#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ecg n SER 2 N 0.00 -2.40 -3.64 1.61 3.41 -1.26 -4.89 113.62 106.45 2ecg n SER 2 Ca 0.00 -1.06 -0.06 0.00 -0.26 0.00 0.00 58.87 57.49 2ecg n SER 2 Cb 0.00 -2.57 -0.02 0.00 -0.26 0.00 0.00 64.21 61.36 2ecg n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2ecg s SER 3 N -3.52 -0.28 0.00 4.04 1.04 -1.26 -5.15 113.70 108.58 2ecg s SER 3 Ca 0.60 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.80 2ecg s SER 3 Cb -0.33 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2ecg s SER 3 CO 0.94 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 174.96 2ecg n GLY 4 N -0.37 2.55 2.72 7.32 0.00 -1.26 -5.12 105.19 111.02 2ecg n GLY 4 Ca -0.08 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 2ecg n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ecg s SER 5 N 0.00 3.99 -0.23 1.61 0.01 -1.26 -5.10 113.70 112.72 2ecg s SER 5 Ca 0.00 -1.62 -0.27 0.00 1.31 0.00 0.00 55.95 55.37 2ecg s SER 5 Cb 0.00 -0.83 0.13 0.00 0.21 0.00 0.00 66.02 65.53 2ecg s SER 5 CO 0.00 -0.42 1.03 -0.55 0.41 0.00 0.00 173.24 173.72 2ecg s SER 6 N 1.64 -0.40 0.00 2.44 0.15 -1.26 -5.15 113.70 111.12 2ecg s SER 6 Ca 0.10 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.39 2ecg s SER 6 Cb -0.17 0.61 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 2ecg s SER 6 CO -0.26 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.56 2ecg n GLY 7 N 1.57 2.38 3.44 9.45 0.00 -1.26 -5.19 105.19 115.58 2ecg n GLY 7 Ca -0.11 0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 2ecg n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ecg s SER 8 N 0.00 -0.41 -0.12 1.61 1.04 -1.26 -5.16 113.70 109.40 2ecg s SER 8 Ca 0.00 -0.21 -0.04 0.00 0.48 0.00 0.00 55.95 56.19 2ecg s SER 8 Cb 0.00 0.57 0.06 0.00 0.10 0.00 0.00 66.02 66.75 2ecg s SER 8 CO 0.00 -0.98 0.18 -0.76 0.98 0.00 0.00 173.24 172.65 2ecg s LEU 9 N -2.80 -0.08 -0.28 2.42 1.02 -1.26 -5.13 118.68 112.57 2ecg s LEU 9 Ca 0.04 0.18 -0.21 0.00 0.02 0.00 0.00 54.13 54.16 2ecg s LEU 9 Cb -0.01 0.30 0.10 0.00 0.02 0.00 0.00 46.19 46.61 2ecg s LEU 9 CO -0.10 -0.27 0.84 0.00 0.02 0.00 0.00 176.35 176.85 2ecg s GLN 10 N 2.30 0.62 -0.29 1.70 -2.07 -1.26 -5.16 119.66 115.50 2ecg s GLN 10 Ca 0.04 0.89 -0.16 0.00 -1.82 0.00 0.00 55.36 54.31 2ecg s GLN 10 Cb -0.13 0.22 0.12 0.00 -1.09 0.00 0.00 33.01 32.13 2ecg s GLN 10 CO -0.07 -0.10 0.84 -1.59 -1.32 0.00 0.00 175.29 173.04 2ecg s LYS 11 N 0.90 0.53 0.17 9.60 -2.85 -1.26 -5.17 119.74 121.66 2ecg s LYS 11 Ca -0.04 0.94 0.10 0.00 -1.00 0.00 0.00 55.97 55.97 2ecg s LYS 11 Cb -0.05 0.13 -0.04 0.00 -2.06 0.00 0.00 37.83 35.81 2ecg s LYS 11 CO -0.10 -0.12 -0.23 -2.00 0.10 0.00 0.00 175.35 173.01 2ecg s GLU 12 N 1.53 1.41 0.01 1.78 2.12 -1.26 -5.14 118.70 119.15 2ecg s GLU 12 Ca -0.09 -1.44 -0.10 0.00 0.36 0.00 0.00 54.97 53.70 2ecg s GLU 12 Cb -0.04 -1.69 -0.05 0.00 0.26 0.00 0.00 34.13 32.61 2ecg s GLU 12 CO -0.17 0.37 0.32 0.42 -0.54 0.00 0.00 175.26 175.66 2ecg s ILE 13 N -1.64 5.20 0.65 -3.70 1.01 -1.26 -5.10 121.20 116.37 2ecg s ILE 13 Ca 0.17 0.42 -0.06 0.00 0.00 0.00 0.00 60.65 61.19 2ecg s ILE 13 Cb -0.08 -3.60 0.04 0.00 0.01 0.00 0.00 42.46 38.83 2ecg s ILE 13 CO 0.08 0.44 0.96 -0.44 0.00 0.00 0.00 174.94 175.98 2ecg s SER 14 N -1.46 5.15 0.40 3.58 0.01 -1.26 -4.84 113.70 115.28 2ecg s SER 14 Ca 0.26 0.55 0.10 0.00 1.31 0.00 0.00 55.95 58.17 2ecg s SER 14 Cb -0.14 -1.35 0.88 0.00 0.21 0.00 0.00 66.02 65.62 2ecg s SER 14 CO 0.14 -1.36 1.97 0.00 0.41 0.00 0.00 173.24 174.40 2ecg h THR 15 N -0.40 0.96 0.00 1.44 1.03 -1.98 0.25 112.91 114.20 2ecg h THR 15 Ca -0.45 -0.20 0.00 0.00 -0.01 0.00 0.00 66.41 65.75 2ecg h THR 15 Cb 1.29 0.32 0.00 0.00 -1.07 0.00 0.00 68.15 68.70 2ecg h THR 15 CO 0.60 0.11 0.00 -0.62 -0.01 0.00 0.00 175.52 175.60 2ecg n GLU 16 N -4.48 0.00 -0.11 0.00 1.02 -1.26 -0.21 120.64 115.59 2ecg n GLU 16 Ca 0.10 0.63 -0.08 0.00 -0.02 0.00 0.00 57.16 57.79 2ecg n GLU 16 Cb 0.30 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.22 2ecg n GLU 16 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2ecg h GLU 17 N 0.00 0.45 0.00 3.49 4.81 -1.93 -1.88 114.58 119.52 2ecg h GLU 17 Ca 0.00 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2ecg h GLU 17 Cb 0.00 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.24 2ecg h GLU 17 CO 0.00 0.30 -0.36 1.96 -0.73 0.00 0.00 179.01 180.18 2ecg h GLN 18 N 0.46 -0.44 -0.99 1.92 4.20 -0.91 -1.46 115.11 117.89 2ecg h GLN 18 Ca 0.14 0.03 0.17 0.00 0.06 0.00 0.00 58.65 59.05 2ecg h GLN 18 Cb -0.02 0.10 -0.10 0.00 0.30 0.00 0.00 27.48 27.76 2ecg h GLN 18 CO -0.05 -0.29 0.62 -0.07 -0.67 0.00 0.00 178.83 178.36 2ecg h LEU 19 N -0.46 0.78 -0.43 1.46 4.07 -0.54 0.46 115.31 120.65 2ecg h LEU 19 Ca 0.01 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2ecg h LEU 19 Cb 0.49 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.16 2ecg h LEU 19 CO -0.24 0.32 0.07 0.54 -1.08 0.00 0.00 178.44 178.06 2ecg n ARG 20 N -4.70 0.04 -0.09 1.13 1.74 -0.57 0.19 116.66 114.41 2ecg n ARG 20 Ca 0.22 0.50 -0.23 0.00 -0.77 0.00 0.00 57.85 57.57 2ecg n ARG 20 Cb 0.53 -1.71 -0.12 0.00 -1.02 0.00 0.00 32.46 30.13 2ecg n ARG 20 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2ecg n ARG 21 N -1.70 0.64 -0.11 5.56 1.85 0.16 -3.99 116.66 119.08 2ecg n ARG 21 Ca -0.00 0.31 -0.23 0.00 -1.00 0.00 0.00 57.85 56.93 2ecg n ARG 21 Cb 0.08 -1.62 -0.11 0.00 -1.05 0.00 0.00 32.46 29.76 2ecg n ARG 21 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09 2ecg n LEU 22 N -3.85 1.87 -0.06 2.89 -0.00 -0.55 -4.21 117.00 113.10 2ecg n LEU 22 Ca -0.41 0.41 0.17 0.00 -0.00 0.00 0.00 56.01 56.18 2ecg n LEU 22 Cb 0.91 -0.95 0.60 0.00 -0.00 0.00 0.00 43.42 43.98 2ecg n LEU 22 CO 0.23 0.31 1.19 1.56 -0.00 0.00 0.00 177.39 180.69 2ecg h GLN 23 N -1.00 0.19 0.00 1.47 4.20 0.18 0.48 115.11 120.63 2ecg h GLN 23 Ca -0.40 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.30 2ecg h GLN 23 Cb 1.34 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.08 2ecg h GLN 23 CO -0.24 0.13 0.00 -0.85 -0.67 0.00 0.00 178.83 177.20 2ecg n GLU 24 N -4.43 0.73 -0.01 1.46 0.28 -1.19 -1.33 120.64 116.15 2ecg n GLU 24 Ca 0.11 0.00 0.04 0.00 -0.16 0.00 0.00 57.16 57.15 2ecg n GLU 24 Cb 0.54 -1.31 -0.08 0.00 1.43 0.00 0.00 31.44 32.02 2ecg n GLU 24 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2ecg n GLU 25 N -0.81 0.63 -0.13 3.44 1.02 0.17 -4.67 120.64 120.28 2ecg n GLU 25 Ca 0.11 -0.08 -0.18 0.00 -0.02 0.00 0.00 57.16 56.99 2ecg n GLU 25 Cb 0.05 -1.25 -0.12 0.00 -0.02 0.00 0.00 31.44 30.10 2ecg n GLU 25 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2ecg n LYS 26 N -1.93 0.65 -0.28 3.49 2.85 -1.03 -5.00 118.16 116.90 2ecg n LYS 26 Ca -0.04 0.15 -0.11 0.00 -1.05 0.00 0.00 58.31 57.26 2ecg n LYS 26 Cb 0.35 -1.52 0.11 0.00 -0.65 0.00 0.00 35.03 33.32 2ecg n LYS 26 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 2ecg n LEU 27 N -3.25 0.00 -4.08 -5.58 -0.00 -0.44 -4.63 117.00 99.02 2ecg n LEU 27 Ca -0.46 -0.32 -0.35 0.00 -0.00 0.00 0.00 56.01 54.89 2ecg n LEU 27 Cb 0.99 -0.49 0.08 0.00 -0.00 0.00 0.00 43.42 43.99 2ecg n LEU 27 CO 0.26 -2.04 -1.52 0.00 -0.00 0.00 0.00 177.39 174.08 2ecg n LYS 29 N 0.87 2.38 -0.01 0.00 5.02 -0.89 -4.51 118.16 121.01 2ecg n LYS 29 Ca -0.01 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2ecg n LYS 29 Cb 0.69 -0.78 -0.00 0.00 -0.02 0.00 0.00 35.03 34.92 2ecg n LYS 29 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2ecg h ILE 30 N 0.00 0.00 0.18 -0.18 5.03 -1.93 -3.41 117.51 117.20 2ecg h ILE 30 Ca 0.00 -0.17 -0.30 0.00 -0.12 0.00 0.00 64.86 64.27 2ecg h ILE 30 Cb 0.37 0.00 0.02 0.00 -3.03 0.00 0.00 36.82 34.18 2ecg h ILE 30 CO 0.00 0.00 -1.33 0.00 -0.68 0.00 0.00 178.15 176.14 2ecg n MET 32 N -3.63 -6.22 -0.03 0.00 2.81 -1.26 -4.89 117.12 103.89 2ecg n MET 32 Ca -0.12 0.72 -0.04 0.00 -1.81 0.00 0.00 57.70 56.45 2ecg n MET 32 Cb 1.05 -5.59 -0.03 0.00 -0.71 0.00 0.00 33.22 27.94 2ecg n MET 32 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2ecg n ASP 33 N -3.01 3.56 -3.33 7.83 2.03 -1.26 -5.00 116.55 117.37 2ecg n ASP 33 Ca -0.14 -0.03 -0.16 0.00 0.52 0.00 0.00 54.79 54.99 2ecg n ASP 33 Cb 0.61 0.06 -0.03 0.00 -0.72 0.00 0.00 41.12 41.03 2ecg n ASP 33 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2ecg n ARG 34 N -2.58 1.38 -3.68 -0.67 0.00 -1.26 -5.07 116.66 104.78 2ecg n ARG 34 Ca -0.11 -1.85 -0.37 0.00 -0.00 0.00 0.00 57.85 55.53 2ecg n ARG 34 Cb 0.63 0.49 -0.12 0.00 -0.00 0.00 0.00 32.46 33.47 2ecg n ARG 34 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2ecg s ASN 35 N -2.39 5.53 -0.15 2.89 0.01 -1.26 -2.88 114.94 116.68 2ecg s ASN 35 Ca 0.00 -0.11 -0.41 0.00 -0.71 0.00 0.00 52.86 51.62 2ecg s ASN 35 Cb 0.00 -2.01 -0.19 0.00 0.41 0.00 0.00 41.25 39.46 2ecg s ASN 35 CO 0.00 -0.04 1.36 2.30 -1.51 0.00 0.00 177.10 179.21 2ecg n ILE 36 N 4.96 0.04 -1.87 0.60 -6.64 -1.26 -4.83 119.36 110.36 2ecg n ILE 36 Ca -0.15 -0.01 0.03 0.00 -1.77 0.00 0.00 62.75 60.85 2ecg n ILE 36 Cb 0.52 -0.47 0.04 0.00 -1.44 0.00 0.00 39.64 38.29 2ecg n ILE 36 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2ecg n ALA 37 N 2.92 2.21 -2.84 -1.28 0.00 -1.26 -4.76 120.51 115.49 2ecg n ALA 37 Ca 0.24 -1.68 -0.10 0.00 0.00 0.00 0.00 53.44 51.89 2ecg n ALA 37 Cb 0.07 -0.51 -0.09 0.00 0.00 0.00 0.00 19.45 18.93 2ecg n ALA 37 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2ecg s ILE 38 N -0.76 0.11 0.41 0.00 -1.09 -1.26 -2.90 121.20 115.71 2ecg s ILE 38 Ca 0.14 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 57.68 2ecg s ILE 38 Cb 0.14 -0.90 -0.03 0.00 -1.58 0.00 0.00 42.46 40.09 2ecg s ILE 38 CO -0.03 -0.51 0.12 0.68 -1.23 0.00 0.00 174.94 173.98 2ecg s VAL 39 N -2.55 0.64 0.45 2.92 -7.23 -1.20 -3.96 120.40 109.45 2ecg s VAL 39 Ca -0.05 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.19 2ecg s VAL 39 Cb -0.01 -2.37 -0.02 0.00 0.56 0.00 0.00 36.38 34.54 2ecg s VAL 39 CO -0.04 0.00 0.28 -0.36 -0.31 0.00 0.00 175.10 174.67 2ecg s PHE 40 N -3.21 2.38 -0.04 2.82 0.08 -1.24 -4.00 117.98 114.76 2ecg s PHE 40 Ca 0.24 -0.64 -0.03 0.00 0.12 0.00 0.00 56.93 56.62 2ecg s PHE 40 Cb 0.03 -1.99 0.02 0.00 -0.57 0.00 0.00 43.02 40.50 2ecg s PHE 40 CO 0.14 -0.05 0.11 0.08 -0.10 0.00 0.00 175.22 175.41 2ecg s VAL 41 N -2.62 -0.01 -0.02 -0.44 1.01 -1.26 -3.51 120.40 113.55 2ecg s VAL 41 Ca 0.40 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 62.16 2ecg s VAL 41 Cb 0.01 -0.17 -0.20 0.00 0.00 0.00 0.00 36.38 36.02 2ecg s VAL 41 CO 0.23 0.02 1.24 1.55 0.00 0.00 0.00 175.10 178.13 2ecg h PRO 42 N 6.26 -0.04 -6.04 2.72 0.13 -1.92 -3.33 132.00 129.77 2ecg h PRO 42 Ca -0.29 0.00 -0.79 0.00 -0.87 0.00 0.00 66.00 64.06 2ecg h PRO 42 Cb 1.19 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2ecg h PRO 42 CO 0.44 0.43 1.00 0.00 -0.23 0.00 0.00 178.00 179.64 2ecg s GLY 44 N 4.47 1.59 -0.31 0.00 0.00 -1.23 -3.64 107.32 108.20 2ecg s GLY 44 Ca 1.08 -2.09 0.00 0.00 0.00 0.00 0.00 44.72 43.71 2ecg s GLY 44 CO 0.69 1.85 0.08 0.30 0.00 0.00 0.00 173.10 176.02 2ecg s HIS 45 N 3.35 2.19 -0.16 1.90 3.76 -1.26 -4.82 115.29 120.25 2ecg s HIS 45 Ca 0.18 -2.02 -0.02 0.00 -0.15 0.00 0.00 55.06 53.05 2ecg s HIS 45 Cb -0.19 -1.98 0.03 0.00 1.11 0.00 0.00 32.58 31.54 2ecg s HIS 45 CO 0.07 -0.89 2.40 1.47 -0.85 0.00 0.00 174.74 176.94 2ecg n LEU 46 N 4.71 5.82 0.08 0.89 -0.00 -1.25 -4.07 117.00 123.18 2ecg n LEU 46 Ca -0.01 -3.04 -0.07 0.00 -0.00 0.00 0.00 56.01 52.89 2ecg n LEU 46 Cb 0.42 -1.17 0.06 0.00 -0.00 0.00 0.00 43.42 42.73 2ecg n LEU 46 CO 0.14 1.30 0.38 -0.37 -0.00 0.00 0.00 177.39 178.83 2ecg h VAL 47 N 1.31 1.42 -3.10 1.47 -1.51 -1.90 -3.44 116.25 110.50 2ecg h VAL 47 Ca 0.18 -2.23 -0.63 0.00 -1.23 0.00 0.00 66.70 62.79 2ecg h VAL 47 Cb 1.03 2.18 -0.08 0.00 -2.13 0.00 0.00 31.29 32.29 2ecg h VAL 47 CO 0.39 0.66 -0.59 0.42 -1.23 0.00 0.00 177.57 177.22 2ecg s THR 48 N -3.54 4.58 0.43 7.19 -4.23 -1.26 -2.10 115.64 116.71 2ecg s THR 48 Ca -0.04 -0.79 -0.10 0.00 -1.18 0.00 0.00 61.69 59.58 2ecg s THR 48 Cb 0.11 -3.23 -0.06 0.00 1.34 0.00 0.00 72.50 70.66 2ecg s THR 48 CO 0.82 0.09 0.80 0.00 -0.54 0.00 0.00 174.62 175.79 2ecg n LYS 50 N -1.49 -0.02 0.21 0.00 2.85 -1.26 0.37 118.16 118.82 2ecg n LYS 50 Ca 0.03 1.07 -0.11 0.00 -1.05 0.00 0.00 58.31 58.24 2ecg n LYS 50 Cb 0.54 -2.26 -0.06 0.00 -0.65 0.00 0.00 35.03 32.60 2ecg n LYS 50 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 2ecg h GLN 51 N 0.00 -0.56 0.08 -1.58 4.20 -1.99 -3.12 115.11 112.13 2ecg h GLN 51 Ca 0.83 0.04 -0.00 0.00 0.06 0.00 0.00 58.65 59.57 2ecg h GLN 51 Cb 3.00 0.13 0.00 0.00 0.30 0.00 0.00 27.48 30.90 2ecg h GLN 51 CO -0.23 -0.29 -0.04 0.00 -0.67 0.00 0.00 178.83 177.60 2ecg n ALA 53 N -2.27 0.39 -0.23 0.00 0.00 0.16 0.13 120.51 118.69 2ecg n ALA 53 Ca -0.08 1.03 -0.06 0.00 0.00 0.00 0.00 53.44 54.33 2ecg n ALA 53 Cb 0.17 -0.70 0.04 0.00 0.00 0.00 0.00 19.45 18.96 2ecg n ALA 53 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2ecg h GLU 54 N 0.00 0.89 -0.06 0.00 5.08 -1.47 -2.93 114.58 116.09 2ecg h GLU 54 Ca 0.53 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 2ecg h GLU 54 Cb 1.01 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 2ecg h GLU 54 CO -0.93 0.65 0.04 0.00 -1.00 0.00 0.00 179.01 177.78 2ecg h ALA 55 N 1.19 0.08 -2.51 3.43 0.00 0.11 -3.42 119.26 118.14 2ecg h ALA 55 Ca 0.23 -0.01 -0.53 0.00 0.00 0.00 0.00 54.91 54.60 2ecg h ALA 55 Cb 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.79 2ecg h ALA 55 CO -0.04 -0.43 0.80 0.14 0.00 0.00 0.00 179.25 179.72 2ecg s VAL 56 N -6.17 3.28 0.19 0.00 -7.23 -0.22 -4.91 120.40 105.33 2ecg s VAL 56 Ca -0.13 0.86 0.10 0.00 -1.81 0.00 0.00 61.98 61.00 2ecg s VAL 56 Cb 0.07 -3.55 -0.08 0.00 0.56 0.00 0.00 36.38 33.37 2ecg s VAL 56 CO 0.67 0.04 1.48 0.44 -0.31 0.00 0.00 175.10 177.43 2ecg h ASP 57 N 7.20 0.00 -5.00 4.85 3.32 -1.82 -3.46 116.42 121.51 2ecg h ASP 57 Ca -0.41 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.51 2ecg h ASP 57 Cb 1.20 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.55 2ecg h ASP 57 CO 0.89 0.75 -0.35 -1.59 -1.72 0.00 0.00 179.24 177.21 2ecg s LYS 58 N -3.23 0.62 -0.32 3.56 -2.85 -1.26 -2.54 119.74 113.72 2ecg s LYS 58 Ca -0.00 -0.32 -0.35 0.00 -1.00 0.00 0.00 55.97 54.30 2ecg s LYS 58 Cb 0.11 0.27 -0.15 0.00 -2.06 0.00 0.00 37.83 36.00 2ecg s LYS 58 CO 0.78 -0.17 1.16 0.00 0.10 0.00 0.00 175.35 177.22 2ecg n PRO 60 N 2.75 0.49 0.00 0.00 -0.04 -1.26 0.18 135.00 137.11 2ecg n PRO 60 Ca 0.22 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 2ecg n PRO 60 Cb -0.03 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 2ecg n PRO 60 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2ecg n MET 61 N -0.74 0.07 0.00 0.54 2.81 -1.26 -4.80 117.12 113.74 2ecg n MET 61 Ca 0.06 0.00 0.08 0.00 -1.81 0.00 0.00 57.70 56.02 2ecg n MET 61 Cb 0.03 -0.84 -0.03 0.00 -0.71 0.00 0.00 33.22 31.67 2ecg n MET 61 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2ecg n TYR 63 N -0.48 -1.46 -3.29 0.00 4.02 0.48 -4.88 117.16 111.55 2ecg n TYR 63 Ca 0.05 0.12 -0.44 0.00 -0.01 0.00 0.00 57.90 57.63 2ecg n TYR 63 Cb 0.30 -3.17 -0.07 0.00 -0.02 0.00 0.00 39.34 36.38 2ecg n TYR 63 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2ecg s THR 64 N -2.79 5.07 -0.06 -0.72 2.01 -1.25 -4.63 115.64 113.26 2ecg s THR 64 Ca 0.09 -0.72 -0.39 0.00 0.31 0.00 0.00 61.69 60.98 2ecg s THR 64 Cb -0.04 -4.17 -0.19 0.00 0.01 0.00 0.00 72.50 68.10 2ecg s THR 64 CO 0.11 -0.63 1.10 0.52 -0.69 0.00 0.00 174.62 175.02 2ecg n VAL 65 N 5.40 0.00 -2.36 3.82 0.31 -1.26 -2.09 118.33 122.15 2ecg n VAL 65 Ca -0.09 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.86 2ecg n VAL 65 Cb 0.45 -0.06 -0.03 0.00 -0.91 0.00 0.00 33.84 33.28 2ecg n VAL 65 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2ecg s ILE 66 N 0.39 3.64 -2.00 2.52 1.09 -1.05 -4.79 121.20 121.00 2ecg s ILE 66 Ca 0.89 -0.05 0.13 0.00 -1.10 0.00 0.00 60.65 60.52 2ecg s ILE 66 Cb -1.25 -4.59 0.37 0.00 -1.06 0.00 0.00 42.46 35.93 2ecg s ILE 66 CO 0.58 -1.52 1.31 1.07 -0.10 0.00 0.00 174.94 176.28 2ecg n THR 67 N 6.93 0.55 -3.62 2.92 5.66 -1.25 -4.81 114.28 120.66 2ecg n THR 67 Ca 0.20 -0.55 -0.04 0.00 -3.05 0.00 0.00 64.05 60.61 2ecg n THR 67 Cb 0.50 0.28 -0.06 0.00 -1.55 0.00 0.00 70.33 69.50 2ecg n THR 67 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 2ecg s PHE 68 N -1.45 -0.96 -1.00 1.09 5.36 -1.26 -5.03 117.98 114.74 2ecg s PHE 68 Ca 0.28 1.83 -0.07 0.00 -0.96 0.00 0.00 56.93 58.01 2ecg s PHE 68 Cb 0.14 0.57 0.25 0.00 -0.34 0.00 0.00 43.02 43.65 2ecg s PHE 68 CO 0.19 -0.48 0.95 0.15 -1.46 0.00 0.00 175.22 174.58 2ecg s LYS 69 N 1.90 3.80 0.45 10.12 3.01 -1.26 -4.04 119.74 133.72 2ecg s LYS 69 Ca -0.08 -3.15 -0.23 0.00 -1.01 0.00 0.00 55.97 51.50 2ecg s LYS 69 Cb -0.06 -4.33 -0.08 0.00 -1.01 0.00 0.00 37.83 32.35 2ecg s LYS 69 CO -0.18 -1.25 1.13 -1.14 0.51 0.00 0.00 175.35 174.42 2ecg s GLN 70 N -1.12 3.83 -0.26 1.68 2.00 -1.26 -4.97 119.66 119.57 2ecg s GLN 70 Ca 0.28 1.69 -0.04 0.00 -2.00 0.00 0.00 55.36 55.29 2ecg s GLN 70 Cb -0.10 -2.40 0.01 0.00 0.80 0.00 0.00 33.01 31.32 2ecg s GLN 70 CO -0.09 -0.47 -0.00 0.15 -0.50 0.00 0.00 175.29 174.38 2ecg s LYS 71 N -2.71 3.11 0.42 1.67 1.02 -1.26 -3.27 119.74 118.72 2ecg s LYS 71 Ca 0.63 -0.82 0.07 0.00 0.02 0.00 0.00 55.97 55.88 2ecg s LYS 71 Cb -0.26 -3.14 -0.03 0.00 -0.52 0.00 0.00 37.83 33.88 2ecg s LYS 71 CO 0.32 -0.35 0.32 0.96 -0.92 0.00 0.00 175.35 175.68 2ecg s ILE 72 N 1.44 2.51 -0.43 2.17 -5.25 -1.14 -5.04 121.20 115.45 2ecg s ILE 72 Ca 0.03 -1.45 0.02 0.00 -0.99 0.00 0.00 60.65 58.26 2ecg s ILE 72 Cb -0.16 -2.96 0.15 0.00 2.95 0.00 0.00 42.46 42.44 2ecg s ILE 72 CO -0.01 0.00 0.28 -0.36 -1.79 0.00 0.00 174.94 173.06 2ecg s PHE 73 N -2.53 1.47 -0.19 1.37 0.40 -1.26 -4.76 117.98 112.49 2ecg s PHE 73 Ca 0.45 -2.23 -0.23 0.00 -0.60 0.00 0.00 56.93 54.33 2ecg s PHE 73 Cb -0.01 -1.38 -0.21 0.00 0.51 0.00 0.00 43.02 41.93 2ecg s PHE 73 CO 0.26 -0.79 0.37 0.52 0.70 0.00 0.00 175.22 176.28 2ecg h MET 74 N 6.38 0.01 0.00 0.44 2.86 -1.95 -3.54 114.93 119.14 2ecg h MET 74 Ca 0.11 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2ecg h MET 74 Cb 0.92 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.59 2ecg h MET 74 CO 0.40 1.01 0.00 0.45 1.06 0.00 0.00 176.91 179.83