#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cra s SER 2 N 0.00 3.93 0.12 1.61 0.01 -1.26 -5.15 113.70 112.97 2cra s SER 2 Ca 0.00 -0.73 0.04 0.00 1.31 0.00 0.00 55.95 56.57 2cra s SER 2 Cb 0.00 -0.53 -0.04 0.00 0.21 0.00 0.00 66.02 65.66 2cra s SER 2 CO 0.00 0.09 -0.10 -0.94 0.41 0.00 0.00 173.24 172.71 2cra s SER 3 N -2.93 1.56 0.00 2.44 1.04 -1.26 -5.10 113.70 109.45 2cra s SER 3 Ca 0.25 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.74 2cra s SER 3 Cb -0.08 0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.06 2cra s SER 3 CO 0.14 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.64 2cra n GLY 4 N 0.10 1.75 0.26 7.32 0.00 -1.26 -5.02 105.19 108.34 2cra n GLY 4 Ca -0.13 0.40 -0.00 0.00 0.00 0.00 0.00 46.02 46.29 2cra n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2cra h SER 5 N 0.00 0.42 -2.38 1.61 0.02 -2.05 -3.44 113.55 107.73 2cra h SER 5 Ca 0.00 -0.09 -0.53 0.00 -0.84 0.00 0.00 61.79 60.33 2cra h SER 5 Cb 0.00 -0.11 -0.06 0.00 0.14 0.00 0.00 62.40 62.37 2cra h SER 5 CO 0.00 0.55 -0.54 -0.44 -1.14 0.00 0.00 176.83 175.25 2cra s SER 6 N -6.79 5.50 -0.07 3.07 0.01 -1.26 -4.88 113.70 109.29 2cra s SER 6 Ca -0.07 -0.21 -0.02 0.00 1.31 0.00 0.00 55.95 56.96 2cra s SER 6 Cb 0.15 -1.41 0.00 0.00 0.21 0.00 0.00 66.02 64.98 2cra s SER 6 CO 0.76 0.00 0.06 0.61 0.41 0.00 0.00 173.24 175.08 2cra n GLY 7 N -0.87 -2.00 3.34 3.44 0.00 -1.26 -4.89 105.19 102.95 2cra n GLY 7 Ca -0.08 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 2cra n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cra n ARG 8 N -0.15 3.06 -0.04 1.61 1.74 -1.26 -4.55 116.66 117.07 2cra n ARG 8 Ca 0.01 -3.06 0.03 0.00 -0.77 0.00 0.00 57.85 54.06 2cra n ARG 8 Cb 0.04 -3.44 -0.16 0.00 -1.02 0.00 0.00 32.46 27.88 2cra n ARG 8 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2cra n LYS 9 N 7.75 0.68 -3.22 5.56 3.00 -1.26 -5.00 118.16 125.67 2cra n LYS 9 Ca 0.50 -0.13 -0.19 0.00 -0.00 0.00 0.00 58.31 58.48 2cra n LYS 9 Cb 0.44 -1.51 0.00 0.00 0.00 0.00 0.00 35.03 33.96 2cra n LYS 9 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2cra n LYS 10 N -2.43 0.87 -0.83 1.64 0.00 -1.26 -5.13 118.16 111.03 2cra n LYS 10 Ca -0.14 -2.58 -0.30 0.00 -0.00 0.00 0.00 58.31 55.29 2cra n LYS 10 Cb 0.78 0.26 0.25 0.00 -0.00 0.00 0.00 35.03 36.32 2cra n LYS 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 2cra s ARG 11 N -3.71 -1.70 0.25 -1.58 3.52 -1.26 -4.94 118.95 109.54 2cra s ARG 11 Ca 0.24 0.08 -0.30 0.00 -0.13 0.00 0.00 55.73 55.62 2cra s ARG 11 Cb -0.02 -1.53 -0.10 0.00 -1.56 0.00 0.00 34.95 31.74 2cra s ARG 11 CO 0.15 -4.05 1.44 0.42 -0.81 0.00 0.00 175.30 172.45 2cra s ILE 12 N -2.74 2.65 0.00 4.11 -1.09 -1.26 -5.02 121.20 117.85 2cra s ILE 12 Ca 0.70 0.55 0.00 0.00 -2.23 0.00 0.00 60.65 59.67 2cra s ILE 12 Cb -0.12 -3.35 0.00 0.00 -1.58 0.00 0.00 42.46 37.41 2cra s ILE 12 CO 0.57 0.09 0.00 -0.81 -1.23 0.00 0.00 174.94 173.56 2cra n PRO 13 N 2.25 0.00 -2.07 2.79 -0.04 -1.26 -4.93 135.00 131.75 2cra n PRO 13 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 2cra n PRO 13 Cb 0.40 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.86 2cra n PRO 13 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2cra n TYR 14 N -1.99 -3.94 -1.45 0.54 4.01 -1.26 -4.98 117.16 108.07 2cra n TYR 14 Ca 0.00 2.35 -0.30 0.00 -0.16 0.00 0.00 57.90 59.79 2cra n TYR 14 Cb 0.00 -3.50 0.10 0.00 -0.31 0.00 0.00 39.34 35.63 2cra n TYR 14 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2cra s SER 15 N -0.48 4.34 0.41 7.72 0.01 -1.26 -4.64 113.70 119.80 2cra s SER 15 Ca 0.00 1.41 0.17 0.00 1.31 0.00 0.00 55.95 58.85 2cra s SER 15 Cb 0.00 -2.15 1.07 0.00 0.21 0.00 0.00 66.02 65.15 2cra s SER 15 CO 0.00 -2.08 1.85 0.50 0.41 0.00 0.00 173.24 173.92 2cra h LYS 16 N -1.16 0.41 0.00 12.44 1.63 -1.98 0.30 116.57 128.21 2cra h LYS 16 Ca -0.47 -0.02 -0.11 0.00 -0.85 0.00 0.00 60.65 59.20 2cra h LYS 16 Cb 1.26 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.79 2cra h LYS 16 CO 0.57 0.27 -0.52 0.78 -3.45 0.00 0.00 179.45 177.10 2cra h GLY 17 N 0.42 0.00 0.30 5.01 0.00 -2.00 -1.45 103.07 105.36 2cra h GLY 17 Ca 0.48 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.68 2cra h GLY 17 CO -0.19 0.00 -0.67 1.46 0.00 0.00 0.00 176.54 177.14 2cra h GLN 18 N 0.00 0.13 0.00 4.80 4.20 -0.88 -3.32 115.11 120.04 2cra h GLN 18 Ca -0.01 -0.22 -0.03 0.00 0.06 0.00 0.00 58.65 58.46 2cra h GLN 18 Cb 0.93 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.79 2cra h GLN 18 CO 0.07 1.11 -0.12 -0.07 -0.67 0.00 0.00 178.83 179.14 2cra h LEU 19 N -0.69 0.00 -1.35 1.46 3.38 -0.87 -2.56 115.31 114.68 2cra h LEU 19 Ca -0.15 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.88 2cra h LEU 19 Cb 1.37 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.07 2cra h LEU 19 CO 0.02 0.12 0.48 -0.09 0.09 0.00 0.00 178.44 179.07 2cra h ARG 20 N 0.00 0.77 0.08 1.13 2.43 -1.36 0.20 114.38 117.64 2cra h ARG 20 Ca -0.00 -0.05 -0.31 0.00 -0.81 0.00 0.00 59.98 58.81 2cra h ARG 20 Cb 0.39 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2cra h ARG 20 CO 0.02 0.51 -1.65 0.93 -1.51 0.00 0.00 179.97 178.27 2cra h GLU 21 N 0.80 0.18 -0.20 0.20 4.39 -1.62 -3.12 114.58 115.21 2cra h GLU 21 Ca 0.31 -0.31 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 2cra h GLU 21 Cb 0.22 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2cra h GLU 21 CO -0.10 0.97 0.04 -0.07 -1.16 0.00 0.00 179.01 178.69 2cra h LEU 22 N 0.05 0.32 -0.90 1.33 3.38 -1.16 -1.07 115.31 117.26 2cra h LEU 22 Ca -0.28 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.35 2cra h LEU 22 Cb 2.01 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.66 2cra h LEU 22 CO 0.12 0.48 -0.22 -0.33 0.09 0.00 0.00 178.44 178.58 2cra h GLU 23 N 0.14 0.56 0.58 1.13 5.08 -0.78 -1.44 114.58 119.85 2cra h GLU 23 Ca 0.06 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2cra h GLU 23 Cb 0.29 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.51 2cra h GLU 23 CO 0.00 0.74 -0.28 -0.09 -1.00 0.00 0.00 179.01 178.39 2cra h ARG 24 N 0.50 -0.75 -0.96 2.33 2.43 -1.45 -0.42 114.38 116.07 2cra h ARG 24 Ca 0.08 0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.41 2cra h ARG 24 Cb 0.66 0.17 -0.08 0.00 -0.42 0.00 0.00 29.97 30.30 2cra h ARG 24 CO 0.05 -0.50 0.59 0.93 -1.51 0.00 0.00 179.97 179.53 2cra h GLU 25 N -0.99 0.93 0.01 0.20 3.07 -1.25 -2.05 114.58 114.49 2cra h GLU 25 Ca -0.08 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.72 2cra h GLU 25 Cb 0.60 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 2cra h GLU 25 CO 0.13 0.61 -0.00 -0.92 -1.40 0.00 0.00 179.01 177.43 2cra h TYR 26 N 0.96 -0.01 -0.11 4.33 3.20 -1.26 0.17 116.97 124.25 2cra h TYR 26 Ca 0.47 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.37 2cra h TYR 26 Cb 0.43 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.70 2cra h TYR 26 CO -0.02 0.10 0.15 0.00 -1.64 0.00 0.00 178.16 176.75 2cra h ALA 27 N 0.88 1.60 0.08 1.82 0.00 -0.40 -1.28 119.26 121.96 2cra h ALA 27 Ca -0.00 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 2cra h ALA 27 Cb 0.11 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2cra h ALA 27 CO 0.00 -0.20 -1.78 0.00 0.00 0.00 0.00 179.25 177.27 2cra h ALA 28 N 1.81 0.53 -2.22 0.00 0.00 -0.75 -3.48 119.26 115.15 2cra h ALA 28 Ca 0.05 -1.36 -0.04 0.00 0.00 0.00 0.00 54.91 53.56 2cra h ALA 28 Cb 0.35 0.53 -0.22 0.00 0.00 0.00 0.00 17.79 18.44 2cra h ALA 28 CO -0.00 1.38 -0.03 0.54 0.00 0.00 0.00 179.25 181.14 2cra s ASN 29 N -6.66 -0.73 0.09 0.00 4.22 0.53 -5.05 114.94 107.34 2cra s ASN 29 Ca -0.13 1.29 -0.13 0.00 -2.14 0.00 0.00 52.86 51.75 2cra s ASN 29 Cb 0.07 1.24 -0.18 0.00 1.28 0.00 0.00 41.25 43.66 2cra s ASN 29 CO 0.81 -0.22 1.27 0.11 -2.04 0.00 0.00 177.10 177.03 2cra h LYS 30 N 6.08 0.78 -4.64 3.55 1.79 -1.83 -3.33 116.57 118.97 2cra h LYS 30 Ca -0.30 -0.68 -0.69 0.00 -2.18 0.00 0.00 60.65 56.79 2cra h LYS 30 Cb 1.19 0.16 -0.32 0.00 -1.58 0.00 0.00 32.23 31.68 2cra h LYS 30 CO 0.16 1.28 -0.61 -0.06 -1.08 0.00 0.00 179.45 179.14 2cra s PHE 31 N -3.64 3.35 0.92 -1.35 0.40 -1.26 -4.94 117.98 111.47 2cra s PHE 31 Ca -0.10 -1.86 -0.14 0.00 -0.60 0.00 0.00 56.93 54.24 2cra s PHE 31 Cb 0.08 -2.53 0.18 0.00 0.51 0.00 0.00 43.02 41.26 2cra s PHE 31 CO 0.91 -0.83 1.27 0.96 0.70 0.00 0.00 175.22 178.23 2cra s ILE 32 N 1.28 2.02 0.31 0.64 -4.36 -1.26 -5.10 121.20 114.74 2cra s ILE 32 Ca 0.00 -0.08 0.09 0.00 -0.26 0.00 0.00 60.65 60.40 2cra s ILE 32 Cb -0.21 -2.94 -0.05 0.00 1.25 0.00 0.00 42.46 40.51 2cra s ILE 32 CO -0.00 0.00 0.06 0.28 0.24 0.00 0.00 174.94 175.51 2cra s THR 33 N -3.77 3.08 0.61 8.37 -1.32 -1.26 -4.95 115.64 116.40 2cra s THR 33 Ca 0.72 -1.84 0.31 0.00 -1.21 0.00 0.00 61.69 59.68 2cra s THR 33 Cb -0.05 -2.89 0.37 0.00 -1.51 0.00 0.00 72.50 68.42 2cra s THR 33 CO 0.52 -0.25 2.14 0.50 -2.21 0.00 0.00 174.62 175.31 2cra h LYS 34 N 1.73 0.00 0.00 7.08 3.11 -1.99 0.40 116.57 126.90 2cra h LYS 34 Ca -0.44 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.40 2cra h LYS 34 Cb 1.25 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.48 2cra h LYS 34 CO 0.63 0.00 -0.07 -0.44 -2.81 0.00 0.00 179.45 176.76 2cra h ASP 35 N 0.00 0.00 0.04 4.20 5.19 -2.01 -3.13 116.42 120.71 2cra h ASP 35 Ca 0.05 -0.00 -0.38 0.00 -0.62 0.00 0.00 57.03 56.09 2cra h ASP 35 Cb 0.39 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.84 2cra h ASP 35 CO -0.00 0.00 -2.35 1.17 -3.12 0.00 0.00 179.24 174.94 2cra n LYS 36 N -3.01 0.67 0.27 3.56 3.00 0.11 -4.16 118.16 118.59 2cra n LYS 36 Ca 0.04 0.14 0.13 0.00 -0.00 0.00 0.00 58.31 58.62 2cra n LYS 36 Cb 0.52 -1.56 0.74 0.00 0.00 0.00 0.00 35.03 34.73 2cra n LYS 36 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 2cra h ARG 37 N 0.01 0.00 -0.16 1.64 2.43 -0.67 -2.32 114.38 115.32 2cra h ARG 37 Ca -0.54 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 58.47 2cra h ARG 37 Cb 2.00 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 31.55 2cra h ARG 37 CO -0.03 0.11 -0.54 0.07 -1.51 0.00 0.00 179.97 178.07 2cra h ARG 38 N 0.00 0.64 0.12 0.20 0.11 -1.72 -2.72 114.38 111.00 2cra h ARG 38 Ca -0.00 -0.48 -0.01 0.00 0.10 0.00 0.00 59.98 59.59 2cra h ARG 38 Cb 0.31 0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.47 2cra h ARG 38 CO 0.01 1.10 -0.06 0.87 0.10 0.00 0.00 179.97 182.00 2cra h LYS 39 N 0.31 -0.15 -0.83 0.08 1.79 -1.63 -2.88 116.57 113.26 2cra h LYS 39 Ca -0.02 0.01 0.14 0.00 -2.18 0.00 0.00 60.65 58.60 2cra h LYS 39 Cb 1.16 0.03 -0.06 0.00 -1.58 0.00 0.00 32.23 31.79 2cra h LYS 39 CO 0.11 0.17 0.54 0.82 -1.08 0.00 0.00 179.45 180.02 2cra h ILE 40 N -0.49 0.82 0.00 1.86 2.04 -1.52 0.33 117.51 120.56 2cra h ILE 40 Ca -0.02 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 2cra h ILE 40 Cb 0.39 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 2cra h ILE 40 CO 0.03 0.11 -0.20 -1.28 0.00 0.00 0.00 178.15 176.80 2cra h SER 41 N 0.58 0.00 0.04 1.72 0.87 -1.36 -0.95 113.55 114.46 2cra h SER 41 Ca 0.41 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.70 2cra h SER 41 Cb 0.76 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.69 2cra h SER 41 CO -0.17 0.20 -1.50 0.00 -0.53 0.00 0.00 176.83 174.84 2cra h ALA 42 N 1.80 0.31 -0.20 6.23 0.00 -0.30 -0.99 119.26 126.11 2cra h ALA 42 Ca -0.00 -1.27 -0.00 0.00 0.00 0.00 0.00 54.91 53.64 2cra h ALA 42 Cb 0.54 0.73 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2cra h ALA 42 CO 0.03 0.90 0.12 0.00 0.00 0.00 0.00 179.25 180.29 2cra h ALA 43 N -0.31 0.26 -0.00 0.00 0.00 -0.60 -2.78 119.26 115.83 2cra h ALA 43 Ca -0.37 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2cra h ALA 43 Cb 1.55 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2cra h ALA 43 CO -0.11 -0.22 -0.46 0.25 0.00 0.00 0.00 179.25 178.70 2cra n THR 44 N -4.91 0.00 -2.08 0.00 -2.24 -0.36 -4.94 114.28 99.75 2cra n THR 44 Ca -0.03 -0.05 -0.17 0.00 -2.27 0.00 0.00 64.05 61.52 2cra n THR 44 Cb 0.06 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 68.67 2cra n THR 44 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2cra n SER 45 N -1.16 -5.10 -4.89 3.42 2.88 -0.65 -4.86 113.62 103.26 2cra n SER 45 Ca 0.08 0.12 -0.21 0.00 -1.33 0.00 0.00 58.87 57.53 2cra n SER 45 Cb 0.34 -4.17 0.06 0.00 -0.75 0.00 0.00 64.21 59.70 2cra n SER 45 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2cra s LEU 46 N -4.69 3.18 0.14 2.46 1.43 -0.47 -4.94 118.68 115.79 2cra s LEU 46 Ca 0.00 -0.42 -0.08 0.00 -1.03 0.00 0.00 54.13 52.60 2cra s LEU 46 Cb 0.00 -2.19 -0.06 0.00 0.03 0.00 0.00 46.19 43.97 2cra s LEU 46 CO 0.00 -1.40 0.43 -0.55 0.23 0.00 0.00 176.35 175.06 2cra s SER 47 N -4.59 6.58 0.49 2.29 0.15 -1.26 -4.43 113.70 112.93 2cra s SER 47 Ca 0.61 0.74 0.24 0.00 0.70 0.00 0.00 55.95 58.25 2cra s SER 47 Cb -0.07 -2.15 1.30 0.00 -1.71 0.00 0.00 66.02 63.38 2cra s SER 47 CO 0.40 0.07 1.91 -0.33 1.20 0.00 0.00 173.24 176.49 2cra h GLU 48 N 3.08 0.16 0.17 5.44 5.08 -1.94 -0.48 114.58 126.09 2cra h GLU 48 Ca -0.47 -0.01 -0.24 0.00 -1.00 0.00 0.00 59.36 57.63 2cra h GLU 48 Cb 1.18 -0.04 0.03 0.00 0.50 0.00 0.00 28.75 30.42 2cra h GLU 48 CO 0.70 0.10 -1.06 -0.09 -1.00 0.00 0.00 179.01 177.65 2cra h ARG 49 N 0.16 0.41 -0.77 2.33 9.65 -1.97 -3.15 114.38 121.05 2cra h ARG 49 Ca 0.38 -0.68 0.05 0.00 -1.10 0.00 0.00 59.98 58.63 2cra h ARG 49 Cb 1.26 0.25 -0.06 0.00 -1.39 0.00 0.00 29.97 30.03 2cra h ARG 49 CO -0.06 1.32 0.47 1.96 2.80 0.00 0.00 179.97 186.45 2cra h GLN 50 N -0.13 0.84 -0.68 0.20 4.20 -1.53 -0.92 115.11 117.09 2cra h GLN 50 Ca -0.18 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.45 2cra h GLN 50 Cb 1.83 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 29.39 2cra h GLN 50 CO 0.20 0.56 0.30 0.82 -0.67 0.00 0.00 178.83 180.04 2cra h ILE 51 N 0.87 1.23 -0.10 2.54 2.04 -1.32 -2.61 117.51 120.16 2cra h ILE 51 Ca 0.33 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 2cra h ILE 51 Cb 0.13 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2cra h ILE 51 CO -0.16 0.28 0.04 0.74 0.00 0.00 0.00 178.15 179.05 2cra h THR 52 N 0.95 1.16 -0.26 -0.27 2.02 -1.34 -2.05 112.91 113.12 2cra h THR 52 Ca 0.23 -0.49 0.06 0.00 0.77 0.00 0.00 66.41 66.99 2cra h THR 52 Cb 0.16 1.29 -0.07 0.00 -1.74 0.00 0.00 68.15 67.79 2cra h THR 52 CO -0.02 0.14 -0.23 0.40 0.37 0.00 0.00 175.52 176.17 2cra h ILE 53 N -0.01 0.40 -0.27 3.11 2.04 -1.07 -0.42 117.51 121.30 2cra h ILE 53 Ca 0.03 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.93 2cra h ILE 53 Cb 0.19 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 2cra h ILE 53 CO -0.00 0.00 0.06 -0.25 0.00 0.00 0.00 178.15 177.96 2cra h TRP 54 N -0.23 0.10 -0.25 1.37 7.01 -1.42 0.79 115.95 123.32 2cra h TRP 54 Ca 0.14 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.23 2cra h TRP 54 Cb 0.45 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.49 2cra h TRP 54 CO -0.40 0.03 0.19 0.74 -2.79 0.00 0.00 178.44 176.22 2cra h PHE 55 N 0.16 0.00 0.00 2.65 -1.00 -0.64 -0.05 116.94 118.06 2cra h PHE 55 Ca 0.12 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.90 2cra h PHE 55 Cb 0.12 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.68 2cra h PHE 55 CO -0.16 0.00 -0.00 1.96 -1.61 0.00 0.00 178.31 178.50 2cra h GLN 56 N 0.00 -0.00 -0.04 1.51 1.08 0.25 -3.20 115.11 114.71 2cra h GLN 56 Ca 0.12 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.33 2cra h GLN 56 Cb 0.51 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.93 2cra h GLN 56 CO -0.00 0.62 0.08 -0.91 -0.95 0.00 0.00 178.83 177.67 2cra h ASN 57 N -1.00 0.00 -0.00 1.46 2.35 -0.56 0.25 115.58 118.08 2cra h ASN 57 Ca -0.00 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.54 2cra h ASN 57 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 2cra h ASN 57 CO 0.00 0.00 -0.75 0.03 -1.65 0.00 0.00 177.43 175.06 2cra h ARG 58 N 0.00 0.65 0.15 0.81 2.47 -1.09 -2.92 114.38 114.45 2cra h ARG 58 Ca 0.02 -0.53 -0.33 0.00 -1.26 0.00 0.00 59.98 57.88 2cra h ARG 58 Cb 0.17 0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 28.60 2cra h ARG 58 CO -0.00 1.15 -1.69 0.00 0.56 0.00 0.00 179.97 179.99 2cra h ARG 59 N 0.45 0.31 0.00 0.04 3.08 -1.16 -3.27 114.38 113.84 2cra h ARG 59 Ca -0.04 -0.53 0.00 0.00 0.07 0.00 0.00 59.98 59.47 2cra h ARG 59 Cb 1.36 0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.61 2cra h ARG 59 CO 0.15 1.20 0.00 0.28 -1.07 0.00 0.00 179.97 180.52 2cra h VAL 60 N 0.09 0.00 0.00 2.04 2.07 -0.67 -2.49 116.25 117.29 2cra h VAL 60 Ca -0.31 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 2cra h VAL 60 Cb 2.06 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 2cra h VAL 60 CO 0.16 0.00 -0.29 0.50 0.02 0.00 0.00 177.57 177.96 2cra h LYS 61 N 0.00 0.00 -0.56 1.57 3.64 -1.60 -2.23 116.57 117.40 2cra h LYS 61 Ca 0.00 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.54 2cra h LYS 61 Cb 0.13 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2cra h LYS 61 CO 0.00 0.45 0.41 1.05 -2.27 0.00 0.00 179.45 179.09 2cra h GLU 62 N -1.00 0.00 0.00 1.90 4.11 -1.57 0.23 114.58 118.26 2cra h GLU 62 Ca -0.05 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.30 2cra h GLU 62 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2cra h GLU 62 CO -0.03 0.00 -1.08 1.57 0.07 0.00 0.00 179.01 179.54 2cra h LYS 63 N 0.00 0.00 -6.25 1.06 5.09 -1.57 -3.39 116.57 111.50 2cra h LYS 63 Ca 0.26 0.00 -0.56 0.00 0.09 0.00 0.00 60.65 60.45 2cra h LYS 63 Cb 1.09 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 33.38 2cra h LYS 63 CO -0.00 0.15 0.55 0.21 -2.09 0.00 0.00 179.45 178.27 2cra s LYS 64 N -3.15 4.42 -1.53 0.07 2.20 0.81 -3.68 119.74 118.88 2cra s LYS 64 Ca -0.01 1.38 -0.12 0.00 -0.36 0.00 0.00 55.97 56.85 2cra s LYS 64 Cb 0.09 -3.54 0.08 0.00 -1.51 0.00 0.00 37.83 32.95 2cra s LYS 64 CO 0.79 -0.31 0.90 0.45 -0.36 0.00 0.00 175.35 176.82 2cra n SER 65 N 4.98 -3.97 -2.77 1.43 2.88 -1.26 -4.88 113.62 110.03 2cra n SER 65 Ca 0.08 -0.83 -0.07 0.00 -1.33 0.00 0.00 58.87 56.72 2cra n SER 65 Cb 0.49 -3.68 0.04 0.00 -0.75 0.00 0.00 64.21 60.31 2cra n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cra n GLY 66 N -1.65 0.51 3.72 0.46 0.00 -1.24 -5.09 105.19 101.91 2cra n GLY 66 Ca -0.01 -1.95 -0.30 0.00 0.00 0.00 0.00 46.02 43.77 2cra n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cra s PRO 67 N -3.30 1.36 0.93 1.61 0.04 -1.26 -5.02 135.00 129.35 2cra s PRO 67 Ca 0.21 0.86 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 2cra s PRO 67 Cb -0.01 -1.82 0.15 0.00 0.04 0.00 0.00 34.50 32.86 2cra s PRO 67 CO 0.14 -2.18 1.09 -1.12 0.04 0.00 0.00 177.00 174.97 2cra s SER 68 N -3.42 3.11 0.08 6.66 0.01 -1.26 -5.05 113.70 113.83 2cra s SER 68 Ca 0.63 1.64 0.08 0.00 1.31 0.00 0.00 55.95 59.62 2cra s SER 68 Cb -0.18 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 2cra s SER 68 CO 0.57 -2.89 -0.20 -0.55 0.41 0.00 0.00 173.24 170.58 2cra s SER 69 N -3.16 3.72 0.00 2.44 0.15 -1.26 -5.30 113.70 110.29 2cra s SER 69 Ca 0.64 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2cra s SER 69 Cb -0.20 -0.51 0.00 0.00 -1.71 0.00 0.00 66.02 63.60 2cra s SER 69 CO 0.58 0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.85