#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2juz s ALA 2 N 0.00 3.01 -0.62 -5.12 0.00 -1.26 -4.92 121.76 112.85 2juz s ALA 2 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.46 2juz s ALA 2 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.92 2juz s ALA 2 CO 0.00 -0.03 0.63 0.00 0.00 0.00 0.00 175.76 176.36 2juz n GLN 3 N -0.55 0.91 -2.37 0.00 10.64 -1.26 -4.85 117.38 119.90 2juz n GLN 3 Ca 0.07 0.00 -0.01 0.00 -1.83 0.00 0.00 57.00 55.23 2juz n GLN 3 Cb 0.53 -1.30 -0.01 0.00 -0.86 0.00 0.00 30.24 28.60 2juz n GLN 3 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 2juz n HIS 4 N 0.23 -3.00 -1.46 2.61 8.25 -1.26 -4.82 115.22 115.78 2juz n HIS 4 Ca 0.00 1.40 -0.42 0.00 -0.26 0.00 0.00 57.72 58.44 2juz n HIS 4 Cb 0.31 -3.34 -0.03 0.00 1.12 0.00 0.00 29.99 28.06 2juz n HIS 4 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2juz n SER 5 N 0.63 3.34 -0.52 0.41 7.64 -1.26 -4.59 113.62 119.27 2juz n SER 5 Ca -0.05 -2.76 0.13 0.00 1.01 0.00 0.00 58.87 57.20 2juz n SER 5 Cb 0.08 -1.41 0.46 0.00 -1.01 0.00 0.00 64.21 62.33 2juz n SER 5 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2juz n LYS 6 N 6.45 1.70 -2.65 1.43 4.76 -1.26 -4.98 118.16 123.61 2juz n LYS 6 Ca 0.51 -1.04 -0.02 0.00 -2.87 0.00 0.00 58.31 54.89 2juz n LYS 6 Cb 0.39 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 2juz n LYS 6 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2juz n TYR 7 N 0.25 -3.56 -2.47 2.13 4.02 -1.26 -4.90 117.16 111.37 2juz n TYR 7 Ca 0.18 1.54 -0.43 0.00 -0.01 0.00 0.00 57.90 59.18 2juz n TYR 7 Cb 0.35 -3.84 -0.02 0.00 -0.02 0.00 0.00 39.34 35.81 2juz n TYR 7 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2juz s SER 8 N -1.77 6.42 0.52 7.72 0.15 -1.26 -4.83 113.70 120.65 2juz s SER 8 Ca 0.06 0.53 0.35 0.00 0.70 0.00 0.00 55.95 57.59 2juz s SER 8 Cb -0.02 -2.55 1.91 0.00 -1.71 0.00 0.00 66.02 63.65 2juz s SER 8 CO 0.72 -1.42 2.08 0.44 1.20 0.00 0.00 173.24 176.25 2juz h ASP 9 N 10.10 0.00 0.02 5.45 3.32 -1.98 0.50 116.42 133.84 2juz h ASP 9 Ca -0.25 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.74 2juz h ASP 9 Cb 1.08 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.64 2juz h ASP 9 CO 1.13 0.00 -0.23 0.00 -1.72 0.00 0.00 179.24 178.42 2juz h ALA 10 N 2.00 -0.00 -0.35 3.45 0.00 -1.99 -2.15 119.26 120.23 2juz h ALA 10 Ca 0.00 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.23 2juz h ALA 10 Cb 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2juz h ALA 10 CO 0.00 0.08 -0.45 1.96 0.00 0.00 0.00 179.25 180.84 2juz h GLN 11 N -0.67 0.92 0.35 0.00 1.08 -1.79 -2.39 115.11 112.60 2juz h GLN 11 Ca -0.03 -0.53 -0.00 0.00 -1.45 0.00 0.00 58.65 56.64 2juz h GLN 11 Cb 1.08 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 28.51 2juz h GLN 11 CO 0.04 1.17 -0.50 1.25 -0.95 0.00 0.00 178.83 179.85 2juz h LEU 12 N 0.73 -1.42 -0.56 1.46 5.85 -0.11 -2.55 115.31 118.70 2juz h LEU 12 Ca 0.04 0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 2juz h LEU 12 Cb 1.06 0.49 -0.01 0.00 0.37 0.00 0.00 40.66 42.57 2juz h LEU 12 CO 0.11 -0.62 -0.27 0.28 -0.34 0.00 0.00 178.44 177.60 2juz h SER 13 N -0.89 0.00 -0.65 1.25 0.02 -1.44 -2.22 113.55 109.61 2juz h SER 13 Ca -0.04 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 2juz h SER 13 Cb 0.82 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.33 2juz h SER 13 CO -0.15 0.27 0.35 0.00 -1.14 0.00 0.00 176.83 176.16 2juz h ALA 14 N 1.73 1.35 -0.18 3.77 0.00 -1.27 0.42 119.26 125.08 2juz h ALA 14 Ca -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2juz h ALA 14 Cb 0.99 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2juz h ALA 14 CO 0.03 0.52 -0.01 0.82 0.00 0.00 0.00 179.25 180.61 2juz h ILE 15 N 0.94 1.27 0.00 0.00 2.04 -0.99 -2.12 117.51 118.65 2juz h ILE 15 Ca 0.24 -0.91 -0.12 0.00 1.00 0.00 0.00 64.86 65.06 2juz h ILE 15 Cb 0.05 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 2juz h ILE 15 CO -0.04 0.27 -0.59 1.62 0.00 0.00 0.00 178.15 179.42 2juz h VAL 16 N 0.05 1.36 -0.02 1.67 3.04 -1.08 -1.93 116.25 119.34 2juz h VAL 16 Ca 0.05 -2.06 -0.11 0.00 -1.01 0.00 0.00 66.70 63.57 2juz h VAL 16 Cb 0.42 2.13 -0.01 0.00 -2.01 0.00 0.00 31.29 31.81 2juz h VAL 16 CO 0.01 0.58 -0.51 0.78 -1.01 0.00 0.00 177.57 177.42 2juz h ASN 17 N 0.00 0.06 -0.27 3.17 -0.26 -0.17 -1.94 115.58 116.18 2juz h ASN 17 Ca -0.01 -0.03 -0.09 0.00 -0.56 0.00 0.00 56.30 55.61 2juz h ASN 17 Cb 1.08 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 38.32 2juz h ASN 17 CO 0.08 0.56 -0.20 -0.78 -1.06 0.00 0.00 177.43 176.03 2juz h ASP 18 N 0.05 0.64 -0.90 5.81 3.58 -1.02 -2.03 116.42 122.55 2juz h ASP 18 Ca -0.00 -0.45 0.11 0.00 0.42 0.00 0.00 57.03 57.12 2juz h ASP 18 Cb 0.92 -0.18 -0.07 0.00 1.72 0.00 0.00 39.33 41.72 2juz h ASP 18 CO 0.07 0.95 0.58 -0.03 -2.88 0.00 0.00 179.24 177.93 2juz h MET 19 N 0.33 0.81 -0.63 0.28 4.05 -1.06 0.47 114.93 119.18 2juz h MET 19 Ca 0.05 -0.05 -0.06 0.00 -0.28 0.00 0.00 59.70 59.36 2juz h MET 19 Cb 0.74 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 31.33 2juz h MET 19 CO 0.05 0.54 0.15 0.82 0.23 0.00 0.00 176.91 178.70 2juz h ILE 20 N 0.84 1.26 -0.69 1.77 2.04 -1.13 -1.41 117.51 120.18 2juz h ILE 20 Ca 0.43 -0.94 -0.08 0.00 1.00 0.00 0.00 64.86 65.28 2juz h ILE 20 Cb 0.51 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 2juz h ILE 20 CO -0.20 0.35 0.13 0.00 0.00 0.00 0.00 178.15 178.44 2juz h ALA 21 N 1.05 0.92 -0.90 1.87 0.00 -0.09 -1.70 119.26 120.42 2juz h ALA 21 Ca 0.20 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 54.92 2juz h ALA 21 Cb 0.37 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2juz h ALA 21 CO 0.00 0.67 0.56 0.28 0.00 0.00 0.00 179.25 180.76 2juz h VAL 22 N 1.06 0.99 -0.08 0.00 2.07 0.15 0.19 116.25 120.64 2juz h VAL 22 Ca 0.21 -0.33 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 2juz h VAL 22 Cb 0.42 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2juz h VAL 22 CO 0.01 0.18 0.05 0.25 0.02 0.00 0.00 177.57 178.07 2juz h LEU 23 N 0.97 0.10 -0.73 2.57 6.46 -0.75 -2.13 115.31 121.80 2juz h LEU 23 Ca 0.41 -0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 58.08 2juz h LEU 23 Cb 0.27 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.14 2juz h LEU 23 CO -0.21 0.15 0.39 -0.33 -0.62 0.00 0.00 178.44 177.82 2juz h GLU 24 N 0.05 1.02 -0.51 1.25 4.39 -0.47 0.15 114.58 120.46 2juz h GLU 24 Ca 0.03 -0.12 -0.05 0.00 0.34 0.00 0.00 59.36 59.56 2juz h GLU 24 Cb 0.07 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 2juz h GLU 24 CO -0.00 0.77 0.11 0.87 -1.16 0.00 0.00 179.01 179.60 2juz h LYS 25 N 1.01 0.77 0.00 2.33 1.57 -0.53 -2.71 116.57 119.01 2juz h LYS 25 Ca 0.26 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2juz h LYS 25 Cb 0.05 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2juz h LYS 25 CO -0.04 0.71 -0.76 0.72 -0.57 0.00 0.00 179.45 179.51 2juz n HIS 26 N -4.28 0.40 -3.29 -1.35 8.25 -0.81 -4.98 115.22 109.16 2juz n HIS 26 Ca 0.04 0.12 -0.15 0.00 -0.26 0.00 0.00 57.72 57.46 2juz n HIS 26 Cb 0.22 -0.54 0.08 0.00 1.12 0.00 0.00 29.99 30.87 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 -2.00 -3.59 -3.17 -0.41 5.02 0.47 -4.98 118.16 109.51 2juz n LYS 27 Ca 0.03 0.85 -0.39 0.00 -2.02 0.00 0.00 58.31 56.78 2juz n LYS 27 Cb 0.43 -5.80 -0.06 0.00 -0.02 0.00 0.00 35.03 29.58 2juz n LYS 27 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2juz s ALA 28 N -3.38 3.47 0.79 7.82 0.00 -1.06 -5.06 121.76 124.34 2juz s ALA 28 Ca 0.31 -0.15 -0.11 0.00 0.00 0.00 0.00 51.96 52.01 2juz s ALA 28 Cb -0.04 -2.85 0.06 0.00 0.00 0.00 0.00 23.12 20.29 2juz s ALA 28 CO 0.73 -0.25 1.09 -1.25 0.00 0.00 0.00 175.76 176.08 2juz s PRO 29 N 1.19 2.16 0.50 0.00 0.04 -1.26 -4.79 135.00 132.85 2juz s PRO 29 Ca 0.30 1.07 0.18 0.00 0.04 0.00 0.00 61.00 62.59 2juz s PRO 29 Cb -0.16 -1.89 1.24 0.00 0.04 0.00 0.00 34.50 33.73 2juz s PRO 29 CO 0.12 -1.68 2.07 0.28 0.04 0.00 0.00 177.00 177.83 2juz h VAL 30 N -1.15 0.91 0.35 -0.36 2.07 -1.97 -0.73 116.25 115.37 2juz h VAL 30 Ca -0.45 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 2juz h VAL 30 Cb 1.24 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 2juz h VAL 30 CO 0.53 0.02 -0.22 0.44 0.02 0.00 0.00 177.57 178.36 2juz h ASP 31 N 0.10 -0.55 0.15 0.57 5.19 -1.99 -0.87 116.42 119.02 2juz h ASP 31 Ca 0.13 0.03 -0.14 0.00 -0.62 0.00 0.00 57.03 56.43 2juz h ASP 31 Cb 0.38 0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.04 2juz h ASP 31 CO -0.01 -0.34 -0.51 -0.07 -3.12 0.00 0.00 179.24 175.19 2juz h LEU 32 N -0.54 0.43 -1.19 1.55 3.38 -1.89 -2.24 115.31 114.82 2juz h LEU 32 Ca -0.05 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 2juz h LEU 32 Cb 0.43 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2juz h LEU 32 CO 0.05 0.87 -0.17 -1.28 0.09 0.00 0.00 178.44 177.99 2juz h SER 33 N 0.31 0.34 0.24 -0.43 0.87 -1.15 0.23 113.55 113.96 2juz h SER 33 Ca 0.01 -0.09 -0.23 0.00 -1.23 0.00 0.00 61.79 60.26 2juz h SER 33 Cb 1.00 -0.09 0.01 0.00 -0.44 0.00 0.00 62.40 62.87 2juz h SER 33 CO 0.09 0.53 -0.92 0.25 -0.53 0.00 0.00 176.83 176.25 2juz h LEU 34 N 0.32 0.62 -0.48 2.23 6.46 -0.85 -2.12 115.31 121.49 2juz h LEU 34 Ca 0.06 -0.48 -0.13 0.00 -0.12 0.00 0.00 57.88 57.21 2juz h LEU 34 Cb 0.50 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.23 2juz h LEU 34 CO 0.03 1.27 -0.23 0.40 -0.62 0.00 0.00 178.44 179.30 2juz h ILE 35 N 0.29 1.27 -0.75 4.05 2.04 -0.98 0.13 117.51 123.55 2juz h ILE 35 Ca -0.08 -1.39 0.01 0.00 1.00 0.00 0.00 64.86 64.40 2juz h ILE 35 Cb 1.55 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 38.73 2juz h ILE 35 CO 0.17 0.48 0.49 0.00 0.00 0.00 0.00 178.15 179.29 2juz h ALA 36 N 0.86 0.96 -0.31 1.87 0.00 -0.97 0.12 119.26 121.79 2juz h ALA 36 Ca 0.11 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2juz h ALA 36 Cb 0.81 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2juz h ALA 36 CO 0.07 0.34 0.17 1.25 0.00 0.00 0.00 179.25 181.08 2juz h LEU 37 N 0.99 0.28 -0.15 0.00 5.85 -0.99 0.11 115.31 121.38 2juz h LEU 37 Ca 0.28 0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.02 2juz h LEU 37 Cb -0.08 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 2juz h LEU 37 CO -0.07 0.20 0.06 1.23 -0.34 0.00 0.00 178.44 179.52 2juz h GLY 38 N 0.36 0.19 0.99 3.75 0.00 -0.13 0.30 103.07 108.53 2juz h GLY 38 Ca 0.12 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 2juz h GLY 38 CO -0.06 0.03 0.31 -0.57 0.00 0.00 0.00 176.54 176.25 2juz h ASN 39 N 0.14 0.79 0.14 0.19 -1.24 -0.64 -2.40 115.58 112.56 2juz h ASN 39 Ca 0.06 -0.12 -0.01 0.00 0.71 0.00 0.00 56.30 56.95 2juz h ASN 39 Cb 0.03 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 38.88 2juz h ASN 39 CO -0.06 0.69 -0.07 -0.03 -1.29 0.00 0.00 177.43 176.67 2juz h MET 40 N 0.84 -0.18 -0.56 6.67 4.05 -0.46 -1.15 114.93 124.15 2juz h MET 40 Ca 0.21 0.01 0.09 0.00 -0.28 0.00 0.00 59.70 59.74 2juz h MET 40 Cb 0.10 0.04 -0.07 0.00 -0.80 0.00 0.00 31.60 30.86 2juz h MET 40 CO -0.03 0.18 0.17 0.00 0.23 0.00 0.00 176.91 177.46 2juz h ALA 41 N 0.22 0.69 0.59 0.39 0.00 -0.41 0.40 119.26 121.13 2juz h ALA 41 Ca -0.02 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2juz h ALA 41 Cb 0.44 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.33 2juz h ALA 41 CO 0.03 -0.25 -0.28 1.03 0.00 0.00 0.00 179.25 179.78 2juz h SER 42 N 0.33 -0.67 -0.44 0.00 0.87 -1.42 -1.96 113.55 110.27 2juz h SER 42 Ca 0.29 -0.03 0.02 0.00 -1.23 0.00 0.00 61.79 60.84 2juz h SER 42 Cb 0.37 0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.48 2juz h SER 42 CO -0.32 -0.38 0.26 -1.13 -0.53 0.00 0.00 176.83 174.73 2juz h ASN 43 N -0.94 0.42 0.12 6.23 -1.24 -0.83 -1.57 115.58 117.77 2juz h ASN 43 Ca -0.08 0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.94 2juz h ASN 43 Cb 0.65 -0.08 -0.02 0.00 0.73 0.00 0.00 38.32 39.60 2juz h ASN 43 CO 0.13 0.30 -0.16 0.25 -1.29 0.00 0.00 177.43 176.66 2juz h LEU 44 N 0.52 -0.44 -0.03 0.34 5.85 -0.24 -1.17 115.31 120.15 2juz h LEU 44 Ca 0.17 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2juz h LEU 44 Cb 0.01 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2juz h LEU 44 CO -0.08 -0.24 0.00 0.18 -0.34 0.00 0.00 178.44 177.96 2juz n LEU 45 N -5.29 0.03 -0.59 2.25 4.77 -0.74 -0.47 117.00 116.97 2juz n LEU 45 Ca -0.07 0.51 0.06 0.00 -0.03 0.00 0.00 56.01 56.48 2juz n LEU 45 Cb 0.20 -0.50 0.10 0.00 -2.33 0.00 0.00 43.42 40.89 2juz n LEU 45 CO 0.29 -0.20 0.52 0.35 -1.33 0.00 0.00 177.39 177.02 2juz n THR 46 N -1.54 0.37 0.00 -5.08 -2.24 -0.61 -4.58 114.28 100.60 2juz n THR 46 Ca 0.04 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 2juz n THR 46 Cb 0.21 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 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 0.69 0.00 -1.19 4.28 -2.24 -0.49 -4.83 114.28 110.50 2juz n THR 47 Ca 0.10 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.75 2juz n THR 47 Cb 0.37 -0.37 0.23 0.00 -2.10 0.00 0.00 70.33 68.46 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 -1.54 3.94 -4.57 3.42 7.64 0.38 -4.95 113.62 117.93 2juz n SER 48 Ca 0.00 -3.47 -0.25 0.00 1.01 0.00 0.00 58.87 56.16 2juz n SER 48 Cb 0.24 -0.76 -0.09 0.00 -1.01 0.00 0.00 64.21 62.59 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 -3.16 3.11 0.01 0.44 -7.23 -1.26 -4.97 120.40 107.34 2juz s VAL 49 Ca 0.54 -1.90 -0.03 0.00 -1.81 0.00 0.00 61.98 58.77 2juz s VAL 49 Cb 0.45 -2.60 -0.02 0.00 0.56 0.00 0.00 36.38 34.77 2juz s VAL 49 CO 0.10 -0.26 1.05 -0.65 -0.31 0.00 0.00 175.10 175.03 2juz h PRO 50 N 2.43 -0.09 0.00 4.82 0.11 -1.93 -3.48 132.00 133.87 2juz h PRO 50 Ca -0.45 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2juz h PRO 50 Cb 1.23 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2juz h PRO 50 CO 0.57 -0.06 0.00 0.94 -0.21 0.00 0.00 178.00 179.24 2juz n GLN 51 N -2.62 0.00 0.24 1.05 7.27 -1.26 -4.96 117.38 117.10 2juz n GLN 51 Ca -0.01 0.00 0.09 0.00 0.07 0.00 0.00 57.00 57.15 2juz n GLN 51 Cb 0.04 0.00 0.62 0.00 2.41 0.00 0.00 30.24 33.32 2juz n GLN 51 CO 0.00 0.00 0.00 1.15 0.07 0.00 0.00 177.06 178.28 2juz h THR 52 N 0.00 0.85 0.00 1.69 2.02 -2.02 -1.19 112.91 114.26 2juz h THR 52 Ca 0.00 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.62 2juz h THR 52 Cb 0.00 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2juz h THR 52 CO 0.00 0.14 0.00 0.00 0.37 0.00 0.00 175.52 176.03 2juz n GLN 53 N -4.00 0.32 0.16 6.66 6.02 -1.26 -3.66 117.38 121.63 2juz n GLN 53 Ca -0.02 0.07 -0.14 0.00 -0.01 0.00 0.00 57.00 56.89 2juz n GLN 53 Cb 0.23 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.92 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 -0.64 0.45 -0.04 0.00 4.81 -1.79 -2.48 114.58 114.88 2juz h GLU 55 Ca 0.01 -0.60 0.01 0.00 -0.13 0.00 0.00 59.36 58.65 2juz h GLU 55 Cb 0.62 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 2juz h GLU 55 CO -0.14 1.24 -0.02 0.00 -0.73 0.00 0.00 179.01 179.37 2juz h ALA 56 N 0.52 0.02 -0.29 2.92 0.00 -1.62 -0.02 119.26 120.78 2juz h ALA 56 Ca -0.14 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 2juz h ALA 56 Cb 1.83 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 2juz h ALA 56 CO 0.21 -0.50 -0.29 -0.07 0.00 0.00 0.00 179.25 178.59 2juz h LEU 57 N -0.02 0.61 -0.09 0.00 4.07 -0.74 -0.75 115.31 118.38 2juz h LEU 57 Ca 0.03 -0.23 0.01 0.00 0.08 0.00 0.00 57.88 57.77 2juz h LEU 57 Cb 0.06 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 2juz h LEU 57 CO -0.06 0.87 0.03 0.00 -1.08 0.00 0.00 178.44 178.19 2juz h ALA 58 N 1.18 0.10 -0.38 1.53 0.00 -1.02 0.29 119.26 120.95 2juz h ALA 58 Ca 0.07 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2juz h ALA 58 Cb 0.76 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2juz h ALA 58 CO 0.06 -0.44 0.04 1.96 0.00 0.00 0.00 179.25 180.88 2juz h GLN 59 N 0.07 0.64 -0.29 0.00 4.20 -0.88 -1.64 115.11 117.21 2juz h GLN 59 Ca 0.04 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.55 2juz h GLN 59 Cb 0.03 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2juz h GLN 59 CO -0.05 0.71 0.14 0.00 -0.67 0.00 0.00 178.83 178.96 2juz h ALA 60 N 0.90 0.38 -0.16 3.87 0.00 -0.95 -0.87 119.26 122.44 2juz h ALA 60 Ca 0.11 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2juz h ALA 60 Cb 0.40 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2juz h ALA 60 CO 0.01 -0.05 0.10 0.35 0.00 0.00 0.00 179.25 179.66 2juz h PHE 61 N 0.34 0.21 -0.43 0.00 3.57 -0.39 0.44 116.94 120.67 2juz h PHE 61 Ca 0.10 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 2juz h PHE 61 Cb 0.13 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2juz h PHE 61 CO -0.02 0.18 0.02 0.66 -2.23 0.00 0.00 178.31 176.93 2juz h SER 62 N 0.18 0.73 0.16 0.41 4.64 -1.20 -1.11 113.55 117.35 2juz h SER 62 Ca 0.06 -0.29 -0.08 0.00 -0.47 0.00 0.00 61.79 61.00 2juz h SER 62 Cb 0.03 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2juz h SER 62 CO -0.01 0.84 -0.30 0.78 -0.87 0.00 0.00 176.83 177.27 2juz h ASN 63 N 0.59 0.24 -0.54 4.97 2.35 -1.09 -1.79 115.58 120.31 2juz h ASN 63 Ca 0.13 -0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.75 2juz h ASN 63 Cb 0.45 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.73 2juz h ASN 63 CO 0.02 0.54 0.16 -1.28 -1.65 0.00 0.00 177.43 175.22 2juz h SER 64 N 0.21 0.83 -0.52 5.81 0.87 -0.46 -1.41 113.55 118.88 2juz h SER 64 Ca 0.03 -0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.43 2juz h SER 64 Cb 0.65 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 2juz h SER 64 CO 0.05 0.80 0.27 -0.07 -0.53 0.00 0.00 176.83 177.35 2juz h LEU 65 N 0.86 0.66 -0.42 2.23 3.38 -0.51 -0.26 115.31 121.26 2juz h LEU 65 Ca 0.19 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.11 2juz h LEU 65 Cb 0.28 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 2juz h LEU 65 CO -0.00 0.57 0.13 0.40 0.09 0.00 0.00 178.44 179.62 2juz h ILE 66 N 0.69 0.84 -0.57 1.22 1.08 -0.77 0.12 117.51 120.13 2juz h ILE 66 Ca 0.18 -0.10 -0.02 0.00 -0.39 0.00 0.00 64.86 64.53 2juz h ILE 66 Cb 0.07 0.54 -0.03 0.00 -3.07 0.00 0.00 36.82 34.33 2juz h ILE 66 CO -0.03 0.05 0.27 0.78 -0.69 0.00 0.00 178.15 178.53 2juz h ASN 67 N 0.28 0.75 -0.32 1.72 -0.26 -0.99 0.83 115.58 117.59 2juz h ASN 67 Ca 0.20 -0.13 -0.01 0.00 -0.56 0.00 0.00 56.30 55.80 2juz h ASN 67 Cb 0.20 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 2juz h ASN 67 CO -0.22 0.67 0.18 0.00 -1.06 0.00 0.00 177.43 177.00 2juz h ALA 68 N 1.10 0.40 -0.17 -0.83 0.00 -0.36 0.15 119.26 119.56 2juz h ALA 68 Ca 0.19 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2juz h ALA 68 Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2juz h ALA 68 CO -0.02 -0.07 0.10 0.28 0.00 0.00 0.00 179.25 179.53 2juz h VAL 69 N 0.39 1.09 -0.62 0.00 2.07 -0.57 -2.38 116.25 116.22 2juz h VAL 69 Ca 0.11 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 2juz h VAL 69 Cb 0.05 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2juz h VAL 69 CO -0.02 0.08 0.25 0.50 0.02 0.00 0.00 177.57 178.40 2juz h LYS 70 N 0.19 0.91 -0.31 1.57 3.64 -0.60 0.12 116.57 122.09 2juz h LYS 70 Ca 0.06 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 2juz h LYS 70 Cb 0.05 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2juz h LYS 70 CO -0.01 0.74 0.12 1.15 -2.27 0.00 0.00 179.45 179.19 2juz h THR 71 N 0.89 1.18 -0.28 1.00 2.02 -0.48 0.24 112.91 117.49 2juz h THR 71 Ca 0.21 -0.55 -0.16 0.00 0.77 0.00 0.00 66.41 66.69 2juz h THR 71 Cb 0.17 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2juz h THR 71 CO -0.02 0.19 -0.46 0.03 0.37 0.00 0.00 175.52 175.64 2juz h ARG 72 N 0.35 0.73 -0.55 6.66 3.08 -1.15 -2.64 114.38 120.86 2juz h ARG 72 Ca 0.10 -0.41 -0.04 0.00 0.07 0.00 0.00 59.98 59.70 2juz h ARG 72 Cb 0.18 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 2juz h ARG 72 CO -0.01 1.03 0.19 1.25 -1.07 0.00 0.00 179.97 181.37 2juz h LEU 73 N 0.59 0.75 -0.56 3.04 5.85 -0.79 -2.87 115.31 121.32 2juz h LEU 73 Ca 0.04 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2juz h LEU 73 Cb 1.01 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2juz h LEU 73 CO 0.10 0.70 0.32 -0.08 -0.34 0.00 0.00 178.44 179.13 2juz h GLU 74 N 0.80 0.77 0.00 1.25 4.22 -0.24 -2.61 114.58 118.77 2juz h GLU 74 Ca 0.19 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 59.54 2juz h GLU 74 Cb 0.20 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2juz h GLU 74 CO -0.01 0.58 0.00 0.72 -2.18 0.00 0.00 179.01 178.12 2juz n HIS 75 N -4.62 0.46 -3.15 0.92 8.25 -1.02 -4.02 115.22 112.04 2juz n HIS 75 Ca 0.03 0.21 -0.45 0.00 -0.26 0.00 0.00 57.72 57.25 2juz n HIS 75 Cb 0.07 -0.83 -0.03 0.00 1.12 0.00 0.00 29.99 30.32 2juz n HIS 75 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2juz s HIS 76 N -3.25 3.30 0.48 4.41 5.65 -0.98 -5.03 115.29 119.87 2juz s HIS 76 Ca 0.02 -1.44 0.08 0.00 0.25 0.00 0.00 55.06 53.97 2juz s HIS 76 Cb 0.07 -4.01 0.03 0.00 -1.18 0.00 0.00 32.58 27.49 2juz s HIS 76 CO 0.24 -1.23 0.53 -1.01 -0.65 0.00 0.00 174.74 172.62 2juz s HIS 77 N 1.76 2.17 -0.29 3.88 3.76 -1.26 -5.01 115.29 120.31 2juz s HIS 77 Ca 0.19 -0.61 0.03 0.00 -0.15 0.00 0.00 55.06 54.52 2juz s HIS 77 Cb -0.15 -2.17 0.18 0.00 1.11 0.00 0.00 32.58 31.55 2juz s HIS 77 CO -0.03 -0.52 0.52 -1.58 -0.85 0.00 0.00 174.74 172.28 2juz s HIS 78 N -2.56 -1.50 -1.39 1.40 2.46 -1.26 -5.08 115.29 107.36 2juz s HIS 78 Ca 0.50 0.95 -0.15 0.00 0.47 0.00 0.00 55.06 56.83 2juz s HIS 78 Cb -0.05 0.20 0.06 0.00 -0.13 0.00 0.00 32.58 32.66 2juz s HIS 78 CO 0.30 -1.00 2.03 1.58 -2.47 0.00 0.00 174.74 175.19 2juz n HIS 79 N 5.40 3.91 0.00 3.88 -0.00 -1.26 -5.32 115.22 121.83 2juz n HIS 79 Ca 0.02 -2.94 0.00 0.00 0.46 0.00 0.00 57.72 55.27 2juz n HIS 79 Cb 0.52 -2.54 0.00 0.00 -0.12 0.00 0.00 29.99 27.85 2juz n HIS 79 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38