#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p9k n SER 2 N 0.00 -7.90 -1.41 1.61 7.64 -1.26 -4.83 113.62 107.46 1p9k n SER 2 Ca 0.00 1.06 0.18 0.00 1.01 0.00 0.00 58.87 61.12 1p9k n SER 2 Cb 0.00 -5.12 -0.06 0.00 -1.01 0.00 0.00 64.21 58.02 1p9k n SER 2 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1p9k n MET 3 N 0.38 -2.98 -3.83 1.43 0.00 -1.26 -4.76 117.12 106.10 1p9k n MET 3 Ca 0.04 2.21 -0.36 0.00 -0.00 0.00 0.00 57.70 59.58 1p9k n MET 3 Cb 0.19 -3.59 -0.13 0.00 0.00 0.00 0.00 33.22 29.69 1p9k n MET 3 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 175.97 176.93 1p9k s ILE 4 N -3.19 3.42 -0.28 1.12 -4.36 -1.26 -5.06 121.20 111.58 1p9k s ILE 4 Ca 0.00 -1.18 -0.23 0.00 -0.26 0.00 0.00 60.65 58.98 1p9k s ILE 4 Cb 0.00 -2.91 0.09 0.00 1.25 0.00 0.00 42.46 40.89 1p9k s ILE 4 CO 0.00 -0.10 0.81 -2.28 0.24 0.00 0.00 174.94 173.62 1p9k s HIS 5 N 1.35 -0.74 -0.29 1.37 2.46 -1.26 -5.16 115.29 113.01 1p9k s HIS 5 Ca -0.03 1.72 -0.16 0.00 0.47 0.00 0.00 55.06 57.06 1p9k s HIS 5 Cb -0.19 0.35 0.16 0.00 -0.13 0.00 0.00 32.58 32.77 1p9k s HIS 5 CO 0.01 -0.36 1.01 -0.98 -2.47 0.00 0.00 174.74 171.95 1p9k s ARG 6 N 0.58 0.32 -0.07 2.88 3.03 -1.26 -5.16 118.95 119.27 1p9k s ARG 6 Ca -0.01 0.60 0.00 0.00 2.03 0.00 0.00 55.73 58.35 1p9k s ARG 6 Cb -0.05 0.14 0.02 0.00 -1.03 0.00 0.00 34.95 34.04 1p9k s ARG 6 CO -0.05 -0.08 -0.05 0.00 -1.13 0.00 0.00 175.30 173.99 1p9k s MET 7 N 1.55 1.09 -0.04 3.89 0.23 -1.26 -5.13 119.30 119.63 1p9k s MET 7 Ca -0.07 -0.14 -0.05 0.00 -1.03 0.00 0.00 55.69 54.40 1p9k s MET 7 Cb -0.04 -1.15 0.01 0.00 -1.53 0.00 0.00 34.83 32.12 1p9k s MET 7 CO -0.15 -0.17 0.13 -1.54 -2.03 0.00 0.00 175.02 171.26 1p9k s SER 8 N 1.34 -0.12 -0.14 -1.18 1.04 -1.26 -5.15 113.70 108.23 1p9k s SER 8 Ca -0.04 0.22 -0.01 0.00 0.48 0.00 0.00 55.95 56.60 1p9k s SER 8 Cb -0.14 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.22 1p9k s SER 8 CO -0.03 -0.07 -0.10 0.21 0.98 0.00 0.00 173.24 174.23 1p9k s ASN 9 N -0.04 4.23 0.73 7.02 3.04 -1.26 -5.12 114.94 123.54 1p9k s ASN 9 Ca -0.01 -0.27 -0.10 0.00 0.04 0.00 0.00 52.86 52.52 1p9k s ASN 9 Cb -0.01 -1.66 0.05 0.00 -1.54 0.00 0.00 41.25 38.09 1p9k s ASN 9 CO 0.00 0.16 1.08 -0.04 -3.04 0.00 0.00 177.10 175.27 1p9k s MET 10 N 0.36 2.35 -0.34 0.43 -1.94 -1.26 -5.03 119.30 113.88 1p9k s MET 10 Ca -0.09 0.08 -0.19 0.00 -1.71 0.00 0.00 55.69 53.78 1p9k s MET 10 Cb -0.15 -2.07 -0.00 0.00 2.01 0.00 0.00 34.83 34.62 1p9k s MET 10 CO 0.05 -1.26 0.56 0.00 -0.01 0.00 0.00 175.02 174.36 1p9k s ALA 11 N -3.37 3.49 -0.05 3.03 0.00 -1.26 -5.04 121.76 118.55 1p9k s ALA 11 Ca 0.60 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.67 1p9k s ALA 11 Cb -0.11 -3.06 0.02 0.00 0.00 0.00 0.00 23.12 19.97 1p9k s ALA 11 CO 0.48 -1.20 -0.06 0.95 0.00 0.00 0.00 175.76 175.93 1p9k s THR 12 N 2.49 0.69 0.06 0.00 -4.23 -1.25 -1.31 115.64 112.09 1p9k s THR 12 Ca 0.21 -0.21 0.01 0.00 -1.18 0.00 0.00 61.69 60.52 1p9k s THR 12 Cb -0.15 -0.69 -0.04 0.00 1.34 0.00 0.00 72.50 72.96 1p9k s THR 12 CO 0.13 0.26 0.15 0.12 -0.54 0.00 0.00 174.62 174.74 1p9k s PHE 13 N 0.92 3.38 -0.22 3.99 2.19 0.57 -4.94 117.98 123.87 1p9k s PHE 13 Ca -0.11 0.19 -0.06 0.00 0.33 0.00 0.00 56.93 57.28 1p9k s PHE 13 Cb -0.15 -1.71 -0.03 0.00 -1.31 0.00 0.00 43.02 39.83 1p9k s PHE 13 CO 0.01 0.57 0.04 -1.54 1.83 0.00 0.00 175.22 176.12 1p9k s SER 14 N -2.34 5.06 0.19 6.13 1.04 -1.26 -0.25 113.70 122.26 1p9k s SER 14 Ca 0.31 -0.17 -0.05 0.00 0.48 0.00 0.00 55.95 56.52 1p9k s SER 14 Cb -0.13 -1.88 0.10 0.00 0.10 0.00 0.00 66.02 64.21 1p9k s SER 14 CO 0.24 0.04 1.54 0.25 0.98 0.00 0.00 173.24 176.28 1p9k h LEU 15 N 7.71 0.77 0.00 2.42 6.46 -1.75 -3.48 115.31 127.44 1p9k h LEU 15 Ca -0.37 -0.35 0.00 0.00 -0.12 0.00 0.00 57.88 57.04 1p9k h LEU 15 Cb 1.18 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.89 1p9k h LEU 15 CO 0.61 1.08 0.00 0.61 -0.62 0.00 0.00 178.44 180.12 1p9k n GLY 16 N 0.07 1.31 3.42 3.75 0.00 -1.26 -4.37 105.19 108.10 1p9k n GLY 16 Ca -0.02 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.56 1p9k n GLY 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p9k n LYS 17 N -1.41 -5.85 -4.55 1.61 5.02 -1.26 -5.03 118.16 106.68 1p9k n LYS 17 Ca 0.00 0.84 -0.27 0.00 -2.02 0.00 0.00 58.31 56.86 1p9k n LYS 17 Cb 0.10 -5.81 -0.11 0.00 -0.02 0.00 0.00 35.03 29.19 1p9k n LYS 17 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1p9k s HIS 18 N -3.38 2.49 0.34 2.13 3.76 -1.26 -5.03 115.29 114.34 1p9k s HIS 18 Ca 0.07 -0.60 0.09 0.00 -0.15 0.00 0.00 55.06 54.47 1p9k s HIS 18 Cb -0.01 -1.66 0.82 0.00 1.11 0.00 0.00 32.58 32.84 1p9k s HIS 18 CO 0.74 0.48 1.83 -1.00 -0.85 0.00 0.00 174.74 175.93 1p9k h PRO 19 N 1.83 0.67 0.00 8.40 0.13 -1.95 -3.47 132.00 137.60 1p9k h PRO 19 Ca -0.43 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1p9k h PRO 19 Cb 1.24 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1p9k h PRO 19 CO 0.76 0.44 0.00 -2.39 -0.23 0.00 0.00 178.00 176.59 1p9k n HIS 20 N -4.62 0.00 -3.95 1.56 1.44 -1.26 -4.76 115.22 103.63 1p9k n HIS 20 Ca 0.20 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.82 1p9k n HIS 20 Cb 0.55 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.57 1p9k n HIS 20 CO 0.00 0.00 0.00 0.14 -2.81 0.00 0.00 176.34 173.67 1p9k s VAL 21 N -3.00 0.15 0.11 0.61 -7.23 -1.23 -4.98 120.40 104.83 1p9k s VAL 21 Ca 0.00 -1.27 0.03 0.00 -1.81 0.00 0.00 61.98 58.93 1p9k s VAL 21 Cb 0.00 -1.12 -0.04 0.00 0.56 0.00 0.00 36.38 35.78 1p9k s VAL 21 CO 0.00 -0.70 0.16 -1.83 -0.31 0.00 0.00 175.10 172.42 1p9k s GLU 22 N -3.16 3.10 0.28 4.82 -1.05 -1.25 -3.55 118.70 117.89 1p9k s GLU 22 Ca -0.00 -0.67 0.02 0.00 -0.15 0.00 0.00 54.97 54.16 1p9k s GLU 22 Cb 0.02 -2.81 0.69 0.00 -0.44 0.00 0.00 34.13 31.59 1p9k s GLU 22 CO -0.07 0.54 1.40 1.47 0.95 0.00 0.00 175.26 179.56 1p9k n LEU 23 N 0.03 -0.10 -0.23 1.83 -0.00 -1.26 0.14 117.00 117.40 1p9k n LEU 23 Ca -0.07 1.52 -0.03 0.00 -0.00 0.00 0.00 56.01 57.43 1p9k n LEU 23 Cb 0.53 -0.56 0.16 0.00 -0.00 0.00 0.00 43.42 43.55 1p9k n LEU 23 CO 0.46 -1.54 1.10 0.00 -0.00 0.00 0.00 177.39 177.41 1p9k h ASP 25 N 1.04 -0.63 -0.27 0.00 3.32 0.79 -1.23 116.42 119.43 1p9k h ASP 25 Ca 0.25 -0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.33 1p9k h ASP 25 Cb 0.11 0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.78 1p9k h ASP 25 CO -0.03 -0.23 -0.03 0.25 -1.72 0.00 0.00 179.24 177.48 1p9k h LEU 26 N -1.13 -0.17 0.81 1.55 5.85 -1.25 -1.72 115.31 119.26 1p9k h LEU 26 Ca -0.08 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1p9k h LEU 26 Cb 0.61 0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.78 1p9k h LEU 26 CO 0.12 -0.05 -0.39 -0.07 -0.34 0.00 0.00 178.44 177.71 1p9k h LEU 27 N 0.05 -0.92 0.03 2.25 4.07 -1.18 -1.56 115.31 118.05 1p9k h LEU 27 Ca 0.13 0.02 0.02 0.00 0.08 0.00 0.00 57.88 58.13 1p9k h LEU 27 Cb 0.18 0.24 -0.05 0.00 1.08 0.00 0.00 40.66 42.11 1p9k h LEU 27 CO -0.24 -0.59 -0.53 0.50 -1.08 0.00 0.00 178.44 176.50 1p9k h LYS 28 N -1.22 -0.66 -0.74 1.13 3.64 -1.19 0.39 116.57 117.91 1p9k h LYS 28 Ca -0.11 0.05 0.08 0.00 -1.27 0.00 0.00 60.65 59.39 1p9k h LYS 28 Cb 0.85 0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.75 1p9k h LYS 28 CO 0.18 -0.44 0.41 -0.07 -2.27 0.00 0.00 179.45 177.26 1p9k h LEU 29 N -0.69 0.60 -1.13 5.20 -0.00 -1.40 0.71 115.31 118.60 1p9k h LEU 29 Ca 0.01 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 1p9k h LEU 29 Cb 0.73 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.32 1p9k h LEU 29 CO -0.34 0.36 0.00 -0.33 -0.00 0.00 0.00 178.44 178.13 1p9k h GLU 30 N 0.73 0.00 0.00 1.13 4.39 -0.70 -3.46 114.58 116.67 1p9k h GLU 30 Ca 0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1p9k h GLU 30 Cb 0.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1p9k h GLU 30 CO -0.22 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.04 1p9k n GLY 31 N -0.40 1.13 0.07 -3.84 0.00 0.24 -5.03 105.19 97.37 1p9k n GLY 31 Ca 0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 46.02 45.75 1p9k n GLY 31 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1p9k h TRP 32 N 0.00 -0.13 -3.30 1.61 4.06 -0.46 -3.46 115.95 114.27 1p9k h TRP 32 Ca 0.00 -0.00 -0.68 0.00 2.06 0.00 0.00 58.89 60.27 1p9k h TRP 32 Cb 0.10 0.04 -0.15 0.00 -1.00 0.00 0.00 29.16 28.15 1p9k h TRP 32 CO 0.00 -0.08 -0.62 0.45 -3.56 0.00 0.00 178.44 174.63 1p9k s SER 33 N -3.69 5.27 0.05 -3.49 0.15 -1.26 -4.99 113.70 105.74 1p9k s SER 33 Ca -0.02 0.14 0.01 0.00 0.70 0.00 0.00 55.95 56.78 1p9k s SER 33 Cb 0.00 -1.52 -0.26 0.00 -1.71 0.00 0.00 66.02 62.53 1p9k s SER 33 CO 0.06 0.36 1.04 -0.33 1.20 0.00 0.00 173.24 175.58 1p9k h GLU 34 N 5.27 0.17 0.00 5.44 5.08 -1.92 -3.37 114.58 125.25 1p9k h GLU 34 Ca -0.50 -0.29 -0.21 0.00 -1.00 0.00 0.00 59.36 57.37 1p9k h GLU 34 Cb 1.19 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 1p9k h GLU 34 CO 0.55 1.06 -1.96 0.43 -1.00 0.00 0.00 179.01 178.10 1p9k n SER 35 N -3.42 1.29 0.00 1.42 7.64 -1.26 -5.00 113.62 114.30 1p9k n SER 35 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.78 1p9k n SER 35 Cb 1.01 1.08 0.00 0.00 -1.01 0.00 0.00 64.21 65.30 1p9k n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p9k n GLY 36 N 1.95 0.95 0.00 0.23 0.00 -1.26 -4.64 105.19 102.42 1p9k n GLY 36 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1p9k n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p9k n ALA 37 N 0.88 0.00 -0.73 4.61 0.00 -1.26 -4.02 120.51 119.99 1p9k n ALA 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1p9k n ALA 37 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1p9k n ALA 37 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1p9k n GLN 38 N 0.00 0.00 0.00 0.00 -0.06 -1.26 -2.75 117.38 113.31 1p9k n GLN 38 Ca 0.00 0.28 0.00 0.00 -2.00 0.00 0.00 57.00 55.28 1p9k n GLN 38 Cb 0.00 -1.13 0.00 0.00 -4.06 0.00 0.00 30.24 25.05 1p9k n GLN 38 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1p9k n ALA 39 N -1.09 2.50 -2.09 1.69 0.00 -1.26 -4.82 120.51 115.45 1p9k n ALA 39 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1p9k n ALA 39 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 1p9k n ALA 39 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1p9k n LYS 40 N -0.25 -1.47 0.30 0.00 5.02 -1.11 -4.84 118.16 115.82 1p9k n LYS 40 Ca 0.00 1.02 0.19 0.00 -2.02 0.00 0.00 58.31 57.50 1p9k n LYS 40 Cb 0.13 -5.50 1.01 0.00 -0.02 0.00 0.00 35.03 30.65 1p9k n LYS 40 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1p9k h ILE 41 N 0.00 0.21 0.00 -0.18 2.04 -1.84 0.26 117.51 118.00 1p9k h ILE 41 Ca -0.44 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.42 1p9k h ILE 41 Cb 1.31 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 1p9k h ILE 41 CO 0.55 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.70 1p9k n ALA 42 N -2.15 -0.03 -0.28 1.87 0.00 -1.26 -2.16 120.51 116.51 1p9k n ALA 42 Ca -0.02 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.58 1p9k n ALA 42 Cb 0.18 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.06 1p9k n ALA 42 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1p9k h ILE 43 N 0.00 0.72 0.07 0.00 1.08 -1.87 -2.68 117.51 114.83 1p9k h ILE 43 Ca 0.00 -0.20 -0.00 0.00 -0.39 0.00 0.00 64.86 64.27 1p9k h ILE 43 Cb 0.00 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 33.85 1p9k h ILE 43 CO 0.00 0.10 -0.04 0.00 -0.69 0.00 0.00 178.15 177.53 1p9k h ALA 44 N 1.61 -1.01 -0.71 1.87 0.00 -1.09 -2.59 119.26 117.34 1p9k h ALA 44 Ca 0.49 -0.02 0.27 0.00 0.00 0.00 0.00 54.91 55.65 1p9k h ALA 44 Cb 0.99 0.06 -0.13 0.00 0.00 0.00 0.00 17.79 18.71 1p9k h ALA 44 CO -0.24 -1.00 0.27 -1.91 0.00 0.00 0.00 179.25 176.37 1p9k n GLU 45 N -2.28 -0.05 0.00 0.00 0.00 -0.92 -0.88 120.64 116.51 1p9k n GLU 45 Ca -0.01 1.01 0.00 0.00 0.00 0.00 0.00 57.16 58.16 1p9k n GLU 45 Cb 0.04 -1.75 0.00 0.00 0.00 0.00 0.00 31.44 29.73 1p9k n GLU 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1p9k n GLY 46 N -1.24 -2.75 0.00 8.31 0.00 -1.08 -2.46 105.19 105.98 1p9k n GLY 46 Ca 0.24 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1p9k n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p9k n GLN 47 N -1.22 0.00 0.00 1.61 10.64 -0.06 -3.66 117.38 124.70 1p9k n GLN 47 Ca 0.00 0.21 0.00 0.00 -1.83 0.00 0.00 57.00 55.38 1p9k n GLN 47 Cb 0.00 -1.76 0.00 0.00 -0.86 0.00 0.00 30.24 27.62 1p9k n GLN 47 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 1p9k n VAL 48 N -1.19 0.00 -3.61 -0.39 0.31 -0.36 -4.86 118.33 108.24 1p9k n VAL 48 Ca 0.00 0.03 -0.03 0.00 -0.01 0.00 0.00 64.34 64.34 1p9k n VAL 48 Cb 0.26 -0.28 -0.05 0.00 -0.91 0.00 0.00 33.84 32.86 1p9k n VAL 48 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1p9k s LYS 49 N 0.00 0.54 0.15 5.55 -0.14 -1.07 -4.83 119.74 119.93 1p9k s LYS 49 Ca 0.00 1.15 0.10 0.00 -1.36 0.00 0.00 55.97 55.85 1p9k s LYS 49 Cb 0.00 0.46 -0.04 0.00 -1.68 0.00 0.00 37.83 36.57 1p9k s LYS 49 CO 0.00 -0.15 -0.18 0.08 -0.76 0.00 0.00 175.35 174.34 1p9k s VAL 50 N 2.20 2.80 -0.88 3.17 1.01 -0.78 -0.06 120.40 127.85 1p9k s VAL 50 Ca -0.07 -1.65 -0.30 0.00 0.00 0.00 0.00 61.98 59.96 1p9k s VAL 50 Cb -0.08 -2.32 -0.19 0.00 0.00 0.00 0.00 36.38 33.80 1p9k s VAL 50 CO -0.18 0.01 2.63 -0.67 0.00 0.00 0.00 175.10 176.89 1p9k n ASP 51 N 0.54 0.76 -1.98 3.32 2.03 0.23 0.13 116.55 121.57 1p9k n ASP 51 Ca -0.14 0.01 -0.21 0.00 0.52 0.00 0.00 54.79 54.97 1p9k n ASP 51 Cb 0.54 -1.07 -0.05 0.00 -0.72 0.00 0.00 41.12 39.81 1p9k n ASP 51 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1p9k n GLY 52 N 6.38 0.79 2.51 0.27 0.00 -1.26 -4.77 105.19 109.11 1p9k n GLY 52 Ca 0.59 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 46.40 1p9k n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p9k s ALA 53 N -2.91 0.36 -1.22 4.61 0.00 0.36 -5.05 121.76 117.90 1p9k s ALA 53 Ca 0.00 -1.83 -0.13 0.00 0.00 0.00 0.00 51.96 49.99 1p9k s ALA 53 Cb 0.00 -1.92 0.17 0.00 0.00 0.00 0.00 23.12 21.37 1p9k s ALA 53 CO 0.00 -2.05 1.50 1.55 0.00 0.00 0.00 175.76 176.76 1p9k n VAL 54 N 2.93 4.25 -3.80 0.00 3.14 -1.26 -1.86 118.33 121.73 1p9k n VAL 54 Ca 0.26 -4.67 -0.08 0.00 -2.96 0.00 0.00 64.34 56.89 1p9k n VAL 54 Cb 0.50 -2.45 -0.01 0.00 -1.06 0.00 0.00 33.84 30.82 1p9k n VAL 54 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1p9k n GLU 55 N 5.55 1.39 -2.69 1.45 1.02 -1.26 -4.99 120.64 121.11 1p9k n GLU 55 Ca 0.38 -1.01 -0.03 0.00 -0.02 0.00 0.00 57.16 56.48 1p9k n GLU 55 Cb 0.42 0.16 0.12 0.00 -0.02 0.00 0.00 31.44 32.13 1p9k n GLU 55 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1p9k n THR 56 N -0.71 0.08 -2.57 2.62 5.66 -1.26 -1.40 114.28 116.70 1p9k n THR 56 Ca -0.02 -1.26 -0.22 0.00 -3.05 0.00 0.00 64.05 59.49 1p9k n THR 56 Cb 0.18 1.01 0.07 0.00 -1.55 0.00 0.00 70.33 70.04 1p9k n THR 56 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 1p9k s ARG 57 N -0.11 2.19 -0.07 1.09 3.00 -1.26 -4.71 118.95 119.07 1p9k s ARG 57 Ca 0.14 -0.85 -0.17 0.00 -1.00 0.00 0.00 55.73 53.85 1p9k s ARG 57 Cb 0.43 -2.40 -0.13 0.00 0.00 0.00 0.00 34.95 32.86 1p9k s ARG 57 CO -0.11 -1.04 0.63 0.87 0.00 0.00 0.00 175.30 175.65 1p9k h LYS 58 N -0.22 -0.18 -5.71 5.12 1.79 -1.98 -3.46 116.57 111.94 1p9k h LYS 58 Ca -0.40 0.01 -0.66 0.00 -2.18 0.00 0.00 60.65 57.42 1p9k h LYS 58 Cb 1.29 0.04 -0.07 0.00 -1.58 0.00 0.00 32.23 31.91 1p9k h LYS 58 CO 0.49 0.21 -0.49 1.03 -1.08 0.00 0.00 179.45 179.60 1p9k s ARG 59 N -2.82 3.41 -0.15 3.15 0.52 -1.26 -4.28 118.95 117.51 1p9k s ARG 59 Ca -0.10 -0.20 -0.05 0.00 -0.52 0.00 0.00 55.73 54.86 1p9k s ARG 59 Cb -0.00 -3.14 -0.03 0.00 0.52 0.00 0.00 34.95 32.30 1p9k s ARG 59 CO 0.37 0.75 0.01 0.00 0.02 0.00 0.00 175.30 176.45 1p9k n LYS 61 N 3.30 3.13 -4.21 0.00 5.02 -1.26 -3.53 118.16 120.61 1p9k n LYS 61 Ca -0.17 -4.55 -0.16 0.00 -2.02 0.00 0.00 58.31 51.40 1p9k n LYS 61 Cb 0.53 -2.40 -0.13 0.00 -0.02 0.00 0.00 35.03 33.00 1p9k n LYS 61 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1p9k s ILE 62 N -2.06 0.64 0.30 -0.18 1.01 -1.26 -5.01 121.20 114.64 1p9k s ILE 62 Ca 0.32 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.27 1p9k s ILE 62 Cb 0.02 -0.60 -0.01 0.00 0.01 0.00 0.00 42.46 41.88 1p9k s ILE 62 CO -0.03 -0.04 0.41 0.68 0.00 0.00 0.00 174.94 175.96 1p9k s VAL 63 N -0.65 0.00 0.00 2.92 -7.23 -1.26 -3.72 120.40 110.46 1p9k s VAL 63 Ca -0.01 -1.65 0.00 0.00 -1.81 0.00 0.00 61.98 58.51 1p9k s VAL 63 Cb -0.06 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.37 1p9k s VAL 63 CO 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.79 1p9k n ALA 64 N -0.49 0.00 -3.34 1.32 0.00 -1.26 -4.46 120.51 112.28 1p9k n ALA 64 Ca 0.01 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 53.00 1p9k n ALA 64 Cb 0.62 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.07 1p9k n ALA 64 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1p9k s GLY 65 N -0.13 3.05 0.30 0.00 0.00 -1.23 -2.80 107.32 106.50 1p9k s GLY 65 Ca 0.00 -3.68 0.09 0.00 0.00 0.00 0.00 44.72 41.13 1p9k s GLY 65 CO 0.00 1.30 -0.11 1.20 0.00 0.00 0.00 173.10 175.49 1p9k s GLN 66 N -0.80 1.67 0.14 2.90 -1.52 -0.50 -4.90 119.66 116.64 1p9k s GLN 66 Ca 0.26 -1.83 0.11 0.00 -1.95 0.00 0.00 55.36 51.96 1p9k s GLN 66 Cb -0.10 -1.50 -0.04 0.00 -0.22 0.00 0.00 33.01 31.15 1p9k s GLN 66 CO -0.08 0.15 -0.26 0.99 -0.25 0.00 0.00 175.29 175.84 1p9k s THR 67 N -2.74 2.29 0.07 -0.19 2.01 -1.26 0.14 115.64 115.96 1p9k s THR 67 Ca 0.30 -1.80 0.05 0.00 0.31 0.00 0.00 61.69 60.56 1p9k s THR 67 Cb 0.01 -2.03 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 1p9k s THR 67 CO 0.14 0.05 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.29 1p9k s VAL 68 N -1.17 1.17 -0.02 3.82 1.01 0.15 0.75 120.40 126.12 1p9k s VAL 68 Ca 0.15 -1.26 0.01 0.00 0.00 0.00 0.00 61.98 60.88 1p9k s VAL 68 Cb -0.10 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.19 1p9k s VAL 68 CO 0.07 -0.16 -0.01 -0.44 0.00 0.00 0.00 175.10 174.56 1p9k s SER 69 N -1.63 0.38 -0.11 3.32 0.01 0.91 -0.64 113.70 115.94 1p9k s SER 69 Ca -0.00 -0.04 -0.03 0.00 1.31 0.00 0.00 55.95 57.19 1p9k s SER 69 Cb -0.10 -0.15 0.04 0.00 0.21 0.00 0.00 66.02 66.03 1p9k s SER 69 CO 0.02 -0.05 0.06 0.12 0.41 0.00 0.00 173.24 173.80 1p9k s PHE 70 N 0.60 0.35 -0.46 2.43 5.36 -0.79 -2.61 117.98 122.86 1p9k s PHE 70 Ca -0.06 -0.17 -0.06 0.00 -0.96 0.00 0.00 56.93 55.68 1p9k s PHE 70 Cb -0.09 -0.69 0.06 0.00 -0.34 0.00 0.00 43.02 41.96 1p9k s PHE 70 CO -0.01 -0.38 0.15 0.00 -1.46 0.00 0.00 175.22 173.51 1p9k n ALA 71 N 5.23 -0.87 0.00 11.12 0.00 -1.26 0.16 120.51 134.89 1p9k n ALA 71 Ca -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1p9k n ALA 71 Cb 0.49 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1p9k n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p9k n GLY 72 N -0.57 1.63 3.48 0.00 0.00 -1.26 -5.04 105.19 103.42 1p9k n GLY 72 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 1p9k n GLY 72 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1p9k s HIS 73 N -2.05 3.31 -0.57 1.61 3.76 0.43 -4.96 115.29 116.83 1p9k s HIS 73 Ca 0.00 -1.89 -0.19 0.00 -0.15 0.00 0.00 55.06 52.84 1p9k s HIS 73 Cb 0.00 -4.37 0.10 0.00 1.11 0.00 0.00 32.58 29.42 1p9k s HIS 73 CO 0.00 -1.48 0.67 -1.12 -0.85 0.00 0.00 174.74 171.96 1p9k s SER 74 N 3.22 6.19 0.21 1.40 0.01 -1.26 -1.89 113.70 121.59 1p9k s SER 74 Ca 0.42 -1.38 0.11 0.00 1.31 0.00 0.00 55.95 56.41 1p9k s SER 74 Cb -0.02 -2.29 -0.05 0.00 0.21 0.00 0.00 66.02 63.87 1p9k s SER 74 CO -0.01 -1.05 -0.23 -0.69 0.41 0.00 0.00 173.24 171.67 1p9k s VAL 75 N 2.57 2.36 0.28 3.43 1.01 0.19 -4.89 120.40 125.35 1p9k s VAL 75 Ca 0.11 -2.12 0.09 0.00 0.00 0.00 0.00 61.98 60.06 1p9k s VAL 75 Cb -0.24 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1p9k s VAL 75 CO 0.07 -0.20 0.06 -1.10 0.00 0.00 0.00 175.10 173.93 1p9k s GLN 76 N -2.89 2.41 0.04 2.72 -0.21 -0.42 0.31 119.66 121.62 1p9k s GLN 76 Ca 0.23 -1.39 0.03 0.00 0.02 0.00 0.00 55.36 54.25 1p9k s GLN 76 Cb -0.07 -2.23 -0.02 0.00 1.00 0.00 0.00 33.01 31.69 1p9k s GLN 76 CO 0.11 0.31 -0.10 0.08 -2.12 0.00 0.00 175.29 173.57 1p9k s VAL 77 N -2.32 0.78 0.13 1.09 1.01 0.37 -0.31 120.40 121.14 1p9k s VAL 77 Ca 0.33 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.43 1p9k s VAL 77 Cb -0.06 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 1p9k s VAL 77 CO 0.21 -0.15 -0.11 0.68 0.00 0.00 0.00 175.10 175.73 1p9k s VAL 78 N -0.97 1.14 -1.93 2.92 -7.23 0.65 -1.41 120.40 113.57 1p9k s VAL 78 Ca -0.03 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.29 1p9k s VAL 78 Cb -0.08 -1.62 0.00 0.00 0.56 0.00 0.00 36.38 35.24 1p9k s VAL 78 CO 0.01 -0.61 0.48 0.00 -0.31 0.00 0.00 175.10 174.67