#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 1.99 -0.44 3.04 0.00 -1.26 -4.99 121.76 120.11 2juz s ALA 2 Ca 0.00 -2.77 -0.03 0.00 0.00 0.00 0.00 51.96 49.16 2juz s ALA 2 Cb 0.00 -1.74 0.12 0.00 0.00 0.00 0.00 23.12 21.49 2juz s ALA 2 CO 0.00 -2.01 2.56 0.00 0.00 0.00 0.00 175.76 176.31 2juz n GLN 3 N 2.70 2.28 0.03 0.00 -0.00 -1.26 -4.54 117.38 116.59 2juz n GLN 3 Ca 0.26 -2.23 -0.11 0.00 -0.00 0.00 0.00 57.00 54.92 2juz n GLN 3 Cb 0.44 -2.03 -0.06 0.00 -0.00 0.00 0.00 30.24 28.59 2juz n GLN 3 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 2juz h HIS 4 N 2.61 -0.03 -3.24 2.61 2.76 -2.07 -3.29 115.15 114.50 2juz h HIS 4 Ca 0.38 0.00 -0.68 0.00 -2.20 0.00 0.00 60.37 57.88 2juz h HIS 4 Cb 0.75 0.02 -0.37 0.00 1.55 0.00 0.00 27.41 29.36 2juz h HIS 4 CO 1.31 -0.02 -0.23 -1.54 -1.30 0.00 0.00 177.93 176.14 2juz s SER 5 N -5.18 5.66 0.00 3.26 1.04 -1.26 -4.84 113.70 112.37 2juz s SER 5 Ca -0.13 -3.78 0.26 0.00 0.48 0.00 0.00 55.95 52.78 2juz s SER 5 Cb 0.07 -1.83 0.86 0.00 0.10 0.00 0.00 66.02 65.22 2juz s SER 5 CO 0.66 -0.15 1.63 2.29 0.98 0.00 0.00 173.24 178.66 2juz n LYS 6 N 2.20 1.79 -2.57 4.02 2.85 -1.24 -4.99 118.16 120.22 2juz n LYS 6 Ca 0.21 -1.15 -0.02 0.00 -1.05 0.00 0.00 58.31 56.30 2juz n LYS 6 Cb 0.36 -1.46 0.00 0.00 -0.65 0.00 0.00 35.03 33.29 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 0.39 -3.29 -4.65 5.58 9.36 -1.26 -5.05 117.16 118.24 2juz n TYR 7 Ca 0.18 1.42 -0.25 0.00 3.32 0.00 0.00 57.90 62.57 2juz n TYR 7 Cb 0.38 -3.67 -0.14 0.00 -0.63 0.00 0.00 39.34 35.29 2juz n TYR 7 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 2juz s SER 8 N -1.68 2.41 0.41 2.98 0.01 -1.26 -4.99 113.70 111.58 2juz s SER 8 Ca 0.06 -0.51 0.10 0.00 1.31 0.00 0.00 55.95 56.92 2juz s SER 8 Cb -0.02 -0.20 0.92 0.00 0.21 0.00 0.00 66.02 66.92 2juz s SER 8 CO 0.66 0.16 1.98 0.44 0.41 0.00 0.00 173.24 176.89 2juz h ASP 9 N 4.93 0.48 -0.73 2.44 5.19 -1.98 0.74 116.42 127.48 2juz h ASP 9 Ca -0.42 0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 55.93 2juz h ASP 9 Cb 1.16 -0.10 -0.03 0.00 0.18 0.00 0.00 39.33 40.54 2juz h ASP 9 CO 0.44 0.30 0.19 0.00 -3.12 0.00 0.00 179.24 177.06 2juz h ALA 10 N 1.67 0.96 -0.16 3.45 0.00 -1.98 0.14 119.26 123.35 2juz h ALA 10 Ca 0.28 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2juz h ALA 10 Cb 0.38 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2juz h ALA 10 CO -0.08 0.67 -0.09 1.96 0.00 0.00 0.00 179.25 181.72 2juz h GLN 11 N 1.10 0.33 0.89 0.00 4.20 -1.49 -2.09 115.11 118.06 2juz h GLN 11 Ca 0.23 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2juz h GLN 11 Cb 0.35 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.14 2juz h GLN 11 CO -0.00 0.66 -0.43 1.25 -0.67 0.00 0.00 178.83 179.64 2juz h LEU 12 N -0.00 -1.02 -1.07 1.46 5.85 -0.82 -2.62 115.31 117.09 2juz h LEU 12 Ca 0.03 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.87 2juz h LEU 12 Cb 0.57 0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.79 2juz h LEU 12 CO 0.02 -0.70 0.62 0.28 -0.34 0.00 0.00 178.44 178.33 2juz h SER 13 N -1.25 0.94 -0.64 1.25 0.02 -0.79 -0.35 113.55 112.72 2juz h SER 13 Ca -0.12 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 2juz h SER 13 Cb 0.92 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.26 2juz h SER 13 CO 0.20 0.56 0.41 0.00 -1.14 0.00 0.00 176.83 176.86 2juz h ALA 14 N 1.51 0.82 -0.03 3.77 0.00 -1.34 0.42 119.26 124.41 2juz h ALA 14 Ca 0.44 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 2juz h ALA 14 Cb 0.31 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2juz h ALA 14 CO -0.19 0.27 -0.02 0.82 0.00 0.00 0.00 179.25 180.13 2juz h ILE 15 N 0.87 1.36 -0.33 0.00 2.04 -0.75 -1.66 117.51 119.03 2juz h ILE 15 Ca 0.23 -1.11 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 2juz h ILE 15 Cb -0.06 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 2juz h ILE 15 CO -0.05 0.30 0.11 0.58 0.00 0.00 0.00 178.15 179.08 2juz h VAL 16 N -0.37 1.21 -0.30 1.67 2.07 -1.02 0.55 116.25 120.07 2juz h VAL 16 Ca 0.01 -0.66 -0.08 0.00 0.82 0.00 0.00 66.70 66.78 2juz h VAL 16 Cb 0.49 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2juz h VAL 16 CO 0.01 0.23 -0.17 -1.13 0.02 0.00 0.00 177.57 176.52 2juz h ASN 17 N 0.38 0.52 -0.08 0.57 -1.24 -0.98 -1.03 115.58 113.72 2juz h ASN 17 Ca 0.11 -0.15 -0.18 0.00 0.71 0.00 0.00 56.30 56.78 2juz h ASN 17 Cb 0.25 -0.14 -0.00 0.00 0.73 0.00 0.00 38.32 39.15 2juz h ASN 17 CO -0.00 0.71 -0.59 -0.78 -1.29 0.00 0.00 177.43 175.48 2juz h ASP 18 N 0.48 0.77 -0.36 1.15 3.58 -1.00 -1.01 116.42 120.03 2juz h ASP 18 Ca 0.08 -0.43 -0.01 0.00 0.42 0.00 0.00 57.03 57.08 2juz h ASP 18 Cb 0.58 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.39 2juz h ASP 18 CO 0.04 1.19 0.18 -0.03 -2.88 0.00 0.00 179.24 177.74 2juz h MET 19 N 0.52 0.52 -0.76 0.28 4.05 -0.48 0.32 114.93 119.39 2juz h MET 19 Ca -0.00 -0.08 -0.03 0.00 -0.28 0.00 0.00 59.70 59.31 2juz h MET 19 Cb 1.17 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.84 2juz h MET 19 CO 0.12 0.47 0.33 0.82 0.23 0.00 0.00 176.91 178.88 2juz h ILE 20 N 0.45 1.24 0.20 1.77 2.04 -1.14 0.13 117.51 122.21 2juz h ILE 20 Ca 0.13 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 2juz h ILE 20 Cb 0.12 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2juz h ILE 20 CO -0.02 0.30 -0.10 0.00 0.00 0.00 0.00 178.15 178.34 2juz h ALA 21 N 1.28 -0.27 0.00 1.87 0.00 -0.69 -2.34 119.26 119.10 2juz h ALA 21 Ca 0.26 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2juz h ALA 21 Cb 0.15 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2juz h ALA 21 CO -0.03 -0.53 -0.17 -0.39 0.00 0.00 0.00 179.25 178.13 2juz h VAL 22 N -0.51 0.59 -0.56 0.00 -1.51 -0.25 -1.61 116.25 112.38 2juz h VAL 22 Ca -0.03 -0.79 -0.08 0.00 -1.23 0.00 0.00 66.70 64.57 2juz h VAL 22 Cb 0.39 1.52 -0.02 0.00 -2.13 0.00 0.00 31.29 31.04 2juz h VAL 22 CO 0.05 0.17 0.05 0.25 -1.23 0.00 0.00 177.57 176.85 2juz h LEU 23 N 0.00 0.90 -0.42 4.19 5.85 -0.57 0.16 115.31 125.41 2juz h LEU 23 Ca -0.00 -0.22 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 2juz h LEU 23 Cb 0.51 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2juz h LEU 23 CO 0.02 0.93 0.00 -0.08 -0.34 0.00 0.00 178.44 178.97 2juz h GLU 24 N 0.87 0.74 0.00 1.25 4.22 -0.75 0.24 114.58 121.14 2juz h GLU 24 Ca 0.17 -0.23 -0.03 0.00 0.08 0.00 0.00 59.36 59.35 2juz h GLU 24 Cb 0.45 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 2juz h GLU 24 CO 0.02 0.81 -0.13 0.87 -2.18 0.00 0.00 179.01 178.40 2juz h LYS 25 N 0.57 0.00 0.04 1.92 6.56 -1.24 -2.16 116.57 122.26 2juz h LYS 25 Ca 0.12 0.00 -0.23 0.00 -1.06 0.00 0.00 60.65 59.48 2juz h LYS 25 Cb 0.48 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.14 2juz h LYS 25 CO 0.02 0.13 -1.01 0.45 -2.06 0.00 0.00 179.45 176.98 2juz h HIS 26 N 0.00 0.44 -5.53 -1.35 3.86 -0.44 -3.49 115.15 108.64 2juz h HIS 26 Ca -0.00 -0.27 -0.07 0.00 -1.16 0.00 0.00 60.37 58.87 2juz h HIS 26 Cb 0.86 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.29 2juz h HIS 26 CO 0.00 1.12 -0.41 1.63 0.86 0.00 0.00 177.93 181.14 2juz n LYS 27 N -3.63 -1.87 -4.03 2.45 5.02 0.81 -5.03 118.16 111.88 2juz n LYS 27 Ca -0.06 1.72 -0.32 0.00 -2.02 0.00 0.00 58.31 57.64 2juz n LYS 27 Cb 0.89 -5.17 -0.15 0.00 -0.02 0.00 0.00 35.03 30.58 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 -2.70 2.72 1.02 7.82 0.00 -1.23 -5.07 121.76 124.33 2juz s ALA 28 Ca 0.14 -2.08 -0.12 0.00 0.00 0.00 0.00 51.96 49.91 2juz s ALA 28 Cb -0.03 -1.78 0.21 0.00 0.00 0.00 0.00 23.12 21.51 2juz s ALA 28 CO 0.78 -1.40 1.08 -1.25 0.00 0.00 0.00 175.76 174.97 2juz s PRO 29 N 1.04 0.18 0.54 0.00 0.04 -1.26 -4.35 135.00 131.19 2juz s PRO 29 Ca -0.01 1.06 0.31 0.00 0.04 0.00 0.00 61.00 62.40 2juz s PRO 29 Cb -0.20 -1.67 1.48 0.00 0.04 0.00 0.00 34.50 34.16 2juz s PRO 29 CO -0.06 -3.04 1.89 -0.24 0.04 0.00 0.00 177.00 175.59 2juz h VAL 30 N -2.14 0.55 0.11 -0.36 3.04 -2.00 0.33 116.25 115.78 2juz h VAL 30 Ca -0.53 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.15 2juz h VAL 30 Cb 1.30 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 31.14 2juz h VAL 30 CO 0.49 0.00 -0.05 0.44 -1.01 0.00 0.00 177.57 177.43 2juz h ASP 31 N 0.00 -0.12 -0.32 3.17 5.19 -1.99 -1.61 116.42 120.74 2juz h ASP 31 Ca 0.42 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.74 2juz h ASP 31 Cb 1.69 0.03 -0.02 0.00 0.18 0.00 0.00 39.33 41.21 2juz h ASP 31 CO -0.00 -0.09 -0.10 -0.07 -3.12 0.00 0.00 179.24 175.86 2juz h LEU 32 N -0.15 0.72 -0.65 1.55 3.38 -1.69 -2.62 115.31 115.86 2juz h LEU 32 Ca -0.01 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 2juz h LEU 32 Cb 0.11 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2juz h LEU 32 CO 0.02 0.85 0.26 -1.28 0.09 0.00 0.00 178.44 178.39 2juz h SER 33 N 0.67 0.89 -0.58 -0.43 0.87 -0.46 0.44 113.55 114.94 2juz h SER 33 Ca 0.12 -0.17 -0.08 0.00 -1.23 0.00 0.00 61.79 60.43 2juz h SER 33 Cb 0.56 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.27 2juz h SER 33 CO 0.03 0.81 0.07 0.25 -0.53 0.00 0.00 176.83 177.47 2juz h LEU 34 N 0.91 0.97 -0.40 2.23 5.85 -1.02 0.13 115.31 123.98 2juz h LEU 34 Ca 0.22 -0.24 -0.12 0.00 0.84 0.00 0.00 57.88 58.58 2juz h LEU 34 Cb 0.20 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2juz h LEU 34 CO -0.02 0.99 -0.22 0.40 -0.34 0.00 0.00 178.44 179.24 2juz h ILE 35 N 0.94 1.28 -0.09 4.05 2.04 -1.12 0.25 117.51 124.86 2juz h ILE 35 Ca 0.18 -1.37 -0.00 0.00 1.00 0.00 0.00 64.86 64.67 2juz h ILE 35 Cb 0.45 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 2juz h ILE 35 CO 0.02 0.46 0.05 0.00 0.00 0.00 0.00 178.15 178.67 2juz h ALA 36 N 0.81 0.12 0.00 1.87 0.00 -0.60 -1.46 119.26 120.01 2juz h ALA 36 Ca 0.09 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2juz h ALA 36 Cb 0.79 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2juz h ALA 36 CO 0.06 -0.33 -0.28 -0.07 0.00 0.00 0.00 179.25 178.64 2juz h LEU 37 N 0.05 0.00 0.19 0.00 3.38 -0.70 -0.85 115.31 117.37 2juz h LEU 37 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2juz h LEU 37 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2juz h LEU 37 CO -0.00 0.28 -0.09 1.23 0.09 0.00 0.00 178.44 179.94 2juz h GLY 38 N 0.95 -0.26 1.37 0.83 0.00 0.02 0.38 103.07 106.36 2juz h GLY 38 Ca -0.00 0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.37 2juz h GLY 38 CO 0.04 -0.10 0.10 3.43 0.00 0.00 0.00 176.54 180.01 2juz h ASN 39 N -0.38 0.73 -0.11 0.19 2.35 -1.08 -2.77 115.58 114.52 2juz h ASN 39 Ca -0.03 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.57 2juz h ASN 39 Cb 0.29 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 2juz h ASN 39 CO 0.04 0.74 -0.01 -0.03 -1.65 0.00 0.00 177.43 176.52 2juz h MET 40 N 0.75 0.20 0.34 0.81 4.05 -0.98 -2.70 114.93 117.41 2juz h MET 40 Ca 0.16 -0.07 -0.00 0.00 -0.28 0.00 0.00 59.70 59.51 2juz h MET 40 Cb 0.31 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.08 2juz h MET 40 CO 0.00 0.47 -0.30 0.00 0.23 0.00 0.00 176.91 177.31 2juz h ALA 41 N 0.73 -0.65 -0.35 0.39 0.00 -0.11 0.00 119.26 119.27 2juz h ALA 41 Ca 0.03 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2juz h ALA 41 Cb 0.38 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2juz h ALA 41 CO 0.01 -0.90 0.19 0.66 0.00 0.00 0.00 179.25 179.21 2juz h SER 42 N -0.65 0.30 0.22 0.00 4.64 -1.57 0.21 113.55 116.70 2juz h SER 42 Ca -0.02 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2juz h SER 42 Cb 0.58 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 2juz h SER 42 CO -0.03 0.22 -0.23 -1.13 -0.87 0.00 0.00 176.83 174.79 2juz h ASN 43 N 0.39 -0.61 -0.51 4.97 -1.24 -1.31 -2.13 115.58 115.14 2juz h ASN 43 Ca 0.14 0.06 -0.04 0.00 0.71 0.00 0.00 56.30 57.17 2juz h ASN 43 Cb 0.03 0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.27 2juz h ASN 43 CO -0.08 -0.33 0.16 -0.07 -1.29 0.00 0.00 177.43 175.82 2juz h LEU 44 N -0.48 0.74 -2.34 0.34 -0.00 -0.69 -2.20 115.31 110.68 2juz h LEU 44 Ca -0.00 -0.20 0.00 0.00 -0.00 0.00 0.00 57.88 57.68 2juz h LEU 44 Cb 0.45 -0.19 -0.00 0.00 -0.00 0.00 0.00 40.66 40.92 2juz h LEU 44 CO -0.06 0.75 0.01 -0.07 -0.00 0.00 0.00 178.44 179.07 2juz h LEU 45 N 0.70 0.00 -2.78 1.67 3.38 -0.45 0.36 115.31 118.19 2juz h LEU 45 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2juz h LEU 45 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2juz h LEU 45 CO -0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.87 2juz n THR 46 N -4.02 1.71 0.00 0.22 -2.24 -0.81 -4.21 114.28 104.93 2juz n THR 46 Ca -0.03 -1.02 0.00 0.00 -2.27 0.00 0.00 64.05 60.73 2juz n THR 46 Cb 0.10 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 2juz n THR 46 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2juz n THR 47 N 0.82 0.00 -0.12 4.28 5.66 -0.19 -4.96 114.28 119.77 2juz n THR 47 Ca 0.22 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 61.02 2juz n THR 47 Cb 0.83 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.49 2juz n THR 47 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2juz n SER 48 N -0.02 1.99 -4.67 1.09 3.41 0.11 -5.00 113.62 110.52 2juz n SER 48 Ca 0.00 -0.05 -0.29 0.00 -0.26 0.00 0.00 58.87 58.27 2juz n SER 48 Cb 0.00 -0.50 0.13 0.00 -0.26 0.00 0.00 64.21 63.59 2juz n SER 48 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2juz s VAL 49 N -2.52 1.98 -0.56 -3.33 -7.23 -1.26 -4.89 120.40 102.58 2juz s VAL 49 Ca -0.35 0.00 0.06 0.00 -1.81 0.00 0.00 61.98 59.89 2juz s VAL 49 Cb 0.10 -2.85 0.06 0.00 0.56 0.00 0.00 36.38 34.25 2juz s VAL 49 CO 0.60 0.00 1.12 -2.65 -0.31 0.00 0.00 175.10 173.86 2juz n PRO 50 N -3.68 0.04 0.00 4.82 -0.02 -1.26 -4.82 135.00 130.08 2juz n PRO 50 Ca 0.09 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2juz n PRO 50 Cb 0.60 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 2juz n PRO 50 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2juz n GLN 51 N -1.68 0.00 0.26 -0.52 7.27 -1.26 -4.35 117.38 117.09 2juz n GLN 51 Ca -0.00 0.00 0.14 0.00 0.07 0.00 0.00 57.00 57.20 2juz n GLN 51 Cb 0.11 0.00 0.71 0.00 2.41 0.00 0.00 30.24 33.47 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 0.44 -0.03 1.69 2.02 -1.98 -1.79 112.91 113.27 2juz h THR 52 Ca 0.00 -0.62 -0.00 0.00 0.77 0.00 0.00 66.41 66.56 2juz h THR 52 Cb 0.00 1.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.84 2juz h THR 52 CO 0.00 0.11 -0.10 1.67 0.37 0.00 0.00 175.52 177.57 2juz n GLN 53 N -3.46 1.47 -0.14 6.66 7.27 -1.26 -4.80 117.38 123.12 2juz n GLN 53 Ca -0.01 -2.76 -0.04 0.00 0.07 0.00 0.00 57.00 54.26 2juz n GLN 53 Cb 0.28 -1.56 0.05 0.00 2.41 0.00 0.00 30.24 31.42 2juz n GLN 53 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2juz h GLU 55 N 0.33 1.11 -0.57 0.00 4.81 -1.87 0.34 114.58 118.74 2juz h GLU 55 Ca 0.21 -0.16 -0.10 0.00 -0.13 0.00 0.00 59.36 59.18 2juz h GLU 55 Cb 0.21 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 2juz h GLU 55 CO -0.22 0.86 -0.06 0.00 -0.73 0.00 0.00 179.01 178.86 2juz h ALA 56 N 1.19 0.83 -0.48 2.92 0.00 -1.82 -1.23 119.26 120.67 2juz h ALA 56 Ca 0.27 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2juz h ALA 56 Cb 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2juz h ALA 56 CO -0.03 0.67 -0.09 -0.07 0.00 0.00 0.00 179.25 179.72 2juz h LEU 57 N 0.93 0.85 -0.31 0.00 4.07 -0.86 -0.35 115.31 119.64 2juz h LEU 57 Ca 0.15 -0.26 -0.01 0.00 0.08 0.00 0.00 57.88 57.85 2juz h LEU 57 Cb 0.61 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.11 2juz h LEU 57 CO 0.04 0.97 0.14 0.00 -1.08 0.00 0.00 178.44 178.50 2juz h ALA 58 N 1.11 0.39 -0.39 1.53 0.00 -0.59 0.20 119.26 121.52 2juz h ALA 58 Ca 0.13 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2juz h ALA 58 Cb 0.60 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2juz h ALA 58 CO 0.04 -0.03 -0.16 1.96 0.00 0.00 0.00 179.25 181.05 2juz h GLN 59 N 0.35 0.73 -0.49 0.00 4.20 -1.12 -0.38 115.11 118.41 2juz h GLN 59 Ca 0.10 -0.26 -0.09 0.00 0.06 0.00 0.00 58.65 58.46 2juz h GLN 59 Cb 0.14 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 2juz h GLN 59 CO -0.01 0.85 -0.07 0.00 -0.67 0.00 0.00 178.83 178.93 2juz h ALA 60 N 1.16 0.96 -0.55 3.87 0.00 -0.75 -0.52 119.26 123.42 2juz h ALA 60 Ca 0.10 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2juz h ALA 60 Cb 0.64 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2juz h ALA 60 CO 0.05 0.62 0.11 0.35 0.00 0.00 0.00 179.25 180.37 2juz h PHE 61 N 0.79 0.95 0.31 0.00 3.57 -0.33 -1.95 116.94 120.28 2juz h PHE 61 Ca 0.14 -0.13 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 2juz h PHE 61 Cb 0.57 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2juz h PHE 61 CO 0.03 0.84 -0.30 1.03 -2.23 0.00 0.00 178.31 177.67 2juz h SER 62 N 0.79 -0.82 -0.74 0.41 0.87 -0.65 -1.76 113.55 111.65 2juz h SER 62 Ca 0.17 0.07 0.09 0.00 -1.23 0.00 0.00 61.79 60.90 2juz h SER 62 Cb 0.38 0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 62.57 2juz h SER 62 CO 0.01 -0.44 0.48 0.78 -0.53 0.00 0.00 176.83 177.14 2juz h ASN 63 N -0.64 0.58 -0.77 6.23 2.35 -1.04 0.81 115.58 123.10 2juz h ASN 63 Ca -0.02 0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 2juz h ASN 63 Cb 0.58 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.81 2juz h ASN 63 CO -0.06 0.35 0.26 -1.28 -1.65 0.00 0.00 177.43 175.05 2juz h SER 64 N 0.64 1.10 -0.25 5.81 0.87 -0.92 0.19 113.55 120.99 2juz h SER 64 Ca 0.34 -0.20 -0.06 0.00 -1.23 0.00 0.00 61.79 60.65 2juz h SER 64 Cb 0.46 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 2juz h SER 64 CO -0.12 1.00 -0.06 -0.07 -0.53 0.00 0.00 176.83 177.05 2juz h LEU 65 N 1.13 0.48 -0.30 2.23 3.38 -0.14 -2.00 115.31 120.10 2juz h LEU 65 Ca 0.25 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.89 2juz h LEU 65 Cb 0.28 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2juz h LEU 65 CO -0.01 0.74 0.08 0.40 0.09 0.00 0.00 178.44 179.74 2juz h ILE 66 N 0.22 0.89 -0.66 1.22 1.08 -0.64 -0.52 117.51 119.10 2juz h ILE 66 Ca 0.06 -0.07 0.06 0.00 -0.39 0.00 0.00 64.86 64.52 2juz h ILE 66 Cb 0.53 0.67 -0.06 0.00 -3.07 0.00 0.00 36.82 34.90 2juz h ILE 66 CO 0.03 0.04 0.36 -1.13 -0.69 0.00 0.00 178.15 176.76 2juz h ASN 67 N 0.20 0.53 -0.27 1.72 -0.73 -0.57 0.13 115.58 116.59 2juz h ASN 67 Ca 0.14 0.03 -0.02 0.00 1.87 0.00 0.00 56.30 58.31 2juz h ASN 67 Cb 0.13 -0.07 -0.01 0.00 0.27 0.00 0.00 38.32 38.63 2juz h ASN 67 CO -0.16 0.34 0.08 0.00 -0.37 0.00 0.00 177.43 177.32 2juz h ALA 68 N 1.35 0.36 -0.09 1.57 0.00 -0.83 -1.57 119.26 120.05 2juz h ALA 68 Ca 0.30 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2juz h ALA 68 Cb 0.20 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2juz h ALA 68 CO -0.19 0.00 0.05 0.28 0.00 0.00 0.00 179.25 179.39 2juz h VAL 69 N 0.28 1.06 -0.98 0.00 2.07 -0.56 -1.98 116.25 116.14 2juz h VAL 69 Ca 0.09 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.48 2juz h VAL 69 Cb 0.26 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 2juz h VAL 69 CO -0.00 0.05 0.64 0.11 0.02 0.00 0.00 177.57 178.39 2juz h LYS 70 N 0.08 1.23 0.00 1.57 1.57 -0.70 0.28 116.57 120.60 2juz h LYS 70 Ca 0.03 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.65 2juz h LYS 70 Cb 0.04 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 2juz h LYS 70 CO -0.01 0.81 -0.43 1.15 -0.57 0.00 0.00 179.45 180.41 2juz h THR 71 N 1.26 1.16 0.12 -0.16 2.02 -1.06 0.10 112.91 116.34 2juz h THR 71 Ca 0.38 -1.56 -0.31 0.00 0.77 0.00 0.00 66.41 65.69 2juz h THR 71 Cb -0.05 1.88 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 2juz h THR 71 CO -0.11 0.42 -1.65 -0.09 0.37 0.00 0.00 175.52 174.46 2juz h ARG 72 N 0.00 0.25 -0.01 6.66 2.43 -0.53 -3.35 114.38 119.82 2juz h ARG 72 Ca -0.00 -0.42 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 2juz h ARG 72 Cb 0.84 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 2juz h ARG 72 CO 0.06 1.20 -0.05 1.28 -1.51 0.00 0.00 179.97 180.95 2juz n LEU 73 N -3.78 1.31 -3.11 3.80 7.99 0.90 -4.95 117.00 119.17 2juz n LEU 73 Ca -0.28 -0.42 -0.42 0.00 -0.01 0.00 0.00 56.01 54.88 2juz n LEU 73 Cb 0.95 -0.03 -0.09 0.00 -0.11 0.00 0.00 43.42 44.15 2juz n LEU 73 CO 0.41 0.22 1.30 1.21 -1.51 0.00 0.00 177.39 179.02 2juz n GLU 74 N -0.06 0.00 -3.76 3.23 2.13 0.35 -4.92 120.64 117.61 2juz n GLU 74 Ca 0.18 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.64 2juz n GLU 74 Cb 0.34 -1.09 -0.07 0.00 0.27 0.00 0.00 31.44 30.89 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 4.64 3.50 -1.27 4.31 3.76 -1.26 -5.02 115.29 123.96 2juz s HIS 75 Ca 0.89 0.47 -0.15 0.00 -0.15 0.00 0.00 55.06 56.11 2juz s HIS 75 Cb -1.07 -2.10 0.12 0.00 1.11 0.00 0.00 32.58 30.64 2juz s HIS 75 CO 0.46 0.47 1.64 0.72 -0.85 0.00 0.00 174.74 177.18 2juz n HIS 76 N 2.86 4.65 -3.85 1.40 -0.00 -1.26 -4.87 115.22 114.15 2juz n HIS 76 Ca -0.17 -3.08 -0.29 0.00 -0.00 0.00 0.00 57.72 54.18 2juz n HIS 76 Cb 0.53 -2.40 -0.16 0.00 -0.00 0.00 0.00 29.99 27.97 2juz n HIS 76 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2juz s HIS 77 N 2.76 1.73 -1.32 4.41 3.76 -1.26 -5.04 115.29 120.32 2juz s HIS 77 Ca 0.48 -1.29 -0.16 0.00 -0.15 0.00 0.00 55.06 53.94 2juz s HIS 77 Cb 0.02 -1.31 0.08 0.00 1.11 0.00 0.00 32.58 32.48 2juz s HIS 77 CO 0.03 -0.69 1.82 0.72 -0.85 0.00 0.00 174.74 175.78 2juz n HIS 78 N 4.86 4.32 -0.79 1.40 8.25 -1.26 -4.79 115.22 127.20 2juz n HIS 78 Ca -0.11 -2.95 0.04 0.00 -0.26 0.00 0.00 57.72 54.45 2juz n HIS 78 Cb 0.46 -2.51 -0.02 0.00 1.12 0.00 0.00 29.99 29.04 2juz n HIS 78 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2juz n HIS 79 N 7.12 -2.16 -0.81 4.41 -0.00 -1.26 -5.34 115.22 117.18 2juz n HIS 79 Ca 0.47 1.18 0.00 0.00 0.46 0.00 0.00 57.72 59.83 2juz n HIS 79 Cb 0.43 -2.01 0.00 0.00 -0.12 0.00 0.00 29.99 28.29 2juz n HIS 79 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38