#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 3.33 0.31 -5.12 0.00 -1.26 -4.71 120.51 113.06 2juz n ALA 2 Ca 0.00 -3.12 0.17 0.00 0.00 0.00 0.00 53.44 50.49 2juz n ALA 2 Cb 0.00 -0.37 0.75 0.00 0.00 0.00 0.00 19.45 19.82 2juz n ALA 2 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2juz h GLN 3 N 0.80 0.00 -0.58 0.00 4.15 -2.09 -1.28 115.11 116.10 2juz h GLN 3 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2juz h GLN 3 Cb 1.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.73 2juz h GLN 3 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 178.83 177.62 2juz n HIS 4 N -2.84 0.65 0.11 3.99 8.25 -1.26 -4.05 115.22 120.08 2juz n HIS 4 Ca 0.00 -0.26 0.06 0.00 -0.26 0.00 0.00 57.72 57.27 2juz n HIS 4 Cb 0.22 -0.14 0.24 0.00 1.12 0.00 0.00 29.99 31.43 2juz n HIS 4 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2juz n SER 5 N 0.33 3.35 -2.35 0.41 2.88 -0.49 -4.33 113.62 113.43 2juz n SER 5 Ca 0.11 -2.31 -0.22 0.00 -1.33 0.00 0.00 58.87 55.12 2juz n SER 5 Cb 0.46 -0.48 -0.10 0.00 -0.75 0.00 0.00 64.21 63.35 2juz n SER 5 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2juz n LYS 6 N 0.65 2.34 -2.66 -1.46 2.85 -1.26 -4.75 118.16 113.88 2juz n LYS 6 Ca 0.17 -1.84 -0.06 0.00 -1.05 0.00 0.00 58.31 55.53 2juz n LYS 6 Cb 0.64 -2.12 0.01 0.00 -0.65 0.00 0.00 35.03 32.91 2juz n LYS 6 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 177.40 178.33 2juz n TYR 7 N 1.62 -3.15 -4.66 5.58 9.36 -1.26 -5.03 117.16 119.61 2juz n TYR 7 Ca 0.48 1.30 -0.33 0.00 3.32 0.00 0.00 57.90 62.66 2juz n TYR 7 Cb 0.68 -3.77 -0.12 0.00 -0.63 0.00 0.00 39.34 35.50 2juz n TYR 7 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2juz s SER 8 N -2.23 4.45 0.52 2.98 0.15 -1.26 -4.98 113.70 113.33 2juz s SER 8 Ca 0.18 -0.13 0.29 0.00 0.70 0.00 0.00 55.95 56.99 2juz s SER 8 Cb -0.05 -1.30 1.43 0.00 -1.71 0.00 0.00 66.02 64.38 2juz s SER 8 CO 0.68 0.29 2.04 -2.24 1.20 0.00 0.00 173.24 175.21 2juz h ASP 9 N 5.79 0.00 0.73 5.45 2.03 -1.95 0.13 116.42 128.59 2juz h ASP 9 Ca -0.41 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 55.63 2juz h ASP 9 Cb 1.18 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.66 2juz h ASP 9 CO 0.54 0.12 -1.26 0.00 -1.03 0.00 0.00 179.24 177.61 2juz h ALA 10 N 1.88 0.32 -0.41 4.15 0.00 -1.96 -2.68 119.26 120.56 2juz h ALA 10 Ca -0.00 -1.02 -0.12 0.00 0.00 0.00 0.00 54.91 53.78 2juz h ALA 10 Cb 0.40 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2juz h ALA 10 CO 0.02 1.20 -0.20 0.37 0.00 0.00 0.00 179.25 180.63 2juz h GLN 11 N 0.03 0.86 0.16 0.00 4.15 -1.69 -0.76 115.11 117.87 2juz h GLN 11 Ca -0.13 -0.38 0.02 0.00 0.77 0.00 0.00 58.65 58.94 2juz h GLN 11 Cb 1.90 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 29.53 2juz h GLN 11 CO 0.15 1.02 -0.36 1.25 -1.93 0.00 0.00 178.83 178.96 2juz h LEU 12 N 0.67 -1.02 -0.82 -2.39 5.85 -0.80 -2.54 115.31 114.26 2juz h LEU 12 Ca 0.09 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 2juz h LEU 12 Cb 0.76 0.38 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 2juz h LEU 12 CO 0.06 -0.45 -0.09 0.77 -0.34 0.00 0.00 178.44 178.39 2juz h SER 13 N -0.61 0.00 -0.85 1.25 4.64 -1.46 -0.93 113.55 115.59 2juz h SER 13 Ca 0.02 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.38 2juz h SER 13 Cb 0.62 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.66 2juz h SER 13 CO -0.18 0.09 0.54 0.00 -0.87 0.00 0.00 176.83 176.41 2juz h ALA 14 N 1.91 1.12 0.23 5.18 0.00 -0.82 0.41 119.26 127.28 2juz h ALA 14 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2juz h ALA 14 Cb 0.79 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2juz h ALA 14 CO 0.01 0.36 -0.11 0.82 0.00 0.00 0.00 179.25 180.33 2juz h ILE 15 N 1.04 0.76 -0.07 0.00 2.04 -0.91 -2.24 117.51 118.13 2juz h ILE 15 Ca 0.34 -0.91 -0.12 0.00 1.00 0.00 0.00 64.86 65.17 2juz h ILE 15 Cb 0.03 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2juz h ILE 15 CO -0.12 0.17 -0.51 1.62 0.00 0.00 0.00 178.15 179.30 2juz h VAL 16 N -0.83 1.36 0.00 1.67 3.04 -1.11 0.16 116.25 120.54 2juz h VAL 16 Ca -0.03 -1.77 -0.16 0.00 -1.01 0.00 0.00 66.70 63.73 2juz h VAL 16 Cb 0.51 1.88 -0.02 0.00 -2.01 0.00 0.00 31.29 31.65 2juz h VAL 16 CO 0.05 0.52 -0.76 -1.13 -1.01 0.00 0.00 177.57 175.24 2juz h ASN 17 N 0.14 0.00 -0.21 3.17 -1.24 -0.29 -1.40 115.58 115.76 2juz h ASN 17 Ca 0.00 0.00 -0.20 0.00 0.71 0.00 0.00 56.30 56.82 2juz h ASN 17 Cb 0.95 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.01 2juz h ASN 17 CO 0.08 0.76 -0.62 -0.78 -1.29 0.00 0.00 177.43 175.57 2juz h ASP 18 N 0.00 0.93 -0.66 1.15 3.58 -1.01 -2.40 116.42 118.02 2juz h ASP 18 Ca -0.01 -0.54 0.10 0.00 0.42 0.00 0.00 57.03 57.00 2juz h ASP 18 Cb 1.36 -0.27 -0.07 0.00 1.72 0.00 0.00 39.33 42.07 2juz h ASP 18 CO 0.10 1.33 0.28 -0.03 -2.88 0.00 0.00 179.24 178.04 2juz h MET 19 N 0.61 0.47 -0.79 0.28 4.05 -0.44 0.48 114.93 119.59 2juz h MET 19 Ca -0.01 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.35 2juz h MET 19 Cb 1.23 -0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 31.89 2juz h MET 19 CO 0.13 0.31 0.36 0.82 0.23 0.00 0.00 176.91 178.77 2juz h ILE 20 N 0.49 1.25 -0.44 1.77 2.04 -1.19 -1.11 117.51 120.32 2juz h ILE 20 Ca 0.33 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.39 2juz h ILE 20 Cb 0.39 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 2juz h ILE 20 CO -0.30 0.31 -0.05 0.00 0.00 0.00 0.00 178.15 178.11 2juz h ALA 21 N 1.26 1.10 -0.61 1.87 0.00 -0.52 -2.44 119.26 119.93 2juz h ALA 21 Ca 0.27 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2juz h ALA 21 Cb 0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2juz h ALA 21 CO -0.03 0.56 0.16 0.28 0.00 0.00 0.00 179.25 180.22 2juz h VAL 22 N 0.68 1.24 0.01 0.00 2.07 0.58 0.41 116.25 121.24 2juz h VAL 22 Ca 0.13 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 2juz h VAL 22 Cb 0.49 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2juz h VAL 22 CO 0.03 0.33 -0.00 0.25 0.02 0.00 0.00 177.57 178.19 2juz h LEU 23 N 0.90 -0.01 -0.82 2.57 6.46 -0.89 0.97 115.31 124.50 2juz h LEU 23 Ca 0.20 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 2juz h LEU 23 Cb 0.31 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.24 2juz h LEU 23 CO -0.00 0.00 0.00 -0.08 -0.62 0.00 0.00 178.44 177.74 2juz h GLU 24 N -0.02 0.00 0.08 1.25 4.22 -1.11 -0.19 114.58 118.80 2juz h GLU 24 Ca -0.00 0.00 -0.27 0.00 0.08 0.00 0.00 59.36 59.17 2juz h GLU 24 Cb 0.02 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.28 2juz h GLU 24 CO 0.00 0.00 -1.14 -0.22 -2.18 0.00 0.00 179.01 175.48 2juz h LYS 25 N 0.00 0.48 0.00 1.92 1.63 0.55 -3.16 116.57 118.00 2juz h LYS 25 Ca 0.00 -0.62 0.00 0.00 -0.85 0.00 0.00 60.65 59.18 2juz h LYS 25 Cb 0.54 0.20 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 2juz h LYS 25 CO 0.00 1.25 -0.42 1.25 -3.45 0.00 0.00 179.45 178.08 2juz h HIS 26 N 0.22 0.00 -4.56 1.91 2.76 -0.49 -3.48 115.15 111.51 2juz h HIS 26 Ca -0.14 0.00 -0.34 0.00 -2.20 0.00 0.00 60.37 57.69 2juz h HIS 26 Cb 1.81 0.00 0.09 0.00 1.55 0.00 0.00 27.41 30.85 2juz h HIS 26 CO 0.08 0.00 -0.55 1.63 -1.30 0.00 0.00 177.93 177.79 2juz n LYS 27 N -2.66 -5.64 -3.80 5.26 4.76 -0.11 -5.00 118.16 110.96 2juz n LYS 27 Ca 0.03 0.74 -0.36 0.00 -2.87 0.00 0.00 58.31 55.85 2juz n LYS 27 Cb 0.50 -5.38 -0.06 0.00 -1.84 0.00 0.00 35.03 28.26 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 -3.19 3.86 0.80 7.82 0.00 -1.19 -5.05 121.76 124.81 2juz s ALA 28 Ca 0.39 -0.59 -0.12 0.00 0.00 0.00 0.00 51.96 51.65 2juz s ALA 28 Cb -0.17 -2.03 0.08 0.00 0.00 0.00 0.00 23.12 20.99 2juz s ALA 28 CO 0.49 0.63 1.14 -1.25 0.00 0.00 0.00 175.76 176.76 2juz s PRO 29 N -1.35 1.83 0.57 0.00 0.04 -1.26 -4.69 135.00 130.14 2juz s PRO 29 Ca 0.21 1.46 0.28 0.00 0.04 0.00 0.00 61.00 62.98 2juz s PRO 29 Cb -0.13 -1.83 1.54 0.00 0.04 0.00 0.00 34.50 34.13 2juz s PRO 29 CO 0.10 -2.01 2.03 -0.24 0.04 0.00 0.00 177.00 176.92 2juz h VAL 30 N -1.11 0.52 0.33 -0.36 3.04 -1.97 -0.80 116.25 115.89 2juz h VAL 30 Ca -0.45 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.23 2juz h VAL 30 Cb 1.26 0.77 0.00 0.00 -2.01 0.00 0.00 31.29 31.31 2juz h VAL 30 CO 0.48 0.00 -0.16 0.44 -1.01 0.00 0.00 177.57 177.32 2juz h ASP 31 N 0.00 -0.37 -0.49 3.17 5.19 -1.99 -2.20 116.42 119.73 2juz h ASP 31 Ca 0.15 0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 56.47 2juz h ASP 31 Cb 0.75 0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.34 2juz h ASP 31 CO -0.00 -0.23 -0.07 0.25 -3.12 0.00 0.00 179.24 176.07 2juz h LEU 32 N -0.51 0.93 -1.21 1.55 5.85 -1.83 -2.50 115.31 117.60 2juz h LEU 32 Ca -0.04 -0.28 -0.07 0.00 0.84 0.00 0.00 57.88 58.32 2juz h LEU 32 Cb 0.33 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2juz h LEU 32 CO 0.07 1.03 -0.35 0.28 -0.34 0.00 0.00 178.44 179.13 2juz h SER 33 N 0.86 0.00 0.22 1.25 0.02 -1.26 -2.24 113.55 112.39 2juz h SER 33 Ca 0.14 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.89 2juz h SER 33 Cb 0.60 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 2juz h SER 33 CO 0.04 0.35 -0.80 0.25 -1.14 0.00 0.00 176.83 175.53 2juz h LEU 34 N 0.00 0.56 -1.15 5.07 6.46 -1.00 -2.60 115.31 122.64 2juz h LEU 34 Ca -0.00 -0.39 -0.01 0.00 -0.12 0.00 0.00 57.88 57.35 2juz h LEU 34 Cb 0.73 -0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 40.46 2juz h LEU 34 CO 0.05 1.16 0.42 0.40 -0.62 0.00 0.00 178.44 179.84 2juz h ILE 35 N 0.30 1.21 -0.56 4.05 2.04 -1.01 0.72 117.51 124.27 2juz h ILE 35 Ca -0.05 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.31 2juz h ILE 35 Cb 1.40 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 2juz h ILE 35 CO 0.14 0.23 0.36 0.00 0.00 0.00 0.00 178.15 178.88 2juz h ALA 36 N 1.45 0.70 -0.69 1.87 0.00 -1.28 0.10 119.26 121.41 2juz h ALA 36 Ca 0.26 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2juz h ALA 36 Cb -0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2juz h ALA 36 CO -0.05 0.16 0.46 1.25 0.00 0.00 0.00 179.25 181.07 2juz h LEU 37 N 0.75 0.79 -0.61 0.00 5.85 -0.93 -0.97 115.31 120.20 2juz h LEU 37 Ca 0.20 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2juz h LEU 37 Cb -0.07 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 2juz h LEU 37 CO -0.04 0.57 0.30 1.23 -0.34 0.00 0.00 178.44 180.16 2juz h GLY 38 N 0.94 0.94 0.89 3.75 0.00 -0.32 0.30 103.07 109.56 2juz h GLY 38 Ca 0.25 -0.46 0.03 0.00 0.00 0.00 0.00 47.33 47.15 2juz h GLY 38 CO -0.06 0.44 0.38 -0.57 0.00 0.00 0.00 176.54 176.74 2juz h ASN 39 N 0.83 0.63 -0.13 0.19 -0.73 -0.43 -1.93 115.58 114.01 2juz h ASN 39 Ca 0.21 -0.00 -0.23 0.00 1.87 0.00 0.00 56.30 58.15 2juz h ASN 39 Cb 0.11 -0.14 0.01 0.00 0.27 0.00 0.00 38.32 38.58 2juz h ASN 39 CO -0.03 0.44 -0.82 -0.03 -0.37 0.00 0.00 177.43 176.62 2juz h MET 40 N 0.76 0.79 -0.13 6.67 4.05 -0.84 -2.64 114.93 123.59 2juz h MET 40 Ca 0.25 -0.67 0.02 0.00 -0.28 0.00 0.00 59.70 59.01 2juz h MET 40 Cb 0.01 0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 30.94 2juz h MET 40 CO -0.10 1.27 0.03 0.00 0.23 0.00 0.00 176.91 178.34 2juz h ALA 41 N 0.53 0.13 -0.47 0.39 0.00 -0.26 -1.03 119.26 118.55 2juz h ALA 41 Ca -0.07 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2juz h ALA 41 Cb 1.46 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 2juz h ALA 41 CO 0.17 -0.42 0.11 0.66 0.00 0.00 0.00 179.25 179.76 2juz h SER 42 N 0.08 0.72 -0.47 0.00 4.64 -1.41 -0.13 113.55 116.99 2juz h SER 42 Ca 0.06 -0.24 0.04 0.00 -0.47 0.00 0.00 61.79 61.18 2juz h SER 42 Cb 0.05 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 61.91 2juz h SER 42 CO -0.08 0.77 0.22 -1.13 -0.87 0.00 0.00 176.83 175.75 2juz h ASN 43 N 0.64 0.31 -0.21 4.97 -0.73 -1.24 -1.49 115.58 117.82 2juz h ASN 43 Ca 0.15 0.03 -0.14 0.00 1.87 0.00 0.00 56.30 58.21 2juz h ASN 43 Cb 0.34 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.91 2juz h ASN 43 CO 0.00 0.22 -0.40 -0.07 -0.37 0.00 0.00 177.43 176.81 2juz h LEU 44 N 0.44 0.73 -0.21 0.34 3.38 -1.00 -2.78 115.31 116.21 2juz h LEU 44 Ca 0.21 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2juz h LEU 44 Cb 0.13 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2juz h LEU 44 CO -0.16 1.13 0.00 0.18 0.09 0.00 0.00 178.44 179.68 2juz n LEU 45 N -4.22 0.30 -0.01 1.67 4.77 -0.08 -0.91 117.00 118.52 2juz n LEU 45 Ca -0.06 0.56 0.06 0.00 -0.03 0.00 0.00 56.01 56.55 2juz n LEU 45 Cb 0.54 -0.50 -0.15 0.00 -2.33 0.00 0.00 43.42 40.98 2juz n LEU 45 CO 0.46 -0.29 -0.73 0.35 -1.33 0.00 0.00 177.39 175.85 2juz n THR 46 N -1.81 0.41 -0.13 -5.08 -2.24 -0.58 -4.21 114.28 100.64 2juz n THR 46 Ca 0.04 -0.59 -0.27 0.00 -2.27 0.00 0.00 64.05 60.96 2juz n THR 46 Cb 0.25 -0.17 -0.10 0.00 -2.10 0.00 0.00 70.33 68.20 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 -2.44 1.53 -1.08 4.28 -2.24 -0.93 -4.55 114.28 108.85 2juz n THR 47 Ca -0.10 -0.31 -0.03 0.00 -2.27 0.00 0.00 64.05 61.35 2juz n THR 47 Cb 0.70 -1.91 0.29 0.00 -2.10 0.00 0.00 70.33 67.32 2juz n THR 47 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2juz n SER 48 N -4.26 4.48 -4.64 3.42 2.88 -0.09 -4.95 113.62 110.47 2juz n SER 48 Ca -0.49 -3.24 -0.43 0.00 -1.33 0.00 0.00 58.87 53.39 2juz n SER 48 Cb 0.84 -0.70 -0.02 0.00 -0.75 0.00 0.00 64.21 63.58 2juz n SER 48 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2juz s VAL 49 N -2.99 4.26 0.28 2.46 0.11 -1.26 -4.89 120.40 118.38 2juz s VAL 49 Ca 0.52 1.45 0.27 0.00 -2.93 0.00 0.00 61.98 61.29 2juz s VAL 49 Cb 0.42 -4.21 0.28 0.00 -1.53 0.00 0.00 36.38 31.35 2juz s VAL 49 CO 0.11 -0.43 1.97 -0.65 -3.33 0.00 0.00 175.10 172.78 2juz h PRO 50 N 8.81 0.00 0.00 1.54 0.11 -1.93 -3.47 132.00 137.06 2juz h PRO 50 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2juz h PRO 50 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2juz h PRO 50 CO 1.02 0.15 0.00 0.94 -0.21 0.00 0.00 178.00 179.90 2juz n GLN 51 N -3.46 0.00 -0.32 1.05 7.27 -1.26 -4.63 117.38 116.03 2juz n GLN 51 Ca -0.01 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 57.04 2juz n GLN 51 Cb 0.32 0.00 0.03 0.00 2.41 0.00 0.00 30.24 33.00 2juz n GLN 51 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 2juz h THR 52 N 0.00 0.06 0.00 1.69 1.35 -2.02 -1.94 112.91 112.05 2juz h THR 52 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2juz h THR 52 Cb 0.00 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 66.48 2juz h THR 52 CO 0.00 0.00 -0.57 0.00 -0.25 0.00 0.00 175.52 174.70 2juz n GLN 53 N -5.46 3.60 -0.00 4.72 10.64 -1.26 -4.71 117.38 124.91 2juz n GLN 53 Ca 0.08 -0.02 -0.09 0.00 -1.83 0.00 0.00 57.00 55.15 2juz n GLN 53 Cb 0.38 -0.86 0.07 0.00 -0.86 0.00 0.00 30.24 28.97 2juz n GLN 53 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2juz h GLU 55 N 0.45 0.97 0.22 0.00 4.81 -1.65 0.17 114.58 119.56 2juz h GLU 55 Ca 0.02 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 2juz h GLU 55 Cb 1.03 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2juz h GLU 55 CO 0.10 0.90 -0.11 0.00 -0.73 0.00 0.00 179.01 179.17 2juz h ALA 56 N 1.03 -0.30 -0.22 2.92 0.00 -1.76 -2.23 119.26 118.69 2juz h ALA 56 Ca 0.19 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2juz h ALA 56 Cb 0.37 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2juz h ALA 56 CO 0.00 -0.58 -0.01 -0.07 0.00 0.00 0.00 179.25 178.60 2juz h LEU 57 N -0.48 0.30 -0.00 0.00 -0.00 -1.19 0.23 115.31 114.16 2juz h LEU 57 Ca -0.03 -0.04 -0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2juz h LEU 57 Cb 0.36 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 40.95 2juz h LEU 57 CO 0.05 0.36 0.00 0.00 -0.00 0.00 0.00 178.44 178.86 2juz h ALA 58 N 1.68 0.00 -0.24 1.53 0.00 -0.56 0.27 119.26 121.94 2juz h ALA 58 Ca 0.07 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2juz h ALA 58 Cb 0.23 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2juz h ALA 58 CO 0.01 -0.42 -0.19 1.96 0.00 0.00 0.00 179.25 180.61 2juz h GLN 59 N -0.16 0.42 0.01 0.00 1.08 -0.90 0.42 115.11 115.99 2juz h GLN 59 Ca 0.00 -0.13 -0.00 0.00 -1.45 0.00 0.00 58.65 57.07 2juz h GLN 59 Cb 0.16 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2juz h GLN 59 CO -0.00 0.59 -0.01 0.00 -0.95 0.00 0.00 178.83 178.47 2juz h ALA 60 N 1.43 -0.02 -0.65 3.87 0.00 -0.31 -1.31 119.26 122.26 2juz h ALA 60 Ca 0.07 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2juz h ALA 60 Cb 0.55 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2juz h ALA 60 CO 0.04 -0.36 0.19 0.35 0.00 0.00 0.00 179.25 179.47 2juz h PHE 61 N -0.33 1.04 0.36 0.00 3.57 -0.34 0.62 116.94 121.86 2juz h PHE 61 Ca -0.00 -0.10 -0.00 0.00 3.53 0.00 0.00 57.97 61.40 2juz h PHE 61 Cb 0.32 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 2juz h PHE 61 CO 0.03 0.84 -0.42 1.03 -2.23 0.00 0.00 178.31 177.56 2juz h SER 62 N 0.97 -1.17 0.22 0.41 0.87 -0.84 -0.70 113.55 113.31 2juz h SER 62 Ca 0.21 0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.85 2juz h SER 62 Cb 0.30 0.40 -0.00 0.00 -0.44 0.00 0.00 62.40 62.66 2juz h SER 62 CO -0.01 -0.56 -0.12 0.78 -0.53 0.00 0.00 176.83 176.40 2juz h ASN 63 N -0.82 0.00 -0.61 6.23 2.35 -1.01 0.61 115.58 122.33 2juz h ASN 63 Ca -0.03 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.69 2juz h ASN 63 Cb 0.75 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.09 2juz h ASN 63 CO -0.10 0.12 0.26 0.28 -1.65 0.00 0.00 177.43 176.33 2juz h SER 64 N 0.00 0.83 -0.44 5.81 0.02 -0.20 0.88 113.55 120.45 2juz h SER 64 Ca -0.00 -0.16 -0.11 0.00 -0.84 0.00 0.00 61.79 60.68 2juz h SER 64 Cb 0.26 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 2juz h SER 64 CO 0.02 0.77 -0.14 -0.07 -1.14 0.00 0.00 176.83 176.26 2juz h LEU 65 N 0.85 0.89 -0.22 5.07 3.38 0.36 -1.32 115.31 124.32 2juz h LEU 65 Ca 0.21 -0.38 0.03 0.00 0.09 0.00 0.00 57.88 57.83 2juz h LEU 65 Cb 0.18 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2juz h LEU 65 CO -0.02 1.07 0.02 0.40 0.09 0.00 0.00 178.44 179.99 2juz h ILE 66 N 0.71 0.87 -0.02 1.22 1.08 -0.60 0.66 117.51 121.42 2juz h ILE 66 Ca 0.11 -0.03 -0.08 0.00 -0.39 0.00 0.00 64.86 64.46 2juz h ILE 66 Cb 0.70 0.77 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 2juz h ILE 66 CO 0.05 0.02 -0.38 0.78 -0.69 0.00 0.00 178.15 177.92 2juz h ASN 67 N 0.09 0.05 -0.22 1.72 2.35 -0.78 0.23 115.58 119.02 2juz h ASN 67 Ca 0.10 -0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 2juz h ASN 67 Cb 0.12 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 2juz h ASN 67 CO -0.16 0.43 0.02 0.00 -1.65 0.00 0.00 177.43 176.08 2juz h ALA 68 N 1.57 0.29 -0.47 -0.83 0.00 -0.47 0.56 119.26 119.92 2juz h ALA 68 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2juz h ALA 68 Cb 0.70 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2juz h ALA 68 CO 0.05 -0.01 0.10 0.28 0.00 0.00 0.00 179.25 179.67 2juz h VAL 69 N 0.16 1.24 -0.04 0.00 2.07 -0.58 -0.99 116.25 118.11 2juz h VAL 69 Ca 0.07 -0.86 0.04 0.00 0.82 0.00 0.00 66.70 66.77 2juz h VAL 69 Cb 0.35 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 2juz h VAL 69 CO 0.01 0.30 -0.33 0.50 0.02 0.00 0.00 177.57 178.07 2juz h LYS 70 N 0.63 -0.44 -0.23 1.57 3.64 -0.41 -1.02 116.57 120.30 2juz h LYS 70 Ca 0.15 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 2juz h LYS 70 Cb 0.35 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 2juz h LYS 70 CO 0.00 -0.29 0.05 1.15 -2.27 0.00 0.00 179.45 178.10 2juz h THR 71 N -0.46 1.12 -0.28 1.00 2.02 -0.78 -1.43 112.91 114.10 2juz h THR 71 Ca 0.07 -0.41 -0.11 0.00 0.77 0.00 0.00 66.41 66.73 2juz h THR 71 Cb 0.56 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 2juz h THR 71 CO -0.30 0.15 -0.29 -0.09 0.37 0.00 0.00 175.52 175.36 2juz h ARG 72 N 0.33 0.58 0.00 6.66 9.65 -0.24 0.28 114.38 131.63 2juz h ARG 72 Ca 0.08 -0.24 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 2juz h ARG 72 Cb 0.14 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 2juz h ARG 72 CO -0.00 0.80 -0.32 -0.07 2.80 0.00 0.00 179.97 183.18 2juz h LEU 73 N 0.50 0.00 0.00 3.80 -0.00 -0.54 -3.34 115.31 115.73 2juz h LEU 73 Ca 0.06 -0.01 -0.08 0.00 -0.00 0.00 0.00 57.88 57.86 2juz h LEU 73 Cb 0.75 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.40 2juz h LEU 73 CO 0.06 0.00 -0.47 -0.33 -0.00 0.00 0.00 178.44 177.71 2juz h GLU 74 N 0.00 0.00 -4.92 1.13 5.08 -0.97 -3.45 114.58 111.45 2juz h GLU 74 Ca 0.00 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.70 2juz h GLU 74 Cb 0.97 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.05 2juz h GLU 74 CO 0.00 0.77 -0.31 -1.01 -1.00 0.00 0.00 179.01 177.47 2juz s HIS 75 N -2.18 3.21 0.06 4.33 3.76 0.94 -4.87 115.29 120.54 2juz s HIS 75 Ca -0.19 -0.05 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 2juz s HIS 75 Cb 0.01 -2.65 0.00 0.00 1.11 0.00 0.00 32.58 31.04 2juz s HIS 75 CO 0.52 -0.43 0.00 0.72 -0.85 0.00 0.00 174.74 174.70 2juz n HIS 76 N 5.36 -0.15 -3.81 1.40 8.25 -1.26 -4.63 115.22 120.38 2juz n HIS 76 Ca -0.09 0.03 -0.29 0.00 -0.26 0.00 0.00 57.72 57.10 2juz n HIS 76 Cb 0.49 0.06 -0.16 0.00 1.12 0.00 0.00 29.99 31.50 2juz n HIS 76 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2juz s HIS 77 N -2.00 1.66 -0.08 4.41 5.65 -1.26 -5.11 115.29 118.56 2juz s HIS 77 Ca 0.00 -1.37 0.01 0.00 0.25 0.00 0.00 55.06 53.95 2juz s HIS 77 Cb 0.00 -1.38 -0.03 0.00 -1.18 0.00 0.00 32.58 29.99 2juz s HIS 77 CO 0.00 -0.72 -0.09 -1.58 -0.65 0.00 0.00 174.74 171.70 2juz s HIS 78 N 1.64 2.88 0.00 3.88 2.46 -1.26 -5.08 115.29 119.81 2juz s HIS 78 Ca -0.00 -0.10 0.00 0.00 0.47 0.00 0.00 55.06 55.42 2juz s HIS 78 Cb -0.18 -1.73 0.00 0.00 -0.13 0.00 0.00 32.58 30.55 2juz s HIS 78 CO -0.11 0.22 0.21 1.58 -2.47 0.00 0.00 174.74 174.17 2juz n HIS 79 N 2.47 0.00 -1.06 3.88 -0.00 -1.26 -5.29 115.22 113.96 2juz n HIS 79 Ca -0.18 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.00 2juz n HIS 79 Cb 0.53 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.40 2juz n HIS 79 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52