#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ctr n SER 2 N 0.00 -0.27 -0.01 1.61 3.41 -1.26 -4.83 113.62 112.27 2ctr n SER 2 Ca 0.00 -1.24 -0.16 0.00 -0.26 0.00 0.00 58.87 57.21 2ctr n SER 2 Cb 0.00 -1.77 -0.10 0.00 -0.26 0.00 0.00 64.21 62.08 2ctr n SER 2 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2ctr h SER 3 N -1.48 0.48 0.00 4.04 4.64 -2.09 -3.47 113.55 115.67 2ctr h SER 3 Ca -0.63 -0.71 0.00 0.00 -0.47 0.00 0.00 61.79 59.98 2ctr h SER 3 Cb 1.39 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2ctr h SER 3 CO 0.77 1.12 0.00 0.61 -0.87 0.00 0.00 176.83 178.46 2ctr n GLY 4 N 0.90 -1.03 3.82 -0.77 0.00 -1.26 -5.16 105.19 101.69 2ctr n GLY 4 Ca -0.09 0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 2ctr n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ctr s SER 5 N 0.00 7.03 -0.47 1.61 1.04 -1.26 -5.04 113.70 116.61 2ctr s SER 5 Ca 0.00 1.31 -0.20 0.00 0.48 0.00 0.00 55.95 57.54 2ctr s SER 5 Cb 0.00 -2.38 0.04 0.00 0.10 0.00 0.00 66.02 63.78 2ctr s SER 5 CO 0.00 0.12 0.65 -0.94 0.98 0.00 0.00 173.24 174.06 2ctr s SER 6 N -1.50 6.28 0.22 7.02 1.04 -1.26 -4.78 113.70 120.73 2ctr s SER 6 Ca 0.38 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.25 2ctr s SER 6 Cb -0.17 -2.31 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2ctr s SER 6 CO 0.21 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.18 2ctr n GLY 7 N 5.10 -0.24 3.84 7.32 0.00 -1.26 -5.04 105.19 114.91 2ctr n GLY 7 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 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 -5.10 5.75 0.08 1.61 0.01 -1.26 -4.99 113.70 109.81 2ctr s SER 8 Ca 0.00 -0.06 -0.27 0.00 1.31 0.00 0.00 55.95 56.92 2ctr s SER 8 Cb 0.00 -1.57 -0.12 0.00 0.21 0.00 0.00 66.02 64.55 2ctr s SER 8 CO 0.00 0.05 1.44 1.88 0.41 0.00 0.00 173.24 177.02 2ctr h TYR 9 N 2.19 -1.22 -1.53 2.43 0.05 -1.96 -0.04 116.97 116.89 2ctr h TYR 9 Ca -0.48 0.03 0.46 0.00 0.05 0.00 0.00 58.73 58.80 2ctr h TYR 9 Cb 1.20 0.52 -0.08 0.00 1.01 0.00 0.00 36.73 39.38 2ctr h TYR 9 CO 0.56 -0.47 1.07 0.66 -1.05 0.00 0.00 178.16 178.92 2ctr n TYR 10 N -4.84 0.19 -0.02 4.88 4.01 -1.26 0.16 117.16 120.27 2ctr n TYR 10 Ca -0.07 0.20 -0.18 0.00 -0.16 0.00 0.00 57.90 57.69 2ctr n TYR 10 Cb 0.33 -0.62 -0.13 0.00 -0.31 0.00 0.00 39.34 38.61 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 0.21 -0.81 7.72 5.19 -1.30 0.34 116.42 127.78 2ctr h ASP 11 Ca 0.79 -0.90 0.01 0.00 -0.62 0.00 0.00 57.03 56.32 2ctr h ASP 11 Cb 2.97 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 42.37 2ctr h ASP 11 CO -0.13 1.30 0.53 0.40 -3.12 0.00 0.00 179.24 178.21 2ctr h ILE 12 N -0.68 1.19 0.18 0.35 2.04 0.28 -2.90 117.51 117.96 2ctr h ILE 12 Ca -0.14 -0.37 -0.32 0.00 1.00 0.00 0.00 64.86 65.03 2ctr h ILE 12 Cb 1.38 0.02 0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2ctr h ILE 12 CO 0.03 0.20 -1.47 -0.07 0.00 0.00 0.00 178.15 176.84 2ctr h LEU 13 N 1.08 0.59 -0.07 1.44 3.38 -0.76 -3.47 115.31 117.50 2ctr h LEU 13 Ca 0.30 -0.70 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2ctr h LEU 13 Cb -0.10 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.46 2ctr h LEU 13 CO -0.08 1.56 0.00 0.61 0.09 0.00 0.00 178.44 180.63 2ctr n GLY 14 N 1.67 1.39 3.35 0.83 0.00 -0.11 -4.76 105.19 107.57 2ctr n GLY 14 Ca -0.16 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.07 2.02 1.05 1.61 -7.23 -0.08 -5.01 120.40 110.68 2ctr s VAL 15 Ca 0.00 -1.81 -0.14 0.00 -1.81 0.00 0.00 61.98 58.23 2ctr s VAL 15 Cb 0.00 -1.87 0.21 0.00 0.56 0.00 0.00 36.38 35.29 2ctr s VAL 15 CO 0.00 -0.10 1.10 -2.16 -0.31 0.00 0.00 175.10 173.62 2ctr s PRO 16 N -2.35 0.04 0.32 4.82 0.04 -1.26 -4.53 135.00 132.08 2ctr s PRO 16 Ca 0.14 0.39 0.12 0.00 0.04 0.00 0.00 61.00 61.69 2ctr s PRO 16 Cb -0.08 -1.70 0.54 0.00 0.04 0.00 0.00 34.50 33.29 2ctr s PRO 16 CO 0.07 -2.96 1.71 0.87 0.04 0.00 0.00 177.00 176.72 2ctr h LYS 17 N -2.06 0.00 -0.27 4.56 6.56 -2.01 -2.56 116.57 120.80 2ctr h LYS 17 Ca -0.54 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.05 2ctr h LYS 17 Cb 1.33 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.99 2ctr h LYS 17 CO 0.54 0.50 0.00 -1.13 -2.06 0.00 0.00 179.45 177.29 2ctr n SER 18 N -3.89 2.34 -4.58 0.86 3.41 -1.26 -4.96 113.62 105.53 2ctr n SER 18 Ca -0.01 -1.84 -0.52 0.00 -0.26 0.00 0.00 58.87 56.24 2ctr n SER 18 Cb 0.52 -0.17 -0.06 0.00 -0.26 0.00 0.00 64.21 64.24 2ctr n SER 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ctr n ALA 19 N 0.76 -1.18 -2.02 7.33 0.00 -0.97 -4.93 120.51 119.51 2ctr n ALA 19 Ca 0.17 0.51 -0.31 0.00 0.00 0.00 0.00 53.44 53.81 2ctr n ALA 19 Cb 0.43 -2.03 -0.03 0.00 0.00 0.00 0.00 19.45 17.81 2ctr n ALA 19 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ctr s SER 20 N 0.30 6.58 0.27 0.00 0.01 -1.26 -4.78 113.70 114.82 2ctr s SER 20 Ca 0.82 1.35 -0.04 0.00 1.31 0.00 0.00 55.95 59.38 2ctr s SER 20 Cb -0.95 -2.41 0.53 0.00 0.21 0.00 0.00 66.02 63.39 2ctr s SER 20 CO 0.49 -0.48 1.47 1.21 0.41 0.00 0.00 173.24 176.34 2ctr n GLU 21 N -1.39 -0.08 -0.31 12.44 2.13 -1.26 0.19 120.64 132.36 2ctr n GLU 21 Ca 0.04 1.45 0.01 0.00 0.66 0.00 0.00 57.16 59.33 2ctr n GLU 21 Cb 0.54 -2.21 0.20 0.00 0.27 0.00 0.00 31.44 30.24 2ctr n GLU 21 CO 0.00 0.00 0.00 0.07 -0.41 0.00 0.00 177.13 176.79 2ctr h ARG 22 N 0.00 1.10 -0.18 5.31 0.11 -1.98 0.12 114.38 118.86 2ctr h ARG 22 Ca 0.49 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 60.48 2ctr h ARG 22 Cb 0.85 -0.25 -0.01 0.00 1.11 0.00 0.00 29.97 31.67 2ctr h ARG 22 CO -0.94 0.73 0.00 1.96 0.10 0.00 0.00 179.97 181.82 2ctr h GLN 23 N 1.13 0.32 0.30 0.08 1.08 0.18 -1.30 115.11 116.90 2ctr h GLN 23 Ca 0.36 -0.10 -0.01 0.00 -1.45 0.00 0.00 58.65 57.45 2ctr h GLN 23 Cb 0.03 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2ctr h GLN 23 CO -0.11 0.53 -0.14 0.82 -0.95 0.00 0.00 178.83 178.97 2ctr h ILE 24 N 0.07 0.73 -0.59 2.54 2.04 -0.68 0.14 117.51 121.77 2ctr h ILE 24 Ca 0.05 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.77 2ctr h ILE 24 Cb 0.38 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 37.25 2ctr h ILE 24 CO 0.01 0.05 0.24 0.11 0.00 0.00 0.00 178.15 178.56 2ctr h LYS 25 N -0.52 0.43 -0.44 2.37 1.57 -1.02 0.22 116.57 119.17 2ctr h LYS 25 Ca -0.04 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 2ctr h LYS 25 Cb 0.39 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2ctr h LYS 25 CO 0.07 0.28 0.06 0.87 -0.57 0.00 0.00 179.45 180.16 2ctr h LYS 26 N 0.44 0.74 -0.74 3.15 1.57 -1.12 0.12 116.57 120.73 2ctr h LYS 26 Ca 0.29 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2ctr h LYS 26 Cb 0.32 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 2ctr h LYS 26 CO -0.27 0.77 0.31 0.00 -0.57 0.00 0.00 179.45 179.69 2ctr h ALA 27 N 0.94 0.96 0.23 3.86 0.00 0.04 -2.40 119.26 122.88 2ctr h ALA 27 Ca 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2ctr h ALA 27 Cb 0.39 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2ctr h ALA 27 CO 0.01 0.57 -0.11 0.35 0.00 0.00 0.00 179.25 180.07 2ctr h PHE 28 N 1.06 -0.29 -0.19 0.00 3.57 -0.44 -2.85 116.94 117.80 2ctr h PHE 28 Ca 0.25 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.76 2ctr h PHE 28 Cb 0.20 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 2ctr h PHE 28 CO 0.02 0.09 -0.23 0.45 -2.23 0.00 0.00 178.31 176.41 2ctr h HIS 29 N -0.87 -0.69 -0.74 0.41 3.86 -0.77 0.26 115.15 116.60 2ctr h HIS 29 Ca -0.03 0.04 0.16 0.00 -1.16 0.00 0.00 60.37 59.38 2ctr h HIS 29 Cb 0.51 0.33 -0.13 0.00 1.06 0.00 0.00 27.41 29.17 2ctr h HIS 29 CO 0.06 -0.19 -0.07 1.57 0.86 0.00 0.00 177.93 180.16 2ctr h LYS 30 N -0.14 0.06 0.44 2.45 2.10 -1.57 -2.05 116.57 117.85 2ctr h LYS 30 Ca 0.03 -0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.66 2ctr h LYS 30 Cb 0.23 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.54 2ctr h LYS 30 CO -0.25 0.04 -0.34 -0.07 -2.00 0.00 0.00 179.45 176.82 2ctr h LEU 31 N 0.06 -0.90 -1.31 7.07 3.38 -0.96 -2.08 115.31 120.57 2ctr h LEU 31 Ca 0.39 0.06 0.43 0.00 0.09 0.00 0.00 57.88 58.85 2ctr h LEU 31 Cb 0.66 0.28 -0.11 0.00 0.09 0.00 0.00 40.66 41.58 2ctr h LEU 31 CO -0.70 -0.48 0.87 0.00 0.09 0.00 0.00 178.44 178.21 2ctr n ALA 32 N -2.58 1.28 -0.08 1.53 0.00 0.78 0.22 120.51 121.65 2ctr n ALA 32 Ca -0.09 0.71 -0.12 0.00 0.00 0.00 0.00 53.44 53.94 2ctr n ALA 32 Cb 0.33 -0.93 -0.05 0.00 0.00 0.00 0.00 19.45 18.80 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 0.53 -0.41 0.00 2.86 -0.99 1.88 114.93 118.80 2ctr h MET 33 Ca 0.77 -0.25 -0.07 0.00 -2.06 0.00 0.00 59.70 58.10 2ctr h MET 33 Cb 2.64 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 34.27 2ctr h MET 33 CO -0.32 0.81 -0.04 -0.22 1.06 0.00 0.00 176.91 178.20 2ctr h LYS 34 N 0.25 0.68 -0.31 1.72 3.64 0.29 -2.81 116.57 120.04 2ctr h LYS 34 Ca 0.05 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2ctr h LYS 34 Cb 0.67 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2ctr h LYS 34 CO 0.04 0.73 0.00 0.66 -2.27 0.00 0.00 179.45 178.61 2ctr n TYR 35 N -4.21 0.92 -1.67 1.91 4.01 -0.46 -4.88 117.16 112.79 2ctr n TYR 35 Ca 0.02 -0.79 -0.44 0.00 -0.16 0.00 0.00 57.90 56.53 2ctr n TYR 35 Cb 0.31 -0.27 -0.04 0.00 -0.31 0.00 0.00 39.34 39.03 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 -0.20 2.46 0.80 -0.72 -0.00 0.64 -4.41 115.22 113.79 2ctr n HIS 36 Ca 0.20 -0.27 0.07 0.00 0.46 0.00 0.00 57.72 58.18 2ctr n HIS 36 Cb 0.82 -2.77 0.40 0.00 -0.12 0.00 0.00 29.99 28.33 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 7.31 0.31 -0.08 1.57 -0.04 -1.26 0.14 135.00 142.95 2ctr n PRO 37 Ca 0.21 0.09 -0.18 0.00 -0.04 0.00 0.00 63.50 63.58 2ctr n PRO 37 Cb 0.38 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.20 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 -1.18 1.76 -0.06 3.54 -0.08 -1.26 -4.56 116.55 114.72 2ctr n ASP 38 Ca 0.09 0.01 -0.15 0.00 -1.51 0.00 0.00 54.79 53.23 2ctr n ASP 38 Cb 0.09 -0.39 -0.14 0.00 2.34 0.00 0.00 41.12 43.03 2ctr n ASP 38 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2ctr n LYS 39 N -3.26 0.69 -2.42 -0.67 4.76 -1.08 -4.88 118.16 111.29 2ctr n LYS 39 Ca -0.39 0.19 -0.43 0.00 -2.87 0.00 0.00 58.31 54.81 2ctr n LYS 39 Cb 1.03 -1.64 -0.02 0.00 -1.84 0.00 0.00 35.03 32.55 2ctr n LYS 39 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2ctr s ASN 40 N -6.35 6.96 -0.52 4.39 3.84 0.12 -4.92 114.94 118.46 2ctr s ASN 40 Ca -0.18 1.74 -0.03 0.00 0.21 0.00 0.00 52.86 54.60 2ctr s ASN 40 Cb 0.07 -2.54 0.17 0.00 -0.55 0.00 0.00 41.25 38.40 2ctr s ASN 40 CO 0.75 -0.72 2.46 0.29 -2.79 0.00 0.00 177.10 177.09 2ctr n LYS 41 N 6.26 2.39 -4.27 0.43 4.76 -1.26 -4.71 118.16 121.75 2ctr n LYS 41 Ca 0.13 -2.50 -0.17 0.00 -2.87 0.00 0.00 58.31 52.90 2ctr n LYS 41 Cb 0.45 -2.09 -0.14 0.00 -1.84 0.00 0.00 35.03 31.41 2ctr n LYS 41 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2ctr s SER 42 N -0.10 1.06 0.18 4.39 0.15 -1.26 -5.05 113.70 113.07 2ctr s SER 42 Ca 0.54 -0.28 -0.07 0.00 0.70 0.00 0.00 55.95 56.83 2ctr s SER 42 Cb 0.38 -0.08 0.06 0.00 -1.71 0.00 0.00 66.02 64.68 2ctr s SER 42 CO -0.21 0.03 1.52 1.55 1.20 0.00 0.00 173.24 177.33 2ctr h PRO 43 N 5.47 0.78 -0.60 5.44 0.13 -2.01 -3.17 132.00 138.03 2ctr h PRO 43 Ca -0.33 -0.41 -0.09 0.00 -0.87 0.00 0.00 66.00 64.30 2ctr h PRO 43 Cb 1.19 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 2ctr h PRO 43 CO 0.47 1.04 0.01 0.22 -0.23 0.00 0.00 178.00 179.51 2ctr h ASP 44 N 0.63 1.03 -0.91 1.44 1.82 -1.99 -3.05 116.42 115.39 2ctr h ASP 44 Ca 0.05 -0.30 0.25 0.00 -0.39 0.00 0.00 57.03 56.64 2ctr h ASP 44 Cb 0.96 -0.28 -0.16 0.00 0.68 0.00 0.00 39.33 40.54 2ctr h ASP 44 CO 0.09 1.08 0.13 0.00 -1.61 0.00 0.00 179.24 178.93 2ctr h ALA 45 N 0.99 1.20 -0.94 -0.78 0.00 -1.90 0.64 119.26 118.47 2ctr h ALA 45 Ca 0.17 0.27 0.12 0.00 0.00 0.00 0.00 54.91 55.48 2ctr h ALA 45 Cb 0.54 0.44 -0.08 0.00 0.00 0.00 0.00 17.79 18.69 2ctr h ALA 45 CO 0.03 -0.53 0.56 1.49 0.00 0.00 0.00 179.25 180.81 2ctr h GLU 46 N 0.10 0.86 -0.34 0.00 4.81 -1.65 -1.52 114.58 116.84 2ctr h GLU 46 Ca 0.56 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.71 2ctr h GLU 46 Cb 1.15 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 2ctr h GLU 46 CO -0.77 0.57 0.11 0.00 -0.73 0.00 0.00 179.01 178.19 2ctr h ALA 47 N 1.52 0.45 0.15 2.92 0.00 0.16 -2.55 119.26 121.90 2ctr h ALA 47 Ca 0.47 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.23 2ctr h ALA 47 Cb 0.49 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2ctr h ALA 47 CO -0.28 0.08 -0.21 0.87 0.00 0.00 0.00 179.25 179.72 2ctr h LYS 48 N 0.40 -0.40 -0.60 0.00 1.79 -0.75 -1.60 116.57 115.41 2ctr h LYS 48 Ca 0.11 0.03 0.15 0.00 -2.18 0.00 0.00 60.65 58.76 2ctr h LYS 48 Cb 0.25 0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.96 2ctr h LYS 48 CO -0.00 -0.27 0.42 0.35 -1.08 0.00 0.00 179.45 178.87 2ctr h PHE 49 N -0.42 0.14 0.00 -1.35 3.04 -1.29 0.30 116.94 117.37 2ctr h PHE 49 Ca 0.02 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.97 2ctr h PHE 49 Cb 0.42 -0.05 -0.00 0.00 2.56 0.00 0.00 35.95 38.88 2ctr h PHE 49 CO -0.18 0.06 -0.02 -0.09 -2.02 0.00 0.00 178.31 176.05 2ctr h ARG 50 N 0.12 0.00 0.00 1.11 9.65 -0.85 -1.14 114.38 123.27 2ctr h ARG 50 Ca 0.29 0.00 -0.24 0.00 -1.10 0.00 0.00 59.98 58.93 2ctr h ARG 50 Cb 0.97 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.50 2ctr h ARG 50 CO -0.04 0.02 -1.97 0.39 2.80 0.00 0.00 179.97 181.17 2ctr n GLU 51 N -3.25 0.66 -0.03 0.20 -0.58 0.10 -4.00 120.64 113.74 2ctr n GLU 51 Ca -0.02 0.06 -0.15 0.00 -0.42 0.00 0.00 57.16 56.64 2ctr n GLU 51 Cb 0.15 -1.63 -0.10 0.00 -0.57 0.00 0.00 31.44 29.28 2ctr n GLU 51 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2ctr h ILE 52 N 0.00 1.45 0.40 -3.67 2.04 -0.85 -2.95 117.51 113.92 2ctr h ILE 52 Ca -0.32 -1.68 -0.02 0.00 1.00 0.00 0.00 64.86 63.85 2ctr h ILE 52 Cb 1.83 2.38 -0.01 0.00 -0.74 0.00 0.00 36.82 40.28 2ctr h ILE 52 CO 0.04 0.47 -0.28 0.00 0.00 0.00 0.00 178.15 178.37 2ctr h ALA 53 N 0.41 -1.07 -1.06 1.87 0.00 -1.44 -1.04 119.26 116.93 2ctr h ALA 53 Ca -0.01 -0.13 0.31 0.00 0.00 0.00 0.00 54.91 55.08 2ctr h ALA 53 Cb 0.89 0.44 -0.13 0.00 0.00 0.00 0.00 17.79 18.99 2ctr h ALA 53 CO 0.05 -1.06 0.65 1.49 0.00 0.00 0.00 179.25 180.38 2ctr h GLU 54 N -0.65 0.34 -0.25 0.00 4.81 -1.71 0.33 114.58 117.45 2ctr h GLU 54 Ca -0.05 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 2ctr h GLU 54 Cb 0.54 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 2ctr h GLU 54 CO 0.03 0.22 0.08 0.00 -0.73 0.00 0.00 179.01 178.61 2ctr h ALA 55 N 1.73 0.32 0.23 2.92 0.00 -1.28 -3.15 119.26 120.04 2ctr h ALA 55 Ca 0.70 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.46 2ctr h ALA 55 Cb 1.70 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2ctr h ALA 55 CO -0.47 -0.05 -0.11 -0.92 0.00 0.00 0.00 179.25 177.69 2ctr h TYR 56 N 0.23 -0.29 -0.72 0.00 3.20 0.80 -2.84 116.97 117.35 2ctr h TYR 56 Ca 0.08 -0.01 0.23 0.00 3.14 0.00 0.00 58.73 62.17 2ctr h TYR 56 Cb 0.23 0.10 -0.13 0.00 1.54 0.00 0.00 36.73 38.46 2ctr h TYR 56 CO 0.00 0.08 0.13 0.39 -1.64 0.00 0.00 178.16 177.12 2ctr n GLU 57 N -5.04 -0.05 -0.03 1.82 -0.58 0.70 0.22 120.64 117.68 2ctr n GLU 57 Ca -0.09 1.06 -0.14 0.00 -0.42 0.00 0.00 57.16 57.57 2ctr n GLU 57 Cb 0.26 -1.74 -0.10 0.00 -0.57 0.00 0.00 31.44 29.28 2ctr n GLU 57 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2ctr h THR 58 N 0.00 1.47 -0.11 2.62 2.02 -1.54 -3.10 112.91 114.27 2ctr h THR 58 Ca 0.49 -1.55 0.00 0.00 0.77 0.00 0.00 66.41 66.12 2ctr h THR 58 Cb 1.12 2.40 0.00 0.00 -1.74 0.00 0.00 68.15 69.93 2ctr h THR 58 CO -0.64 0.42 0.00 0.18 0.37 0.00 0.00 175.52 175.85 2ctr n LEU 59 N -4.64 0.82 -0.10 2.58 4.77 0.34 -1.09 117.00 119.68 2ctr n LEU 59 Ca -0.08 -0.41 -0.17 0.00 -0.03 0.00 0.00 56.01 55.32 2ctr n LEU 59 Cb 0.38 -0.16 -0.08 0.00 -2.33 0.00 0.00 43.42 41.24 2ctr n LEU 59 CO 0.37 0.18 -0.58 -0.24 -1.33 0.00 0.00 177.39 175.79 2ctr n SER 60 N -0.12 1.86 -2.99 -1.43 2.88 0.60 -4.83 113.62 109.59 2ctr n SER 60 Ca 0.04 0.47 -0.15 0.00 -1.33 0.00 0.00 58.87 57.90 2ctr n SER 60 Cb 0.15 -0.91 0.11 0.00 -0.75 0.00 0.00 64.21 62.82 2ctr n SER 60 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2ctr n ASP 61 N -4.47 -0.58 -0.04 -3.46 2.03 -1.23 -4.99 116.55 103.81 2ctr n ASP 61 Ca -0.26 -1.08 -0.04 0.00 0.52 0.00 0.00 54.79 53.93 2ctr n ASP 61 Cb 0.57 -0.51 -0.01 0.00 -0.72 0.00 0.00 41.12 40.44 2ctr n ASP 61 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ctr n ALA 62 N -3.64 0.34 -0.32 -1.67 0.00 -1.26 -3.72 120.51 110.25 2ctr n ALA 62 Ca -0.11 -0.43 0.06 0.00 0.00 0.00 0.00 53.44 52.96 2ctr n ALA 62 Cb 0.29 0.01 0.21 0.00 0.00 0.00 0.00 19.45 19.97 2ctr n ALA 62 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2ctr h ASN 63 N -0.48 0.74 0.45 0.00 4.21 -1.97 0.35 115.58 118.88 2ctr h ASN 63 Ca 0.00 0.06 -0.02 0.00 1.21 0.00 0.00 56.30 57.55 2ctr h ASN 63 Cb 0.39 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.51 2ctr h ASN 63 CO 0.00 0.39 -0.21 0.03 -1.29 0.00 0.00 177.43 176.34 2ctr h ARG 64 N 0.83 -0.58 -0.04 0.81 3.08 -1.81 -1.45 114.38 115.22 2ctr h ARG 64 Ca 0.45 0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.51 2ctr h ARG 64 Cb 0.49 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 2ctr h ARG 64 CO -0.28 -0.33 -0.12 -0.09 -1.07 0.00 0.00 179.97 178.07 2ctr h ARG 65 N -0.70 0.06 -0.12 0.04 1.12 -0.62 -1.78 114.38 112.38 2ctr h ARG 65 Ca -0.06 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 58.78 2ctr h ARG 65 Cb 0.51 -0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 30.46 2ctr h ARG 65 CO 0.10 0.19 0.02 -0.22 -3.11 0.00 0.00 179.97 176.95 2ctr h LYS 66 N 0.06 0.20 -0.10 0.20 3.64 -0.05 -2.76 116.57 117.75 2ctr h LYS 66 Ca 0.01 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 2ctr h LYS 66 Cb 0.26 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2ctr h LYS 66 CO 0.02 0.40 0.02 0.93 -2.27 0.00 0.00 179.45 178.54 2ctr h GLU 67 N -0.04 0.17 0.00 1.90 5.08 -0.97 -0.04 114.58 120.68 2ctr h GLU 67 Ca 0.04 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2ctr h GLU 67 Cb 0.30 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2ctr h GLU 67 CO 0.00 0.38 0.11 0.98 -1.00 0.00 0.00 179.01 179.47 2ctr n TYR 68 N -4.85 0.43 -0.13 4.33 9.36 -0.69 0.23 117.16 125.83 2ctr n TYR 68 Ca -0.06 0.22 -0.22 0.00 3.32 0.00 0.00 57.90 61.16 2ctr n TYR 68 Cb 0.17 -0.78 -0.11 0.00 -0.63 0.00 0.00 39.34 37.99 2ctr n TYR 68 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2ctr n ASP 69 N -1.94 1.98 0.14 2.98 2.03 -0.88 -2.33 116.55 118.53 2ctr n ASP 69 Ca -0.01 0.05 0.13 0.00 0.52 0.00 0.00 54.79 55.48 2ctr n ASP 69 Cb 0.13 -0.56 0.45 0.00 -0.72 0.00 0.00 41.12 40.42 2ctr n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ctr h THR 70 N -0.39 0.00 0.00 5.18 1.03 -0.04 -3.31 112.91 115.37 2ctr h THR 70 Ca -0.61 -0.42 -0.19 0.00 -0.01 0.00 0.00 66.41 65.17 2ctr h THR 70 Cb 1.76 1.32 -0.03 0.00 -1.07 0.00 0.00 68.15 70.13 2ctr h THR 70 CO -0.22 0.00 -1.69 0.18 -0.01 0.00 0.00 175.52 173.78 2ctr n LEU 71 N -2.40 2.40 0.00 0.00 4.77 0.14 -5.06 117.00 116.84 2ctr n LEU 71 Ca 0.04 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2ctr n LEU 71 Cb 0.35 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2ctr n LEU 71 CO 0.26 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 2ctr n GLY 72 N 2.72 -3.21 0.30 -0.72 0.00 -0.99 -4.01 105.19 99.28 2ctr n GLY 72 Ca -0.22 -2.16 0.14 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.18 0.00 -0.04 1.61 -0.00 -1.26 -2.08 115.22 113.27 2ctr n HIS 73 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2ctr n HIS 73 Cb 0.00 -0.06 -0.13 0.00 -0.12 0.00 0.00 29.99 29.68 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 -0.35 1.07 -0.10 0.26 3.41 -1.26 -4.38 113.62 112.27 2ctr n SER 74 Ca 0.18 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.62 2ctr n SER 74 Cb 0.30 1.33 -0.06 0.00 -0.26 0.00 0.00 64.21 65.53 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 -2.35 1.11 -0.12 7.33 0.00 -1.24 -4.44 120.51 120.80 2ctr n ALA 75 Ca -0.15 -0.89 0.27 0.00 0.00 0.00 0.00 53.44 52.68 2ctr n ALA 75 Cb 0.74 0.09 0.69 0.00 0.00 0.00 0.00 19.45 20.96 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 -0.95 0.00 -1.37 0.00 3.04 -1.62 -0.23 116.94 115.81 2ctr h PHE 76 Ca -0.27 0.00 -0.60 0.00 3.98 0.00 0.00 57.97 61.08 2ctr h PHE 76 Cb 1.21 0.00 -0.22 0.00 2.56 0.00 0.00 35.95 39.50 2ctr h PHE 76 CO -0.28 0.00 0.67 0.25 -2.02 0.00 0.00 178.31 176.94 2ctr n THR 77 N -3.79 3.41 -2.76 4.41 -2.24 -1.26 -4.93 114.28 107.12 2ctr n THR 77 Ca 0.17 -3.38 -0.43 0.00 -2.27 0.00 0.00 64.05 58.14 2ctr n THR 77 Cb 1.04 -1.42 -0.04 0.00 -2.10 0.00 0.00 70.33 67.81 2ctr n THR 77 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2ctr s SER 78 N -0.32 6.42 0.00 3.42 1.04 -0.10 -4.38 113.70 119.78 2ctr s SER 78 Ca 0.55 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.90 2ctr s SER 78 Cb 0.40 -2.47 0.00 0.00 0.10 0.00 0.00 66.02 64.05 2ctr s SER 78 CO -0.27 -1.25 0.00 0.61 0.98 0.00 0.00 173.24 173.31 2ctr n GLY 79 N 5.04 1.75 3.03 7.32 0.00 -1.26 -5.02 105.19 116.05 2ctr n GLY 79 Ca 0.05 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 2ctr n GLY 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ctr s LYS 80 N 0.00 1.87 0.00 1.61 2.47 -1.26 -5.09 119.74 119.34 2ctr s LYS 80 Ca 0.00 -1.50 0.00 0.00 -1.56 0.00 0.00 55.97 52.91 2ctr s LYS 80 Cb 0.00 -2.96 0.00 0.00 -1.46 0.00 0.00 37.83 33.41 2ctr s LYS 80 CO 0.00 -0.72 0.00 0.41 0.16 0.00 0.00 175.35 175.20 2ctr n GLY 81 N 4.40 7.03 3.11 5.54 0.00 -1.26 -4.99 105.19 119.01 2ctr n GLY 81 Ca -0.07 -1.90 -0.23 0.00 0.00 0.00 0.00 46.02 43.81 2ctr n GLY 81 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ctr s GLN 82 N 1.20 1.33 0.22 1.61 -0.44 -1.26 -5.10 119.66 117.21 2ctr s GLN 82 Ca 0.00 -0.52 -0.18 0.00 -2.50 0.00 0.00 55.36 52.16 2ctr s GLN 82 Cb 0.00 -1.23 -0.12 0.00 -1.64 0.00 0.00 33.01 30.02 2ctr s GLN 82 CO 0.00 0.27 0.22 -1.13 0.50 0.00 0.00 175.29 175.15 2ctr n SER 83 N 2.92 -1.52 -2.75 6.67 3.41 -1.26 -4.95 113.62 116.14 2ctr n SER 83 Ca -0.16 0.70 -0.06 0.00 -0.26 0.00 0.00 58.87 59.10 2ctr n SER 83 Cb 0.54 -0.67 0.03 0.00 -0.26 0.00 0.00 64.21 63.86 2ctr n SER 83 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ctr n GLY 84 N 1.59 -0.36 0.00 5.00 0.00 -1.26 -4.98 105.19 105.18 2ctr n GLY 84 Ca 0.11 0.35 0.08 0.00 0.00 0.00 0.00 46.02 46.56 2ctr n GLY 84 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ctr n PRO 85 N 2.29 0.43 -1.74 1.61 -0.04 -1.26 -4.80 135.00 131.49 2ctr n PRO 85 Ca 0.13 0.03 -0.42 0.00 -0.04 0.00 0.00 63.50 63.20 2ctr n PRO 85 Cb 0.60 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.53 2ctr n PRO 85 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2ctr s SER 86 N -2.12 6.45 0.30 3.54 0.15 -1.26 -4.94 113.70 115.82 2ctr s SER 86 Ca 0.21 2.72 -0.29 0.00 0.70 0.00 0.00 55.95 59.29 2ctr s SER 86 Cb 0.11 -2.56 -0.10 0.00 -1.71 0.00 0.00 66.02 61.75 2ctr s SER 86 CO 0.19 -0.99 1.25 -0.94 1.20 0.00 0.00 173.24 173.95 2ctr s SER 87 N 2.75 6.93 0.00 5.45 1.04 -1.26 -5.26 113.70 123.35 2ctr s SER 87 Ca 0.80 2.53 0.04 0.00 0.48 0.00 0.00 55.95 59.80 2ctr s SER 87 Cb -0.45 -2.64 0.03 0.00 0.10 0.00 0.00 66.02 63.06 2ctr s SER 87 CO 0.36 -0.42 0.62 0.61 0.98 0.00 0.00 173.24 175.39