#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 -1.79 0.42 -5.12 0.00 -1.26 -5.17 121.76 108.84 2juz s ALA 2 Ca 0.00 1.90 0.08 0.00 0.00 0.00 0.00 51.96 53.93 2juz s ALA 2 Cb 0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.11 2juz s ALA 2 CO 0.00 -0.34 0.35 -0.65 0.00 0.00 0.00 175.76 175.12 2juz s GLN 3 N 0.09 2.47 -0.41 0.00 -1.52 -1.26 -5.06 119.66 113.97 2juz s GLN 3 Ca -0.02 -1.60 0.05 0.00 -1.95 0.00 0.00 55.36 51.84 2juz s GLN 3 Cb -0.04 -2.30 0.43 0.00 -0.22 0.00 0.00 33.01 30.88 2juz s GLN 3 CO 0.02 -0.20 1.24 1.58 -0.25 0.00 0.00 175.29 177.68 2juz n HIS 4 N -1.51 3.10 0.00 0.91 -0.00 -1.26 -4.89 115.22 111.57 2juz n HIS 4 Ca 0.03 -2.69 0.00 0.00 0.46 0.00 0.00 57.72 55.52 2juz n HIS 4 Cb 0.62 -0.32 0.00 0.00 -0.12 0.00 0.00 29.99 30.17 2juz n HIS 4 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2juz n SER 5 N -0.60 0.00 0.01 0.26 3.41 -1.26 -4.76 113.62 110.68 2juz n SER 5 Ca 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2juz n SER 5 Cb 0.77 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 2juz n SER 5 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2juz n LYS 6 N -0.08 0.00 0.00 4.33 5.02 -1.26 -5.02 118.16 121.14 2juz n LYS 6 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2juz n LYS 6 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 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 -2.56 0.00 -3.65 2.13 4.02 -1.26 -4.88 117.16 110.96 2juz n TYR 7 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.84 2juz n TYR 7 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.26 2juz n TYR 7 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2juz s SER 8 N -3.09 -0.97 0.54 7.72 0.01 -1.26 -4.78 113.70 111.86 2juz s SER 8 Ca 0.00 1.49 0.21 0.00 1.31 0.00 0.00 55.95 58.96 2juz s SER 8 Cb 0.00 1.66 1.41 0.00 0.21 0.00 0.00 66.02 69.30 2juz s SER 8 CO 0.00 -0.23 2.14 -0.78 0.41 0.00 0.00 173.24 174.78 2juz h ASP 9 N 7.38 0.00 -0.29 2.44 3.58 -1.98 0.56 116.42 128.12 2juz h ASP 9 Ca -0.26 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.03 2juz h ASP 9 Cb 1.18 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.22 2juz h ASP 9 CO 0.15 0.00 -0.44 0.00 -2.88 0.00 0.00 179.24 176.07 2juz h ALA 10 N 1.94 0.59 -0.03 -0.78 0.00 -1.98 -0.73 119.26 118.26 2juz h ALA 10 Ca 0.05 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2juz h ALA 10 Cb 0.20 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2juz h ALA 10 CO -0.00 0.68 0.00 1.96 0.00 0.00 0.00 179.25 181.89 2juz h GLN 11 N 0.69 0.05 0.71 0.00 1.08 -1.53 -2.60 115.11 113.51 2juz h GLN 11 Ca 0.04 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.19 2juz h GLN 11 Cb 1.02 -0.01 0.01 0.00 -0.05 0.00 0.00 27.48 28.45 2juz h GLN 11 CO 0.10 0.30 -0.34 1.25 -0.95 0.00 0.00 178.83 179.19 2juz h LEU 12 N -0.20 -0.81 -1.06 1.46 5.85 -0.91 -2.36 115.31 117.27 2juz h LEU 12 Ca 0.01 0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.87 2juz h LEU 12 Cb 0.28 0.21 -0.08 0.00 0.37 0.00 0.00 40.66 41.44 2juz h LEU 12 CO 0.00 -0.57 0.62 0.77 -0.34 0.00 0.00 178.44 178.92 2juz h SER 13 N -0.98 0.89 -0.13 1.25 4.64 -1.21 -0.87 113.55 117.15 2juz h SER 13 Ca -0.10 0.04 0.01 0.00 -0.47 0.00 0.00 61.79 61.27 2juz h SER 13 Cb 0.74 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 2juz h SER 13 CO 0.16 0.48 0.06 0.00 -0.87 0.00 0.00 176.83 176.66 2juz h ALA 14 N 1.54 0.15 -0.30 5.18 0.00 -1.30 0.11 119.26 124.65 2juz h ALA 14 Ca 0.48 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.39 2juz h ALA 14 Cb 0.49 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2juz h ALA 14 CO -0.24 -0.39 0.15 0.82 0.00 0.00 0.00 179.25 179.59 2juz h ILE 15 N 0.13 1.15 -0.13 0.00 2.04 -0.66 -0.21 117.51 119.83 2juz h ILE 15 Ca 0.05 -0.43 -0.14 0.00 1.00 0.00 0.00 64.86 65.34 2juz h ILE 15 Cb 0.02 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2juz h ILE 15 CO -0.04 0.15 -0.53 0.58 0.00 0.00 0.00 178.15 178.31 2juz h VAL 16 N 0.35 1.34 0.00 1.67 2.07 -1.13 -2.41 116.25 118.14 2juz h VAL 16 Ca 0.10 -1.80 -0.09 0.00 0.82 0.00 0.00 66.70 65.73 2juz h VAL 16 Cb 0.11 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2juz h VAL 16 CO -0.01 0.54 -0.44 -1.13 0.02 0.00 0.00 177.57 176.55 2juz h ASN 17 N 0.28 0.00 -0.30 0.57 -1.24 -0.55 -2.47 115.58 111.86 2juz h ASN 17 Ca 0.01 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 2juz h ASN 17 Cb 1.02 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.06 2juz h ASN 17 CO 0.09 0.44 0.10 0.44 -1.29 0.00 0.00 177.43 177.21 2juz h ASP 18 N 0.00 0.44 -0.96 1.15 3.32 -0.56 -1.87 116.42 117.94 2juz h ASP 18 Ca -0.00 -0.20 0.08 0.00 0.02 0.00 0.00 57.03 56.93 2juz h ASP 18 Cb 0.81 -0.11 -0.07 0.00 0.22 0.00 0.00 39.33 40.17 2juz h ASP 18 CO 0.06 0.52 0.62 0.24 -1.72 0.00 0.00 179.24 178.95 2juz h MET 19 N 0.33 1.01 -0.58 3.56 2.86 -1.10 0.40 114.93 121.41 2juz h MET 19 Ca 0.10 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2juz h MET 19 Cb 0.23 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 2juz h MET 19 CO -0.00 0.67 0.33 0.82 1.06 0.00 0.00 176.91 179.78 2juz h ILE 20 N 1.04 1.19 -0.49 -1.22 2.04 -1.11 -0.63 117.51 118.33 2juz h ILE 20 Ca 0.43 -0.46 -0.11 0.00 1.00 0.00 0.00 64.86 65.72 2juz h ILE 20 Cb 0.30 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 2juz h ILE 20 CO -0.19 0.20 -0.12 0.00 0.00 0.00 0.00 178.15 178.05 2juz h ALA 21 N 1.15 0.86 -0.77 1.87 0.00 -0.24 -2.33 119.26 119.80 2juz h ALA 21 Ca 0.21 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2juz h ALA 21 Cb 0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.59 2juz h ALA 21 CO -0.03 0.65 0.49 0.28 0.00 0.00 0.00 179.25 180.63 2juz h VAL 22 N 0.82 1.10 -0.61 0.00 2.07 0.11 1.00 116.25 120.74 2juz h VAL 22 Ca 0.13 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.34 2juz h VAL 22 Cb 0.65 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 2juz h VAL 22 CO 0.05 0.17 0.40 0.25 0.02 0.00 0.00 177.57 178.46 2juz h LEU 23 N 0.94 0.68 -0.15 2.57 6.46 -0.86 -2.36 115.31 122.59 2juz h LEU 23 Ca 0.31 -0.01 -0.15 0.00 -0.12 0.00 0.00 57.88 57.91 2juz h LEU 23 Cb 0.04 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 39.81 2juz h LEU 23 CO -0.12 0.49 -0.48 -0.08 -0.62 0.00 0.00 178.44 177.63 2juz h GLU 24 N 0.81 0.59 -0.55 1.25 4.57 -0.83 -0.62 114.58 119.80 2juz h GLU 24 Ca 0.23 -0.43 -0.06 0.00 -1.18 0.00 0.00 59.36 57.91 2juz h GLU 24 Cb -0.07 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 2juz h GLU 24 CO -0.06 1.05 0.10 0.87 -1.18 0.00 0.00 179.01 179.80 2juz h LYS 25 N 0.24 0.91 0.00 1.92 1.57 -0.76 -2.27 116.57 118.18 2juz h LYS 25 Ca -0.02 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 2juz h LYS 25 Cb 1.10 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2juz h LYS 25 CO 0.10 0.87 -0.33 1.58 -0.57 0.00 0.00 179.45 181.10 2juz n HIS 26 N -4.36 0.17 -2.51 -1.35 -0.00 -0.90 -5.00 115.22 101.28 2juz n HIS 26 Ca 0.02 0.05 -0.02 0.00 0.46 0.00 0.00 57.72 58.23 2juz n HIS 26 Cb 0.26 -0.46 0.00 0.00 -0.12 0.00 0.00 29.99 29.68 2juz n HIS 26 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 2juz n LYS 27 N -1.67 -2.58 -4.45 1.57 3.00 -0.36 -5.07 118.16 108.60 2juz n LYS 27 Ca 0.06 2.20 -0.22 0.00 -0.00 0.00 0.00 58.31 60.35 2juz n LYS 27 Cb 0.36 -4.63 -0.16 0.00 0.00 0.00 0.00 35.03 30.60 2juz n LYS 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2juz s ALA 28 N -1.59 1.01 0.89 3.14 0.00 -0.49 -5.02 121.76 119.71 2juz s ALA 28 Ca 0.06 -0.33 -0.12 0.00 0.00 0.00 0.00 51.96 51.57 2juz s ALA 28 Cb -0.02 -0.44 0.13 0.00 0.00 0.00 0.00 23.12 22.79 2juz s ALA 28 CO 0.63 0.11 1.10 -2.14 0.00 0.00 0.00 175.76 175.46 2juz s PRO 29 N 0.48 1.30 0.42 0.00 0.02 -1.26 -4.75 135.00 131.21 2juz s PRO 29 Ca -0.09 0.70 0.29 0.00 0.02 0.00 0.00 61.00 61.92 2juz s PRO 29 Cb -0.13 -1.82 1.43 0.00 0.02 0.00 0.00 34.50 34.00 2juz s PRO 29 CO 0.02 -2.18 1.88 -0.39 -0.33 0.00 0.00 177.00 176.00 2juz h VAL 30 N -1.50 0.00 0.06 3.83 -1.51 -2.01 -0.33 116.25 114.79 2juz h VAL 30 Ca -0.50 -0.14 -0.29 0.00 -1.23 0.00 0.00 66.70 64.54 2juz h VAL 30 Cb 1.29 0.88 -0.03 0.00 -2.13 0.00 0.00 31.29 31.31 2juz h VAL 30 CO 0.57 0.00 -1.59 -0.90 -1.23 0.00 0.00 177.57 174.41 2juz n ASP 31 N -2.56 1.98 -0.18 4.19 5.75 -1.26 -3.10 116.55 121.37 2juz n ASP 31 Ca -0.01 0.33 -0.09 0.00 -0.01 0.00 0.00 54.79 55.01 2juz n ASP 31 Cb 0.14 -0.93 0.01 0.00 -1.03 0.00 0.00 41.12 39.31 2juz n ASP 31 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2juz h LEU 32 N -0.54 0.82 -1.36 -2.12 3.38 -1.87 -2.22 115.31 111.42 2juz h LEU 32 Ca -0.39 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.25 2juz h LEU 32 Cb 1.63 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 42.15 2juz h LEU 32 CO -0.08 0.89 -0.17 0.77 0.09 0.00 0.00 178.44 179.94 2juz h SER 33 N 0.72 0.21 -0.32 -0.43 4.64 -1.24 -1.65 113.55 115.48 2juz h SER 33 Ca 0.15 -0.05 -0.08 0.00 -0.47 0.00 0.00 61.79 61.34 2juz h SER 33 Cb 0.44 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 2juz h SER 33 CO 0.01 0.40 -0.06 0.25 -0.87 0.00 0.00 176.83 176.56 2juz h LEU 34 N 0.21 0.70 -0.65 5.97 5.85 -1.41 -1.54 115.31 124.44 2juz h LEU 34 Ca 0.04 -0.18 -0.13 0.00 0.84 0.00 0.00 57.88 58.45 2juz h LEU 34 Cb 0.43 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2juz h LEU 34 CO 0.03 0.81 -0.35 0.40 -0.34 0.00 0.00 178.44 178.98 2juz h ILE 35 N 0.66 1.29 -0.88 4.05 2.04 -0.75 -2.12 117.51 121.80 2juz h ILE 35 Ca 0.12 -1.50 0.01 0.00 1.00 0.00 0.00 64.86 64.49 2juz h ILE 35 Cb 0.50 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.98 2juz h ILE 35 CO 0.03 0.48 0.58 0.00 0.00 0.00 0.00 178.15 179.24 2juz h ALA 36 N 1.05 1.11 -0.76 1.87 0.00 -0.87 0.46 119.26 122.12 2juz h ALA 36 Ca 0.06 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2juz h ALA 36 Cb 0.86 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 2juz h ALA 36 CO 0.07 0.51 0.48 -0.07 0.00 0.00 0.00 179.25 180.25 2juz h LEU 37 N 1.18 0.80 -0.43 0.00 3.38 -0.95 0.38 115.31 119.68 2juz h LEU 37 Ca 0.32 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.23 2juz h LEU 37 Cb -0.13 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2juz h LEU 37 CO -0.07 0.55 0.02 1.23 0.09 0.00 0.00 178.44 180.26 2juz h GLY 38 N 0.95 0.80 1.00 0.83 0.00 -0.69 0.28 103.07 106.24 2juz h GLY 38 Ca 0.30 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 2juz h GLY 38 CO -0.11 0.53 0.34 3.43 0.00 0.00 0.00 176.54 180.73 2juz h ASN 39 N 0.58 0.68 -0.14 0.19 2.35 -0.60 -1.28 115.58 117.36 2juz h ASN 39 Ca 0.12 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2juz h ASN 39 Cb 0.45 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 2juz h ASN 39 CO 0.02 0.53 -0.01 -0.03 -1.65 0.00 0.00 177.43 176.29 2juz h MET 40 N 0.76 0.26 -0.11 0.81 4.05 -0.76 -2.42 114.93 117.52 2juz h MET 40 Ca 0.20 -0.09 0.04 0.00 -0.28 0.00 0.00 59.70 59.58 2juz h MET 40 Cb -0.02 -0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 30.70 2juz h MET 40 CO -0.04 0.50 -0.26 0.00 0.23 0.00 0.00 176.91 177.34 2juz h ALA 41 N 0.75 -0.28 -0.49 0.39 0.00 -0.24 0.39 119.26 119.79 2juz h ALA 41 Ca 0.04 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2juz h ALA 41 Cb 0.39 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2juz h ALA 41 CO 0.01 -0.73 0.26 0.66 0.00 0.00 0.00 179.25 179.44 2juz h SER 42 N -0.34 0.63 -0.27 0.00 4.64 -1.27 0.18 113.55 117.11 2juz h SER 42 Ca 0.09 -0.10 -0.10 0.00 -0.47 0.00 0.00 61.79 61.21 2juz h SER 42 Cb 0.48 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2juz h SER 42 CO -0.30 0.55 -0.16 -1.13 -0.87 0.00 0.00 176.83 174.92 2juz h ASN 43 N 0.66 0.71 -0.30 4.97 -1.24 -1.09 -2.02 115.58 117.26 2juz h ASN 43 Ca 0.17 -0.23 -0.12 0.00 0.71 0.00 0.00 56.30 56.84 2juz h ASN 43 Cb 0.07 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 38.93 2juz h ASN 43 CO -0.03 0.88 -0.28 0.25 -1.29 0.00 0.00 177.43 176.97 2juz h LEU 44 N 0.64 0.76 -1.73 0.34 5.85 0.21 -2.96 115.31 118.43 2juz h LEU 44 Ca 0.10 -0.46 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 2juz h LEU 44 Cb 0.63 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 2juz h LEU 44 CO 0.04 1.07 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.97 2juz h LEU 45 N 0.47 0.00 -2.43 2.25 3.38 -0.50 0.53 115.31 119.01 2juz h LEU 45 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2juz h LEU 45 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2juz h LEU 45 CO 0.07 0.17 0.00 0.35 0.09 0.00 0.00 178.44 179.12 2juz n THR 46 N -3.74 1.43 0.02 0.22 -2.24 -0.77 -4.13 114.28 105.07 2juz n THR 46 Ca -0.02 -0.86 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 2juz n THR 46 Cb 0.28 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 2juz n THR 46 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2juz n THR 47 N 0.67 0.06 0.10 4.28 -1.04 -0.49 -4.93 114.28 112.92 2juz n THR 47 Ca 0.18 0.02 0.09 0.00 -2.04 0.00 0.00 64.05 62.30 2juz n THR 47 Cb 0.72 -0.88 -0.00 0.00 -1.82 0.00 0.00 70.33 68.35 2juz n THR 47 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2juz h SER 48 N 0.00 0.00 -4.43 8.00 4.64 -1.16 -3.46 113.55 117.14 2juz h SER 48 Ca 0.00 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.63 2juz h SER 48 Cb 0.32 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.11 2juz h SER 48 CO 0.00 0.14 -0.88 0.54 -0.87 0.00 0.00 176.83 175.75 2juz s VAL 49 N -3.25 2.00 0.44 0.95 0.11 -1.26 -5.10 120.40 114.30 2juz s VAL 49 Ca -0.00 -1.07 -0.22 0.00 -2.93 0.00 0.00 61.98 57.75 2juz s VAL 49 Cb 0.09 -1.67 -0.11 0.00 -1.53 0.00 0.00 36.38 33.16 2juz s VAL 49 CO 0.78 0.56 0.72 -0.81 -3.33 0.00 0.00 175.10 173.03 2juz n PRO 50 N 2.60 0.83 0.14 1.54 -0.04 -1.26 -4.72 135.00 134.08 2juz n PRO 50 Ca -0.16 0.30 -0.13 0.00 -0.04 0.00 0.00 63.50 63.47 2juz n PRO 50 Cb 0.51 -1.73 -0.06 0.00 -0.04 0.00 0.00 33.50 32.18 2juz n PRO 50 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2juz h GLN 51 N 0.96 -0.45 0.00 0.54 7.50 -1.99 0.39 115.11 122.05 2juz h GLN 51 Ca -0.42 0.03 -0.02 0.00 0.50 0.00 0.00 58.65 58.73 2juz h GLN 51 Cb 1.38 0.10 -0.00 0.00 0.05 0.00 0.00 27.48 29.01 2juz h GLN 51 CO 0.53 -0.30 -0.10 0.00 -1.50 0.00 0.00 178.83 177.45 2juz h THR 52 N -0.47 0.49 0.00 -0.54 1.03 -2.01 -1.68 112.91 109.72 2juz h THR 52 Ca 0.01 -0.49 0.00 0.00 -0.01 0.00 0.00 66.41 65.92 2juz h THR 52 Cb 0.47 1.33 0.00 0.00 -1.07 0.00 0.00 68.15 68.88 2juz h THR 52 CO -0.09 0.10 -0.93 0.00 -0.01 0.00 0.00 175.52 174.59 2juz n GLN 53 N -3.56 0.17 -0.06 0.00 6.02 -0.83 -4.29 117.38 114.83 2juz n GLN 53 Ca -0.02 -0.01 -0.09 0.00 -0.01 0.00 0.00 57.00 56.88 2juz n GLN 53 Cb 0.23 -1.55 -0.02 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 0.25 0.75 0.06 0.00 5.08 -1.75 -0.63 114.58 118.34 2juz h GLU 55 Ca 0.09 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2juz h GLU 55 Cb 0.02 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2juz h GLU 55 CO -0.06 0.50 -0.03 0.00 -1.00 0.00 0.00 179.01 178.41 2juz h ALA 56 N 1.64 -0.08 -0.55 3.43 0.00 -1.57 -2.37 119.26 119.75 2juz h ALA 56 Ca 0.22 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2juz h ALA 56 Cb -0.07 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2juz h ALA 56 CO -0.05 -0.20 -0.03 -0.07 0.00 0.00 0.00 179.25 178.91 2juz h LEU 57 N -0.79 0.96 -0.83 0.00 4.07 -0.94 0.46 115.31 118.24 2juz h LEU 57 Ca -0.01 -0.27 -0.06 0.00 0.08 0.00 0.00 57.88 57.62 2juz h LEU 57 Cb 0.62 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 42.08 2juz h LEU 57 CO 0.01 1.03 0.17 0.00 -1.08 0.00 0.00 178.44 178.57 2juz h ALA 58 N 1.07 1.05 0.04 1.53 0.00 -1.21 0.64 119.26 122.37 2juz h ALA 58 Ca 0.16 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2juz h ALA 58 Cb 0.56 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2juz h ALA 58 CO 0.03 0.63 -0.02 0.37 0.00 0.00 0.00 179.25 180.26 2juz h GLN 59 N 0.99 -0.05 -0.26 0.00 5.75 -1.00 -2.35 115.11 118.21 2juz h GLN 59 Ca 0.21 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.73 2juz h GLN 59 Cb 0.34 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 2juz h GLN 59 CO -0.00 0.22 0.14 0.00 -2.65 0.00 0.00 178.83 176.54 2juz h ALA 60 N 0.64 0.31 -0.20 3.38 0.00 -0.73 -0.53 119.26 122.13 2juz h ALA 60 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 2juz h ALA 60 Cb 0.29 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2juz h ALA 60 CO 0.01 -0.25 -0.05 0.35 0.00 0.00 0.00 179.25 179.31 2juz h PHE 61 N 0.29 -0.10 -0.18 0.00 3.04 -0.88 0.71 116.94 119.81 2juz h PHE 61 Ca 0.10 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.07 2juz h PHE 61 Cb 0.01 0.07 -0.01 0.00 2.56 0.00 0.00 35.95 38.59 2juz h PHE 61 CO -0.09 -0.08 0.09 0.77 -2.02 0.00 0.00 178.31 176.99 2juz h SER 62 N 0.00 0.24 -0.21 0.41 0.02 -1.19 -2.30 113.55 110.52 2juz h SER 62 Ca 0.10 -0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 2juz h SER 62 Cb 0.14 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2juz h SER 62 CO -0.20 0.27 -0.02 0.78 -1.14 0.00 0.00 176.83 176.52 2juz h ASN 63 N 0.18 0.47 0.49 3.07 2.35 -0.75 -0.79 115.58 120.60 2juz h ASN 63 Ca 0.06 -0.09 -0.07 0.00 -0.55 0.00 0.00 56.30 55.65 2juz h ASN 63 Cb 0.09 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 2juz h ASN 63 CO -0.01 0.56 -0.35 0.77 -1.65 0.00 0.00 177.43 176.75 2juz h SER 64 N 0.48 0.00 0.12 5.81 4.64 -0.64 -1.18 113.55 122.78 2juz h SER 64 Ca 0.10 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.24 2juz h SER 64 Cb 0.34 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2juz h SER 64 CO 0.01 0.35 -0.66 -0.07 -0.87 0.00 0.00 176.83 175.59 2juz h LEU 65 N 0.00 0.58 -1.03 5.97 3.38 -0.63 -2.25 115.31 121.33 2juz h LEU 65 Ca -0.00 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 2juz h LEU 65 Cb 0.69 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 2juz h LEU 65 CO 0.05 1.09 0.50 0.40 0.09 0.00 0.00 178.44 180.57 2juz h ILE 66 N 0.36 1.24 -0.72 1.22 1.08 -0.57 -0.26 117.51 119.87 2juz h ILE 66 Ca -0.02 -0.55 0.02 0.00 -0.39 0.00 0.00 64.86 63.92 2juz h ILE 66 Cb 1.23 0.04 -0.04 0.00 -3.07 0.00 0.00 36.82 34.98 2juz h ILE 66 CO 0.12 0.26 0.47 -1.13 -0.69 0.00 0.00 178.15 177.18 2juz h ASN 67 N 1.19 0.79 -0.67 1.72 -0.73 -1.06 -0.88 115.58 115.94 2juz h ASN 67 Ca 0.31 -0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.44 2juz h ASN 67 Cb -0.03 -0.19 -0.03 0.00 0.27 0.00 0.00 38.32 38.34 2juz h ASN 67 CO -0.06 0.57 0.31 0.00 -0.37 0.00 0.00 177.43 177.88 2juz h ALA 68 N 1.28 0.87 -0.09 1.57 0.00 -0.69 0.15 119.26 122.35 2juz h ALA 68 Ca 0.27 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.06 2juz h ALA 68 Cb -0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 2juz h ALA 68 CO -0.08 0.44 -0.09 0.28 0.00 0.00 0.00 179.25 179.80 2juz h VAL 69 N 0.93 0.74 -0.30 0.00 2.07 -0.55 -0.17 116.25 118.97 2juz h VAL 69 Ca 0.23 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.78 2juz h VAL 69 Cb 0.14 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2juz h VAL 69 CO -0.03 0.00 0.11 0.11 0.02 0.00 0.00 177.57 177.78 2juz h LYS 70 N -0.12 0.24 -0.61 1.57 6.56 -0.79 -2.73 116.57 120.69 2juz h LYS 70 Ca 0.07 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.62 2juz h LYS 70 Cb 0.21 -0.05 -0.03 0.00 -0.57 0.00 0.00 32.23 31.79 2juz h LYS 70 CO -0.16 0.16 0.28 1.15 -2.06 0.00 0.00 179.45 178.82 2juz h THR 71 N 0.24 1.22 -0.41 -0.16 2.02 -0.33 0.39 112.91 115.88 2juz h THR 71 Ca 0.13 -0.64 -0.05 0.00 0.77 0.00 0.00 66.41 66.62 2juz h THR 71 Cb 0.10 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 2juz h THR 71 CO -0.13 0.26 0.08 0.03 0.37 0.00 0.00 175.52 176.12 2juz h ARG 72 N 0.85 0.68 0.06 6.66 3.08 -0.91 -1.89 114.38 122.90 2juz h ARG 72 Ca 0.21 -0.18 -0.19 0.00 0.07 0.00 0.00 59.98 59.90 2juz h ARG 72 Cb 0.14 -0.08 0.02 0.00 0.08 0.00 0.00 29.97 30.13 2juz h ARG 72 CO -0.02 0.71 -0.76 -0.07 -1.07 0.00 0.00 179.97 178.76 2juz h LEU 73 N 0.54 0.56 -4.37 3.04 -0.00 -1.35 -3.32 115.31 110.41 2juz h LEU 73 Ca 0.13 -0.83 -0.68 0.00 -0.00 0.00 0.00 57.88 56.50 2juz h LEU 73 Cb 0.36 -0.18 -0.26 0.00 -0.00 0.00 0.00 40.66 40.58 2juz h LEU 73 CO 0.01 1.34 0.89 -0.62 -0.00 0.00 0.00 178.44 180.05 2juz n GLU 74 N -4.13 2.63 -1.58 1.13 1.02 0.14 -4.96 120.64 114.89 2juz n GLU 74 Ca -0.12 -3.19 -0.41 0.00 -0.02 0.00 0.00 57.16 53.42 2juz n GLU 74 Cb 0.77 -2.23 -0.03 0.00 -0.02 0.00 0.00 31.44 29.93 2juz n GLU 74 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 2juz n HIS 75 N -0.58 1.80 -3.63 -0.32 1.44 -0.71 -4.79 115.22 108.43 2juz n HIS 75 Ca 0.56 -0.05 -0.37 0.00 -2.01 0.00 0.00 57.72 55.85 2juz n HIS 75 Cb 0.49 -2.70 -0.11 0.00 0.12 0.00 0.00 29.99 27.79 2juz n HIS 75 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2juz s HIS 76 N 9.50 3.22 0.38 -1.40 5.04 -1.26 -5.08 115.29 125.70 2juz s HIS 76 Ca 1.00 0.07 0.06 0.00 -1.54 0.00 0.00 55.06 54.66 2juz s HIS 76 Cb -0.29 -2.33 -0.07 0.00 0.04 0.00 0.00 32.58 29.92 2juz s HIS 76 CO 0.33 -0.14 0.02 -1.01 -2.34 0.00 0.00 174.74 171.60 2juz s HIS 77 N 1.58 2.35 0.00 3.88 3.76 -1.26 -5.05 115.29 120.54 2juz s HIS 77 Ca 0.07 -0.75 0.03 0.00 -0.15 0.00 0.00 55.06 54.26 2juz s HIS 77 Cb -0.15 -1.61 0.04 0.00 1.11 0.00 0.00 32.58 31.97 2juz s HIS 77 CO 0.09 0.32 0.90 1.58 -0.85 0.00 0.00 174.74 176.78 2juz n HIS 78 N -0.87 0.00 0.00 1.40 -0.00 -1.26 -5.04 115.22 109.45 2juz n HIS 78 Ca -0.04 -0.07 0.00 0.00 0.46 0.00 0.00 57.72 58.07 2juz n HIS 78 Cb 0.67 0.03 0.00 0.00 -0.12 0.00 0.00 29.99 30.57 2juz n HIS 78 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2juz n HIS 79 N 0.05 0.00 -1.08 1.57 8.25 -1.26 -5.40 115.22 117.35 2juz n HIS 79 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2juz n HIS 79 Cb 0.70 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.81 2juz n HIS 79 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59