#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ctr s SER 2 N 0.00 1.76 0.00 1.61 0.15 -1.26 -5.17 113.70 110.80 2ctr s SER 2 Ca 0.00 -1.52 0.07 0.00 0.70 0.00 0.00 55.95 55.21 2ctr s SER 2 Cb 0.00 0.30 -0.02 0.00 -1.71 0.00 0.00 66.02 64.59 2ctr s SER 2 CO 0.00 -0.83 -0.23 -0.94 1.20 0.00 0.00 173.24 172.45 2ctr s SER 3 N -3.41 2.68 0.52 5.45 1.04 -1.26 -5.07 113.70 113.65 2ctr s SER 3 Ca 0.34 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.32 2ctr s SER 3 Cb 0.06 -0.27 0.00 0.00 0.10 0.00 0.00 66.02 65.90 2ctr s SER 3 CO 0.16 0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.24 2ctr n GLY 4 N 2.28 -1.63 3.37 7.32 0.00 -1.26 -4.96 105.19 110.31 2ctr n GLY 4 Ca -0.16 -1.11 -0.19 0.00 0.00 0.00 0.00 46.02 44.57 2ctr n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ctr s SER 5 N -6.33 2.16 0.36 1.61 0.01 -1.26 -4.96 113.70 105.30 2ctr s SER 5 Ca 0.00 -1.21 -0.28 0.00 1.31 0.00 0.00 55.95 55.76 2ctr s SER 5 Cb 0.00 -0.05 -0.11 0.00 0.21 0.00 0.00 66.02 66.07 2ctr s SER 5 CO 0.00 -0.46 1.51 -0.44 0.41 0.00 0.00 173.24 174.26 2ctr s SER 6 N -3.36 6.35 0.00 2.44 0.01 -1.26 -4.87 113.70 113.01 2ctr s SER 6 Ca 0.29 3.03 0.00 0.00 1.31 0.00 0.00 55.95 60.58 2ctr s SER 6 Cb 0.05 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2ctr s SER 6 CO 0.10 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.48 2ctr n GLY 7 N 0.80 -1.06 3.91 3.44 0.00 -1.26 -5.08 105.19 105.93 2ctr n GLY 7 Ca 0.02 0.27 -0.31 0.00 0.00 0.00 0.00 46.02 46.01 2ctr n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ctr s SER 8 N -0.03 6.31 0.10 1.61 0.01 -1.26 -4.95 113.70 115.49 2ctr s SER 8 Ca 0.00 0.25 -0.26 0.00 1.31 0.00 0.00 55.95 57.25 2ctr s SER 8 Cb 0.00 -1.93 -0.08 0.00 0.21 0.00 0.00 66.02 64.22 2ctr s SER 8 CO 0.00 0.17 1.43 1.88 0.41 0.00 0.00 173.24 177.13 2ctr h TYR 9 N 3.08 -1.36 -1.47 2.43 0.05 -1.96 0.35 116.97 118.08 2ctr h TYR 9 Ca -0.45 0.07 0.46 0.00 0.05 0.00 0.00 58.73 58.85 2ctr h TYR 9 Cb 1.16 0.64 -0.09 0.00 1.01 0.00 0.00 36.73 39.45 2ctr h TYR 9 CO 0.61 -0.38 1.02 0.66 -1.05 0.00 0.00 178.16 179.02 2ctr n TYR 10 N -4.81 0.26 -0.03 4.88 4.01 -1.26 0.14 117.16 120.35 2ctr n TYR 10 Ca -0.02 0.26 -0.20 0.00 -0.16 0.00 0.00 57.90 57.77 2ctr n TYR 10 Cb 0.26 -0.68 -0.13 0.00 -0.31 0.00 0.00 39.34 38.48 2ctr n TYR 10 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2ctr h ASP 11 N 0.00 0.24 -0.93 7.72 5.19 -0.63 0.30 116.42 128.31 2ctr h ASP 11 Ca 0.78 -0.80 0.10 0.00 -0.62 0.00 0.00 57.03 56.49 2ctr h ASP 11 Cb 2.88 -0.08 -0.07 0.00 0.18 0.00 0.00 39.33 42.25 2ctr h ASP 11 CO -0.18 1.50 0.60 0.40 -3.12 0.00 0.00 179.24 178.44 2ctr h ILE 12 N -0.56 0.97 0.01 0.35 2.04 0.32 -2.39 117.51 118.25 2ctr h ILE 12 Ca -0.27 -0.32 -0.30 0.00 1.00 0.00 0.00 64.86 64.97 2ctr h ILE 12 Cb 1.55 -0.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.52 2ctr h ILE 12 CO -0.01 0.17 -1.78 0.18 0.00 0.00 0.00 178.15 176.72 2ctr n LEU 13 N -4.54 1.04 -0.03 1.44 4.77 0.40 -4.86 117.00 115.22 2ctr n LEU 13 Ca 0.16 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 2ctr n LEU 13 Cb 0.31 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2ctr n LEU 13 CO 0.30 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 2ctr n GLY 14 N 1.62 1.24 3.48 -0.72 0.00 -0.28 -4.74 105.19 105.79 2ctr n GLY 14 Ca -0.19 -0.39 -0.28 0.00 0.00 0.00 0.00 46.02 45.16 2ctr n GLY 14 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ctr s VAL 15 N -2.05 2.73 0.98 1.61 -7.23 0.91 -4.99 120.40 112.35 2ctr s VAL 15 Ca 0.00 -1.73 -0.12 0.00 -1.81 0.00 0.00 61.98 58.32 2ctr s VAL 15 Cb 0.00 -2.29 0.18 0.00 0.56 0.00 0.00 36.38 34.83 2ctr s VAL 15 CO 0.00 -0.02 1.09 -2.16 -0.31 0.00 0.00 175.10 173.70 2ctr s PRO 16 N -2.47 0.59 0.36 4.82 0.04 -1.26 -4.47 135.00 132.62 2ctr s PRO 16 Ca 0.20 0.59 0.11 0.00 0.04 0.00 0.00 61.00 61.94 2ctr s PRO 16 Cb -0.09 -1.75 0.70 0.00 0.04 0.00 0.00 34.50 33.40 2ctr s PRO 16 CO 0.11 -2.64 1.83 0.87 0.04 0.00 0.00 177.00 177.21 2ctr h LYS 17 N -1.83 0.10 -0.65 4.56 6.56 -2.01 -2.31 116.57 121.00 2ctr h LYS 17 Ca -0.53 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.02 2ctr h LYS 17 Cb 1.32 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.97 2ctr h LYS 17 CO 0.57 0.41 0.00 0.45 -2.06 0.00 0.00 179.45 178.82 2ctr n SER 18 N -4.13 5.03 -4.67 0.86 2.88 -1.26 -4.98 113.62 107.34 2ctr n SER 18 Ca -0.02 -2.54 -0.50 0.00 -1.33 0.00 0.00 58.87 54.49 2ctr n SER 18 Cb 0.38 -0.61 -0.05 0.00 -0.75 0.00 0.00 64.21 63.18 2ctr n SER 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ctr n ALA 19 N 1.07 0.65 -1.77 -1.46 0.00 -0.87 -4.92 120.51 113.21 2ctr n ALA 19 Ca 0.27 0.37 -0.36 0.00 0.00 0.00 0.00 53.44 53.71 2ctr n ALA 19 Cb 0.96 -2.37 -0.01 0.00 0.00 0.00 0.00 19.45 18.03 2ctr n ALA 19 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ctr s SER 20 N 2.78 6.00 0.27 0.00 0.15 -1.26 -4.69 113.70 116.94 2ctr s SER 20 Ca 0.89 2.21 0.03 0.00 0.70 0.00 0.00 55.95 59.78 2ctr s SER 20 Cb -0.77 -2.59 0.70 0.00 -1.71 0.00 0.00 66.02 61.65 2ctr s SER 20 CO 0.50 -1.03 1.34 1.21 1.20 0.00 0.00 173.24 176.46 2ctr n GLU 21 N -0.88 -0.07 -0.32 5.44 2.13 -1.26 0.22 120.64 125.91 2ctr n GLU 21 Ca 0.09 1.27 -0.04 0.00 0.66 0.00 0.00 57.16 59.15 2ctr n GLU 21 Cb 0.50 -2.05 0.08 0.00 0.27 0.00 0.00 31.44 30.24 2ctr n GLU 21 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2ctr h ARG 22 N 0.00 1.13 -0.47 5.31 2.43 -1.98 -0.59 114.38 120.21 2ctr h ARG 22 Ca 0.54 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.61 2ctr h ARG 22 Cb 1.16 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 30.43 2ctr h ARG 22 CO -0.79 0.75 0.18 1.96 -1.51 0.00 0.00 179.97 180.56 2ctr h GLN 23 N 1.16 0.70 0.41 0.20 4.20 0.23 -0.99 115.11 121.03 2ctr h GLN 23 Ca 0.31 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 2ctr h GLN 23 Cb -0.13 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.54 2ctr h GLN 23 CO -0.07 0.64 -0.20 0.82 -0.67 0.00 0.00 178.83 179.35 2ctr h ILE 24 N 0.61 0.58 -0.54 2.54 2.04 -0.85 0.12 117.51 122.01 2ctr h ILE 24 Ca 0.15 -0.31 0.09 0.00 1.00 0.00 0.00 64.86 65.80 2ctr h ILE 24 Cb 0.21 0.72 -0.07 0.00 -0.74 0.00 0.00 36.82 36.94 2ctr h ILE 24 CO -0.01 0.06 0.15 0.11 0.00 0.00 0.00 178.15 178.45 2ctr h LYS 25 N -0.74 0.29 0.09 2.37 1.57 -1.10 0.24 116.57 119.28 2ctr h LYS 25 Ca -0.06 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2ctr h LYS 25 Cb 0.52 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2ctr h LYS 25 CO 0.09 0.19 -0.04 0.87 -0.57 0.00 0.00 179.45 179.99 2ctr h LYS 26 N 0.30 -0.11 -0.70 3.15 1.57 -1.13 0.22 116.57 119.87 2ctr h LYS 26 Ca 0.27 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.12 2ctr h LYS 26 Cb 0.35 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.63 2ctr h LYS 26 CO -0.32 0.09 0.39 0.00 -0.57 0.00 0.00 179.45 179.04 2ctr h ALA 27 N 0.59 0.95 0.31 3.86 0.00 -0.27 -2.40 119.26 122.30 2ctr h ALA 27 Ca -0.01 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2ctr h ALA 27 Cb 0.25 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ctr h ALA 27 CO 0.02 0.07 -0.15 0.35 0.00 0.00 0.00 179.25 179.54 2ctr h PHE 28 N 0.71 -0.39 -0.29 0.00 3.57 -0.43 -2.89 116.94 117.22 2ctr h PHE 28 Ca 0.32 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.84 2ctr h PHE 28 Cb 0.21 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 2ctr h PHE 28 CO -0.08 -0.04 -0.19 0.45 -2.23 0.00 0.00 178.31 176.22 2ctr h HIS 29 N -0.85 -0.61 -0.66 0.41 3.86 -0.40 0.16 115.15 117.07 2ctr h HIS 29 Ca -0.04 0.04 0.13 0.00 -1.16 0.00 0.00 60.37 59.33 2ctr h HIS 29 Cb 0.52 0.30 -0.13 0.00 1.06 0.00 0.00 27.41 29.17 2ctr h HIS 29 CO 0.03 -0.13 -0.23 0.87 0.86 0.00 0.00 177.93 179.34 2ctr h LYS 30 N -0.02 -0.06 0.12 2.45 6.56 -1.55 -2.12 116.57 121.96 2ctr h LYS 30 Ca 0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.65 2ctr h LYS 30 Cb 0.15 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 31.79 2ctr h LYS 30 CO -0.29 -0.04 -0.33 -0.07 -2.06 0.00 0.00 179.45 176.66 2ctr h LEU 31 N -0.06 -0.99 -1.49 2.94 3.38 -0.81 -0.78 115.31 117.50 2ctr h LEU 31 Ca 0.30 0.10 0.49 0.00 0.09 0.00 0.00 57.88 58.85 2ctr h LEU 31 Cb 0.52 0.36 -0.12 0.00 0.09 0.00 0.00 40.66 41.51 2ctr h LEU 31 CO -0.70 -0.37 1.00 0.00 0.09 0.00 0.00 178.44 178.46 2ctr n ALA 32 N -2.73 1.46 -0.05 1.53 0.00 0.39 0.23 120.51 121.35 2ctr n ALA 32 Ca -0.06 0.78 -0.16 0.00 0.00 0.00 0.00 53.44 54.00 2ctr n ALA 32 Cb 0.27 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 2ctr n ALA 32 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2ctr h MET 33 N 0.00 0.84 -0.07 0.00 2.86 -0.75 1.89 114.93 119.70 2ctr h MET 33 Ca 0.86 -0.61 -0.10 0.00 -2.06 0.00 0.00 59.70 57.79 2ctr h MET 33 Cb 2.99 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 34.74 2ctr h MET 33 CO -0.32 1.23 -0.42 -0.22 1.06 0.00 0.00 176.91 178.24 2ctr h LYS 34 N 0.61 0.17 -0.13 1.72 3.64 0.36 -3.06 116.57 119.88 2ctr h LYS 34 Ca -0.02 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2ctr h LYS 34 Cb 1.29 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 2ctr h LYS 34 CO 0.14 0.56 0.00 0.66 -2.27 0.00 0.00 179.45 178.55 2ctr n TYR 35 N -4.02 0.32 -1.67 1.91 4.01 -0.21 -4.86 117.16 112.64 2ctr n TYR 35 Ca -0.02 -0.76 -0.49 0.00 -0.16 0.00 0.00 57.90 56.48 2ctr n TYR 35 Cb 0.48 -0.14 -0.05 0.00 -0.31 0.00 0.00 39.34 39.31 2ctr n TYR 35 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 2ctr n HIS 36 N -0.62 2.19 0.97 -0.72 -0.00 0.64 -4.44 115.22 113.25 2ctr n HIS 36 Ca 0.13 0.22 0.07 0.00 0.46 0.00 0.00 57.72 58.60 2ctr n HIS 36 Cb 0.57 -2.56 0.44 0.00 -0.12 0.00 0.00 29.99 28.32 2ctr n HIS 36 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2ctr n PRO 37 N 4.84 0.49 -0.11 1.57 -0.04 -1.26 -0.45 135.00 140.03 2ctr n PRO 37 Ca 0.20 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.51 2ctr n PRO 37 Cb 0.26 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.15 2ctr n PRO 37 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2ctr n ASP 38 N -0.98 2.25 0.02 3.54 2.03 -1.26 -4.66 116.55 117.50 2ctr n ASP 38 Ca 0.11 -0.11 -0.22 0.00 0.52 0.00 0.00 54.79 55.10 2ctr n ASP 38 Cb 0.05 -0.36 -0.14 0.00 -0.72 0.00 0.00 41.12 39.95 2ctr n ASP 38 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2ctr h LYS 39 N -0.03 0.29 -6.59 -0.67 1.79 -1.86 -3.46 116.57 106.04 2ctr h LYS 39 Ca -0.50 -0.50 -0.53 0.00 -2.18 0.00 0.00 60.65 56.94 2ctr h LYS 39 Cb 1.76 0.19 0.02 0.00 -1.58 0.00 0.00 32.23 32.62 2ctr h LYS 39 CO -0.09 1.23 0.66 1.21 -1.08 0.00 0.00 179.45 181.39 2ctr s ASN 40 N -7.09 6.91 -0.57 0.86 3.84 0.40 -4.93 114.94 114.36 2ctr s ASN 40 Ca -0.21 2.30 0.01 0.00 0.21 0.00 0.00 52.86 55.17 2ctr s ASN 40 Cb 0.06 -2.60 0.44 0.00 -0.55 0.00 0.00 41.25 38.61 2ctr s ASN 40 CO 0.79 -0.56 1.76 0.29 -2.79 0.00 0.00 177.10 176.59 2ctr n LYS 41 N 3.36 2.99 -4.21 0.43 4.01 -1.26 -4.77 118.16 118.71 2ctr n LYS 41 Ca 0.09 -3.61 -0.19 0.00 -0.51 0.00 0.00 58.31 54.09 2ctr n LYS 41 Cb 0.43 -2.28 -0.12 0.00 -0.51 0.00 0.00 35.03 32.55 2ctr n LYS 41 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 2ctr s SER 42 N -2.34 1.89 0.01 4.39 0.01 -1.26 -5.07 113.70 111.33 2ctr s SER 42 Ca 0.59 -0.67 -0.23 0.00 1.31 0.00 0.00 55.95 56.95 2ctr s SER 42 Cb 0.47 -0.07 -0.17 0.00 0.21 0.00 0.00 66.02 66.46 2ctr s SER 42 CO -0.04 -0.07 1.31 1.55 0.41 0.00 0.00 173.24 176.40 2ctr h PRO 43 N 4.07 0.20 -0.89 12.44 0.13 -2.03 -3.19 132.00 142.73 2ctr h PRO 43 Ca -0.41 -0.10 0.09 0.00 -0.87 0.00 0.00 66.00 64.70 2ctr h PRO 43 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 2ctr h PRO 43 CO 0.42 0.63 0.57 -0.44 -0.23 0.00 0.00 178.00 178.95 2ctr h ASP 44 N -0.23 0.81 -0.46 1.44 3.32 -2.01 -2.54 116.42 116.76 2ctr h ASP 44 Ca 0.01 0.02 0.08 0.00 0.02 0.00 0.00 57.03 57.17 2ctr h ASP 44 Cb 0.59 -0.15 -0.10 0.00 0.22 0.00 0.00 39.33 39.89 2ctr h ASP 44 CO 0.02 0.48 -0.35 0.00 -1.72 0.00 0.00 179.24 177.67 2ctr h ALA 45 N 1.55 -0.19 -0.99 3.45 0.00 -1.90 0.16 119.26 121.34 2ctr h ALA 45 Ca 0.41 0.11 0.26 0.00 0.00 0.00 0.00 54.91 55.69 2ctr h ALA 45 Cb 0.38 0.77 -0.13 0.00 0.00 0.00 0.00 17.79 18.80 2ctr h ALA 45 CO -0.17 -0.74 0.56 1.49 0.00 0.00 0.00 179.25 180.39 2ctr h GLU 46 N -0.24 0.47 0.16 0.00 4.81 -1.55 -0.85 114.58 117.38 2ctr h GLU 46 Ca 0.18 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2ctr h GLU 46 Cb 0.55 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2ctr h GLU 46 CO -0.59 0.31 -0.08 0.00 -0.73 0.00 0.00 179.01 177.92 2ctr h ALA 47 N 1.76 -0.22 -0.49 2.92 0.00 -0.84 -2.93 119.26 119.47 2ctr h ALA 47 Ca 0.66 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.44 2ctr h ALA 47 Cb 1.33 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 19.11 2ctr h ALA 47 CO -0.52 -0.36 -0.34 0.87 0.00 0.00 0.00 179.25 178.89 2ctr h LYS 48 N -0.73 -0.21 -0.55 0.00 1.79 0.26 0.38 116.57 117.51 2ctr h LYS 48 Ca -0.02 0.01 0.12 0.00 -2.18 0.00 0.00 60.65 58.58 2ctr h LYS 48 Cb 0.51 0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 2ctr h LYS 48 CO 0.04 -0.14 0.38 0.35 -1.08 0.00 0.00 179.45 178.99 2ctr h PHE 49 N -0.22 0.25 0.00 -1.35 3.04 -1.29 0.18 116.94 117.54 2ctr h PHE 49 Ca 0.19 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.15 2ctr h PHE 49 Cb 0.55 -0.08 -0.00 0.00 2.56 0.00 0.00 35.95 38.98 2ctr h PHE 49 CO -0.60 0.11 -0.01 -0.09 -2.02 0.00 0.00 178.31 175.71 2ctr h ARG 50 N 0.23 0.00 0.00 1.11 9.65 -0.04 -1.27 114.38 124.05 2ctr h ARG 50 Ca 0.26 0.00 -0.25 0.00 -1.10 0.00 0.00 59.98 58.89 2ctr h ARG 50 Cb 0.72 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.26 2ctr h ARG 50 CO -0.05 0.01 -2.03 0.39 2.80 0.00 0.00 179.97 181.08 2ctr n GLU 51 N -3.32 0.66 -0.07 0.20 1.02 0.57 -3.86 120.64 115.85 2ctr n GLU 51 Ca -0.03 0.04 -0.14 0.00 -0.02 0.00 0.00 57.16 57.00 2ctr n GLU 51 Cb 0.09 -1.61 -0.05 0.00 -0.02 0.00 0.00 31.44 29.85 2ctr n GLU 51 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2ctr h ILE 52 N 0.00 1.31 0.55 -3.67 2.04 -0.80 -2.92 117.51 114.02 2ctr h ILE 52 Ca -0.33 -1.60 -0.03 0.00 1.00 0.00 0.00 64.86 63.90 2ctr h ILE 52 Cb 1.84 1.76 0.01 0.00 -0.74 0.00 0.00 36.82 39.69 2ctr h ILE 52 CO 0.03 0.50 -0.26 0.00 0.00 0.00 0.00 178.15 178.42 2ctr h ALA 53 N 0.64 -0.92 -0.94 1.87 0.00 -1.48 -2.17 119.26 116.26 2ctr h ALA 53 Ca 0.02 -0.16 0.27 0.00 0.00 0.00 0.00 54.91 55.04 2ctr h ALA 53 Cb 0.99 0.29 -0.16 0.00 0.00 0.00 0.00 17.79 18.90 2ctr h ALA 53 CO 0.09 -0.87 0.17 1.49 0.00 0.00 0.00 179.25 180.14 2ctr h GLU 54 N -0.95 0.09 -0.54 0.00 4.57 -1.69 0.65 114.58 116.71 2ctr h GLU 54 Ca -0.08 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.08 2ctr h GLU 54 Cb 0.57 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 2ctr h GLU 54 CO 0.12 0.06 0.27 0.00 -1.18 0.00 0.00 179.01 178.28 2ctr h ALA 55 N 1.89 0.70 0.34 2.92 0.00 -1.50 -3.11 119.26 120.51 2ctr h ALA 55 Ca 0.60 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.38 2ctr h ALA 55 Cb 1.29 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2ctr h ALA 55 CO -0.79 0.26 -0.16 -0.92 0.00 0.00 0.00 179.25 177.64 2ctr h TYR 56 N 0.73 -0.42 -0.78 0.00 3.20 0.78 -2.75 116.97 117.73 2ctr h TYR 56 Ca 0.19 -0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.26 2ctr h TYR 56 Cb 0.10 0.14 -0.15 0.00 1.54 0.00 0.00 36.73 38.37 2ctr h TYR 56 CO -0.01 -0.09 0.01 0.39 -1.64 0.00 0.00 178.16 176.82 2ctr n GLU 57 N -5.14 -0.06 -0.01 1.82 1.02 0.87 0.19 120.64 119.33 2ctr n GLU 57 Ca -0.10 1.17 -0.13 0.00 -0.02 0.00 0.00 57.16 58.08 2ctr n GLU 57 Cb 0.27 -1.85 -0.10 0.00 -0.02 0.00 0.00 31.44 29.75 2ctr n GLU 57 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2ctr h THR 58 N 0.00 1.34 0.00 2.62 2.02 -1.52 -2.80 112.91 114.57 2ctr h THR 58 Ca 0.47 -1.01 0.00 0.00 0.77 0.00 0.00 66.41 66.64 2ctr h THR 58 Cb 0.95 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 69.39 2ctr h THR 58 CO -0.73 0.26 0.00 0.18 0.37 0.00 0.00 175.52 175.60 2ctr n LEU 59 N -4.88 0.00 -0.11 2.58 4.77 0.25 -0.87 117.00 118.74 2ctr n LEU 59 Ca -0.08 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.67 2ctr n LEU 59 Cb 0.22 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.20 2ctr n LEU 59 CO 0.33 0.00 -0.60 -0.24 -1.33 0.00 0.00 177.39 175.55 2ctr n SER 60 N -0.88 1.87 -4.80 -1.43 2.88 0.52 -4.87 113.62 106.91 2ctr n SER 60 Ca 0.15 0.41 -0.29 0.00 -1.33 0.00 0.00 58.87 57.81 2ctr n SER 60 Cb 0.07 -0.95 0.11 0.00 -0.75 0.00 0.00 64.21 62.69 2ctr n SER 60 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2ctr s ASP 61 N -6.91 4.04 -0.01 -3.46 1.11 -1.11 -4.96 116.67 105.36 2ctr s ASP 61 Ca -0.30 1.13 -0.00 0.00 0.18 0.00 0.00 52.55 53.57 2ctr s ASP 61 Cb 0.07 -1.79 -0.00 0.00 1.07 0.00 0.00 42.92 42.27 2ctr s ASP 61 CO 0.58 -2.24 -0.00 0.00 1.18 0.00 0.00 175.17 174.70 2ctr h ALA 62 N -1.28 0.00 -0.68 5.23 0.00 -1.93 -2.89 119.26 117.71 2ctr h ALA 62 Ca -0.49 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 54.54 2ctr h ALA 62 Cb 1.30 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 19.00 2ctr h ALA 62 CO 0.61 0.00 0.25 -0.91 0.00 0.00 0.00 179.25 179.20 2ctr h ASN 63 N -0.14 0.23 0.43 0.00 4.21 -1.96 0.56 115.58 118.90 2ctr h ASN 63 Ca 0.00 0.10 -0.01 0.00 1.21 0.00 0.00 56.30 57.60 2ctr h ASN 63 Cb 0.00 0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.27 2ctr h ASN 63 CO 0.00 0.11 -0.34 0.03 -1.29 0.00 0.00 177.43 175.94 2ctr h ARG 64 N 0.41 -0.73 0.00 0.81 3.08 -1.81 0.26 114.38 116.41 2ctr h ARG 64 Ca 0.36 0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.42 2ctr h ARG 64 Cb 0.51 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2ctr h ARG 64 CO -0.37 -0.49 -0.21 -0.09 -1.07 0.00 0.00 179.97 177.74 2ctr h ARG 65 N -0.76 0.00 -0.41 0.04 1.12 -0.45 -1.92 114.38 112.00 2ctr h ARG 65 Ca -0.04 0.00 -0.08 0.00 -1.11 0.00 0.00 59.98 58.75 2ctr h ARG 65 Cb 0.65 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.60 2ctr h ARG 65 CO -0.01 0.21 -0.07 -0.22 -3.11 0.00 0.00 179.97 176.77 2ctr h LYS 66 N 0.00 0.77 0.01 0.20 3.64 0.69 -2.58 116.57 119.30 2ctr h LYS 66 Ca -0.00 -0.28 -0.00 0.00 -1.27 0.00 0.00 60.65 59.10 2ctr h LYS 66 Cb 0.38 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2ctr h LYS 66 CO 0.03 0.89 -0.00 0.93 -2.27 0.00 0.00 179.45 179.02 2ctr h GLU 67 N 0.58 -0.01 0.00 1.90 5.08 -0.61 -0.80 114.58 120.72 2ctr h GLU 67 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2ctr h GLU 67 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2ctr h GLU 67 CO 0.04 0.45 0.19 -0.92 -1.00 0.00 0.00 179.01 177.76 2ctr h TYR 68 N -0.48 0.00 0.09 4.33 3.20 -1.39 0.76 116.97 123.49 2ctr h TYR 68 Ca -0.00 0.00 -0.37 0.00 3.14 0.00 0.00 58.73 61.50 2ctr h TYR 68 Cb 0.47 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 2ctr h TYR 68 CO 0.09 0.00 -2.09 -3.47 -1.64 0.00 0.00 178.16 171.05 2ctr n ASP 69 N -2.96 2.02 0.16 -2.11 -0.08 -0.97 -1.05 116.55 111.56 2ctr n ASP 69 Ca -0.02 0.15 0.12 0.00 -1.51 0.00 0.00 54.79 53.53 2ctr n ASP 69 Cb 0.24 -0.72 0.28 0.00 2.34 0.00 0.00 41.12 43.26 2ctr n ASP 69 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ctr h THR 70 N 0.05 0.00 0.00 5.18 1.03 0.28 -3.37 112.91 116.09 2ctr h THR 70 Ca -0.45 -0.74 -0.19 0.00 -0.01 0.00 0.00 66.41 65.01 2ctr h THR 70 Cb 2.01 1.72 -0.03 0.00 -1.07 0.00 0.00 68.15 70.79 2ctr h THR 70 CO 0.05 0.00 -1.65 0.18 -0.01 0.00 0.00 175.52 174.09 2ctr n LEU 71 N -2.68 1.22 0.00 0.00 4.77 0.25 -5.06 117.00 115.50 2ctr n LEU 71 Ca 0.05 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2ctr n LEU 71 Cb 0.48 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2ctr n LEU 71 CO 0.32 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 2ctr n GLY 72 N 2.39 -0.86 0.95 -0.72 0.00 -0.21 -4.00 105.19 102.73 2ctr n GLY 72 Ca -0.23 -2.14 0.12 0.00 0.00 0.00 0.00 46.02 43.77 2ctr n GLY 72 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2ctr n HIS 73 N 0.00 0.16 -0.04 1.61 -0.00 -1.26 -3.09 115.22 112.60 2ctr n HIS 73 Ca 0.00 -0.08 -0.03 0.00 0.46 0.00 0.00 57.72 58.07 2ctr n HIS 73 Cb 0.00 0.00 -0.06 0.00 -0.12 0.00 0.00 29.99 29.81 2ctr n HIS 73 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2ctr n SER 74 N 1.21 3.11 -0.11 0.26 3.41 -1.26 -4.39 113.62 115.85 2ctr n SER 74 Ca 0.16 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.52 2ctr n SER 74 Cb 0.56 0.74 -0.11 0.00 -0.26 0.00 0.00 64.21 65.14 2ctr n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ctr n ALA 75 N -2.24 0.99 -0.31 7.33 0.00 -1.26 -4.41 120.51 120.61 2ctr n ALA 75 Ca -0.12 -0.78 -0.02 0.00 0.00 0.00 0.00 53.44 52.53 2ctr n ALA 75 Cb 0.71 -0.27 0.11 0.00 0.00 0.00 0.00 19.45 20.00 2ctr n ALA 75 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2ctr h PHE 76 N -0.87 1.02 -1.59 0.00 3.57 -1.75 -3.17 116.94 114.15 2ctr h PHE 76 Ca -0.51 0.03 -0.76 0.00 3.53 0.00 0.00 57.97 60.25 2ctr h PHE 76 Cb 1.52 -0.34 -0.17 0.00 2.79 0.00 0.00 35.95 39.75 2ctr h PHE 76 CO 0.02 0.58 1.88 0.25 -2.23 0.00 0.00 178.31 178.81 2ctr n THR 77 N -4.56 4.63 -3.75 4.41 -2.24 -1.26 -4.88 114.28 106.63 2ctr n THR 77 Ca 0.10 -4.64 -0.35 0.00 -2.27 0.00 0.00 64.05 56.90 2ctr n THR 77 Cb 0.09 -2.27 -0.10 0.00 -2.10 0.00 0.00 70.33 65.95 2ctr n THR 77 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2ctr s SER 78 N 0.36 5.18 0.00 3.42 0.15 -1.20 -4.78 113.70 116.83 2ctr s SER 78 Ca 0.40 -3.12 0.00 0.00 0.70 0.00 0.00 55.95 53.93 2ctr s SER 78 Cb 0.10 -1.81 0.00 0.00 -1.71 0.00 0.00 66.02 62.60 2ctr s SER 78 CO 0.01 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 174.77 2ctr n GLY 79 N 3.09 -2.36 3.04 9.45 0.00 -1.26 -5.15 105.19 112.00 2ctr n GLY 79 Ca 0.11 0.76 -0.13 0.00 0.00 0.00 0.00 46.02 46.76 2ctr n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ctr s LYS 80 N 0.00 0.50 0.17 1.61 0.00 -1.26 -5.16 119.74 115.60 2ctr s LYS 80 Ca 0.00 -0.67 -0.01 0.00 0.00 0.00 0.00 55.97 55.29 2ctr s LYS 80 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 37.83 37.54 2ctr s LYS 80 CO 0.00 0.05 0.24 0.41 0.00 0.00 0.00 175.35 176.05 2ctr n GLY 81 N 1.67 2.62 3.44 0.59 0.00 -1.26 -5.07 105.19 107.18 2ctr n GLY 81 Ca -0.21 -1.49 -0.11 0.00 0.00 0.00 0.00 46.02 44.20 2ctr n GLY 81 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ctr s GLN 82 N -2.38 1.19 -0.14 1.61 -2.07 -1.26 -5.07 119.66 111.54 2ctr s GLN 82 Ca 0.14 -0.42 -0.17 0.00 -1.82 0.00 0.00 55.36 53.09 2ctr s GLN 82 Cb -0.01 0.55 -0.25 0.00 -1.09 0.00 0.00 33.01 32.22 2ctr s GLN 82 CO 0.10 -0.52 0.46 0.66 -1.32 0.00 0.00 175.29 174.67 2ctr h SER 83 N 2.02 0.26 -3.54 12.60 4.64 -2.03 -3.51 113.55 123.99 2ctr h SER 83 Ca -0.32 -0.78 0.36 0.00 -0.47 0.00 0.00 61.79 60.58 2ctr h SER 83 Cb 1.29 -0.08 -0.17 0.00 -0.31 0.00 0.00 62.40 63.13 2ctr h SER 83 CO 0.37 1.57 -1.07 0.61 -0.87 0.00 0.00 176.83 177.44 2ctr n GLY 84 N 1.68 -2.99 3.64 -0.77 0.00 -1.26 -4.68 105.19 100.82 2ctr n GLY 84 Ca -0.27 -1.08 -0.43 0.00 0.00 0.00 0.00 46.02 44.25 2ctr n GLY 84 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ctr s PRO 85 N -3.72 3.95 -0.24 1.61 0.04 -1.26 -5.00 135.00 130.38 2ctr s PRO 85 Ca 0.00 1.79 -0.11 0.00 0.04 0.00 0.00 61.00 62.72 2ctr s PRO 85 Cb 0.00 -3.99 -0.05 0.00 0.04 0.00 0.00 34.50 30.50 2ctr s PRO 85 CO 0.00 -1.11 0.18 -1.12 0.04 0.00 0.00 177.00 174.99 2ctr s SER 86 N 3.71 6.14 -1.63 6.66 0.01 -1.26 -4.41 113.70 122.91 2ctr s SER 86 Ca 0.70 0.14 -0.14 0.00 1.31 0.00 0.00 55.95 57.95 2ctr s SER 86 Cb -0.26 -2.11 0.12 0.00 0.21 0.00 0.00 66.02 63.97 2ctr s SER 86 CO 0.27 0.05 0.72 -1.20 0.41 0.00 0.00 173.24 173.50 2ctr n SER 87 N 4.31 -2.79 0.00 2.44 7.64 -1.26 -5.09 113.62 118.86 2ctr n SER 87 Ca -0.15 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.74 2ctr n SER 87 Cb 0.52 -2.89 0.00 0.00 -1.01 0.00 0.00 64.21 60.83 2ctr n SER 87 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64