#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2juz n ALA 2 N 0.00 0.00 -2.66 3.04 0.00 -1.26 -4.68 120.51 114.95 2juz n ALA 2 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 2juz n ALA 2 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2juz n ALA 2 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2juz s GLN 3 N 0.00 4.32 0.22 0.00 1.11 -1.26 -5.05 119.66 119.00 2juz s GLN 3 Ca 0.00 0.55 -0.30 0.00 0.01 0.00 0.00 55.36 55.63 2juz s GLN 3 Cb 0.00 -3.40 -0.09 0.00 -1.01 0.00 0.00 33.01 28.51 2juz s GLN 3 CO 0.00 0.23 1.12 -1.01 0.01 0.00 0.00 175.29 175.64 2juz s HIS 4 N 0.35 3.55 -1.01 0.91 3.76 -1.26 -4.93 115.29 116.67 2juz s HIS 4 Ca 0.28 1.60 -0.23 0.00 -0.15 0.00 0.00 55.06 56.56 2juz s HIS 4 Cb -0.16 -3.32 -0.03 0.00 1.11 0.00 0.00 32.58 30.18 2juz s HIS 4 CO 0.13 -0.73 1.84 -1.12 -0.85 0.00 0.00 174.74 174.01 2juz s SER 5 N -0.38 5.48 -0.27 1.40 0.01 -1.26 -4.65 113.70 114.02 2juz s SER 5 Ca 0.48 -1.13 0.09 0.00 1.31 0.00 0.00 55.95 56.69 2juz s SER 5 Cb -0.31 -2.57 0.45 0.00 0.21 0.00 0.00 66.02 63.80 2juz s SER 5 CO 0.38 -2.49 1.19 0.29 0.41 0.00 0.00 173.24 173.03 2juz n LYS 6 N 8.72 3.09 -2.44 12.44 5.02 -1.26 -4.98 118.16 138.75 2juz n LYS 6 Ca 0.40 -3.94 -0.00 0.00 -2.02 0.00 0.00 58.31 52.75 2juz n LYS 6 Cb 0.48 -2.09 -0.00 0.00 -0.02 0.00 0.00 35.03 33.39 2juz n LYS 6 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2juz n TYR 7 N -0.78 -3.17 -3.77 2.13 4.01 -1.26 -5.02 117.16 109.30 2juz n TYR 7 Ca 0.37 1.44 -0.37 0.00 -0.16 0.00 0.00 57.90 59.18 2juz n TYR 7 Cb 0.91 -3.47 -0.12 0.00 -0.31 0.00 0.00 39.34 36.35 2juz n TYR 7 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2juz s SER 8 N -1.22 5.25 0.17 7.72 0.15 -1.26 -4.92 113.70 119.59 2juz s SER 8 Ca -0.02 -1.33 0.20 0.00 0.70 0.00 0.00 55.95 55.50 2juz s SER 8 Cb 0.00 -1.84 0.84 0.00 -1.71 0.00 0.00 66.02 63.31 2juz s SER 8 CO 0.61 -0.36 1.61 -0.90 1.20 0.00 0.00 173.24 175.40 2juz n ASP 9 N 4.75 0.42 0.11 5.45 5.75 -1.26 -0.80 116.55 130.98 2juz n ASP 9 Ca -0.11 0.61 -0.19 0.00 -0.01 0.00 0.00 54.79 55.09 2juz n ASP 9 Cb 0.44 -0.70 -0.15 0.00 -1.03 0.00 0.00 41.12 39.68 2juz n ASP 9 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2juz h ALA 10 N 2.33 0.03 -0.33 2.12 0.00 -1.99 -2.20 119.26 119.21 2juz h ALA 10 Ca 0.00 -0.91 -0.11 0.00 0.00 0.00 0.00 54.91 53.89 2juz h ALA 10 Cb 0.31 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2juz h ALA 10 CO 0.00 0.91 -0.23 1.96 0.00 0.00 0.00 179.25 181.89 2juz h GLN 11 N 0.10 0.74 0.28 0.00 1.08 -1.74 -2.62 115.11 112.96 2juz h GLN 11 Ca -0.19 -0.35 0.01 0.00 -1.45 0.00 0.00 58.65 56.66 2juz h GLN 11 Cb 2.04 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 29.43 2juz h GLN 11 CO 0.22 0.97 -0.41 1.25 -0.95 0.00 0.00 178.83 179.92 2juz h LEU 12 N 0.52 -1.15 -0.89 1.46 7.12 -0.99 -0.26 115.31 121.11 2juz h LEU 12 Ca 0.07 0.11 0.03 0.00 0.13 0.00 0.00 57.88 58.22 2juz h LEU 12 Cb 0.78 0.41 -0.05 0.00 -0.53 0.00 0.00 40.66 41.27 2juz h LEU 12 CO 0.06 -0.52 0.57 0.77 -0.13 0.00 0.00 178.44 179.19 2juz h SER 13 N -0.75 0.95 -0.74 1.25 4.64 -1.46 -1.84 113.55 115.61 2juz h SER 13 Ca -0.01 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 2juz h SER 13 Cb 0.71 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.55 2juz h SER 13 CO -0.14 0.65 0.42 0.00 -0.87 0.00 0.00 176.83 176.90 2juz h ALA 14 N 1.37 0.95 -0.29 5.18 0.00 -1.12 0.25 119.26 125.59 2juz h ALA 14 Ca 0.35 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2juz h ALA 14 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2juz h ALA 14 CO -0.12 0.44 0.14 0.82 0.00 0.00 0.00 179.25 180.54 2juz h ILE 15 N 1.02 1.15 -0.32 0.00 2.04 -0.26 0.54 117.51 121.68 2juz h ILE 15 Ca 0.26 -0.42 -0.14 0.00 1.00 0.00 0.00 64.86 65.56 2juz h ILE 15 Cb 0.01 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2juz h ILE 15 CO -0.05 0.15 -0.36 0.58 0.00 0.00 0.00 178.15 178.48 2juz h VAL 16 N 0.34 1.29 -0.28 1.67 2.07 -1.15 -1.82 116.25 118.37 2juz h VAL 16 Ca 0.10 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.09 2juz h VAL 16 Cb 0.11 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2juz h VAL 16 CO -0.01 0.50 0.15 -1.13 0.02 0.00 0.00 177.57 177.10 2juz h ASN 17 N 0.59 0.35 -0.57 0.57 -0.73 -0.35 0.02 115.58 115.46 2juz h ASN 17 Ca 0.05 -0.09 -0.11 0.00 1.87 0.00 0.00 56.30 58.02 2juz h ASN 17 Cb 0.94 -0.09 -0.02 0.00 0.27 0.00 0.00 38.32 39.42 2juz h ASN 17 CO 0.09 0.34 -0.06 -0.78 -0.37 0.00 0.00 177.43 176.65 2juz h ASP 18 N 0.34 1.04 -0.36 1.15 1.82 -0.89 -2.31 116.42 117.21 2juz h ASP 18 Ca 0.10 -0.32 -0.02 0.00 -0.39 0.00 0.00 57.03 56.39 2juz h ASP 18 Cb 0.07 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 39.77 2juz h ASP 18 CO -0.02 1.12 0.16 -0.03 -1.61 0.00 0.00 179.24 178.87 2juz h MET 19 N 0.95 0.58 -0.37 0.28 4.05 -0.96 0.36 114.93 119.82 2juz h MET 19 Ca 0.16 -0.07 0.03 0.00 -0.28 0.00 0.00 59.70 59.53 2juz h MET 19 Cb 0.62 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.28 2juz h MET 19 CO 0.04 0.48 0.19 0.82 0.23 0.00 0.00 176.91 178.67 2juz h ILE 20 N 0.58 0.99 -0.62 1.77 2.04 -0.46 0.29 117.51 122.10 2juz h ILE 20 Ca 0.14 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.78 2juz h ILE 20 Cb 0.12 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 2juz h ILE 20 CO -0.01 0.07 0.04 0.00 0.00 0.00 0.00 178.15 178.25 2juz h ALA 21 N 1.19 0.89 -0.57 1.87 0.00 -0.85 -0.45 119.26 121.34 2juz h ALA 21 Ca 0.16 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2juz h ALA 21 Cb 0.06 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2juz h ALA 21 CO -0.10 0.66 0.38 0.28 0.00 0.00 0.00 179.25 180.47 2juz h VAL 22 N 0.98 1.15 -0.55 0.00 2.07 0.20 -0.69 116.25 119.41 2juz h VAL 22 Ca 0.18 -0.27 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 2juz h VAL 22 Cb 0.51 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 2juz h VAL 22 CO 0.02 0.14 0.03 0.25 0.02 0.00 0.00 177.57 178.03 2juz h LEU 23 N 0.77 0.87 -1.50 2.57 5.85 -0.21 -2.50 115.31 121.17 2juz h LEU 23 Ca 0.21 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2juz h LEU 23 Cb -0.09 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.70 2juz h LEU 23 CO -0.05 0.92 -0.23 -0.08 -0.34 0.00 0.00 178.44 178.66 2juz h GLU 24 N 0.85 0.00 0.00 1.25 4.81 -0.46 0.44 114.58 121.47 2juz h GLU 24 Ca 0.16 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.33 2juz h GLU 24 Cb 0.46 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 2juz h GLU 24 CO 0.02 0.23 -0.32 0.87 -0.73 0.00 0.00 179.01 179.07 2juz h LYS 25 N 0.00 0.00 0.00 1.92 1.79 -0.67 -3.26 116.57 116.34 2juz h LYS 25 Ca -0.00 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.20 2juz h LYS 25 Cb 0.55 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.15 2juz h LYS 25 CO 0.03 0.32 -2.00 0.72 -1.08 0.00 0.00 179.45 177.44 2juz n HIS 26 N -3.61 0.00 -2.81 -1.35 8.25 -0.89 -5.07 115.22 109.74 2juz n HIS 26 Ca -0.01 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.38 2juz n HIS 26 Cb 0.45 -0.71 0.01 0.00 1.12 0.00 0.00 29.99 30.86 2juz n HIS 26 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2juz n LYS 27 N -2.65 -2.45 -2.50 -0.41 4.76 0.15 -4.97 118.16 110.09 2juz n LYS 27 Ca -0.26 2.16 -0.41 0.00 -2.87 0.00 0.00 58.31 56.94 2juz n LYS 27 Cb 0.94 -5.57 -0.04 0.00 -1.84 0.00 0.00 35.03 28.52 2juz n LYS 27 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2juz s ALA 28 N -2.48 3.37 0.00 7.82 0.00 -1.26 -4.91 121.76 124.32 2juz s ALA 28 Ca 0.22 0.82 0.00 0.00 0.00 0.00 0.00 51.96 53.00 2juz s ALA 28 Cb -0.06 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2juz s ALA 28 CO 0.76 -0.24 0.96 -0.35 0.00 0.00 0.00 175.76 176.89 2juz n PRO 29 N 2.48 0.60 0.00 0.00 -0.04 -1.26 -4.77 135.00 132.01 2juz n PRO 29 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2juz n PRO 29 Cb 0.46 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 2juz n PRO 29 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2juz n VAL 30 N 1.31 0.00 0.14 0.52 0.31 -1.26 -4.51 118.33 114.83 2juz n VAL 30 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 2juz n VAL 30 Cb 0.30 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.18 2juz n VAL 30 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2juz h ASP 31 N 0.00 -0.81 0.03 4.52 3.32 -2.00 -1.43 116.42 120.05 2juz h ASP 31 Ca 0.00 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 2juz h ASP 31 Cb 0.00 0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 2juz h ASP 31 CO 0.00 -0.36 -0.02 -0.07 -1.72 0.00 0.00 179.24 177.07 2juz h LEU 32 N -0.53 0.00 -0.78 1.55 3.38 -1.93 0.10 115.31 117.11 2juz h LEU 32 Ca -0.03 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 2juz h LEU 32 Cb 0.47 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2juz h LEU 32 CO -0.07 0.02 -0.27 -1.28 0.09 0.00 0.00 178.44 176.93 2juz h SER 33 N 0.00 0.64 0.79 -0.43 0.87 -1.79 0.21 113.55 113.84 2juz h SER 33 Ca -0.00 -0.23 -0.23 0.00 -1.23 0.00 0.00 61.79 60.10 2juz h SER 33 Cb 0.03 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 2juz h SER 33 CO 0.00 0.88 -1.04 -0.07 -0.53 0.00 0.00 176.83 176.07 2juz h LEU 34 N 0.54 0.18 -0.10 2.23 3.38 0.19 -2.44 115.31 119.31 2juz h LEU 34 Ca 0.07 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 2juz h LEU 34 Cb 0.74 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2juz h LEU 34 CO 0.06 1.11 -0.09 0.40 0.09 0.00 0.00 178.44 180.00 2juz h ILE 35 N 0.04 1.36 -0.43 1.22 1.08 -0.85 0.36 117.51 120.30 2juz h ILE 35 Ca -0.06 -1.25 0.09 0.00 -0.39 0.00 0.00 64.86 63.25 2juz h ILE 35 Cb 1.77 1.98 -0.09 0.00 -3.07 0.00 0.00 36.82 37.40 2juz h ILE 35 CO 0.15 0.35 -0.29 0.00 -0.69 0.00 0.00 178.15 177.68 2juz h ALA 36 N 0.58 -0.06 -0.59 1.87 0.00 -1.03 0.25 119.26 120.28 2juz h ALA 36 Ca 0.02 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2juz h ALA 36 Cb 0.61 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2juz h ALA 36 CO 0.02 -0.66 0.29 -0.07 0.00 0.00 0.00 179.25 178.83 2juz h LEU 37 N -0.20 0.77 -0.04 0.00 4.07 -1.35 0.19 115.31 118.74 2juz h LEU 37 Ca 0.19 -0.13 0.01 0.00 0.08 0.00 0.00 57.88 58.04 2juz h LEU 37 Cb 0.51 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.04 2juz h LEU 37 CO -0.55 0.67 -0.03 1.23 -1.08 0.00 0.00 178.44 178.69 2juz h GLY 38 N 0.80 0.01 1.07 0.83 0.00 0.41 0.40 103.07 106.59 2juz h GLY 38 Ca 0.20 0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.47 2juz h GLY 38 CO -0.03 -0.04 0.01 -0.57 0.00 0.00 0.00 176.54 175.92 2juz h ASN 39 N -0.03 1.02 -0.13 0.19 -1.24 -0.41 -2.74 115.58 112.25 2juz h ASN 39 Ca 0.03 -0.30 0.00 0.00 0.71 0.00 0.00 56.30 56.74 2juz h ASN 39 Cb 0.07 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.84 2juz h ASN 39 CO -0.06 1.07 0.09 -0.03 -1.29 0.00 0.00 177.43 177.21 2juz h MET 40 N 0.94 0.17 0.05 6.67 4.05 -0.29 -0.19 114.93 126.33 2juz h MET 40 Ca 0.17 -0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.61 2juz h MET 40 Cb 0.54 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.25 2juz h MET 40 CO 0.03 0.12 -0.33 0.00 0.23 0.00 0.00 176.91 176.95 2juz h ALA 41 N 1.04 -0.52 -0.15 0.39 0.00 -0.12 0.24 119.26 120.14 2juz h ALA 41 Ca 0.05 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2juz h ALA 41 Cb -0.02 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2juz h ALA 41 CO -0.01 -0.86 0.07 0.77 0.00 0.00 0.00 179.25 179.22 2juz h SER 42 N -0.51 0.11 -0.37 0.00 0.02 -1.38 -0.24 113.55 111.18 2juz h SER 42 Ca 0.05 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 2juz h SER 42 Cb 0.58 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 2juz h SER 42 CO -0.24 0.09 0.16 -1.13 -1.14 0.00 0.00 176.83 174.56 2juz h ASN 43 N 0.16 0.51 -0.09 3.07 -1.24 -0.69 -1.82 115.58 115.48 2juz h ASN 43 Ca 0.06 -0.16 -0.16 0.00 0.71 0.00 0.00 56.30 56.75 2juz h ASN 43 Cb 0.01 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 38.93 2juz h ASN 43 CO -0.04 0.53 -0.52 -0.07 -1.29 0.00 0.00 177.43 176.03 2juz h LEU 44 N 0.46 0.74 -1.56 0.34 3.38 -0.43 -2.68 115.31 115.56 2juz h LEU 44 Ca 0.13 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 2juz h LEU 44 Cb 0.17 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2juz h LEU 44 CO -0.01 1.12 -0.06 -0.07 0.09 0.00 0.00 178.44 179.51 2juz h LEU 45 N 0.52 0.00 -2.51 1.67 3.38 -0.85 0.41 115.31 117.93 2juz h LEU 45 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2juz h LEU 45 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2juz h LEU 45 CO 0.10 0.06 0.00 0.35 0.09 0.00 0.00 178.44 179.04 2juz n THR 46 N -3.20 0.71 0.00 0.22 -2.24 -0.70 -4.49 114.28 104.57 2juz n THR 46 Ca -0.00 -0.86 0.00 0.00 -2.27 0.00 0.00 64.05 60.92 2juz n THR 46 Cb 0.31 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 2juz n THR 46 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2juz n THR 47 N 1.54 0.00 -0.08 4.28 -2.24 -0.89 -4.99 114.28 111.90 2juz n THR 47 Ca 0.21 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.77 2juz n THR 47 Cb 0.61 -0.41 -0.12 0.00 -2.10 0.00 0.00 70.33 68.31 2juz n THR 47 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2juz n SER 48 N -2.19 2.01 -4.88 3.42 7.64 0.14 -4.93 113.62 114.83 2juz n SER 48 Ca 0.00 0.15 -0.30 0.00 1.01 0.00 0.00 58.87 59.73 2juz n SER 48 Cb 0.07 -0.73 -0.02 0.00 -1.01 0.00 0.00 64.21 62.53 2juz n SER 48 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2juz s VAL 49 N -2.51 4.78 -0.21 0.44 -7.23 -1.11 -4.97 120.40 109.60 2juz s VAL 49 Ca -0.30 0.60 -0.34 0.00 -1.81 0.00 0.00 61.98 60.14 2juz s VAL 49 Cb 0.09 -3.79 -0.10 0.00 0.56 0.00 0.00 36.38 33.13 2juz s VAL 49 CO 0.64 -0.73 2.05 -2.65 -0.31 0.00 0.00 175.10 174.10 2juz n PRO 50 N -1.83 1.73 0.30 4.82 -0.02 -1.26 -4.82 135.00 133.91 2juz n PRO 50 Ca 0.03 0.56 0.19 0.00 -2.02 0.00 0.00 63.50 62.26 2juz n PRO 50 Cb 0.54 -2.68 0.85 0.00 -0.02 0.00 0.00 33.50 32.20 2juz n PRO 50 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 2juz h GLN 51 N 11.36 0.00 0.00 -0.52 3.07 -1.93 0.13 115.11 127.21 2juz h GLN 51 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.34 2juz h GLN 51 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.84 2juz h GLN 51 CO 0.97 0.01 0.00 -2.37 0.09 0.00 0.00 178.83 177.54 2juz n THR 52 N -3.13 0.11 -1.16 1.86 5.66 -1.26 -2.87 114.28 113.50 2juz n THR 52 Ca -0.01 0.03 0.03 0.00 -3.05 0.00 0.00 64.05 61.05 2juz n THR 52 Cb 0.23 -0.58 0.04 0.00 -1.55 0.00 0.00 70.33 68.46 2juz n THR 52 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2juz n GLN 53 N -1.26 0.88 -0.01 1.09 6.02 0.33 -4.87 117.38 119.57 2juz n GLN 53 Ca 0.14 -1.38 -0.12 0.00 -0.01 0.00 0.00 57.00 55.63 2juz n GLN 53 Cb 0.20 -0.85 -0.06 0.00 1.02 0.00 0.00 30.24 30.55 2juz n GLN 53 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2juz h GLU 55 N -0.02 0.50 0.32 0.00 -0.00 -1.89 -1.13 114.58 112.36 2juz h GLU 55 Ca 0.03 -0.34 -0.02 0.00 -0.00 0.00 0.00 59.36 59.03 2juz h GLU 55 Cb 0.16 0.05 0.00 0.00 -0.00 0.00 0.00 28.75 28.97 2juz h GLU 55 CO -0.00 0.96 -0.15 0.00 -0.00 0.00 0.00 179.01 179.81 2juz h ALA 56 N 0.96 -0.43 -0.40 1.06 0.00 -1.84 -1.08 119.26 117.53 2juz h ALA 56 Ca -0.01 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 2juz h ALA 56 Cb 1.16 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 2juz h ALA 56 CO 0.11 -0.72 -0.18 -0.07 0.00 0.00 0.00 179.25 178.39 2juz h LEU 57 N -0.48 0.78 0.12 0.00 4.07 -0.87 -0.99 115.31 117.94 2juz h LEU 57 Ca -0.04 -0.26 -0.00 0.00 0.08 0.00 0.00 57.88 57.65 2juz h LEU 57 Cb 0.37 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 41.89 2juz h LEU 57 CO 0.07 0.96 -0.07 0.00 -1.08 0.00 0.00 178.44 178.32 2juz h ALA 58 N 1.11 -0.18 -0.49 1.53 0.00 -1.10 0.13 119.26 120.26 2juz h ALA 58 Ca 0.10 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2juz h ALA 58 Cb 0.68 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2juz h ALA 58 CO 0.05 -0.60 -0.05 1.96 0.00 0.00 0.00 179.25 180.61 2juz h GLN 59 N -0.19 0.90 -0.23 0.00 4.20 -1.12 -0.41 115.11 118.26 2juz h GLN 59 Ca -0.01 -0.31 0.01 0.00 0.06 0.00 0.00 58.65 58.40 2juz h GLN 59 Cb 0.16 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 2juz h GLN 59 CO 0.01 0.95 0.12 0.00 -0.67 0.00 0.00 178.83 179.24 2juz h ALA 60 N 0.91 0.27 -0.51 3.87 0.00 -1.02 0.13 119.26 122.91 2juz h ALA 60 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2juz h ALA 60 Cb 0.58 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2juz h ALA 60 CO 0.03 -0.28 0.33 0.35 0.00 0.00 0.00 179.25 179.68 2juz h PHE 61 N 0.25 0.65 0.79 0.00 3.57 -0.63 -2.02 116.94 119.56 2juz h PHE 61 Ca 0.09 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 2juz h PHE 61 Cb 0.01 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.54 2juz h PHE 61 CO -0.09 0.42 -0.40 0.77 -2.23 0.00 0.00 178.31 176.78 2juz h SER 62 N 0.69 -0.97 -0.08 0.41 0.02 -0.60 -2.37 113.55 110.65 2juz h SER 62 Ca 0.19 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.19 2juz h SER 62 Cb -0.06 0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 2juz h SER 62 CO -0.04 -0.67 0.06 0.78 -1.14 0.00 0.00 176.83 175.82 2juz h ASN 63 N -1.09 0.05 -0.53 3.07 2.35 -0.72 0.11 115.58 118.83 2juz h ASN 63 Ca -0.11 -0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 2juz h ASN 63 Cb 0.85 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 39.18 2juz h ASN 63 CO 0.16 0.04 0.03 0.28 -1.65 0.00 0.00 177.43 176.28 2juz h SER 64 N 0.06 0.89 -0.34 5.81 0.02 -1.21 -0.83 113.55 117.96 2juz h SER 64 Ca 0.03 -0.29 -0.08 0.00 -0.84 0.00 0.00 61.79 60.61 2juz h SER 64 Cb 0.06 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 2juz h SER 64 CO -0.00 0.96 -0.10 -0.07 -1.14 0.00 0.00 176.83 176.48 2juz h LEU 65 N 0.79 0.67 -0.51 5.07 3.38 -0.44 -2.00 115.31 122.27 2juz h LEU 65 Ca 0.15 -0.38 0.08 0.00 0.09 0.00 0.00 57.88 57.83 2juz h LEU 65 Cb 0.49 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 2juz h LEU 65 CO 0.02 0.90 0.13 0.40 0.09 0.00 0.00 178.44 179.98 2juz h ILE 66 N 0.45 0.75 0.03 1.22 1.08 -0.76 -0.36 117.51 119.91 2juz h ILE 66 Ca 0.08 -0.10 -0.00 0.00 -0.39 0.00 0.00 64.86 64.45 2juz h ILE 66 Cb 0.61 0.44 -0.00 0.00 -3.07 0.00 0.00 36.82 34.80 2juz h ILE 66 CO 0.04 0.05 -0.02 -1.13 -0.69 0.00 0.00 178.15 176.40 2juz h ASN 67 N 0.28 -0.04 -0.20 1.72 -0.73 -1.01 -0.61 115.58 114.99 2juz h ASN 67 Ca 0.26 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.42 2juz h ASN 67 Cb 0.33 0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.92 2juz h ASN 67 CO -0.31 -0.03 0.10 0.00 -0.37 0.00 0.00 177.43 176.82 2juz h ALA 68 N 0.92 0.26 -0.46 1.57 0.00 -0.85 0.10 119.26 120.81 2juz h ALA 68 Ca -0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2juz h ALA 68 Cb 0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2juz h ALA 68 CO 0.00 -0.17 -0.11 0.28 0.00 0.00 0.00 179.25 179.25 2juz h VAL 69 N 0.20 1.27 -0.21 0.00 2.07 -1.05 -0.10 116.25 118.43 2juz h VAL 69 Ca 0.07 -1.23 -0.14 0.00 0.82 0.00 0.00 66.70 66.22 2juz h VAL 69 Cb 0.13 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2juz h VAL 69 CO -0.01 0.42 -0.46 0.50 0.02 0.00 0.00 177.57 178.05 2juz h LYS 70 N 0.73 0.53 0.00 1.57 3.64 -0.97 -1.22 116.57 120.85 2juz h LYS 70 Ca 0.12 -0.29 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 2juz h LYS 70 Cb 0.66 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 2juz h LYS 70 CO 0.05 0.88 -0.06 1.15 -2.27 0.00 0.00 179.45 179.19 2juz h THR 71 N 0.43 0.13 -0.14 1.00 2.02 -0.68 0.83 112.91 116.50 2juz h THR 71 Ca 0.03 -0.92 -0.11 0.00 0.77 0.00 0.00 66.41 66.18 2juz h THR 71 Cb 0.96 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 2juz h THR 71 CO 0.09 0.06 -0.34 -0.09 0.37 0.00 0.00 175.52 175.61 2juz h ARG 72 N 0.00 0.48 0.69 6.66 1.12 -0.41 -3.31 114.38 119.61 2juz h ARG 72 Ca -0.00 -0.33 -0.03 0.00 -1.11 0.00 0.00 59.98 58.51 2juz h ARG 72 Cb 0.81 0.05 0.01 0.00 -0.01 0.00 0.00 29.97 30.82 2juz h ARG 72 CO 0.01 0.94 -0.33 1.25 -3.11 0.00 0.00 179.97 178.73 2juz h LEU 73 N 0.10 -0.78 -2.98 3.80 5.85 -1.02 -3.48 115.31 116.79 2juz h LEU 73 Ca -0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2juz h LEU 73 Cb 0.95 0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.18 2juz h LEU 73 CO 0.07 -0.46 -0.87 1.21 -0.34 0.00 0.00 178.44 178.05 2juz n GLU 74 N -5.43 -0.23 -3.36 1.25 2.13 0.27 -4.90 120.64 110.36 2juz n GLU 74 Ca -0.13 0.68 -0.44 0.00 0.66 0.00 0.00 57.16 57.92 2juz n GLU 74 Cb 0.38 -0.86 -0.07 0.00 0.27 0.00 0.00 31.44 31.17 2juz n GLU 74 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 2juz s HIS 75 N -0.87 3.22 -0.46 4.31 3.76 -1.26 -4.97 115.29 119.02 2juz s HIS 75 Ca 0.00 -0.89 0.03 0.00 -0.15 0.00 0.00 55.06 54.05 2juz s HIS 75 Cb 0.00 -3.22 0.16 0.00 1.11 0.00 0.00 32.58 30.63 2juz s HIS 75 CO 0.00 -0.83 0.32 -3.38 -0.85 0.00 0.00 174.74 170.00 2juz s HIS 76 N 1.75 1.67 0.23 1.40 -3.43 -1.26 -4.97 115.29 110.67 2juz s HIS 76 Ca 0.05 -2.39 -0.04 0.00 -0.80 0.00 0.00 55.06 51.88 2juz s HIS 76 Cb -0.24 -1.46 0.23 0.00 -1.43 0.00 0.00 32.58 29.68 2juz s HIS 76 CO 0.07 -0.77 1.71 1.25 -2.00 0.00 0.00 174.74 175.00 2juz h HIS 77 N 6.13 0.95 -3.84 0.38 2.76 -2.03 -3.41 115.15 116.08 2juz h HIS 77 Ca 0.14 -0.15 -0.49 0.00 -2.20 0.00 0.00 60.37 57.67 2juz h HIS 77 Cb 0.90 -0.25 -0.31 0.00 1.55 0.00 0.00 27.41 29.30 2juz h HIS 77 CO 0.42 0.88 -0.81 -1.58 -1.30 0.00 0.00 177.93 175.54 2juz s HIS 78 N -4.94 1.29 0.14 5.26 5.65 -1.26 -5.12 115.29 116.31 2juz s HIS 78 Ca -0.10 -0.35 -0.30 0.00 0.25 0.00 0.00 55.06 54.56 2juz s HIS 78 Cb 0.14 -0.89 -0.07 0.00 -1.18 0.00 0.00 32.58 30.58 2juz s HIS 78 CO 0.83 -0.13 1.13 -1.58 -0.65 0.00 0.00 174.74 174.34 2juz s HIS 79 N 0.14 3.54 -2.25 3.88 2.46 -1.26 -5.21 115.29 116.58 2juz s HIS 79 Ca -0.04 1.51 0.30 0.00 0.47 0.00 0.00 55.06 57.30 2juz s HIS 79 Cb -0.10 -3.32 1.48 0.00 -0.13 0.00 0.00 32.58 30.50 2juz s HIS 79 CO 0.01 -0.81 1.98 0.72 -2.47 0.00 0.00 174.74 174.17