#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ctr s SER 2 N 0.00 1.67 0.08 1.61 0.01 -1.26 -5.10 113.70 110.72 2ctr s SER 2 Ca 0.00 -1.40 -0.31 0.00 1.31 0.00 0.00 55.95 55.55 2ctr s SER 2 Cb 0.00 0.10 -0.10 0.00 0.21 0.00 0.00 66.02 66.23 2ctr s SER 2 CO 0.00 -0.70 1.89 -0.55 0.41 0.00 0.00 173.24 174.28 2ctr s SER 3 N -3.39 6.44 0.00 2.44 0.15 -1.26 -4.73 113.70 113.35 2ctr s SER 3 Ca 0.37 2.72 0.00 0.00 0.70 0.00 0.00 55.95 59.73 2ctr s SER 3 Cb 0.08 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.84 2ctr s SER 3 CO 0.15 -1.02 0.00 0.61 1.20 0.00 0.00 173.24 174.17 2ctr n GLY 4 N 4.36 -0.41 3.79 9.45 0.00 -1.26 -5.18 105.19 115.95 2ctr n GLY 4 Ca 0.19 0.34 -0.02 0.00 0.00 0.00 0.00 46.02 46.53 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 -4.00 -0.07 0.00 1.61 1.04 -1.26 -5.09 113.70 105.92 2ctr s SER 5 Ca 0.00 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.99 2ctr s SER 5 Cb 0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2ctr s SER 5 CO 0.00 -0.77 0.67 -1.20 0.98 0.00 0.00 173.24 172.91 2ctr n SER 6 N -0.80 0.00 0.00 7.02 7.64 -1.26 -4.98 113.62 121.24 2ctr n SER 6 Ca -0.05 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.60 2ctr n SER 6 Cb 0.60 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 2ctr n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ctr n GLY 7 N -0.12 1.26 3.98 0.23 0.00 -1.26 -4.38 105.19 104.91 2ctr n GLY 7 Ca 0.00 -0.88 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 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 -4.00 6.05 0.09 1.61 0.01 -1.26 -4.96 113.70 111.24 2ctr s SER 8 Ca 0.00 -0.09 -0.35 0.00 1.31 0.00 0.00 55.95 56.83 2ctr s SER 8 Cb 0.00 -1.41 -0.15 0.00 0.21 0.00 0.00 66.02 64.67 2ctr s SER 8 CO 0.00 -0.36 1.57 1.88 0.41 0.00 0.00 173.24 176.74 2ctr h TYR 9 N 0.92 -1.36 -1.12 2.43 0.05 -1.90 -0.18 116.97 115.81 2ctr h TYR 9 Ca -0.47 0.02 0.32 0.00 0.05 0.00 0.00 58.73 58.65 2ctr h TYR 9 Cb 1.25 0.55 -0.04 0.00 1.01 0.00 0.00 36.73 39.49 2ctr h TYR 9 CO 0.43 -0.62 1.13 1.88 -1.05 0.00 0.00 178.16 179.93 2ctr h TYR 10 N -0.89 0.00 0.15 4.88 0.05 -1.92 1.16 116.97 120.41 2ctr h TYR 10 Ca -0.04 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.40 2ctr h TYR 10 Cb 0.81 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.55 2ctr h TYR 10 CO -0.31 0.00 -1.82 -0.44 -1.05 0.00 0.00 178.16 174.55 2ctr h ASP 11 N 0.00 0.50 -0.15 3.88 3.32 -1.33 -0.39 116.42 122.25 2ctr h ASP 11 Ca 0.53 -0.93 -0.03 0.00 0.02 0.00 0.00 57.03 56.62 2ctr h ASP 11 Cb 2.79 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 42.17 2ctr h ASP 11 CO -0.01 1.80 -0.03 0.40 -1.72 0.00 0.00 179.24 179.68 2ctr h ILE 12 N 0.03 1.29 -0.02 0.35 2.04 0.27 -3.18 117.51 118.28 2ctr h ILE 12 Ca -0.38 -0.98 -0.19 0.00 1.00 0.00 0.00 64.86 64.31 2ctr h ILE 12 Cb 2.02 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 39.72 2ctr h ILE 12 CO 0.12 0.29 -0.82 -0.07 0.00 0.00 0.00 178.15 177.67 2ctr h LEU 13 N -0.00 0.35 -0.27 1.44 3.38 -0.77 -3.47 115.31 115.97 2ctr h LEU 13 Ca 0.04 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2ctr h LEU 13 Cb 0.46 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2ctr h LEU 13 CO 0.01 1.02 0.00 0.61 0.09 0.00 0.00 178.44 180.18 2ctr n GLY 14 N 0.73 1.11 3.35 0.83 0.00 -0.92 -4.72 105.19 105.56 2ctr n GLY 14 Ca -0.04 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.27 1.96 0.68 1.61 -7.23 -0.20 -5.02 120.40 109.93 2ctr s VAL 15 Ca 0.00 -1.82 -0.14 0.00 -1.81 0.00 0.00 61.98 58.21 2ctr s VAL 15 Cb 0.00 -1.84 0.01 0.00 0.56 0.00 0.00 36.38 35.11 2ctr s VAL 15 CO 0.00 -0.15 1.11 -2.16 -0.31 0.00 0.00 175.10 173.58 2ctr s PRO 16 N -2.43 2.71 0.64 4.82 0.04 -1.26 -4.51 135.00 135.01 2ctr s PRO 16 Ca 0.14 1.35 0.38 0.00 0.04 0.00 0.00 61.00 62.91 2ctr s PRO 16 Cb -0.08 -1.94 2.13 0.00 0.04 0.00 0.00 34.50 34.64 2ctr s PRO 16 CO 0.07 -1.31 2.28 0.87 0.04 0.00 0.00 177.00 178.94 2ctr h LYS 17 N -0.17 0.00 -0.31 4.56 1.57 -2.01 0.10 116.57 120.32 2ctr h LYS 17 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2ctr h LYS 17 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2ctr h LYS 17 CO 0.54 0.00 0.00 0.45 -0.57 0.00 0.00 179.45 179.87 2ctr n SER 18 N -3.34 3.99 -4.72 0.86 2.88 -1.26 -5.02 113.62 106.99 2ctr n SER 18 Ca -0.02 -2.88 -0.42 0.00 -1.33 0.00 0.00 58.87 54.21 2ctr n SER 18 Cb 0.13 -0.52 -0.01 0.00 -0.75 0.00 0.00 64.21 63.05 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 -0.24 1.89 -1.95 -1.46 0.00 0.36 -4.97 120.51 114.15 2ctr n ALA 19 Ca 0.21 0.37 -0.32 0.00 0.00 0.00 0.00 53.44 53.70 2ctr n ALA 19 Cb 0.87 -2.36 -0.06 0.00 0.00 0.00 0.00 19.45 17.90 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 0.12 6.79 0.19 0.00 0.15 -1.26 -4.79 113.70 114.90 2ctr s SER 20 Ca 0.61 1.50 -0.10 0.00 0.70 0.00 0.00 55.95 58.66 2ctr s SER 20 Cb -0.54 -2.47 0.25 0.00 -1.71 0.00 0.00 66.02 61.55 2ctr s SER 20 CO 0.55 -0.37 1.15 1.21 1.20 0.00 0.00 173.24 176.98 2ctr n GLU 21 N -0.82 -0.13 -0.21 5.44 2.13 -1.26 0.20 120.64 125.99 2ctr n GLU 21 Ca 0.06 1.14 -0.01 0.00 0.66 0.00 0.00 57.16 59.01 2ctr n GLU 21 Cb 0.54 -1.70 0.10 0.00 0.27 0.00 0.00 31.44 30.65 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 0.49 -0.67 5.31 0.11 -1.99 0.24 114.38 117.87 2ctr h ARG 22 Ca 0.30 -0.03 0.02 0.00 0.10 0.00 0.00 59.98 60.37 2ctr h ARG 22 Cb 0.48 -0.11 -0.04 0.00 1.11 0.00 0.00 29.97 31.42 2ctr h ARG 22 CO -0.74 0.32 0.43 1.96 0.10 0.00 0.00 179.97 182.04 2ctr h GLN 23 N 0.51 0.83 0.31 0.08 1.08 0.19 0.19 115.11 118.30 2ctr h GLN 23 Ca 0.30 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.43 2ctr h GLN 23 Cb 0.30 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2ctr h GLN 23 CO -0.25 0.55 -0.15 0.82 -0.95 0.00 0.00 178.83 178.85 2ctr h ILE 24 N 0.86 0.71 -0.44 2.54 2.04 -0.31 0.32 117.51 123.23 2ctr h ILE 24 Ca 0.26 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.71 2ctr h ILE 24 Cb -0.04 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2ctr h ILE 24 CO -0.08 0.09 0.21 0.11 0.00 0.00 0.00 178.15 178.48 2ctr h LYS 25 N -0.67 0.41 -0.37 2.37 1.57 -0.86 0.24 116.57 119.26 2ctr h LYS 25 Ca -0.04 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 2ctr h LYS 25 Cb 0.47 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2ctr h LYS 25 CO 0.07 0.27 0.03 0.87 -0.57 0.00 0.00 179.45 180.12 2ctr h LYS 26 N 0.42 0.63 -0.47 3.15 1.79 -0.60 0.16 116.57 121.64 2ctr h LYS 26 Ca 0.19 -0.19 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 2ctr h LYS 26 Cb 0.12 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 2ctr h LYS 26 CO -0.15 0.72 0.11 0.00 -1.08 0.00 0.00 179.45 179.05 2ctr h ALA 27 N 0.89 1.31 0.12 3.86 0.00 0.04 -2.69 119.26 122.79 2ctr h ALA 27 Ca 0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2ctr h ALA 27 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2ctr h ALA 27 CO 0.01 0.49 -0.06 0.35 0.00 0.00 0.00 179.25 180.04 2ctr h PHE 28 N 0.69 -0.15 -0.29 0.00 3.57 -0.35 -3.13 116.94 117.28 2ctr h PHE 28 Ca 0.16 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.68 2ctr h PHE 28 Cb 0.26 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.01 2ctr h PHE 28 CO 0.01 0.26 -0.24 0.45 -2.23 0.00 0.00 178.31 176.56 2ctr h HIS 29 N -0.95 -0.76 -0.75 0.41 3.86 -0.68 0.21 115.15 116.50 2ctr h HIS 29 Ca -0.02 0.04 0.15 0.00 -1.16 0.00 0.00 60.37 59.38 2ctr h HIS 29 Cb 0.47 0.37 -0.14 0.00 1.06 0.00 0.00 27.41 29.17 2ctr h HIS 29 CO 0.09 -0.18 -0.21 1.57 0.86 0.00 0.00 177.93 180.06 2ctr h LYS 30 N -0.09 -0.01 0.41 2.45 2.10 -1.64 -1.85 116.57 117.93 2ctr h LYS 30 Ca 0.05 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.69 2ctr h LYS 30 Cb 0.21 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.53 2ctr h LYS 30 CO -0.32 -0.01 -0.38 -0.07 -2.00 0.00 0.00 179.45 176.67 2ctr h LEU 31 N -0.02 -1.05 -1.34 7.07 3.38 -1.05 -1.83 115.31 120.48 2ctr h LEU 31 Ca 0.35 0.08 0.44 0.00 0.09 0.00 0.00 57.88 58.85 2ctr h LEU 31 Cb 0.55 0.34 -0.11 0.00 0.09 0.00 0.00 40.66 41.53 2ctr h LEU 31 CO -0.78 -0.52 0.89 0.00 0.09 0.00 0.00 178.44 178.13 2ctr n ALA 32 N -2.67 1.32 -0.03 1.53 0.00 0.57 0.16 120.51 121.39 2ctr n ALA 32 Ca -0.09 0.73 -0.13 0.00 0.00 0.00 0.00 53.44 53.95 2ctr n ALA 32 Cb 0.36 -0.96 -0.08 0.00 0.00 0.00 0.00 19.45 18.76 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 0.14 -0.18 0.00 2.86 -0.91 1.79 114.93 118.63 2ctr h MET 33 Ca 0.79 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 58.33 2ctr h MET 33 Cb 2.71 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 34.35 2ctr h MET 33 CO -0.33 0.53 -0.09 -0.22 1.06 0.00 0.00 176.91 177.86 2ctr h LYS 34 N -0.25 0.28 -0.21 1.72 3.64 0.17 -2.58 116.57 119.35 2ctr h LYS 34 Ca 0.01 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2ctr h LYS 34 Cb 0.49 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 2ctr h LYS 34 CO 0.01 0.39 -0.02 0.66 -2.27 0.00 0.00 179.45 178.22 2ctr n TYR 35 N -4.29 0.72 -1.81 1.91 4.01 -0.20 -4.87 117.16 112.63 2ctr n TYR 35 Ca -0.00 -1.02 -0.42 0.00 -0.16 0.00 0.00 57.90 56.29 2ctr n TYR 35 Cb 0.25 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 38.95 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 -2.91 1.70 -2.00 -0.72 2.46 0.61 -4.30 115.29 110.12 2ctr s HIS 36 Ca 0.40 -0.13 0.15 0.00 0.47 0.00 0.00 55.06 55.95 2ctr s HIS 36 Cb 0.34 -4.10 0.88 0.00 -0.13 0.00 0.00 32.58 29.57 2ctr s HIS 36 CO 0.06 -4.78 1.30 -0.35 -2.47 0.00 0.00 174.74 168.50 2ctr n PRO 37 N 7.06 0.49 -0.10 2.88 -0.04 -1.26 -0.25 135.00 143.77 2ctr n PRO 37 Ca 0.18 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.52 2ctr n PRO 37 Cb 0.41 -1.47 -0.14 0.00 -0.04 0.00 0.00 33.50 32.26 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 -0.97 0.83 -0.12 3.54 9.92 -1.26 -4.64 116.55 123.86 2ctr n ASP 38 Ca 0.11 -0.04 -0.18 0.00 -0.53 0.00 0.00 54.79 54.15 2ctr n ASP 38 Cb 0.05 0.54 -0.12 0.00 -0.64 0.00 0.00 41.12 40.95 2ctr n ASP 38 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2ctr n LYS 39 N -2.88 0.66 -2.18 -1.24 4.76 -1.01 -4.94 118.16 111.33 2ctr n LYS 39 Ca -0.35 0.16 -0.42 0.00 -2.87 0.00 0.00 58.31 54.83 2ctr n LYS 39 Cb 1.08 -1.54 -0.03 0.00 -1.84 0.00 0.00 35.03 32.70 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 -6.57 6.84 -0.80 4.39 3.84 0.66 -4.94 114.94 118.35 2ctr s ASN 40 Ca -0.33 2.32 0.01 0.00 0.21 0.00 0.00 52.86 55.07 2ctr s ASN 40 Cb 0.09 -2.59 0.35 0.00 -0.55 0.00 0.00 41.25 38.54 2ctr s ASN 40 CO 0.62 -0.63 1.59 0.29 -2.79 0.00 0.00 177.10 176.17 2ctr n LYS 41 N 3.81 4.02 -3.82 0.43 5.02 -1.26 -4.76 118.16 121.60 2ctr n LYS 41 Ca 0.11 -4.41 -0.12 0.00 -2.02 0.00 0.00 58.31 51.87 2ctr n LYS 41 Cb 0.42 -2.34 -0.11 0.00 -0.02 0.00 0.00 35.03 32.98 2ctr n LYS 41 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ctr s SER 42 N -2.05 -0.13 0.40 4.39 0.15 -1.26 -5.03 113.70 110.17 2ctr s SER 42 Ca 0.46 0.18 0.29 0.00 0.70 0.00 0.00 55.95 57.58 2ctr s SER 42 Cb 0.30 0.33 1.19 0.00 -1.71 0.00 0.00 66.02 66.13 2ctr s SER 42 CO -0.21 -0.18 1.85 1.55 1.20 0.00 0.00 173.24 177.45 2ctr h PRO 43 N 5.25 0.00 0.11 5.44 0.13 -2.03 -2.88 132.00 138.03 2ctr h PRO 43 Ca -0.27 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.58 2ctr h PRO 43 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2ctr h PRO 43 CO 0.39 0.00 -1.31 0.38 -0.23 0.00 0.00 178.00 177.24 2ctr h ASP 44 N 0.00 0.38 -0.62 1.44 3.04 -2.00 -3.33 116.42 115.33 2ctr h ASP 44 Ca 0.00 -0.44 0.03 0.00 -3.24 0.00 0.00 57.03 53.38 2ctr h ASP 44 Cb 0.42 -0.12 -0.04 0.00 -1.04 0.00 0.00 39.33 38.55 2ctr h ASP 44 CO 0.00 1.35 0.38 0.00 -2.04 0.00 0.00 179.24 178.93 2ctr h ALA 45 N 0.59 0.81 -0.93 4.15 0.00 -1.87 -2.07 119.26 119.94 2ctr h ALA 45 Ca -0.16 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 54.93 2ctr h ALA 45 Cb 1.97 -0.19 -0.11 0.00 0.00 0.00 0.00 17.79 19.46 2ctr h ALA 45 CO 0.19 0.13 0.49 1.49 0.00 0.00 0.00 179.25 181.54 2ctr h GLU 46 N 0.75 0.56 -0.16 0.00 4.81 -1.66 -0.72 114.58 118.16 2ctr h GLU 46 Ca 0.25 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.36 2ctr h GLU 46 Cb 0.03 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 2ctr h GLU 46 CO -0.11 0.37 -0.25 0.00 -0.73 0.00 0.00 179.01 178.30 2ctr h ALA 47 N 1.65 0.24 -0.14 2.92 0.00 -1.55 -2.97 119.26 119.42 2ctr h ALA 47 Ca 0.55 -0.38 0.05 0.00 0.00 0.00 0.00 54.91 55.12 2ctr h ALA 47 Cb 0.93 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 2ctr h ALA 47 CO -0.44 0.22 -0.38 0.87 0.00 0.00 0.00 179.25 179.52 2ctr h LYS 48 N 0.08 -0.44 -0.42 0.00 1.79 -0.53 0.54 116.57 117.59 2ctr h LYS 48 Ca 0.01 0.03 0.10 0.00 -2.18 0.00 0.00 60.65 58.61 2ctr h LYS 48 Cb 0.82 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.55 2ctr h LYS 48 CO 0.06 -0.29 0.29 0.35 -1.08 0.00 0.00 179.45 178.78 2ctr h PHE 49 N -0.45 0.15 0.00 -1.35 3.57 -1.39 0.16 116.94 117.63 2ctr h PHE 49 Ca 0.09 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 2ctr h PHE 49 Cb 0.60 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 2ctr h PHE 49 CO -0.46 0.07 -0.00 -0.09 -2.23 0.00 0.00 178.31 175.60 2ctr h ARG 50 N 0.14 0.00 0.00 1.11 9.65 -0.72 -0.57 114.38 124.00 2ctr h ARG 50 Ca 0.20 0.00 -0.36 0.00 -1.10 0.00 0.00 59.98 58.71 2ctr h ARG 50 Cb 0.60 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.11 2ctr h ARG 50 CO -0.03 0.00 -2.32 0.39 2.80 0.00 0.00 179.97 180.82 2ctr n GLU 51 N -3.12 0.68 -0.04 0.20 -0.58 0.49 -3.98 120.64 114.29 2ctr n GLU 51 Ca -0.02 0.06 -0.13 0.00 -0.42 0.00 0.00 57.16 56.65 2ctr n GLU 51 Cb 0.13 -1.56 -0.08 0.00 -0.57 0.00 0.00 31.44 29.36 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 1.37 0.34 -3.67 2.04 -0.82 -2.76 117.51 114.02 2ctr h ILE 52 Ca -0.52 -1.27 -0.02 0.00 1.00 0.00 0.00 64.86 64.05 2ctr h ILE 52 Cb 2.16 2.04 0.00 0.00 -0.74 0.00 0.00 36.82 40.28 2ctr h ILE 52 CO 0.02 0.35 -0.18 0.00 0.00 0.00 0.00 178.15 178.34 2ctr h ALA 53 N 0.55 -1.10 -1.17 1.87 0.00 -1.35 -0.19 119.26 117.88 2ctr h ALA 53 Ca 0.01 -0.10 0.38 0.00 0.00 0.00 0.00 54.91 55.19 2ctr h ALA 53 Cb 0.61 0.23 -0.13 0.00 0.00 0.00 0.00 17.79 18.50 2ctr h ALA 53 CO 0.02 -1.07 0.73 1.49 0.00 0.00 0.00 179.25 180.42 2ctr h GLU 54 N -0.48 0.19 -0.26 0.00 4.81 -1.70 0.66 114.58 117.79 2ctr h GLU 54 Ca -0.05 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 2ctr h GLU 54 Cb 0.37 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2ctr h GLU 54 CO 0.07 0.12 -0.19 0.00 -0.73 0.00 0.00 179.01 178.28 2ctr h ALA 55 N 1.69 0.38 0.14 2.92 0.00 -1.21 -3.25 119.26 119.93 2ctr h ALA 55 Ca 0.76 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 2ctr h ALA 55 Cb 2.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.85 2ctr h ALA 55 CO -0.46 0.31 -0.07 -0.92 0.00 0.00 0.00 179.25 178.11 2ctr h TYR 56 N 0.32 -0.18 -0.77 0.00 3.20 0.20 -2.96 116.97 116.78 2ctr h TYR 56 Ca 0.05 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.07 2ctr h TYR 56 Cb 0.73 0.06 -0.15 0.00 1.54 0.00 0.00 36.73 38.91 2ctr h TYR 56 CO 0.07 0.21 -0.20 0.39 -1.64 0.00 0.00 178.16 176.99 2ctr n GLU 57 N -4.99 -0.07 -0.15 1.82 -0.58 0.82 0.21 120.64 117.70 2ctr n GLU 57 Ca -0.09 1.20 -0.11 0.00 -0.42 0.00 0.00 57.16 57.75 2ctr n GLU 57 Cb 0.24 -1.79 -0.01 0.00 -0.57 0.00 0.00 31.44 29.31 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 1.27 -0.20 2.62 2.02 -1.59 -2.47 112.91 114.57 2ctr h THR 58 Ca 0.37 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2ctr h THR 58 Cb 0.56 1.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 2ctr h THR 58 CO -0.79 0.37 0.00 0.18 0.37 0.00 0.00 175.52 175.65 2ctr n LEU 59 N -4.37 1.13 -0.12 2.58 4.77 0.44 -0.40 117.00 121.03 2ctr n LEU 59 Ca -0.01 -0.55 -0.17 0.00 -0.03 0.00 0.00 56.01 55.25 2ctr n LEU 59 Cb 0.32 -0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 41.16 2ctr n LEU 59 CO 0.42 0.28 -1.29 -0.24 -1.33 0.00 0.00 177.39 175.22 2ctr n SER 60 N 0.09 1.76 -4.93 -1.43 2.88 0.55 -4.86 113.62 107.68 2ctr n SER 60 Ca 0.09 -0.10 -0.26 0.00 -1.33 0.00 0.00 58.87 57.27 2ctr n SER 60 Cb 0.19 -0.28 0.04 0.00 -0.75 0.00 0.00 64.21 63.41 2ctr n SER 60 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2ctr s ASP 61 N -6.43 5.37 0.00 -3.46 1.01 -1.09 -4.99 116.67 107.08 2ctr s ASP 61 Ca -0.31 0.57 0.00 0.00 0.71 0.00 0.00 52.55 53.52 2ctr s ASP 61 Cb 0.09 -1.48 0.00 0.00 1.01 0.00 0.00 42.92 42.54 2ctr s ASP 61 CO 0.64 -1.19 0.12 0.00 0.21 0.00 0.00 175.17 174.94 2ctr n ALA 62 N -2.63 -0.05 -0.21 5.23 0.00 -1.26 -2.41 120.51 119.18 2ctr n ALA 62 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.51 2ctr n ALA 62 Cb 0.58 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.16 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 0.00 -0.10 0.26 0.00 2.35 -1.97 0.56 115.58 116.68 2ctr h ASN 63 Ca 0.00 0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2ctr h ASN 63 Cb 0.00 0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 2ctr h ASN 63 CO 0.00 -0.05 -0.31 0.03 -1.65 0.00 0.00 177.43 175.45 2ctr h ARG 64 N 0.21 -0.59 0.00 0.81 3.08 -1.81 0.13 114.38 116.20 2ctr h ARG 64 Ca 0.34 0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.39 2ctr h ARG 64 Cb 0.54 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2ctr h ARG 64 CO -0.47 -0.40 -0.19 -0.09 -1.07 0.00 0.00 179.97 177.75 2ctr h ARG 65 N -0.62 0.00 -0.29 0.04 1.12 0.03 -0.56 114.38 114.10 2ctr h ARG 65 Ca -0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 59.98 58.76 2ctr h ARG 65 Cb 0.58 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.54 2ctr h ARG 65 CO -0.09 0.19 -0.23 -0.22 -3.11 0.00 0.00 179.97 176.51 2ctr h LYS 66 N 0.00 0.67 -0.10 0.20 3.64 0.89 -1.89 116.57 119.98 2ctr h LYS 66 Ca -0.00 -0.33 -0.11 0.00 -1.27 0.00 0.00 60.65 58.94 2ctr h LYS 66 Cb 0.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2ctr h LYS 66 CO 0.02 0.94 -0.36 0.93 -2.27 0.00 0.00 179.45 178.71 2ctr h GLU 67 N 0.41 0.42 -0.02 1.90 5.08 -0.42 0.17 114.58 122.13 2ctr h GLU 67 Ca 0.05 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2ctr h GLU 67 Cb 0.78 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.09 2ctr h GLU 67 CO 0.06 0.94 -0.02 -0.92 -1.00 0.00 0.00 179.01 178.07 2ctr h TYR 68 N -0.01 0.03 0.10 4.33 5.03 -1.15 0.53 116.97 125.82 2ctr h TYR 68 Ca -0.02 0.00 -0.28 0.00 2.58 0.00 0.00 58.73 61.02 2ctr h TYR 68 Cb 0.99 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 39.25 2ctr h TYR 68 CO 0.12 0.05 -1.45 0.22 -1.32 0.00 0.00 178.16 175.78 2ctr h ASP 69 N 0.03 0.32 0.52 -2.11 1.82 -1.30 0.38 116.42 116.09 2ctr h ASP 69 Ca 0.01 -0.82 -0.07 0.00 -0.39 0.00 0.00 57.03 55.76 2ctr h ASP 69 Cb 0.06 -0.10 -0.01 0.00 0.68 0.00 0.00 39.33 39.95 2ctr h ASP 69 CO 0.00 1.62 -0.34 0.00 -1.61 0.00 0.00 179.24 178.92 2ctr h THR 70 N -0.37 1.03 0.00 2.25 1.03 -0.41 -3.31 112.91 113.13 2ctr h THR 70 Ca -0.32 -1.25 -0.35 0.00 -0.01 0.00 0.00 66.41 64.48 2ctr h THR 70 Cb 1.72 1.72 -0.06 0.00 -1.07 0.00 0.00 68.15 70.46 2ctr h THR 70 CO 0.02 0.33 -2.21 0.18 -0.01 0.00 0.00 175.52 173.83 2ctr n LEU 71 N -3.82 2.21 0.00 0.00 4.77 0.18 -5.05 117.00 115.28 2ctr n LEU 71 Ca -0.01 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2ctr n LEU 71 Cb 0.41 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 2ctr n LEU 71 CO 0.37 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 2ctr n GLY 72 N 2.02 0.44 0.11 -0.72 0.00 0.13 -4.39 105.19 102.78 2ctr n GLY 72 Ca -0.41 -2.16 -0.20 0.00 0.00 0.00 0.00 46.02 43.26 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 0.49 0.70 0.10 1.61 -0.00 -1.26 -3.51 115.22 113.35 2ctr n HIS 73 Ca 0.00 0.30 -0.23 0.00 0.46 0.00 0.00 57.72 58.25 2ctr n HIS 73 Cb 0.00 -0.97 -0.13 0.00 -0.12 0.00 0.00 29.99 28.76 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 -1.00 0.88 -0.63 0.26 0.87 -1.91 -2.34 113.55 109.68 2ctr h SER 74 Ca -0.34 -0.84 -0.08 0.00 -1.23 0.00 0.00 61.79 59.30 2ctr h SER 74 Cb 1.21 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 62.86 2ctr h SER 74 CO -0.21 1.64 0.08 0.00 -0.53 0.00 0.00 176.83 177.81 2ctr h ALA 75 N 0.26 0.93 -0.22 6.23 0.00 -1.80 -3.02 119.26 121.64 2ctr h ALA 75 Ca -0.20 -0.28 -0.20 0.00 0.00 0.00 0.00 54.91 54.23 2ctr h ALA 75 Cb 1.96 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.51 2ctr h ALA 75 CO 0.25 0.66 -0.65 0.35 0.00 0.00 0.00 179.25 179.86 2ctr h PHE 76 N 1.00 1.04 -0.43 0.00 3.57 -1.64 -3.27 116.94 117.21 2ctr h PHE 76 Ca 0.19 -0.41 -0.36 0.00 3.53 0.00 0.00 57.97 60.92 2ctr h PHE 76 Cb 0.46 -0.18 -0.10 0.00 2.79 0.00 0.00 35.95 38.92 2ctr h PHE 76 CO 0.03 1.23 0.33 0.25 -2.23 0.00 0.00 178.31 177.92 2ctr n THR 77 N -3.97 3.32 -3.19 4.41 -2.24 -0.88 -4.91 114.28 106.82 2ctr n THR 77 Ca -0.05 -2.24 -0.40 0.00 -2.27 0.00 0.00 64.05 59.09 2ctr n THR 77 Cb 0.68 -1.91 -0.06 0.00 -2.10 0.00 0.00 70.33 66.94 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 1.35 6.62 0.00 3.42 0.15 -1.23 -4.34 113.70 119.66 2ctr s SER 78 Ca 0.64 0.74 0.00 0.00 0.70 0.00 0.00 55.95 58.03 2ctr s SER 78 Cb 0.33 -2.32 0.00 0.00 -1.71 0.00 0.00 66.02 62.32 2ctr s SER 78 CO -0.09 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.74 2ctr n GLY 79 N 3.85 0.53 3.15 9.45 0.00 -1.26 -5.08 105.19 115.82 2ctr n GLY 79 Ca -0.03 -0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 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 0.80 2.16 -0.06 1.61 2.20 -1.26 -4.95 119.74 120.24 2ctr s LYS 80 Ca 0.00 -1.83 -0.24 0.00 -0.36 0.00 0.00 55.97 53.54 2ctr s LYS 80 Cb 0.00 -3.69 -0.26 0.00 -1.51 0.00 0.00 37.83 32.37 2ctr s LYS 80 CO 0.00 -1.11 0.96 0.78 -0.36 0.00 0.00 175.35 175.62 2ctr h GLY 81 N 8.14 0.23 -1.04 5.54 0.00 -1.98 -3.46 103.07 110.50 2ctr h GLY 81 Ca -0.15 -0.48 -0.47 0.00 0.00 0.00 0.00 47.33 46.23 2ctr h GLY 81 CO 0.75 0.42 0.20 1.20 0.00 0.00 0.00 176.54 179.10 2ctr s GLN 82 N -2.81 0.66 0.07 4.80 1.11 -1.26 -5.07 119.66 117.15 2ctr s GLN 82 Ca -0.15 0.76 0.00 0.00 0.01 0.00 0.00 55.36 55.98 2ctr s GLN 82 Cb 0.01 -1.74 -0.04 0.00 -1.01 0.00 0.00 33.01 30.22 2ctr s GLN 82 CO 0.77 -2.64 -0.04 -1.12 0.01 0.00 0.00 175.29 172.26 2ctr s SER 83 N -3.26 0.72 -0.45 5.90 0.01 -1.26 -5.12 113.70 110.24 2ctr s SER 83 Ca 0.65 -0.99 0.03 0.00 1.31 0.00 0.00 55.95 56.95 2ctr s SER 83 Cb -0.19 0.16 0.16 0.00 0.21 0.00 0.00 66.02 66.35 2ctr s SER 83 CO 0.58 -0.54 0.32 -0.83 0.41 0.00 0.00 173.24 173.18 2ctr s GLY 84 N -2.93 1.47 0.82 3.44 0.00 -1.26 -5.13 107.32 103.74 2ctr s GLY 84 Ca 0.08 -2.57 -0.11 0.00 0.00 0.00 0.00 44.72 42.12 2ctr s GLY 84 CO -0.08 1.87 1.09 2.56 0.00 0.00 0.00 173.10 178.54 2ctr s PRO 85 N 0.07 1.89 -0.26 2.90 0.04 -1.26 -5.04 135.00 133.33 2ctr s PRO 85 Ca 0.26 1.04 0.02 0.00 0.04 0.00 0.00 61.00 62.37 2ctr s PRO 85 Cb -0.07 -1.86 0.06 0.00 0.04 0.00 0.00 34.50 32.66 2ctr s PRO 85 CO -0.12 -1.87 -0.10 -1.12 0.04 0.00 0.00 177.00 173.84 2ctr s SER 86 N -3.40 4.45 -0.46 6.66 0.01 -1.26 -5.04 113.70 114.65 2ctr s SER 86 Ca 0.62 -1.33 0.03 0.00 1.31 0.00 0.00 55.95 56.58 2ctr s SER 86 Cb -0.17 -1.57 0.15 0.00 0.21 0.00 0.00 66.02 64.64 2ctr s SER 86 CO 0.56 -0.19 0.31 -0.55 0.41 0.00 0.00 173.24 173.79 2ctr s SER 87 N 1.14 2.88 0.00 2.44 0.15 -1.26 -5.31 113.70 113.74 2ctr s SER 87 Ca -0.07 -2.91 0.28 0.00 0.70 0.00 0.00 55.95 53.94 2ctr s SER 87 Cb -0.19 -0.79 1.00 0.00 -1.71 0.00 0.00 66.02 64.32 2ctr s SER 87 CO -0.05 -0.21 1.71 0.61 1.20 0.00 0.00 173.24 176.51