#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 6.94 -3.65 1.61 3.41 -1.26 -4.95 113.62 115.72 2ctr n SER 2 Ca 0.00 -3.78 -0.15 0.00 -0.26 0.00 0.00 58.87 54.67 2ctr n SER 2 Cb 0.00 -0.82 -0.08 0.00 -0.26 0.00 0.00 64.21 63.05 2ctr n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2ctr s SER 3 N -2.21 -0.44 0.60 4.04 0.15 -1.26 -5.09 113.70 109.49 2ctr s SER 3 Ca 0.60 0.51 0.00 0.00 0.70 0.00 0.00 55.95 57.76 2ctr s SER 3 Cb 0.47 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 65.32 2ctr s SER 3 CO -0.06 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 174.53 2ctr n GLY 4 N 1.40 1.69 3.49 9.45 0.00 -1.26 -4.93 105.19 115.02 2ctr n GLY 4 Ca -0.19 -0.73 -0.26 0.00 0.00 0.00 0.00 46.02 44.84 2ctr n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ctr n SER 5 N 5.41 -4.71 -4.63 1.61 2.88 -1.26 -4.92 113.62 108.01 2ctr n SER 5 Ca 0.00 -0.51 -0.41 0.00 -1.33 0.00 0.00 58.87 56.62 2ctr n SER 5 Cb 0.00 -3.82 -0.06 0.00 -0.75 0.00 0.00 64.21 59.59 2ctr n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2ctr s SER 6 N -2.93 6.66 0.03 -3.46 0.01 -1.26 -4.91 113.70 107.84 2ctr s SER 6 Ca 0.48 0.78 0.00 0.00 1.31 0.00 0.00 55.95 58.52 2ctr s SER 6 Cb -0.24 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 63.61 2ctr s SER 6 CO 0.59 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 174.40 2ctr n GLY 7 N 4.06 0.05 3.80 3.44 0.00 -1.26 -5.08 105.19 110.20 2ctr n GLY 7 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 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 -5.29 5.39 0.08 1.61 0.01 -1.26 -5.01 113.70 109.22 2ctr s SER 8 Ca 0.00 -0.31 -0.36 0.00 1.31 0.00 0.00 55.95 56.58 2ctr s SER 8 Cb 0.00 -1.31 -0.18 0.00 0.21 0.00 0.00 66.02 64.74 2ctr s SER 8 CO 0.00 -0.05 1.57 1.88 0.41 0.00 0.00 173.24 177.05 2ctr h TYR 9 N 1.53 -1.34 -1.55 2.43 0.05 -1.96 -1.33 116.97 114.79 2ctr h TYR 9 Ca -0.48 -0.00 0.45 0.00 0.05 0.00 0.00 58.73 58.75 2ctr h TYR 9 Cb 1.24 0.50 -0.06 0.00 1.01 0.00 0.00 36.73 39.42 2ctr h TYR 9 CO 0.57 -0.70 1.29 0.66 -1.05 0.00 0.00 178.16 178.93 2ctr n TYR 10 N -5.60 0.00 -0.06 4.88 4.01 -1.26 0.10 117.16 119.23 2ctr n TYR 10 Ca -0.14 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.41 2ctr n TYR 10 Cb 0.48 -0.39 -0.13 0.00 -0.31 0.00 0.00 39.34 39.00 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 0.10 -0.91 7.72 5.19 -1.55 -0.52 116.42 126.44 2ctr h ASP 11 Ca 0.74 -0.76 0.03 0.00 -0.62 0.00 0.00 57.03 56.42 2ctr h ASP 11 Cb 3.31 -0.03 -0.05 0.00 0.18 0.00 0.00 39.33 42.74 2ctr h ASP 11 CO -0.01 1.36 0.59 0.40 -3.12 0.00 0.00 179.24 178.46 2ctr h ILE 12 N -0.83 1.16 0.13 0.35 2.04 0.18 -3.02 117.51 117.52 2ctr h ILE 12 Ca -0.22 -0.40 -0.22 0.00 1.00 0.00 0.00 64.86 65.03 2ctr h ILE 12 Cb 1.32 -0.10 0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2ctr h ILE 12 CO -0.07 0.21 -1.03 -0.07 0.00 0.00 0.00 178.15 177.19 2ctr h LEU 13 N 1.15 0.43 0.00 1.44 3.38 -0.87 -3.47 115.31 117.38 2ctr h LEU 13 Ca 0.36 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.42 2ctr h LEU 13 Cb -0.01 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2ctr h LEU 13 CO -0.11 1.47 0.00 0.61 0.09 0.00 0.00 178.44 180.50 2ctr n GLY 14 N 1.69 1.27 3.27 0.83 0.00 -0.45 -4.80 105.19 107.00 2ctr n GLY 14 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 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 1.60 0.91 1.61 -7.23 -0.33 -5.02 120.40 109.94 2ctr s VAL 15 Ca 0.00 -1.62 -0.12 0.00 -1.81 0.00 0.00 61.98 58.44 2ctr s VAL 15 Cb 0.00 -1.55 0.14 0.00 0.56 0.00 0.00 36.38 35.53 2ctr s VAL 15 CO 0.00 -0.19 1.09 -2.16 -0.31 0.00 0.00 175.10 173.53 2ctr s PRO 16 N -2.18 1.12 0.40 4.82 0.04 -1.26 -4.56 135.00 133.36 2ctr s PRO 16 Ca 0.08 0.77 0.14 0.00 0.04 0.00 0.00 61.00 62.03 2ctr s PRO 16 Cb -0.08 -1.80 0.83 0.00 0.04 0.00 0.00 34.50 33.49 2ctr s PRO 16 CO 0.04 -2.33 1.88 0.87 0.04 0.00 0.00 177.00 177.51 2ctr h LYS 17 N -1.61 0.00 -0.48 4.56 1.57 -2.01 -1.87 116.57 116.73 2ctr h LYS 17 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2ctr h LYS 17 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2ctr h LYS 17 CO 0.55 0.31 0.00 -1.13 -0.57 0.00 0.00 179.45 178.61 2ctr n SER 18 N -4.14 2.72 -4.62 0.86 3.41 -1.26 -4.97 113.62 105.62 2ctr n SER 18 Ca -0.02 -1.97 -0.46 0.00 -0.26 0.00 0.00 58.87 56.16 2ctr n SER 18 Cb 0.35 -0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 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 0.99 0.09 -2.42 7.33 0.00 -0.71 -4.97 120.51 120.82 2ctr n ALA 19 Ca 0.17 0.42 -0.25 0.00 0.00 0.00 0.00 53.44 53.78 2ctr n ALA 19 Cb 0.44 -2.11 -0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 -0.14 6.18 0.20 0.00 0.15 -1.26 -4.82 113.70 114.01 2ctr s SER 20 Ca 0.65 0.64 -0.22 0.00 0.70 0.00 0.00 55.95 57.73 2ctr s SER 20 Cb -0.72 -2.04 0.13 0.00 -1.71 0.00 0.00 66.02 61.68 2ctr s SER 20 CO 0.55 -0.51 1.56 -0.08 1.20 0.00 0.00 173.24 175.96 2ctr h GLU 21 N 0.43 -0.08 -1.00 5.44 4.81 -1.93 0.66 114.58 122.91 2ctr h GLU 21 Ca -0.48 0.01 0.17 0.00 -0.13 0.00 0.00 59.36 58.93 2ctr h GLU 21 Cb 1.22 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 30.52 2ctr h GLU 21 CO 0.61 -0.05 0.62 0.07 -0.73 0.00 0.00 179.01 179.52 2ctr h ARG 22 N -0.08 0.78 -0.03 1.92 0.11 -1.99 0.23 114.38 115.33 2ctr h ARG 22 Ca 0.26 -0.05 -0.01 0.00 0.10 0.00 0.00 59.98 60.29 2ctr h ARG 22 Cb 0.56 -0.18 -0.00 0.00 1.11 0.00 0.00 29.97 31.46 2ctr h ARG 22 CO -0.86 0.52 -0.01 1.96 0.10 0.00 0.00 179.97 181.68 2ctr h GLN 23 N 0.80 0.06 -0.92 0.08 1.08 -0.18 -1.31 115.11 114.72 2ctr h GLN 23 Ca 0.56 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.73 2ctr h GLN 23 Cb 0.82 -0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.20 2ctr h GLN 23 CO -0.35 0.42 0.57 0.82 -0.95 0.00 0.00 178.83 179.34 2ctr h ILE 24 N -0.31 1.25 0.27 2.54 2.04 0.16 0.88 117.51 124.33 2ctr h ILE 24 Ca 0.01 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.33 2ctr h ILE 24 Cb 0.40 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 2ctr h ILE 24 CO 0.00 0.26 -0.13 0.11 0.00 0.00 0.00 178.15 178.39 2ctr h LYS 25 N 1.26 -0.34 -0.47 2.37 1.57 -0.55 -0.24 116.57 120.17 2ctr h LYS 25 Ca 0.33 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 59.15 2ctr h LYS 25 Cb -0.07 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 2ctr h LYS 25 CO -0.06 -0.08 0.29 0.87 -0.57 0.00 0.00 179.45 179.90 2ctr h LYS 26 N -0.58 0.58 -0.02 3.15 1.79 -1.09 0.33 116.57 120.73 2ctr h LYS 26 Ca -0.04 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2ctr h LYS 26 Cb 0.42 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.94 2ctr h LYS 26 CO 0.06 0.38 0.01 0.00 -1.08 0.00 0.00 179.45 178.82 2ctr h ALA 27 N 1.19 0.02 0.35 3.86 0.00 -0.80 -1.80 119.26 122.09 2ctr h ALA 27 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2ctr h ALA 27 Cb -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2ctr h ALA 27 CO -0.06 -0.48 -0.17 0.35 0.00 0.00 0.00 179.25 178.89 2ctr h PHE 28 N 0.02 -0.43 -0.62 0.00 3.57 -0.80 -2.40 116.94 116.28 2ctr h PHE 28 Ca 0.01 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.55 2ctr h PHE 28 Cb 0.00 0.14 -0.07 0.00 2.79 0.00 0.00 35.95 38.81 2ctr h PHE 28 CO -0.08 -0.27 -0.37 0.72 -2.23 0.00 0.00 178.31 176.08 2ctr n HIS 29 N -3.71 -0.27 -0.22 0.41 8.25 0.11 -0.00 115.22 119.79 2ctr n HIS 29 Ca -0.06 0.77 0.02 0.00 -0.26 0.00 0.00 57.72 58.19 2ctr n HIS 29 Cb 0.18 -0.54 0.11 0.00 1.12 0.00 0.00 29.99 30.86 2ctr n HIS 29 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2ctr h LYS 30 N 0.00 0.08 0.46 -0.41 1.57 -1.43 -2.38 116.57 114.46 2ctr h LYS 30 Ca 0.10 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2ctr h LYS 30 Cb 0.25 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2ctr h LYS 30 CO -0.58 0.05 -0.34 -0.07 -0.57 0.00 0.00 179.45 177.94 2ctr h LEU 31 N 0.08 -0.90 -1.02 2.94 3.38 0.12 -2.27 115.31 117.64 2ctr h LEU 31 Ca 0.34 0.06 0.37 0.00 0.09 0.00 0.00 57.88 58.74 2ctr h LEU 31 Cb 0.56 0.28 -0.12 0.00 0.09 0.00 0.00 40.66 41.47 2ctr h LEU 31 CO -0.60 -0.49 0.63 0.00 0.09 0.00 0.00 178.44 178.07 2ctr n ALA 32 N -2.58 1.02 -0.01 1.53 0.00 0.51 0.18 120.51 121.16 2ctr n ALA 32 Ca -0.09 0.73 -0.12 0.00 0.00 0.00 0.00 53.44 53.95 2ctr n ALA 32 Cb 0.33 -0.84 -0.08 0.00 0.00 0.00 0.00 19.45 18.87 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 0.10 -0.06 0.00 2.86 -1.08 1.85 114.93 118.60 2ctr h MET 33 Ca 0.70 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 58.27 2ctr h MET 33 Cb 2.14 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.79 2ctr h MET 33 CO -0.44 0.35 -0.16 -0.22 1.06 0.00 0.00 176.91 177.51 2ctr h LYS 34 N -0.17 0.10 -0.32 1.72 3.11 0.21 -2.30 116.57 118.93 2ctr h LYS 34 Ca 0.02 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2ctr h LYS 34 Cb 0.31 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 2ctr h LYS 34 CO 0.00 0.26 0.00 0.66 -2.81 0.00 0.00 179.45 177.56 2ctr n TYR 35 N -4.30 0.83 -2.03 1.91 4.01 -0.27 -4.74 117.16 112.56 2ctr n TYR 35 Ca -0.02 -0.72 -0.41 0.00 -0.16 0.00 0.00 57.90 56.59 2ctr n TYR 35 Cb 0.25 -0.21 -0.02 0.00 -0.31 0.00 0.00 39.34 39.05 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 -2.11 3.04 -0.49 -0.72 2.46 0.63 -4.32 115.29 113.77 2ctr s HIS 36 Ca 0.36 1.05 0.23 0.00 0.47 0.00 0.00 55.06 57.18 2ctr s HIS 36 Cb 0.26 -3.80 0.97 0.00 -0.13 0.00 0.00 32.58 29.89 2ctr s HIS 36 CO 0.12 -2.58 1.70 -0.35 -2.47 0.00 0.00 174.74 171.17 2ctr n PRO 37 N 2.32 0.19 -0.07 2.88 -0.04 -1.26 0.06 135.00 139.08 2ctr n PRO 37 Ca 0.07 0.42 -0.21 0.00 -0.04 0.00 0.00 63.50 63.74 2ctr n PRO 37 Cb 0.40 -1.86 -0.12 0.00 -0.04 0.00 0.00 33.50 31.88 2ctr n PRO 37 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2ctr h ASP 38 N 0.00 0.12 0.17 3.54 5.19 -1.95 -3.40 116.42 120.10 2ctr h ASP 38 Ca 0.00 -0.68 -0.24 0.00 -0.62 0.00 0.00 57.03 55.48 2ctr h ASP 38 Cb 0.35 -0.04 0.02 0.00 0.18 0.00 0.00 39.33 39.85 2ctr h ASP 38 CO 0.00 1.51 -1.10 0.11 -3.12 0.00 0.00 179.24 176.64 2ctr h LYS 39 N -0.74 0.37 -6.22 3.56 1.79 -1.85 -3.44 116.57 110.04 2ctr h LYS 39 Ca -0.31 -0.63 -0.57 0.00 -2.18 0.00 0.00 60.65 56.97 2ctr h LYS 39 Cb 1.44 0.23 -0.04 0.00 -1.58 0.00 0.00 32.23 32.29 2ctr h LYS 39 CO -0.10 1.30 0.95 1.21 -1.08 0.00 0.00 179.45 181.72 2ctr s ASN 40 N -7.16 6.82 -0.51 0.86 3.84 0.11 -4.91 114.94 113.98 2ctr s ASN 40 Ca -0.13 1.59 -0.02 0.00 0.21 0.00 0.00 52.86 54.51 2ctr s ASN 40 Cb 0.02 -2.54 0.27 0.00 -0.55 0.00 0.00 41.25 38.45 2ctr s ASN 40 CO 0.86 -0.89 2.18 0.29 -2.79 0.00 0.00 177.10 176.75 2ctr n LYS 41 N 6.90 2.30 -4.16 0.43 4.76 -1.26 -4.63 118.16 122.49 2ctr n LYS 41 Ca 0.15 -2.46 -0.16 0.00 -2.87 0.00 0.00 58.31 52.96 2ctr n LYS 41 Cb 0.45 -2.00 -0.11 0.00 -1.84 0.00 0.00 35.03 31.53 2ctr n LYS 41 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2ctr s SER 42 N -0.52 1.46 -0.01 4.39 0.01 -1.26 -5.07 113.70 112.70 2ctr s SER 42 Ca 0.49 -0.69 -0.25 0.00 1.31 0.00 0.00 55.95 56.81 2ctr s SER 42 Cb 0.37 -0.01 -0.19 0.00 0.21 0.00 0.00 66.02 66.40 2ctr s SER 42 CO -0.10 -0.18 1.28 1.55 0.41 0.00 0.00 173.24 176.20 2ctr h PRO 43 N 3.99 0.05 -0.88 12.44 0.13 -2.01 -3.23 132.00 142.50 2ctr h PRO 43 Ca -0.38 -0.03 0.11 0.00 -0.87 0.00 0.00 66.00 64.83 2ctr h PRO 43 Cb 1.19 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.24 2ctr h PRO 43 CO 0.46 0.52 0.51 0.38 -0.23 0.00 0.00 178.00 179.64 2ctr h ASP 44 N -0.41 0.71 -0.76 1.44 2.03 -1.99 -2.33 116.42 115.10 2ctr h ASP 44 Ca 0.00 0.06 0.13 0.00 -0.73 0.00 0.00 57.03 56.49 2ctr h ASP 44 Cb 0.51 -0.07 -0.14 0.00 -0.83 0.00 0.00 39.33 38.80 2ctr h ASP 44 CO 0.01 0.37 -0.34 0.00 -1.03 0.00 0.00 179.24 178.25 2ctr h ALA 45 N 1.50 0.11 -0.75 4.15 0.00 -1.89 0.26 119.26 122.65 2ctr h ALA 45 Ca 0.44 0.22 0.17 0.00 0.00 0.00 0.00 54.91 55.74 2ctr h ALA 45 Cb 0.47 0.84 -0.12 0.00 0.00 0.00 0.00 17.79 18.98 2ctr h ALA 45 CO -0.28 -0.62 0.13 1.49 0.00 0.00 0.00 179.25 179.97 2ctr h GLU 46 N -0.08 0.20 0.27 0.00 4.81 -1.52 -1.53 114.58 116.72 2ctr h GLU 46 Ca 0.29 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.50 2ctr h GLU 46 Cb 0.57 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.91 2ctr h GLU 46 CO -0.81 0.13 -0.13 0.00 -0.73 0.00 0.00 179.01 177.48 2ctr h ALA 47 N 1.65 -0.36 -0.78 2.92 0.00 -0.62 -2.99 119.26 119.07 2ctr h ALA 47 Ca 0.42 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 55.30 2ctr h ALA 47 Cb 0.74 0.14 -0.13 0.00 0.00 0.00 0.00 17.79 18.54 2ctr h ALA 47 CO -0.56 -0.59 -0.40 0.87 0.00 0.00 0.00 179.25 178.57 2ctr h LYS 48 N -0.58 -0.10 -0.98 0.00 1.79 -0.12 0.57 116.57 117.15 2ctr h LYS 48 Ca -0.04 0.01 0.17 0.00 -2.18 0.00 0.00 60.65 58.61 2ctr h LYS 48 Cb 0.42 0.02 -0.09 0.00 -1.58 0.00 0.00 32.23 31.00 2ctr h LYS 48 CO 0.06 -0.06 0.61 0.35 -1.08 0.00 0.00 179.45 179.33 2ctr h PHE 49 N -0.10 0.99 -0.15 -1.35 3.57 -1.36 0.31 116.94 118.86 2ctr h PHE 49 Ca 0.26 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.84 2ctr h PHE 49 Cb 0.56 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 2ctr h PHE 49 CO -0.78 0.29 0.27 -0.09 -2.23 0.00 0.00 178.31 175.77 2ctr h ARG 50 N 0.77 0.00 0.00 1.11 9.65 0.30 0.11 114.38 126.32 2ctr h ARG 50 Ca 0.53 0.00 -0.24 0.00 -1.10 0.00 0.00 59.98 59.17 2ctr h ARG 50 Cb 0.81 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.35 2ctr h ARG 50 CO -0.30 0.00 -2.01 0.39 2.80 0.00 0.00 179.97 180.85 2ctr n GLU 51 N -3.40 0.66 -0.06 0.20 4.71 0.10 -4.00 120.64 118.86 2ctr n GLU 51 Ca 0.01 0.03 -0.14 0.00 -0.01 0.00 0.00 57.16 57.05 2ctr n GLU 51 Cb 0.38 -1.61 -0.06 0.00 -1.01 0.00 0.00 31.44 29.13 2ctr n GLU 51 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 2ctr h ILE 52 N 0.00 1.33 0.51 -3.67 2.04 -0.12 -2.95 117.51 114.66 2ctr h ILE 52 Ca -0.32 -1.60 -0.03 0.00 1.00 0.00 0.00 64.86 63.92 2ctr h ILE 52 Cb 1.80 1.89 0.01 0.00 -0.74 0.00 0.00 36.82 39.78 2ctr h ILE 52 CO 0.03 0.49 -0.25 0.00 0.00 0.00 0.00 178.15 178.43 2ctr h ALA 53 N 0.59 -1.14 -1.17 1.87 0.00 -1.32 -2.08 119.26 116.00 2ctr h ALA 53 Ca 0.01 -0.15 0.37 0.00 0.00 0.00 0.00 54.91 55.13 2ctr h ALA 53 Cb 0.97 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.90 2ctr h ALA 53 CO 0.08 -1.09 0.74 1.49 0.00 0.00 0.00 179.25 180.47 2ctr h GLU 54 N -0.72 0.20 -0.58 0.00 4.57 -1.70 0.95 114.58 117.32 2ctr h GLU 54 Ca -0.07 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.01 2ctr h GLU 54 Cb 0.53 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 2ctr h GLU 54 CO 0.12 0.13 0.00 0.00 -1.18 0.00 0.00 179.01 178.08 2ctr h ALA 55 N 1.67 0.91 0.00 2.92 0.00 -1.32 -3.09 119.26 120.34 2ctr h ALA 55 Ca 0.74 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 2ctr h ALA 55 Cb 2.11 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.68 2ctr h ALA 55 CO -0.43 0.65 -0.00 -0.92 0.00 0.00 0.00 179.25 178.55 2ctr h TYR 56 N 0.92 -0.00 -0.98 0.00 5.03 0.15 -3.03 116.97 119.05 2ctr h TYR 56 Ca 0.17 -0.00 0.27 0.00 2.58 0.00 0.00 58.73 61.75 2ctr h TYR 56 Cb 0.53 0.00 -0.18 0.00 1.55 0.00 0.00 36.73 38.63 2ctr h TYR 56 CO 0.04 0.84 0.03 0.39 -1.32 0.00 0.00 178.16 178.13 2ctr n GLU 57 N -4.69 -0.08 -0.06 1.82 -0.58 0.71 0.21 120.64 117.98 2ctr n GLU 57 Ca -0.10 1.47 -0.13 0.00 -0.42 0.00 0.00 57.16 57.98 2ctr n GLU 57 Cb 0.41 -2.34 -0.07 0.00 -0.57 0.00 0.00 31.44 28.87 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 1.34 -0.19 2.62 2.02 -1.63 -2.92 112.91 114.16 2ctr h THR 58 Ca 0.60 -1.32 0.00 0.00 0.77 0.00 0.00 66.41 66.46 2ctr h THR 58 Cb 1.25 1.85 0.00 0.00 -1.74 0.00 0.00 68.15 69.51 2ctr h THR 58 CO -0.92 0.39 0.00 0.18 0.37 0.00 0.00 175.52 175.54 2ctr n LEU 59 N -4.53 1.52 -0.12 2.58 4.77 0.16 -0.88 117.00 120.50 2ctr n LEU 59 Ca -0.06 -0.77 -0.25 0.00 -0.03 0.00 0.00 56.01 54.91 2ctr n LEU 59 Cb 0.37 -0.28 -0.11 0.00 -2.33 0.00 0.00 43.42 41.07 2ctr n LEU 59 CO 0.40 0.30 -1.25 -0.24 -1.33 0.00 0.00 177.39 175.27 2ctr n SER 60 N 0.13 1.97 -3.06 -1.43 2.88 0.58 -4.94 113.62 109.73 2ctr n SER 60 Ca 0.07 0.20 -0.14 0.00 -1.33 0.00 0.00 58.87 57.67 2ctr n SER 60 Cb 0.29 -0.72 0.09 0.00 -0.75 0.00 0.00 64.21 63.12 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 -3.93 0.23 -0.03 -3.46 2.03 -1.20 -5.02 116.55 105.17 2ctr n ASP 61 Ca -0.48 -1.34 -0.02 0.00 0.52 0.00 0.00 54.79 53.47 2ctr n ASP 61 Cb 0.90 -0.47 -0.01 0.00 -0.72 0.00 0.00 41.12 40.83 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 -3.30 0.21 -0.12 -1.67 0.00 -1.26 -3.87 120.51 110.49 2ctr n ALA 62 Ca -0.10 -0.28 -0.06 0.00 0.00 0.00 0.00 53.44 52.99 2ctr n ALA 62 Cb 0.30 0.01 0.02 0.00 0.00 0.00 0.00 19.45 19.77 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 -0.41 0.28 -0.62 0.00 -1.24 -1.97 0.13 115.58 111.74 2ctr h ASN 63 Ca 0.00 0.02 0.12 0.00 0.71 0.00 0.00 56.30 57.16 2ctr h ASN 63 Cb 0.24 -0.03 -0.10 0.00 0.73 0.00 0.00 38.32 39.17 2ctr h ASN 63 CO 0.00 0.20 0.09 0.03 -1.29 0.00 0.00 177.43 176.46 2ctr h ARG 64 N 0.39 0.20 -0.18 6.67 3.08 -1.80 0.18 114.38 122.92 2ctr h ARG 64 Ca 0.17 -0.01 -0.19 0.00 0.07 0.00 0.00 59.98 60.02 2ctr h ARG 64 Cb 0.08 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2ctr h ARG 64 CO -0.12 0.13 -0.66 -0.09 -1.07 0.00 0.00 179.97 178.16 2ctr h ARG 65 N 0.20 0.68 -0.75 0.04 2.43 -0.53 -2.18 114.38 114.26 2ctr h ARG 65 Ca 0.33 -0.49 0.01 0.00 -0.81 0.00 0.00 59.98 59.02 2ctr h ARG 65 Cb 0.52 0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.11 2ctr h ARG 65 CO -0.46 1.11 0.50 -0.22 -1.51 0.00 0.00 179.97 179.38 2ctr h LYS 66 N 0.49 0.98 -0.12 0.20 3.64 0.61 -1.21 116.57 121.16 2ctr h LYS 66 Ca -0.02 -0.06 -0.18 0.00 -1.27 0.00 0.00 60.65 59.12 2ctr h LYS 66 Cb 1.25 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 2ctr h LYS 66 CO 0.13 0.65 -0.67 0.93 -2.27 0.00 0.00 179.45 178.22 2ctr h GLU 67 N 1.01 0.48 0.00 1.90 5.08 -0.70 0.11 114.58 122.46 2ctr h GLU 67 Ca 0.28 -0.36 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 2ctr h GLU 67 Cb -0.10 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 2ctr h GLU 67 CO -0.07 0.98 -0.15 -0.92 -1.00 0.00 0.00 179.01 177.86 2ctr h TYR 68 N 0.35 0.00 0.04 4.33 3.20 -0.92 0.13 116.97 124.10 2ctr h TYR 68 Ca -0.02 0.00 -0.37 0.00 3.14 0.00 0.00 58.73 61.48 2ctr h TYR 68 Cb 1.24 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.46 2ctr h TYR 68 CO 0.05 0.15 -2.11 -3.47 -1.64 0.00 0.00 178.16 171.14 2ctr n ASP 69 N -3.55 2.00 0.20 -2.11 2.03 -0.50 -1.70 116.55 112.93 2ctr n ASP 69 Ca -0.01 0.17 0.05 0.00 0.52 0.00 0.00 54.79 55.52 2ctr n ASP 69 Cb 0.29 -0.74 0.40 0.00 -0.72 0.00 0.00 41.12 40.35 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 -0.35 1.04 0.00 5.18 1.03 -0.73 -3.32 112.91 115.76 2ctr h THR 70 Ca -0.51 -1.28 -0.39 0.00 -0.01 0.00 0.00 66.41 64.22 2ctr h THR 70 Cb 1.78 1.73 -0.06 0.00 -1.07 0.00 0.00 68.15 70.54 2ctr h THR 70 CO -0.12 0.34 -2.29 0.18 -0.01 0.00 0.00 175.52 173.63 2ctr n LEU 71 N -3.82 1.84 0.00 0.00 4.77 0.46 -5.06 117.00 115.18 2ctr n LEU 71 Ca -0.01 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2ctr n LEU 71 Cb 0.42 -0.76 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2ctr n LEU 71 CO 0.37 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2ctr n GLY 72 N 1.39 0.11 0.00 -0.72 0.00 -0.69 -4.63 105.19 100.65 2ctr n GLY 72 Ca -0.47 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 43.91 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 0.33 1.61 -0.00 -1.26 -4.27 115.22 111.63 2ctr n HIS 73 Ca 0.00 0.00 0.14 0.00 0.46 0.00 0.00 57.72 58.32 2ctr n HIS 73 Cb 0.00 0.00 0.49 0.00 -0.12 0.00 0.00 29.99 30.36 2ctr n HIS 73 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2ctr h SER 74 N 0.00 0.00 0.00 0.26 0.87 -1.88 -3.15 113.55 109.65 2ctr h SER 74 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2ctr h SER 74 Cb 0.76 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 2ctr h SER 74 CO 0.00 0.00 -0.21 0.00 -0.53 0.00 0.00 176.83 176.09 2ctr n ALA 75 N -1.99 0.94 -0.36 6.23 0.00 -1.26 -4.09 120.51 119.97 2ctr n ALA 75 Ca 0.02 -0.31 -0.10 0.00 0.00 0.00 0.00 53.44 53.06 2ctr n ALA 75 Cb 0.36 0.02 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 2ctr n ALA 75 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ctr n PHE 76 N -2.98 -0.38 -3.55 0.00 -0.00 -1.26 -2.69 117.46 106.59 2ctr n PHE 76 Ca -0.03 1.08 -0.29 0.00 -0.00 0.00 0.00 57.45 58.21 2ctr n PHE 76 Cb 0.11 -0.57 -0.08 0.00 -0.00 0.00 0.00 39.48 38.94 2ctr n PHE 76 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39 2ctr n THR 77 N -4.99 2.42 -2.57 -2.13 5.66 -1.19 -5.05 114.28 106.44 2ctr n THR 77 Ca 0.02 -5.17 -0.43 0.00 -3.05 0.00 0.00 64.05 55.42 2ctr n THR 77 Cb 0.22 -2.15 -0.02 0.00 -1.55 0.00 0.00 70.33 66.84 2ctr n THR 77 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2ctr s SER 78 N -1.96 6.64 0.00 1.09 1.04 -1.10 -4.69 113.70 114.72 2ctr s SER 78 Ca 0.34 0.63 0.00 0.00 0.48 0.00 0.00 55.95 57.40 2ctr s SER 78 Cb 0.07 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.64 2ctr s SER 78 CO -0.06 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.55 2ctr n GLY 79 N 4.72 0.81 3.64 7.32 0.00 -1.26 -4.95 105.19 115.47 2ctr n GLY 79 Ca 0.13 -1.25 -0.06 0.00 0.00 0.00 0.00 46.02 44.84 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 0.56 0.00 1.61 2.20 -1.26 -5.10 119.74 117.75 2ctr s LYS 80 Ca 0.00 0.90 0.00 0.00 -0.36 0.00 0.00 55.97 56.51 2ctr s LYS 80 Cb 0.00 0.15 0.00 0.00 -1.51 0.00 0.00 37.83 36.47 2ctr s LYS 80 CO 0.00 -0.11 0.63 0.41 -0.36 0.00 0.00 175.35 175.92 2ctr n GLY 81 N 3.68 -2.85 3.55 5.54 0.00 -1.26 -4.34 105.19 109.52 2ctr n GLY 81 Ca -0.18 0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.52 2.92 0.23 1.61 1.11 -1.26 -4.98 119.66 117.76 2ctr s GLN 82 Ca 0.00 0.13 0.05 0.00 0.01 0.00 0.00 55.36 55.55 2ctr s GLN 82 Cb 0.00 -4.34 -0.03 0.00 -1.01 0.00 0.00 33.01 27.63 2ctr s GLN 82 CO 0.00 -2.46 0.29 -1.12 0.01 0.00 0.00 175.29 172.01 2ctr s SER 83 N 5.95 6.07 -0.81 5.90 0.01 -1.26 -4.71 113.70 124.85 2ctr s SER 83 Ca 0.51 -0.01 -0.02 0.00 1.31 0.00 0.00 55.95 57.75 2ctr s SER 83 Cb -0.10 -1.73 -0.01 0.00 0.21 0.00 0.00 66.02 64.40 2ctr s SER 83 CO 0.16 -0.04 0.72 0.61 0.41 0.00 0.00 173.24 175.10 2ctr n GLY 84 N -1.16 -1.23 3.77 3.44 0.00 -1.26 -4.96 105.19 103.78 2ctr n GLY 84 Ca -0.08 0.50 -0.33 0.00 0.00 0.00 0.00 46.02 46.11 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 -3.59 2.68 0.21 1.61 0.04 -1.26 -4.94 135.00 129.74 2ctr s PRO 85 Ca 0.08 1.34 -0.32 0.00 0.04 0.00 0.00 61.00 62.14 2ctr s PRO 85 Cb -0.02 -1.94 -0.14 0.00 0.04 0.00 0.00 34.50 32.45 2ctr s PRO 85 CO 0.78 -1.34 1.47 -1.13 0.04 0.00 0.00 177.00 176.82 2ctr n SER 86 N -2.67 2.88 -4.68 6.66 3.41 -1.26 -4.95 113.62 113.01 2ctr n SER 86 Ca 0.10 1.12 -0.38 0.00 -0.26 0.00 0.00 58.87 59.46 2ctr n SER 86 Cb 0.52 -1.43 -0.08 0.00 -0.26 0.00 0.00 64.21 62.97 2ctr n SER 86 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2ctr s SER 87 N 0.52 6.41 0.00 4.04 0.01 -1.26 -5.30 113.70 118.13 2ctr s SER 87 Ca 0.72 0.48 0.00 0.00 1.31 0.00 0.00 55.95 58.47 2ctr s SER 87 Cb -0.66 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 63.36 2ctr s SER 87 CO 0.45 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.69