#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 -0.30 0.00 -2.24 -1.26 -4.40 114.28 106.08 2jub n THR 2 Ca 0.00 -0.41 -0.04 0.00 -2.27 0.00 0.00 64.05 61.33 2jub n THR 2 Cb 0.00 1.32 0.07 0.00 -2.10 0.00 0.00 70.33 69.62 2jub n THR 2 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2jub h LEU 3 N 2.97 0.94 0.08 3.22 5.85 -1.99 0.38 115.31 126.76 2jub h LEU 3 Ca 0.00 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 2jub h LEU 3 Cb 0.72 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2jub h LEU 3 CO 0.00 0.69 -0.04 0.74 -0.34 0.00 0.00 178.44 179.49 2jub h THR 4 N 1.11 1.17 -0.07 1.05 2.02 -1.98 -2.68 112.91 113.53 2jub h THR 4 Ca 0.30 -0.97 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 2jub h THR 4 Cb -0.11 1.78 -0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2jub h THR 4 CO -0.06 0.24 -0.06 0.28 0.37 0.00 0.00 175.52 176.28 2jub h SER 5 N -0.56 0.17 -0.24 4.18 0.02 -1.77 -3.00 113.55 112.35 2jub h SER 5 Ca -0.01 -0.48 -0.08 0.00 -0.84 0.00 0.00 61.79 60.38 2jub h SER 5 Cb 0.47 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 2jub h SER 5 CO 0.02 0.61 -0.16 -0.33 -1.14 0.00 0.00 176.83 175.83 2jub h GLU 6 N -0.27 0.54 -0.15 3.45 5.08 -1.05 -2.79 114.58 119.39 2jub h GLU 6 Ca 0.01 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.06 2jub h GLU 6 Cb 0.56 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2jub h GLU 6 CO 0.02 0.83 -0.11 0.28 -1.00 0.00 0.00 179.01 179.02 2jub h VAL 7 N 0.25 1.33 -0.36 3.13 2.07 -1.61 -2.58 116.25 118.49 2jub h VAL 7 Ca 0.05 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.33 2jub h VAL 7 Cb 0.69 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 2jub h VAL 7 CO 0.04 0.36 0.21 0.40 0.02 0.00 0.00 177.57 178.61 2jub h ILE 8 N -0.02 1.12 -0.97 4.57 5.03 -1.63 -2.35 117.51 123.26 2jub h ILE 8 Ca 0.03 -0.29 0.04 0.00 -0.12 0.00 0.00 64.86 64.51 2jub h ILE 8 Cb 0.62 0.67 -0.06 0.00 -3.03 0.00 0.00 36.82 35.03 2jub h ILE 8 CO 0.03 0.12 0.63 0.50 -0.68 0.00 0.00 178.15 178.76 2jub h LYS 9 N 0.47 1.18 -0.97 2.37 1.63 -1.50 -1.47 116.57 118.27 2jub h LYS 9 Ca 0.13 -0.07 0.11 0.00 -0.85 0.00 0.00 60.65 59.97 2jub h LYS 9 Cb 0.01 -0.27 -0.08 0.00 -0.60 0.00 0.00 32.23 31.30 2jub h LYS 9 CO -0.02 0.78 0.60 0.00 -3.45 0.00 0.00 179.45 177.35 2jub h ALA 10 N 1.44 1.44 -2.11 5.00 0.00 -1.00 -3.43 119.26 120.60 2jub h ALA 10 Ca 0.39 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 2jub h ALA 10 Cb 0.02 -0.19 -0.21 0.00 0.00 0.00 0.00 17.79 17.41 2jub h ALA 10 CO -0.12 0.21 0.08 0.54 0.00 0.00 0.00 179.25 179.96 2jub s ASN 11 N -5.68 -0.67 -0.29 0.00 4.22 -0.55 -4.81 114.94 107.16 2jub s ASN 11 Ca -0.12 1.15 -0.14 0.00 -2.14 0.00 0.00 52.86 51.61 2jub s ASN 11 Cb 0.22 1.13 0.12 0.00 1.28 0.00 0.00 41.25 44.00 2jub s ASN 11 CO 0.80 -0.33 0.79 -1.59 -2.04 0.00 0.00 177.10 174.73 2jub s LYS 12 N -0.07 0.53 -1.47 3.55 -2.85 -1.24 -4.43 119.74 113.77 2jub s LYS 12 Ca -0.03 1.10 -0.00 0.00 -1.00 0.00 0.00 55.97 56.04 2jub s LYS 12 Cb -0.04 0.42 0.00 0.00 -2.06 0.00 0.00 37.83 36.16 2jub s LYS 12 CO 0.03 -0.14 0.26 0.41 0.10 0.00 0.00 175.35 176.00 2jub n GLY 13 N 4.68 -0.18 2.32 0.59 0.00 -1.26 -4.90 105.19 106.44 2jub n GLY 13 Ca -0.15 0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 2jub n GLY 13 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jub n ARG 14 N -4.47 1.61 -3.33 1.61 0.63 -1.26 -4.97 116.66 106.47 2jub n ARG 14 Ca -0.31 -3.91 -0.22 0.00 -0.92 0.00 0.00 57.85 52.48 2jub n ARG 14 Cb 0.69 -1.72 0.02 0.00 0.45 0.00 0.00 32.46 31.89 2jub n ARG 14 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2jub n GLU 15 N 1.02 -1.89 -1.51 -0.14 1.02 -1.26 -4.45 120.64 113.43 2jub n GLU 15 Ca 0.25 1.49 -0.26 0.00 -0.02 0.00 0.00 57.16 58.62 2jub n GLU 15 Cb 0.48 -3.59 -0.19 0.00 -0.02 0.00 0.00 31.44 28.12 2jub n GLU 15 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jub n GLY 16 N -0.74 -0.44 1.28 0.62 0.00 -1.26 -4.07 105.19 100.57 2jub n GLY 16 Ca -0.07 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2jub n GLY 16 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2jub n LYS 17 N 6.61 0.00 -3.62 1.61 4.81 -1.26 -4.77 118.16 121.54 2jub n LYS 17 Ca 0.65 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.71 2jub n LYS 17 Cb 0.16 -0.06 -0.11 0.00 0.02 0.00 0.00 35.03 35.03 2jub n LYS 17 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2jub s PRO 18 N -1.64 3.77 -0.09 1.64 0.04 -1.26 -3.15 135.00 134.31 2jub s PRO 18 Ca 0.00 -0.43 0.04 0.00 0.04 0.00 0.00 61.00 60.64 2jub s PRO 18 Cb 0.00 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.94 2jub s PRO 18 CO 0.00 -0.24 -0.22 1.41 0.04 0.00 0.00 177.00 177.99 2jub s MET 19 N 1.71 2.76 -0.15 4.56 1.75 -1.21 -4.97 119.30 123.75 2jub s MET 19 Ca 0.07 -0.79 -0.04 0.00 -1.25 0.00 0.00 55.69 53.67 2jub s MET 19 Cb -0.16 -2.12 -0.03 0.00 2.84 0.00 0.00 34.83 35.36 2jub s MET 19 CO 0.09 0.17 -0.03 0.42 -0.65 0.00 0.00 175.02 175.02 2jub s ILE 20 N 0.36 4.01 -0.60 10.11 1.01 -1.26 -1.77 121.20 133.06 2jub s ILE 20 Ca -0.17 -0.32 -0.19 0.00 0.00 0.00 0.00 60.65 59.97 2jub s ILE 20 Cb -0.17 -2.76 0.10 0.00 0.01 0.00 0.00 42.46 39.64 2jub s ILE 20 CO 0.08 0.50 0.73 -0.55 0.00 0.00 0.00 174.94 175.69 2jub s SER 21 N 0.26 6.20 0.17 3.58 0.15 -1.05 -4.87 113.70 118.14 2jub s SER 21 Ca -0.02 -1.44 0.11 0.00 0.70 0.00 0.00 55.95 55.30 2jub s SER 21 Cb -0.14 -2.31 0.62 0.00 -1.71 0.00 0.00 66.02 62.49 2jub s SER 21 CO 0.03 -1.13 1.34 0.00 1.20 0.00 0.00 173.24 174.68 2jub n LEU 22 N 6.38 0.30 -0.32 3.45 -0.00 -1.26 0.21 117.00 125.75 2jub n LEU 22 Ca -0.08 0.63 -0.03 0.00 -0.00 0.00 0.00 56.01 56.53 2jub n LEU 22 Cb 0.43 -0.67 0.09 0.00 -0.00 0.00 0.00 43.42 43.27 2jub n LEU 22 CO 0.58 -0.74 1.24 0.58 -0.00 0.00 0.00 177.39 179.06 2jub h VAL 23 N 0.00 1.20 0.00 1.47 2.07 -1.96 -3.20 116.25 115.83 2jub h VAL 23 Ca 0.00 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2jub h VAL 23 Cb 0.02 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.72 2jub h VAL 23 CO 0.00 0.21 -0.74 0.47 0.02 0.00 0.00 177.57 177.53 2jub n ASP 24 N -4.49 2.70 0.00 0.57 8.00 -0.44 -4.99 116.55 117.90 2jub n ASP 24 Ca 0.10 -0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.38 2jub n ASP 24 Cb 0.04 1.08 0.00 0.00 -0.02 0.00 0.00 41.12 42.22 2jub n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jub n GLY 25 N 1.84 0.53 3.85 0.44 0.00 0.56 -5.01 105.19 107.40 2jub n GLY 25 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.12 3.60 -0.16 1.61 0.41 -1.20 -4.83 118.70 118.00 2jub s GLU 26 Ca 0.00 0.87 -0.15 0.00 -0.41 0.00 0.00 54.97 55.27 2jub s GLU 26 Cb 0.00 -2.08 -0.04 0.00 -1.78 0.00 0.00 34.13 30.22 2jub s GLU 26 CO 0.00 -0.57 0.35 -1.21 -0.49 0.00 0.00 175.26 173.35 2jub s GLU 27 N -4.77 4.25 -0.70 1.61 2.02 -1.26 -2.54 118.70 117.32 2jub s GLU 27 Ca 0.57 0.19 0.05 0.00 0.02 0.00 0.00 54.97 55.80 2jub s GLU 27 Cb -0.11 -3.46 0.18 0.00 0.10 0.00 0.00 34.13 30.84 2jub s GLU 27 CO 0.46 0.15 0.54 -0.89 0.02 0.00 0.00 175.26 175.54 2jub n ILE 28 N 3.81 1.78 -2.23 -1.63 5.41 -0.73 -5.00 119.36 120.78 2jub n ILE 28 Ca -0.10 -4.94 -0.40 0.00 1.00 0.00 0.00 62.75 58.31 2jub n ILE 28 Cb 0.52 -2.18 -0.03 0.00 -0.71 0.00 0.00 39.64 37.24 2jub n ILE 28 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2jub s LYS 29 N -1.65 2.93 0.00 0.38 2.20 -1.26 -3.09 119.74 119.25 2jub s LYS 29 Ca 0.27 0.41 0.00 0.00 -0.36 0.00 0.00 55.97 56.29 2jub s LYS 29 Cb -0.01 -4.28 0.00 0.00 -1.51 0.00 0.00 37.83 32.03 2jub s LYS 29 CO -0.14 -2.39 0.00 0.41 -0.36 0.00 0.00 175.35 172.86 2jub n GLY 30 N 5.52 0.06 3.00 5.54 0.00 -1.19 -5.03 105.19 113.09 2jub n GLY 30 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.06 0.07 -0.23 2.61 -4.23 -1.18 -4.28 115.64 108.34 2jub s THR 31 Ca 0.00 -0.59 -0.01 0.00 -1.18 0.00 0.00 61.69 59.91 2jub s THR 31 Cb 0.00 -0.25 0.07 0.00 1.34 0.00 0.00 72.50 73.65 2jub s THR 31 CO 0.00 -0.33 -0.00 0.68 -0.54 0.00 0.00 174.62 174.43 2jub s VAL 32 N -1.01 1.12 -0.46 2.29 -7.23 -1.26 -3.33 120.40 110.52 2jub s VAL 32 Ca -0.11 -1.03 0.00 0.00 -1.81 0.00 0.00 61.98 59.03 2jub s VAL 32 Cb -0.07 -1.53 0.00 0.00 0.56 0.00 0.00 36.38 35.34 2jub s VAL 32 CO -0.00 -0.21 0.00 -1.22 -0.31 0.00 0.00 175.10 173.36 2jub n TYR 33 N 4.81 -1.11 -3.36 2.82 4.01 -1.26 -4.87 117.16 118.20 2jub n TYR 33 Ca -0.09 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.29 2jub n TYR 33 Cb 0.45 -1.58 -0.06 0.00 -0.31 0.00 0.00 39.34 37.84 2jub n TYR 33 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2jub s LEU 34 N -3.48 4.33 0.00 7.72 2.96 -1.26 -3.45 118.68 125.51 2jub s LEU 34 Ca 0.00 1.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.98 2jub s LEU 34 Cb 0.00 -3.27 0.00 0.00 0.50 0.00 0.00 46.19 43.42 2jub s LEU 34 CO 0.00 0.10 0.00 0.61 -1.32 0.00 0.00 176.35 175.74 2jub n GLY 35 N 0.78 0.63 1.38 7.98 0.00 -1.26 -4.89 105.19 109.83 2jub n GLY 35 Ca -0.05 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2jub n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jub n ASP 36 N 0.90 0.22 0.00 1.61 8.00 -1.26 -5.04 116.55 120.98 2jub n ASP 36 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2jub n ASP 36 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2jub n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jub n GLY 37 N 1.95 0.00 3.62 0.44 0.00 -1.26 -5.00 105.19 104.94 2jub n GLY 37 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 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 0.00 1.52 -3.78 1.61 4.27 -1.22 -4.27 117.44 115.57 2jub n TRP 38 Ca 0.00 0.66 -0.13 0.00 -3.89 0.00 0.00 57.50 54.15 2jub n TRP 38 Cb 0.00 -2.29 -0.12 0.00 -1.36 0.00 0.00 31.31 27.54 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 -0.47 -0.25 0.09 -0.67 0.01 -1.23 -5.03 113.70 106.15 2jub s SER 39 Ca 0.58 0.48 -0.27 0.00 1.31 0.00 0.00 55.95 58.06 2jub s SER 39 Cb -0.67 0.46 0.08 0.00 0.21 0.00 0.00 66.02 66.10 2jub s SER 39 CO 0.60 -0.10 0.97 0.00 0.41 0.00 0.00 173.24 175.12 2jub s ALA 40 N 0.39 -1.75 0.03 1.44 0.00 -1.26 -2.14 121.76 118.47 2jub s ALA 40 Ca -0.02 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.37 2jub s ALA 40 Cb -0.04 0.54 -0.02 0.00 0.00 0.00 0.00 23.12 23.60 2jub s ALA 40 CO -0.02 -0.93 0.02 -1.59 0.00 0.00 0.00 175.76 173.24 2jub s LYS 41 N -3.16 0.49 -0.15 0.00 -2.85 -0.87 -5.02 119.74 108.19 2jub s LYS 41 Ca 0.10 -0.83 -0.06 0.00 -1.00 0.00 0.00 55.97 54.18 2jub s LYS 41 Cb -0.01 0.18 -0.04 0.00 -2.06 0.00 0.00 37.83 35.90 2jub s LYS 41 CO -0.02 -0.10 0.08 0.15 0.10 0.00 0.00 175.35 175.56 2jub s LYS 42 N -2.56 3.64 0.00 1.78 1.02 -1.26 -2.39 119.74 119.97 2jub s LYS 42 Ca -0.06 -0.29 0.17 0.00 0.02 0.00 0.00 55.97 55.81 2jub s LYS 42 Cb -0.02 -3.13 -0.03 0.00 -0.52 0.00 0.00 37.83 34.13 2jub s LYS 42 CO -0.05 0.51 0.86 -3.47 -0.92 0.00 0.00 175.35 172.28 2jub n ASP 43 N 2.81 1.55 0.00 2.83 -0.08 -1.25 -4.97 116.55 117.44 2jub n ASP 43 Ca -0.18 -1.28 0.00 0.00 -1.51 0.00 0.00 54.79 51.83 2jub n ASP 43 Cb 0.53 0.55 0.00 0.00 2.34 0.00 0.00 41.12 44.54 2jub n ASP 43 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jub n GLY 44 N 1.22 0.45 0.48 0.27 0.00 -1.26 -4.72 105.19 101.63 2jub n GLY 44 Ca 0.06 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.15 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 0.01 0.00 -3.65 4.61 0.00 -1.26 -5.07 120.51 115.14 2jub n ALA 45 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2jub n ALA 45 Cb 0.21 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.50 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 -1.45 -0.27 0.23 0.00 2.01 -1.26 -2.02 115.64 112.88 2jub s THR 46 Ca 0.00 0.30 -0.30 0.00 0.31 0.00 0.00 61.69 62.01 2jub s THR 46 Cb 0.00 -0.34 -0.09 0.00 0.01 0.00 0.00 72.50 72.08 2jub s THR 46 CO 0.00 0.11 1.03 -0.63 -0.69 0.00 0.00 174.62 174.44 2jub s ILE 47 N 2.30 3.83 -0.30 1.82 -1.09 -0.33 -3.86 121.20 123.56 2jub s ILE 47 Ca 0.03 1.76 -0.11 0.00 -2.23 0.00 0.00 60.65 60.11 2jub s ILE 47 Cb -0.12 -4.12 -0.02 0.00 -1.58 0.00 0.00 42.46 36.61 2jub s ILE 47 CO -0.06 0.39 0.18 -0.69 -1.23 0.00 0.00 174.94 173.52 2jub s VAL 48 N -0.91 4.94 -0.01 2.92 1.01 -1.00 -2.25 120.40 125.10 2jub s VAL 48 Ca 0.44 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.28 2jub s VAL 48 Cb -0.29 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 2jub s VAL 48 CO 0.36 0.12 -0.16 -0.63 0.00 0.00 0.00 175.10 174.79 2jub s ILE 49 N 1.68 1.26 -0.16 2.22 1.01 -0.93 -2.04 121.20 124.23 2jub s ILE 49 Ca 0.06 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 60.05 2jub s ILE 49 Cb -0.17 -1.05 0.02 0.00 0.01 0.00 0.00 42.46 41.27 2jub s ILE 49 CO 0.08 0.36 -0.21 -0.44 0.00 0.00 0.00 174.94 174.73 2jub s SER 50 N -0.33 3.11 0.00 3.58 0.01 -0.91 -1.00 113.70 118.17 2jub s SER 50 Ca 0.05 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 56.68 2jub s SER 50 Cb -0.07 -1.46 0.00 0.00 0.21 0.00 0.00 66.02 64.70 2jub s SER 50 CO -0.00 0.03 0.47 -2.65 0.41 0.00 0.00 173.24 171.49 2jub n PRO 51 N 4.41 0.00 -0.10 12.44 -0.02 -1.26 -3.47 135.00 147.00 2jub n PRO 51 Ca -0.21 0.47 -0.14 0.00 -2.02 0.00 0.00 63.50 61.60 2jub n PRO 51 Cb 0.51 -0.87 -0.09 0.00 -0.02 0.00 0.00 33.50 33.02 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 -1.20 1.59 -3.00 3.55 0.00 -1.26 -3.60 120.51 116.59 2jub n ALA 52 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.62 2jub n ALA 52 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2jub n ALA 52 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2jub n GLU 53 N -3.14 0.00 -3.32 0.00 0.28 -1.26 -4.25 120.64 108.95 2jub n GLU 53 Ca -0.35 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.57 2jub n GLU 53 Cb 0.86 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.66 2jub n GLU 53 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2jub s GLU 54 N 0.15 0.39 -0.30 3.44 2.02 -1.26 -4.82 118.70 118.32 2jub s GLU 54 Ca 0.00 0.33 -0.07 0.00 0.02 0.00 0.00 54.97 55.25 2jub s GLU 54 Cb 0.00 -0.34 0.01 0.00 0.10 0.00 0.00 34.13 33.90 2jub s GLU 54 CO 0.00 -0.85 0.10 0.95 0.02 0.00 0.00 175.26 175.47 2jub s THR 55 N 2.56 4.07 0.00 3.63 -4.23 -1.26 -4.89 115.64 115.52 2jub s THR 55 Ca 0.11 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.93 2jub s THR 55 Cb -0.14 -3.12 0.00 0.00 1.34 0.00 0.00 72.50 70.58 2jub s THR 55 CO -0.24 0.04 0.00 0.00 -0.54 0.00 0.00 174.62 173.88 2jub n ALA 56 N 4.89 0.00 -0.15 3.99 0.00 -1.26 -0.69 120.51 127.28 2jub n ALA 56 Ca -0.14 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.29 2jub n ALA 56 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.91 2jub n ALA 56 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2jub n LEU 57 N 0.00 1.23 0.00 0.00 -0.00 -1.26 -4.79 117.00 112.18 2jub n LEU 57 Ca 0.00 -0.75 -0.19 0.00 -0.00 0.00 0.00 56.01 55.07 2jub n LEU 57 Cb 0.00 -0.28 0.09 0.00 -0.00 0.00 0.00 43.42 43.23 2jub n LEU 57 CO 0.00 0.16 0.45 2.22 -0.00 0.00 0.00 177.39 180.22 2jub n PHE 58 N 2.22 -2.93 -3.72 1.47 1.16 0.14 -5.11 117.46 110.69 2jub n PHE 58 Ca 0.03 -1.52 -0.22 0.00 -1.87 0.00 0.00 57.45 53.87 2jub n PHE 58 Cb 0.15 -0.60 -0.18 0.00 -1.61 0.00 0.00 39.48 37.25 2jub n PHE 58 CO 0.00 0.00 0.00 -1.59 -1.87 0.00 0.00 176.76 173.30 2jub s LYS 59 N -4.62 0.30 0.86 3.97 -2.85 -1.26 -4.97 119.74 111.17 2jub s LYS 59 Ca 0.55 0.22 -0.10 0.00 -1.00 0.00 0.00 55.97 55.64 2jub s LYS 59 Cb -0.03 -0.80 0.16 0.00 -2.06 0.00 0.00 37.83 35.11 2jub s LYS 59 CO 0.36 -0.32 1.19 0.00 0.10 0.00 0.00 175.35 176.68 2jub s ALA 60 N 2.06 2.79 -0.07 0.59 0.00 -1.26 -4.79 121.76 121.08 2jub s ALA 60 Ca 0.05 -1.35 0.01 0.00 0.00 0.00 0.00 51.96 50.67 2jub s ALA 60 Cb -0.12 -2.51 0.02 0.00 0.00 0.00 0.00 23.12 20.50 2jub s ALA 60 CO -0.04 -2.03 -0.08 0.21 0.00 0.00 0.00 175.76 173.82 2jub s LYS 61 N -5.60 1.31 -0.43 0.00 2.20 -0.17 -5.00 119.74 112.05 2jub s LYS 61 Ca 0.70 -0.25 -0.14 0.00 -0.36 0.00 0.00 55.97 55.93 2jub s LYS 61 Cb -0.05 -1.22 0.04 0.00 -1.51 0.00 0.00 37.83 35.09 2jub s LYS 61 CO 0.50 -0.09 0.32 -1.01 -0.36 0.00 0.00 175.35 174.70 2jub s HIS 62 N 1.03 3.25 -0.09 4.03 3.76 -1.26 -2.19 115.29 123.82 2jub s HIS 62 Ca -0.08 -0.82 -0.04 0.00 -0.15 0.00 0.00 55.06 53.97 2jub s HIS 62 Cb -0.14 -2.79 -0.04 0.00 1.11 0.00 0.00 32.58 30.72 2jub s HIS 62 CO -0.00 -0.69 0.06 0.42 -0.85 0.00 0.00 174.74 173.68 2jub s ILE 63 N 1.63 4.81 0.73 0.60 1.01 -0.95 -4.99 121.20 124.03 2jub s ILE 63 Ca 0.04 -0.10 -0.12 0.00 0.00 0.00 0.00 60.65 60.47 2jub s ILE 63 Cb -0.21 -3.07 0.03 0.00 0.01 0.00 0.00 42.46 39.22 2jub s ILE 63 CO 0.08 0.58 1.10 -0.44 0.00 0.00 0.00 174.94 176.26 2jub s SER 64 N -1.05 4.76 0.25 3.58 0.01 -1.26 -1.19 113.70 118.81 2jub s SER 64 Ca 0.15 1.89 -0.05 0.00 1.31 0.00 0.00 55.95 59.25 2jub s SER 64 Cb -0.12 -2.53 0.31 0.00 0.21 0.00 0.00 66.02 63.89 2jub s SER 64 CO 0.04 -1.86 1.90 0.00 0.41 0.00 0.00 173.24 173.74 2jub h ALA 65 N -0.65 1.29 -0.52 1.44 0.00 -1.77 -2.10 119.26 116.94 2jub h ALA 65 Ca -0.45 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 2jub h ALA 65 Cb 1.24 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2jub h ALA 65 CO 0.53 0.53 -0.15 0.00 0.00 0.00 0.00 179.25 180.16 2jub h ALA 66 N 1.40 0.75 -0.02 0.00 0.00 -1.91 -2.04 119.26 117.43 2jub h ALA 66 Ca 0.39 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2jub h ALA 66 Cb -0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2jub h ALA 66 CO -0.12 0.67 0.03 0.45 0.00 0.00 0.00 179.25 180.28 2jub h HIS 67 N 0.89 0.00 -0.92 0.00 -0.00 -1.75 0.38 115.15 113.75 2jub h HIS 67 Ca 0.13 0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.51 2jub h HIS 67 Cb 0.72 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 28.08 2jub h HIS 67 CO 0.05 0.00 0.61 1.25 -0.00 0.00 0.00 177.93 179.84 2jub h LEU 68 N 0.00 1.05 -1.75 2.43 7.12 -0.86 0.11 115.31 123.42 2jub h LEU 68 Ca 0.01 -0.03 0.12 0.00 0.13 0.00 0.00 57.88 58.11 2jub h LEU 68 Cb 0.07 -0.26 -0.03 0.00 -0.53 0.00 0.00 40.66 39.90 2jub h LEU 68 CO -0.00 0.76 0.39 0.11 -0.13 0.00 0.00 178.44 179.57 2jub h LYS 69 N 1.24 0.27 -0.88 1.25 1.79 -0.28 0.13 116.57 120.09 2jub h LYS 69 Ca 0.34 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.80 2jub h LYS 69 Cb -0.13 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.42 2jub h LYS 69 CO -0.08 0.18 0.59 0.82 -1.08 0.00 0.00 179.45 179.87 2jub h ILE 70 N 0.27 1.23 -0.72 1.86 2.04 -0.79 -1.98 117.51 119.43 2jub h ILE 70 Ca 0.27 -0.41 -0.06 0.00 1.00 0.00 0.00 64.86 65.66 2jub h ILE 70 Cb 0.69 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 2jub h ILE 70 CO -0.06 0.22 0.20 0.40 0.00 0.00 0.00 178.15 178.91 2jub h ILE 71 N 1.20 1.26 -0.82 -0.67 5.03 -0.72 -2.20 117.51 120.59 2jub h ILE 71 Ca 0.32 -0.93 0.01 0.00 -0.12 0.00 0.00 64.86 64.14 2jub h ILE 71 Cb -0.14 0.50 -0.04 0.00 -3.03 0.00 0.00 36.82 34.11 2jub h ILE 71 CO -0.07 0.36 0.53 0.00 -0.68 0.00 0.00 178.15 178.29 2jub h ALA 72 N 1.10 1.04 -0.00 1.87 0.00 -0.97 -2.28 119.26 120.01 2jub h ALA 72 Ca 0.23 -0.07 -0.24 0.00 0.00 0.00 0.00 54.91 54.83 2jub h ALA 72 Cb 0.34 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2jub h ALA 72 CO -0.00 0.46 -0.98 1.57 0.00 0.00 0.00 179.25 180.30 2jub h LYS 73 N 1.11 0.55 -0.02 0.00 2.10 -1.33 -2.79 116.57 116.20 2jub h LYS 73 Ca 0.30 -0.59 -0.00 0.00 -2.00 0.00 0.00 60.65 58.36 2jub h LYS 73 Cb -0.11 0.17 -0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2jub h LYS 73 CO -0.06 1.21 -0.01 -0.97 -2.00 0.00 0.00 179.45 177.62 2jub h ASN 74 N 0.31 0.03 0.00 7.07 -0.73 -1.25 -3.36 115.58 117.65 2jub h ASN 74 Ca -0.10 -0.39 -0.00 0.00 1.87 0.00 0.00 56.30 57.67 2jub h ASN 74 Cb 1.63 -0.01 -0.00 0.00 0.27 0.00 0.00 38.32 40.21 2jub h ASN 74 CO 0.18 0.42 -0.03 -0.07 -0.37 0.00 0.00 177.43 177.56 2jub h LEU 75 N -0.35 0.00 0.00 0.34 4.07 -1.56 -3.43 115.31 114.38 2jub h LEU 75 Ca 0.00 -0.43 0.00 0.00 0.08 0.00 0.00 57.88 57.53 2jub h LEU 75 Cb 0.40 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.14 2jub h LEU 75 CO 0.00 0.73 0.00 0.18 -1.08 0.00 0.00 178.44 178.27