#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 -5.46 -4.63 1.61 7.64 -1.26 -4.97 113.62 106.56 1p9k n SER 2 Ca 0.00 -0.21 -0.40 0.00 1.01 0.00 0.00 58.87 59.27 1p9k n SER 2 Cb 0.00 -4.33 -0.07 0.00 -1.01 0.00 0.00 64.21 58.80 1p9k n SER 2 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1p9k s MET 3 N -5.44 4.10 -0.25 1.43 -2.45 -1.26 -5.05 119.30 110.38 1p9k s MET 3 Ca 0.22 0.36 -0.07 0.00 -1.25 0.00 0.00 55.69 54.95 1p9k s MET 3 Cb -0.10 -3.63 -0.03 0.00 1.25 0.00 0.00 34.83 32.32 1p9k s MET 3 CO 0.28 -0.31 0.07 0.96 1.05 0.00 0.00 175.02 177.07 1p9k s ILE 4 N 2.17 4.30 0.23 10.11 -4.36 -1.26 -5.08 121.20 127.31 1p9k s ILE 4 Ca 0.22 -0.19 -0.30 0.00 -0.26 0.00 0.00 60.65 60.13 1p9k s ILE 4 Cb -0.16 -3.02 -0.09 0.00 1.25 0.00 0.00 42.46 40.45 1p9k s ILE 4 CO 0.09 0.33 1.06 -1.00 0.24 0.00 0.00 174.94 175.66 1p9k s HIS 5 N 1.61 3.68 0.11 1.37 3.76 -1.26 -5.05 115.29 119.51 1p9k s HIS 5 Ca 0.06 1.72 0.05 0.00 -0.15 0.00 0.00 55.06 56.74 1p9k s HIS 5 Cb -0.15 -3.21 -0.04 0.00 1.11 0.00 0.00 32.58 30.29 1p9k s HIS 5 CO 0.04 -0.33 0.00 1.03 -0.85 0.00 0.00 174.74 174.63 1p9k s ARG 6 N -0.97 2.52 -0.24 1.40 1.81 -1.26 -5.04 118.95 117.18 1p9k s ARG 6 Ca 0.45 -0.90 -0.06 0.00 -1.72 0.00 0.00 55.73 53.50 1p9k s ARG 6 Cb -0.29 -2.50 -0.12 0.00 -0.45 0.00 0.00 34.95 31.58 1p9k s ARG 6 CO 0.37 0.52 -0.27 -1.33 -0.68 0.00 0.00 175.30 173.91 1p9k n MET 7 N 0.37 0.54 -1.73 3.54 2.81 -1.26 -4.98 117.12 116.41 1p9k n MET 7 Ca -0.10 0.19 -0.42 0.00 -1.81 0.00 0.00 57.70 55.55 1p9k n MET 7 Cb 0.53 -1.40 -0.01 0.00 -0.71 0.00 0.00 33.22 31.62 1p9k n MET 7 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1p9k n SER 8 N -3.69 3.41 -4.19 7.83 2.88 -1.26 -4.97 113.62 113.63 1p9k n SER 8 Ca -0.45 1.17 -0.38 0.00 -1.33 0.00 0.00 58.87 57.89 1p9k n SER 8 Cb 0.88 -1.54 -0.11 0.00 -0.75 0.00 0.00 64.21 62.68 1p9k n SER 8 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1p9k s ASN 9 N 0.18 5.38 0.40 -3.46 -0.87 -1.26 -5.08 114.94 110.23 1p9k s ASN 9 Ca 0.61 -1.71 -0.26 0.00 -1.57 0.00 0.00 52.86 49.93 1p9k s ASN 9 Cb -0.54 -1.89 -0.09 0.00 -0.02 0.00 0.00 41.25 38.72 1p9k s ASN 9 CO 0.54 -0.51 1.25 -0.32 -2.57 0.00 0.00 177.10 175.49 1p9k s MET 10 N 1.28 4.02 -0.99 -0.60 1.75 -1.26 -4.86 119.30 118.64 1p9k s MET 10 Ca 0.04 2.03 -0.25 0.00 -1.25 0.00 0.00 55.69 56.26 1p9k s MET 10 Cb -0.23 -2.74 -0.14 0.00 2.84 0.00 0.00 34.83 34.56 1p9k s MET 10 CO -0.01 -0.41 2.12 0.00 -0.65 0.00 0.00 175.02 176.07 1p9k s ALA 11 N -1.31 1.03 -0.18 4.11 0.00 -1.26 -4.83 121.76 119.32 1p9k s ALA 11 Ca 0.57 -1.45 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 1p9k s ALA 11 Cb -0.35 -4.64 0.06 0.00 0.00 0.00 0.00 23.12 18.19 1p9k s ALA 11 CO 0.45 -5.92 0.09 0.95 0.00 0.00 0.00 175.76 171.33 1p9k s THR 12 N 13.91 -0.05 0.46 0.00 -4.23 -1.25 -1.66 115.64 122.82 1p9k s THR 12 Ca 0.80 -0.22 0.07 0.00 -1.18 0.00 0.00 61.69 61.15 1p9k s THR 12 Cb -0.07 -0.63 0.02 0.00 1.34 0.00 0.00 72.50 73.17 1p9k s THR 12 CO 0.11 -0.30 0.63 0.12 -0.54 0.00 0.00 174.62 174.63 1p9k s PHE 13 N 2.12 2.72 -0.10 3.99 5.36 0.20 -4.93 117.98 127.34 1p9k s PHE 13 Ca 0.02 -0.34 -0.03 0.00 -0.96 0.00 0.00 56.93 55.62 1p9k s PHE 13 Cb -0.16 -2.45 -0.03 0.00 -0.34 0.00 0.00 43.02 40.04 1p9k s PHE 13 CO -0.11 -0.56 0.00 -1.12 -1.46 0.00 0.00 175.22 171.97 1p9k s SER 14 N -4.39 5.23 0.00 6.13 0.01 -1.26 -0.93 113.70 118.49 1p9k s SER 14 Ca 0.56 0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.93 1p9k s SER 14 Cb -0.10 -1.55 0.00 0.00 0.21 0.00 0.00 66.02 64.58 1p9k s SER 14 CO 0.34 0.34 0.00 -0.11 0.41 0.00 0.00 173.24 174.23 1p9k n LEU 15 N 2.40 1.02 -0.32 2.44 -0.00 -0.68 -4.80 117.00 117.06 1p9k n LEU 15 Ca -0.18 0.00 0.35 0.00 -0.00 0.00 0.00 56.01 56.18 1p9k n LEU 15 Cb 0.53 0.00 0.67 0.00 -0.00 0.00 0.00 43.42 44.62 1p9k n LEU 15 CO 0.29 0.17 1.33 1.23 -0.00 0.00 0.00 177.39 180.41 1p9k h GLY 16 N 0.00 0.00 0.55 -3.96 0.00 -1.69 0.27 103.07 98.23 1p9k h GLY 16 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.43 1p9k h GLY 16 CO 0.00 0.00 0.58 0.50 0.00 0.00 0.00 176.54 177.62 1p9k h LYS 17 N 0.00 0.94 -6.05 4.80 1.57 -1.87 -3.43 116.57 112.54 1p9k h LYS 17 Ca 0.58 -0.06 -0.61 0.00 -1.87 0.00 0.00 60.65 58.69 1p9k h LYS 17 Cb 2.70 -0.21 -0.13 0.00 0.08 0.00 0.00 32.23 34.67 1p9k h LYS 17 CO -0.01 0.62 -0.71 -1.01 -0.57 0.00 0.00 179.45 177.78 1p9k s HIS 18 N -6.00 2.38 0.55 -1.35 3.76 0.94 -5.03 115.29 110.53 1p9k s HIS 18 Ca -0.12 -0.43 0.22 0.00 -0.15 0.00 0.00 55.06 54.58 1p9k s HIS 18 Cb 0.21 -1.24 1.52 0.00 1.11 0.00 0.00 32.58 34.17 1p9k s HIS 18 CO 0.80 0.63 2.19 -1.00 -0.85 0.00 0.00 174.74 176.51 1p9k h PRO 19 N 2.10 0.00 0.00 8.40 0.13 -1.84 -3.47 132.00 137.32 1p9k h PRO 19 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1p9k h PRO 19 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1p9k h PRO 19 CO 0.66 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.04 1p9k n HIS 20 N -4.22 0.00 -4.04 1.56 1.44 -1.26 -4.77 115.22 103.93 1p9k n HIS 20 Ca -0.02 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.59 1p9k n HIS 20 Cb 0.11 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.14 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 -2.00 0.04 -0.04 0.61 -7.23 -1.24 -4.98 120.40 105.55 1p9k s VAL 21 Ca 0.00 -1.58 -0.04 0.00 -1.81 0.00 0.00 61.98 58.55 1p9k s VAL 21 Cb 0.00 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 1p9k s VAL 21 CO 0.00 -0.20 0.16 -0.70 -0.31 0.00 0.00 175.10 174.05 1p9k s GLU 22 N -4.03 3.41 0.30 4.82 2.12 -1.26 -3.73 118.70 120.33 1p9k s GLU 22 Ca 0.23 -0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.29 1p9k s GLU 22 Cb 0.04 -3.11 0.71 0.00 0.26 0.00 0.00 34.13 32.03 1p9k s GLU 22 CO 0.04 0.71 1.58 1.37 -0.54 0.00 0.00 175.26 178.42 1p9k h LEU 23 N 4.19 -0.50 -1.04 2.70 8.10 -1.84 1.04 115.31 127.96 1p9k h LEU 23 Ca -0.51 0.27 -0.03 0.00 0.11 0.00 0.00 57.88 57.73 1p9k h LEU 23 Cb 1.20 0.48 -0.03 0.00 -0.44 0.00 0.00 40.66 41.87 1p9k h LEU 23 CO 0.65 -0.34 0.32 0.00 -4.11 0.00 0.00 178.44 174.96 1p9k h ASP 25 N 0.99 -0.62 -0.84 0.00 3.32 0.65 0.39 116.42 120.32 1p9k h ASP 25 Ca 0.24 -0.05 0.07 0.00 0.02 0.00 0.00 57.03 57.31 1p9k h ASP 25 Cb 0.13 0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.77 1p9k h ASP 25 CO -0.03 -0.25 0.51 0.25 -1.72 0.00 0.00 179.24 178.00 1p9k h LEU 26 N -1.03 0.78 0.56 1.55 6.46 -0.99 -0.35 115.31 122.30 1p9k h LEU 26 Ca -0.07 0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.68 1p9k h LEU 26 Cb 0.63 -0.13 0.01 0.00 -0.73 0.00 0.00 40.66 40.43 1p9k h LEU 26 CO 0.12 0.49 -0.27 -0.07 -0.62 0.00 0.00 178.44 178.09 1p9k h LEU 27 N 0.91 -0.64 -0.29 2.25 4.07 -1.02 -2.10 115.31 118.49 1p9k h LEU 27 Ca 0.38 0.02 0.06 0.00 0.08 0.00 0.00 57.88 58.42 1p9k h LEU 27 Cb 0.22 0.16 -0.08 0.00 1.08 0.00 0.00 40.66 42.04 1p9k h LEU 27 CO -0.19 -0.34 -0.36 0.50 -1.08 0.00 0.00 178.44 176.96 1p9k h LYS 28 N -0.97 -0.33 -1.00 1.13 3.64 -0.83 -0.32 116.57 117.89 1p9k h LYS 28 Ca -0.08 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.47 1p9k h LYS 28 Cb 0.58 0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 32.38 1p9k h LYS 28 CO 0.13 -0.22 0.62 -0.07 -2.27 0.00 0.00 179.45 177.63 1p9k h LEU 29 N -0.34 0.87 -0.51 5.20 3.38 -1.15 0.24 115.31 123.00 1p9k h LEU 29 Ca 0.13 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1p9k h LEU 29 Cb 0.57 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1p9k h LEU 29 CO -0.48 0.41 0.00 -0.33 0.09 0.00 0.00 178.44 178.13 1p9k h GLU 30 N 0.91 0.00 0.00 1.13 4.39 -0.41 -3.47 114.58 117.14 1p9k h GLU 30 Ca 0.52 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.22 1p9k h GLU 30 Cb 0.62 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1p9k h GLU 30 CO -0.31 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 177.95 1p9k n GLY 31 N 0.45 1.16 0.21 -3.84 0.00 0.84 -5.02 105.19 98.99 1p9k n GLY 31 Ca 0.03 -0.23 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.42 -3.14 1.61 4.06 -1.31 -3.45 115.95 113.30 1p9k h TRP 32 Ca 0.00 -0.01 -0.67 0.00 2.06 0.00 0.00 58.89 60.27 1p9k h TRP 32 Cb 0.09 0.14 -0.13 0.00 -1.00 0.00 0.00 29.16 28.25 1p9k h TRP 32 CO 0.00 -0.20 -0.58 0.45 -3.56 0.00 0.00 178.44 174.55 1p9k s SER 33 N -5.06 5.56 0.26 -3.49 0.15 -1.26 -5.01 113.70 104.86 1p9k s SER 33 Ca -0.08 0.21 0.03 0.00 0.70 0.00 0.00 55.95 56.82 1p9k s SER 33 Cb 0.01 -1.68 0.35 0.00 -1.71 0.00 0.00 66.02 62.99 1p9k s SER 33 CO 0.27 0.36 1.65 -0.08 1.20 0.00 0.00 173.24 176.64 1p9k h GLU 34 N 5.31 0.37 0.00 5.44 4.81 -1.94 -3.34 114.58 125.22 1p9k h GLU 34 Ca -0.50 -0.18 -0.30 0.00 -0.13 0.00 0.00 59.36 58.25 1p9k h GLU 34 Cb 1.20 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 1p9k h GLU 34 CO 0.57 0.72 -2.11 -1.13 -0.73 0.00 0.00 179.01 176.33 1p9k n SER 35 N -4.02 2.25 0.00 1.04 3.41 -1.26 -5.05 113.62 109.98 1p9k n SER 35 Ca -0.02 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1p9k n SER 35 Cb 0.50 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1p9k n SER 35 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p9k n GLY 36 N 2.37 3.77 0.00 5.00 0.00 -1.25 -4.83 105.19 110.24 1p9k n GLY 36 Ca -0.36 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 44.72 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 1.13 -0.04 4.61 0.00 -1.26 -3.45 120.51 121.50 1p9k n ALA 37 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.03 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 -0.08 0.00 0.00 0.00 -0.06 -1.26 -1.78 117.38 114.19 1p9k n GLN 38 Ca 0.00 0.65 0.00 0.00 -2.00 0.00 0.00 57.00 55.65 1p9k n GLN 38 Cb 0.27 -1.48 0.00 0.00 -4.06 0.00 0.00 30.24 24.96 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 -2.28 2.20 -1.75 1.69 0.00 -1.26 -4.77 120.51 114.33 1p9k n ALA 39 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1p9k n ALA 39 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.40 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 -0.16 -1.20 0.32 0.00 5.02 -0.74 -4.85 118.16 116.55 1p9k n LYS 40 Ca 0.00 0.99 0.21 0.00 -2.02 0.00 0.00 58.31 57.49 1p9k n LYS 40 Cb 0.11 -5.25 1.09 0.00 -0.02 0.00 0.00 35.03 30.95 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 0.00 0.00 -0.18 2.04 -1.79 -0.80 117.51 116.79 1p9k h ILE 41 Ca -0.35 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.42 1p9k h ILE 41 Cb 1.14 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1p9k h ILE 41 CO 0.48 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.63 1p9k n ALA 42 N -2.06 -0.02 -0.31 1.87 0.00 -1.22 -2.01 120.51 116.76 1p9k n ALA 42 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.56 1p9k n ALA 42 Cb 0.11 0.00 0.38 0.00 0.00 0.00 0.00 19.45 19.94 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 0.75 0.05 0.00 1.08 -1.89 -2.68 117.51 114.81 1p9k h ILE 43 Ca 0.00 -0.23 -0.00 0.00 -0.39 0.00 0.00 64.86 64.23 1p9k h ILE 43 Cb 0.00 0.01 -0.00 0.00 -3.07 0.00 0.00 36.82 33.76 1p9k h ILE 43 CO 0.00 0.12 -0.03 0.00 -0.69 0.00 0.00 178.15 177.55 1p9k h ALA 44 N 1.61 -0.94 -0.73 1.87 0.00 -1.29 -2.65 119.26 117.13 1p9k h ALA 44 Ca 0.51 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.63 1p9k h ALA 44 Cb 0.89 0.11 -0.13 0.00 0.00 0.00 0.00 17.79 18.66 1p9k h ALA 44 CO -0.27 -0.94 0.11 -1.91 0.00 0.00 0.00 179.25 176.24 1p9k n GLU 45 N -2.30 -0.05 0.00 0.00 0.00 -0.85 -0.51 120.64 116.93 1p9k n GLU 45 Ca -0.01 1.07 0.00 0.00 0.00 0.00 0.00 57.16 58.22 1p9k n GLU 45 Cb 0.03 -1.75 0.00 0.00 0.00 0.00 0.00 31.44 29.72 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 -1.32 -2.82 0.18 8.31 0.00 -1.07 -1.51 105.19 106.97 1p9k n GLY 46 Ca 0.20 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.45 1p9k n GLY 46 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1p9k h GLN 47 N 0.00 0.00 0.00 1.61 1.08 -0.45 -3.20 115.11 114.15 1p9k h GLN 47 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1p9k h GLN 47 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1p9k h GLN 47 CO 0.00 0.00 0.00 0.28 -0.95 0.00 0.00 178.83 178.16 1p9k n VAL 48 N -1.97 0.00 -3.65 -0.54 0.31 -0.56 -4.93 118.33 106.99 1p9k n VAL 48 Ca -0.00 0.11 0.01 0.00 -0.01 0.00 0.00 64.34 64.44 1p9k n VAL 48 Cb 0.57 -0.36 -0.06 0.00 -0.91 0.00 0.00 33.84 33.07 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 0.15 0.09 5.55 -0.14 -1.03 -4.88 119.74 119.48 1p9k s LYS 49 Ca 0.00 0.26 0.09 0.00 -1.36 0.00 0.00 55.97 54.96 1p9k s LYS 49 Cb 0.00 0.03 -0.04 0.00 -1.68 0.00 0.00 37.83 36.14 1p9k s LYS 49 CO 0.00 -0.03 -0.20 0.08 -0.76 0.00 0.00 175.35 174.44 1p9k s VAL 50 N 1.12 2.71 -0.88 3.17 1.01 -0.82 -0.17 120.40 126.54 1p9k s VAL 50 Ca -0.08 -1.42 -0.28 0.00 0.00 0.00 0.00 61.98 60.19 1p9k s VAL 50 Cb -0.03 -2.19 -0.19 0.00 0.00 0.00 0.00 36.38 33.97 1p9k s VAL 50 CO -0.11 0.20 2.60 -0.67 0.00 0.00 0.00 175.10 177.11 1p9k n ASP 51 N 1.12 0.67 -0.72 3.32 2.03 0.31 0.18 116.55 123.47 1p9k n ASP 51 Ca -0.16 -0.05 -0.09 0.00 0.52 0.00 0.00 54.79 55.00 1p9k n ASP 51 Cb 0.52 -1.06 -0.04 0.00 -0.72 0.00 0.00 41.12 39.82 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 6.34 1.06 2.40 0.27 0.00 -1.26 -4.69 105.19 109.31 1p9k n GLY 52 Ca 0.59 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 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 1.17 1.37 -1.97 4.61 0.00 0.49 -5.03 120.51 121.14 1p9k n ALA 53 Ca -0.09 -2.72 -0.42 0.00 0.00 0.00 0.00 53.44 50.21 1p9k n ALA 53 Cb 0.38 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.86 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 1.91 3.93 -3.07 0.00 3.14 -1.24 -1.94 118.33 121.05 1p9k n VAL 54 Ca 0.20 -3.62 -0.18 0.00 -2.96 0.00 0.00 64.34 57.79 1p9k n VAL 54 Cb 0.54 -2.49 0.06 0.00 -1.06 0.00 0.00 33.84 30.89 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 4.89 0.65 -2.51 1.45 -0.58 -1.26 -4.95 120.64 118.34 1p9k n GLU 55 Ca 0.48 -2.80 0.00 0.00 -0.42 0.00 0.00 57.16 54.43 1p9k n GLU 55 Cb 0.37 -0.19 0.05 0.00 -0.57 0.00 0.00 31.44 31.10 1p9k n GLU 55 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1p9k n THR 56 N -2.11 0.86 -2.92 2.62 -2.24 -1.26 -2.74 114.28 106.50 1p9k n THR 56 Ca 0.14 -2.28 -0.19 0.00 -2.27 0.00 0.00 64.05 59.45 1p9k n THR 56 Cb 0.54 1.20 0.04 0.00 -2.10 0.00 0.00 70.33 70.00 1p9k n THR 56 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1p9k s ARG 57 N -2.57 2.56 0.05 -0.78 0.52 -1.26 -4.73 118.95 112.74 1p9k s ARG 57 Ca 0.26 -1.25 -0.16 0.00 -0.52 0.00 0.00 55.73 54.06 1p9k s ARG 57 Cb 0.34 -2.65 -0.22 0.00 0.52 0.00 0.00 34.95 32.94 1p9k s ARG 57 CO -0.07 -0.59 1.18 0.87 0.02 0.00 0.00 175.30 176.71 1p9k h LYS 58 N 0.33 0.60 -6.22 3.54 1.79 -1.96 -3.44 116.57 111.21 1p9k h LYS 58 Ca -0.38 -0.61 -0.60 0.00 -2.18 0.00 0.00 60.65 56.89 1p9k h LYS 58 Cb 1.28 0.16 -0.25 0.00 -1.58 0.00 0.00 32.23 31.84 1p9k h LYS 58 CO 0.45 1.22 -0.85 -0.98 -1.08 0.00 0.00 179.45 178.21 1p9k s ARG 59 N -3.38 1.42 -0.15 3.15 1.70 -1.26 -3.96 118.95 116.48 1p9k s ARG 59 Ca -0.11 -1.01 -0.01 0.00 -0.47 0.00 0.00 55.73 54.13 1p9k s ARG 59 Cb 0.06 -1.58 0.04 0.00 -0.57 0.00 0.00 34.95 32.90 1p9k s ARG 59 CO 0.88 0.40 -0.04 0.00 -1.08 0.00 0.00 175.30 175.46 1p9k s LYS 61 N 1.73 2.82 -0.01 0.00 3.01 -1.26 -4.24 119.74 121.79 1p9k s LYS 61 Ca 0.02 -0.81 0.03 0.00 -1.01 0.00 0.00 55.97 54.20 1p9k s LYS 61 Cb -0.15 -5.20 -0.01 0.00 -1.01 0.00 0.00 37.83 31.47 1p9k s LYS 61 CO -0.07 -3.27 -0.09 0.42 0.51 0.00 0.00 175.35 172.85 1p9k s ILE 62 N 9.05 0.68 0.31 2.17 1.01 -1.26 -5.00 121.20 128.16 1p9k s ILE 62 Ca 0.64 -0.37 -0.05 0.00 0.00 0.00 0.00 60.65 60.87 1p9k s ILE 62 Cb -0.03 -0.57 0.00 0.00 0.01 0.00 0.00 42.46 41.87 1p9k s ILE 62 CO 0.02 0.19 0.46 0.68 0.00 0.00 0.00 174.94 176.30 1p9k s VAL 63 N -0.20 0.00 0.00 2.92 -7.23 -1.26 -3.70 120.40 110.93 1p9k s VAL 63 Ca 0.03 -1.56 0.00 0.00 -1.81 0.00 0.00 61.98 58.64 1p9k s VAL 63 Cb -0.03 -2.54 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 -0.50 0.00 -2.42 1.32 0.00 -1.26 -4.36 120.51 113.29 1p9k n ALA 64 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 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 0.41 0.00 0.00 0.00 177.50 177.91 1p9k n GLY 65 N 0.00 3.66 3.37 0.00 0.00 -1.18 -2.90 105.19 108.14 1p9k n GLY 65 Ca 0.00 -1.76 -0.26 0.00 0.00 0.00 0.00 46.02 44.00 1p9k n GLY 65 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1p9k s GLN 66 N 2.53 1.36 0.16 1.61 -1.52 -0.51 -4.88 119.66 118.40 1p9k s GLN 66 Ca 0.47 -1.39 0.09 0.00 -1.95 0.00 0.00 55.36 52.58 1p9k s GLN 66 Cb 0.06 -1.65 -0.04 0.00 -0.22 0.00 0.00 33.01 31.16 1p9k s GLN 66 CO 0.01 0.36 -0.15 0.99 -0.25 0.00 0.00 175.29 176.25 1p9k s THR 67 N -1.53 2.94 0.03 -0.19 2.01 -1.26 0.88 115.64 118.52 1p9k s THR 67 Ca 0.15 -1.66 0.06 0.00 0.31 0.00 0.00 61.69 60.55 1p9k s THR 67 Cb -0.08 -2.41 -0.02 0.00 0.01 0.00 0.00 72.50 70.00 1p9k s THR 67 CO 0.07 -0.03 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.11 1p9k s VAL 68 N -1.50 1.30 -0.01 3.82 1.01 0.91 0.11 120.40 126.05 1p9k s VAL 68 Ca 0.22 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.20 1p9k s VAL 68 Cb -0.09 -1.15 0.01 0.00 0.00 0.00 0.00 36.38 35.15 1p9k s VAL 68 CO 0.13 0.12 -0.03 -0.44 0.00 0.00 0.00 175.10 174.88 1p9k s SER 69 N -1.02 0.52 -0.10 3.32 0.01 0.76 -1.74 113.70 115.44 1p9k s SER 69 Ca 0.04 -0.07 -0.04 0.00 1.31 0.00 0.00 55.95 57.19 1p9k s SER 69 Cb -0.08 -0.14 0.05 0.00 0.21 0.00 0.00 66.02 66.06 1p9k s SER 69 CO 0.01 0.00 0.19 0.12 0.41 0.00 0.00 173.24 173.98 1p9k s PHE 70 N 0.28 -0.26 0.00 2.43 5.36 -0.35 -2.46 117.98 122.98 1p9k s PHE 70 Ca -0.03 0.72 0.00 0.00 -0.96 0.00 0.00 56.93 56.66 1p9k s PHE 70 Cb -0.06 -0.15 0.00 0.00 -0.34 0.00 0.00 43.02 42.47 1p9k s PHE 70 CO -0.00 -0.28 0.00 0.00 -1.46 0.00 0.00 175.22 173.47 1p9k n ALA 71 N 5.13 0.00 -0.34 11.12 0.00 -1.26 0.77 120.51 135.92 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 0.40 3.55 0.00 0.00 -1.26 -5.03 105.19 102.84 1p9k n GLY 72 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.17 3.11 -0.26 1.61 3.76 0.23 -5.03 115.29 118.54 1p9k s HIS 73 Ca 0.00 0.16 0.03 0.00 -0.15 0.00 0.00 55.06 55.09 1p9k s HIS 73 Cb 0.00 -3.22 0.06 0.00 1.11 0.00 0.00 32.58 30.53 1p9k s HIS 73 CO 0.00 -0.73 -0.10 0.45 -0.85 0.00 0.00 174.74 173.51 1p9k s SER 74 N 1.89 4.43 0.07 1.40 0.15 -1.26 -1.21 113.70 119.17 1p9k s SER 74 Ca 0.23 -1.43 0.04 0.00 0.70 0.00 0.00 55.95 55.49 1p9k s SER 74 Cb -0.14 -1.53 -0.03 0.00 -1.71 0.00 0.00 66.02 62.61 1p9k s SER 74 CO 0.17 -0.21 -0.12 -0.69 1.20 0.00 0.00 173.24 173.59 1p9k s VAL 75 N 1.11 0.97 0.45 4.45 1.01 -0.71 -4.89 120.40 122.79 1p9k s VAL 75 Ca -0.08 -1.30 0.07 0.00 0.00 0.00 0.00 61.98 60.67 1p9k s VAL 75 Cb -0.20 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1p9k s VAL 75 CO -0.05 -0.30 0.25 -1.10 0.00 0.00 0.00 175.10 173.89 1p9k s GLN 76 N -1.83 2.28 0.01 2.72 -0.21 -0.66 -0.06 119.66 121.90 1p9k s GLN 76 Ca -0.03 -1.87 -0.04 0.00 0.02 0.00 0.00 55.36 53.44 1p9k s GLN 76 Cb -0.09 -2.04 -0.01 0.00 1.00 0.00 0.00 33.01 31.87 1p9k s GLN 76 CO 0.02 -0.25 0.06 0.08 -2.12 0.00 0.00 175.29 173.08 1p9k s VAL 77 N -2.64 0.10 0.18 1.09 1.01 0.25 0.60 120.40 121.00 1p9k s VAL 77 Ca 0.38 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.60 1p9k s VAL 77 Cb 0.01 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 1p9k s VAL 77 CO 0.22 -0.46 -0.14 0.68 0.00 0.00 0.00 175.10 175.40 1p9k s VAL 78 N -1.55 1.61 -2.30 2.92 -7.23 -0.11 -1.43 120.40 112.31 1p9k s VAL 78 Ca -0.14 -2.09 0.18 0.00 -1.81 0.00 0.00 61.98 58.12 1p9k s VAL 78 Cb -0.08 -1.93 0.15 0.00 0.56 0.00 0.00 36.38 35.08 1p9k s VAL 78 CO -0.00 -0.56 1.08 0.00 -0.31 0.00 0.00 175.10 175.31