#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 1.81 0.00 4.33 2.00 -1.26 -5.18 119.66 121.37 2abd s GLN 2 Ca 0.00 -2.06 0.00 0.00 -2.00 0.00 0.00 55.36 51.30 2abd s GLN 2 Cb 0.00 -0.82 0.00 0.00 0.80 0.00 0.00 33.01 32.99 2abd s GLN 2 CO 0.00 -0.32 0.00 0.00 -0.50 0.00 0.00 175.29 174.47 2abd n ALA 3 N -0.83 0.00 0.82 1.58 0.00 -1.26 -4.97 120.51 115.85 2abd n ALA 3 Ca -0.05 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.49 2abd n ALA 3 Cb 0.66 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.18 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 1.70 0.01 0.00 0.00 -1.26 -4.66 120.64 116.44 2abd n GLU 4 Ca 0.00 -1.59 -0.15 0.00 0.00 0.00 0.00 57.16 55.42 2abd n GLU 4 Cb 0.00 -1.37 -0.10 0.00 0.00 0.00 0.00 31.44 29.97 2abd n GLU 4 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 2abd h PHE 5 N 3.67 -1.60 -0.02 -1.84 3.57 -1.93 0.59 116.94 119.38 2abd h PHE 5 Ca 0.00 0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.56 2abd h PHE 5 Cb 0.80 0.71 -0.00 0.00 2.79 0.00 0.00 35.95 40.25 2abd h PHE 5 CO 0.00 -0.56 0.07 -0.44 -2.23 0.00 0.00 178.31 175.15 2abd h ASP 6 N -0.62 0.00 0.18 0.41 3.32 -1.99 0.30 116.42 118.03 2abd h ASP 6 Ca 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 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 -0.41 0.00 -0.09 0.11 -1.72 0.00 0.00 179.24 177.13 2abd h LYS 7 N 0.00 -0.23 -0.45 3.56 1.57 -1.24 0.34 116.57 120.12 2abd h LYS 7 Ca 0.01 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 2abd h LYS 7 Cb 0.15 0.05 -0.10 0.00 0.08 0.00 0.00 32.23 32.41 2abd h LYS 7 CO -0.00 0.18 -0.32 0.00 -0.57 0.00 0.00 179.45 178.73 2abd h ALA 8 N -0.32 -0.13 0.18 3.86 0.00 0.35 0.86 119.26 124.05 2abd h ALA 8 Ca -0.02 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2abd h ALA 8 Cb 0.52 0.71 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 2abd h ALA 8 CO 0.04 -0.70 -0.46 0.00 0.00 0.00 0.00 179.25 178.13 2abd h ALA 9 N 0.84 -0.87 -0.71 0.00 0.00 -0.76 0.21 119.26 117.97 2abd h ALA 9 Ca 0.19 -0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.15 2abd h ALA 9 Cb 0.54 0.76 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 2abd h ALA 9 CO -0.57 -1.05 -0.03 1.49 0.00 0.00 0.00 179.25 179.09 2abd h GLU 10 N -0.73 0.08 0.40 0.00 4.81 0.57 -0.23 114.58 119.48 2abd h GLU 10 Ca 0.00 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 2abd h GLU 10 Cb 0.73 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.10 2abd h GLU 10 CO -0.23 0.06 -0.19 0.93 -0.73 0.00 0.00 179.01 178.84 2abd h GLU 11 N 0.09 -0.52 -0.47 1.92 5.08 -0.38 -3.30 114.58 117.01 2abd h GLU 11 Ca 0.38 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.87 2abd h GLU 11 Cb 0.64 0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.92 2abd h GLU 11 CO -0.64 -0.21 -0.08 -0.24 -1.00 0.00 0.00 179.01 176.84 2abd h VAL 12 N -0.95 0.57 0.00 3.13 3.04 -0.17 0.42 116.25 122.28 2abd h VAL 12 Ca -0.05 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.62 2abd h VAL 12 Cb 0.55 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 30.36 2abd h VAL 12 CO 0.09 0.01 0.00 2.29 -1.01 0.00 0.00 177.57 178.95 2abd n LYS 13 N -5.30 0.12 -0.06 4.17 -0.00 -0.13 -2.93 118.16 114.02 2abd n LYS 13 Ca 0.04 0.09 -0.07 0.00 -0.00 0.00 0.00 58.31 58.36 2abd n LYS 13 Cb 0.25 -1.50 -0.06 0.00 -0.00 0.00 0.00 35.03 33.72 2abd n LYS 13 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2abd n HIS 14 N -1.10 0.00 0.00 5.58 8.25 0.09 -5.09 115.22 122.95 2abd n HIS 14 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2abd n HIS 14 Cb 0.02 -0.47 0.00 0.00 1.12 0.00 0.00 29.99 30.66 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 -2.69 0.00 -0.34 2.41 4.77 -0.89 -4.77 117.00 115.49 2abd n LEU 15 Ca -0.20 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 55.91 2abd n LEU 15 Cb 0.76 0.00 0.25 0.00 -2.33 0.00 0.00 43.42 42.10 2abd n LEU 15 CO 0.15 0.00 0.74 0.29 -1.33 0.00 0.00 177.39 177.24 2abd n LYS 16 N 0.00 -0.08 -4.24 3.23 5.02 0.53 -4.21 118.16 118.41 2abd n LYS 16 Ca 0.00 1.46 -0.24 0.00 -2.02 0.00 0.00 58.31 57.50 2abd n LYS 16 Cb 0.00 -2.28 -0.07 0.00 -0.02 0.00 0.00 35.03 32.66 2abd n LYS 16 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2abd s THR 17 N -6.02 3.64 -0.39 -0.18 2.01 -1.26 -5.09 115.64 108.36 2abd s THR 17 Ca -0.13 -1.67 -0.14 0.00 0.31 0.00 0.00 61.69 60.05 2abd s THR 17 Cb 0.28 -2.90 0.01 0.00 0.01 0.00 0.00 72.50 69.90 2abd s THR 17 CO 0.75 -0.27 0.28 -0.54 -0.69 0.00 0.00 174.62 174.16 2abd s LYS 18 N -3.39 3.16 0.79 4.92 -0.14 -1.26 -4.92 119.74 118.90 2abd s LYS 18 Ca 0.30 -0.89 -0.16 0.00 -1.36 0.00 0.00 55.97 53.86 2abd s LYS 18 Cb -0.08 -3.92 -0.06 0.00 -1.68 0.00 0.00 37.83 32.09 2abd s LYS 18 CO 0.20 -0.64 0.13 -2.30 -0.76 0.00 0.00 175.35 171.98 2abd n PRO 19 N 5.15 0.09 -1.05 -1.68 -0.02 -1.26 -4.93 135.00 131.29 2abd n PRO 19 Ca -0.12 0.06 -0.32 0.00 -2.02 0.00 0.00 63.50 61.11 2abd n PRO 19 Cb 0.48 -1.54 0.13 0.00 -0.02 0.00 0.00 33.50 32.55 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 -2.03 1.87 0.11 3.55 0.00 -1.26 -4.56 121.76 119.44 2abd s ALA 20 Ca 0.57 0.55 -0.26 0.00 0.00 0.00 0.00 51.96 52.83 2abd s ALA 20 Cb -0.31 -3.40 -0.08 0.00 0.00 0.00 0.00 23.12 19.33 2abd s ALA 20 CO 0.66 -2.24 1.43 0.22 0.00 0.00 0.00 175.76 175.83 2abd h ASP 21 N -1.27 -1.58 -0.32 0.00 1.82 -1.99 -0.19 116.42 112.90 2abd h ASP 21 Ca -0.44 0.22 0.07 0.00 -0.39 0.00 0.00 57.03 56.49 2abd h ASP 21 Cb 1.26 0.67 -0.08 0.00 0.68 0.00 0.00 39.33 41.86 2abd h ASP 21 CO 0.46 -0.27 -0.26 -0.33 -1.61 0.00 0.00 179.24 177.24 2abd h GLU 22 N -0.20 -0.22 -0.20 0.28 5.08 -1.98 0.44 114.58 117.79 2abd h GLU 22 Ca 0.08 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.51 2abd h GLU 22 Cb 0.42 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.64 2abd h GLU 22 CO -0.58 -0.15 -0.42 0.93 -1.00 0.00 0.00 179.01 177.79 2abd h GLU 23 N -0.23 -0.44 -0.66 2.33 5.08 -1.67 0.12 114.58 119.11 2abd h GLU 23 Ca 0.16 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.66 2abd h GLU 23 Cb 0.48 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.75 2abd h GLU 23 CO -0.45 -0.29 0.24 0.52 -1.00 0.00 0.00 179.01 178.03 2abd h MET 24 N -0.45 0.40 0.15 2.33 2.86 -0.28 -2.58 114.93 117.35 2abd h MET 24 Ca 0.09 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.72 2abd h MET 24 Cb 0.62 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 2abd h MET 24 CO -0.44 0.26 -0.35 -0.07 1.06 0.00 0.00 176.91 177.37 2abd h LEU 25 N 0.41 -1.01 0.02 1.22 3.38 0.17 0.50 115.31 120.00 2abd h LEU 25 Ca 0.35 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.44 2abd h LEU 25 Cb 0.47 0.38 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 2abd h LEU 25 CO -0.35 -0.44 -0.38 0.15 0.09 0.00 0.00 178.44 177.51 2abd h PHE 26 N -0.60 -1.11 -0.00 1.13 3.57 -0.64 0.28 116.94 119.57 2abd h PHE 26 Ca 0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2abd h PHE 26 Cb 0.62 0.48 -0.00 0.00 2.79 0.00 0.00 35.95 39.84 2abd h PHE 26 CO -0.30 -0.41 -0.00 0.82 -2.23 0.00 0.00 178.31 176.19 2abd h ILE 27 N -0.49 0.00 -0.44 1.41 5.03 -1.34 -1.19 117.51 120.48 2abd h ILE 27 Ca 0.00 0.00 0.04 0.00 -0.12 0.00 0.00 64.86 64.78 2abd h ILE 27 Cb 0.52 0.00 -0.05 0.00 -3.03 0.00 0.00 36.82 34.26 2abd h ILE 27 CO -0.24 0.00 -0.26 0.00 -0.68 0.00 0.00 178.15 176.97 2abd n TYR 28 N -2.75 -0.19 -0.09 1.37 9.36 0.17 0.31 117.16 125.34 2abd n TYR 28 Ca -0.00 0.55 -0.12 0.00 3.32 0.00 0.00 57.90 61.66 2abd n TYR 28 Cb 0.00 -0.53 -0.06 0.00 -0.63 0.00 0.00 39.34 38.12 2abd n TYR 28 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2abd h SER 29 N 0.00 -1.50 0.27 2.98 4.64 -0.32 0.30 113.55 119.91 2abd h SER 29 Ca 0.07 0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 61.59 2abd h SER 29 Cb 0.18 0.63 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2abd h SER 29 CO -0.41 -0.40 -0.13 0.45 -0.87 0.00 0.00 176.83 175.47 2abd h HIS 30 N -0.40 -0.34 0.06 4.77 3.86 -0.75 0.32 115.15 122.67 2abd h HIS 30 Ca 0.11 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.31 2abd h HIS 30 Cb 0.61 0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.17 2abd h HIS 30 CO -0.61 -0.17 -0.24 -0.92 0.86 0.00 0.00 177.93 176.85 2abd h TYR 31 N -0.42 -0.68 -0.95 2.45 3.20 0.34 0.36 116.97 121.27 2abd h TYR 31 Ca -0.04 0.02 0.27 0.00 3.14 0.00 0.00 58.73 62.12 2abd h TYR 31 Cb 0.32 0.29 -0.17 0.00 1.54 0.00 0.00 36.73 38.71 2abd h TYR 31 CO -0.04 -0.27 0.13 0.87 -1.64 0.00 0.00 178.16 177.21 2abd h LYS 32 N -0.34 0.06 -0.09 1.82 1.79 -0.37 0.28 116.57 119.74 2abd h LYS 32 Ca -0.00 -0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2abd h LYS 32 Cb 0.34 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.97 2abd h LYS 32 CO -0.13 0.04 -0.06 1.96 -1.08 0.00 0.00 179.45 180.18 2abd h GLN 33 N 0.06 0.19 -0.67 3.15 1.08 0.24 0.29 115.11 119.44 2abd h GLN 33 Ca 0.60 -0.09 0.08 0.00 -1.45 0.00 0.00 58.65 57.79 2abd h GLN 33 Cb 1.28 -0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.66 2abd h GLN 33 CO -0.82 0.58 0.45 0.00 -0.95 0.00 0.00 178.83 178.08 2abd h ALA 34 N 0.60 1.81 0.00 3.87 0.00 0.20 -3.03 119.26 122.72 2abd h ALA 34 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2abd h ALA 34 Cb 0.54 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2abd h ALA 34 CO 0.02 0.07 -0.74 0.25 0.00 0.00 0.00 179.25 178.84 2abd n THR 35 N -4.48 1.20 -0.05 0.00 -2.24 0.76 -4.82 114.28 104.64 2abd n THR 35 Ca 0.10 0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 62.01 2abd n THR 35 Cb 0.28 -2.19 -0.09 0.00 -2.10 0.00 0.00 70.33 66.23 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 -0.80 1.18 0.00 2.28 2.07 -0.85 -3.51 116.25 116.62 2abd h VAL 36 Ca 0.00 -1.83 0.00 0.00 0.82 0.00 0.00 66.70 65.69 2abd h VAL 36 Cb 0.74 2.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 2abd h VAL 36 CO 0.00 0.39 0.00 0.61 0.02 0.00 0.00 177.57 178.59 2abd n GLY 37 N 1.56 0.04 3.55 2.17 0.00 0.70 -5.00 105.19 108.21 2abd n GLY 37 Ca -0.07 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 43.87 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 4.74 0.00 1.61 1.11 -1.26 -3.71 116.67 115.16 2abd s ASP 38 Ca 0.00 0.34 0.00 0.00 0.18 0.00 0.00 52.55 53.07 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 -2.87 0.00 0.00 1.18 0.00 0.00 175.17 173.48 2abd n ILE 39 N 7.85 0.00 -1.95 0.77 3.06 -1.26 -4.78 119.36 123.06 2abd n ILE 39 Ca 0.34 0.00 -0.25 0.00 -2.50 0.00 0.00 62.75 60.33 2abd n ILE 39 Cb 0.51 0.00 0.03 0.00 0.54 0.00 0.00 39.64 40.71 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 5.26 -0.02 9.51 6.94 -1.26 -4.59 115.26 131.10 2abd n ASN 40 Ca 0.00 -3.75 -0.04 0.00 -0.02 0.00 0.00 54.58 50.77 2abd n ASN 40 Cb 0.00 -0.42 -0.01 0.00 -2.36 0.00 0.00 39.78 36.99 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 -0.73 0.27 0.00 5.53 -2.24 -1.26 -5.15 114.28 110.70 2abd n THR 41 Ca 0.46 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 62.21 2abd n THR 41 Cb 0.92 -1.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 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 -3.20 0.00 -2.07 -0.78 1.02 -1.26 -5.05 120.64 109.30 2abd n GLU 42 Ca -0.07 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.65 2abd n GLU 42 Cb 0.52 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.91 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 -3.29 4.27 0.52 3.49 3.52 -1.26 -5.00 118.95 121.21 2abd s ARG 43 Ca 0.00 2.19 -0.13 0.00 -0.13 0.00 0.00 55.73 57.66 2abd s ARG 43 Cb 0.00 -3.23 -0.10 0.00 -1.56 0.00 0.00 34.95 30.06 2abd s ARG 43 CO 0.00 -0.52 -0.72 -2.30 -0.81 0.00 0.00 175.30 170.95 2abd n PRO 44 N 4.06 0.00 0.00 5.12 -0.02 -1.26 -5.06 135.00 137.84 2abd n PRO 44 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2abd n PRO 44 Cb 0.41 -0.52 0.00 0.00 -0.02 0.00 0.00 33.50 33.36 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 1.83 0.00 0.00 -1.23 0.00 -1.26 -5.02 105.19 99.52 2abd n GLY 45 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.79 0.00 -1.24 1.61 2.81 -1.26 -4.75 117.12 112.50 2abd n MET 46 Ca 0.00 0.01 -0.30 0.00 -1.81 0.00 0.00 57.70 55.60 2abd n MET 46 Cb 0.00 -0.17 0.09 0.00 -0.71 0.00 0.00 33.22 32.44 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 -1.59 7.32 -0.02 4.03 4.77 -1.26 -4.80 117.00 125.46 2abd n LEU 47 Ca 0.00 -4.01 0.02 0.00 -0.03 0.00 0.00 56.01 51.99 2abd n LEU 47 Cb 0.00 -0.95 0.03 0.00 -2.33 0.00 0.00 43.42 40.17 2abd n LEU 47 CO 0.00 1.35 0.06 0.47 -1.33 0.00 0.00 177.39 177.94 2abd n ASP 48 N -0.80 0.02 0.00 -1.43 9.92 -1.26 -3.62 116.55 119.38 2abd n ASP 48 Ca 0.58 0.10 0.00 0.00 -0.53 0.00 0.00 54.79 54.93 2abd n ASP 48 Cb 0.85 -0.05 0.00 0.00 -0.64 0.00 0.00 41.12 41.28 2abd n ASP 48 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 2abd n PHE 49 N -3.23 0.00 -1.42 1.24 3.72 -1.26 0.07 117.46 116.58 2abd n PHE 49 Ca 0.02 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.17 2abd n PHE 49 Cb 0.07 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 38.73 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 -1.79 2.54 0.07 -1.08 4.76 -1.24 -4.59 118.16 116.84 2abd n LYS 50 Ca 0.00 -3.32 0.00 0.00 -2.87 0.00 0.00 58.31 52.12 2abd n LYS 50 Cb 0.00 -2.18 0.00 0.00 -1.84 0.00 0.00 35.03 31.01 2abd n LYS 50 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2abd n GLY 51 N -0.99 -0.11 0.01 0.72 0.00 0.11 -4.86 105.19 100.06 2abd n GLY 51 Ca 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.56 2abd n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2abd n LYS 52 N -3.32 -0.01 -0.33 1.61 5.02 -0.54 -0.17 118.16 120.43 2abd n LYS 52 Ca 0.00 0.25 0.02 0.00 -2.02 0.00 0.00 58.31 56.56 2abd n LYS 52 Cb 0.08 -0.37 0.07 0.00 -0.02 0.00 0.00 35.03 34.79 2abd n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2abd n ALA 53 N -2.33 0.03 -0.11 7.82 0.00 -1.26 0.87 120.51 125.54 2abd n ALA 53 Ca 0.00 0.93 -0.05 0.00 0.00 0.00 0.00 53.44 54.32 2abd n ALA 53 Cb 0.00 -0.48 0.02 0.00 0.00 0.00 0.00 19.45 18.99 2abd n ALA 53 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2abd h LYS 54 N 0.00 0.10 0.26 0.00 6.56 -0.89 0.51 116.57 123.11 2abd h LYS 54 Ca 0.36 -0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.94 2abd h LYS 54 Cb 0.59 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.20 2abd h LYS 54 CO -0.90 0.06 -0.38 2.35 -2.06 0.00 0.00 179.45 178.53 2abd h TRP 55 N 0.10 -1.06 -0.19 -1.35 7.01 0.71 -0.69 115.95 120.48 2abd h TRP 55 Ca 0.18 0.02 0.05 0.00 2.11 0.00 0.00 58.89 61.25 2abd h TRP 55 Cb 0.25 0.43 -0.06 0.00 -2.10 0.00 0.00 29.16 27.67 2abd h TRP 55 CO -0.25 -0.47 -0.20 -0.44 -2.79 0.00 0.00 178.44 174.29 2abd h ASP 56 N -0.67 -0.63 -0.44 2.65 5.19 -0.23 0.40 116.42 122.70 2abd h ASP 56 Ca -0.03 0.12 0.07 0.00 -0.62 0.00 0.00 57.03 56.57 2abd h ASP 56 Cb 0.61 0.30 -0.06 0.00 0.18 0.00 0.00 39.33 40.35 2abd h ASP 56 CO -0.11 -0.24 0.08 0.00 -3.12 0.00 0.00 179.24 175.85 2abd h ALA 57 N 0.83 0.47 0.29 3.45 0.00 0.15 0.25 119.26 124.71 2abd h ALA 57 Ca 0.12 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2abd h ALA 57 Cb 0.40 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2abd h ALA 57 CO -0.32 -0.32 -0.14 2.35 0.00 0.00 0.00 179.25 180.82 2abd h TRP 58 N 0.21 -0.37 -0.89 0.00 7.01 -0.54 -2.96 115.95 118.41 2abd h TRP 58 Ca 0.22 -0.01 0.19 0.00 2.11 0.00 0.00 58.89 61.40 2abd h TRP 58 Cb 0.28 0.12 -0.17 0.00 -2.10 0.00 0.00 29.16 27.29 2abd h TRP 58 CO -0.22 -0.09 -0.14 -0.97 -2.79 0.00 0.00 178.44 174.23 2abd h ASN 59 N -0.62 -0.69 -0.90 2.65 -1.24 0.54 0.12 115.58 115.44 2abd h ASN 59 Ca -0.04 0.26 0.26 0.00 0.71 0.00 0.00 56.30 57.49 2abd h ASN 59 Cb 0.44 0.51 -0.04 0.00 0.73 0.00 0.00 38.32 39.97 2abd h ASN 59 CO 0.07 -0.29 0.97 -0.08 -1.29 0.00 0.00 177.43 176.81 2abd h GLU 60 N 0.02 0.00 0.17 6.67 4.81 -0.36 0.59 114.58 126.48 2abd h GLU 60 Ca 0.46 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 59.33 2abd h GLU 60 Cb 0.77 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.15 2abd h GLU 60 CO -0.88 0.00 -1.82 -0.07 -0.73 0.00 0.00 179.01 175.51 2abd h LEU 61 N 0.00 0.56 0.00 1.64 3.38 -0.83 -3.48 115.31 116.58 2abd h LEU 61 Ca 0.43 -0.94 0.00 0.00 0.09 0.00 0.00 57.88 57.45 2abd h LEU 61 Cb 2.36 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.93 2abd h LEU 61 CO -0.00 1.81 0.00 1.17 0.09 0.00 0.00 178.44 181.51 2abd n LYS 62 N -3.57 0.00 0.00 1.13 4.81 0.20 0.16 118.16 120.89 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 1.07 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.12 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 1.71 3.80 3.14 0.00 -1.26 -4.99 105.19 107.59 2abd n GLY 63 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2abd n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2abd s THR 64 N -2.00 3.86 -0.77 2.61 2.01 0.12 -4.86 115.64 116.61 2abd s THR 64 Ca 0.00 1.24 -0.26 0.00 0.31 0.00 0.00 61.69 62.98 2abd s THR 64 Cb 0.00 -3.55 -0.17 0.00 0.01 0.00 0.00 72.50 68.80 2abd s THR 64 CO 0.00 -0.17 2.48 -1.20 -0.69 0.00 0.00 174.62 175.04 2abd n SER 65 N -0.64 1.06 -0.14 3.53 7.64 -1.26 -4.75 113.62 119.05 2abd n SER 65 Ca 0.08 -0.42 0.14 0.00 1.01 0.00 0.00 58.87 59.68 2abd n SER 65 Cb 0.52 -1.23 0.26 0.00 -1.01 0.00 0.00 64.21 62.75 2abd n SER 65 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2abd n LYS 66 N 8.36 -0.03 -0.07 1.43 5.02 -1.26 0.14 118.16 131.75 2abd n LYS 66 Ca 0.52 0.62 -0.10 0.00 -2.02 0.00 0.00 58.31 57.33 2abd n LYS 66 Cb 0.30 -1.12 -0.04 0.00 -0.02 0.00 0.00 35.03 34.16 2abd n LYS 66 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2abd h GLU 67 N 0.00 0.37 -0.33 1.97 3.07 -1.87 -0.79 114.58 116.98 2abd h GLU 67 Ca 0.38 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 59.18 2abd h GLU 67 Cb 1.00 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.83 2abd h GLU 67 CO -0.35 0.42 0.21 -0.44 -1.40 0.00 0.00 179.01 177.45 2abd h ASP 68 N 0.24 0.36 -0.52 1.42 3.32 0.88 0.89 116.42 123.01 2abd h ASP 68 Ca 0.08 -0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.23 2abd h ASP 68 Cb 0.19 -0.08 -0.09 0.00 0.22 0.00 0.00 39.33 39.57 2abd h ASP 68 CO -0.01 0.26 -0.04 0.00 -1.72 0.00 0.00 179.24 177.73 2abd h ALA 69 N 1.13 0.45 0.78 3.45 0.00 -0.83 0.27 119.26 124.51 2abd h ALA 69 Ca 0.13 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2abd h ALA 69 Cb -0.03 0.31 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2abd h ALA 69 CO -0.04 -0.41 -0.37 0.52 0.00 0.00 0.00 179.25 178.95 2abd h MET 70 N 0.07 -1.00 -0.36 0.00 2.86 -0.20 0.83 114.93 117.13 2abd h MET 70 Ca 0.26 0.07 0.03 0.00 -2.06 0.00 0.00 59.70 58.00 2abd h MET 70 Cb 0.40 0.23 -0.05 0.00 0.06 0.00 0.00 31.60 32.24 2abd h MET 70 CO -0.47 -0.67 -0.24 0.87 1.06 0.00 0.00 176.91 177.46 2abd h LYS 71 N -1.10 -0.03 -0.38 1.72 1.57 -0.39 -0.40 116.57 117.56 2abd h LYS 71 Ca -0.11 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.72 2abd h LYS 71 Cb 0.80 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 33.04 2abd h LYS 71 CO 0.17 -0.02 -0.53 0.00 -0.57 0.00 0.00 179.45 178.51 2abd h ALA 72 N -0.46 -0.76 -0.98 3.86 0.00 -0.51 0.33 119.26 120.73 2abd h ALA 72 Ca 0.06 -0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.10 2abd h ALA 72 Cb 0.18 1.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.93 2abd h ALA 72 CO -0.36 -1.01 -0.45 0.98 0.00 0.00 0.00 179.25 178.41 2abd n TYR 73 N -5.21 -0.12 0.22 0.00 9.36 0.28 0.00 117.16 121.69 2abd n TYR 73 Ca -0.03 1.22 -0.09 0.00 3.32 0.00 0.00 57.90 62.31 2abd n TYR 73 Cb 0.32 -0.77 -0.04 0.00 -0.63 0.00 0.00 39.34 38.22 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 -1.32 2.97 1.08 -0.29 0.15 117.51 120.10 2abd h ILE 74 Ca 0.28 -0.20 0.42 0.00 -0.39 0.00 0.00 64.86 64.97 2abd h ILE 74 Cb 0.53 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.19 2abd h ILE 74 CO -0.96 0.00 0.90 0.47 -0.69 0.00 0.00 178.15 177.88 2abd n ASP 75 N -4.12 0.09 -0.10 1.72 8.00 0.11 0.23 116.55 122.48 2abd n ASP 75 Ca -0.07 0.96 -0.19 0.00 0.71 0.00 0.00 54.79 56.19 2abd n ASP 75 Cb 0.23 -0.47 -0.12 0.00 -0.02 0.00 0.00 41.12 40.73 2abd n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2abd n LYS 76 N -3.94 0.67 -0.32 -1.24 4.76 0.10 -4.43 118.16 113.76 2abd n LYS 76 Ca 0.34 0.19 0.24 0.00 -2.87 0.00 0.00 58.31 56.20 2abd n LYS 76 Cb 1.42 -1.56 0.46 0.00 -1.84 0.00 0.00 35.03 33.50 2abd n LYS 76 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2abd h VAL 77 N -0.05 0.12 -0.53 -0.18 2.07 0.27 -1.13 116.25 116.83 2abd h VAL 77 Ca -0.55 -0.04 0.11 0.00 0.82 0.00 0.00 66.70 67.05 2abd h VAL 77 Cb 1.91 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 31.58 2abd h VAL 77 CO -0.07 0.02 -0.10 1.21 0.02 0.00 0.00 177.57 178.65 2abd n GLU 78 N -5.26 -0.05 -0.08 1.57 4.07 -1.05 0.22 120.64 120.08 2abd n GLU 78 Ca 0.31 0.81 -0.08 0.00 -0.06 0.00 0.00 57.16 58.14 2abd n GLU 78 Cb 1.02 -1.23 -0.02 0.00 -0.06 0.00 0.00 31.44 31.15 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 -0.27 -0.88 5.31 5.08 -1.52 0.57 114.58 122.88 2abd h GLU 79 Ca 0.27 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.67 2abd h GLU 79 Cb 0.44 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.70 2abd h GLU 79 CO -0.53 -0.18 0.57 -0.07 -1.00 0.00 0.00 179.01 177.80 2abd h LEU 80 N -0.28 0.96 -1.95 1.33 3.38 0.25 0.48 115.31 119.47 2abd h LEU 80 Ca 0.15 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2abd h LEU 80 Cb 0.52 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2abd h LEU 80 CO -0.46 0.67 -0.08 0.50 0.09 0.00 0.00 178.44 179.16 2abd h LYS 81 N 1.12 0.00 0.00 1.13 3.64 0.14 0.58 116.57 123.18 2abd h LYS 81 Ca 0.34 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.53 2abd h LYS 81 Cb -0.03 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2abd h LYS 81 CO -0.11 0.08 -1.90 1.17 -2.27 0.00 0.00 179.45 176.42 2abd n LYS 82 N -3.39 0.65 -0.07 1.90 3.00 0.17 -3.61 118.16 116.82 2abd n LYS 82 Ca -0.01 0.03 -0.22 0.00 -0.00 0.00 0.00 58.31 58.11 2abd n LYS 82 Cb 0.24 -1.63 -0.12 0.00 0.00 0.00 0.00 35.03 33.51 2abd n LYS 82 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2abd n LYS 83 N -2.67 0.67 -0.04 1.64 4.81 0.14 -4.86 118.16 117.85 2abd n LYS 83 Ca -0.16 0.29 -0.10 0.00 -0.87 0.00 0.00 58.31 57.48 2abd n LYS 83 Cb 0.87 -1.63 -0.03 0.00 0.02 0.00 0.00 35.03 34.26 2abd n LYS 83 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2abd n TYR 84 N -3.72 0.00 -0.53 5.64 4.01 0.18 -4.93 117.16 117.81 2abd n TYR 84 Ca -0.39 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.42 2abd n TYR 84 Cb 0.94 -0.34 -0.02 0.00 -0.31 0.00 0.00 39.34 39.61 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 2.41 -0.67 0.69 2.72 0.00 0.39 -3.64 105.19 107.10 2abd n GLY 85 Ca -0.17 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.54 2abd n GLY 85 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83