#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 2.97 0.00 3.04 0.00 -1.26 -4.85 121.76 121.65 2juz s ALA 2 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.00 2juz s ALA 2 Cb 0.00 -3.98 0.00 0.00 0.00 0.00 0.00 23.12 19.14 2juz s ALA 2 CO 0.00 -2.50 0.00 1.04 0.00 0.00 0.00 175.76 174.30 2juz n GLN 3 N 8.24 0.00 -0.65 0.00 3.00 -1.26 -2.41 117.38 124.30 2juz n GLN 3 Ca 0.19 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.13 2juz n GLN 3 Cb 0.47 0.00 0.18 0.00 0.00 0.00 0.00 30.24 30.89 2juz n GLN 3 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2juz n HIS 4 N 0.00 1.59 -0.74 1.08 8.25 -1.26 -4.41 115.22 119.72 2juz n HIS 4 Ca 0.00 -0.88 -0.13 0.00 -0.26 0.00 0.00 57.72 56.45 2juz n HIS 4 Cb 0.00 -0.52 0.03 0.00 1.12 0.00 0.00 29.99 30.63 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 -0.06 6.04 -1.20 0.41 2.88 -1.01 -4.55 113.62 116.13 2juz n SER 5 Ca 0.27 -2.90 -0.04 0.00 -1.33 0.00 0.00 58.87 54.87 2juz n SER 5 Cb 1.03 -1.04 0.07 0.00 -0.75 0.00 0.00 64.21 63.52 2juz n SER 5 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2juz n LYS 6 N 0.55 1.60 -2.54 -1.46 5.02 -1.26 -4.86 118.16 115.21 2juz n LYS 6 Ca 0.23 -0.86 -0.03 0.00 -2.02 0.00 0.00 58.31 55.63 2juz n LYS 6 Cb 0.59 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 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 0.08 -3.03 -2.74 2.13 4.01 -1.26 -4.93 117.16 111.42 2juz n TYR 7 Ca 0.14 1.28 -0.43 0.00 -0.16 0.00 0.00 57.90 58.74 2juz n TYR 7 Cb 0.73 -3.58 -0.04 0.00 -0.31 0.00 0.00 39.34 36.14 2juz n TYR 7 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2juz s SER 8 N -1.85 6.37 0.32 7.72 0.01 -1.26 -4.85 113.70 120.16 2juz s SER 8 Ca 0.11 -0.20 0.23 0.00 1.31 0.00 0.00 55.95 57.40 2juz s SER 8 Cb -0.03 -2.48 1.15 0.00 0.21 0.00 0.00 66.02 64.87 2juz s SER 8 CO 0.63 -1.33 1.69 -0.90 0.41 0.00 0.00 173.24 173.74 2juz n ASP 9 N 7.83 0.60 0.07 2.44 5.75 -1.26 -0.30 116.55 131.68 2juz n ASP 9 Ca 0.04 0.75 -0.21 0.00 -0.01 0.00 0.00 54.79 55.35 2juz n ASP 9 Cb 0.48 -0.84 -0.13 0.00 -1.03 0.00 0.00 41.12 39.60 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 2.06 -0.02 -0.27 2.12 0.00 -2.00 -2.23 119.26 118.93 2juz h ALA 10 Ca 0.00 -0.73 -0.18 0.00 0.00 0.00 0.00 54.91 54.00 2juz h ALA 10 Cb 0.09 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2juz h ALA 10 CO 0.00 0.57 -0.54 0.37 0.00 0.00 0.00 179.25 179.65 2juz h GLN 11 N 0.08 0.80 0.33 0.00 4.15 -1.48 -2.57 115.11 116.41 2juz h GLN 11 Ca -0.17 -0.50 -0.01 0.00 0.77 0.00 0.00 58.65 58.75 2juz h GLN 11 Cb 1.78 0.06 -0.03 0.00 0.21 0.00 0.00 27.48 29.50 2juz h GLN 11 CO 0.21 1.13 -0.43 1.25 -1.93 0.00 0.00 178.83 179.06 2juz h LEU 12 N 0.61 -1.22 -1.32 -2.39 5.85 -0.70 -0.80 115.31 115.35 2juz h LEU 12 Ca 0.01 0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.92 2juz h LEU 12 Cb 1.13 0.42 -0.05 0.00 0.37 0.00 0.00 40.66 42.53 2juz h LEU 12 CO 0.12 -0.53 0.52 0.77 -0.34 0.00 0.00 178.44 178.97 2juz h SER 13 N -0.78 0.70 -0.91 1.25 4.64 -1.45 0.99 113.55 117.99 2juz h SER 13 Ca -0.04 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2juz h SER 13 Cb 0.70 -0.14 -0.04 0.00 -0.31 0.00 0.00 62.40 62.61 2juz h SER 13 CO -0.11 0.43 0.55 0.00 -0.87 0.00 0.00 176.83 176.84 2juz h ALA 14 N 1.59 1.16 -0.03 5.18 0.00 -1.09 0.61 119.26 126.68 2juz h ALA 14 Ca 0.35 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2juz h ALA 14 Cb 0.35 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2juz h ALA 14 CO -0.13 0.61 -0.01 0.82 0.00 0.00 0.00 179.25 180.54 2juz h ILE 15 N 1.25 1.31 -0.66 0.00 2.04 0.61 -2.52 117.51 119.53 2juz h ILE 15 Ca 0.33 -0.93 -0.05 0.00 1.00 0.00 0.00 64.86 65.21 2juz h ILE 15 Cb -0.06 1.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 2juz h ILE 15 CO -0.06 0.25 0.21 0.58 0.00 0.00 0.00 178.15 179.12 2juz h VAL 16 N -0.32 1.25 -0.73 1.67 2.07 -0.87 -0.01 116.25 119.32 2juz h VAL 16 Ca 0.01 -0.85 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 2juz h VAL 16 Cb 0.40 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2juz h VAL 16 CO 0.00 0.33 0.35 0.78 0.02 0.00 0.00 177.57 179.05 2juz h ASN 17 N 0.95 0.95 0.08 0.57 2.35 -0.93 -0.16 115.58 119.39 2juz h ASN 17 Ca 0.21 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2juz h ASN 17 Cb 0.29 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.42 2juz h ASN 17 CO -0.01 0.82 -0.04 -0.78 -1.65 0.00 0.00 177.43 175.77 2juz h ASP 18 N 1.02 -0.09 -0.70 5.81 3.58 -1.07 -1.21 116.42 123.77 2juz h ASP 18 Ca 0.25 -0.28 0.13 0.00 0.42 0.00 0.00 57.03 57.56 2juz h ASP 18 Cb 0.12 0.02 -0.09 0.00 1.72 0.00 0.00 39.33 41.10 2juz h ASP 18 CO -0.03 0.23 0.23 -0.03 -2.88 0.00 0.00 179.24 176.77 2juz h MET 19 N -0.42 0.36 0.10 0.28 4.05 -0.82 0.43 114.93 118.91 2juz h MET 19 Ca -0.01 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 2juz h MET 19 Cb 0.36 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.08 2juz h MET 19 CO 0.02 0.24 -0.05 0.82 0.23 0.00 0.00 176.91 178.17 2juz h ILE 20 N 0.37 0.92 -0.84 1.77 2.04 -0.91 -2.03 117.51 118.84 2juz h ILE 20 Ca 0.38 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 66.15 2juz h ILE 20 Cb 0.57 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 2juz h ILE 20 CO -0.41 0.02 0.46 0.00 0.00 0.00 0.00 178.15 178.22 2juz h ALA 21 N 0.73 1.07 -0.41 1.87 0.00 0.08 -1.37 119.26 121.22 2juz h ALA 21 Ca -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2juz h ALA 21 Cb 0.13 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2juz h ALA 21 CO 0.02 0.58 0.25 0.28 0.00 0.00 0.00 179.25 180.38 2juz h VAL 22 N 1.16 1.07 -0.46 0.00 2.07 -0.10 -0.22 116.25 119.77 2juz h VAL 22 Ca 0.30 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 67.57 2juz h VAL 22 Cb 0.02 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 2juz h VAL 22 CO -0.05 0.09 0.01 -0.07 0.02 0.00 0.00 177.57 177.58 2juz h LEU 23 N 0.52 0.71 -0.60 2.57 -0.00 -0.91 0.11 115.31 117.72 2juz h LEU 23 Ca 0.16 -0.16 -0.06 0.00 -0.00 0.00 0.00 57.88 57.82 2juz h LEU 23 Cb -0.02 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 40.43 2juz h LEU 23 CO -0.06 0.77 0.14 -0.33 -0.00 0.00 0.00 178.44 178.95 2juz h GLU 24 N 0.70 0.96 -0.16 1.13 4.39 -0.77 0.17 114.58 121.00 2juz h GLU 24 Ca 0.14 -0.24 -0.11 0.00 0.34 0.00 0.00 59.36 59.49 2juz h GLU 24 Cb 0.41 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2juz h GLU 24 CO 0.02 0.89 -0.40 0.87 -1.16 0.00 0.00 179.01 179.22 2juz h LYS 25 N 0.87 0.35 0.00 2.33 1.57 -0.56 -2.89 116.57 118.24 2juz h LYS 25 Ca 0.19 -0.17 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 2juz h LYS 25 Cb 0.37 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 2juz h LYS 25 CO 0.00 0.70 -0.67 1.25 -0.57 0.00 0.00 179.45 180.16 2juz h HIS 26 N 0.30 0.00 -5.56 -1.35 2.76 -0.48 -3.49 115.15 107.32 2juz h HIS 26 Ca 0.03 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.12 2juz h HIS 26 Cb 0.84 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.80 2juz h HIS 26 CO 0.02 0.67 -0.50 1.17 -1.30 0.00 0.00 177.93 178.00 2juz n LYS 27 N -3.41 -1.99 -4.60 5.26 4.81 0.55 -5.02 118.16 113.76 2juz n LYS 27 Ca 0.00 1.78 -0.33 0.00 -0.87 0.00 0.00 58.31 58.89 2juz n LYS 27 Cb 0.75 -5.02 -0.12 0.00 0.02 0.00 0.00 35.03 30.66 2juz n LYS 27 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2juz s ALA 28 N -2.59 2.88 0.61 3.14 0.00 -1.23 -5.08 121.76 119.49 2juz s ALA 28 Ca 0.19 -0.87 -0.17 0.00 0.00 0.00 0.00 51.96 51.11 2juz s ALA 28 Cb -0.04 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.73 2juz s ALA 28 CO 0.79 0.37 1.13 -1.25 0.00 0.00 0.00 175.76 176.79 2juz s PRO 29 N -0.12 3.00 0.54 0.00 0.04 -1.26 -4.78 135.00 132.43 2juz s PRO 29 Ca 0.01 1.51 0.36 0.00 0.04 0.00 0.00 61.00 62.92 2juz s PRO 29 Cb -0.13 -1.97 1.96 0.00 0.04 0.00 0.00 34.50 34.40 2juz s PRO 29 CO 0.03 -1.11 2.11 -0.39 0.04 0.00 0.00 177.00 177.68 2juz h VAL 30 N 0.52 0.00 0.28 -0.36 -1.51 -1.99 -0.23 116.25 112.96 2juz h VAL 30 Ca -0.48 -0.01 -0.01 0.00 -1.23 0.00 0.00 66.70 64.97 2juz h VAL 30 Cb 1.26 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 2juz h VAL 30 CO 0.55 0.00 -0.13 0.44 -1.23 0.00 0.00 177.57 177.20 2juz h ASP 31 N 0.00 -0.31 -0.28 4.19 3.32 -1.99 -1.84 116.42 119.51 2juz h ASP 31 Ca 0.00 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 2juz h ASP 31 Cb 0.01 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2juz h ASP 31 CO 0.00 -0.19 -0.16 -0.07 -1.72 0.00 0.00 179.24 177.09 2juz h LEU 32 N -0.43 0.72 0.17 1.55 3.38 -1.85 -2.15 115.31 116.69 2juz h LEU 32 Ca -0.04 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2juz h LEU 32 Cb 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2juz h LEU 32 CO 0.06 0.89 -0.14 -1.28 0.09 0.00 0.00 178.44 178.06 2juz h SER 33 N 0.65 -0.38 0.82 -0.43 0.87 -1.13 0.15 113.55 114.11 2juz h SER 33 Ca 0.10 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.59 2juz h SER 33 Cb 0.64 0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.71 2juz h SER 33 CO 0.04 -0.22 -0.51 -0.07 -0.53 0.00 0.00 176.83 175.54 2juz h LEU 34 N -0.33 0.00 -0.27 2.23 -0.00 -1.29 -1.90 115.31 113.74 2juz h LEU 34 Ca -0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 57.68 2juz h LEU 34 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.97 2juz h LEU 34 CO -0.02 0.51 -0.63 0.40 -0.00 0.00 0.00 178.44 178.70 2juz h ILE 35 N 0.00 1.28 -0.40 1.22 2.04 -1.11 0.31 117.51 120.86 2juz h ILE 35 Ca -0.01 -1.83 0.00 0.00 1.00 0.00 0.00 64.86 64.03 2juz h ILE 35 Cb 1.06 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 2juz h ILE 35 CO 0.07 0.59 0.26 0.00 0.00 0.00 0.00 178.15 179.06 2juz h ALA 36 N 0.67 0.51 -0.37 1.87 0.00 -0.51 0.36 119.26 121.81 2juz h ALA 36 Ca -0.01 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2juz h ALA 36 Cb 1.24 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2juz h ALA 36 CO 0.13 -0.02 -0.16 -0.07 0.00 0.00 0.00 179.25 179.13 2juz h LEU 37 N 0.54 0.68 0.27 0.00 3.38 -1.29 0.21 115.31 119.10 2juz h LEU 37 Ca 0.15 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2juz h LEU 37 Cb -0.04 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.53 2juz h LEU 37 CO -0.03 0.85 -0.13 1.23 0.09 0.00 0.00 178.44 180.45 2juz h GLY 38 N 0.98 -0.38 1.05 0.83 0.00 0.23 0.41 103.07 106.19 2juz h GLY 38 Ca 0.10 0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.58 2juz h GLY 38 CO 0.04 -0.14 0.63 -0.57 0.00 0.00 0.00 176.54 176.50 2juz h ASN 39 N -0.58 1.11 -0.01 0.19 -1.24 -0.28 -0.13 115.58 114.65 2juz h ASN 39 Ca -0.04 -0.04 -0.00 0.00 0.71 0.00 0.00 56.30 56.94 2juz h ASN 39 Cb 0.42 -0.28 -0.00 0.00 0.73 0.00 0.00 38.32 39.19 2juz h ASN 39 CO 0.06 0.82 0.00 -0.03 -1.29 0.00 0.00 177.43 176.99 2juz h MET 40 N 1.31 0.01 -0.44 6.67 4.05 -0.85 -1.52 114.93 124.17 2juz h MET 40 Ca 0.35 -0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.80 2juz h MET 40 Cb -0.14 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.63 2juz h MET 40 CO -0.07 0.28 0.24 0.00 0.23 0.00 0.00 176.91 177.59 2juz h ALA 41 N 0.73 0.55 -0.18 0.39 0.00 0.11 0.21 119.26 121.06 2juz h ALA 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2juz h ALA 41 Cb 0.28 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2juz h ALA 41 CO 0.00 -0.10 0.12 0.77 0.00 0.00 0.00 179.25 180.04 2juz h SER 42 N 0.48 0.20 -0.64 0.00 0.02 -1.00 0.33 113.55 112.93 2juz h SER 42 Ca 0.18 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.08 2juz h SER 42 Cb 0.06 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 2juz h SER 42 CO -0.11 0.14 0.21 -1.13 -1.14 0.00 0.00 176.83 174.81 2juz h ASN 43 N 0.24 0.95 -0.33 3.07 -1.24 -0.86 -1.61 115.58 115.80 2juz h ASN 43 Ca 0.07 -0.17 -0.15 0.00 0.71 0.00 0.00 56.30 56.76 2juz h ASN 43 Cb -0.02 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.77 2juz h ASN 43 CO -0.02 0.89 -0.37 -0.07 -1.29 0.00 0.00 177.43 176.56 2juz h LEU 44 N 0.98 0.93 -1.28 0.34 3.38 -0.21 -2.10 115.31 117.36 2juz h LEU 44 Ca 0.22 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2juz h LEU 44 Cb 0.28 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2juz h LEU 44 CO -0.01 1.20 0.00 -0.07 0.09 0.00 0.00 178.44 179.65 2juz h LEU 45 N 0.72 0.00 -2.80 1.67 3.38 0.07 0.93 115.31 119.29 2juz h LEU 45 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2juz h LEU 45 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2juz h LEU 45 CO 0.09 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.97 2juz n THR 46 N -2.66 0.98 0.00 0.22 -2.24 -0.64 -4.50 114.28 105.44 2juz n THR 46 Ca 0.01 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 2juz n THR 46 Cb 0.23 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.97 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 1.08 0.00 0.71 4.28 -1.04 -0.56 -4.88 114.28 113.87 2juz n THR 47 Ca 0.18 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.32 2juz n THR 47 Cb 0.52 -0.28 0.36 0.00 -1.82 0.00 0.00 70.33 69.11 2juz n THR 47 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2juz n SER 48 N -2.00 0.61 -4.93 8.00 7.64 0.31 -4.85 113.62 118.40 2juz n SER 48 Ca 0.00 0.36 -0.25 0.00 1.01 0.00 0.00 58.87 59.98 2juz n SER 48 Cb 0.05 -0.37 0.01 0.00 -1.01 0.00 0.00 64.21 62.88 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 -3.09 4.26 0.00 0.44 -7.23 -1.23 -5.05 120.40 108.50 2juz s VAL 49 Ca 0.10 -0.15 0.00 0.00 -1.81 0.00 0.00 61.98 60.12 2juz s VAL 49 Cb 0.14 -3.62 0.00 0.00 0.56 0.00 0.00 36.38 33.47 2juz s VAL 49 CO 0.63 -0.54 0.79 -0.81 -0.31 0.00 0.00 175.10 174.86 2juz n PRO 50 N -2.25 0.00 0.00 4.82 -0.04 -1.26 -5.01 135.00 131.26 2juz n PRO 50 Ca 0.01 0.43 0.00 0.00 -0.04 0.00 0.00 63.50 63.90 2juz n PRO 50 Cb 0.57 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 2juz n PRO 50 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2juz n GLN 51 N -1.59 0.00 -0.00 0.54 7.27 -1.26 -4.99 117.38 117.34 2juz n GLN 51 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 57.00 57.00 2juz n GLN 51 Cb 0.00 0.00 0.11 0.00 2.41 0.00 0.00 30.24 32.76 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 1.30 0.00 1.69 2.02 -2.01 -2.75 112.91 113.16 2juz h THR 52 Ca 0.00 -1.56 0.00 0.00 0.77 0.00 0.00 66.41 65.62 2juz h THR 52 Cb 0.00 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 2juz h THR 52 CO 0.00 0.49 0.00 0.00 0.37 0.00 0.00 175.52 176.38 2juz n GLN 53 N -4.03 0.17 -0.31 6.66 3.00 -1.26 -3.25 117.38 118.36 2juz n GLN 53 Ca -0.02 0.17 0.06 0.00 -0.01 0.00 0.00 57.00 57.20 2juz n GLN 53 Cb 0.51 -1.50 0.26 0.00 0.00 0.00 0.00 30.24 29.51 2juz n GLN 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2juz h GLU 55 N 0.98 0.94 -0.15 0.00 4.22 -1.80 0.40 114.58 119.16 2juz h GLU 55 Ca 0.42 -0.06 -0.09 0.00 0.08 0.00 0.00 59.36 59.72 2juz h GLU 55 Cb 0.34 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2juz h GLU 55 CO -0.18 0.62 -0.25 0.00 -2.18 0.00 0.00 179.01 177.03 2juz h ALA 56 N 1.26 0.23 -0.52 2.92 0.00 -1.62 -2.62 119.26 118.91 2juz h ALA 56 Ca 0.26 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2juz h ALA 56 Cb -0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2juz h ALA 56 CO -0.06 0.21 0.03 -0.07 0.00 0.00 0.00 179.25 179.36 2juz h LEU 57 N 0.05 0.87 -0.50 0.00 4.07 -0.82 0.23 115.31 119.21 2juz h LEU 57 Ca 0.01 -0.29 -0.05 0.00 0.08 0.00 0.00 57.88 57.63 2juz h LEU 57 Cb 0.82 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 42.31 2juz h LEU 57 CO 0.06 0.95 0.13 0.00 -1.08 0.00 0.00 178.44 178.50 2juz h ALA 58 N 0.96 0.66 -0.01 1.53 0.00 -0.28 0.12 119.26 122.23 2juz h ALA 58 Ca 0.15 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2juz h ALA 58 Cb 0.48 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2juz h ALA 58 CO 0.02 0.33 -0.50 0.37 0.00 0.00 0.00 179.25 179.47 2juz h GLN 59 N 0.68 0.02 -0.16 0.00 5.75 -1.32 0.20 115.11 120.27 2juz h GLN 59 Ca 0.16 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.63 2juz h GLN 59 Cb 0.31 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.85 2juz h GLN 59 CO -0.00 0.52 0.02 0.00 -2.65 0.00 0.00 178.83 176.72 2juz h ALA 60 N 1.48 0.22 -0.79 3.38 0.00 -0.52 -0.20 119.26 122.83 2juz h ALA 60 Ca -0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 2juz h ALA 60 Cb 0.90 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 2juz h ALA 60 CO 0.07 -0.11 0.32 0.35 0.00 0.00 0.00 179.25 179.88 2juz h PHE 61 N 0.06 1.19 0.35 0.00 3.57 -0.69 0.94 116.94 122.36 2juz h PHE 61 Ca 0.05 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 2juz h PHE 61 Cb 0.31 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 2juz h PHE 61 CO 0.02 0.89 -0.42 1.03 -2.23 0.00 0.00 178.31 177.60 2juz h SER 62 N 1.15 -1.18 0.14 0.41 0.87 -0.46 -1.38 113.55 113.09 2juz h SER 62 Ca 0.26 0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.91 2juz h SER 62 Cb 0.20 0.40 -0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2juz h SER 62 CO -0.02 -0.53 -0.08 0.78 -0.53 0.00 0.00 176.83 176.45 2juz h ASN 63 N -0.79 0.00 -0.44 6.23 2.35 -0.89 -0.45 115.58 121.60 2juz h ASN 63 Ca -0.04 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 2juz h ASN 63 Cb 0.70 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.05 2juz h ASN 63 CO -0.09 0.08 0.18 -1.28 -1.65 0.00 0.00 177.43 174.67 2juz h SER 64 N 0.00 0.59 -0.49 5.81 0.87 -0.41 0.22 113.55 120.14 2juz h SER 64 Ca -0.00 -0.16 -0.11 0.00 -1.23 0.00 0.00 61.79 60.29 2juz h SER 64 Cb 0.16 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 2juz h SER 64 CO 0.01 0.59 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.71 2juz h LEU 65 N 0.56 0.97 0.01 2.23 3.38 -0.12 -0.43 115.31 121.91 2juz h LEU 65 Ca 0.15 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2juz h LEU 65 Cb 0.17 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2juz h LEU 65 CO -0.01 1.09 -0.08 0.40 0.09 0.00 0.00 178.44 179.93 2juz h ILE 66 N 0.86 0.79 -0.50 1.22 1.08 -0.78 -1.48 117.51 118.70 2juz h ILE 66 Ca 0.13 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.56 2juz h ILE 66 Cb 0.67 0.79 -0.02 0.00 -3.07 0.00 0.00 36.82 35.19 2juz h ILE 66 CO 0.05 0.00 0.11 -1.13 -0.69 0.00 0.00 178.15 176.49 2juz h ASN 67 N -0.15 0.71 -0.30 1.72 -1.24 -0.44 -1.17 115.58 114.71 2juz h ASN 67 Ca 0.03 -0.12 0.02 0.00 0.71 0.00 0.00 56.30 56.94 2juz h ASN 67 Cb 0.18 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 39.02 2juz h ASN 67 CO -0.08 0.70 0.14 0.00 -1.29 0.00 0.00 177.43 176.91 2juz h ALA 68 N 1.39 0.36 -0.53 1.57 0.00 -0.65 0.28 119.26 121.69 2juz h ALA 68 Ca 0.16 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2juz h ALA 68 Cb 0.28 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2juz h ALA 68 CO -0.00 -0.25 0.17 0.28 0.00 0.00 0.00 179.25 179.45 2juz h VAL 69 N 0.30 1.23 -0.87 0.00 2.07 -0.86 0.42 116.25 118.54 2juz h VAL 69 Ca 0.12 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 2juz h VAL 69 Cb 0.05 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 2juz h VAL 69 CO -0.09 0.29 0.44 0.11 0.02 0.00 0.00 177.57 178.34 2juz h LYS 70 N 0.73 1.24 0.00 1.57 6.56 -0.82 -1.34 116.57 124.51 2juz h LYS 70 Ca 0.17 -0.17 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 2juz h LYS 70 Cb 0.27 -0.23 0.00 0.00 -0.57 0.00 0.00 32.23 31.70 2juz h LYS 70 CO -0.01 0.93 0.00 1.15 -2.06 0.00 0.00 179.45 179.46 2juz h THR 71 N 1.23 0.00 -0.11 -0.16 2.02 -0.19 0.38 112.91 116.08 2juz h THR 71 Ca 0.30 -0.77 -0.21 0.00 0.77 0.00 0.00 66.41 66.51 2juz h THR 71 Cb 0.08 1.77 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 2juz h THR 71 CO -0.04 0.00 -0.77 -0.09 0.37 0.00 0.00 175.52 174.99 2juz h ARG 72 N 0.00 0.59 0.22 6.66 1.12 0.07 -3.27 114.38 119.76 2juz h ARG 72 Ca 0.00 -0.49 -0.34 0.00 -1.11 0.00 0.00 59.98 58.04 2juz h ARG 72 Cb 0.77 0.11 0.02 0.00 -0.01 0.00 0.00 29.97 30.86 2juz h ARG 72 CO 0.00 1.11 -1.56 -0.07 -3.11 0.00 0.00 179.97 176.35 2juz h LEU 73 N 0.40 0.72 -0.74 3.80 3.38 -1.04 -3.51 115.31 118.31 2juz h LEU 73 Ca -0.05 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.06 2juz h LEU 73 Cb 1.38 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2juz h LEU 73 CO 0.15 1.70 -0.59 -0.62 0.09 0.00 0.00 178.44 179.16 2juz n GLU 74 N -3.65 -3.19 0.24 1.13 1.02 0.13 -4.82 120.64 111.50 2juz n GLU 74 Ca -0.19 2.31 0.13 0.00 -0.02 0.00 0.00 57.16 59.40 2juz n GLU 74 Cb 1.09 -2.56 0.39 0.00 -0.02 0.00 0.00 31.44 30.35 2juz n GLU 74 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2juz h HIS 75 N 1.75 0.00 -3.46 -0.32 -0.00 -1.93 -3.38 115.15 107.80 2juz h HIS 75 Ca 0.00 0.00 -0.71 0.00 -0.00 0.00 0.00 60.37 59.66 2juz h HIS 75 Cb 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 27.41 27.10 2juz h HIS 75 CO 0.00 0.05 -0.51 -1.01 -0.00 0.00 0.00 177.93 176.46 2juz s HIS 76 N -3.42 3.45 -0.08 5.26 3.76 -1.26 -4.90 115.29 118.11 2juz s HIS 76 Ca 0.04 -2.00 0.13 0.00 -0.15 0.00 0.00 55.06 53.08 2juz s HIS 76 Cb 0.07 -3.10 -0.19 0.00 1.11 0.00 0.00 32.58 30.47 2juz s HIS 76 CO 0.62 -0.93 0.18 -2.39 -0.85 0.00 0.00 174.74 171.37 2juz n HIS 77 N 4.76 0.00 0.00 1.40 1.44 -1.26 -5.01 115.22 116.54 2juz n HIS 77 Ca -0.07 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.64 2juz n HIS 77 Cb 0.42 -0.49 0.00 0.00 0.12 0.00 0.00 29.99 30.03 2juz n HIS 77 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2juz n HIS 78 N -2.25 0.00 0.00 -1.40 -0.00 -1.26 -3.78 115.22 106.54 2juz n HIS 78 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.60 2juz n HIS 78 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.65 2juz n HIS 78 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2juz n HIS 79 N 0.00 0.00 -0.79 1.57 -0.00 -1.26 -5.30 115.22 109.44 2juz n HIS 79 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2juz n HIS 79 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2juz n HIS 79 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38