#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 -3.06 -0.04 1.61 7.64 -1.26 -4.97 113.62 113.54 1p9k n SER 2 Ca 0.00 1.27 -0.16 0.00 1.01 0.00 0.00 58.87 60.99 1p9k n SER 2 Cb 0.00 -4.57 -0.13 0.00 -1.01 0.00 0.00 64.21 58.50 1p9k n SER 2 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1p9k h MET 3 N 3.48 0.09 -4.48 1.43 2.86 -2.12 -3.48 114.93 112.70 1p9k h MET 3 Ca -0.33 -0.15 -0.28 0.00 -2.06 0.00 0.00 59.70 56.88 1p9k h MET 3 Cb 0.74 0.05 0.10 0.00 0.06 0.00 0.00 31.60 32.56 1p9k h MET 3 CO 0.01 1.07 -0.49 -0.89 1.06 0.00 0.00 176.91 177.66 1p9k n ILE 4 N -4.46 -2.39 0.26 -1.22 5.41 -1.26 -4.91 119.36 110.79 1p9k n ILE 4 Ca -0.12 -0.04 0.15 0.00 1.00 0.00 0.00 62.75 63.74 1p9k n ILE 4 Cb 0.59 -3.40 0.58 0.00 -0.71 0.00 0.00 39.64 36.70 1p9k n ILE 4 CO 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 176.55 175.81 1p9k h HIS 5 N -1.88 0.00 -4.91 1.39 2.76 -2.04 -3.48 115.15 106.99 1p9k h HIS 5 Ca -0.41 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 1p9k h HIS 5 Cb 1.26 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 30.16 1p9k h HIS 5 CO 0.35 0.05 -1.18 -2.13 -1.30 0.00 0.00 177.93 173.72 1p9k n ARG 6 N -3.15 -3.72 0.00 5.26 0.63 -1.26 -5.05 116.66 109.36 1p9k n ARG 6 Ca 0.01 2.92 -0.00 0.00 -0.92 0.00 0.00 57.85 59.85 1p9k n ARG 6 Cb 0.36 -4.93 -0.00 0.00 0.45 0.00 0.00 32.46 28.33 1p9k n ARG 6 CO 0.00 0.00 0.00 -0.12 -2.51 0.00 0.00 177.63 175.00 1p9k n MET 7 N 1.07 0.01 -3.57 -0.14 1.56 -1.26 -4.98 117.12 109.82 1p9k n MET 7 Ca -0.18 0.00 -0.41 0.00 -0.27 0.00 0.00 57.70 56.84 1p9k n MET 7 Cb 0.28 -0.18 -0.09 0.00 2.15 0.00 0.00 33.22 35.37 1p9k n MET 7 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 1p9k s SER 8 N -4.78 5.72 0.35 6.12 0.15 -1.26 -5.08 113.70 114.92 1p9k s SER 8 Ca -0.00 -1.50 -0.08 0.00 0.70 0.00 0.00 55.95 55.06 1p9k s SER 8 Cb 0.00 -2.02 -0.06 0.00 -1.71 0.00 0.00 66.02 62.23 1p9k s SER 8 CO 0.01 -0.56 0.68 0.20 1.20 0.00 0.00 173.24 174.76 1p9k s ASN 9 N 2.23 6.51 0.67 5.45 0.01 -1.26 -5.07 114.94 123.47 1p9k s ASN 9 Ca 0.03 0.97 -0.14 0.00 -0.71 0.00 0.00 52.86 53.01 1p9k s ASN 9 Cb -0.23 -2.25 0.00 0.00 0.41 0.00 0.00 41.25 39.18 1p9k s ASN 9 CO 0.03 -0.30 1.09 -0.04 -1.51 0.00 0.00 177.10 176.36 1p9k s MET 10 N -3.65 2.86 -0.15 -0.60 -1.94 -1.26 -5.03 119.30 109.52 1p9k s MET 10 Ca 0.48 1.25 -0.10 0.00 -1.71 0.00 0.00 55.69 55.61 1p9k s MET 10 Cb -0.10 -1.97 -0.05 0.00 2.01 0.00 0.00 34.83 34.72 1p9k s MET 10 CO 0.30 -1.19 0.19 0.00 -0.01 0.00 0.00 175.02 174.31 1p9k s ALA 11 N -2.55 3.74 -0.05 3.03 0.00 -1.26 -5.05 121.76 119.61 1p9k s ALA 11 Ca 0.64 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 52.04 1p9k s ALA 11 Cb -0.18 -2.16 0.01 0.00 0.00 0.00 0.00 23.12 20.79 1p9k s ALA 11 CO 0.44 0.33 -0.13 0.95 0.00 0.00 0.00 175.76 177.36 1p9k s THR 12 N -0.22 1.15 0.07 0.00 -4.23 -1.25 -1.03 115.64 110.13 1p9k s THR 12 Ca 0.13 -0.52 0.05 0.00 -1.18 0.00 0.00 61.69 60.17 1p9k s THR 12 Cb -0.12 -1.03 -0.04 0.00 1.34 0.00 0.00 72.50 72.65 1p9k s THR 12 CO 0.02 0.35 -0.04 0.12 -0.54 0.00 0.00 174.62 174.54 1p9k s PHE 13 N 0.43 2.92 0.03 3.99 5.36 0.17 -4.96 117.98 125.93 1p9k s PHE 13 Ca -0.10 -0.05 0.02 0.00 -0.96 0.00 0.00 56.93 55.84 1p9k s PHE 13 Cb -0.14 -1.53 -0.04 0.00 -0.34 0.00 0.00 43.02 40.97 1p9k s PHE 13 CO 0.03 0.45 0.04 -1.12 -1.46 0.00 0.00 175.22 173.16 1p9k s SER 14 N -2.08 5.35 -0.08 6.13 0.01 -1.26 -0.28 113.70 121.50 1p9k s SER 14 Ca 0.23 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.50 1p9k s SER 14 Cb -0.11 -1.43 -0.05 0.00 0.21 0.00 0.00 66.02 64.64 1p9k s SER 14 CO 0.15 0.24 -0.07 0.18 0.41 0.00 0.00 173.24 174.15 1p9k n LEU 15 N 1.00 2.89 0.00 2.44 4.77 -0.07 -4.91 117.00 123.11 1p9k n LEU 15 Ca -0.12 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1p9k n LEU 15 Cb 0.52 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1p9k n LEU 15 CO 0.38 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1p9k n GLY 16 N 3.11 1.03 2.55 -0.72 0.00 0.27 -4.41 105.19 107.03 1p9k n GLY 16 Ca -0.13 -0.76 -0.11 0.00 0.00 0.00 0.00 46.02 45.01 1p9k n GLY 16 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1p9k n LYS 17 N 0.00 1.06 -4.14 1.61 2.85 -1.26 -4.78 118.16 113.49 1p9k n LYS 17 Ca 0.00 -2.54 -0.24 0.00 -1.05 0.00 0.00 58.31 54.48 1p9k n LYS 17 Cb 0.00 -1.08 -0.07 0.00 -0.65 0.00 0.00 35.03 33.23 1p9k n LYS 17 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 1p9k s HIS 18 N -1.06 2.63 0.42 5.58 3.76 -1.26 -5.03 115.29 120.34 1p9k s HIS 18 Ca 0.28 -0.49 0.09 0.00 -0.15 0.00 0.00 55.06 54.79 1p9k s HIS 18 Cb 0.35 -1.77 0.92 0.00 1.11 0.00 0.00 32.58 33.20 1p9k s HIS 18 CO -0.05 0.29 2.07 -1.00 -0.85 0.00 0.00 174.74 175.19 1p9k h PRO 19 N 1.53 0.47 0.00 8.40 0.13 -1.98 -3.48 132.00 137.07 1p9k h PRO 19 Ca -0.43 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1p9k h PRO 19 Cb 1.25 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1p9k h PRO 19 CO 0.67 0.31 0.00 -2.39 -0.23 0.00 0.00 178.00 176.36 1p9k n HIS 20 N -4.48 0.00 -3.94 1.56 1.44 -1.26 -4.64 115.22 103.89 1p9k n HIS 20 Ca 0.03 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.64 1p9k n HIS 20 Cb 0.08 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.09 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 0.13 0.14 0.61 -7.23 -1.23 -4.98 120.40 104.84 1p9k s VAL 21 Ca 0.00 -1.08 -0.26 0.00 -1.81 0.00 0.00 61.98 58.83 1p9k s VAL 21 Cb 0.00 -0.79 -0.07 0.00 0.56 0.00 0.00 36.38 36.08 1p9k s VAL 21 CO 0.00 -0.59 0.80 -0.70 -0.31 0.00 0.00 175.10 174.30 1p9k s GLU 22 N -2.39 4.59 0.49 4.82 2.12 -1.26 -3.39 118.70 123.68 1p9k s GLU 22 Ca -0.07 1.19 0.40 0.00 0.36 0.00 0.00 54.97 56.85 1p9k s GLU 22 Cb -0.03 -3.30 1.58 0.00 0.26 0.00 0.00 34.13 32.65 1p9k s GLU 22 CO -0.04 0.47 1.60 1.37 -0.54 0.00 0.00 175.26 178.13 1p9k h LEU 23 N 4.71 0.12 -0.34 2.70 8.10 -1.85 1.35 115.31 130.09 1p9k h LEU 23 Ca -0.46 0.08 -0.18 0.00 0.11 0.00 0.00 57.88 57.43 1p9k h LEU 23 Cb 1.21 0.08 -0.00 0.00 -0.44 0.00 0.00 40.66 41.50 1p9k h LEU 23 CO 0.68 -0.12 -0.55 0.00 -4.11 0.00 0.00 178.44 174.33 1p9k h ASP 25 N 0.62 -0.23 -0.41 0.00 3.32 0.14 0.49 116.42 120.36 1p9k h ASP 25 Ca 0.01 -0.10 0.03 0.00 0.02 0.00 0.00 57.03 56.99 1p9k h ASP 25 Cb 1.15 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.73 1p9k h ASP 25 CO 0.12 -0.04 0.22 0.25 -1.72 0.00 0.00 179.24 178.06 1p9k h LEU 26 N -0.40 0.33 0.60 1.55 5.85 -1.43 -1.85 115.31 119.95 1p9k h LEU 26 Ca -0.03 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1p9k h LEU 26 Cb 0.31 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 41.30 1p9k h LEU 26 CO 0.05 0.24 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.02 1p9k h LEU 27 N 0.44 -0.68 -0.16 2.25 4.07 -1.24 -2.36 115.31 117.62 1p9k h LEU 27 Ca 0.17 0.02 0.02 0.00 0.08 0.00 0.00 57.88 58.18 1p9k h LEU 27 Cb 0.06 0.18 -0.04 0.00 1.08 0.00 0.00 40.66 41.94 1p9k h LEU 27 CO -0.11 -0.32 -0.26 0.50 -1.08 0.00 0.00 178.44 177.17 1p9k h LYS 28 N -1.15 -0.20 -0.90 1.13 3.64 -0.02 0.30 116.57 119.36 1p9k h LYS 28 Ca -0.08 0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.46 1p9k h LYS 28 Cb 0.62 0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 32.39 1p9k h LYS 28 CO 0.14 -0.14 0.51 -0.07 -2.27 0.00 0.00 179.45 177.62 1p9k h LEU 29 N -0.21 0.66 -0.61 5.20 -0.00 -1.47 0.95 115.31 119.81 1p9k h LEU 29 Ca 0.03 0.08 0.00 0.00 -0.00 0.00 0.00 57.88 57.99 1p9k h LEU 29 Cb 0.29 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 40.92 1p9k h LEU 29 CO -0.26 0.29 0.00 -0.33 -0.00 0.00 0.00 178.44 178.13 1p9k h GLU 30 N 0.72 0.00 0.00 1.13 4.39 -0.79 -3.46 114.58 116.57 1p9k h GLU 30 Ca 0.49 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.19 1p9k h GLU 30 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1p9k h GLU 30 CO -0.34 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 177.92 1p9k n GLY 31 N 0.30 1.32 0.05 -3.84 0.00 0.33 -5.03 105.19 98.32 1p9k n GLY 31 Ca 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.09 -2.94 1.61 4.06 -0.70 -3.47 115.95 114.42 1p9k h TRP 32 Ca 0.00 -0.00 -0.63 0.00 2.06 0.00 0.00 58.89 60.32 1p9k h TRP 32 Cb 0.15 0.03 -0.05 0.00 -1.00 0.00 0.00 29.16 28.29 1p9k h TRP 32 CO 0.00 -0.06 -0.52 0.45 -3.56 0.00 0.00 178.44 174.76 1p9k s SER 33 N -3.79 6.21 0.08 -3.49 0.15 -1.26 -5.00 113.70 106.60 1p9k s SER 33 Ca -0.01 0.23 -0.02 0.00 0.70 0.00 0.00 55.95 56.85 1p9k s SER 33 Cb 0.00 -1.88 -0.27 0.00 -1.71 0.00 0.00 66.02 62.16 1p9k s SER 33 CO 0.04 0.19 1.15 -0.33 1.20 0.00 0.00 173.24 175.49 1p9k h GLU 34 N 3.25 0.22 0.00 5.44 3.07 -1.94 -3.37 114.58 121.25 1p9k h GLU 34 Ca -0.46 -0.38 -0.27 0.00 -0.50 0.00 0.00 59.36 57.76 1p9k h GLU 34 Cb 1.17 0.14 -0.05 0.00 -0.84 0.00 0.00 28.75 29.17 1p9k h GLU 34 CO 0.73 1.17 -2.00 0.43 -1.40 0.00 0.00 179.01 177.94 1p9k n SER 35 N -3.49 1.66 0.00 1.42 7.64 -1.26 -5.06 113.62 114.53 1p9k n SER 35 Ca -0.07 -0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.79 1p9k n SER 35 Cb 1.01 0.63 0.00 0.00 -1.01 0.00 0.00 64.21 64.84 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 2.21 2.94 0.00 0.23 0.00 -1.26 -4.75 105.19 104.56 1p9k n GLY 36 Ca -0.25 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 1.49 0.15 4.61 0.00 -1.26 -3.74 120.51 121.75 1p9k n ALA 37 Ca 0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 53.44 52.69 1p9k n ALA 37 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1p9k n ALA 37 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1p9k h GLN 38 N 0.00 -0.53 -0.36 0.00 5.75 -1.99 -2.00 115.11 115.98 1p9k h GLN 38 Ca 0.00 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1p9k h GLN 38 Cb 0.61 0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.28 1p9k h GLN 38 CO 0.00 -0.35 0.00 0.00 -2.65 0.00 0.00 178.83 175.83 1p9k n ALA 39 N -2.60 2.14 -1.10 3.38 0.00 -1.26 -4.77 120.51 116.30 1p9k n ALA 39 Ca -0.06 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.34 1p9k n ALA 39 Cb 0.26 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 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 -0.17 -0.69 0.15 0.00 4.76 -0.75 -4.87 118.16 116.59 1p9k n LYS 40 Ca 0.00 0.44 0.12 0.00 -2.87 0.00 0.00 58.31 56.00 1p9k n LYS 40 Cb 0.09 -4.13 0.55 0.00 -1.84 0.00 0.00 35.03 29.70 1p9k n LYS 40 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1p9k n ILE 41 N -2.67 0.90 0.00 -0.18 5.41 -1.26 -1.93 119.36 119.62 1p9k n ILE 41 Ca -0.03 0.46 0.00 0.00 1.00 0.00 0.00 62.75 64.18 1p9k n ILE 41 Cb 0.22 -1.43 0.00 0.00 -0.71 0.00 0.00 39.64 37.72 1p9k n ILE 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1p9k n ALA 42 N -1.79 -0.00 -0.19 -1.39 0.00 -1.25 -1.51 120.51 114.38 1p9k n ALA 42 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.65 1p9k n ALA 42 Cb 0.14 0.00 0.58 0.00 0.00 0.00 0.00 19.45 20.18 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 0.67 0.00 0.00 1.08 -1.89 -2.72 117.51 114.65 1p9k h ILE 43 Ca 0.00 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 1p9k h ILE 43 Cb 0.00 0.38 0.00 0.00 -3.07 0.00 0.00 36.82 34.13 1p9k h ILE 43 CO 0.00 0.05 0.00 0.00 -0.69 0.00 0.00 178.15 177.51 1p9k n ALA 44 N -2.58 -0.33 -0.25 1.87 0.00 -0.81 -1.83 120.51 116.58 1p9k n ALA 44 Ca 0.17 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.84 1p9k n ALA 44 Cb 0.73 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.60 1p9k n ALA 44 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1p9k n GLU 45 N -1.67 -0.05 0.00 0.00 0.00 -0.57 -0.91 120.64 117.44 1p9k n GLU 45 Ca 0.00 1.07 0.00 0.00 0.00 0.00 0.00 57.16 58.23 1p9k n GLU 45 Cb 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 31.44 29.55 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 -1.23 -2.19 0.00 8.31 0.00 -1.05 -2.85 105.19 106.18 1p9k n GLY 46 Ca 0.27 0.00 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 -1.43 0.00 0.00 1.61 -0.00 -0.09 -3.42 117.38 114.06 1p9k n GLN 47 Ca 0.00 0.19 0.00 0.00 -0.00 0.00 0.00 57.00 57.19 1p9k n GLN 47 Cb 0.00 -1.79 0.00 0.00 -0.00 0.00 0.00 30.24 28.45 1p9k n GLN 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1p9k n VAL 48 N -1.18 0.00 -3.45 -0.39 0.31 -0.29 -4.85 118.33 108.48 1p9k n VAL 48 Ca 0.00 0.12 0.01 0.00 -0.01 0.00 0.00 64.34 64.46 1p9k n VAL 48 Cb 0.29 -0.39 -0.04 0.00 -0.91 0.00 0.00 33.84 32.79 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 0.38 0.19 5.55 -0.14 -1.05 -4.87 119.74 119.79 1p9k s LYS 49 Ca 0.00 0.93 0.09 0.00 -1.36 0.00 0.00 55.97 55.62 1p9k s LYS 49 Cb 0.00 0.56 -0.04 0.00 -1.68 0.00 0.00 37.83 36.67 1p9k s LYS 49 CO 0.00 -0.15 -0.07 0.08 -0.76 0.00 0.00 175.35 174.45 1p9k s VAL 50 N 2.60 3.31 -0.89 3.17 1.01 -0.84 -1.07 120.40 127.69 1p9k s VAL 50 Ca -0.03 -1.64 -0.27 0.00 0.00 0.00 0.00 61.98 60.05 1p9k s VAL 50 Cb -0.08 -2.66 -0.20 0.00 0.00 0.00 0.00 36.38 33.44 1p9k s VAL 50 CO -0.18 -0.13 2.56 -0.67 0.00 0.00 0.00 175.10 176.68 1p9k n ASP 51 N -0.08 0.50 -1.56 3.32 -0.08 0.12 0.10 116.55 118.89 1p9k n ASP 51 Ca -0.10 -0.13 -0.19 0.00 -1.51 0.00 0.00 54.79 52.86 1p9k n ASP 51 Cb 0.56 -1.03 -0.07 0.00 2.34 0.00 0.00 41.12 42.92 1p9k n ASP 51 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1p9k n GLY 52 N 6.28 1.52 2.50 0.27 0.00 -1.26 -4.86 105.19 109.64 1p9k n GLY 52 Ca 0.60 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 46.31 1p9k n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p9k n ALA 53 N 0.88 1.48 -1.96 4.61 0.00 0.29 -5.03 120.51 120.78 1p9k n ALA 53 Ca -0.19 -2.50 -0.41 0.00 0.00 0.00 0.00 53.44 50.34 1p9k n ALA 53 Cb 0.63 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 1p9k n ALA 53 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1p9k n VAL 54 N 2.85 4.84 -3.16 0.00 3.14 -1.26 -1.98 118.33 122.76 1p9k n VAL 54 Ca 0.26 -4.04 -0.20 0.00 -2.96 0.00 0.00 64.34 57.39 1p9k n VAL 54 Cb 0.50 -2.24 0.05 0.00 -1.06 0.00 0.00 33.84 31.10 1p9k n VAL 54 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1p9k s GLU 55 N -0.16 2.31 -0.26 1.45 2.02 -1.26 -4.93 118.70 117.86 1p9k s GLU 55 Ca 0.53 -1.69 0.22 0.00 0.02 0.00 0.00 54.97 54.05 1p9k s GLU 55 Cb 0.16 -2.57 0.51 0.00 0.10 0.00 0.00 34.13 32.33 1p9k s GLU 55 CO -0.07 -0.82 1.10 -2.37 0.02 0.00 0.00 175.26 173.13 1p9k n THR 56 N -2.17 1.30 -2.30 3.63 5.66 -1.26 -1.23 114.28 117.91 1p9k n THR 56 Ca 0.13 -2.97 -0.26 0.00 -3.05 0.00 0.00 64.05 57.90 1p9k n THR 56 Cb 0.62 1.19 0.11 0.00 -1.55 0.00 0.00 70.33 70.69 1p9k n THR 56 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1p9k s ARG 57 N -3.76 1.69 -0.08 1.09 0.52 -1.26 -4.71 118.95 112.44 1p9k s ARG 57 Ca 0.28 -0.61 -0.27 0.00 -0.52 0.00 0.00 55.73 54.60 1p9k s ARG 57 Cb 0.33 -2.17 -0.23 0.00 0.52 0.00 0.00 34.95 33.40 1p9k s ARG 57 CO -0.03 -1.54 0.99 0.87 0.02 0.00 0.00 175.30 175.61 1p9k h LYS 58 N -0.76 -0.01 -5.75 3.54 1.57 -1.97 -3.45 116.57 109.74 1p9k h LYS 58 Ca -0.42 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.70 1p9k h LYS 58 Cb 1.28 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.43 1p9k h LYS 58 CO 0.48 0.73 -0.61 -0.98 -0.57 0.00 0.00 179.45 178.50 1p9k s ARG 59 N -3.16 3.27 -0.34 3.15 1.70 -1.26 -4.12 118.95 118.18 1p9k s ARG 59 Ca -0.17 -0.40 -0.13 0.00 -0.47 0.00 0.00 55.73 54.56 1p9k s ARG 59 Cb -0.01 -2.90 -0.02 0.00 -0.57 0.00 0.00 34.95 31.46 1p9k s ARG 59 CO 0.67 0.57 0.24 0.00 -1.08 0.00 0.00 175.30 175.70 1p9k n LYS 61 N 5.10 3.37 -4.29 0.00 5.02 -1.26 -3.54 118.16 122.56 1p9k n LYS 61 Ca -0.13 -3.54 -0.18 0.00 -2.02 0.00 0.00 58.31 52.45 1p9k n LYS 61 Cb 0.50 -3.10 -0.14 0.00 -0.02 0.00 0.00 35.03 32.27 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 1.78 0.71 0.30 -0.18 -1.09 -1.26 -5.02 121.20 116.43 1p9k s ILE 62 Ca 0.44 -0.56 -0.04 0.00 -2.23 0.00 0.00 60.65 58.26 1p9k s ILE 62 Cb 0.04 -0.63 -0.01 0.00 -1.58 0.00 0.00 42.46 40.28 1p9k s ILE 62 CO 0.01 0.07 0.40 0.68 -1.23 0.00 0.00 174.94 174.87 1p9k s VAL 63 N -0.47 0.00 0.00 2.92 -7.23 -1.26 -3.64 120.40 110.72 1p9k s VAL 63 Ca 0.01 -1.66 0.00 0.00 -1.81 0.00 0.00 61.98 58.52 1p9k s VAL 63 Cb -0.05 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.38 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 -0.48 0.00 -2.76 1.32 0.00 -1.26 -4.36 120.51 112.97 1p9k n ALA 64 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 1p9k n ALA 64 Cb 0.62 0.00 -0.00 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 -0.83 1.97 0.21 0.00 0.00 -1.25 -3.16 107.32 104.26 1p9k s GLY 65 Ca 0.00 -3.07 0.10 0.00 0.00 0.00 0.00 44.72 41.75 1p9k s GLY 65 CO 0.00 2.39 -0.20 1.20 0.00 0.00 0.00 173.10 176.49 1p9k s GLN 66 N 3.02 1.47 0.15 2.90 -1.52 0.26 -4.92 119.66 121.03 1p9k s GLN 66 Ca 0.48 -1.56 0.08 0.00 -1.95 0.00 0.00 55.36 52.41 1p9k s GLN 66 Cb 0.00 -1.61 -0.04 0.00 -0.22 0.00 0.00 33.01 31.14 1p9k s GLN 66 CO 0.03 0.33 -0.09 0.99 -0.25 0.00 0.00 175.29 176.29 1p9k s THR 67 N -2.10 3.30 0.06 -0.19 2.01 -1.26 0.13 115.64 117.58 1p9k s THR 67 Ca 0.22 -1.50 0.06 0.00 0.31 0.00 0.00 61.69 60.78 1p9k s THR 67 Cb -0.06 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.82 1p9k s THR 67 CO 0.10 -0.03 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.13 1p9k s VAL 68 N -1.53 1.42 -0.05 3.82 1.01 0.12 0.15 120.40 125.35 1p9k s VAL 68 Ca 0.24 -1.23 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 1p9k s VAL 68 Cb -0.10 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 35.02 1p9k s VAL 68 CO 0.15 0.02 0.12 -0.44 0.00 0.00 0.00 175.10 174.95 1p9k s SER 69 N -1.41 -0.11 -0.10 3.32 0.01 -0.23 -1.97 113.70 113.20 1p9k s SER 69 Ca 0.04 0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.50 1p9k s SER 69 Cb -0.09 0.22 0.05 0.00 0.21 0.00 0.00 66.02 66.41 1p9k s SER 69 CO 0.02 -0.06 0.20 0.12 0.41 0.00 0.00 173.24 173.93 1p9k s PHE 70 N 0.30 -0.28 0.00 2.43 5.36 -0.44 -2.52 117.98 122.84 1p9k s PHE 70 Ca -0.02 0.75 0.00 0.00 -0.96 0.00 0.00 56.93 56.70 1p9k s PHE 70 Cb -0.03 -0.14 0.00 0.00 -0.34 0.00 0.00 43.02 42.51 1p9k s PHE 70 CO -0.01 -0.29 0.00 0.00 -1.46 0.00 0.00 175.22 173.46 1p9k n ALA 71 N 5.15 0.00 -0.15 11.12 0.00 -1.26 0.12 120.51 135.49 1p9k n ALA 71 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1p9k n ALA 71 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 0.00 0.29 3.49 0.00 0.00 -1.26 -4.99 105.19 102.72 1p9k n GLY 72 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.38 2.82 -0.31 1.61 3.76 0.32 -5.00 115.29 118.11 1p9k s HIS 73 Ca 0.00 -0.25 0.00 0.00 -0.15 0.00 0.00 55.06 54.67 1p9k s HIS 73 Cb 0.00 -4.01 0.07 0.00 1.11 0.00 0.00 32.58 29.75 1p9k s HIS 73 CO 0.00 -1.35 0.01 -1.12 -0.85 0.00 0.00 174.74 171.43 1p9k s SER 74 N 3.00 4.80 0.16 1.40 0.01 -1.26 -1.32 113.70 120.49 1p9k s SER 74 Ca 0.25 -1.58 0.08 0.00 1.31 0.00 0.00 55.95 56.01 1p9k s SER 74 Cb -0.15 -1.67 -0.04 0.00 0.21 0.00 0.00 66.02 64.37 1p9k s SER 74 CO 0.16 -0.30 -0.17 -0.69 0.41 0.00 0.00 173.24 172.65 1p9k s VAL 75 N 1.13 1.71 0.23 3.43 1.01 -0.83 -4.68 120.40 122.40 1p9k s VAL 75 Ca -0.01 -1.93 0.09 0.00 0.00 0.00 0.00 61.98 60.12 1p9k s VAL 75 Cb -0.20 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1p9k s VAL 75 CO -0.04 -0.38 -0.01 -1.10 0.00 0.00 0.00 175.10 173.57 1p9k s GLN 76 N -2.92 2.32 0.01 2.72 -0.21 -0.19 -0.70 119.66 120.69 1p9k s GLN 76 Ca 0.16 -1.31 -0.01 0.00 0.02 0.00 0.00 55.36 54.22 1p9k s GLN 76 Cb -0.05 -2.23 -0.01 0.00 1.00 0.00 0.00 33.01 31.72 1p9k s GLN 76 CO 0.06 0.40 -0.01 0.08 -2.12 0.00 0.00 175.29 173.70 1p9k s VAL 77 N -2.09 0.09 0.31 1.09 1.01 0.34 0.46 120.40 121.61 1p9k s VAL 77 Ca 0.30 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.62 1p9k s VAL 77 Cb -0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 1p9k s VAL 77 CO 0.19 -0.39 0.26 0.68 0.00 0.00 0.00 175.10 175.84 1p9k s VAL 78 N -1.16 0.00 -2.00 2.92 -7.23 0.62 0.92 120.40 114.47 1p9k s VAL 78 Ca -0.13 -2.00 0.26 0.00 -1.81 0.00 0.00 61.98 58.30 1p9k s VAL 78 Cb -0.08 -2.50 0.74 0.00 0.56 0.00 0.00 36.38 35.10 1p9k s VAL 78 CO -0.01 0.00 1.90 0.00 -0.31 0.00 0.00 175.10 176.69