 59.94 2abd h LYS 7 Cb 0.35 -0.09 0.01 0.00 -0.60 0.00 0.00 32.23 31.89 2abd h LYS 7 CO 0.00 0.27 -0.33 0.00 -3.45 0.00 0.00 179.45 175.94 2abd h ALA 8 N 1.43 -0.93 -0.94 5.00 0.00 0.68 -1.43 119.26 123.07 2abd h ALA 8 Ca 0.32 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 55.14 2abd h ALA 8 Cb 0.40 0.36 -0.14 0.00 0.00 0.00 0.00 17.79 18.40 2abd h ALA 8 CO -0.31 -0.93 -0.40 0.00 0.00 0.00 0.00 179.25 177.60 2abd n ALA 9 N -2.60 -0.20 -0.22 0.00 0.00 0.13 0.18 120.51 117.79 2abd n ALA 9 Ca -0.13 0.91 -0.06 0.00 0.00 0.00 0.00 53.44 54.16 2abd n ALA 9 Cb 0.39 -0.36 0.04 0.00 0.00 0.00 0.00 19.45 19.51 2abd n ALA 9 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2abd h GLU 10 N 0.00 0.82 -0.03 0.00 4.81 -0.44 -2.13 114.58 117.62 2abd h GLU 10 Ca 0.29 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.43 2abd h GLU 10 Cb 0.53 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2abd h GLU 10 CO -0.92 0.56 -0.11 0.93 -0.73 0.00 0.00 179.01 178.74 2abd h GLU 11 N 0.84 0.12 -0.47 1.92 5.08 0.80 -3.32 114.58 119.55 2abd h GLU 11 Ca 0.23 -0.09 0.06 0.00 -1.00 0.00 0.00 59.36 58.55 2abd h GLU 11 Cb -0.07 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.14 2abd h GLU 11 CO -0.05 0.75 0.17 -0.24 -1.00 0.00 0.00 179.01 178.64 2abd h VAL 12 N -0.48 0.86 0.00 3.13 3.04 -0.26 -0.32 116.25 122.21 2abd h VAL 12 Ca -0.01 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 2abd h VAL 12 Cb 0.77 0.48 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 2abd h VAL 12 CO 0.02 0.06 0.00 0.29 -1.01 0.00 0.00 177.57 176.94 2abd n LYS 13 N -5.00 0.11 -0.13 4.17 5.02 -0.80 -3.17 118.16 118.36 2abd n LYS 13 Ca 0.04 0.60 -0.18 0.00 -2.02 0.00 0.00 58.31 56.75 2abd n LYS 13 Cb 0.18 -1.86 -0.12 0.00 -0.02 0.00 0.00 35.03 33.21 2abd n LYS 13 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2abd n HIS 14 N -2.10 0.00 0.00 2.13 8.25 -0.18 -4.97 115.22 118.35 2abd n HIS 14 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2abd n HIS 14 Cb 0.03 -0.98 0.00 0.00 1.12 0.00 0.00 29.99 30.16 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 -3.27 0.00 -0.15 2.41 4.77 -0.88 -4.56 117.00 115.32 2abd n LEU 15 Ca -0.45 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 55.66 2abd n LEU 15 Cb 0.98 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 42.30 2abd n LEU 15 CO 0.25 0.00 0.43 1.17 -1.33 0.00 0.00 177.39 177.91 2abd n LYS 16 N 0.00 -0.02 -4.34 3.23 4.81 0.22 -4.02 118.16 118.04 2abd n LYS 16 Ca 0.00 0.49 -0.23 0.00 -0.87 0.00 0.00 58.31 57.70 2abd n LYS 16 Cb 0.00 -0.93 -0.08 0.00 0.02 0.00 0.00 35.03 34.04 2abd n LYS 16 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2abd s THR 17 N -4.40 3.17 -0.36 3.15 2.01 -1.24 -5.08 115.64 112.89 2abd s THR 17 Ca -0.03 -2.03 -0.20 0.00 0.31 0.00 0.00 61.69 59.74 2abd s THR 17 Cb 0.12 -2.68 0.00 0.00 0.01 0.00 0.00 72.50 69.95 2abd s THR 17 CO 0.30 -0.37 0.60 -0.54 -0.69 0.00 0.00 174.62 173.92 2abd s LYS 18 N -3.58 3.61 0.29 4.92 -0.14 -1.26 -4.89 119.74 118.69 2abd s LYS 18 Ca 0.31 -0.07 -0.26 0.00 -1.36 0.00 0.00 55.97 54.59 2abd s LYS 18 Cb -0.06 -3.83 -0.16 0.00 -1.68 0.00 0.00 37.83 32.11 2abd s LYS 18 CO 0.18 -0.74 0.53 -2.30 -0.76 0.00 0.00 175.35 172.26 2abd n PRO 19 N 5.98 0.32 -1.59 -1.68 -0.02 -1.26 -4.93 135.00 131.82 2abd n PRO 19 Ca -0.02 0.11 -0.32 0.00 -2.02 0.00 0.00 63.50 61.25 2abd n PRO 19 Cb 0.49 -1.22 0.06 0.00 -0.02 0.00 0.00 33.50 32.80 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 -1.20 2.53 0.06 3.55 0.00 -1.26 -4.73 121.76 120.70 2abd s ALA 20 Ca 0.62 0.26 -0.16 0.00 0.00 0.00 0.00 51.96 52.68 2abd s ALA 20 Cb -0.79 -3.24 -0.06 0.00 0.00 0.00 0.00 23.12 19.04 2abd s ALA 20 CO 0.58 -1.32 1.27 0.38 0.00 0.00 0.00 175.76 176.67 2abd h ASP 21 N -0.53 -0.86 -0.33 0.00 2.03 -1.95 0.11 116.42 114.89 2abd h ASP 21 Ca -0.45 0.11 0.06 0.00 -0.73 0.00 0.00 57.03 56.02 2abd h ASP 21 Cb 1.22 0.34 -0.08 0.00 -0.83 0.00 0.00 39.33 39.98 2abd h ASP 21 CO 0.55 -0.22 -0.45 -0.33 -1.03 0.00 0.00 179.24 177.75 2abd h GLU 22 N -0.26 -0.38 -0.52 4.15 5.08 -1.99 0.37 114.58 121.03 2abd h GLU 22 Ca 0.02 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.51 2abd h GLU 22 Cb 0.32 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.57 2abd h GLU 22 CO -0.24 -0.25 -0.03 0.93 -1.00 0.00 0.00 179.01 178.43 2abd h GLU 23 N -0.39 0.09 -0.42 2.33 5.08 -1.88 -1.44 114.58 117.95 2abd h GLU 23 Ca 0.11 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2abd h GLU 23 Cb 0.60 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2abd h GLU 23 CO -0.53 0.06 0.23 0.52 -1.00 0.00 0.00 179.01 178.28 2abd h MET 24 N 0.09 0.44 -0.74 2.33 2.86 0.71 -3.07 114.93 117.55 2abd h MET 24 Ca 0.26 -0.03 0.16 0.00 -2.06 0.00 0.00 59.70 58.04 2abd h MET 24 Cb 0.40 -0.10 -0.14 0.00 0.06 0.00 0.00 31.60 31.82 2abd h MET 24 CO -0.46 0.29 -0.13 1.28 1.06 0.00 0.00 176.91 178.96 2abd n LEU 25 N -4.89 -0.21 0.02 1.22 4.77 0.11 0.20 117.00 118.23 2abd n LEU 25 Ca 0.02 1.27 -0.01 0.00 -0.03 0.00 0.00 56.01 57.26 2abd n LEU 25 Cb 0.09 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 40.76 2abd n LEU 25 CO 0.31 -1.24 0.50 0.15 -1.33 0.00 0.00 177.39 175.78 2abd h PHE 26 N 0.00 -0.08 -0.63 -1.77 3.57 -1.56 0.34 116.94 116.81 2abd h PHE 26 Ca 0.38 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.97 2abd h PHE 26 Cb 0.66 0.03 -0.11 0.00 2.79 0.00 0.00 35.95 39.32 2abd h PHE 26 CO -0.51 -0.04 -0.48 0.82 -2.23 0.00 0.00 178.31 175.86 2abd h ILE 27 N -0.07 0.05 0.02 1.41 5.03 -1.30 -0.29 117.51 122.36 2abd h ILE 27 Ca -0.00 0.00 0.01 0.00 -0.12 0.00 0.00 64.86 64.75 2abd h ILE 27 Cb 0.06 0.05 -0.03 0.00 -3.03 0.00 0.00 36.82 33.86 2abd h ILE 27 CO 0.00 0.00 -0.31 0.22 -0.68 0.00 0.00 178.15 177.38 2abd h TYR 28 N -0.22 -0.91 0.05 1.37 3.20 -0.18 0.85 116.97 121.13 2abd h TYR 28 Ca 0.16 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.08 2abd h TYR 28 Cb 0.55 0.39 -0.05 0.00 1.54 0.00 0.00 36.73 39.16 2abd h TYR 28 CO -0.77 -0.34 -0.53 0.66 -1.64 0.00 0.00 178.16 175.55 2abd h SER 29 N -0.40 -1.62 -0.17 -2.11 4.64 0.04 0.15 113.55 114.09 2abd h SER 29 Ca 0.00 0.18 0.01 0.00 -0.47 0.00 0.00 61.79 61.51 2abd h SER 29 Cb 0.42 0.61 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 2abd h SER 29 CO -0.20 -0.54 0.09 0.45 -0.87 0.00 0.00 176.83 175.76 2abd h HIS 30 N -0.71 0.17 -0.08 4.77 3.86 -1.02 -1.68 115.15 120.46 2abd h HIS 30 Ca 0.01 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2abd h HIS 30 Cb 0.74 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 29.13 2abd h HIS 30 CO -0.49 0.10 -0.26 -0.92 0.86 0.00 0.00 177.93 177.22 2abd h TYR 31 N 0.19 -0.77 -0.76 2.45 3.20 0.13 0.12 116.97 121.53 2abd h TYR 31 Ca 0.07 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.11 2abd h TYR 31 Cb 0.00 0.35 -0.14 0.00 1.54 0.00 0.00 36.73 38.48 2abd h TYR 31 CO -0.08 -0.26 -0.25 0.87 -1.64 0.00 0.00 178.16 176.80 2abd h LYS 32 N -0.27 -0.04 -0.26 1.82 1.79 -0.58 0.25 116.57 119.29 2abd h LYS 32 Ca 0.02 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2abd h LYS 32 Cb 0.32 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 2abd h LYS 32 CO -0.21 -0.02 0.16 1.96 -1.08 0.00 0.00 179.45 180.25 2abd h GLN 33 N -0.04 0.34 -0.23 3.15 1.08 -0.31 0.33 115.11 119.43 2abd h GLN 33 Ca 0.34 -0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.53 2abd h GLN 33 Cb 0.57 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.92 2abd h GLN 33 CO -0.80 0.26 0.16 0.00 -0.95 0.00 0.00 178.83 177.50 2abd h ALA 34 N 1.07 1.92 0.00 3.87 0.00 0.16 -3.25 119.26 123.03 2abd h ALA 34 Ca 0.09 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.74 2abd h ALA 34 Cb -0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2abd h ALA 34 CO -0.02 0.05 -1.89 0.25 0.00 0.00 0.00 179.25 177.65 2abd n THR 35 N -4.50 0.88 -0.07 0.00 -2.24 0.63 -4.86 114.28 104.12 2abd n THR 35 Ca 0.01 -0.27 -0.06 0.00 -2.27 0.00 0.00 64.05 61.46 2abd n THR 35 Cb 0.13 -1.46 -0.03 0.00 -2.10 0.00 0.00 70.33 66.87 2abd n THR 35 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2abd h VAL 36 N -0.36 0.16 0.00 2.28 2.07 -0.56 -3.50 116.25 116.33 2abd h VAL 36 Ca -0.38 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 65.96 2abd h VAL 36 Cb 1.42 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2abd h VAL 36 CO -0.17 0.05 0.00 0.61 0.02 0.00 0.00 177.57 178.08 2abd n GLY 37 N 1.62 2.49 0.00 2.17 0.00 -0.43 -5.02 105.19 106.03 2abd n GLY 37 Ca -0.09 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.89 2abd n GLY 37 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2abd n ASP 38 N 0.00 0.00 0.00 1.61 9.92 -1.26 -4.24 116.55 122.58 2abd n ASP 38 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2abd n ASP 38 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2abd n ASP 38 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2abd n ILE 39 N 0.00 0.00 -1.36 0.53 3.06 -1.26 -4.82 119.36 115.51 2abd n ILE 39 Ca 0.00 0.00 -0.14 0.00 -2.50 0.00 0.00 62.75 60.11 2abd n ILE 39 Cb 0.00 0.00 0.19 0.00 0.54 0.00 0.00 39.64 40.37 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 3.07 0.00 9.51 2.04 -1.26 -4.80 115.26 123.82 2abd n ASN 40 Ca 0.00 -3.71 0.00 0.00 -0.44 0.00 0.00 54.58 50.43 2abd n ASN 40 Cb 0.00 -0.73 0.00 0.00 -2.53 0.00 0.00 39.78 36.52 2abd n ASN 40 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 2abd n THR 41 N -1.14 0.00 -3.60 5.53 -2.24 -1.26 -5.15 114.28 106.42 2abd n THR 41 Ca 0.46 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 62.18 2abd n THR 41 Cb 1.34 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.53 2abd n THR 41 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2abd s GLU 42 N 2.66 0.36 -0.63 -0.78 -1.05 -1.26 -5.10 118.70 112.90 2abd s GLU 42 Ca 0.00 0.02 -0.25 0.00 -0.15 0.00 0.00 54.97 54.58 2abd s GLU 42 Cb 0.00 0.17 0.04 0.00 -0.44 0.00 0.00 34.13 33.90 2abd s GLU 42 CO 0.00 -0.13 1.09 0.50 0.95 0.00 0.00 175.26 177.67 2abd s ARG 43 N -1.48 3.29 0.07 -4.83 3.52 -1.26 -4.88 118.95 113.38 2abd s ARG 43 Ca 0.05 -0.27 -0.18 0.00 -0.13 0.00 0.00 55.73 55.20 2abd s ARG 43 Cb -0.01 -4.11 -0.10 0.00 -1.56 0.00 0.00 34.95 29.17 2abd s ARG 43 CO -0.04 -1.77 0.39 -2.30 -0.81 0.00 0.00 175.30 170.77 2abd n PRO 44 N 8.21 0.00 0.00 5.12 -0.02 -1.26 -4.92 135.00 142.12 2abd n PRO 44 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2abd n PRO 44 Cb 0.48 -0.64 0.00 0.00 -0.02 0.00 0.00 33.50 33.32 2abd n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2abd n GLY 45 N 1.01 0.00 0.09 -1.23 0.00 -1.26 -4.97 105.19 98.83 2abd n GLY 45 Ca 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 2abd n GLY 45 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2abd n MET 46 N -2.58 0.53 -0.10 1.61 2.81 -1.26 -5.07 117.12 113.05 2abd n MET 46 Ca 0.00 0.25 0.00 0.00 -1.81 0.00 0.00 57.70 56.14 2abd n MET 46 Cb 0.13 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.17 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 -4.46 0.00 -4.49 4.03 4.77 -1.26 -4.72 117.00 110.88 2abd n LEU 47 Ca -0.17 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.39 2abd n LEU 47 Cb 0.53 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 2abd n LEU 47 CO 0.18 -0.05 -0.15 -0.67 -1.33 0.00 0.00 177.39 175.37 2abd n ASP 48 N -0.29 -1.92 0.00 -1.43 2.03 -1.26 -4.78 116.55 108.90 2abd n ASP 48 Ca 0.00 -1.21 0.00 0.00 0.52 0.00 0.00 54.79 54.10 2abd n ASP 48 Cb 0.00 -1.78 0.00 0.00 -0.72 0.00 0.00 41.12 38.62 2abd n ASP 48 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2abd n PHE 49 N -4.13 0.00 -2.00 -0.67 3.01 -1.26 0.32 117.46 112.73 2abd n PHE 49 Ca 0.09 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.15 2abd n PHE 49 Cb 0.47 -0.19 0.04 0.00 -0.01 0.00 0.00 39.48 39.78 2abd n PHE 49 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2abd n LYS 50 N -2.04 3.00 0.04 -1.08 4.81 -1.26 -4.31 118.16 117.32 2abd n LYS 50 Ca 0.00 -3.64 0.00 0.00 -0.87 0.00 0.00 58.31 53.80 2abd n LYS 50 Cb 0.00 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 32.76 2abd n LYS 50 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2abd n GLY 51 N -0.50 -0.08 0.00 3.14 0.00 0.15 -4.88 105.19 103.03 2abd n GLY 51 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.55 2abd n GLY 51 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2abd n LYS 52 N -3.11 0.00 -0.33 1.61 0.00 -0.58 0.26 118.16 116.00 2abd n LYS 52 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.35 2abd n LYS 52 Cb 0.15 0.00 0.12 0.00 -0.00 0.00 0.00 35.03 35.30 2abd n LYS 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2abd h ALA 53 N 0.00 0.58 -0.36 0.58 0.00 -1.89 0.93 119.26 119.09 2abd h ALA 53 Ca 0.00 0.35 0.07 0.00 0.00 0.00 0.00 54.91 55.34 2abd h ALA 53 Cb 0.00 0.73 -0.09 0.00 0.00 0.00 0.00 17.79 18.43 2abd h ALA 53 CO 0.00 -0.41 -0.35 0.87 0.00 0.00 0.00 179.25 179.37 2abd h LYS 54 N -0.00 -0.28 -0.16 0.00 1.79 -0.56 0.45 116.57 117.80 2abd h LYS 54 Ca 0.44 0.02 0.04 0.00 -2.18 0.00 0.00 60.65 58.96 2abd h LYS 54 Cb 0.67 0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 31.32 2abd h LYS 54 CO -0.96 -0.19 -0.51 2.35 -1.08 0.00 0.00 179.45 179.06 2abd h TRP 55 N -0.29 -1.52 0.01 -1.35 7.01 0.59 0.21 115.95 120.61 2abd h TRP 55 Ca 0.15 0.06 0.01 0.00 2.11 0.00 0.00 58.89 61.23 2abd h TRP 55 Cb 0.55 0.68 -0.02 0.00 -2.10 0.00 0.00 29.16 28.28 2abd h TRP 55 CO -0.54 -0.53 -0.08 -0.44 -2.79 0.00 0.00 178.44 174.07 2abd h ASP 56 N -0.55 -0.21 -0.52 2.65 3.32 0.05 0.52 116.42 121.67 2abd h ASP 56 Ca 0.05 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.24 2abd h ASP 56 Cb 0.67 0.09 -0.09 0.00 0.22 0.00 0.00 39.33 40.22 2abd h ASP 56 CO -0.44 -0.11 -0.03 0.00 -1.72 0.00 0.00 179.24 176.93 2abd h ALA 57 N 0.84 0.46 0.48 3.45 0.00 0.46 0.17 119.26 125.12 2abd h ALA 57 Ca 0.03 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2abd h ALA 57 Cb 0.17 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2abd h ALA 57 CO -0.07 -0.40 -0.23 2.35 0.00 0.00 0.00 179.25 180.89 2abd h TRP 58 N 0.08 -0.60 -1.00 0.00 7.01 -0.20 -3.17 115.95 118.08 2abd h TRP 58 Ca 0.26 -0.01 0.24 0.00 2.11 0.00 0.00 58.89 61.49 2abd h TRP 58 Cb 0.40 0.20 -0.19 0.00 -2.10 0.00 0.00 29.16 27.47 2abd h TRP 58 CO -0.35 -0.27 -0.11 -1.71 -2.79 0.00 0.00 178.44 173.20 2abd n ASN 59 N -5.25 -0.23 -0.52 2.65 5.15 0.18 0.21 115.26 117.44 2abd n ASN 59 Ca -0.10 1.71 0.43 0.00 -0.60 0.00 0.00 54.58 56.01 2abd n ASN 59 Cb 0.31 -0.57 0.75 0.00 -0.53 0.00 0.00 39.78 39.73 2abd n ASN 59 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 2abd h GLU 60 N 0.00 0.04 -0.44 1.20 4.81 -0.66 0.54 114.58 120.07 2abd h GLU 60 Ca 0.54 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.77 2abd h GLU 60 Cb 1.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.37 2abd h GLU 60 CO -0.98 0.03 0.00 1.28 -0.73 0.00 0.00 179.01 178.60 2abd n LEU 61 N -4.24 3.05 -4.57 1.64 4.77 0.13 -4.87 117.00 112.91 2abd n LEU 61 Ca 0.37 -1.40 -0.20 0.00 -0.03 0.00 0.00 56.01 54.75 2abd n LEU 61 Cb 1.62 -0.29 -0.07 0.00 -2.33 0.00 0.00 43.42 42.35 2abd n LEU 61 CO 0.36 0.70 1.27 -0.75 -1.33 0.00 0.00 177.39 177.65 2abd s LYS 62 N -1.42 1.95 0.00 3.23 2.36 0.19 0.33 119.74 126.38 2abd s LYS 62 Ca 0.38 -0.17 0.00 0.00 -2.55 0.00 0.00 55.97 53.63 2abd s LYS 62 Cb 0.21 -4.98 0.00 0.00 -1.05 0.00 0.00 37.83 32.01 2abd s LYS 62 CO 0.29 -4.24 0.00 0.41 1.55 0.00 0.00 175.35 173.36 2abd n GLY 63 N 6.56 0.18 3.45 5.54 0.00 -1.26 -5.01 105.19 114.66 2abd n GLY 63 Ca 0.43 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.17 2abd n GLY 63 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2abd n THR 64 N 0.00 0.00 -2.80 2.61 5.66 0.15 -4.83 114.28 115.08 2abd n THR 64 Ca 0.00 -0.45 -0.43 0.00 -3.05 0.00 0.00 64.05 60.12 2abd n THR 64 Cb 0.00 -0.98 -0.03 0.00 -1.55 0.00 0.00 70.33 67.77 2abd n THR 64 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2abd s SER 65 N -2.37 6.43 0.00 1.09 0.01 -1.26 -4.83 113.70 112.77 2abd s SER 65 Ca 0.68 -1.49 0.00 0.00 1.31 0.00 0.00 55.95 56.45 2abd s SER 65 Cb -0.25 -2.46 0.00 0.00 0.21 0.00 0.00 66.02 63.52 2abd s SER 65 CO 0.65 -1.33 0.00 1.17 0.41 0.00 0.00 173.24 174.14 2abd n LYS 66 N 7.62 0.00 0.05 12.44 4.81 -1.26 0.25 118.16 142.07 2abd n LYS 66 Ca 0.16 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.49 2abd n LYS 66 Cb 0.48 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.40 2abd n LYS 66 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2abd h GLU 67 N 0.00 0.12 -0.55 1.64 3.07 -1.89 -3.27 114.58 113.70 2abd h GLU 67 Ca 0.00 -0.21 0.11 0.00 -0.50 0.00 0.00 59.36 58.76 2abd h GLU 67 Cb 0.00 0.08 -0.11 0.00 -0.84 0.00 0.00 28.75 27.88 2abd h GLU 67 CO 0.00 0.97 -0.25 -0.44 -1.40 0.00 0.00 179.01 177.89 2abd h ASP 68 N 0.03 -0.86 -0.90 1.42 3.32 -0.59 0.91 116.42 119.76 2abd h ASP 68 Ca -0.17 0.20 0.11 0.00 0.02 0.00 0.00 57.03 57.19 2abd h ASP 68 Cb 1.93 0.47 -0.13 0.00 0.22 0.00 0.00 39.33 41.82 2abd h ASP 68 CO 0.14 -0.26 -0.50 0.00 -1.72 0.00 0.00 179.24 176.89 2abd h ALA 69 N 1.22 -0.31 0.69 3.45 0.00 -1.71 0.39 119.26 122.98 2abd h ALA 69 Ca 0.25 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 2abd h ALA 69 Cb 0.50 1.19 0.01 0.00 0.00 0.00 0.00 17.79 19.49 2abd h ALA 69 CO -0.62 -0.85 -0.33 0.52 0.00 0.00 0.00 179.25 177.97 2abd h MET 70 N -0.06 -0.90 -0.76 0.00 2.86 -1.04 0.43 114.93 115.47 2abd h MET 70 Ca 0.21 0.06 0.14 0.00 -2.06 0.00 0.00 59.70 58.06 2abd h MET 70 Cb 0.50 0.20 -0.14 0.00 0.06 0.00 0.00 31.60 32.23 2abd h MET 70 CO -0.89 -0.60 -0.28 0.87 1.06 0.00 0.00 176.91 177.07 2abd h LYS 71 N -1.02 -0.06 0.86 1.72 1.79 -0.64 0.13 116.57 119.35 2abd h LYS 71 Ca -0.10 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.34 2abd h LYS 71 Cb 0.71 0.01 0.01 0.00 -1.58 0.00 0.00 32.23 31.38 2abd h LYS 71 CO 0.16 -0.04 -0.41 0.00 -1.08 0.00 0.00 179.45 178.08 2abd h ALA 72 N 1.45 -1.27 -0.50 3.86 0.00 -0.20 -2.74 119.26 119.85 2abd h ALA 72 Ca 0.33 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2abd h ALA 72 Cb 0.58 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 2abd h ALA 72 CO -0.80 -1.18 -0.30 0.98 0.00 0.00 0.00 179.25 177.95 2abd n TYR 73 N -5.19 -0.22 0.12 0.00 9.36 0.15 0.22 117.16 121.60 2abd n TYR 73 Ca -0.14 0.63 -0.05 0.00 3.32 0.00 0.00 57.90 61.66 2abd n TYR 73 Cb 0.45 -0.51 -0.02 0.00 -0.63 0.00 0.00 39.34 38.63 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 -0.36 2.97 5.03 -1.30 0.15 117.51 124.01 2abd h ILE 74 Ca 0.08 -0.03 0.10 0.00 -0.12 0.00 0.00 64.86 64.90 2abd h ILE 74 Cb 0.21 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 33.98 2abd h ILE 74 CO -0.47 0.00 0.90 0.44 -0.68 0.00 0.00 178.15 178.33 2abd h ASP 75 N -0.35 0.00 0.00 1.72 5.19 -1.10 0.51 116.42 122.40 2abd h ASP 75 Ca -0.03 0.00 -0.43 0.00 -0.62 0.00 0.00 57.03 55.94 2abd h ASP 75 Cb 0.25 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.69 2abd h ASP 75 CO 0.05 0.00 -2.42 1.17 -3.12 0.00 0.00 179.24 174.93 2abd n LYS 76 N -2.92 0.60 -0.25 3.56 3.00 0.13 -4.54 118.16 117.74 2abd n LYS 76 Ca 0.08 0.27 0.21 0.00 -0.00 0.00 0.00 58.31 58.87 2abd n LYS 76 Cb 1.02 -1.52 0.39 0.00 0.00 0.00 0.00 35.03 34.92 2abd n LYS 76 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2abd n VAL 77 N -4.10 -0.32 -0.44 3.15 0.31 0.52 -0.87 118.33 116.59 2abd n VAL 77 Ca -0.51 1.59 0.37 0.00 -0.01 0.00 0.00 64.34 65.78 2abd n VAL 77 Cb 0.89 -2.52 0.62 0.00 -0.91 0.00 0.00 33.84 31.92 2abd n VAL 77 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2abd n GLU 78 N -4.82 -0.03 0.18 5.55 -0.00 -1.19 0.13 120.64 120.46 2abd n GLU 78 Ca 0.26 1.12 -0.14 0.00 -0.00 0.00 0.00 57.16 58.40 2abd n GLU 78 Cb 0.89 -2.22 -0.08 0.00 -0.00 0.00 0.00 31.44 30.03 2abd n GLU 78 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 2abd h GLU 79 N 0.00 -0.39 -0.54 3.44 5.08 -1.34 -2.47 114.58 118.36 2abd h GLU 79 Ca 0.79 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 59.22 2abd h GLU 79 Cb 2.61 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 31.90 2abd h GLU 79 CO -0.39 -0.18 0.29 -0.07 -1.00 0.00 0.00 179.01 177.65 2abd h LEU 80 N -0.53 0.43 -1.81 1.33 3.38 0.89 0.24 115.31 119.24 2abd h LEU 80 Ca -0.04 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.05 2abd h LEU 80 Cb 0.40 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2abd h LEU 80 CO 0.07 0.29 0.51 0.50 0.09 0.00 0.00 178.44 179.90 2abd h LYS 81 N 0.56 0.00 0.00 1.13 3.64 -0.56 0.30 116.57 121.64 2abd h LYS 81 Ca 0.23 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.43 2abd h LYS 81 Cb 0.12 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2abd h LYS 81 CO -0.15 0.00 -1.50 1.63 -2.27 0.00 0.00 179.45 177.16 2abd n LYS 82 N -3.39 0.54 -0.08 1.90 5.02 0.53 -2.22 118.16 120.46 2abd n LYS 82 Ca 0.06 0.30 -0.09 0.00 -2.02 0.00 0.00 58.31 56.56 2abd n LYS 82 Cb 0.66 -1.51 -0.02 0.00 -0.02 0.00 0.00 35.03 34.13 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 -0.29 0.00 1.97 1.63 -0.06 -3.31 116.57 115.50 2abd h LYS 83 Ca -0.28 0.02 -0.30 0.00 -0.85 0.00 0.00 60.65 59.24 2abd h LYS 83 Cb 1.18 0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.83 2abd h LYS 83 CO -0.17 -0.19 -1.81 0.66 -3.45 0.00 0.00 179.45 174.49 2abd n TYR 84 N -5.41 0.39 0.00 1.91 4.01 0.83 -4.97 117.16 113.92 2abd n TYR 84 Ca -0.00 0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 2abd n TYR 84 Cb 0.33 -0.95 0.00 0.00 -0.31 0.00 0.00 39.34 38.41 2abd n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2abd n GLY 85 N 1.36 0.00 0.00 2.72 0.00 0.16 -3.68 105.19 105.75 2abd n GLY 85 Ca -0.39 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.77 2abd n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71