#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jub n THR 2 N 0.00 0.00 -0.31 0.00 5.66 -1.26 -4.16 114.28 114.21 2jub n THR 2 Ca 0.00 -0.18 -0.04 0.00 -3.05 0.00 0.00 64.05 60.78 2jub n THR 2 Cb 0.00 1.02 0.08 0.00 -1.55 0.00 0.00 70.33 69.88 2jub n THR 2 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 2jub h LEU 3 N 1.74 0.98 0.14 1.09 6.46 -2.01 0.50 115.31 124.21 2jub h LEU 3 Ca 0.00 -0.03 -0.19 0.00 -0.12 0.00 0.00 57.88 57.54 2jub h LEU 3 Cb 0.66 -0.24 0.02 0.00 -0.73 0.00 0.00 40.66 40.37 2jub h LEU 3 CO 0.00 0.71 -0.84 0.00 -0.62 0.00 0.00 178.44 177.69 2jub h THR 4 N 1.15 1.49 0.37 1.05 1.03 -1.93 -2.78 112.91 113.29 2jub h THR 4 Ca 0.31 -2.51 -0.02 0.00 -0.01 0.00 0.00 66.41 64.18 2jub h THR 4 Cb -0.13 3.15 0.00 0.00 -1.07 0.00 0.00 68.15 70.10 2jub h THR 4 CO -0.07 0.72 -0.18 -1.28 -0.01 0.00 0.00 175.52 174.70 2jub h SER 5 N -0.32 -0.42 -0.25 0.00 0.87 -1.67 -2.26 113.55 109.50 2jub h SER 5 Ca -0.14 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.31 2jub h SER 5 Cb 1.65 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.72 2jub h SER 5 CO 0.16 -0.29 -0.29 -0.33 -0.53 0.00 0.00 176.83 175.55 2jub h GLU 6 N -0.51 0.64 -0.50 2.24 5.08 -1.06 -3.13 114.58 117.35 2jub h GLU 6 Ca -0.05 -0.35 -0.04 0.00 -1.00 0.00 0.00 59.36 57.92 2jub h GLU 6 Cb 0.39 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2jub h GLU 6 CO 0.08 0.96 0.16 0.28 -1.00 0.00 0.00 179.01 179.49 2jub h VAL 7 N 0.36 1.23 0.22 3.13 2.07 -1.52 -2.36 116.25 119.37 2jub h VAL 7 Ca 0.04 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2jub h VAL 7 Cb 0.86 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 2jub h VAL 7 CO 0.07 0.28 -0.11 0.40 0.02 0.00 0.00 177.57 178.23 2jub h ILE 8 N 0.67 0.80 -1.01 4.57 5.03 -1.48 -2.64 117.51 123.45 2jub h ILE 8 Ca 0.16 -0.09 0.09 0.00 -0.12 0.00 0.00 64.86 64.90 2jub h ILE 8 Cb 0.27 0.85 -0.07 0.00 -3.03 0.00 0.00 36.82 34.84 2jub h ILE 8 CO -0.01 0.02 0.64 0.50 -0.68 0.00 0.00 178.15 178.63 2jub h LYS 9 N -0.34 1.07 -0.30 2.37 3.64 -1.48 1.17 116.57 122.70 2jub h LYS 9 Ca -0.03 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2jub h LYS 9 Cb 0.26 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2jub h LYS 9 CO 0.05 0.71 0.17 0.00 -2.27 0.00 0.00 179.45 178.11 2jub h ALA 10 N 1.49 0.37 0.00 5.00 0.00 -1.12 -3.38 119.26 121.62 2jub h ALA 10 Ca 0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2jub h ALA 10 Cb 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2jub h ALA 10 CO -0.21 -0.21 -0.01 0.09 0.00 0.00 0.00 179.25 178.91 2jub n ASN 11 N -4.93 0.02 -2.88 0.00 3.02 -0.81 -4.98 115.26 104.70 2jub n ASN 11 Ca -0.01 0.03 -0.06 0.00 -0.03 0.00 0.00 54.58 54.51 2jub n ASN 11 Cb 0.06 -0.50 0.01 0.00 -0.61 0.00 0.00 39.78 38.73 2jub n ASN 11 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2jub n LYS 12 N -2.49 -2.11 -1.87 3.52 4.81 0.40 -3.77 118.16 116.64 2jub n LYS 12 Ca -0.00 1.96 -0.09 0.00 -0.87 0.00 0.00 58.31 59.31 2jub n LYS 12 Cb 0.00 -5.65 -0.02 0.00 0.02 0.00 0.00 35.03 29.39 2jub n LYS 12 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jub n GLY 13 N -0.64 0.35 0.34 3.14 0.00 -1.26 -4.93 105.19 102.19 2jub n GLY 13 Ca 0.09 -0.55 -0.17 0.00 0.00 0.00 0.00 46.02 45.39 2jub n GLY 13 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2jub h ARG 14 N 0.00 -0.79 -5.77 1.61 2.43 -1.95 -3.47 114.38 106.43 2jub h ARG 14 Ca -0.20 0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 58.95 2jub h ARG 14 Cb 0.97 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2jub h ARG 14 CO 0.25 -0.51 -0.94 -1.91 -1.51 0.00 0.00 179.97 175.36 2jub n GLU 15 N -5.43 -2.08 0.00 0.20 4.07 -1.26 -4.96 120.64 111.18 2jub n GLU 15 Ca -0.13 1.84 0.00 0.00 -0.06 0.00 0.00 57.16 58.82 2jub n GLU 15 Cb 0.34 -3.60 0.00 0.00 -0.06 0.00 0.00 31.44 28.12 2jub n GLU 15 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jub n GLY 16 N 0.52 1.24 0.00 8.31 0.00 -1.26 -5.09 105.19 108.91 2jub n GLY 16 Ca 0.01 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2jub n GLY 16 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jub n LYS 17 N 0.00 0.00 -3.78 1.61 5.02 -1.26 -4.90 118.16 114.85 2jub n LYS 17 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2jub n LYS 17 Cb 0.00 -0.23 -0.06 0.00 -0.02 0.00 0.00 35.03 34.72 2jub n LYS 17 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2jub s PRO 18 N -1.00 3.57 -0.03 1.97 0.04 -1.12 0.15 135.00 138.58 2jub s PRO 18 Ca 0.00 0.01 0.07 0.00 0.04 0.00 0.00 61.00 61.12 2jub s PRO 18 Cb 0.00 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.33 2jub s PRO 18 CO 0.00 0.75 -0.24 1.41 0.04 0.00 0.00 177.00 178.96 2jub s MET 19 N -1.08 2.11 -0.15 4.56 1.75 -1.18 -4.82 119.30 120.48 2jub s MET 19 Ca 0.18 -0.86 -0.04 0.00 -1.25 0.00 0.00 55.69 53.72 2jub s MET 19 Cb -0.13 -1.95 -0.03 0.00 2.84 0.00 0.00 34.83 35.56 2jub s MET 19 CO 0.07 0.46 -0.01 0.42 -0.65 0.00 0.00 175.02 175.32 2jub s ILE 20 N -0.42 4.20 -0.60 10.11 1.01 -1.26 -2.05 121.20 132.19 2jub s ILE 20 Ca 0.05 -0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.25 2jub s ILE 20 Cb -0.11 -2.84 0.10 0.00 0.01 0.00 0.00 42.46 39.62 2jub s ILE 20 CO 0.01 0.51 0.75 -0.55 0.00 0.00 0.00 174.94 175.65 2jub s SER 21 N 0.13 6.18 0.00 3.58 0.15 -1.07 -4.87 113.70 117.81 2jub s SER 21 Ca 0.01 -1.33 0.09 0.00 0.70 0.00 0.00 55.95 55.42 2jub s SER 21 Cb -0.13 -2.32 0.39 0.00 -1.71 0.00 0.00 66.02 62.25 2jub s SER 21 CO 0.02 -1.16 1.29 0.00 1.20 0.00 0.00 173.24 174.59 2jub n LEU 22 N 6.57 0.01 -0.35 3.45 -0.00 -1.26 0.31 117.00 125.72 2jub n LEU 22 Ca -0.08 0.50 -0.02 0.00 -0.00 0.00 0.00 56.01 56.41 2jub n LEU 22 Cb 0.43 -0.50 0.10 0.00 -0.00 0.00 0.00 43.42 43.45 2jub n LEU 22 CO 0.59 -0.35 1.27 0.58 -0.00 0.00 0.00 177.39 179.48 2jub h VAL 23 N 0.00 1.23 0.00 1.47 2.07 -2.00 -3.29 116.25 115.73 2jub h VAL 23 Ca 0.00 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2jub h VAL 23 Cb 0.16 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 2jub h VAL 23 CO 0.00 0.23 0.00 -0.67 0.02 0.00 0.00 177.57 177.15 2jub n ASP 24 N -4.44 0.28 -2.48 0.57 -0.08 -0.82 -5.08 116.55 104.51 2jub n ASP 24 Ca 0.11 -0.78 -0.03 0.00 -1.51 0.00 0.00 54.79 52.59 2jub n ASP 24 Cb 0.03 0.11 0.00 0.00 2.34 0.00 0.00 41.12 43.60 2jub n ASP 24 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jub n GLY 25 N 0.11 -2.76 2.96 0.27 0.00 0.92 -5.04 105.19 101.66 2jub n GLY 25 Ca 0.00 0.59 -0.13 0.00 0.00 0.00 0.00 46.02 46.48 2jub n GLY 25 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jub s GLU 26 N -1.69 0.11 -0.14 1.61 2.02 -1.15 -4.91 118.70 114.55 2jub s GLU 26 Ca 0.08 0.23 -0.27 0.00 0.02 0.00 0.00 54.97 55.03 2jub s GLU 26 Cb -0.02 -0.03 -0.01 0.00 0.10 0.00 0.00 34.13 34.16 2jub s GLU 26 CO 0.60 -0.07 0.90 -1.21 0.02 0.00 0.00 175.26 175.50 2jub s GLU 27 N 0.47 4.35 -0.63 1.61 8.01 -1.26 -2.60 118.70 128.66 2jub s GLU 27 Ca -0.03 1.17 0.06 0.00 0.01 0.00 0.00 54.97 56.18 2jub s GLU 27 Cb -0.05 -3.56 0.22 0.00 -4.31 0.00 0.00 34.13 26.44 2jub s GLU 27 CO -0.02 -0.31 0.63 -0.89 0.01 0.00 0.00 175.26 174.68 2jub n ILE 28 N 4.62 1.66 -1.63 -1.63 5.41 -0.87 -5.02 119.36 121.91 2jub n ILE 28 Ca 0.06 -4.90 -0.47 0.00 1.00 0.00 0.00 62.75 58.43 2jub n ILE 28 Cb 0.49 -2.09 -0.05 0.00 -0.71 0.00 0.00 39.64 37.28 2jub n ILE 28 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2jub n LYS 29 N 1.35 2.04 0.00 0.38 5.02 -1.26 -3.05 118.16 122.63 2jub n LYS 29 Ca 0.26 0.70 0.00 0.00 -2.02 0.00 0.00 58.31 57.25 2jub n LYS 29 Cb 0.41 -2.75 0.00 0.00 -0.02 0.00 0.00 35.03 32.66 2jub n LYS 29 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jub n GLY 30 N 4.99 1.71 2.96 0.72 0.00 -0.96 -4.97 105.19 109.64 2jub n GLY 30 Ca 0.27 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.13 2jub n GLY 30 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jub s THR 31 N -1.71 0.42 -0.35 2.61 -4.23 0.39 -3.99 115.64 108.79 2jub s THR 31 Ca 0.00 -0.25 0.03 0.00 -1.18 0.00 0.00 61.69 60.29 2jub s THR 31 Cb 0.00 -0.36 0.10 0.00 1.34 0.00 0.00 72.50 73.58 2jub s THR 31 CO 0.00 0.11 0.08 0.68 -0.54 0.00 0.00 174.62 174.95 2jub s VAL 32 N -0.16 1.96 -0.01 2.29 -7.23 -1.25 -2.79 120.40 113.22 2jub s VAL 32 Ca 0.02 -2.23 0.00 0.00 -1.81 0.00 0.00 61.98 57.96 2jub s VAL 32 Cb -0.02 -2.45 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2jub s VAL 32 CO -0.00 -0.64 0.00 0.00 -0.31 0.00 0.00 175.10 174.14 2jub n TYR 33 N 4.26 -1.65 -3.60 2.82 0.18 -1.26 -4.84 117.16 113.07 2jub n TYR 33 Ca 0.03 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.44 2jub n TYR 33 Cb 0.41 -1.01 -0.07 0.00 -0.38 0.00 0.00 39.34 38.29 2jub n TYR 33 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 2jub s LEU 34 N -3.98 4.34 0.00 -3.48 1.98 -1.26 -4.41 118.68 111.88 2jub s LEU 34 Ca 0.00 0.63 0.00 0.00 -2.89 0.00 0.00 54.13 51.87 2jub s LEU 34 Cb 0.00 -2.37 0.00 0.00 0.66 0.00 0.00 46.19 44.48 2jub s LEU 34 CO 0.00 0.24 0.00 0.61 -1.89 0.00 0.00 176.35 175.31 2jub n GLY 35 N 2.61 1.37 0.00 7.98 0.00 -1.26 -5.00 105.19 110.89 2jub n GLY 35 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2jub n GLY 35 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jub n ASP 36 N 0.00 0.00 -1.01 1.61 5.75 -1.26 -5.02 116.55 116.61 2jub n ASP 36 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 54.79 54.78 2jub n ASP 36 Cb 0.00 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 2jub n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jub n GLY 37 N -0.41 0.77 3.38 6.12 0.00 -1.23 -5.08 105.19 108.74 2jub n GLY 37 Ca 0.00 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 2jub n GLY 37 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2jub n TRP 38 N 0.20 -1.39 -3.78 1.61 4.27 -1.20 -4.21 117.44 112.93 2jub n TRP 38 Ca -0.04 0.53 -0.13 0.00 -3.89 0.00 0.00 57.50 53.97 2jub n TRP 38 Cb 0.85 -1.87 -0.10 0.00 -1.36 0.00 0.00 31.31 28.83 2jub n TRP 38 CO 0.00 0.00 0.00 -1.12 -2.29 0.00 0.00 177.69 174.28 2jub s SER 39 N -1.03 -0.19 0.14 -0.67 0.01 -1.22 -5.00 113.70 105.74 2jub s SER 39 Ca 0.63 0.18 -0.03 0.00 1.31 0.00 0.00 55.95 58.04 2jub s SER 39 Cb -0.54 0.38 -0.03 0.00 0.21 0.00 0.00 66.02 66.04 2jub s SER 39 CO 0.60 -0.33 0.12 0.00 0.41 0.00 0.00 173.24 174.04 2jub s ALA 40 N -0.89 0.63 -0.20 1.44 0.00 -1.26 -2.49 121.76 118.99 2jub s ALA 40 Ca -0.10 -1.31 -0.12 0.00 0.00 0.00 0.00 51.96 50.43 2jub s ALA 40 Cb -0.05 0.87 0.06 0.00 0.00 0.00 0.00 23.12 24.01 2jub s ALA 40 CO 0.03 -0.53 0.50 0.21 0.00 0.00 0.00 175.76 175.96 2jub s LYS 41 N -4.03 0.50 -0.23 0.00 2.20 -0.36 -4.98 119.74 112.85 2jub s LYS 41 Ca 0.22 0.91 -0.09 0.00 -0.36 0.00 0.00 55.97 56.65 2jub s LYS 41 Cb 0.06 0.05 -0.05 0.00 -1.51 0.00 0.00 37.83 36.39 2jub s LYS 41 CO 0.01 -0.15 0.12 0.15 -0.36 0.00 0.00 175.35 175.13 2jub s LYS 42 N 1.37 3.99 0.00 4.03 1.02 -1.26 -1.79 119.74 127.10 2jub s LYS 42 Ca -0.09 -0.31 0.24 0.00 0.02 0.00 0.00 55.97 55.83 2jub s LYS 42 Cb -0.07 -3.43 0.21 0.00 -0.52 0.00 0.00 37.83 34.01 2jub s LYS 42 CO -0.14 0.08 1.26 -0.25 -0.92 0.00 0.00 175.35 175.38 2jub n ASP 43 N 4.19 2.74 0.00 2.83 8.00 -1.21 -4.94 116.55 128.16 2jub n ASP 43 Ca -0.16 -1.88 0.00 0.00 0.71 0.00 0.00 54.79 53.46 2jub n ASP 43 Cb 0.52 0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.70 2jub n ASP 43 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jub n GLY 44 N 1.35 0.55 1.99 0.44 0.00 -1.26 -4.73 105.19 103.54 2jub n GLY 44 Ca 0.13 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2jub n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jub n ALA 45 N 0.34 0.00 -3.13 4.61 0.00 -1.26 -5.07 120.51 116.00 2jub n ALA 45 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 2jub n ALA 45 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 2jub n ALA 45 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2jub s THR 46 N -2.00 1.81 -0.09 0.00 2.01 -1.26 -1.72 115.64 114.39 2jub s THR 46 Ca 0.00 -0.89 -0.17 0.00 0.31 0.00 0.00 61.69 60.94 2jub s THR 46 Cb 0.00 -1.57 -0.05 0.00 0.01 0.00 0.00 72.50 70.89 2jub s THR 46 CO 0.00 0.51 0.44 -0.63 -0.69 0.00 0.00 174.62 174.25 2jub s ILE 47 N 0.26 5.15 -0.27 1.82 -1.09 -0.68 -3.32 121.20 123.06 2jub s ILE 47 Ca -0.13 0.88 -0.13 0.00 -2.23 0.00 0.00 60.65 59.04 2jub s ILE 47 Cb -0.16 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.91 2jub s ILE 47 CO 0.06 0.41 0.28 -0.69 -1.23 0.00 0.00 174.94 173.77 2jub s VAL 48 N 0.11 5.25 0.14 2.92 1.01 -0.74 -2.41 120.40 126.68 2jub s VAL 48 Ca 0.24 0.36 0.07 0.00 0.00 0.00 0.00 61.98 62.65 2jub s VAL 48 Cb -0.15 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2jub s VAL 48 CO 0.11 0.21 -0.15 -0.63 0.00 0.00 0.00 175.10 174.63 2jub s ILE 49 N 1.91 1.47 -0.14 2.22 1.01 -0.90 -1.22 121.20 125.55 2jub s ILE 49 Ca 0.11 -1.82 0.00 0.00 0.00 0.00 0.00 60.65 58.94 2jub s ILE 49 Cb -0.16 -1.66 0.02 0.00 0.01 0.00 0.00 42.46 40.67 2jub s ILE 49 CO 0.10 -0.42 -0.14 -0.44 0.00 0.00 0.00 174.94 174.05 2jub s SER 50 N -2.60 2.62 0.00 3.58 0.01 -1.04 -0.70 113.70 115.57 2jub s SER 50 Ca 0.12 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.91 2jub s SER 50 Cb -0.04 -1.14 0.00 0.00 0.21 0.00 0.00 66.02 65.04 2jub s SER 50 CO 0.04 -0.05 0.14 -2.65 0.41 0.00 0.00 173.24 171.13 2jub n PRO 51 N 4.73 0.00 -0.09 12.44 -0.02 -1.26 -3.43 135.00 147.37 2jub n PRO 51 Ca -0.17 0.14 -0.12 0.00 -2.02 0.00 0.00 63.50 61.34 2jub n PRO 51 Cb 0.50 -0.48 -0.10 0.00 -0.02 0.00 0.00 33.50 33.40 2jub n PRO 51 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jub n ALA 52 N -1.53 1.60 -3.00 3.55 0.00 -1.26 -3.70 120.51 116.17 2jub n ALA 52 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 53.44 52.56 2jub n ALA 52 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.46 2jub n ALA 52 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jub n GLU 53 N -2.91 0.00 -3.28 0.00 1.02 -1.26 -3.23 120.64 110.98 2jub n GLU 53 Ca -0.31 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 56.86 2jub n GLU 53 Cb 0.90 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.30 2jub n GLU 53 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2jub s GLU 54 N 0.02 0.31 -0.30 3.49 2.12 -1.26 -4.81 118.70 118.27 2jub s GLU 54 Ca 0.00 0.67 0.13 0.00 0.36 0.00 0.00 54.97 56.12 2jub s GLU 54 Cb 0.00 0.39 0.47 0.00 0.26 0.00 0.00 34.13 35.25 2jub s GLU 54 CO 0.00 -0.23 1.14 0.25 -0.54 0.00 0.00 175.26 175.88 2jub n THR 55 N 5.25 2.01 0.00 -1.70 -2.24 -1.26 -4.93 114.28 111.40 2jub n THR 55 Ca -0.07 -3.82 0.00 0.00 -2.27 0.00 0.00 64.05 57.89 2jub n THR 55 Cb 0.53 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 2jub n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jub n ALA 56 N -0.60 0.00 1.45 6.98 0.00 -1.26 -4.53 120.51 122.55 2jub n ALA 56 Ca 0.29 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.88 2jub n ALA 56 Cb 0.87 0.00 0.69 0.00 0.00 0.00 0.00 19.45 21.00 2jub n ALA 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jub n LEU 57 N 0.00 0.26 0.00 0.00 4.77 -1.26 -4.82 117.00 115.95 2jub n LEU 57 Ca 0.00 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2jub n LEU 57 Cb 0.00 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2jub n LEU 57 CO 0.00 0.05 0.00 0.49 -1.33 0.00 0.00 177.39 176.60 2jub n PHE 58 N -1.09 0.00 -3.78 -1.77 3.72 -1.26 -5.17 117.46 108.11 2jub n PHE 58 Ca 0.15 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.45 2jub n PHE 58 Cb 0.25 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.74 2jub n PHE 58 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 176.76 175.12 2jub s LYS 59 N 1.88 1.08 0.79 -1.08 -2.85 -1.26 -4.87 119.74 113.43 2jub s LYS 59 Ca 0.00 -0.90 -0.09 0.00 -1.00 0.00 0.00 55.97 53.98 2jub s LYS 59 Cb 0.00 0.42 0.11 0.00 -2.06 0.00 0.00 37.83 36.30 2jub s LYS 59 CO 0.00 -0.40 1.12 0.00 0.10 0.00 0.00 175.35 176.17 2jub s ALA 60 N -3.87 2.90 0.10 0.59 0.00 -1.26 -4.71 121.76 115.52 2jub s ALA 60 Ca 0.08 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 51.01 2jub s ALA 60 Cb 0.03 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 2jub s ALA 60 CO -0.08 -1.69 -0.09 0.21 0.00 0.00 0.00 175.76 174.12 2jub s LYS 61 N -5.46 0.87 0.42 0.00 2.20 0.12 -4.99 119.74 112.90 2jub s LYS 61 Ca 0.65 -1.27 0.06 0.00 -0.36 0.00 0.00 55.97 55.05 2jub s LYS 61 Cb -0.08 -0.41 -0.07 0.00 -1.51 0.00 0.00 37.83 35.76 2jub s LYS 61 CO 0.48 0.04 0.01 -1.01 -0.36 0.00 0.00 175.35 174.51 2jub s HIS 62 N -3.04 2.40 -0.29 4.03 3.76 -1.26 -2.12 115.29 118.77 2jub s HIS 62 Ca 0.09 -0.73 -0.15 0.00 -0.15 0.00 0.00 55.06 54.13 2jub s HIS 62 Cb 0.01 -1.73 0.13 0.00 1.11 0.00 0.00 32.58 32.11 2jub s HIS 62 CO -0.02 0.39 0.86 0.42 -0.85 0.00 0.00 174.74 175.55 2jub s ILE 63 N -2.77 -0.26 0.64 0.60 1.01 -1.01 -4.88 121.20 114.53 2jub s ILE 63 Ca 0.31 0.00 -0.18 0.00 0.00 0.00 0.00 60.65 60.78 2jub s ILE 63 Cb 0.09 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.54 2jub s ILE 63 CO 0.16 0.00 1.15 -1.54 0.00 0.00 0.00 174.94 174.71 2jub n SER 64 N 4.40 1.50 -0.23 3.58 3.41 -1.26 -1.69 113.62 123.33 2jub n SER 64 Ca -0.16 0.81 0.02 0.00 -0.26 0.00 0.00 58.87 59.28 2jub n SER 64 Cb 0.55 -1.49 0.14 0.00 -0.26 0.00 0.00 64.21 63.15 2jub n SER 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jub h ALA 65 N 0.45 0.91 -0.74 7.33 0.00 -1.70 -0.66 119.26 124.86 2jub h ALA 65 Ca -0.50 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2jub h ALA 65 Cb 1.35 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 2jub h ALA 65 CO 0.52 -0.16 0.47 0.00 0.00 0.00 0.00 179.25 180.08 2jub h ALA 66 N 1.46 0.94 -0.37 0.00 0.00 -1.88 0.47 119.26 119.87 2jub h ALA 66 Ca 0.35 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.30 2jub h ALA 66 Cb 0.44 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2jub h ALA 66 CO -0.32 0.38 0.34 0.45 0.00 0.00 0.00 179.25 180.10 2jub h HIS 67 N 1.00 0.00 -0.07 0.00 -0.00 -1.46 0.85 115.15 115.47 2jub h HIS 67 Ca 0.27 0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.65 2jub h HIS 67 Cb -0.08 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.33 2jub h HIS 67 CO -0.02 0.00 0.05 1.25 -0.00 0.00 0.00 177.93 179.22 2jub h LEU 68 N 0.00 0.02 -1.11 2.43 6.46 -0.38 0.15 115.31 122.88 2jub h LEU 68 Ca 0.17 -0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.85 2jub h LEU 68 Cb 0.86 -0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.77 2jub h LEU 68 CO -0.00 0.01 -0.24 0.11 -0.62 0.00 0.00 178.44 177.70 2jub h LYS 69 N 0.02 0.34 -0.22 1.25 1.57 0.69 -1.94 116.57 118.29 2jub h LYS 69 Ca 0.03 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2jub h LYS 69 Cb 0.11 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2jub h LYS 69 CO -0.00 0.56 0.14 0.97 -0.57 0.00 0.00 179.45 180.55 2jub h ILE 70 N 0.31 1.05 -0.69 1.86 2.10 -0.73 -1.84 117.51 119.57 2jub h ILE 70 Ca 0.05 -0.10 -0.05 0.00 1.08 0.00 0.00 64.86 65.84 2jub h ILE 70 Cb 0.59 0.74 -0.03 0.00 -1.09 0.00 0.00 36.82 37.03 2jub h ILE 70 CO 0.04 0.05 0.24 0.40 -1.08 0.00 0.00 178.15 177.80 2jub h ILE 71 N 0.28 1.25 -0.38 2.19 2.04 -1.34 -2.30 117.51 119.26 2jub h ILE 71 Ca 0.08 -0.83 -0.16 0.00 1.00 0.00 0.00 64.86 64.95 2jub h ILE 71 Cb -0.02 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2jub h ILE 71 CO -0.02 0.33 -0.40 0.00 0.00 0.00 0.00 178.15 178.06 2jub h ALA 72 N 1.11 0.57 0.01 1.87 0.00 -1.36 -2.13 119.26 119.33 2jub h ALA 72 Ca 0.22 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2jub h ALA 72 Cb 0.26 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2jub h ALA 72 CO -0.01 0.68 -0.01 -0.22 0.00 0.00 0.00 179.25 179.69 2jub h LYS 73 N 0.76 -0.03 0.00 0.00 3.64 -1.29 0.19 116.57 119.84 2jub h LYS 73 Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2jub h LYS 73 Cb 1.00 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 2jub h LYS 73 CO 0.10 -0.02 0.00 0.09 -2.27 0.00 0.00 179.45 177.35 2jub n ASN 74 N -5.11 0.00 -0.05 4.20 5.03 -0.88 -4.14 115.26 114.32 2jub n ASN 74 Ca -0.07 0.73 -0.10 0.00 0.87 0.00 0.00 54.58 56.00 2jub n ASN 74 Cb 0.04 -0.43 -0.04 0.00 -1.02 0.00 0.00 39.78 38.33 2jub n ASN 74 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 2jub h LEU 75 N 0.00 0.24 -1.88 3.41 4.07 -1.50 -3.45 115.31 116.19 2jub h LEU 75 Ca 0.00 -0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.90 2jub h LEU 75 Cb 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.68 2jub h LEU 75 CO 0.00 0.23 0.00 0.18 -1.08 0.00 0.00 178.44 177.77