#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ecg s SER 2 N 0.00 -0.28 0.00 1.61 0.15 -1.26 -5.08 113.70 108.84 2ecg s SER 2 Ca 0.00 -0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.65 2ecg s SER 2 Cb 0.00 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 2ecg s SER 2 CO 0.00 -0.48 0.00 -0.24 1.20 0.00 0.00 173.24 173.72 2ecg n SER 3 N -0.19 1.70 -0.81 5.45 2.88 -1.26 -5.16 113.62 116.23 2ecg n SER 3 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 2ecg n SER 3 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 2ecg n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ecg n GLY 4 N 2.74 -3.65 3.08 0.46 0.00 -1.26 -5.04 105.19 101.50 2ecg n GLY 4 Ca 0.00 -1.00 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 2ecg n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ecg s SER 5 N -3.45 -0.23 0.31 1.61 0.15 -1.26 -5.16 113.70 105.67 2ecg s SER 5 Ca 0.00 0.58 -0.14 0.00 0.70 0.00 0.00 55.95 57.09 2ecg s SER 5 Cb 0.00 0.49 0.02 0.00 -1.71 0.00 0.00 66.02 64.82 2ecg s SER 5 CO 0.00 -0.18 0.63 -0.44 1.20 0.00 0.00 173.24 174.45 2ecg s SER 6 N 1.41 0.06 0.00 5.45 0.01 -1.26 -5.18 113.70 114.19 2ecg s SER 6 Ca -0.08 -1.00 0.00 0.00 1.31 0.00 0.00 55.95 56.18 2ecg s SER 6 Cb -0.10 0.71 0.00 0.00 0.21 0.00 0.00 66.02 66.84 2ecg s SER 6 CO -0.09 -1.38 0.00 0.61 0.41 0.00 0.00 173.24 172.79 2ecg n GLY 7 N -0.47 4.15 3.96 3.44 0.00 -1.26 -5.15 105.19 109.86 2ecg n GLY 7 Ca -0.04 -1.39 -0.20 0.00 0.00 0.00 0.00 46.02 44.39 2ecg n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ecg s SER 8 N 0.00 5.20 -0.67 1.61 0.15 -1.26 -5.02 113.70 113.70 2ecg s SER 8 Ca 0.00 -0.74 -0.02 0.00 0.70 0.00 0.00 55.95 55.89 2ecg s SER 8 Cb 0.00 -0.25 0.36 0.00 -1.71 0.00 0.00 66.02 64.42 2ecg s SER 8 CO 0.00 -0.92 2.09 0.18 1.20 0.00 0.00 173.24 175.79 2ecg n LEU 9 N -1.84 7.43 -3.90 3.45 4.77 -1.26 -4.79 117.00 120.87 2ecg n LEU 9 Ca 0.07 -4.33 -0.29 0.00 -0.03 0.00 0.00 56.01 51.43 2ecg n LEU 9 Cb 0.61 -1.04 -0.13 0.00 -2.33 0.00 0.00 43.42 40.53 2ecg n LEU 9 CO 0.40 1.55 -0.14 -1.10 -1.33 0.00 0.00 177.39 176.77 2ecg s GLN 10 N -3.53 2.04 -0.13 3.23 -0.21 -1.26 -5.04 119.66 114.75 2ecg s GLN 10 Ca 0.57 -2.79 -0.04 0.00 0.02 0.00 0.00 55.36 53.12 2ecg s GLN 10 Cb 0.45 -3.20 0.06 0.00 1.00 0.00 0.00 33.01 31.32 2ecg s GLN 10 CO -0.15 -1.18 0.15 -1.59 -2.12 0.00 0.00 175.29 170.39 2ecg s LYS 11 N -0.60 0.07 0.04 2.91 -2.85 -1.26 -5.14 119.74 112.90 2ecg s LYS 11 Ca 0.20 0.27 0.04 0.00 -1.00 0.00 0.00 55.97 55.48 2ecg s LYS 11 Cb -0.18 -0.98 -0.02 0.00 -2.06 0.00 0.00 37.83 34.59 2ecg s LYS 11 CO -0.06 -0.50 -0.12 -2.00 0.10 0.00 0.00 175.35 172.76 2ecg s GLU 12 N 2.25 0.82 0.62 1.78 2.12 -1.26 -5.15 118.70 119.88 2ecg s GLU 12 Ca 0.04 -0.72 -0.14 0.00 0.36 0.00 0.00 54.97 54.51 2ecg s GLU 12 Cb -0.14 -0.78 -0.02 0.00 0.26 0.00 0.00 34.13 33.44 2ecg s GLU 12 CO -0.08 0.19 1.06 0.42 -0.54 0.00 0.00 175.26 176.31 2ecg s ILE 13 N -0.90 3.88 0.23 -3.70 1.01 -1.26 -5.05 121.20 115.41 2ecg s ILE 13 Ca -0.00 0.80 -0.07 0.00 0.00 0.00 0.00 60.65 61.38 2ecg s ILE 13 Cb -0.08 -3.39 -0.06 0.00 0.01 0.00 0.00 42.46 38.95 2ecg s ILE 13 CO 0.01 -0.61 0.51 -0.55 0.00 0.00 0.00 174.94 174.30 2ecg s SER 14 N -3.08 6.53 0.49 3.58 0.15 -1.26 -4.92 113.70 115.19 2ecg s SER 14 Ca 0.62 0.77 0.24 0.00 0.70 0.00 0.00 55.95 58.28 2ecg s SER 14 Cb -0.15 -2.16 1.29 0.00 -1.71 0.00 0.00 66.02 63.28 2ecg s SER 14 CO 0.42 -0.09 1.91 0.00 1.20 0.00 0.00 173.24 176.69 2ecg h THR 15 N 1.78 0.67 0.40 6.45 1.03 -1.98 -0.02 112.91 121.24 2ecg h THR 15 Ca -0.47 -0.06 -0.02 0.00 -0.01 0.00 0.00 66.41 65.86 2ecg h THR 15 Cb 1.18 0.49 -0.00 0.00 -1.07 0.00 0.00 68.15 68.74 2ecg h THR 15 CO 0.69 0.03 -0.22 -0.33 -0.01 0.00 0.00 175.52 175.68 2ecg h GLU 16 N 0.17 -0.57 0.18 0.00 4.39 -1.99 -0.75 114.58 116.01 2ecg h GLU 16 Ca 0.38 0.04 -0.01 0.00 0.34 0.00 0.00 59.36 60.11 2ecg h GLU 16 Cb 1.26 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 2ecg h GLU 16 CO -0.07 -0.38 -0.08 1.49 -1.16 0.00 0.00 179.01 178.81 2ecg h GLU 17 N -0.59 -0.23 -0.22 2.33 4.22 -1.70 -2.49 114.58 115.91 2ecg h GLU 17 Ca -0.05 0.02 0.03 0.00 0.08 0.00 0.00 59.36 59.43 2ecg h GLU 17 Cb 0.47 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 2ecg h GLU 17 CO 0.06 0.17 -0.33 1.96 -2.18 0.00 0.00 179.01 178.69 2ecg h GLN 18 N -0.71 -0.24 -0.71 1.92 4.20 -1.07 -1.11 115.11 117.39 2ecg h GLN 18 Ca -0.02 0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.85 2ecg h GLN 18 Cb 0.50 0.06 -0.10 0.00 0.30 0.00 0.00 27.48 28.23 2ecg h GLN 18 CO 0.04 -0.16 0.20 -0.07 -0.67 0.00 0.00 178.83 178.17 2ecg h LEU 19 N -0.25 0.08 -0.73 1.46 4.07 -1.24 0.47 115.31 119.18 2ecg h LEU 19 Ca 0.04 0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.13 2ecg h LEU 19 Cb 0.36 0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.25 2ecg h LEU 19 CO -0.34 0.01 0.28 0.54 -1.08 0.00 0.00 178.44 177.86 2ecg n ARG 20 N -5.11 0.08 -0.11 1.13 5.12 -0.45 0.22 116.66 117.54 2ecg n ARG 20 Ca 0.13 0.52 -0.23 0.00 -1.93 0.00 0.00 57.85 56.34 2ecg n ARG 20 Cb 0.41 -2.03 -0.11 0.00 -1.16 0.00 0.00 32.46 29.58 2ecg n ARG 20 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2ecg n ARG 21 N -1.93 0.57 -0.08 5.56 1.74 0.16 -3.96 116.66 118.72 2ecg n ARG 21 Ca -0.01 0.49 -0.21 0.00 -0.77 0.00 0.00 57.85 57.36 2ecg n ARG 21 Cb 0.30 -1.68 -0.12 0.00 -1.02 0.00 0.00 32.46 29.94 2ecg n ARG 21 CO 0.00 0.00 0.00 1.37 -1.52 0.00 0.00 177.63 177.48 2ecg h LEU 22 N -1.00 0.08 -2.04 0.55 -0.00 -0.93 -3.36 115.31 108.62 2ecg h LEU 22 Ca -0.42 -0.65 0.12 0.00 -0.00 0.00 0.00 57.88 56.93 2ecg h LEU 22 Cb 1.35 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.97 2ecg h LEU 22 CO -0.26 1.47 0.34 1.56 -0.00 0.00 0.00 178.44 181.55 2ecg h GLN 23 N -0.83 0.00 -0.00 0.17 4.20 0.25 0.52 115.11 119.41 2ecg h GLN 23 Ca -0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.41 2ecg h GLN 23 Cb 1.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.15 2ecg h GLN 23 CO -0.13 0.00 0.00 -0.85 -0.67 0.00 0.00 178.83 177.18 2ecg n GLU 24 N -4.17 1.01 0.00 1.46 0.28 -1.18 -2.80 120.64 115.24 2ecg n GLU 24 Ca 0.07 -0.02 0.02 0.00 -0.16 0.00 0.00 57.16 57.07 2ecg n GLU 24 Cb 0.53 -1.12 -0.02 0.00 1.43 0.00 0.00 31.44 32.26 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 -0.60 4.93 -0.10 3.44 1.02 0.18 -4.76 120.64 124.76 2ecg n GLU 25 Ca 0.06 -0.07 -0.15 0.00 -0.02 0.00 0.00 57.16 56.98 2ecg n GLU 25 Cb 0.03 -0.76 -0.05 0.00 -0.02 0.00 0.00 31.44 30.64 2ecg n GLU 25 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2ecg n LYS 26 N -0.99 0.50 -0.41 3.49 5.02 -1.12 -5.02 118.16 119.63 2ecg n LYS 26 Ca 0.01 0.21 -0.11 0.00 -2.02 0.00 0.00 58.31 56.40 2ecg n LYS 26 Cb 0.08 -1.37 0.11 0.00 -0.02 0.00 0.00 35.03 33.83 2ecg n LYS 26 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 2ecg n LEU 27 N -4.30 0.00 -4.07 -0.35 -0.00 -1.16 -4.77 117.00 102.36 2ecg n LEU 27 Ca -0.26 -0.32 -0.37 0.00 -0.00 0.00 0.00 56.01 55.06 2ecg n LEU 27 Cb 0.61 -0.59 0.07 0.00 -0.00 0.00 0.00 43.42 43.51 2ecg n LEU 27 CO 0.13 -2.17 -1.68 0.00 -0.00 0.00 0.00 177.39 173.68 2ecg n LYS 29 N 1.36 2.07 0.07 0.00 5.02 -1.20 -4.47 118.16 121.01 2ecg n LYS 29 Ca -0.01 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.25 2ecg n LYS 29 Cb 0.71 -0.77 -0.02 0.00 -0.02 0.00 0.00 35.03 34.93 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 0.16 -0.18 5.03 -1.93 -3.40 117.51 117.19 2ecg h ILE 30 Ca 0.00 -0.34 -0.32 0.00 -0.12 0.00 0.00 64.86 64.08 2ecg h ILE 30 Cb 0.55 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.34 2ecg h ILE 30 CO 0.00 0.00 -1.64 0.00 -0.68 0.00 0.00 178.15 175.83 2ecg n MET 32 N -3.72 -7.01 -0.01 0.00 2.81 -1.26 -4.92 117.12 103.01 2ecg n MET 32 Ca -0.25 0.83 -0.02 0.00 -1.81 0.00 0.00 57.70 56.45 2ecg n MET 32 Cb 1.01 -5.82 -0.01 0.00 -0.71 0.00 0.00 33.22 27.68 2ecg n MET 32 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2ecg n ASP 33 N -3.04 3.31 -3.23 7.83 8.00 -1.26 -5.01 116.55 123.14 2ecg n ASP 33 Ca -0.18 -0.01 -0.12 0.00 0.71 0.00 0.00 54.79 55.19 2ecg n ASP 33 Cb 0.63 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.68 2ecg n ASP 33 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2ecg n ARG 34 N -2.65 1.20 -3.66 -1.24 0.00 -1.26 -5.09 116.66 103.96 2ecg n ARG 34 Ca -0.04 -1.54 -0.37 0.00 -0.00 0.00 0.00 57.85 55.90 2ecg n ARG 34 Cb 0.54 0.22 -0.11 0.00 -0.00 0.00 0.00 32.46 33.11 2ecg n ARG 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2ecg s ASN 35 N -2.38 5.82 -0.19 2.89 4.22 -1.26 -3.65 114.94 120.38 2ecg s ASN 35 Ca 0.11 -0.03 -0.39 0.00 -2.14 0.00 0.00 52.86 50.42 2ecg s ASN 35 Cb -0.01 -2.06 -0.15 0.00 1.28 0.00 0.00 41.25 40.31 2ecg s ASN 35 CO 0.07 -0.01 1.72 2.30 -2.04 0.00 0.00 177.10 179.13 2ecg n ILE 36 N 4.81 0.31 -2.12 0.54 -6.64 -1.26 -4.76 119.36 110.23 2ecg n ILE 36 Ca -0.15 -0.06 0.04 0.00 -1.77 0.00 0.00 62.75 60.82 2ecg n ILE 36 Cb 0.52 -1.30 0.06 0.00 -1.44 0.00 0.00 39.64 37.48 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 5.20 2.50 -3.01 -1.28 0.00 -1.26 -4.89 120.51 117.77 2ecg n ALA 37 Ca 0.25 -2.24 -0.11 0.00 0.00 0.00 0.00 53.44 51.34 2ecg n ALA 37 Cb 0.17 -0.59 -0.09 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.79 0.09 0.41 0.00 -1.09 -1.25 -2.10 121.20 116.47 2ecg s ILE 38 Ca 0.27 -0.73 0.04 0.00 -2.23 0.00 0.00 60.65 58.00 2ecg s ILE 38 Cb 0.29 -0.76 -0.02 0.00 -1.58 0.00 0.00 42.46 40.39 2ecg s ILE 38 CO -0.10 -0.40 0.14 0.68 -1.23 0.00 0.00 174.94 174.03 2ecg s VAL 39 N -2.07 0.54 0.54 2.92 -7.23 -0.81 -4.07 120.40 110.22 2ecg s VAL 39 Ca -0.09 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.14 2ecg s VAL 39 Cb -0.03 -2.32 0.04 0.00 0.56 0.00 0.00 36.38 34.63 2ecg s VAL 39 CO -0.01 0.00 0.42 -0.36 -0.31 0.00 0.00 175.10 174.84 2ecg s PHE 40 N -3.20 1.65 -0.11 2.82 0.08 -1.24 -3.88 117.98 114.10 2ecg s PHE 40 Ca 0.23 -0.83 -0.09 0.00 0.12 0.00 0.00 56.93 56.36 2ecg s PHE 40 Cb 0.02 -1.93 0.03 0.00 -0.57 0.00 0.00 43.02 40.57 2ecg s PHE 40 CO 0.15 -0.49 0.29 0.08 -0.10 0.00 0.00 175.22 175.15 2ecg s VAL 41 N -2.76 -0.01 -0.02 -0.44 1.01 -1.26 -3.84 120.40 113.08 2ecg s VAL 41 Ca 0.36 0.02 -0.26 0.00 0.00 0.00 0.00 61.98 62.10 2ecg s VAL 41 Cb -0.02 -0.42 -0.20 0.00 0.00 0.00 0.00 36.38 35.73 2ecg s VAL 41 CO 0.22 0.01 1.26 1.55 0.00 0.00 0.00 175.10 178.14 2ecg h PRO 42 N 5.96 -0.01 -6.01 2.72 0.13 -1.93 -3.31 132.00 129.56 2ecg h PRO 42 Ca -0.29 0.00 -0.81 0.00 -0.87 0.00 0.00 66.00 64.04 2ecg h PRO 42 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2ecg h PRO 42 CO 0.33 0.48 1.05 0.00 -0.23 0.00 0.00 178.00 179.62 2ecg s GLY 44 N 4.72 1.52 -0.30 0.00 0.00 -1.25 -3.69 107.32 108.32 2ecg s GLY 44 Ca 1.12 -1.84 -0.01 0.00 0.00 0.00 0.00 44.72 44.00 2ecg s GLY 44 CO 0.72 1.88 0.08 0.30 0.00 0.00 0.00 173.10 176.07 2ecg s HIS 45 N 3.56 1.85 -0.11 1.90 3.76 -1.26 -4.86 115.29 120.12 2ecg s HIS 45 Ca 0.20 -1.76 -0.05 0.00 -0.15 0.00 0.00 55.06 53.29 2ecg s HIS 45 Cb -0.18 -1.74 -0.18 0.00 1.11 0.00 0.00 32.58 31.58 2ecg s HIS 45 CO 0.11 -0.86 3.38 1.47 -0.85 0.00 0.00 174.74 177.99 2ecg n LEU 46 N 4.81 5.54 -0.97 0.89 -0.00 -1.26 -3.99 117.00 122.03 2ecg n LEU 46 Ca -0.03 -3.37 0.10 0.00 -0.00 0.00 0.00 56.01 52.71 2ecg n LEU 46 Cb 0.43 -1.37 0.26 0.00 -0.00 0.00 0.00 43.42 42.74 2ecg n LEU 46 CO 0.13 1.69 0.72 1.33 -0.00 0.00 0.00 177.39 181.25 2ecg n VAL 47 N 2.08 0.58 -4.17 1.47 0.24 -1.26 -4.80 118.33 112.47 2ecg n VAL 47 Ca 0.43 -0.67 -0.16 0.00 -2.04 0.00 0.00 64.34 61.90 2ecg n VAL 47 Cb 0.82 0.52 -0.12 0.00 -1.47 0.00 0.00 33.84 33.58 2ecg n VAL 47 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2ecg s THR 48 N -1.42 0.76 0.37 3.34 -4.23 -1.26 -3.21 115.64 109.99 2ecg s THR 48 Ca 0.37 -0.97 -0.03 0.00 -1.18 0.00 0.00 61.69 59.88 2ecg s THR 48 Cb 0.20 -0.75 -0.04 0.00 1.34 0.00 0.00 72.50 73.25 2ecg s THR 48 CO 0.27 -0.19 0.62 0.00 -0.54 0.00 0.00 174.62 174.79 2ecg n LYS 50 N -1.71 -0.06 0.44 0.00 4.81 -1.26 0.11 118.16 120.48 2ecg n LYS 50 Ca -0.02 1.05 -0.17 0.00 -0.87 0.00 0.00 58.31 58.29 2ecg n LYS 50 Cb 0.55 -1.62 -0.08 0.00 0.02 0.00 0.00 35.03 33.90 2ecg n LYS 50 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2ecg h GLN 51 N 0.00 -1.08 0.82 1.64 4.20 -1.99 -2.71 115.11 116.00 2ecg h GLN 51 Ca 0.38 0.07 -0.04 0.00 0.06 0.00 0.00 58.65 59.12 2ecg h GLN 51 Cb 0.70 0.24 0.01 0.00 0.30 0.00 0.00 27.48 28.73 2ecg h GLN 51 CO -0.67 -0.72 -0.40 0.00 -0.67 0.00 0.00 178.83 176.37 2ecg n ALA 53 N -2.56 1.02 0.02 0.00 0.00 0.30 0.21 120.51 119.50 2ecg n ALA 53 Ca -0.14 0.73 -0.19 0.00 0.00 0.00 0.00 53.44 53.85 2ecg n ALA 53 Cb 0.44 -0.84 -0.12 0.00 0.00 0.00 0.00 19.45 18.93 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 0.43 -0.28 0.00 4.39 -1.13 -3.32 114.58 114.67 2ecg h GLU 54 Ca 0.70 -0.51 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 2ecg h GLU 54 Cb 2.14 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 30.94 2ecg h GLU 54 CO -0.44 1.17 0.10 0.00 -1.16 0.00 0.00 179.01 178.68 2ecg h ALA 55 N 0.28 0.36 -2.32 3.43 0.00 0.34 -3.42 119.26 117.93 2ecg h ALA 55 Ca -0.10 -0.14 -0.54 0.00 0.00 0.00 0.00 54.91 54.13 2ecg h ALA 55 Cb 1.45 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 19.16 2ecg h ALA 55 CO 0.14 -0.02 1.25 1.33 0.00 0.00 0.00 179.25 181.96 2ecg n VAL 56 N -4.73 0.74 0.25 0.00 0.24 0.85 -4.85 118.33 110.82 2ecg n VAL 56 Ca -0.02 -0.16 0.15 0.00 -2.04 0.00 0.00 64.34 62.26 2ecg n VAL 56 Cb 0.15 -2.33 0.45 0.00 -1.47 0.00 0.00 33.84 30.64 2ecg n VAL 56 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 2ecg h ASP 57 N 10.91 0.00 -4.41 -1.34 2.03 -1.87 -3.45 116.42 118.29 2ecg h ASP 57 Ca -0.49 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 55.76 2ecg h ASP 57 Cb 1.24 0.00 -0.20 0.00 -0.83 0.00 0.00 39.33 39.54 2ecg h ASP 57 CO 0.94 0.02 0.16 -1.59 -1.03 0.00 0.00 179.24 177.74 2ecg s LYS 58 N -3.46 0.93 -0.35 4.15 -2.85 -1.26 -1.88 119.74 115.01 2ecg s LYS 58 Ca 0.04 0.69 -0.32 0.00 -1.00 0.00 0.00 55.97 55.38 2ecg s LYS 58 Cb 0.07 0.45 -0.14 0.00 -2.06 0.00 0.00 37.83 36.15 2ecg s LYS 58 CO 0.60 -0.19 1.24 0.00 0.10 0.00 0.00 175.35 177.10 2ecg n PRO 60 N 3.60 0.48 0.00 0.00 -0.04 -1.26 0.17 135.00 137.96 2ecg n PRO 60 Ca 0.27 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 2ecg n PRO 60 Cb -0.04 -1.05 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 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 -0.55 0.44 0.00 0.54 2.81 -1.26 -4.80 117.12 114.30 2ecg n MET 61 Ca 0.01 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.96 2ecg n MET 61 Cb 0.00 -0.82 -0.01 0.00 -0.71 0.00 0.00 33.22 31.68 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 -0.30 -2.20 -3.58 0.00 4.02 0.45 -4.92 117.16 110.62 2ecg n TYR 63 Ca 0.05 0.86 -0.41 0.00 -0.01 0.00 0.00 57.90 58.40 2ecg n TYR 63 Cb 0.26 -3.79 -0.11 0.00 -0.02 0.00 0.00 39.34 35.69 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 -3.27 4.60 0.13 -0.72 2.01 -1.25 -4.76 115.64 112.38 2ecg s THR 64 Ca 0.66 -0.92 -0.24 0.00 0.31 0.00 0.00 61.69 61.50 2ecg s THR 64 Cb -0.34 -3.60 -0.14 0.00 0.01 0.00 0.00 72.50 68.43 2ecg s THR 64 CO 0.82 -0.29 0.49 0.52 -0.69 0.00 0.00 174.62 175.47 2ecg n VAL 65 N 5.01 1.25 -2.43 3.82 0.31 -1.26 -2.14 118.33 122.89 2ecg n VAL 65 Ca -0.12 -0.31 -0.38 0.00 -0.01 0.00 0.00 64.34 63.52 2ecg n VAL 65 Cb 0.46 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.35 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 -0.63 3.75 -2.29 2.52 -1.09 -0.79 -4.77 121.20 117.91 2ecg s ILE 66 Ca 0.54 -0.37 0.24 0.00 -2.23 0.00 0.00 60.65 58.83 2ecg s ILE 66 Cb -0.78 -4.76 0.54 0.00 -1.58 0.00 0.00 42.46 35.88 2ecg s ILE 66 CO 0.44 -1.67 1.70 1.07 -1.23 0.00 0.00 174.94 175.24 2ecg n THR 67 N 6.98 0.10 -3.58 2.92 5.66 -1.25 -4.91 114.28 120.20 2ecg n THR 67 Ca 0.27 -0.24 -0.07 0.00 -3.05 0.00 0.00 64.05 60.96 2ecg n THR 67 Cb 0.50 0.25 -0.02 0.00 -1.55 0.00 0.00 70.33 69.51 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 -1.90 -0.30 -0.48 1.09 5.36 -1.26 -5.01 117.98 115.48 2ecg s PHE 68 Ca 0.35 0.10 0.04 0.00 -0.96 0.00 0.00 56.93 56.46 2ecg s PHE 68 Cb 0.18 0.57 0.18 0.00 -0.34 0.00 0.00 43.02 43.61 2ecg s PHE 68 CO 0.29 -0.66 0.39 1.63 -1.46 0.00 0.00 175.22 175.41 2ecg n LYS 69 N -0.33 0.64 -2.54 10.12 4.01 -1.26 -4.31 118.16 124.49 2ecg n LYS 69 Ca -0.09 -3.51 -0.42 0.00 -0.51 0.00 0.00 58.31 53.79 2ecg n LYS 69 Cb 0.62 -1.80 -0.03 0.00 -0.51 0.00 0.00 35.03 33.30 2ecg n LYS 69 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 2ecg s GLN 70 N -0.41 4.52 -0.13 1.97 -0.44 -1.25 -4.94 119.66 118.97 2ecg s GLN 70 Ca 0.31 1.65 -0.14 0.00 -2.50 0.00 0.00 55.36 54.68 2ecg s GLN 70 Cb 0.03 -3.36 -0.05 0.00 -1.64 0.00 0.00 33.01 27.99 2ecg s GLN 70 CO -0.18 -0.10 0.32 0.21 0.50 0.00 0.00 175.29 176.03 2ecg s LYS 71 N 0.68 4.17 0.32 1.67 2.20 -1.26 -1.92 119.74 125.59 2ecg s LYS 71 Ca 0.54 0.17 0.07 0.00 -0.36 0.00 0.00 55.97 56.39 2ecg s LYS 71 Cb -0.27 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.64 2ecg s LYS 71 CO 0.30 0.33 0.30 0.96 -0.36 0.00 0.00 175.35 176.87 2ecg s ILE 72 N 0.18 3.79 -0.25 5.43 -4.36 -0.89 -4.99 121.20 120.10 2ecg s ILE 72 Ca 0.19 -1.32 0.15 0.00 -0.26 0.00 0.00 60.65 59.40 2ecg s ILE 72 Cb -0.14 -3.26 0.47 0.00 1.25 0.00 0.00 42.46 40.78 2ecg s ILE 72 CO 0.06 -0.21 1.16 0.49 0.24 0.00 0.00 174.94 176.68 2ecg n PHE 73 N -1.37 1.71 -0.28 1.37 3.72 -1.26 -4.79 117.46 116.56 2ecg n PHE 73 Ca -0.03 -2.00 -0.07 0.00 -0.05 0.00 0.00 57.45 55.30 2ecg n PHE 73 Cb 0.59 -0.27 -0.06 0.00 -0.94 0.00 0.00 39.48 38.79 2ecg n PHE 73 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 2ecg n MET 74 N -0.61 -0.29 0.00 -1.08 2.81 -1.26 -5.21 117.12 111.48 2ecg n MET 74 Ca 0.24 1.00 0.00 0.00 -1.81 0.00 0.00 57.70 57.13 2ecg n MET 74 Cb 0.89 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.93 2ecg n MET 74 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91