#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 1.18 -3.63 1.61 3.41 -1.26 -5.15 113.62 109.78 2ecg n SER 2 Ca 0.00 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 2ecg n SER 2 Cb 0.00 -0.44 0.01 0.00 -0.26 0.00 0.00 64.21 63.52 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 -5.71 -0.01 0.00 4.04 1.04 -1.26 -5.18 113.70 106.63 2ecg s SER 3 Ca -0.09 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 55.97 2ecg s SER 3 Cb 0.01 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.42 2ecg s SER 3 CO 0.14 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2ecg n GLY 4 N -0.77 1.07 3.55 7.32 0.00 -1.26 -5.15 105.19 109.95 2ecg n GLY 4 Ca -0.00 -1.86 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 2ecg n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ecg s SER 5 N -1.00 -0.47 0.24 1.61 1.04 -1.26 -5.18 113.70 108.68 2ecg s SER 5 Ca 0.00 0.45 0.09 0.00 0.48 0.00 0.00 55.95 56.97 2ecg s SER 5 Cb 0.00 0.40 -0.05 0.00 0.10 0.00 0.00 66.02 66.47 2ecg s SER 5 CO 0.00 -0.48 -0.16 -0.55 0.98 0.00 0.00 173.24 173.03 2ecg s SER 6 N -1.34 3.04 -0.35 7.02 0.15 -1.26 -5.08 113.70 115.88 2ecg s SER 6 Ca -0.04 -1.04 0.15 0.00 0.70 0.00 0.00 55.95 55.72 2ecg s SER 6 Cb -0.00 -0.21 0.43 0.00 -1.71 0.00 0.00 66.02 64.52 2ecg s SER 6 CO 0.03 -0.10 1.03 0.61 1.20 0.00 0.00 173.24 176.02 2ecg n GLY 7 N -0.50 1.64 2.73 9.45 0.00 -1.26 -5.06 105.19 112.19 2ecg n GLY 7 Ca -0.07 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.68 2ecg n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ecg s SER 8 N -2.51 3.24 -0.41 1.61 0.01 -1.26 -5.00 113.70 109.37 2ecg s SER 8 Ca 0.27 -1.04 0.04 0.00 1.31 0.00 0.00 55.95 56.53 2ecg s SER 8 Cb 0.43 -0.66 0.45 0.00 0.21 0.00 0.00 66.02 66.45 2ecg s SER 8 CO -0.01 -0.33 1.43 0.18 0.41 0.00 0.00 173.24 174.91 2ecg n LEU 9 N 5.00 5.70 -4.56 2.44 4.32 -1.26 -4.95 117.00 123.70 2ecg n LEU 9 Ca -0.07 -4.67 -0.43 0.00 -0.02 0.00 0.00 56.01 50.82 2ecg n LEU 9 Cb 0.46 -0.53 -0.01 0.00 -1.62 0.00 0.00 43.42 41.71 2ecg n LEU 9 CO 0.12 1.95 1.73 -1.10 -1.22 0.00 0.00 177.39 178.87 2ecg s GLN 10 N -3.67 3.87 -0.33 3.23 -0.21 -1.26 -4.90 119.66 116.40 2ecg s GLN 10 Ca 0.54 -1.79 0.01 0.00 0.02 0.00 0.00 55.36 54.14 2ecg s GLN 10 Cb 0.44 -5.41 0.10 0.00 1.00 0.00 0.00 33.01 29.13 2ecg s GLN 10 CO -0.00 -2.18 0.09 0.15 -2.12 0.00 0.00 175.29 171.23 2ecg s LYS 11 N 4.12 1.00 0.01 2.91 3.01 -1.26 -5.10 119.74 124.43 2ecg s LYS 11 Ca 0.50 -1.39 -0.06 0.00 -1.01 0.00 0.00 55.97 54.00 2ecg s LYS 11 Cb 0.02 -2.42 -0.00 0.00 -1.01 0.00 0.00 37.83 34.41 2ecg s LYS 11 CO 0.01 -0.98 0.11 -2.00 0.51 0.00 0.00 175.35 173.01 2ecg s GLU 12 N 1.31 0.50 0.32 1.68 2.12 -1.26 -5.16 118.70 118.21 2ecg s GLU 12 Ca 0.11 -0.51 -0.08 0.00 0.36 0.00 0.00 54.97 54.85 2ecg s GLU 12 Cb -0.18 0.20 -0.06 0.00 0.26 0.00 0.00 34.13 34.35 2ecg s GLU 12 CO -0.18 -0.12 0.63 0.42 -0.54 0.00 0.00 175.26 175.47 2ecg s ILE 13 N -1.71 4.92 0.12 -3.70 1.01 -1.26 -5.09 121.20 115.49 2ecg s ILE 13 Ca -0.12 0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.86 2ecg s ILE 13 Cb -0.06 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 2ecg s ILE 13 CO -0.00 -0.35 0.26 -0.55 0.00 0.00 0.00 174.94 174.30 2ecg s SER 14 N -3.03 6.35 0.43 3.58 0.15 -1.26 -4.93 113.70 114.99 2ecg s SER 14 Ca 0.47 0.22 0.22 0.00 0.70 0.00 0.00 55.95 57.56 2ecg s SER 14 Cb -0.11 -1.93 1.20 0.00 -1.71 0.00 0.00 66.02 63.47 2ecg s SER 14 CO 0.29 0.10 1.78 0.00 1.20 0.00 0.00 173.24 176.60 2ecg h THR 15 N 1.81 0.50 0.04 6.45 1.03 -1.98 0.02 112.91 120.78 2ecg h THR 15 Ca -0.47 -0.10 0.02 0.00 -0.01 0.00 0.00 66.41 65.85 2ecg h THR 15 Cb 1.18 0.17 -0.03 0.00 -1.07 0.00 0.00 68.15 68.40 2ecg h THR 15 CO 0.72 0.06 -0.18 -0.33 -0.01 0.00 0.00 175.52 175.77 2ecg h GLU 16 N 0.31 -0.30 0.31 0.00 5.08 -1.99 -0.29 114.58 117.69 2ecg h GLU 16 Ca 0.58 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.95 2ecg h GLU 16 Cb 1.65 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.98 2ecg h GLU 16 CO -0.24 -0.20 -0.15 1.49 -1.00 0.00 0.00 179.01 178.91 2ecg h GLU 17 N -0.32 -0.40 -0.51 2.33 4.22 -1.47 -2.68 114.58 115.76 2ecg h GLU 17 Ca 0.04 0.03 0.05 0.00 0.08 0.00 0.00 59.36 59.56 2ecg h GLU 17 Cb 0.37 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.63 2ecg h GLU 17 CO -0.14 -0.08 -0.44 1.96 -2.18 0.00 0.00 179.01 178.12 2ecg h GLN 18 N -0.96 -0.17 -0.70 1.92 4.20 -1.10 0.55 115.11 118.85 2ecg h GLN 18 Ca -0.04 0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.81 2ecg h GLN 18 Cb 0.50 0.04 -0.09 0.00 0.30 0.00 0.00 27.48 28.23 2ecg h GLN 18 CO 0.07 -0.12 0.22 -0.07 -0.67 0.00 0.00 178.83 178.27 2ecg h LEU 19 N -0.18 0.14 -1.09 1.46 4.07 -1.16 0.49 115.31 119.04 2ecg h LEU 19 Ca 0.08 0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2ecg h LEU 19 Cb 0.40 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.27 2ecg h LEU 19 CO -0.57 0.05 0.21 0.03 -1.08 0.00 0.00 178.44 177.07 2ecg h ARG 20 N 0.35 0.00 0.00 1.13 2.47 -0.54 1.34 114.38 119.13 2ecg h ARG 20 Ca 0.38 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.89 2ecg h ARG 20 Cb 0.59 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.88 2ecg h ARG 20 CO -0.42 0.00 -1.19 0.54 0.56 0.00 0.00 179.97 179.45 2ecg n ARG 21 N -2.14 0.55 -0.08 0.04 1.74 0.17 -3.88 116.66 113.05 2ecg n ARG 21 Ca -0.01 0.57 -0.15 0.00 -0.77 0.00 0.00 57.85 57.49 2ecg n ARG 21 Cb 0.24 -1.74 -0.10 0.00 -1.02 0.00 0.00 32.46 29.84 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 0.00 -0.61 0.55 -0.00 -1.01 -3.36 115.31 109.88 2ecg h LEU 22 Ca -0.32 -0.57 0.13 0.00 -0.00 0.00 0.00 57.88 57.12 2ecg h LEU 22 Cb 1.22 0.00 -0.11 0.00 -0.00 0.00 0.00 40.66 41.77 2ecg h LEU 22 CO -0.19 1.14 -0.05 1.56 -0.00 0.00 0.00 178.44 180.89 2ecg h GLN 23 N -1.00 0.07 -0.57 0.17 4.20 0.15 0.48 115.11 118.60 2ecg h GLN 23 Ca -0.15 -0.00 0.17 0.00 0.06 0.00 0.00 58.65 58.72 2ecg h GLN 23 Cb 0.98 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 2ecg h GLN 23 CO -0.09 0.04 0.56 1.05 -0.67 0.00 0.00 178.83 179.72 2ecg h GLU 24 N 0.07 0.00 -0.63 1.46 4.11 -1.66 0.89 114.58 118.82 2ecg h GLU 24 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.74 2ecg h GLU 24 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2ecg h GLU 24 CO -0.56 0.00 0.00 0.39 0.07 0.00 0.00 179.01 178.91 2ecg n GLU 25 N -3.79 1.95 0.06 1.06 1.02 0.17 -4.13 120.64 116.98 2ecg n GLU 25 Ca 0.11 -0.91 0.00 0.00 -0.02 0.00 0.00 57.16 56.34 2ecg n GLU 25 Cb 0.78 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 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 0.18 0.00 -0.23 3.49 5.02 0.31 -5.09 118.16 121.85 2ecg n LYS 26 Ca 0.08 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.13 2ecg n LYS 26 Cb 0.41 -0.43 0.24 0.00 -0.02 0.00 0.00 35.03 35.23 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 -3.42 0.00 -4.19 -0.35 -0.00 -1.07 -4.73 117.00 103.24 2ecg n LEU 27 Ca 0.00 -0.71 -0.35 0.00 -0.00 0.00 0.00 56.01 54.95 2ecg n LEU 27 Cb 0.06 -0.84 0.06 0.00 -0.00 0.00 0.00 43.42 42.70 2ecg n LEU 27 CO 0.00 -2.63 -0.78 0.00 -0.00 0.00 0.00 177.39 173.98 2ecg n LYS 29 N 0.89 3.31 0.22 0.00 -0.00 -0.86 -4.10 118.16 117.63 2ecg n LYS 29 Ca 0.03 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.20 2ecg n LYS 29 Cb 0.54 -0.95 -0.07 0.00 -0.00 0.00 0.00 35.03 34.54 2ecg n LYS 29 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 2ecg h ILE 30 N 0.00 0.42 0.02 0.58 5.03 -1.93 -3.38 117.51 118.24 2ecg h ILE 30 Ca 0.00 -0.52 -0.38 0.00 -0.12 0.00 0.00 64.86 63.84 2ecg h ILE 30 Cb 0.81 0.60 -0.06 0.00 -3.03 0.00 0.00 36.82 35.14 2ecg h ILE 30 CO 0.00 0.07 -2.37 0.00 -0.68 0.00 0.00 178.15 175.17 2ecg n MET 32 N -3.18 -7.33 -0.02 0.00 2.81 -1.26 -4.90 117.12 103.24 2ecg n MET 32 Ca -0.41 0.82 -0.04 0.00 -1.81 0.00 0.00 57.70 56.27 2ecg n MET 32 Cb 1.03 -5.84 -0.02 0.00 -0.71 0.00 0.00 33.22 27.68 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 -3.05 2.59 -4.79 7.83 2.03 -1.26 -5.01 116.55 114.88 2ecg n ASP 33 Ca -0.10 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 54.99 2ecg n ASP 33 Cb 0.60 -0.09 -0.05 0.00 -0.72 0.00 0.00 41.12 40.86 2ecg n ASP 33 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2ecg s ARG 34 N -2.08 2.50 -0.10 -0.67 0.52 -1.26 -5.08 118.95 112.77 2ecg s ARG 34 Ca -0.06 -1.49 -0.22 0.00 -0.52 0.00 0.00 55.73 53.44 2ecg s ARG 34 Cb 0.02 -2.29 -0.03 0.00 0.52 0.00 0.00 34.95 33.17 2ecg s ARG 34 CO 0.09 0.04 0.65 -0.80 0.02 0.00 0.00 175.30 175.30 2ecg s ASN 35 N -3.94 6.88 0.07 0.23 0.01 -1.26 -3.45 114.94 113.47 2ecg s ASN 35 Ca 0.41 1.06 -0.34 0.00 -0.71 0.00 0.00 52.86 53.27 2ecg s ASN 35 Cb -0.03 -2.38 -0.13 0.00 0.41 0.00 0.00 41.25 39.12 2ecg s ASN 35 CO 0.25 -0.13 1.67 2.30 -1.51 0.00 0.00 177.10 179.68 2ecg n ILE 36 N 3.95 0.20 -1.40 0.60 -6.64 -1.26 -4.63 119.36 110.18 2ecg n ILE 36 Ca -0.02 -0.04 0.02 0.00 -1.77 0.00 0.00 62.75 60.94 2ecg n ILE 36 Cb 0.51 -1.61 0.03 0.00 -1.44 0.00 0.00 39.64 37.12 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 4.49 1.82 -3.16 -1.28 0.00 -1.26 -4.91 120.51 116.20 2ecg n ALA 37 Ca 0.19 -1.20 -0.12 0.00 0.00 0.00 0.00 53.44 52.31 2ecg n ALA 37 Cb 0.28 -0.31 -0.09 0.00 0.00 0.00 0.00 19.45 19.33 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 -0.65 0.07 0.48 0.00 -1.09 -1.26 -2.05 121.20 116.70 2ecg s ILE 38 Ca 0.06 -0.58 0.02 0.00 -2.23 0.00 0.00 60.65 57.92 2ecg s ILE 38 Cb 0.05 -0.50 -0.02 0.00 -1.58 0.00 0.00 42.46 40.41 2ecg s ILE 38 CO 0.01 -0.32 0.04 0.68 -1.23 0.00 0.00 174.94 174.11 2ecg s VAL 39 N -1.32 1.03 0.20 2.92 -7.23 -0.32 -4.45 120.40 111.23 2ecg s VAL 39 Ca -0.14 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.11 2ecg s VAL 39 Cb -0.06 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 2ecg s VAL 39 CO 0.03 0.00 0.02 -0.36 -0.31 0.00 0.00 175.10 174.47 2ecg s PHE 40 N -2.97 2.85 -0.01 2.82 0.08 -1.24 -3.91 117.98 115.60 2ecg s PHE 40 Ca 0.12 -0.15 0.03 0.00 0.12 0.00 0.00 56.93 57.05 2ecg s PHE 40 Cb 0.02 -1.35 -0.01 0.00 -0.57 0.00 0.00 43.02 41.12 2ecg s PHE 40 CO 0.07 0.54 -0.09 0.08 -0.10 0.00 0.00 175.22 175.71 2ecg s VAL 41 N -1.87 0.72 0.02 -0.44 1.01 -1.25 -2.77 120.40 115.82 2ecg s VAL 41 Ca 0.29 -0.38 -0.22 0.00 0.00 0.00 0.00 61.98 61.66 2ecg s VAL 41 Cb -0.09 -0.61 -0.16 0.00 0.00 0.00 0.00 36.38 35.52 2ecg s VAL 41 CO 0.19 0.21 1.32 1.55 0.00 0.00 0.00 175.10 178.37 2ecg h PRO 42 N 5.98 0.24 -6.07 2.72 0.13 -1.92 -3.28 132.00 129.80 2ecg h PRO 42 Ca -0.31 -0.13 -0.74 0.00 -0.87 0.00 0.00 66.00 63.95 2ecg h PRO 42 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2ecg h PRO 42 CO 0.49 0.66 1.06 0.00 -0.23 0.00 0.00 178.00 179.98 2ecg s GLY 44 N 4.73 1.53 -0.20 0.00 0.00 -1.11 -3.61 107.32 108.65 2ecg s GLY 44 Ca 1.05 -1.81 -0.01 0.00 0.00 0.00 0.00 44.72 43.94 2ecg s GLY 44 CO 0.64 1.86 -0.00 0.30 0.00 0.00 0.00 173.10 175.90 2ecg s HIS 45 N 3.51 1.51 -0.53 1.90 3.76 -1.26 -4.83 115.29 119.35 2ecg s HIS 45 Ca 0.20 -1.14 -0.03 0.00 -0.15 0.00 0.00 55.06 53.94 2ecg s HIS 45 Cb -0.18 -1.22 0.17 0.00 1.11 0.00 0.00 32.58 32.46 2ecg s HIS 45 CO 0.11 -0.66 2.45 1.47 -0.85 0.00 0.00 174.74 177.27 2ecg n LEU 46 N 4.92 6.78 -0.66 0.89 -0.00 -1.26 -3.83 117.00 123.84 2ecg n LEU 46 Ca -0.10 -4.12 0.06 0.00 -0.00 0.00 0.00 56.01 51.85 2ecg n LEU 46 Cb 0.46 -1.15 0.16 0.00 -0.00 0.00 0.00 43.42 42.89 2ecg n LEU 46 CO 0.15 1.64 0.63 1.33 -0.00 0.00 0.00 177.39 181.14 2ecg n VAL 47 N 0.37 0.48 -4.06 1.47 0.24 -1.26 -4.57 118.33 111.00 2ecg n VAL 47 Ca 0.48 -0.47 -0.08 0.00 -2.04 0.00 0.00 64.34 62.23 2ecg n VAL 47 Cb 0.50 0.23 -0.09 0.00 -1.47 0.00 0.00 33.84 33.00 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 -1.53 0.18 0.35 3.34 -4.23 -1.26 -2.02 115.64 110.46 2ecg s THR 48 Ca 0.24 -1.72 0.07 0.00 -1.18 0.00 0.00 61.69 59.09 2ecg s THR 48 Cb 0.12 -1.62 -0.02 0.00 1.34 0.00 0.00 72.50 72.33 2ecg s THR 48 CO 0.16 -0.81 0.40 0.00 -0.54 0.00 0.00 174.62 173.83 2ecg n LYS 50 N -1.55 -0.06 0.10 0.00 5.02 -1.26 0.77 118.16 121.18 2ecg n LYS 50 Ca 0.00 1.18 -0.04 0.00 -2.02 0.00 0.00 58.31 57.43 2ecg n LYS 50 Cb 0.59 -1.96 -0.02 0.00 -0.02 0.00 0.00 35.03 33.63 2ecg n LYS 50 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 2ecg h GLN 51 N 0.00 -0.25 0.15 1.97 4.20 -1.97 -3.06 115.11 116.15 2ecg h GLN 51 Ca 0.56 0.02 0.01 0.00 0.06 0.00 0.00 58.65 59.29 2ecg h GLN 51 Cb 1.29 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 29.08 2ecg h GLN 51 CO -0.72 -0.16 -0.48 0.00 -0.67 0.00 0.00 178.83 176.80 2ecg n ALA 53 N -2.87 1.18 0.05 0.00 0.00 0.23 0.16 120.51 119.25 2ecg n ALA 53 Ca -0.08 0.75 -0.21 0.00 0.00 0.00 0.00 53.44 53.89 2ecg n ALA 53 Cb 0.38 -0.91 -0.15 0.00 0.00 0.00 0.00 19.45 18.77 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 0.32 -0.42 0.00 4.39 -1.05 -3.35 114.58 114.46 2ecg h GLU 54 Ca 0.76 -0.55 0.03 0.00 0.34 0.00 0.00 59.36 59.94 2ecg h GLU 54 Cb 2.45 0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 31.27 2ecg h GLU 54 CO -0.40 1.26 0.23 0.00 -1.16 0.00 0.00 179.01 178.94 2ecg h ALA 55 N 0.06 0.53 -2.08 3.43 0.00 0.33 -3.40 119.26 118.13 2ecg h ALA 55 Ca -0.20 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.15 2ecg h ALA 55 Cb 1.75 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 2ecg h ALA 55 CO 0.15 -0.11 1.15 0.14 0.00 0.00 0.00 179.25 180.58 2ecg s VAL 56 N -6.15 3.60 0.30 0.00 -7.23 0.49 -4.88 120.40 106.53 2ecg s VAL 56 Ca -0.13 0.68 0.00 0.00 -1.81 0.00 0.00 61.98 60.73 2ecg s VAL 56 Cb 0.12 -3.59 0.28 0.00 0.56 0.00 0.00 36.38 33.74 2ecg s VAL 56 CO 0.72 -0.23 1.93 0.44 -0.31 0.00 0.00 175.10 177.66 2ecg h ASP 57 N 10.84 0.91 -5.03 4.85 5.19 -1.87 -3.44 116.42 127.86 2ecg h ASP 57 Ca -0.36 -0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 55.94 2ecg h ASP 57 Cb 1.17 -0.20 -0.18 0.00 0.18 0.00 0.00 39.33 40.29 2ecg h ASP 57 CO 0.99 0.60 -0.35 -1.59 -3.12 0.00 0.00 179.24 175.77 2ecg s LYS 58 N -5.90 0.68 -0.34 3.56 -2.85 -1.26 -3.62 119.74 110.00 2ecg s LYS 58 Ca -0.11 -0.46 -0.32 0.00 -1.00 0.00 0.00 55.97 54.08 2ecg s LYS 58 Cb 0.19 0.29 -0.14 0.00 -2.06 0.00 0.00 37.83 36.12 2ecg s LYS 58 CO 0.80 -0.19 1.18 0.00 0.10 0.00 0.00 175.35 177.23 2ecg n PRO 60 N 3.28 0.49 0.00 0.00 -0.04 -1.26 0.17 135.00 137.63 2ecg n PRO 60 Ca 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 2ecg n PRO 60 Cb -0.04 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 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 -0.61 0.25 -0.00 0.54 2.81 -1.26 -4.81 117.12 114.03 2ecg n MET 61 Ca 0.03 0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.99 2ecg n MET 61 Cb 0.01 -0.79 -0.09 0.00 -0.71 0.00 0.00 33.22 31.65 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 -1.36 -1.53 -3.47 0.00 4.02 0.44 -4.91 117.16 110.35 2ecg n TYR 63 Ca 0.03 0.24 -0.43 0.00 -0.01 0.00 0.00 57.90 57.72 2ecg n TYR 63 Cb 0.24 -3.69 -0.09 0.00 -0.02 0.00 0.00 39.34 35.78 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 -2.97 4.90 -0.23 -0.72 2.01 -1.25 -4.70 115.64 112.69 2ecg s THR 64 Ca 0.16 -1.14 -0.42 0.00 0.31 0.00 0.00 61.69 60.60 2ecg s THR 64 Cb -0.07 -3.93 -0.19 0.00 0.01 0.00 0.00 72.50 68.32 2ecg s THR 64 CO 0.19 -0.53 1.42 0.52 -0.69 0.00 0.00 174.62 175.53 2ecg n VAL 65 N 5.11 0.05 -2.05 3.82 0.31 -1.26 -2.64 118.33 121.66 2ecg n VAL 65 Ca -0.12 -0.01 -0.31 0.00 -0.01 0.00 0.00 64.34 63.90 2ecg n VAL 65 Cb 0.44 -0.50 -0.04 0.00 -0.91 0.00 0.00 33.84 32.83 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 1.79 3.42 -1.65 2.52 1.09 -1.24 -4.77 121.20 122.37 2ecg s ILE 66 Ca 0.97 -0.19 0.05 0.00 -1.10 0.00 0.00 60.65 60.38 2ecg s ILE 66 Cb -1.29 -4.00 0.18 0.00 -1.06 0.00 0.00 42.46 36.29 2ecg s ILE 66 CO 0.67 -0.95 1.04 1.07 -0.10 0.00 0.00 174.94 176.67 2ecg n THR 67 N 7.65 0.38 -3.47 2.92 5.66 -1.24 -4.72 114.28 121.46 2ecg n THR 67 Ca 0.34 -0.28 0.01 0.00 -3.05 0.00 0.00 64.05 61.06 2ecg n THR 67 Cb 0.49 -0.05 -0.05 0.00 -1.55 0.00 0.00 70.33 69.18 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 -1.66 -0.69 -0.86 1.09 5.36 -1.26 -5.03 117.98 114.93 2ecg s PHE 68 Ca 0.13 1.23 -0.15 0.00 -0.96 0.00 0.00 56.93 57.17 2ecg s PHE 68 Cb 0.08 0.41 0.19 0.00 -0.34 0.00 0.00 43.02 43.36 2ecg s PHE 68 CO 0.07 -0.34 0.87 0.15 -1.46 0.00 0.00 175.22 174.51 2ecg s LYS 69 N 2.24 3.61 -0.14 10.12 3.01 -1.26 -3.84 119.74 133.47 2ecg s LYS 69 Ca -0.04 -2.27 -0.24 0.00 -1.01 0.00 0.00 55.97 52.41 2ecg s LYS 69 Cb -0.06 -4.57 -0.02 0.00 -1.01 0.00 0.00 37.83 32.17 2ecg s LYS 69 CO -0.17 -1.43 0.76 -1.14 0.51 0.00 0.00 175.35 173.88 2ecg s GLN 70 N 0.87 4.32 0.05 1.68 2.00 -1.25 -4.94 119.66 122.38 2ecg s GLN 70 Ca 0.22 0.91 -0.21 0.00 -2.00 0.00 0.00 55.36 54.28 2ecg s GLN 70 Cb -0.08 -3.54 -0.06 0.00 0.80 0.00 0.00 33.01 30.12 2ecg s GLN 70 CO -0.09 -0.20 0.62 0.21 -0.50 0.00 0.00 175.29 175.33 2ecg s LYS 71 N 1.71 4.31 0.32 1.67 2.20 -1.26 -1.17 119.74 127.52 2ecg s LYS 71 Ca 0.36 0.81 0.07 0.00 -0.36 0.00 0.00 55.97 56.86 2ecg s LYS 71 Cb -0.17 -3.29 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 2ecg s LYS 71 CO 0.14 0.49 0.29 0.96 -0.36 0.00 0.00 175.35 176.87 2ecg s ILE 72 N -0.65 3.73 -0.32 5.43 -4.36 -0.87 -4.97 121.20 119.19 2ecg s ILE 72 Ca 0.31 -1.35 0.16 0.00 -0.26 0.00 0.00 60.65 59.51 2ecg s ILE 72 Cb -0.19 -3.24 0.47 0.00 1.25 0.00 0.00 42.46 40.74 2ecg s ILE 72 CO 0.19 -0.20 1.06 0.49 0.24 0.00 0.00 174.94 176.72 2ecg n PHE 73 N -1.36 1.75 -0.34 1.37 3.72 -1.26 -4.85 117.46 116.49 2ecg n PHE 73 Ca -0.03 -2.56 0.02 0.00 -0.05 0.00 0.00 57.45 54.82 2ecg n PHE 73 Cb 0.59 -0.28 0.07 0.00 -0.94 0.00 0.00 39.48 38.93 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 -0.38 -0.16 0.00 -1.08 2.81 -1.26 -5.24 117.12 111.81 2ecg n MET 74 Ca 0.18 1.42 0.05 0.00 -1.81 0.00 0.00 57.70 57.54 2ecg n MET 74 Cb 0.81 -2.12 0.30 0.00 -0.71 0.00 0.00 33.22 31.50 2ecg n MET 74 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35