#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 -2.76 -4.96 1.61 7.64 -1.26 -4.96 113.62 108.93 2ctr n SER 2 Ca 0.00 -0.88 -0.20 0.00 1.01 0.00 0.00 58.87 58.80 2ctr n SER 2 Cb 0.00 -3.51 -0.01 0.00 -1.01 0.00 0.00 64.21 59.67 2ctr n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2ctr s SER 3 N -3.76 5.88 1.37 6.43 0.15 -1.26 -5.11 113.70 117.40 2ctr s SER 3 Ca 0.40 -0.21 -0.19 0.00 0.70 0.00 0.00 55.95 56.64 2ctr s SER 3 Cb -0.21 -1.27 0.30 0.00 -1.71 0.00 0.00 66.02 63.13 2ctr s SER 3 CO 0.86 -0.36 0.68 0.61 1.20 0.00 0.00 173.24 176.23 2ctr n GLY 4 N -1.55 -3.84 3.29 9.45 0.00 -1.26 -5.07 105.19 106.21 2ctr n GLY 4 Ca -0.02 -1.25 -0.18 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.83 1.28 0.11 1.61 0.01 -1.26 -5.18 113.70 107.44 2ctr s SER 5 Ca 0.52 -1.59 -0.08 0.00 1.31 0.00 0.00 55.95 56.12 2ctr s SER 5 Cb -0.09 0.45 -0.01 0.00 0.21 0.00 0.00 66.02 66.58 2ctr s SER 5 CO 0.44 -0.94 0.19 -0.44 0.41 0.00 0.00 173.24 172.90 2ctr s SER 6 N -3.33 0.14 0.00 2.44 0.01 -1.26 -4.87 113.70 106.82 2ctr s SER 6 Ca 0.38 -0.79 0.00 0.00 1.31 0.00 0.00 55.95 56.85 2ctr s SER 6 Cb 0.04 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.63 2ctr s SER 6 CO 0.20 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 173.68 2ctr n GLY 7 N -0.10 -1.36 3.76 3.44 0.00 -1.26 -5.05 105.19 104.62 2ctr n GLY 7 Ca -0.12 0.47 -0.40 0.00 0.00 0.00 0.00 46.02 45.98 2ctr n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ctr s SER 8 N -4.00 7.19 0.14 1.61 1.04 -1.26 -4.83 113.70 113.58 2ctr s SER 8 Ca 0.00 2.28 -0.28 0.00 0.48 0.00 0.00 55.95 58.43 2ctr s SER 8 Cb 0.00 -2.63 -0.07 0.00 0.10 0.00 0.00 66.02 63.42 2ctr s SER 8 CO 0.00 -0.20 1.49 1.88 0.98 0.00 0.00 173.24 177.39 2ctr h TYR 9 N 3.67 -1.68 -1.28 5.02 0.05 -1.95 0.68 116.97 121.48 2ctr h TYR 9 Ca -0.47 0.11 0.45 0.00 0.05 0.00 0.00 58.73 58.86 2ctr h TYR 9 Cb 1.21 0.84 -0.13 0.00 1.01 0.00 0.00 36.73 39.66 2ctr h TYR 9 CO 0.58 -0.36 0.82 0.66 -1.05 0.00 0.00 178.16 178.81 2ctr n TYR 10 N -5.05 0.67 -0.05 4.88 4.01 -1.26 0.86 117.16 121.22 2ctr n TYR 10 Ca 0.01 0.68 -0.14 0.00 -0.16 0.00 0.00 57.90 58.29 2ctr n TYR 10 Cb 0.25 -1.11 -0.12 0.00 -0.31 0.00 0.00 39.34 38.06 2ctr n TYR 10 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 2ctr h ASP 11 N 0.00 0.01 -0.88 7.72 3.58 0.08 0.46 116.42 127.40 2ctr h ASP 11 Ca 0.82 -0.78 0.06 0.00 0.42 0.00 0.00 57.03 57.55 2ctr h ASP 11 Cb 2.64 -0.00 -0.06 0.00 1.72 0.00 0.00 39.33 43.62 2ctr h ASP 11 CO -0.45 0.79 0.55 0.40 -2.88 0.00 0.00 179.24 177.66 2ctr h ILE 12 N -0.77 1.06 0.17 2.25 2.04 0.14 -2.89 117.51 119.51 2ctr h ILE 12 Ca -0.00 -0.35 -0.25 0.00 1.00 0.00 0.00 64.86 65.26 2ctr h ILE 12 Cb 0.80 -0.04 0.02 0.00 -0.74 0.00 0.00 36.82 36.85 2ctr h ILE 12 CO 0.00 0.19 -1.16 -0.07 0.00 0.00 0.00 178.15 177.11 2ctr h LEU 13 N 1.02 0.55 0.00 1.44 3.38 -0.71 -3.47 115.31 117.51 2ctr h LEU 13 Ca 0.38 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2ctr h LEU 13 Cb 0.15 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2ctr h LEU 13 CO -0.17 1.54 0.00 0.61 0.09 0.00 0.00 178.44 180.52 2ctr n GLY 14 N 1.71 1.57 3.49 0.83 0.00 0.14 -4.71 105.19 108.23 2ctr n GLY 14 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.00 2.75 0.75 1.61 -7.23 0.04 -5.01 120.40 111.30 2ctr s VAL 15 Ca 0.00 -1.85 -0.12 0.00 -1.81 0.00 0.00 61.98 58.20 2ctr s VAL 15 Cb 0.00 -2.34 0.04 0.00 0.56 0.00 0.00 36.38 34.64 2ctr s VAL 15 CO 0.00 -0.11 1.10 -2.16 -0.31 0.00 0.00 175.10 173.61 2ctr s PRO 16 N -2.74 2.38 0.58 4.82 0.04 -1.26 -4.58 135.00 134.24 2ctr s PRO 16 Ca 0.23 1.23 0.27 0.00 0.04 0.00 0.00 61.00 62.76 2ctr s PRO 16 Cb -0.08 -1.91 1.71 0.00 0.04 0.00 0.00 34.50 34.26 2ctr s PRO 16 CO 0.12 -1.55 2.23 0.87 0.04 0.00 0.00 177.00 178.71 2ctr h LYS 17 N -0.84 0.00 -0.36 4.56 1.79 -2.00 -0.12 116.57 119.60 2ctr h LYS 17 Ca -0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 2ctr h LYS 17 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2ctr h LYS 17 CO 0.52 0.00 0.00 0.45 -1.08 0.00 0.00 179.45 179.34 2ctr n SER 18 N -3.98 4.17 -4.65 0.86 2.88 -1.26 -5.02 113.62 106.61 2ctr n SER 18 Ca -0.03 -2.84 -0.45 0.00 -1.33 0.00 0.00 58.87 54.23 2ctr n SER 18 Cb 0.10 -0.54 -0.02 0.00 -0.75 0.00 0.00 64.21 63.00 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 -0.06 0.72 -1.82 -1.46 0.00 -0.06 -4.95 120.51 112.88 2ctr n ALA 19 Ca 0.22 0.40 -0.33 0.00 0.00 0.00 0.00 53.44 53.73 2ctr n ALA 19 Cb 0.89 -2.20 -0.06 0.00 0.00 0.00 0.00 19.45 18.09 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 -0.05 6.79 0.45 0.00 0.01 -1.26 -4.77 113.70 114.86 2ctr s SER 20 Ca 0.64 1.71 0.33 0.00 1.31 0.00 0.00 55.95 59.93 2ctr s SER 20 Cb -0.66 -2.54 1.49 0.00 0.21 0.00 0.00 66.02 64.52 2ctr s SER 20 CO 0.55 -0.47 1.59 -0.08 0.41 0.00 0.00 173.24 175.25 2ctr h GLU 21 N 1.70 0.03 -0.10 12.44 4.81 -1.92 1.87 114.58 133.40 2ctr h GLU 21 Ca -0.49 -0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.55 2ctr h GLU 21 Cb 1.19 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.56 2ctr h GLU 21 CO 0.61 0.02 -0.74 -0.09 -0.73 0.00 0.00 179.01 178.08 2ctr h ARG 22 N 0.03 0.51 -0.26 1.92 2.43 -1.98 -2.59 114.38 114.44 2ctr h ARG 22 Ca 0.87 -0.42 -0.12 0.00 -0.81 0.00 0.00 59.98 59.50 2ctr h ARG 22 Cb 2.81 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 32.43 2ctr h ARG 22 CO -0.44 1.04 -0.35 1.96 -1.51 0.00 0.00 179.97 180.68 2ctr h GLN 23 N 0.35 0.57 0.47 0.20 4.20 0.25 -0.59 115.11 120.55 2ctr h GLN 23 Ca -0.04 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.39 2ctr h GLN 23 Cb 1.33 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.10 2ctr h GLN 23 CO 0.13 0.84 -0.22 0.82 -0.67 0.00 0.00 178.83 179.73 2ctr h ILE 24 N 0.48 0.25 -0.16 2.54 2.04 -1.08 -1.14 117.51 120.44 2ctr h ILE 24 Ca 0.05 -0.55 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 2ctr h ILE 24 Cb 0.83 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 2ctr h ILE 24 CO 0.07 0.05 0.08 0.07 0.00 0.00 0.00 178.15 178.41 2ctr h LYS 25 N -1.07 0.22 0.13 2.37 2.10 -1.53 -0.38 116.57 118.42 2ctr h LYS 25 Ca -0.06 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.56 2ctr h LYS 25 Cb 0.56 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 2ctr h LYS 25 CO 0.11 0.18 -0.06 0.87 -2.00 0.00 0.00 179.45 178.54 2ctr h LYS 26 N 0.23 -0.17 -0.67 0.07 1.79 -1.10 0.19 116.57 116.91 2ctr h LYS 26 Ca 0.06 0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.51 2ctr h LYS 26 Cb 0.03 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 30.69 2ctr h LYS 26 CO -0.01 0.21 0.28 0.00 -1.08 0.00 0.00 179.45 178.86 2ctr h ALA 27 N 0.16 1.25 0.15 3.86 0.00 -0.92 -2.94 119.26 120.82 2ctr h ALA 27 Ca -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2ctr h ALA 27 Cb 0.47 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2ctr h ALA 27 CO 0.03 0.56 -0.07 0.35 0.00 0.00 0.00 179.25 180.12 2ctr h PHE 28 N 0.95 -0.18 -0.79 0.00 3.57 -1.07 -2.93 116.94 116.48 2ctr h PHE 28 Ca 0.23 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.80 2ctr h PHE 28 Cb 0.15 0.06 -0.10 0.00 2.79 0.00 0.00 35.95 38.86 2ctr h PHE 28 CO 0.01 0.26 -0.50 0.45 -2.23 0.00 0.00 178.31 176.31 2ctr h HIS 29 N -0.77 -1.60 -0.53 0.41 3.86 -0.55 0.29 115.15 116.25 2ctr h HIS 29 Ca -0.02 0.11 0.10 0.00 -1.16 0.00 0.00 60.37 59.39 2ctr h HIS 29 Cb 0.53 0.80 -0.08 0.00 1.06 0.00 0.00 27.41 29.72 2ctr h HIS 29 CO 0.08 -0.33 0.10 1.57 0.86 0.00 0.00 177.93 180.21 2ctr h LYS 30 N -0.04 0.22 0.29 2.45 2.10 -1.63 -2.87 116.57 117.10 2ctr h LYS 30 Ca 0.13 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.75 2ctr h LYS 30 Cb 0.37 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 31.64 2ctr h LYS 30 CO -0.77 0.15 -0.27 -0.07 -2.00 0.00 0.00 179.45 176.49 2ctr h LEU 31 N 0.23 -0.73 -0.82 7.07 3.38 -0.49 -2.17 115.31 121.77 2ctr h LEU 31 Ca 0.27 0.06 0.32 0.00 0.09 0.00 0.00 57.88 58.61 2ctr h LEU 31 Cb 0.39 0.24 -0.12 0.00 0.09 0.00 0.00 40.66 41.26 2ctr h LEU 31 CO -0.37 -0.36 0.48 0.00 0.09 0.00 0.00 178.44 178.28 2ctr n ALA 32 N -2.54 0.83 -0.00 1.53 0.00 0.70 0.20 120.51 121.23 2ctr n ALA 32 Ca -0.07 0.68 -0.13 0.00 0.00 0.00 0.00 53.44 53.93 2ctr n ALA 32 Cb 0.25 -0.74 -0.08 0.00 0.00 0.00 0.00 19.45 18.88 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 0.04 -0.09 0.00 2.86 -1.23 1.84 114.93 118.35 2ctr h MET 33 Ca 0.61 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 58.21 2ctr h MET 33 Cb 1.77 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.42 2ctr h MET 33 CO -0.46 0.34 -0.07 -0.22 1.06 0.00 0.00 176.91 177.56 2ctr h LYS 34 N -0.27 0.13 -0.19 1.72 3.64 0.26 -2.32 116.57 119.54 2ctr h LYS 34 Ca 0.01 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 2ctr h LYS 34 Cb 0.33 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2ctr h LYS 34 CO 0.00 0.22 -0.04 0.66 -2.27 0.00 0.00 179.45 178.02 2ctr n TYR 35 N -4.38 0.67 -2.05 1.91 4.01 -0.17 -4.85 117.16 112.31 2ctr n TYR 35 Ca -0.01 -1.07 -0.42 0.00 -0.16 0.00 0.00 57.90 56.23 2ctr n TYR 35 Cb 0.20 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 38.90 2ctr n TYR 35 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2ctr s HIS 36 N -2.94 2.57 -2.00 -0.72 2.46 0.62 -4.30 115.29 110.99 2ctr s HIS 36 Ca 0.40 0.51 0.13 0.00 0.47 0.00 0.00 55.06 56.57 2ctr s HIS 36 Cb 0.34 -3.84 0.78 0.00 -0.13 0.00 0.00 32.58 29.73 2ctr s HIS 36 CO 0.05 -3.31 1.21 -0.35 -2.47 0.00 0.00 174.74 169.87 2ctr n PRO 37 N 5.58 0.49 -0.11 2.88 -0.04 -1.26 -0.25 135.00 142.29 2ctr n PRO 37 Ca 0.15 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.45 2ctr n PRO 37 Cb 0.42 -1.42 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 2ctr n PRO 37 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ctr n ASP 38 N -0.92 2.23 -0.01 3.54 8.00 -1.26 -4.65 116.55 123.48 2ctr n ASP 38 Ca 0.10 -0.06 -0.16 0.00 0.71 0.00 0.00 54.79 55.38 2ctr n ASP 38 Cb 0.05 -0.39 -0.14 0.00 -0.02 0.00 0.00 41.12 40.62 2ctr n ASP 38 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2ctr n LYS 39 N -3.25 0.71 -2.59 -1.24 4.76 -1.11 -4.83 118.16 110.60 2ctr n LYS 39 Ca -0.39 0.27 -0.43 0.00 -2.87 0.00 0.00 58.31 54.89 2ctr n LYS 39 Cb 0.89 -1.74 -0.02 0.00 -1.84 0.00 0.00 35.03 32.33 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 -6.62 6.95 -0.46 4.39 3.84 0.66 -4.93 114.94 118.78 2ctr s ASN 40 Ca -0.15 1.25 -0.04 0.00 0.21 0.00 0.00 52.86 54.13 2ctr s ASN 40 Cb 0.07 -2.54 0.07 0.00 -0.55 0.00 0.00 41.25 38.30 2ctr s ASN 40 CO 0.79 -0.83 2.73 1.17 -2.79 0.00 0.00 177.10 178.17 2ctr n LYS 41 N 6.73 2.38 -4.13 0.43 4.81 -1.26 -4.69 118.16 122.42 2ctr n LYS 41 Ca 0.13 -2.33 -0.15 0.00 -0.87 0.00 0.00 58.31 55.08 2ctr n LYS 41 Cb 0.46 -2.12 -0.14 0.00 0.02 0.00 0.00 35.03 33.25 2ctr n LYS 41 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2ctr s SER 42 N 0.31 0.65 0.27 3.14 0.15 -1.26 -5.05 113.70 111.92 2ctr s SER 42 Ca 0.58 -0.20 0.05 0.00 0.70 0.00 0.00 55.95 57.08 2ctr s SER 42 Cb 0.38 -0.04 0.37 0.00 -1.71 0.00 0.00 66.02 65.01 2ctr s SER 42 CO -0.22 0.00 1.65 1.55 1.20 0.00 0.00 173.24 177.42 2ctr h PRO 43 N 5.67 0.29 -0.27 5.44 0.13 -2.02 -3.07 132.00 138.18 2ctr h PRO 43 Ca -0.30 -0.15 -0.12 0.00 -0.87 0.00 0.00 66.00 64.56 2ctr h PRO 43 Cb 1.19 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2ctr h PRO 43 CO 0.48 0.70 -0.34 0.38 -0.23 0.00 0.00 178.00 178.98 2ctr h ASP 44 N 0.24 0.62 -0.33 1.44 2.03 -1.99 -3.16 116.42 115.28 2ctr h ASP 44 Ca 0.02 -0.25 0.06 0.00 -0.73 0.00 0.00 57.03 56.12 2ctr h ASP 44 Cb 0.90 -0.17 -0.05 0.00 -0.83 0.00 0.00 39.33 39.18 2ctr h ASP 44 CO 0.07 0.91 0.00 0.00 -1.03 0.00 0.00 179.24 179.20 2ctr h ALA 45 N 1.12 0.30 -1.01 4.15 0.00 -1.89 -1.03 119.26 120.90 2ctr h ALA 45 Ca 0.05 0.09 0.24 0.00 0.00 0.00 0.00 54.91 55.30 2ctr h ALA 45 Cb 0.83 0.15 -0.09 0.00 0.00 0.00 0.00 17.79 18.68 2ctr h ALA 45 CO 0.07 -0.40 0.65 1.49 0.00 0.00 0.00 179.25 181.06 2ctr h GLU 46 N 0.10 0.44 0.11 0.00 4.81 -1.60 -1.21 114.58 117.22 2ctr h GLU 46 Ca 0.16 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2ctr h GLU 46 Cb 0.21 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2ctr h GLU 46 CO -0.26 0.29 -0.05 0.00 -0.73 0.00 0.00 179.01 178.25 2ctr h ALA 47 N 1.62 -0.15 -0.49 2.92 0.00 -1.30 -3.07 119.26 118.79 2ctr h ALA 47 Ca 0.57 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 55.33 2ctr h ALA 47 Cb 1.35 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 19.10 2ctr h ALA 47 CO -0.29 -0.31 -0.25 0.87 0.00 0.00 0.00 179.25 179.27 2ctr h LYS 48 N -0.71 -0.14 -0.74 0.00 1.79 -0.52 0.28 116.57 116.53 2ctr h LYS 48 Ca -0.02 0.01 0.16 0.00 -2.18 0.00 0.00 60.65 58.62 2ctr h LYS 48 Cb 0.53 0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 31.17 2ctr h LYS 48 CO 0.03 -0.09 0.50 0.35 -1.08 0.00 0.00 179.45 179.16 2ctr h PHE 49 N -0.14 0.42 -0.02 -1.35 3.57 -1.40 0.27 116.94 118.29 2ctr h PHE 49 Ca 0.22 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.74 2ctr h PHE 49 Cb 0.49 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.10 2ctr h PHE 49 CO -0.52 0.16 0.04 -0.09 -2.23 0.00 0.00 178.31 175.67 2ctr h ARG 50 N 0.36 0.00 0.00 1.11 9.65 -0.35 -0.27 114.38 124.88 2ctr h ARG 50 Ca 0.37 0.00 -0.35 0.00 -1.10 0.00 0.00 59.98 58.90 2ctr h ARG 50 Cb 0.92 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 29.43 2ctr h ARG 50 CO -0.11 0.00 -2.21 0.39 2.80 0.00 0.00 179.97 180.85 2ctr n GLU 51 N -3.37 0.67 -0.05 0.20 -0.58 0.89 -3.86 120.64 114.54 2ctr n GLU 51 Ca -0.02 0.08 -0.13 0.00 -0.42 0.00 0.00 57.16 56.66 2ctr n GLU 51 Cb 0.12 -1.60 -0.08 0.00 -0.57 0.00 0.00 31.44 29.32 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 1.36 0.43 -3.67 2.04 -0.66 -2.77 117.51 114.24 2ctr h ILE 52 Ca -0.48 -1.31 -0.02 0.00 1.00 0.00 0.00 64.86 64.05 2ctr h ILE 52 Cb 2.18 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 40.21 2ctr h ILE 52 CO 0.04 0.38 -0.21 0.00 0.00 0.00 0.00 178.15 178.36 2ctr h ALA 53 N 0.58 -1.04 -0.96 1.87 0.00 -1.30 -2.37 119.26 116.04 2ctr h ALA 53 Ca 0.02 -0.13 0.30 0.00 0.00 0.00 0.00 54.91 55.10 2ctr h ALA 53 Cb 0.66 0.22 -0.17 0.00 0.00 0.00 0.00 17.79 18.51 2ctr h ALA 53 CO 0.03 -1.00 0.25 1.49 0.00 0.00 0.00 179.25 180.03 2ctr h GLU 54 N -0.63 0.09 -0.35 0.00 4.57 -1.70 0.58 114.58 117.13 2ctr h GLU 54 Ca -0.06 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.14 2ctr h GLU 54 Cb 0.44 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 2ctr h GLU 54 CO 0.10 0.06 0.18 0.00 -1.18 0.00 0.00 179.01 178.17 2ctr h ALA 55 N 1.92 0.44 -0.16 2.92 0.00 -1.41 -2.91 119.26 120.06 2ctr h ALA 55 Ca 0.66 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.54 2ctr h ALA 55 Cb 1.48 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 2ctr h ALA 55 CO -0.78 -0.18 -0.02 -0.92 0.00 0.00 0.00 179.25 177.35 2ctr h TYR 56 N 0.38 0.32 -0.97 0.00 3.20 0.56 -2.81 116.97 117.65 2ctr h TYR 56 Ca 0.15 -0.06 0.40 0.00 3.14 0.00 0.00 58.73 62.36 2ctr h TYR 56 Cb 0.05 -0.08 -0.18 0.00 1.54 0.00 0.00 36.73 38.06 2ctr h TYR 56 CO -0.09 0.54 0.50 0.39 -1.64 0.00 0.00 178.16 177.85 2ctr n GLU 57 N -4.72 -0.06 -0.05 1.82 -0.58 0.37 0.23 120.64 117.65 2ctr n GLU 57 Ca -0.05 1.35 -0.14 0.00 -0.42 0.00 0.00 57.16 57.89 2ctr n GLU 57 Cb 0.24 -2.41 -0.12 0.00 -0.57 0.00 0.00 31.44 28.58 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 1.67 0.00 2.62 2.02 -1.44 -3.18 112.91 114.59 2ctr h THR 58 Ca 0.81 -2.04 0.00 0.00 0.77 0.00 0.00 66.41 65.95 2ctr h THR 58 Cb 2.14 3.04 0.00 0.00 -1.74 0.00 0.00 68.15 71.58 2ctr h THR 58 CO -0.76 0.54 0.00 0.18 0.37 0.00 0.00 175.52 175.85 2ctr n LEU 59 N -4.63 0.00 -0.07 2.58 4.77 0.11 -0.45 117.00 119.31 2ctr n LEU 59 Ca -0.10 0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 55.86 2ctr n LEU 59 Cb 0.45 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2ctr n LEU 59 CO 0.35 -0.02 -0.20 0.77 -1.33 0.00 0.00 177.39 176.96 2ctr h SER 60 N 0.00 0.00 -4.18 -1.43 4.64 0.29 -3.46 113.55 109.41 2ctr h SER 60 Ca 0.00 -0.27 -0.50 0.00 -0.47 0.00 0.00 61.79 60.56 2ctr h SER 60 Cb 0.05 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.21 2ctr h SER 60 CO 0.00 0.91 0.38 -1.81 -0.87 0.00 0.00 176.83 175.44 2ctr s ASP 61 N -6.04 5.66 0.00 4.97 1.11 -1.20 -4.94 116.67 116.23 2ctr s ASP 61 Ca -0.15 1.89 0.00 0.00 0.18 0.00 0.00 52.55 54.46 2ctr s ASP 61 Cb 0.02 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.47 2ctr s ASP 61 CO 0.33 -1.25 0.62 0.00 1.18 0.00 0.00 175.17 176.05 2ctr n ALA 62 N -2.00 -0.30 -0.21 5.23 0.00 -1.26 -1.57 120.51 120.40 2ctr n ALA 62 Ca 0.09 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.55 2ctr n ALA 62 Cb 0.52 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.09 2ctr n ALA 62 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2ctr h ASN 63 N 0.00 -0.11 0.09 0.00 -1.24 -1.95 0.64 115.58 113.02 2ctr h ASN 63 Ca 0.00 0.13 0.02 0.00 0.71 0.00 0.00 56.30 57.17 2ctr h ASN 63 Cb 0.00 0.21 -0.04 0.00 0.73 0.00 0.00 38.32 39.21 2ctr h ASN 63 CO 0.00 -0.05 -0.35 0.03 -1.29 0.00 0.00 177.43 175.77 2ctr h ARG 64 N 0.20 -0.54 0.00 6.67 3.08 -1.80 -1.23 114.38 120.76 2ctr h ARG 64 Ca 0.34 0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.37 2ctr h ARG 64 Cb 0.53 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 2ctr h ARG 64 CO -0.47 -0.36 -0.26 -0.09 -1.07 0.00 0.00 179.97 177.72 2ctr h ARG 65 N -0.56 0.00 -0.42 0.04 1.12 0.28 -2.33 114.38 112.51 2ctr h ARG 65 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.91 2ctr h ARG 65 Cb 0.60 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.54 2ctr h ARG 65 CO -0.22 0.26 0.27 -0.22 -3.11 0.00 0.00 179.97 176.95 2ctr h LYS 66 N 0.00 0.57 -0.05 0.20 1.63 0.14 -1.90 116.57 117.16 2ctr h LYS 66 Ca -0.00 -0.04 -0.14 0.00 -0.85 0.00 0.00 60.65 59.61 2ctr h LYS 66 Cb 0.57 -0.12 0.01 0.00 -0.60 0.00 0.00 32.23 32.08 2ctr h LYS 66 CO 0.03 0.40 -0.53 0.93 -3.45 0.00 0.00 179.45 176.83 2ctr h GLU 67 N 0.57 0.45 0.00 1.90 5.08 -1.15 -0.80 114.58 120.63 2ctr h GLU 67 Ca 0.15 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2ctr h GLU 67 Cb -0.03 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2ctr h GLU 67 CO -0.03 1.06 0.00 0.98 -1.00 0.00 0.00 179.01 180.02 2ctr n TYR 68 N -4.24 0.12 -0.09 4.33 9.36 -0.89 0.24 117.16 125.99 2ctr n TYR 68 Ca -0.09 0.06 -0.17 0.00 3.32 0.00 0.00 57.90 61.02 2ctr n TYR 68 Cb 0.63 -0.60 -0.08 0.00 -0.63 0.00 0.00 39.34 38.66 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 -1.62 1.98 0.25 2.98 -0.08 -0.72 -2.94 116.55 116.39 2ctr n ASP 69 Ca -0.00 0.07 0.14 0.00 -1.51 0.00 0.00 54.79 53.49 2ctr n ASP 69 Cb 0.01 -0.43 0.48 0.00 2.34 0.00 0.00 41.12 43.53 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 -0.35 0.10 0.00 5.18 1.03 -0.71 -3.31 112.91 114.85 2ctr h THR 70 Ca -0.45 -0.79 -0.26 0.00 -0.01 0.00 0.00 66.41 64.90 2ctr h THR 70 Cb 1.53 1.72 -0.05 0.00 -1.07 0.00 0.00 68.15 70.28 2ctr h THR 70 CO -0.18 0.04 -1.97 0.18 -0.01 0.00 0.00 175.52 173.58 2ctr n LEU 71 N -3.14 2.64 0.00 0.00 4.77 0.14 -5.06 117.00 116.35 2ctr n LEU 71 Ca 0.02 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 2ctr n LEU 71 Cb 0.40 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2ctr n LEU 71 CO 0.30 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.68 2ctr n GLY 72 N 2.53 0.21 0.57 -0.72 0.00 -1.15 -4.45 105.19 102.18 2ctr n GLY 72 Ca -0.31 -1.89 -0.04 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 0.00 0.00 0.23 1.61 -0.00 -1.26 -4.00 115.22 111.81 2ctr n HIS 73 Ca 0.00 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.24 2ctr n HIS 73 Cb 0.00 -0.22 0.55 0.00 -0.12 0.00 0.00 29.99 30.20 2ctr n HIS 73 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2ctr h SER 74 N -0.44 0.00 0.00 0.26 4.64 -1.93 -0.44 113.55 115.64 2ctr h SER 74 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2ctr h SER 74 Cb 0.44 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2ctr h SER 74 CO 0.00 0.15 -0.04 0.00 -0.87 0.00 0.00 176.83 176.08 2ctr h ALA 75 N 1.85 0.01 0.00 5.18 0.00 -1.83 -3.31 119.26 121.15 2ctr h ALA 75 Ca -0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2ctr h ALA 75 Cb 0.28 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2ctr h ALA 75 CO 0.02 0.02 -0.00 0.35 0.00 0.00 0.00 179.25 179.64 2ctr h PHE 76 N -1.00 0.00 -0.94 0.00 3.04 -1.67 -1.33 116.94 115.04 2ctr h PHE 76 Ca -0.01 0.00 -0.56 0.00 3.98 0.00 0.00 57.97 61.38 2ctr h PHE 76 Cb 0.59 0.00 -0.28 0.00 2.56 0.00 0.00 35.95 38.82 2ctr h PHE 76 CO 0.15 0.00 0.72 0.25 -2.02 0.00 0.00 178.31 177.42 2ctr n THR 77 N -3.43 3.30 -2.22 4.41 -2.24 -0.18 -4.97 114.28 108.96 2ctr n THR 77 Ca -0.03 -2.29 -0.42 0.00 -2.27 0.00 0.00 64.05 59.04 2ctr n THR 77 Cb 0.08 -0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 67.44 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 -1.37 6.83 0.00 3.42 0.15 -0.50 -3.48 113.70 118.74 2ctr s SER 78 Ca 0.57 2.05 0.00 0.00 0.70 0.00 0.00 55.95 59.27 2ctr s SER 78 Cb 0.46 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 2ctr s SER 78 CO 0.05 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.32 2ctr n GLY 79 N 3.76 1.71 3.15 9.45 0.00 -1.26 -5.13 105.19 116.87 2ctr n GLY 79 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.54 0.77 0.25 1.61 2.47 -1.23 -5.17 119.74 117.90 2ctr s LYS 80 Ca 0.00 -1.22 0.06 0.00 -1.56 0.00 0.00 55.97 53.25 2ctr s LYS 80 Cb 0.00 -0.20 -0.02 0.00 -1.46 0.00 0.00 37.83 36.15 2ctr s LYS 80 CO 0.00 -0.01 0.22 0.41 0.16 0.00 0.00 175.35 176.13 2ctr n GLY 81 N 0.24 3.17 3.55 5.54 0.00 -1.26 -5.16 105.19 111.28 2ctr n GLY 81 Ca -0.14 -1.83 -0.34 0.00 0.00 0.00 0.00 46.02 43.71 2ctr n GLY 81 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ctr s GLN 82 N -3.02 3.32 -0.05 1.61 -0.21 -1.26 -4.99 119.66 115.05 2ctr s GLN 82 Ca 0.30 -0.51 -0.01 0.00 0.02 0.00 0.00 55.36 55.16 2ctr s GLN 82 Cb 0.01 -2.81 -0.03 0.00 1.00 0.00 0.00 33.01 31.19 2ctr s GLN 82 CO 0.21 0.43 -0.06 0.43 -2.12 0.00 0.00 175.29 174.19 2ctr n SER 83 N 2.95 2.11 -4.33 5.90 7.64 -1.26 -5.06 113.62 121.57 2ctr n SER 83 Ca -0.18 0.02 -0.39 0.00 1.01 0.00 0.00 58.87 59.33 2ctr n SER 83 Cb 0.53 -0.12 0.02 0.00 -1.01 0.00 0.00 64.21 63.63 2ctr n SER 83 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ctr n GLY 84 N 2.97 -2.56 0.21 0.23 0.00 -1.26 -4.85 105.19 99.93 2ctr n GLY 84 Ca -0.10 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.83 2ctr n GLY 84 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ctr h PRO 85 N 0.12 0.00 -5.56 1.61 0.13 -2.07 -3.43 132.00 122.80 2ctr h PRO 85 Ca -0.42 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.08 2ctr h PRO 85 Cb 1.43 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.47 2ctr h PRO 85 CO 0.44 0.29 -0.42 -1.54 -0.23 0.00 0.00 178.00 176.54 2ctr s SER 86 N -6.39 6.40 0.05 1.44 1.04 -1.26 -5.10 113.70 109.89 2ctr s SER 86 Ca -0.01 0.48 0.07 0.00 0.48 0.00 0.00 55.95 56.97 2ctr s SER 86 Cb 0.12 -2.12 -0.03 0.00 0.10 0.00 0.00 66.02 64.09 2ctr s SER 86 CO 0.66 0.28 -0.19 -0.94 0.98 0.00 0.00 173.24 174.02 2ctr s SER 87 N -0.37 2.33 0.00 7.02 1.04 -1.26 -5.01 113.70 117.45 2ctr s SER 87 Ca 0.15 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.04 2ctr s SER 87 Cb -0.13 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 65.82 2ctr s SER 87 CO 0.04 0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.99