#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 -5.25 -4.87 1.61 2.88 -1.26 -4.98 113.62 101.75 2ctr n SER 2 Ca 0.00 -0.56 -0.30 0.00 -1.33 0.00 0.00 58.87 56.68 2ctr n SER 2 Cb 0.00 -5.03 0.04 0.00 -0.75 0.00 0.00 64.21 58.47 2ctr n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2ctr s SER 3 N -3.59 5.50 -0.33 -3.46 0.15 -1.26 -5.03 113.70 105.69 2ctr s SER 3 Ca 0.43 1.24 0.17 0.00 0.70 0.00 0.00 55.95 58.50 2ctr s SER 3 Cb -0.19 -2.09 0.46 0.00 -1.71 0.00 0.00 66.02 62.49 2ctr s SER 3 CO 0.72 -1.32 0.96 0.61 1.20 0.00 0.00 173.24 175.42 2ctr n GLY 4 N -2.79 1.77 3.69 9.45 0.00 -1.26 -5.12 105.19 110.94 2ctr n GLY 4 Ca 0.07 -1.37 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 2ctr n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ctr s SER 5 N -3.16 3.24 -0.15 1.61 0.15 -1.26 -5.02 113.70 109.11 2ctr s SER 5 Ca 0.28 1.69 -0.08 0.00 0.70 0.00 0.00 55.95 58.54 2ctr s SER 5 Cb 0.45 -2.33 0.06 0.00 -1.71 0.00 0.00 66.02 62.50 2ctr s SER 5 CO 0.03 -2.81 0.36 -0.94 1.20 0.00 0.00 173.24 171.07 2ctr s SER 6 N -3.16 -0.36 0.00 5.45 1.04 -1.26 -4.92 113.70 110.49 2ctr s SER 6 Ca 0.64 0.79 0.00 0.00 0.48 0.00 0.00 55.95 57.86 2ctr s SER 6 Cb -0.20 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2ctr s SER 6 CO 0.58 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 175.21 2ctr n GLY 7 N 4.47 0.11 3.93 7.32 0.00 -1.26 -5.00 105.19 114.76 2ctr n GLY 7 Ca -0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 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 1.00 6.37 0.09 1.61 0.01 -1.26 -4.91 113.70 116.61 2ctr s SER 8 Ca 0.00 0.43 -0.23 0.00 1.31 0.00 0.00 55.95 57.45 2ctr s SER 8 Cb 0.00 -2.02 -0.08 0.00 0.21 0.00 0.00 66.02 64.13 2ctr s SER 8 CO 0.00 -0.12 1.39 1.88 0.41 0.00 0.00 173.24 176.80 2ctr h TYR 9 N 1.63 -1.19 -1.35 2.43 0.05 -1.95 0.23 116.97 116.83 2ctr h TYR 9 Ca -0.49 0.05 0.45 0.00 0.05 0.00 0.00 58.73 58.80 2ctr h TYR 9 Cb 1.20 0.55 -0.12 0.00 1.01 0.00 0.00 36.73 39.37 2ctr h TYR 9 CO 0.54 -0.36 0.89 0.66 -1.05 0.00 0.00 178.16 178.84 2ctr n TYR 10 N -4.59 0.52 -0.00 4.88 4.01 -1.26 0.12 117.16 120.84 2ctr n TYR 10 Ca -0.03 0.53 -0.18 0.00 -0.16 0.00 0.00 57.90 58.06 2ctr n TYR 10 Cb 0.25 -0.96 -0.14 0.00 -0.31 0.00 0.00 39.34 38.18 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 0.27 -0.89 7.72 5.19 -0.90 0.31 116.42 128.12 2ctr h ASP 11 Ca 0.81 -0.94 0.08 0.00 -0.62 0.00 0.00 57.03 56.36 2ctr h ASP 11 Cb 2.73 -0.09 -0.06 0.00 0.18 0.00 0.00 39.33 42.09 2ctr h ASP 11 CO -0.35 1.28 0.58 0.40 -3.12 0.00 0.00 179.24 178.02 2ctr h ILE 12 N -0.62 1.02 0.10 0.35 2.04 0.32 -2.79 117.51 117.93 2ctr h ILE 12 Ca -0.12 -0.33 -0.35 0.00 1.00 0.00 0.00 64.86 65.07 2ctr h ILE 12 Cb 1.41 -0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 2ctr h ILE 12 CO 0.07 0.17 -1.92 -0.07 0.00 0.00 0.00 178.15 176.40 2ctr h LEU 13 N 0.95 0.33 0.00 1.44 3.38 -0.79 -3.47 115.31 117.16 2ctr h LEU 13 Ca 0.39 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2ctr h LEU 13 Cb 0.29 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2ctr h LEU 13 CO -0.16 1.67 0.00 0.61 0.09 0.00 0.00 178.44 180.65 2ctr n GLY 14 N 1.89 1.62 3.60 0.83 0.00 0.82 -4.73 105.19 109.21 2ctr n GLY 14 Ca -0.28 -0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.33 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 3.38 0.75 1.61 -7.23 0.25 -4.99 120.40 112.17 2ctr s VAL 15 Ca 0.00 -1.47 -0.11 0.00 -1.81 0.00 0.00 61.98 58.58 2ctr s VAL 15 Cb 0.00 -2.65 0.05 0.00 0.56 0.00 0.00 36.38 34.33 2ctr s VAL 15 CO 0.00 -0.04 1.09 -2.16 -0.31 0.00 0.00 175.10 173.68 2ctr s PRO 16 N -2.66 2.35 0.50 4.82 0.04 -1.26 -4.54 135.00 134.25 2ctr s PRO 16 Ca 0.24 1.21 0.15 0.00 0.04 0.00 0.00 61.00 62.64 2ctr s PRO 16 Cb -0.10 -1.91 1.19 0.00 0.04 0.00 0.00 34.50 33.73 2ctr s PRO 16 CO 0.16 -1.58 2.12 0.87 0.04 0.00 0.00 177.00 178.61 2ctr h LYS 17 N -0.93 0.12 -0.55 4.56 6.56 -2.00 -0.23 116.57 124.11 2ctr h LYS 17 Ca -0.44 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.14 2ctr h LYS 17 Cb 1.23 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.87 2ctr h LYS 17 CO 0.52 0.08 0.00 0.43 -2.06 0.00 0.00 179.45 178.42 2ctr n SER 18 N -4.52 5.30 -4.69 0.86 7.64 -1.26 -5.00 113.62 111.96 2ctr n SER 18 Ca -0.01 -2.84 -0.43 0.00 1.01 0.00 0.00 58.87 56.60 2ctr n SER 18 Cb 0.12 -0.64 -0.01 0.00 -1.01 0.00 0.00 64.21 62.66 2ctr n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ctr n ALA 19 N 0.58 1.20 -2.09 -0.43 0.00 -0.10 -4.96 120.51 114.70 2ctr n ALA 19 Ca 0.26 0.38 -0.34 0.00 0.00 0.00 0.00 53.44 53.74 2ctr n ALA 19 Cb 1.10 -2.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 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 -0.15 6.91 0.27 0.00 0.15 -1.26 -4.79 113.70 114.83 2ctr s SER 20 Ca 0.59 1.38 0.11 0.00 0.70 0.00 0.00 55.95 58.73 2ctr s SER 20 Cb -0.60 -2.41 0.87 0.00 -1.71 0.00 0.00 66.02 62.18 2ctr s SER 20 CO 0.58 -0.13 1.22 1.21 1.20 0.00 0.00 173.24 177.33 2ctr n GLU 21 N 0.04 -0.05 -0.13 5.44 2.13 -1.26 0.22 120.64 127.02 2ctr n GLU 21 Ca 0.02 1.11 -0.08 0.00 0.66 0.00 0.00 57.16 58.86 2ctr n GLU 21 Cb 0.52 -1.90 -0.00 0.00 0.27 0.00 0.00 31.44 30.33 2ctr n GLU 21 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2ctr h ARG 22 N 0.00 0.53 -0.38 5.31 9.65 -1.99 -1.38 114.38 126.13 2ctr h ARG 22 Ca 0.59 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 59.38 2ctr h ARG 22 Cb 1.45 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.90 2ctr h ARG 22 CO -0.65 0.39 0.07 1.96 2.80 0.00 0.00 179.97 184.54 2ctr h GLN 23 N 0.52 0.62 0.44 0.20 4.20 0.22 0.12 115.11 121.44 2ctr h GLN 23 Ca 0.14 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2ctr h GLN 23 Cb -0.00 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 2ctr h GLN 23 CO -0.03 0.68 -0.39 0.82 -0.67 0.00 0.00 178.83 179.25 2ctr h ILE 24 N 0.47 0.21 -0.23 2.54 2.04 -0.91 0.13 117.51 121.76 2ctr h ILE 24 Ca 0.12 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.92 2ctr h ILE 24 Cb 0.36 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2ctr h ILE 24 CO 0.01 0.00 -0.09 0.07 0.00 0.00 0.00 178.15 178.14 2ctr h LYS 25 N -0.83 0.36 0.19 2.37 2.10 -1.27 -0.68 116.57 118.81 2ctr h LYS 25 Ca -0.04 -0.08 -0.01 0.00 -2.00 0.00 0.00 60.65 58.52 2ctr h LYS 25 Cb 0.73 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.01 2ctr h LYS 25 CO -0.03 0.46 -0.09 0.87 -2.00 0.00 0.00 179.45 178.66 2ctr h LYS 26 N 0.34 -0.24 -0.34 0.07 1.79 -0.30 0.30 116.57 118.20 2ctr h LYS 26 Ca 0.07 0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.51 2ctr h LYS 26 Cb 0.37 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 2ctr h LYS 26 CO 0.02 -0.03 0.03 0.00 -1.08 0.00 0.00 179.45 178.39 2ctr h ALA 27 N 0.36 0.46 0.60 3.86 0.00 -0.62 -3.07 119.26 120.85 2ctr h ALA 27 Ca -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2ctr h ALA 27 Cb 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2ctr h ALA 27 CO 0.04 0.19 -0.31 0.35 0.00 0.00 0.00 179.25 179.52 2ctr h PHE 28 N 0.40 -0.81 -0.27 0.00 3.57 -1.10 -2.37 116.94 116.36 2ctr h PHE 28 Ca 0.10 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.61 2ctr h PHE 28 Cb 0.41 0.28 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 2ctr h PHE 28 CO 0.03 -0.49 -0.16 0.72 -2.23 0.00 0.00 178.31 176.19 2ctr n HIS 29 N -4.32 -0.12 -0.27 0.41 8.25 0.09 -0.08 115.22 119.19 2ctr n HIS 29 Ca -0.10 0.33 -0.00 0.00 -0.26 0.00 0.00 57.72 57.69 2ctr n HIS 29 Cb 0.33 -0.47 0.07 0.00 1.12 0.00 0.00 29.99 31.04 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 -0.04 0.43 -0.41 1.57 -1.57 -1.87 116.57 114.67 2ctr h LYS 30 Ca 0.04 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2ctr h LYS 30 Cb 0.11 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 2ctr h LYS 30 CO -0.25 -0.03 -0.36 -0.07 -0.57 0.00 0.00 179.45 178.17 2ctr h LEU 31 N -0.04 -0.96 -1.08 2.94 3.38 0.07 -2.08 115.31 117.54 2ctr h LEU 31 Ca 0.34 0.07 0.36 0.00 0.09 0.00 0.00 57.88 58.74 2ctr h LEU 31 Cb 0.58 0.30 -0.10 0.00 0.09 0.00 0.00 40.66 41.53 2ctr h LEU 31 CO -0.81 -0.50 0.70 0.00 0.09 0.00 0.00 178.44 177.93 2ctr n ALA 32 N -2.62 1.06 -0.05 1.53 0.00 0.72 0.23 120.51 121.39 2ctr n ALA 32 Ca -0.09 0.63 -0.13 0.00 0.00 0.00 0.00 53.44 53.85 2ctr n ALA 32 Cb 0.34 -0.80 -0.07 0.00 0.00 0.00 0.00 19.45 18.92 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 0.27 -0.60 0.00 2.86 -0.99 1.97 114.93 118.43 2ctr h MET 33 Ca 0.66 -0.12 -0.06 0.00 -2.06 0.00 0.00 59.70 58.12 2ctr h MET 33 Cb 2.19 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 33.82 2ctr h MET 33 CO -0.31 0.62 0.14 -0.22 1.06 0.00 0.00 176.91 178.20 2ctr h LYS 34 N -0.08 0.94 -0.58 1.72 3.11 0.31 -2.59 116.57 119.41 2ctr h LYS 34 Ca 0.03 -0.21 0.00 0.00 -2.81 0.00 0.00 60.65 57.66 2ctr h LYS 34 Cb 0.54 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 31.64 2ctr h LYS 34 CO 0.02 0.84 0.00 0.66 -2.81 0.00 0.00 179.45 178.16 2ctr n TYR 35 N -4.26 0.92 -1.66 1.91 4.01 -0.34 -4.70 117.16 113.05 2ctr n TYR 35 Ca 0.04 -0.54 -0.47 0.00 -0.16 0.00 0.00 57.90 56.77 2ctr n TYR 35 Cb 0.24 -0.07 -0.04 0.00 -0.31 0.00 0.00 39.34 39.16 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 1.10 2.19 0.55 -0.72 -0.00 0.67 -4.36 115.22 114.65 2ctr n HIS 36 Ca 0.21 0.29 0.07 0.00 0.46 0.00 0.00 57.72 58.75 2ctr n HIS 36 Cb 0.63 -2.53 0.32 0.00 -0.12 0.00 0.00 29.99 28.29 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 3.59 0.06 -0.03 1.57 -0.04 -1.26 -0.37 135.00 138.53 2ctr n PRO 37 Ca 0.18 0.22 0.01 0.00 -0.04 0.00 0.00 63.50 63.87 2ctr n PRO 37 Cb 0.28 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.10 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 -1.44 0.26 -0.13 3.54 8.00 -1.26 -4.58 116.55 120.94 2ctr n ASP 38 Ca 0.04 0.11 -0.28 0.00 0.71 0.00 0.00 54.79 55.37 2ctr n ASP 38 Cb 0.15 1.10 -0.10 0.00 -0.02 0.00 0.00 41.12 42.25 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 -2.61 0.59 -2.25 -1.24 4.76 -0.97 -4.86 118.16 111.58 2ctr n LYS 39 Ca -0.15 0.29 -0.42 0.00 -2.87 0.00 0.00 58.31 55.16 2ctr n LYS 39 Cb 0.85 -1.52 -0.03 0.00 -1.84 0.00 0.00 35.03 32.49 2ctr n LYS 39 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2ctr s ASN 40 N -7.38 6.01 -0.11 4.39 -0.87 0.50 -4.88 114.94 112.61 2ctr s ASN 40 Ca -0.37 0.66 -0.05 0.00 -1.57 0.00 0.00 52.86 51.52 2ctr s ASN 40 Cb 0.14 -2.54 -0.19 0.00 -0.02 0.00 0.00 41.25 38.64 2ctr s ASN 40 CO 0.51 -1.73 3.42 0.29 -2.57 0.00 0.00 177.10 177.02 2ctr n LYS 41 N 8.52 2.09 -4.10 -0.60 5.02 -1.26 -4.72 118.16 123.12 2ctr n LYS 41 Ca 0.17 -1.32 -0.13 0.00 -2.02 0.00 0.00 58.31 55.01 2ctr n LYS 41 Cb 0.49 -2.03 -0.11 0.00 -0.02 0.00 0.00 35.03 33.36 2ctr n LYS 41 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2ctr s SER 42 N 1.60 1.00 0.20 4.39 0.01 -1.26 -5.06 113.70 114.59 2ctr s SER 42 Ca 0.65 -0.67 -0.04 0.00 1.31 0.00 0.00 55.95 57.19 2ctr s SER 42 Cb 0.33 0.04 0.14 0.00 0.21 0.00 0.00 66.02 66.74 2ctr s SER 42 CO -0.05 -0.26 1.55 1.55 0.41 0.00 0.00 173.24 176.44 2ctr h PRO 43 N 4.08 0.66 -0.65 12.44 0.13 -2.02 -3.16 132.00 143.49 2ctr h PRO 43 Ca -0.36 -0.35 -0.08 0.00 -0.87 0.00 0.00 66.00 64.34 2ctr h PRO 43 Cb 1.19 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2ctr h PRO 43 CO 0.47 0.95 0.10 0.38 -0.23 0.00 0.00 178.00 179.67 2ctr h ASP 44 N 0.54 1.03 -0.44 1.44 2.03 -1.97 -3.14 116.42 115.92 2ctr h ASP 44 Ca 0.04 -0.26 0.08 0.00 -0.73 0.00 0.00 57.03 56.16 2ctr h ASP 44 Cb 0.94 -0.27 -0.10 0.00 -0.83 0.00 0.00 39.33 39.07 2ctr h ASP 44 CO 0.09 1.04 -0.33 0.00 -1.03 0.00 0.00 179.24 179.00 2ctr h ALA 45 N 1.03 -0.16 -0.61 4.15 0.00 -1.89 0.01 119.26 121.79 2ctr h ALA 45 Ca 0.19 0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.34 2ctr h ALA 45 Cb 0.45 0.73 -0.12 0.00 0.00 0.00 0.00 17.79 18.85 2ctr h ALA 45 CO 0.01 -0.72 -0.21 1.49 0.00 0.00 0.00 179.25 179.83 2ctr h GLU 46 N -0.23 -0.05 -0.16 0.00 4.81 -1.63 -0.65 114.58 116.67 2ctr h GLU 46 Ca 0.18 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2ctr h GLU 46 Cb 0.54 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2ctr h GLU 46 CO -0.57 -0.03 0.10 0.00 -0.73 0.00 0.00 179.01 177.78 2ctr h ALA 47 N 1.45 0.20 -0.34 2.92 0.00 -1.27 -2.75 119.26 119.48 2ctr h ALA 47 Ca 0.28 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.23 2ctr h ALA 47 Cb 0.49 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 2ctr h ALA 47 CO -0.66 -0.32 -0.51 0.87 0.00 0.00 0.00 179.25 178.63 2ctr h LYS 48 N 0.21 -0.41 -0.96 0.00 1.79 0.45 0.14 116.57 117.78 2ctr h LYS 48 Ca 0.06 0.03 0.21 0.00 -2.18 0.00 0.00 60.65 58.76 2ctr h LYS 48 Cb -0.02 0.09 -0.08 0.00 -1.58 0.00 0.00 32.23 30.64 2ctr h LYS 48 CO -0.01 -0.27 0.62 0.35 -1.08 0.00 0.00 179.45 179.05 2ctr h PHE 49 N -0.43 0.74 -0.37 -1.35 3.57 -1.26 0.33 116.94 118.18 2ctr h PHE 49 Ca 0.08 0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.71 2ctr h PHE 49 Cb 0.62 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2ctr h PHE 49 CO -0.66 0.17 0.42 -0.09 -2.23 0.00 0.00 178.31 175.92 2ctr h ARG 50 N 0.53 0.00 0.00 1.11 9.65 -0.42 0.18 114.38 125.43 2ctr h ARG 50 Ca 0.53 0.00 -0.28 0.00 -1.10 0.00 0.00 59.98 59.12 2ctr h ARG 50 Cb 1.13 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.65 2ctr h ARG 50 CO -0.26 0.00 -2.11 0.39 2.80 0.00 0.00 179.97 180.79 2ctr n GLU 51 N -3.67 0.67 -0.06 0.20 -0.58 0.11 -3.99 120.64 113.32 2ctr n GLU 51 Ca 0.06 0.04 -0.14 0.00 -0.42 0.00 0.00 57.16 56.70 2ctr n GLU 51 Cb 0.58 -1.60 -0.07 0.00 -0.57 0.00 0.00 31.44 29.78 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 1.34 0.20 -3.67 2.04 -0.24 -3.03 117.51 114.16 2ctr h ILE 52 Ca -0.39 -1.59 -0.01 0.00 1.00 0.00 0.00 64.86 63.87 2ctr h ILE 52 Cb 1.97 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.98 2ctr h ILE 52 CO 0.04 0.48 -0.09 0.00 0.00 0.00 0.00 178.15 178.58 2ctr h ALA 53 N 0.58 -1.01 -0.94 1.87 0.00 -0.99 -2.62 119.26 116.15 2ctr h ALA 53 Ca 0.01 -0.06 0.24 0.00 0.00 0.00 0.00 54.91 55.09 2ctr h ALA 53 Cb 0.94 0.10 -0.18 0.00 0.00 0.00 0.00 17.79 18.66 2ctr h ALA 53 CO 0.08 -0.99 -0.06 -1.91 0.00 0.00 0.00 179.25 176.37 2ctr n GLU 54 N -2.75 -0.08 -0.35 0.00 2.13 -1.26 0.18 120.64 118.51 2ctr n GLU 54 Ca -0.03 1.43 0.06 0.00 0.66 0.00 0.00 57.16 59.28 2ctr n GLU 54 Cb 0.10 -2.23 0.22 0.00 0.27 0.00 0.00 31.44 29.80 2ctr n GLU 54 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2ctr h ALA 55 N 1.89 1.45 -0.02 4.31 0.00 -1.47 -1.38 119.26 124.03 2ctr h ALA 55 Ca 0.53 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.40 2ctr h ALA 55 Cb 1.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2ctr h ALA 55 CO -0.91 0.25 -0.22 -0.92 0.00 0.00 0.00 179.25 177.45 2ctr h TYR 56 N 1.00 0.26 -0.56 0.00 3.20 0.23 -2.59 116.97 118.51 2ctr h TYR 56 Ca 0.47 -0.13 0.11 0.00 3.14 0.00 0.00 58.73 62.33 2ctr h TYR 56 Cb 0.41 -0.04 -0.10 0.00 1.54 0.00 0.00 36.73 38.55 2ctr h TYR 56 CO -0.01 0.88 -0.07 0.93 -1.64 0.00 0.00 178.16 178.25 2ctr h GLU 57 N -0.44 0.05 0.40 1.82 5.08 -0.35 1.88 114.58 123.02 2ctr h GLU 57 Ca -0.02 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 2ctr h GLU 57 Cb 0.93 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.17 2ctr h GLU 57 CO 0.04 0.03 -0.19 1.15 -1.00 0.00 0.00 179.01 179.04 2ctr h THR 58 N 0.05 0.58 0.00 1.13 2.02 -1.35 -2.08 112.91 113.26 2ctr h THR 58 Ca 0.28 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 67.08 2ctr h THR 58 Cb 0.44 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 2ctr h THR 58 CO -0.53 0.07 0.00 0.18 0.37 0.00 0.00 175.52 175.61 2ctr n LEU 59 N -5.23 0.00 -0.07 2.58 4.77 -0.93 0.19 117.00 118.31 2ctr n LEU 59 Ca -0.10 0.42 -0.08 0.00 -0.03 0.00 0.00 56.01 56.21 2ctr n LEU 59 Cb 0.28 -0.42 -0.06 0.00 -2.33 0.00 0.00 43.42 40.88 2ctr n LEU 59 CO 0.32 -0.22 0.03 0.28 -1.33 0.00 0.00 177.39 176.48 2ctr h SER 60 N 0.00 0.00 -3.36 -1.43 0.02 0.33 -3.44 113.55 105.67 2ctr h SER 60 Ca 0.00 -0.42 -0.41 0.00 -0.84 0.00 0.00 61.79 60.12 2ctr h SER 60 Cb 0.21 0.00 0.20 0.00 0.14 0.00 0.00 62.40 62.95 2ctr h SER 60 CO 0.00 0.83 0.04 -1.81 -1.14 0.00 0.00 176.83 174.75 2ctr s ASP 61 N -5.97 0.49 0.00 3.07 1.11 -0.82 -4.91 116.67 109.65 2ctr s ASP 61 Ca -0.12 0.92 0.00 0.00 0.18 0.00 0.00 52.55 53.53 2ctr s ASP 61 Cb -0.00 -1.36 0.00 0.00 1.07 0.00 0.00 42.92 42.63 2ctr s ASP 61 CO 0.35 -4.42 0.00 0.00 1.18 0.00 0.00 175.17 172.28 2ctr n ALA 62 N -5.00 0.00 -0.20 5.23 0.00 -1.26 -2.89 120.51 116.39 2ctr n ALA 62 Ca 0.10 -0.09 0.18 0.00 0.00 0.00 0.00 53.44 53.63 2ctr n ALA 62 Cb 0.58 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.56 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 0.37 0.18 0.00 4.21 -1.96 0.42 115.58 118.80 2ctr h ASN 63 Ca 0.00 0.03 -0.01 0.00 1.21 0.00 0.00 56.30 57.53 2ctr h ASN 63 Cb 0.00 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.16 2ctr h ASN 63 CO 0.00 0.17 -0.08 0.03 -1.29 0.00 0.00 177.43 176.26 2ctr h ARG 64 N 0.39 -0.23 0.00 0.81 3.08 -1.78 0.15 114.38 116.79 2ctr h ARG 64 Ca 0.41 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.43 2ctr h ARG 64 Cb 1.03 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 2ctr h ARG 64 CO -0.14 0.18 -0.21 -0.09 -1.07 0.00 0.00 179.97 178.64 2ctr h ARG 65 N -0.74 0.00 0.14 0.04 1.12 0.51 -1.80 114.38 113.65 2ctr h ARG 65 Ca -0.02 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.84 2ctr h ARG 65 Cb 0.51 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.47 2ctr h ARG 65 CO 0.04 0.21 -0.06 -0.22 -3.11 0.00 0.00 179.97 176.83 2ctr h LYS 66 N 0.00 -0.17 -0.85 0.20 3.64 -0.18 -2.98 116.57 116.23 2ctr h LYS 66 Ca -0.00 0.01 0.23 0.00 -1.27 0.00 0.00 60.65 59.62 2ctr h LYS 66 Cb 0.39 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.20 2ctr h LYS 66 CO 0.03 -0.06 0.60 0.93 -2.27 0.00 0.00 179.45 178.67 2ctr h GLU 67 N -1.04 0.10 0.00 1.90 4.39 -0.70 0.84 114.58 120.07 2ctr h GLU 67 Ca -0.02 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 2ctr h GLU 67 Cb 0.19 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 2ctr h GLU 67 CO 0.03 0.07 -0.21 -0.92 -1.16 0.00 0.00 179.01 176.82 2ctr h TYR 68 N 0.11 0.00 0.00 4.33 5.03 -1.41 -0.37 116.97 124.66 2ctr h TYR 68 Ca 0.42 0.00 -0.21 0.00 2.58 0.00 0.00 58.73 61.52 2ctr h TYR 68 Cb 1.48 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 39.72 2ctr h TYR 68 CO -0.00 0.21 -1.87 -3.47 -1.32 0.00 0.00 178.16 171.72 2ctr n ASP 69 N -3.24 0.41 0.07 -2.11 -0.08 0.24 -2.22 116.55 109.62 2ctr n ASP 69 Ca 0.02 0.18 -0.20 0.00 -1.51 0.00 0.00 54.79 53.28 2ctr n ASP 69 Cb 0.51 0.78 -0.15 0.00 2.34 0.00 0.00 41.12 44.61 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 0.00 1.03 0.10 5.18 1.03 -0.19 -3.38 112.91 116.68 2ctr h THR 70 Ca -0.27 -2.65 -0.36 0.00 -0.01 0.00 0.00 66.41 63.13 2ctr h THR 70 Cb 1.71 2.75 -0.02 0.00 -1.07 0.00 0.00 68.15 71.52 2ctr h THR 70 CO 0.03 0.83 -2.01 0.18 -0.01 0.00 0.00 175.52 174.54 2ctr n LEU 71 N -3.52 2.62 0.00 0.00 4.77 -0.15 -5.07 117.00 115.65 2ctr n LEU 71 Ca -0.21 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2ctr n LEU 71 Cb 1.06 -1.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2ctr n LEU 71 CO 0.51 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 178.00 2ctr n GLY 72 N 1.98 0.13 0.13 -0.72 0.00 -0.94 -4.31 105.19 101.45 2ctr n GLY 72 Ca -0.34 -2.29 -0.22 0.00 0.00 0.00 0.00 46.02 43.17 2ctr n GLY 72 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2ctr h HIS 73 N 0.00 0.51 0.06 1.61 2.76 -1.95 -2.95 115.15 115.18 2ctr h HIS 73 Ca 0.00 -0.37 -0.26 0.00 -2.20 0.00 0.00 60.37 57.54 2ctr h HIS 73 Cb 0.00 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 28.92 2ctr h HIS 73 CO 0.00 1.61 -1.30 1.03 -1.30 0.00 0.00 177.93 177.97 2ctr h SER 74 N -0.18 0.20 0.34 3.26 0.87 -1.92 -3.14 113.55 112.97 2ctr h SER 74 Ca -0.33 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 59.97 2ctr h SER 74 Cb 1.86 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.76 2ctr h SER 74 CO 0.09 1.20 -0.16 0.00 -0.53 0.00 0.00 176.83 177.43 2ctr h ALA 75 N 0.77 -0.45 -0.44 6.23 0.00 -1.75 -3.23 119.26 120.38 2ctr h ALA 75 Ca -0.14 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 54.76 2ctr h ALA 75 Cb 1.92 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.86 2ctr h ALA 75 CO 0.15 -0.45 0.38 0.35 0.00 0.00 0.00 179.25 179.68 2ctr h PHE 76 N -1.07 0.00 -1.05 0.00 3.04 -1.69 -2.28 116.94 113.89 2ctr h PHE 76 Ca -0.05 0.00 -0.53 0.00 3.98 0.00 0.00 57.97 61.38 2ctr h PHE 76 Cb 0.43 0.00 -0.17 0.00 2.56 0.00 0.00 35.95 38.77 2ctr h PHE 76 CO 0.02 0.00 0.67 0.25 -2.02 0.00 0.00 178.31 177.23 2ctr n THR 77 N -4.04 3.60 -3.52 4.41 -2.24 -1.19 -4.81 114.28 106.50 2ctr n THR 77 Ca 0.08 -3.15 -0.40 0.00 -2.27 0.00 0.00 64.05 58.31 2ctr n THR 77 Cb 0.57 -1.68 -0.04 0.00 -2.10 0.00 0.00 70.33 67.08 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 0.41 6.36 0.00 3.42 0.15 -0.86 -4.62 113.70 118.57 2ctr s SER 78 Ca 0.59 -3.41 0.00 0.00 0.70 0.00 0.00 55.95 53.83 2ctr s SER 78 Cb 0.35 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.63 2ctr s SER 78 CO -0.20 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.56 2ctr n GLY 79 N 2.85 2.67 3.00 9.45 0.00 -1.26 -5.01 105.19 116.89 2ctr n GLY 79 Ca 0.19 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 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 2.64 0.00 1.61 2.20 -1.26 -5.04 119.74 119.88 2ctr s LYS 80 Ca 0.00 -3.08 0.00 0.00 -0.36 0.00 0.00 55.97 52.53 2ctr s LYS 80 Cb 0.00 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 32.71 2ctr s LYS 80 CO 0.00 -1.23 0.00 0.41 -0.36 0.00 0.00 175.35 174.17 2ctr n GLY 81 N 2.50 5.54 3.45 5.54 0.00 -1.26 -4.93 105.19 116.03 2ctr n GLY 81 Ca 0.16 -1.61 -0.15 0.00 0.00 0.00 0.00 46.02 44.42 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 0.48 1.11 -0.21 1.61 0.74 -1.26 -5.08 119.66 117.05 2ctr s GLN 82 Ca 0.00 -0.12 -0.21 0.00 0.05 0.00 0.00 55.36 55.09 2ctr s GLN 82 Cb 0.00 0.52 -0.19 0.00 1.10 0.00 0.00 33.01 34.44 2ctr s GLN 82 CO 0.00 -0.41 0.18 0.43 -0.55 0.00 0.00 175.29 174.94 2ctr n SER 83 N 0.37 1.87 -2.88 6.67 7.64 -1.26 -5.06 113.62 120.98 2ctr n SER 83 Ca -0.18 0.41 -0.08 0.00 1.01 0.00 0.00 58.87 60.02 2ctr n SER 83 Cb 0.60 -0.95 0.01 0.00 -1.01 0.00 0.00 64.21 62.86 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 1.44 -1.28 3.74 0.23 0.00 -1.26 -4.99 105.19 103.07 2ctr n GLY 84 Ca -0.34 1.23 -0.30 0.00 0.00 0.00 0.00 46.02 46.60 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 -2.63 1.77 -0.10 1.61 0.04 -1.26 -4.90 135.00 129.52 2ctr s PRO 85 Ca 0.24 1.01 -0.13 0.00 0.04 0.00 0.00 61.00 62.16 2ctr s PRO 85 Cb -0.07 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.65 2ctr s PRO 85 CO 0.77 -1.94 0.34 0.45 0.04 0.00 0.00 177.00 176.67 2ctr s SER 86 N -3.40 -0.32 0.12 6.66 0.15 -1.26 -5.05 113.70 110.60 2ctr s SER 86 Ca 0.62 0.55 -0.20 0.00 0.70 0.00 0.00 55.95 57.62 2ctr s SER 86 Cb -0.18 0.61 -0.07 0.00 -1.71 0.00 0.00 66.02 64.68 2ctr s SER 86 CO 0.56 -0.21 0.63 -0.55 1.20 0.00 0.00 173.24 174.87 2ctr s SER 87 N -0.22 7.11 0.00 5.45 0.15 -1.26 -5.11 113.70 119.82 2ctr s SER 87 Ca -0.04 1.34 0.00 0.00 0.70 0.00 0.00 55.95 57.96 2ctr s SER 87 Cb -0.03 -2.39 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 2ctr s SER 87 CO 0.02 0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.29