#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 0.00 0.00 4.33 7.27 -1.26 -5.09 117.38 122.63 2abd n GLN 2 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2abd n GLN 2 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2abd n GLN 2 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2abd n ALA 3 N -0.61 0.00 0.13 1.69 0.00 -1.26 -4.96 120.51 115.50 2abd n ALA 3 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2abd n ALA 3 Cb 0.00 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.67 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 2.49 -0.35 0.00 0.00 -1.26 -4.61 120.64 116.91 2abd n GLU 4 Ca 0.00 -2.30 -0.10 0.00 0.00 0.00 0.00 57.16 54.76 2abd n GLU 4 Cb 0.00 -1.49 -0.09 0.00 0.00 0.00 0.00 31.44 29.86 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 4.15 -1.66 0.00 -1.84 3.57 -1.93 1.18 116.94 120.40 2abd h PHE 5 Ca 0.00 0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2abd h PHE 5 Cb 0.95 0.83 -0.00 0.00 2.79 0.00 0.00 35.95 40.52 2abd h PHE 5 CO 0.29 -0.34 -0.03 -0.44 -2.23 0.00 0.00 178.31 175.56 2abd h ASP 6 N -0.03 0.00 -0.22 0.41 3.32 -1.99 0.28 116.42 118.19 2abd h ASP 6 Ca 0.13 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.03 2abd h ASP 6 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2abd h ASP 6 CO -0.80 0.03 -0.47 0.11 -1.72 0.00 0.00 179.24 176.38 2abd h LYS 7 N 0.00 0.71 0.64 3.56 1.79 0.76 0.22 116.57 124.25 2abd h LYS 7 Ca -0.00 -0.47 -0.03 0.00 -2.18 0.00 0.00 60.65 57.97 2abd h LYS 7 Cb 0.11 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 2abd h LYS 7 CO 0.00 1.09 -0.33 0.00 -1.08 0.00 0.00 179.45 179.14 2abd h ALA 8 N 0.62 -0.89 -0.76 3.86 0.00 0.34 -0.24 119.26 122.18 2abd h ALA 8 Ca 0.00 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 54.90 2abd h ALA 8 Cb 1.08 0.37 -0.13 0.00 0.00 0.00 0.00 17.79 19.11 2abd h ALA 8 CO 0.10 -1.00 0.04 0.00 0.00 0.00 0.00 179.25 178.39 2abd h ALA 9 N -0.54 0.83 -0.72 0.00 0.00 -0.47 0.37 119.26 118.74 2abd h ALA 9 Ca -0.09 0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2abd h ALA 9 Cb 0.69 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 2abd h ALA 9 CO 0.13 -0.42 0.42 1.49 0.00 0.00 0.00 179.25 180.87 2abd h GLU 10 N 0.12 0.75 0.18 0.00 4.81 0.24 -1.64 114.58 119.05 2abd h GLU 10 Ca 0.42 -0.05 -0.24 0.00 -0.13 0.00 0.00 59.36 59.36 2abd h GLU 10 Cb 0.75 -0.17 0.03 0.00 0.63 0.00 0.00 28.75 29.99 2abd h GLU 10 CO -0.65 0.50 -1.06 0.93 -0.73 0.00 0.00 179.01 178.00 2abd h GLU 11 N 0.78 0.39 -1.00 1.92 5.08 0.80 -3.31 114.58 119.24 2abd h GLU 11 Ca 0.31 -0.67 0.05 0.00 -1.00 0.00 0.00 59.36 58.05 2abd h GLU 11 Cb 0.16 0.25 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 2abd h GLU 11 CO -0.17 1.32 0.65 -0.24 -1.00 0.00 0.00 179.01 179.57 2abd h VAL 12 N -0.19 1.14 0.00 3.13 3.04 -0.33 0.96 116.25 124.01 2abd h VAL 12 Ca -0.18 -0.42 0.00 0.00 -1.01 0.00 0.00 66.70 65.08 2abd h VAL 12 Cb 1.84 -0.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.92 2abd h VAL 12 CO 0.20 0.22 0.00 0.29 -1.01 0.00 0.00 177.57 177.27 2abd n LYS 13 N -4.47 0.17 -0.02 4.17 5.02 -0.62 -3.23 118.16 119.18 2abd n LYS 13 Ca 0.14 0.13 -0.02 0.00 -2.02 0.00 0.00 58.31 56.54 2abd n LYS 13 Cb 0.13 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 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 -1.18 0.00 0.00 2.13 8.25 0.25 -5.07 115.22 119.60 2abd n HIS 14 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 2abd n HIS 14 Cb 0.05 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 30.94 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 -2.24 0.00 -0.09 2.41 4.77 -0.74 -4.62 117.00 116.49 2abd n LEU 15 Ca -0.08 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 55.98 2abd n LEU 15 Cb 0.64 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.87 2abd n LEU 15 CO 0.09 0.00 0.27 1.17 -1.33 0.00 0.00 177.39 177.59 2abd n LYS 16 N 0.00 -0.02 -4.53 3.23 4.81 0.15 -3.75 118.16 118.05 2abd n LYS 16 Ca 0.00 0.39 -0.28 0.00 -0.87 0.00 0.00 58.31 57.54 2abd n LYS 16 Cb 0.00 -0.67 -0.13 0.00 0.02 0.00 0.00 35.03 34.25 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 -4.60 2.10 -0.32 3.15 2.01 -1.26 -5.06 115.64 111.65 2abd s THR 17 Ca -0.03 -1.59 -0.29 0.00 0.31 0.00 0.00 61.69 60.10 2abd s THR 17 Cb 0.09 -1.85 -0.01 0.00 0.01 0.00 0.00 72.50 70.74 2abd s THR 17 CO 0.21 0.15 1.54 -0.75 -0.69 0.00 0.00 174.62 175.09 2abd s LYS 18 N -1.75 3.63 0.17 4.92 2.47 -1.25 -4.91 119.74 123.02 2abd s LYS 18 Ca 0.12 1.30 -0.32 0.00 -1.56 0.00 0.00 55.97 55.51 2abd s LYS 18 Cb -0.10 -4.05 -0.16 0.00 -1.46 0.00 0.00 37.83 32.06 2abd s LYS 18 CO 0.04 -1.49 1.03 -2.30 0.16 0.00 0.00 175.35 172.79 2abd n PRO 19 N 7.93 0.84 -1.47 4.03 -0.02 -1.26 -4.94 135.00 140.10 2abd n PRO 19 Ca 0.18 0.30 -0.33 0.00 -2.02 0.00 0.00 63.50 61.64 2abd n PRO 19 Cb 0.47 -1.70 0.08 0.00 -0.02 0.00 0.00 33.50 32.32 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 -0.38 2.25 0.07 3.55 0.00 -1.26 -4.64 121.76 121.35 2abd s ALA 20 Ca 0.73 0.54 -0.14 0.00 0.00 0.00 0.00 51.96 53.09 2abd s ALA 20 Cb -0.91 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 18.83 2abd s ALA 20 CO 0.54 -1.66 1.23 0.22 0.00 0.00 0.00 175.76 176.10 2abd h ASP 21 N -0.51 -0.92 0.00 0.00 1.82 -1.99 -0.14 116.42 114.68 2abd h ASP 21 Ca -0.46 0.14 0.03 0.00 -0.39 0.00 0.00 57.03 56.35 2abd h ASP 21 Cb 1.25 0.40 -0.04 0.00 0.68 0.00 0.00 39.33 41.62 2abd h ASP 21 CO 0.51 -0.11 -0.26 -0.33 -1.61 0.00 0.00 179.24 177.45 2abd h GLU 22 N -0.03 -0.38 -0.77 0.28 5.08 -1.99 0.34 114.58 117.12 2abd h GLU 22 Ca 0.06 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.59 2abd h GLU 22 Cb 0.19 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 29.39 2abd h GLU 22 CO -0.38 -0.25 -0.27 0.93 -1.00 0.00 0.00 179.01 178.03 2abd h GLU 23 N -0.40 -0.05 -0.18 2.33 3.07 -1.64 -1.15 114.58 116.57 2abd h GLU 23 Ca 0.06 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 58.79 2abd h GLU 23 Cb 0.48 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 2abd h GLU 23 CO -0.22 -0.03 -0.40 0.00 -1.40 0.00 0.00 179.01 176.96 2abd h MET 24 N -0.05 0.59 -0.66 2.33 -0.00 -0.60 -3.28 114.93 113.26 2abd h MET 24 Ca 0.33 -0.39 0.13 0.00 -0.00 0.00 0.00 59.70 59.77 2abd h MET 24 Cb 0.58 0.05 -0.12 0.00 -0.00 0.00 0.00 31.60 32.11 2abd h MET 24 CO -0.81 1.01 -0.17 1.28 -0.00 0.00 0.00 176.91 178.22 2abd n LEU 25 N -4.26 -0.25 0.09 -0.10 4.77 0.12 -0.07 117.00 117.29 2abd n LEU 25 Ca -0.06 1.13 -0.06 0.00 -0.03 0.00 0.00 56.01 57.00 2abd n LEU 25 Cb 0.53 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2abd n LEU 25 CO 0.45 -1.08 0.51 0.15 -1.33 0.00 0.00 177.39 176.09 2abd h PHE 26 N 0.00 -0.44 -0.44 -1.77 3.57 -1.58 0.33 116.94 116.60 2abd h PHE 26 Ca 0.31 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.86 2abd h PHE 26 Cb 0.48 0.17 -0.08 0.00 2.79 0.00 0.00 35.95 39.31 2abd h PHE 26 CO -0.51 -0.21 -0.50 0.82 -2.23 0.00 0.00 178.31 175.68 2abd h ILE 27 N -0.31 0.00 -0.26 1.41 5.03 -1.01 0.43 117.51 122.80 2abd h ILE 27 Ca -0.02 0.00 0.04 0.00 -0.12 0.00 0.00 64.86 64.76 2abd h ILE 27 Cb 0.27 0.00 -0.07 0.00 -3.03 0.00 0.00 36.82 33.99 2abd h ILE 27 CO -0.02 0.00 -0.50 0.22 -0.68 0.00 0.00 178.15 177.16 2abd h TYR 28 N -0.30 -1.53 -0.02 1.37 3.20 -0.39 0.96 116.97 120.26 2abd h TYR 28 Ca 0.08 0.07 0.03 0.00 3.14 0.00 0.00 58.73 62.05 2abd h TYR 28 Cb 0.51 0.70 -0.06 0.00 1.54 0.00 0.00 36.73 39.42 2abd h TYR 28 CO -0.76 -0.47 -0.37 0.66 -1.64 0.00 0.00 178.16 175.58 2abd h SER 29 N -0.44 -1.12 -0.16 -2.11 4.64 0.05 0.36 113.55 114.77 2abd h SER 29 Ca 0.05 0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 61.49 2abd h SER 29 Cb 0.58 0.45 -0.01 0.00 -0.31 0.00 0.00 62.40 63.11 2abd h SER 29 CO -0.48 -0.42 0.03 0.45 -0.87 0.00 0.00 176.83 175.54 2abd h HIS 30 N -0.51 0.29 -0.11 4.77 3.86 -0.71 -1.66 115.15 121.07 2abd h HIS 30 Ca 0.06 -0.04 0.02 0.00 -1.16 0.00 0.00 60.37 59.25 2abd h HIS 30 Cb 0.61 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.97 2abd h HIS 30 CO -0.40 0.43 -0.22 -0.92 0.86 0.00 0.00 177.93 177.69 2abd h TYR 31 N 0.06 -0.66 -0.86 2.45 3.20 0.13 0.34 116.97 121.63 2abd h TYR 31 Ca 0.05 0.03 0.22 0.00 3.14 0.00 0.00 58.73 62.16 2abd h TYR 31 Cb 0.30 0.30 -0.15 0.00 1.54 0.00 0.00 36.73 38.72 2abd h TYR 31 CO 0.02 -0.21 0.05 0.87 -1.64 0.00 0.00 178.16 177.26 2abd h LYS 32 N -0.19 0.09 0.93 1.82 1.79 -0.24 0.31 116.57 121.08 2abd h LYS 32 Ca 0.02 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.44 2abd h LYS 32 Cb 0.25 -0.02 0.01 0.00 -1.58 0.00 0.00 32.23 30.89 2abd h LYS 32 CO -0.21 0.06 -0.47 1.96 -1.08 0.00 0.00 179.45 179.71 2abd h GLN 33 N 0.10 -1.24 -0.86 3.15 1.08 0.40 0.69 115.11 118.42 2abd h GLN 33 Ca 0.50 0.08 0.22 0.00 -1.45 0.00 0.00 58.65 58.01 2abd h GLN 33 Cb 0.96 0.28 -0.14 0.00 -0.05 0.00 0.00 27.48 28.53 2abd h GLN 33 CO -0.75 -0.82 0.24 0.00 -0.95 0.00 0.00 178.83 176.54 2abd h ALA 34 N -1.23 1.24 0.00 3.87 0.00 0.99 -1.49 119.26 122.64 2abd h ALA 34 Ca -0.13 0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2abd h ALA 34 Cb 0.99 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2abd h ALA 34 CO 0.19 -0.44 -0.05 1.79 0.00 0.00 0.00 179.25 180.74 2abd h THR 35 N 0.23 0.00 0.06 0.00 1.35 -0.35 -3.45 112.91 110.75 2abd h THR 35 Ca 0.53 -0.17 -0.00 0.00 -0.55 0.00 0.00 66.41 66.22 2abd h THR 35 Cb 1.05 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.47 2abd h THR 35 CO -0.63 0.00 -0.03 0.58 -0.25 0.00 0.00 175.52 175.20 2abd h VAL 36 N -0.17 0.37 0.00 6.82 2.07 0.04 -3.50 116.25 121.87 2abd h VAL 36 Ca 0.00 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.33 2abd h VAL 36 Cb 0.05 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2abd h VAL 36 CO 0.00 0.12 0.00 0.61 0.02 0.00 0.00 177.57 178.32 2abd n GLY 37 N 1.51 0.25 3.77 2.17 0.00 0.14 -4.97 105.19 108.07 2abd n GLY 37 Ca -0.03 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.32 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 5.62 -0.91 1.61 1.11 -1.26 -3.30 116.67 115.54 2abd s ASP 38 Ca 0.00 2.16 -0.25 0.00 0.18 0.00 0.00 52.55 54.64 2abd s ASP 38 Cb 0.00 -2.58 -0.12 0.00 1.07 0.00 0.00 42.92 41.29 2abd s ASP 38 CO 0.00 -1.29 2.19 -0.51 1.18 0.00 0.00 175.17 176.74 2abd s ILE 39 N -1.84 3.18 -0.60 0.77 2.07 -1.26 -4.66 121.20 118.86 2abd s ILE 39 Ca 0.72 -0.20 -0.00 0.00 -1.41 0.00 0.00 60.65 59.76 2abd s ILE 39 Cb -0.24 -3.60 0.52 0.00 0.13 0.00 0.00 42.46 39.27 2abd s ILE 39 CO 0.29 -0.37 2.00 0.59 -1.91 0.00 0.00 174.94 175.54 2abd n ASN 40 N 17.19 6.44 0.00 4.50 3.02 -1.26 -4.72 115.26 140.42 2abd n ASN 40 Ca 0.44 -3.73 0.00 0.00 -0.03 0.00 0.00 54.58 51.26 2abd n ASN 40 Cb 0.45 -0.94 0.00 0.00 -0.61 0.00 0.00 39.78 38.69 2abd n ASN 40 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2abd n THR 41 N -0.98 0.00 -3.55 3.41 -2.24 -1.26 -5.18 114.28 104.48 2abd n THR 41 Ca 0.62 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 62.29 2abd n THR 41 Cb 0.99 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.17 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 3.95 0.74 -0.52 -0.78 -1.05 -1.26 -5.13 118.70 114.64 2abd s GLU 42 Ca 0.00 0.03 -0.29 0.00 -0.15 0.00 0.00 54.97 54.56 2abd s GLU 42 Cb 0.00 0.34 0.03 0.00 -0.44 0.00 0.00 34.13 34.06 2abd s GLU 42 CO 0.00 -0.26 1.23 0.50 0.95 0.00 0.00 175.26 177.68 2abd s ARG 43 N -1.73 3.57 0.00 -4.83 3.52 -1.26 -4.89 118.95 113.32 2abd s ARG 43 Ca -0.01 0.46 0.00 0.00 -0.13 0.00 0.00 55.73 56.05 2abd s ARG 43 Cb -0.01 -3.99 0.00 0.00 -1.56 0.00 0.00 34.95 29.39 2abd s ARG 43 CO -0.00 -1.60 0.00 -2.30 -0.81 0.00 0.00 175.30 170.59 2abd n PRO 44 N 8.23 1.25 0.00 5.12 -0.02 -1.26 -5.01 135.00 143.30 2abd n PRO 44 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2abd n PRO 44 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 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 0.00 1.41 0.00 -1.23 0.00 -1.26 -4.79 105.19 99.31 2abd n GLY 45 Ca 0.00 0.00 0.00 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 0.00 0.00 -1.26 1.61 2.81 -1.26 -4.84 117.12 114.18 2abd n MET 46 Ca 0.00 0.00 -0.30 0.00 -1.81 0.00 0.00 57.70 55.59 2abd n MET 46 Cb 0.00 0.00 0.11 0.00 -0.71 0.00 0.00 33.22 32.62 2abd n MET 46 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2abd n LEU 47 N 0.00 7.29 -0.10 4.03 -0.00 -1.26 -4.39 117.00 122.57 2abd n LEU 47 Ca 0.00 -3.99 -0.15 0.00 -0.00 0.00 0.00 56.01 51.87 2abd n LEU 47 Cb 0.00 -0.93 -0.05 0.00 -0.00 0.00 0.00 43.42 42.44 2abd n LEU 47 CO 0.00 1.31 -0.91 -0.90 -0.00 0.00 0.00 177.39 176.89 2abd n ASP 48 N -0.92 1.94 0.00 1.96 5.75 -1.26 -4.96 116.55 119.07 2abd n ASP 48 Ca 0.60 0.33 0.00 0.00 -0.01 0.00 0.00 54.79 55.71 2abd n ASP 48 Cb 0.98 -0.76 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 2abd n ASP 48 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2abd n PHE 49 N -4.40 0.00 -1.09 2.11 3.72 -1.26 -4.17 117.46 112.37 2abd n PHE 49 Ca -0.26 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 56.88 2abd n PHE 49 Cb 0.63 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 39.28 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 0.00 2.29 -0.01 -1.08 5.02 -1.26 -4.24 118.16 118.88 2abd n LYS 50 Ca 0.00 -2.75 -0.01 0.00 -2.02 0.00 0.00 58.31 53.53 2abd n LYS 50 Cb 0.00 -2.08 -0.00 0.00 -0.02 0.00 0.00 35.03 32.93 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 -0.76 -0.35 0.00 0.72 0.00 -1.26 -4.64 105.19 98.91 2abd n GLY 51 Ca 0.54 -0.04 -0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -2.79 -0.00 -0.36 1.61 5.02 -1.26 -0.15 118.16 120.23 2abd n LYS 52 Ca -0.02 0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.19 2abd n LYS 52 Cb 0.06 -0.01 -0.08 0.00 -0.02 0.00 0.00 35.03 34.99 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 -4.00 -0.51 -0.22 7.82 0.00 -1.26 0.51 120.51 122.84 2abd n ALA 53 Ca 0.00 0.75 -0.01 0.00 0.00 0.00 0.00 53.44 54.18 2abd n ALA 53 Cb 0.00 -0.15 0.06 0.00 0.00 0.00 0.00 19.45 19.37 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 -0.02 0.46 0.00 6.56 -0.84 0.32 116.57 123.06 2abd h LYS 54 Ca 0.15 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.73 2abd h LYS 54 Cb 0.37 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.01 2abd h LYS 54 CO -0.82 -0.01 -0.41 2.35 -2.06 0.00 0.00 179.45 178.50 2abd h TRP 55 N -0.02 -1.12 0.21 -1.35 7.01 -0.03 -2.06 115.95 118.59 2abd h TRP 55 Ca 0.31 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.33 2abd h TRP 55 Cb 0.50 0.43 -0.03 0.00 -2.10 0.00 0.00 29.16 27.96 2abd h TRP 55 CO -0.55 -0.58 -0.29 -0.44 -2.79 0.00 0.00 178.44 173.79 2abd h ASP 56 N -0.87 -0.82 -0.80 2.65 3.32 0.05 0.42 116.42 120.36 2abd h ASP 56 Ca -0.05 0.08 0.16 0.00 0.02 0.00 0.00 57.03 57.25 2abd h ASP 56 Cb 0.76 0.29 -0.15 0.00 0.22 0.00 0.00 39.33 40.45 2abd h ASP 56 CO -0.04 -0.40 -0.22 0.00 -1.72 0.00 0.00 179.24 176.86 2abd h ALA 57 N 0.06 0.47 0.26 3.45 0.00 -0.30 0.17 119.26 123.38 2abd h ALA 57 Ca 0.01 0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 2abd h ALA 57 Cb 0.55 0.65 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2abd h ALA 57 CO -0.11 -0.43 -0.13 2.35 0.00 0.00 0.00 179.25 180.93 2abd h TRP 58 N -0.01 -0.33 -0.95 0.00 7.01 -0.78 -3.23 115.95 117.65 2abd h TRP 58 Ca 0.38 -0.01 0.22 0.00 2.11 0.00 0.00 58.89 61.59 2abd h TRP 58 Cb 0.59 0.11 -0.18 0.00 -2.10 0.00 0.00 29.16 27.58 2abd h TRP 58 CO -0.65 0.03 -0.11 -0.97 -2.79 0.00 0.00 178.44 173.95 2abd h ASN 59 N -0.76 -0.67 -0.67 2.65 -1.24 0.13 0.18 115.58 115.20 2abd h ASN 59 Ca -0.04 0.28 0.19 0.00 0.71 0.00 0.00 56.30 57.44 2abd h ASN 59 Cb 0.50 0.53 -0.03 0.00 0.73 0.00 0.00 38.32 40.05 2abd h ASN 59 CO 0.06 -0.32 0.99 -0.33 -1.29 0.00 0.00 177.43 176.54 2abd h GLU 60 N 0.01 0.00 0.00 6.67 4.39 -0.76 0.46 114.58 125.36 2abd h GLU 60 Ca 0.51 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.95 2abd h GLU 60 Cb 0.92 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.53 2abd h GLU 60 CO -0.93 0.00 -1.92 1.28 -1.16 0.00 0.00 179.01 176.28 2abd n LEU 61 N -3.15 0.47 0.00 1.33 4.77 0.62 -4.95 117.00 116.08 2abd n LEU 61 Ca 0.15 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2abd n LEU 61 Cb 1.20 0.26 0.00 0.00 -2.33 0.00 0.00 43.42 42.55 2abd n LEU 61 CO 0.19 0.34 0.00 1.17 -1.33 0.00 0.00 177.39 177.76 2abd n LYS 62 N -2.83 0.00 0.00 3.23 0.00 0.16 0.12 118.16 118.84 2abd n LYS 62 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.11 2abd n LYS 62 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 36.03 2abd n LYS 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2abd n GLY 63 N 0.00 1.16 3.75 3.14 0.00 -1.26 -4.94 105.19 107.03 2abd n GLY 63 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.50 2.03 -0.21 2.61 -1.32 0.31 -4.81 115.64 112.75 2abd s THR 64 Ca 0.00 0.02 -0.32 0.00 -1.21 0.00 0.00 61.69 60.18 2abd s THR 64 Cb 0.00 -3.01 -0.09 0.00 -1.51 0.00 0.00 72.50 67.89 2abd s THR 64 CO 0.00 -0.00 2.09 -1.20 -2.21 0.00 0.00 174.62 173.30 2abd n SER 65 N -1.19 3.01 -0.04 8.08 7.64 -1.26 -4.76 113.62 125.10 2abd n SER 65 Ca 0.11 0.55 0.01 0.00 1.01 0.00 0.00 58.87 60.55 2abd n SER 65 Cb 0.45 -1.40 0.03 0.00 -1.01 0.00 0.00 64.21 62.28 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 7.86 -0.01 -0.02 1.43 4.76 -1.26 0.97 118.16 131.88 2abd n LYS 66 Ca 0.31 0.18 -0.13 0.00 -2.87 0.00 0.00 58.31 55.79 2abd n LYS 66 Cb 0.33 -0.28 -0.10 0.00 -1.84 0.00 0.00 35.03 33.14 2abd n LYS 66 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 2abd h GLU 67 N 0.00 0.00 -0.82 1.97 4.22 -1.90 -3.17 114.58 114.89 2abd h GLU 67 Ca 0.07 -0.00 0.19 0.00 0.08 0.00 0.00 59.36 59.70 2abd h GLU 67 Cb 0.13 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.23 2abd h GLU 67 CO -0.11 0.57 -0.01 -0.44 -2.18 0.00 0.00 179.01 176.83 2abd h ASP 68 N -0.56 -0.42 -0.70 1.04 5.19 0.26 0.47 116.42 121.71 2abd h ASP 68 Ca 0.00 0.22 0.15 0.00 -0.62 0.00 0.00 57.03 56.78 2abd h ASP 68 Cb 0.56 0.40 -0.11 0.00 0.18 0.00 0.00 39.33 40.36 2abd h ASP 68 CO 0.00 -0.23 0.10 0.00 -3.12 0.00 0.00 179.24 175.99 2abd h ALA 69 N 1.79 0.82 0.40 3.45 0.00 -1.48 0.13 119.26 124.38 2abd h ALA 69 Ca 0.46 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.53 2abd h ALA 69 Cb 0.83 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2abd h ALA 69 CO -0.75 -0.37 -0.19 0.52 0.00 0.00 0.00 179.25 178.46 2abd h MET 70 N 0.20 -0.51 -0.76 0.00 2.86 -0.23 0.14 114.93 116.62 2abd h MET 70 Ca 0.39 0.03 0.07 0.00 -2.06 0.00 0.00 59.70 58.13 2abd h MET 70 Cb 0.66 0.12 -0.09 0.00 0.06 0.00 0.00 31.60 32.34 2abd h MET 70 CO -0.54 -0.34 -0.47 0.87 1.06 0.00 0.00 176.91 177.49 2abd h LYS 71 N -1.05 -0.02 -0.07 1.72 1.57 -0.29 0.33 116.57 118.75 2abd h LYS 71 Ca -0.05 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2abd h LYS 71 Cb 0.41 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.68 2abd h LYS 71 CO 0.09 -0.02 -0.42 0.00 -0.57 0.00 0.00 179.45 178.53 2abd h ALA 72 N 0.16 -0.81 -0.62 3.86 0.00 -0.83 0.54 119.26 121.54 2abd h ALA 72 Ca 0.12 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.08 2abd h ALA 72 Cb 0.34 0.90 -0.10 0.00 0.00 0.00 0.00 17.79 18.93 2abd h ALA 72 CO -0.73 -0.96 -0.24 0.98 0.00 0.00 0.00 179.25 178.30 2abd n TYR 73 N -4.80 0.02 0.11 0.00 9.36 0.97 0.40 117.16 123.22 2abd n TYR 73 Ca -0.05 0.77 -0.05 0.00 3.32 0.00 0.00 57.90 61.88 2abd n TYR 73 Cb 0.30 -0.74 -0.03 0.00 -0.63 0.00 0.00 39.34 38.25 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 -1.62 2.97 2.04 -0.52 -1.35 117.51 119.04 2abd h ILE 74 Ca 0.22 -0.69 0.47 0.00 1.00 0.00 0.00 64.86 65.86 2abd h ILE 74 Cb 0.37 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.39 2abd h ILE 74 CO -0.62 0.00 1.20 0.44 0.00 0.00 0.00 178.15 179.18 2abd h ASP 75 N -1.05 0.00 0.13 1.72 3.32 0.16 0.67 116.42 121.37 2abd h ASP 75 Ca -0.04 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.66 2abd h ASP 75 Cb 0.27 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.76 2abd h ASP 75 CO 0.06 0.00 -2.21 1.17 -1.72 0.00 0.00 179.24 176.54 2abd n LYS 76 N -3.96 0.68 -0.33 3.56 0.00 0.16 -4.20 118.16 114.07 2abd n LYS 76 Ca 0.36 0.12 0.13 0.00 0.00 0.00 0.00 58.31 58.92 2abd n LYS 76 Cb 1.70 -1.60 0.31 0.00 0.00 0.00 0.00 35.03 35.44 2abd n LYS 76 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2abd h VAL 77 N 0.01 0.65 -1.71 3.15 2.07 0.15 0.43 116.25 121.00 2abd h VAL 77 Ca -0.48 -0.23 0.49 0.00 0.82 0.00 0.00 66.70 67.31 2abd h VAL 77 Cb 2.11 -0.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 2abd h VAL 77 CO 0.02 0.12 1.34 -0.08 0.02 0.00 0.00 177.57 178.99 2abd h GLU 78 N 0.66 0.00 0.00 1.57 4.57 -1.60 0.92 114.58 120.69 2abd h GLU 78 Ca 0.57 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.75 2abd h GLU 78 Cb 0.93 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.52 2abd h GLU 78 CO -0.42 0.00 -0.00 0.93 -1.18 0.00 0.00 179.01 178.34 2abd h GLU 79 N 0.00 -0.00 -0.68 1.92 5.08 -1.17 -3.19 114.58 116.54 2abd h GLU 79 Ca 0.81 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 59.22 2abd h GLU 79 Cb 3.48 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 32.68 2abd h GLU 79 CO -0.01 0.62 0.40 -0.07 -1.00 0.00 0.00 179.01 178.95 2abd h LEU 80 N -0.62 0.63 -1.51 1.33 3.38 0.64 0.21 115.31 119.37 2abd h LEU 80 Ca -0.00 0.02 0.14 0.00 0.09 0.00 0.00 57.88 58.12 2abd h LEU 80 Cb 0.62 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2abd h LEU 80 CO 0.00 0.42 0.71 0.50 0.09 0.00 0.00 178.44 180.15 2abd h LYS 81 N 0.76 0.00 0.00 1.13 3.64 -0.95 0.42 116.57 121.57 2abd h LYS 81 Ca 0.29 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.44 2abd h LYS 81 Cb 0.11 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 2abd h LYS 81 CO -0.15 0.00 -1.74 1.63 -2.27 0.00 0.00 179.45 176.93 2abd n LYS 82 N -3.30 0.56 -0.16 1.90 5.02 0.52 -2.25 118.16 120.46 2abd n LYS 82 Ca 0.09 0.25 -0.03 0.00 -2.02 0.00 0.00 58.31 56.60 2abd n LYS 82 Cb 0.88 -1.47 0.03 0.00 -0.02 0.00 0.00 35.03 34.45 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 -0.04 0.00 1.97 3.64 -0.16 -3.36 116.57 117.62 2abd h LYS 83 Ca -0.35 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 58.93 2abd h LYS 83 Cb 1.29 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 2abd h LYS 83 CO -0.21 -0.03 -1.06 0.66 -2.27 0.00 0.00 179.45 176.54 2abd n TYR 84 N -5.38 0.00 -4.67 1.91 4.01 0.11 -4.96 117.16 108.18 2abd n TYR 84 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 2abd n TYR 84 Cb 0.29 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 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 2.40 0.98 0.31 2.72 0.00 0.99 -4.01 105.19 108.58 2abd n GLY 85 Ca -0.15 -0.69 0.04 0.00 0.00 0.00 0.00 46.02 45.21 2abd n GLY 85 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83