#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 6.46 -0.09 1.61 0.15 -1.26 -5.01 113.70 115.56 2cra s SER 2 Ca 0.00 -1.62 -0.04 0.00 0.70 0.00 0.00 55.95 54.99 2cra s SER 2 Cb 0.00 -2.42 -0.04 0.00 -1.71 0.00 0.00 66.02 61.85 2cra s SER 2 CO 0.00 -1.24 0.06 -0.55 1.20 0.00 0.00 173.24 172.71 2cra s SER 3 N 3.79 5.73 0.00 5.45 0.15 -1.26 -4.99 113.70 122.58 2cra s SER 3 Ca 0.31 0.28 0.00 0.00 0.70 0.00 0.00 55.95 57.23 2cra s SER 3 Cb -0.08 -1.72 0.00 0.00 -1.71 0.00 0.00 66.02 62.50 2cra s SER 3 CO -0.03 0.38 0.00 0.61 1.20 0.00 0.00 173.24 175.41 2cra n GLY 4 N 2.01 -1.30 3.64 9.45 0.00 -1.26 -5.04 105.19 112.70 2cra n GLY 4 Ca -0.19 -1.96 -0.05 0.00 0.00 0.00 0.00 46.02 43.83 2cra n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cra s SER 5 N -4.00 -0.34 -0.08 1.61 0.15 -1.26 -5.09 113.70 104.69 2cra s SER 5 Ca 0.00 0.61 -0.05 0.00 0.70 0.00 0.00 55.95 57.21 2cra s SER 5 Cb 0.00 0.81 -0.02 0.00 -1.71 0.00 0.00 66.02 65.11 2cra s SER 5 CO 0.00 -0.10 -0.10 -0.24 1.20 0.00 0.00 173.24 173.99 2cra n SER 6 N 2.57 0.96 -0.83 5.45 2.88 -1.26 -5.11 113.62 118.29 2cra n SER 6 Ca -0.14 0.42 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 2cra n SER 6 Cb 0.57 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 2cra n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cra n GLY 7 N 1.66 -3.60 3.24 0.46 0.00 -1.26 -4.85 105.19 100.84 2cra n GLY 7 Ca -0.04 -1.02 -0.28 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.68 -2.67 -3.52 1.61 1.74 -1.26 -4.02 116.66 106.85 2cra n ARG 8 Ca 0.00 -0.78 -0.19 0.00 -0.77 0.00 0.00 57.85 56.11 2cra n ARG 8 Cb 0.16 -1.78 0.06 0.00 -1.02 0.00 0.00 32.46 29.88 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 -3.38 -5.13 -1.60 5.56 4.81 -1.26 -4.93 118.16 112.25 2cra n LYS 9 Ca 0.05 0.74 -0.36 0.00 -0.87 0.00 0.00 58.31 57.87 2cra n LYS 9 Cb 0.54 -5.51 0.08 0.00 0.02 0.00 0.00 35.03 30.15 2cra n LYS 9 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2cra n LYS 10 N -4.07 0.90 -2.31 1.64 2.85 -1.26 -5.04 118.16 110.88 2cra n LYS 10 Ca -0.26 0.37 -0.05 0.00 -1.05 0.00 0.00 58.31 57.32 2cra n LYS 10 Cb 0.66 -2.45 -0.01 0.00 -0.65 0.00 0.00 35.03 32.58 2cra n LYS 10 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 2cra n ARG 11 N -2.00 1.67 -1.63 -1.58 1.85 -1.26 -5.08 116.66 108.63 2cra n ARG 11 Ca 0.15 -0.62 -0.46 0.00 -1.00 0.00 0.00 57.85 55.91 2cra n ARG 11 Cb 0.48 0.14 -0.03 0.00 -1.05 0.00 0.00 32.46 32.01 2cra n ARG 11 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 2cra n ILE 12 N -0.35 1.06 -1.02 8.89 2.08 -1.26 -4.99 119.36 123.77 2cra n ILE 12 Ca -0.03 -0.26 -0.00 0.00 0.56 0.00 0.00 62.75 63.02 2cra n ILE 12 Cb 0.11 -1.18 0.00 0.00 -0.75 0.00 0.00 39.64 37.82 2cra n ILE 12 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 2cra n PRO 13 N 1.75 0.00 -2.09 0.38 -0.04 -1.26 -4.93 135.00 128.82 2cra n PRO 13 Ca 0.13 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2cra n PRO 13 Cb 0.29 -0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.75 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 -2.00 -3.93 -1.17 0.54 4.01 -1.26 -4.98 117.16 108.38 2cra n TYR 14 Ca 0.00 2.34 -0.30 0.00 -0.16 0.00 0.00 57.90 59.78 2cra n TYR 14 Cb 0.00 -3.50 0.14 0.00 -0.31 0.00 0.00 39.34 35.67 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 -0.49 3.38 0.36 7.72 0.01 -1.26 -4.63 113.70 118.79 2cra s SER 15 Ca 0.00 1.51 0.12 0.00 1.31 0.00 0.00 55.95 58.89 2cra s SER 15 Cb 0.00 -2.18 0.91 0.00 0.21 0.00 0.00 66.02 64.96 2cra s SER 15 CO 0.00 -2.70 1.82 0.11 0.41 0.00 0.00 173.24 172.87 2cra h LYS 16 N -1.59 0.57 -0.30 12.44 6.56 -1.98 0.92 116.57 133.18 2cra h LYS 16 Ca -0.50 -0.03 -0.14 0.00 -1.06 0.00 0.00 60.65 58.92 2cra h LYS 16 Cb 1.28 -0.13 -0.00 0.00 -0.57 0.00 0.00 32.23 32.81 2cra h LYS 16 CO 0.54 0.38 -0.35 0.78 -2.06 0.00 0.00 179.45 178.74 2cra h GLY 17 N 0.59 0.84 0.89 3.86 0.00 -1.99 -1.57 103.07 105.68 2cra h GLY 17 Ca 0.53 -0.88 -0.06 0.00 0.00 0.00 0.00 47.33 46.91 2cra h GLY 17 CO -0.27 0.80 -0.06 1.46 0.00 0.00 0.00 176.54 178.47 2cra h GLN 18 N 0.53 0.57 0.00 4.80 4.20 -1.46 -2.84 115.11 120.90 2cra h GLN 18 Ca 0.04 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.50 2cra h GLN 18 Cb 0.93 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 2cra h GLN 18 CO 0.08 0.75 -0.19 -0.07 -0.67 0.00 0.00 178.83 178.74 2cra h LEU 19 N 0.34 0.00 -1.53 1.46 3.38 -0.92 -2.79 115.31 115.25 2cra h LEU 19 Ca 0.08 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.13 2cra h LEU 19 Cb 0.53 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2cra h LEU 19 CO 0.03 0.19 0.42 -0.09 0.09 0.00 0.00 178.44 179.08 2cra h ARG 20 N 0.00 0.54 0.13 1.13 2.43 -1.02 0.26 114.38 117.84 2cra h ARG 20 Ca -0.00 -0.03 -0.32 0.00 -0.81 0.00 0.00 59.98 58.82 2cra h ARG 20 Cb 0.56 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 2cra h ARG 20 CO 0.02 0.36 -1.58 0.93 -1.51 0.00 0.00 179.97 178.19 2cra h GLU 21 N 0.55 0.27 0.39 0.20 4.39 -1.57 -3.19 114.58 115.63 2cra h GLU 21 Ca 0.29 -0.47 -0.02 0.00 0.34 0.00 0.00 59.36 59.50 2cra h GLU 21 Cb 0.40 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2cra h GLU 21 CO -0.09 1.14 -0.19 -0.07 -1.16 0.00 0.00 179.01 178.64 2cra h LEU 22 N 0.07 -0.44 -0.55 1.33 3.38 -1.28 -0.63 115.31 117.19 2cra h LEU 22 Ca -0.27 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 57.67 2cra h LEU 22 Cb 2.03 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 42.82 2cra h LEU 22 CO 0.16 -0.09 0.13 -0.33 0.09 0.00 0.00 178.44 178.40 2cra h GLU 23 N -0.85 0.26 0.56 1.13 5.08 -0.69 0.25 114.58 120.32 2cra h GLU 23 Ca -0.05 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2cra h GLU 23 Cb 0.54 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.74 2cra h GLU 23 CO 0.09 0.18 -0.27 0.00 -1.00 0.00 0.00 179.01 178.00 2cra h ARG 24 N 0.27 -0.72 -0.87 2.33 3.08 -1.56 -0.13 114.38 116.78 2cra h ARG 24 Ca 0.28 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.48 2cra h ARG 24 Cb 0.38 0.16 -0.06 0.00 0.08 0.00 0.00 29.97 30.53 2cra h ARG 24 CO -0.34 -0.46 0.56 0.93 -1.07 0.00 0.00 179.97 179.59 2cra h GLU 25 N -0.82 0.79 -0.11 0.04 3.07 -0.73 0.30 114.58 117.12 2cra h GLU 25 Ca -0.08 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.72 2cra h GLU 25 Cb 0.60 -0.18 -0.00 0.00 -0.84 0.00 0.00 28.75 28.33 2cra h GLU 25 CO 0.13 0.52 -0.01 -0.92 -1.40 0.00 0.00 179.01 177.33 2cra h TYR 26 N 0.81 0.22 0.00 4.33 3.20 -0.27 -0.81 116.97 124.45 2cra h TYR 26 Ca 0.41 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.20 2cra h TYR 26 Cb 0.49 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 2cra h TYR 26 CO -0.00 0.46 -0.20 0.00 -1.64 0.00 0.00 178.16 176.78 2cra h ALA 27 N 0.72 1.63 0.00 1.82 0.00 -0.31 -2.05 119.26 121.08 2cra h ALA 27 Ca 0.03 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 2cra h ALA 27 Cb 0.38 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2cra h ALA 27 CO 0.01 0.25 -0.55 0.00 0.00 0.00 0.00 179.25 178.96 2cra h ALA 28 N 1.80 0.66 -0.75 0.00 0.00 -0.78 -3.45 119.26 116.75 2cra h ALA 28 Ca -0.00 -0.50 0.18 0.00 0.00 0.00 0.00 54.91 54.59 2cra h ALA 28 Cb 0.37 -0.09 -0.22 0.00 0.00 0.00 0.00 17.79 17.85 2cra h ALA 28 CO 0.03 0.68 0.09 0.54 0.00 0.00 0.00 179.25 180.59 2cra s ASN 29 N -6.48 -0.69 0.51 0.00 2.20 -0.33 -5.02 114.94 105.13 2cra s ASN 29 Ca 0.03 0.62 0.27 0.00 -0.94 0.00 0.00 52.86 52.84 2cra s ASN 29 Cb 0.08 1.65 1.37 0.00 -2.00 0.00 0.00 41.25 42.36 2cra s ASN 29 CO 0.75 -0.13 1.90 0.11 -2.94 0.00 0.00 177.10 176.79 2cra h LYS 30 N 7.81 0.10 -4.59 3.55 1.57 -1.76 -3.37 116.57 119.88 2cra h LYS 30 Ca -0.16 -0.01 -0.62 0.00 -1.87 0.00 0.00 60.65 58.00 2cra h LYS 30 Cb 1.15 -0.02 -0.37 0.00 0.08 0.00 0.00 32.23 33.07 2cra h LYS 30 CO 0.04 0.06 -0.81 -0.06 -0.57 0.00 0.00 179.45 178.11 2cra s PHE 31 N -5.09 2.40 0.90 -1.35 0.40 -1.26 -4.97 117.98 109.01 2cra s PHE 31 Ca -0.06 -1.55 -0.14 0.00 -0.60 0.00 0.00 56.93 54.58 2cra s PHE 31 Cb 0.21 -1.64 0.16 0.00 0.51 0.00 0.00 43.02 42.27 2cra s PHE 31 CO 0.77 -0.74 1.26 0.96 0.70 0.00 0.00 175.22 178.17 2cra s ILE 32 N 1.40 2.02 0.24 0.64 -4.36 -1.26 -5.09 121.20 114.79 2cra s ILE 32 Ca -0.00 -0.05 0.08 0.00 -0.26 0.00 0.00 60.65 60.41 2cra s ILE 32 Cb -0.16 -2.97 -0.04 0.00 1.25 0.00 0.00 42.46 40.54 2cra s ILE 32 CO -0.09 0.00 0.06 0.28 0.24 0.00 0.00 174.94 175.44 2cra s THR 33 N -3.75 3.83 0.52 8.37 -1.32 -1.26 -4.94 115.64 117.09 2cra s THR 33 Ca 0.70 -1.64 0.29 0.00 -1.21 0.00 0.00 61.69 59.83 2cra s THR 33 Cb -0.06 -3.03 0.46 0.00 -1.51 0.00 0.00 72.50 68.36 2cra s THR 33 CO 0.51 -0.31 1.90 0.11 -2.21 0.00 0.00 174.62 174.62 2cra h LYS 34 N 1.94 0.06 -0.13 7.08 1.57 -1.98 0.32 116.57 125.43 2cra h LYS 34 Ca -0.46 -0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.12 2cra h LYS 34 Cb 1.24 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2cra h LYS 34 CO 0.60 0.04 -0.73 -0.44 -0.57 0.00 0.00 179.45 178.35 2cra h ASP 35 N 0.06 0.70 -0.00 0.86 5.19 -2.00 -3.05 116.42 118.18 2cra h ASP 35 Ca 0.41 -0.45 -0.06 0.00 -0.62 0.00 0.00 57.03 56.31 2cra h ASP 35 Cb 1.55 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 40.86 2cra h ASP 35 CO -0.03 1.21 -0.23 0.50 -3.12 0.00 0.00 179.24 177.57 2cra h LYS 36 N 0.41 0.16 -0.82 3.56 1.63 -0.92 -3.03 116.57 117.57 2cra h LYS 36 Ca -0.03 -0.17 0.23 0.00 -0.85 0.00 0.00 60.65 59.82 2cra h LYS 36 Cb 1.32 0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 32.96 2cra h LYS 36 CO 0.14 0.90 0.58 -0.09 -3.45 0.00 0.00 179.45 177.53 2cra h ARG 37 N -0.51 0.06 0.03 1.90 2.43 -0.76 0.26 114.38 117.79 2cra h ARG 37 Ca -0.03 -0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.90 2cra h ARG 37 Cb 0.98 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 2cra h ARG 37 CO 0.05 0.04 -1.02 0.00 -1.51 0.00 0.00 179.97 177.53 2cra h ARG 38 N 0.06 0.38 -0.04 0.20 3.08 -1.54 -3.00 114.38 113.53 2cra h ARG 38 Ca 0.40 -0.46 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 2cra h ARG 38 Cb 1.49 0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.68 2cra h ARG 38 CO -0.03 1.14 -0.08 0.87 -1.07 0.00 0.00 179.97 180.80 2cra h LYS 39 N 0.20 0.12 -0.93 0.04 1.79 -0.47 -3.17 116.57 114.15 2cra h LYS 39 Ca -0.10 -0.08 0.10 0.00 -2.18 0.00 0.00 60.65 58.39 2cra h LYS 39 Cb 1.67 0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 32.26 2cra h LYS 39 CO 0.17 0.65 0.60 0.82 -1.08 0.00 0.00 179.45 180.62 2cra h ILE 40 N -0.40 0.97 0.00 1.86 2.04 -1.04 0.12 117.51 121.06 2cra h ILE 40 Ca 0.00 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 2cra h ILE 40 Cb 0.65 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2cra h ILE 40 CO 0.02 0.17 -0.07 -1.28 0.00 0.00 0.00 178.15 176.99 2cra h SER 41 N 0.94 0.00 0.15 1.72 0.87 -1.52 0.17 113.55 115.87 2cra h SER 41 Ca 0.43 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 60.63 2cra h SER 41 Cb 0.40 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 2cra h SER 41 CO -0.19 0.07 -1.92 0.00 -0.53 0.00 0.00 176.83 174.25 2cra h ALA 42 N 1.93 0.35 -0.32 6.23 0.00 -0.84 0.49 119.26 127.10 2cra h ALA 42 Ca -0.00 -1.32 -0.09 0.00 0.00 0.00 0.00 54.91 53.50 2cra h ALA 42 Cb 0.16 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2cra h ALA 42 CO 0.01 1.23 -0.14 0.00 0.00 0.00 0.00 179.25 180.35 2cra h ALA 43 N 0.09 0.45 -0.38 0.00 0.00 -0.62 -3.09 119.26 115.71 2cra h ALA 43 Ca -0.40 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2cra h ALA 43 Cb 2.06 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2cra h ALA 43 CO 0.12 0.34 0.00 0.25 0.00 0.00 0.00 179.25 179.96 2cra n THR 44 N -4.38 0.49 -3.05 0.00 -2.24 0.55 -4.94 114.28 100.71 2cra n THR 44 Ca -0.03 -0.73 -0.20 0.00 -2.27 0.00 0.00 64.05 60.83 2cra n THR 44 Cb 0.38 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 2cra n THR 44 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2cra n SER 45 N 1.45 -4.15 -5.01 3.42 7.64 -0.60 -4.92 113.62 111.45 2cra n SER 45 Ca 0.19 -0.21 -0.21 0.00 1.01 0.00 0.00 58.87 59.65 2cra n SER 45 Cb 0.60 -3.44 0.05 0.00 -1.01 0.00 0.00 64.21 60.41 2cra n SER 45 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2cra s LEU 46 N -6.27 2.99 0.24 -3.43 1.43 0.06 -4.96 118.68 108.74 2cra s LEU 46 Ca 0.27 -0.95 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 2cra s LEU 46 Cb -0.14 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 2cra s LEU 46 CO 0.33 -1.32 0.43 -0.55 0.23 0.00 0.00 176.35 175.47 2cra s SER 47 N -4.60 6.36 0.23 2.29 0.15 -1.26 -4.44 113.70 112.42 2cra s SER 47 Ca 0.56 0.39 -0.06 0.00 0.70 0.00 0.00 55.95 57.54 2cra s SER 47 Cb -0.05 -2.00 0.33 0.00 -1.71 0.00 0.00 66.02 62.59 2cra s SER 47 CO 0.36 -0.11 1.81 -0.33 1.20 0.00 0.00 173.24 176.17 2cra h GLU 48 N 1.60 0.74 -0.17 5.44 5.08 -1.95 -1.70 114.58 123.63 2cra h GLU 48 Ca -0.49 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 57.68 2cra h GLU 48 Cb 1.20 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2cra h GLU 48 CO 0.65 0.49 -0.45 -0.09 -1.00 0.00 0.00 179.01 178.61 2cra h ARG 49 N 0.77 0.61 -0.45 2.33 9.65 -1.95 -2.97 114.38 122.37 2cra h ARG 49 Ca 0.36 -0.43 0.09 0.00 -1.10 0.00 0.00 59.98 58.90 2cra h ARG 49 Cb 0.28 0.07 -0.08 0.00 -1.39 0.00 0.00 29.97 28.84 2cra h ARG 49 CO -0.22 1.05 -0.05 1.96 2.80 0.00 0.00 179.97 185.51 2cra h GLN 50 N 0.28 0.06 0.00 0.20 4.20 -1.82 0.19 115.11 118.22 2cra h GLN 50 Ca -0.01 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2cra h GLN 50 Cb 1.07 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.83 2cra h GLN 50 CO 0.10 0.04 -0.16 0.82 -0.67 0.00 0.00 178.83 178.95 2cra h ILE 51 N 0.06 0.81 0.05 2.54 2.04 -1.37 -2.65 117.51 118.99 2cra h ILE 51 Ca 0.22 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 2cra h ILE 51 Cb 0.34 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.79 2cra h ILE 51 CO -0.42 0.16 -0.02 0.74 0.00 0.00 0.00 178.15 178.61 2cra h THR 52 N 0.00 1.31 -0.42 -0.27 2.02 -0.60 -2.96 112.91 111.99 2cra h THR 52 Ca -0.00 -1.58 0.08 0.00 0.77 0.00 0.00 66.41 65.68 2cra h THR 52 Cb 0.36 2.30 -0.07 0.00 -1.74 0.00 0.00 68.15 69.00 2cra h THR 52 CO 0.02 0.38 -0.02 0.40 0.37 0.00 0.00 175.52 176.67 2cra h ILE 53 N -0.81 0.66 -0.54 3.11 2.04 -0.65 -1.06 117.51 120.27 2cra h ILE 53 Ca -0.01 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.88 2cra h ILE 53 Cb 0.66 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 37.25 2cra h ILE 53 CO 0.01 0.02 0.25 -0.25 0.00 0.00 0.00 178.15 178.18 2cra h TRP 54 N 0.09 0.45 0.00 1.37 7.01 -1.58 0.17 115.95 123.46 2cra h TRP 54 Ca 0.21 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.21 2cra h TRP 54 Cb 0.31 -0.12 -0.00 0.00 -2.10 0.00 0.00 29.16 27.24 2cra h TRP 54 CO -0.29 0.19 -0.09 0.74 -2.79 0.00 0.00 178.44 176.20 2cra h PHE 55 N 0.47 0.00 0.08 2.65 -1.00 -1.14 -2.02 116.94 115.98 2cra h PHE 55 Ca 0.25 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.03 2cra h PHE 55 Cb 0.21 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.77 2cra h PHE 55 CO -0.12 0.09 -0.04 1.96 -1.61 0.00 0.00 178.31 178.59 2cra h GLN 56 N 0.00 -0.10 -0.27 1.51 4.20 0.13 -3.23 115.11 117.35 2cra h GLN 56 Ca -0.00 0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.80 2cra h GLN 56 Cb 0.18 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 2cra h GLN 56 CO 0.01 0.38 0.29 -0.91 -0.67 0.00 0.00 178.83 177.93 2cra h ASN 57 N -0.94 0.00 -0.14 1.46 2.35 -0.90 0.28 115.58 117.69 2cra h ASN 57 Ca -0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2cra h ASN 57 Cb 0.53 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.90 2cra h ASN 57 CO 0.02 0.00 -0.00 -0.09 -1.65 0.00 0.00 177.43 175.70 2cra h ARG 58 N 0.00 0.25 0.01 0.81 9.65 -1.41 -1.92 114.38 121.77 2cra h ARG 58 Ca 0.13 -0.08 -0.03 0.00 -1.10 0.00 0.00 59.98 58.90 2cra h ARG 58 Cb 0.70 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 29.26 2cra h ARG 58 CO -0.00 0.49 -0.14 0.00 2.80 0.00 0.00 179.97 183.11 2cra h ARG 59 N -0.02 0.02 -0.66 0.20 3.08 -1.25 -3.30 114.38 112.45 2cra h ARG 59 Ca 0.04 -0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.24 2cra h ARG 59 Cb 0.38 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 2cra h ARG 59 CO 0.01 1.02 0.52 0.28 -1.07 0.00 0.00 179.97 180.72 2cra h VAL 60 N -0.95 0.56 -0.84 2.04 2.07 -0.60 0.51 116.25 119.03 2cra h VAL 60 Ca -0.03 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.71 2cra h VAL 60 Cb 1.07 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 2cra h VAL 60 CO -0.00 0.00 0.59 0.50 0.02 0.00 0.00 177.57 178.67 2cra h LYS 61 N 0.00 0.16 -0.57 1.57 3.64 -1.42 0.23 116.57 120.17 2cra h LYS 61 Ca 0.31 -0.01 -0.33 0.00 -1.27 0.00 0.00 60.65 59.35 2cra h LYS 61 Cb 1.34 -0.04 -0.20 0.00 -0.41 0.00 0.00 32.23 32.93 2cra h LYS 61 CO -0.00 0.10 0.04 -0.85 -2.27 0.00 0.00 179.45 176.48 2cra n GLU 62 N -4.38 2.19 -0.04 1.90 0.28 0.17 -4.42 120.64 116.34 2cra n GLU 62 Ca 0.17 -3.30 -0.05 0.00 -0.16 0.00 0.00 57.16 53.82 2cra n GLU 62 Cb 0.80 -1.98 -0.03 0.00 1.43 0.00 0.00 31.44 31.66 2cra n GLU 62 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2cra n LYS 63 N -1.06 0.17 -0.01 3.44 4.76 0.80 -4.76 118.16 121.50 2cra n LYS 63 Ca 0.42 0.05 -0.16 0.00 -2.87 0.00 0.00 58.31 55.74 2cra n LYS 63 Cb 1.09 -1.08 -0.12 0.00 -1.84 0.00 0.00 35.03 33.09 2cra n LYS 63 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2cra h LYS 64 N -0.05 0.25 -3.99 1.97 1.57 -1.77 -3.47 116.57 111.08 2cra h LYS 64 Ca -0.16 -0.28 -0.14 0.00 -1.87 0.00 0.00 60.65 58.19 2cra h LYS 64 Cb 1.23 0.08 -0.18 0.00 0.08 0.00 0.00 32.23 33.44 2cra h LYS 64 CO -0.04 1.01 -0.64 0.45 -0.57 0.00 0.00 179.45 179.66 2cra s SER 65 N -6.50 0.29 0.62 0.86 0.15 -1.26 -5.17 113.70 102.69 2cra s SER 65 Ca -0.15 -0.65 -0.02 0.00 0.70 0.00 0.00 55.95 55.83 2cra s SER 65 Cb 0.02 0.17 0.05 0.00 -1.71 0.00 0.00 66.02 64.55 2cra s SER 65 CO 0.77 -0.45 0.88 -0.83 1.20 0.00 0.00 173.24 174.80 2cra s GLY 66 N -2.10 1.78 0.89 9.45 0.00 -1.26 -4.41 107.32 111.67 2cra s GLY 66 Ca -0.06 -1.24 -0.15 0.00 0.00 0.00 0.00 44.72 43.27 2cra s GLY 66 CO -0.05 -0.89 0.79 -1.55 0.00 0.00 0.00 173.10 171.41 2cra n PRO 67 N -2.58 -2.57 -3.60 2.90 -0.04 -1.26 -5.10 135.00 122.74 2cra n PRO 67 Ca 0.09 -1.27 -0.05 0.00 -0.04 0.00 0.00 63.50 62.23 2cra n PRO 67 Cb 0.60 -1.19 -0.02 0.00 -0.04 0.00 0.00 33.50 32.86 2cra n PRO 67 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cra s SER 68 N -3.64 -0.23 -0.78 3.54 0.15 -1.26 -5.10 113.70 106.38 2cra s SER 68 Ca 0.51 -0.12 -0.24 0.00 0.70 0.00 0.00 55.95 56.80 2cra s SER 68 Cb -0.05 0.33 0.05 0.00 -1.71 0.00 0.00 66.02 64.64 2cra s SER 68 CO 0.39 -0.56 1.21 -0.55 1.20 0.00 0.00 173.24 174.93 2cra s SER 69 N -2.60 6.26 0.00 5.45 0.15 -1.26 -5.36 113.70 116.33 2cra s SER 69 Ca 0.09 -0.90 0.17 0.00 0.70 0.00 0.00 55.95 56.02 2cra s SER 69 Cb -0.00 -2.51 0.14 0.00 -1.71 0.00 0.00 66.02 61.93 2cra s SER 69 CO -0.05 -1.61 1.05 0.61 1.20 0.00 0.00 173.24 174.44