#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ju8 s ASN 2 N 0.00 6.65 0.00 6.12 6.03 -1.26 -4.75 114.94 127.72 2ju8 s ASN 2 Ca 0.00 0.55 0.00 0.00 -1.03 0.00 0.00 52.86 52.38 2ju8 s ASN 2 Cb 0.00 -2.43 0.00 0.00 -3.03 0.00 0.00 41.25 35.79 2ju8 s ASN 2 CO 0.00 -0.77 0.00 0.49 -2.03 0.00 0.00 177.10 174.79 2ju8 n PHE 3 N 6.54 -0.15 -3.79 1.54 3.72 -1.26 -4.98 117.46 119.08 2ju8 n PHE 3 Ca 0.05 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.09 2ju8 n PHE 3 Cb 0.48 0.31 -0.07 0.00 -0.94 0.00 0.00 39.48 39.26 2ju8 n PHE 3 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2ju8 s SER 4 N -3.98 6.30 0.00 4.37 0.01 -1.26 -4.65 113.70 114.49 2ju8 s SER 4 Ca 0.00 0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.61 2ju8 s SER 4 Cb 0.00 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 64.15 2ju8 s SER 4 CO 0.00 0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.55 2ju8 n GLY 5 N 2.80 1.58 3.44 3.44 0.00 -1.14 -5.00 105.19 110.31 2ju8 n GLY 5 Ca -0.18 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 2ju8 n GLY 5 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ju8 s LYS 6 N -2.00 3.55 -0.00 1.61 2.20 -1.26 -2.47 119.74 121.37 2ju8 s LYS 6 Ca 0.00 -0.58 0.08 0.00 -0.36 0.00 0.00 55.97 55.11 2ju8 s LYS 6 Cb 0.00 -2.85 -0.02 0.00 -1.51 0.00 0.00 37.83 33.45 2ju8 s LYS 6 CO 0.00 0.18 -0.25 0.71 -0.36 0.00 0.00 175.35 175.63 2ju8 s TYR 7 N 0.50 2.23 -0.14 4.03 2.02 -0.03 -2.74 117.35 123.22 2ju8 s TYR 7 Ca -0.05 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 2ju8 s TYR 7 Cb -0.15 -1.41 -0.00 0.00 -0.40 0.00 0.00 41.96 40.00 2ju8 s TYR 7 CO 0.03 0.00 -0.16 -1.14 -1.57 0.00 0.00 175.55 172.71 2ju8 s GLN 8 N -0.75 3.23 0.32 -0.62 2.00 -0.64 -1.70 119.66 121.50 2ju8 s GLN 8 Ca 0.10 -0.75 -0.29 0.00 -2.00 0.00 0.00 55.36 52.42 2ju8 s GLN 8 Cb -0.10 -2.58 -0.10 0.00 0.80 0.00 0.00 33.01 31.04 2ju8 s GLN 8 CO -0.00 0.08 1.23 0.08 -0.50 0.00 0.00 175.29 176.18 2ju8 s VAL 9 N 0.64 3.01 0.00 1.34 1.01 -0.64 -1.70 120.40 124.06 2ju8 s VAL 9 Ca -0.08 1.01 0.00 0.00 0.00 0.00 0.00 61.98 62.91 2ju8 s VAL 9 Cb -0.16 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2ju8 s VAL 9 CO 0.02 0.24 0.00 0.00 0.00 0.00 0.00 175.10 175.36 2ju8 n GLN 10 N 0.90 3.00 -3.54 2.72 6.02 -0.54 -4.36 117.38 121.58 2ju8 n GLN 10 Ca -0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.91 2ju8 n GLN 10 Cb 0.43 -0.66 -0.02 0.00 1.02 0.00 0.00 30.24 31.01 2ju8 n GLN 10 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2ju8 s SER 11 N -0.95 -0.32 0.04 1.08 0.15 -1.25 -5.07 113.70 107.37 2ju8 s SER 11 Ca 0.00 -0.05 -0.09 0.00 0.70 0.00 0.00 55.95 56.51 2ju8 s SER 11 Cb 0.00 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 2ju8 s SER 11 CO 0.00 -0.63 0.17 -1.58 1.20 0.00 0.00 173.24 172.40 2ju8 s GLN 12 N -3.09 0.66 -0.16 5.44 -0.44 -1.26 -2.45 119.66 118.36 2ju8 s GLN 12 Ca 0.06 -0.65 -0.04 0.00 -2.50 0.00 0.00 55.36 52.24 2ju8 s GLN 12 Cb -0.01 0.27 -0.03 0.00 -1.64 0.00 0.00 33.01 31.61 2ju8 s GLN 12 CO -0.07 -0.19 -0.04 -1.21 0.50 0.00 0.00 175.29 174.29 2ju8 s GLU 13 N -2.53 3.67 0.11 1.67 0.41 -1.06 -4.92 118.70 116.06 2ju8 s GLU 13 Ca -0.05 -0.52 0.00 0.00 -0.41 0.00 0.00 54.97 53.99 2ju8 s GLU 13 Cb -0.01 -2.92 0.00 0.00 -1.78 0.00 0.00 34.13 29.41 2ju8 s GLU 13 CO -0.04 0.23 0.00 0.09 -0.49 0.00 0.00 175.26 175.06 2ju8 n ASN 14 N 3.56 -7.17 0.03 -0.19 4.13 -1.26 -3.77 115.26 110.58 2ju8 n ASN 14 Ca -0.17 1.10 0.00 0.00 1.68 0.00 0.00 54.58 57.19 2ju8 n ASN 14 Cb 0.52 -3.98 0.00 0.00 -1.54 0.00 0.00 39.78 34.79 2ju8 n ASN 14 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2ju8 n PHE 15 N 1.37 -0.12 -0.17 3.10 3.01 -1.26 -4.78 117.46 118.60 2ju8 n PHE 15 Ca 0.00 0.02 -0.03 0.00 1.01 0.00 0.00 57.45 58.46 2ju8 n PHE 15 Cb 0.00 0.05 0.07 0.00 -0.01 0.00 0.00 39.48 39.59 2ju8 n PHE 15 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2ju8 h GLU 16 N 0.00 0.38 -0.93 -1.08 5.08 -1.97 -2.64 114.58 113.42 2ju8 h GLU 16 Ca 0.00 -0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.49 2ju8 h GLU 16 Cb 0.00 -0.09 -0.10 0.00 0.50 0.00 0.00 28.75 29.07 2ju8 h GLU 16 CO 0.00 0.25 0.53 -1.35 -1.00 0.00 0.00 179.01 177.44 2ju8 h PRO 17 N 0.39 0.73 0.12 2.33 0.11 -2.00 -2.63 132.00 131.05 2ju8 h PRO 17 Ca 0.25 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.32 2ju8 h PRO 17 Cb 0.26 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.19 2ju8 h PRO 17 CO -0.24 0.48 -0.13 0.35 -0.21 0.00 0.00 178.00 178.25 2ju8 h PHE 18 N 0.75 -0.33 -0.64 0.65 3.57 -1.77 -2.69 116.94 116.48 2ju8 h PHE 18 Ca 0.50 0.00 0.01 0.00 3.53 0.00 0.00 57.97 62.02 2ju8 h PHE 18 Cb 0.69 0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.52 2ju8 h PHE 18 CO -0.05 -0.20 0.42 0.00 -2.23 0.00 0.00 178.31 176.26 2ju8 h MET 19 N -0.28 0.82 -0.38 1.11 -0.00 -1.50 -2.57 114.93 112.12 2ju8 h MET 19 Ca 0.01 -0.05 -0.00 0.00 -0.00 0.00 0.00 59.70 59.65 2ju8 h MET 19 Cb 0.27 -0.19 -0.02 0.00 -0.00 0.00 0.00 31.60 31.67 2ju8 h MET 19 CO -0.04 0.54 0.22 0.87 -0.00 0.00 0.00 176.91 178.51 2ju8 h LYS 20 N 0.85 0.52 0.00 -0.10 1.57 -1.20 -0.40 116.57 117.80 2ju8 h LYS 20 Ca 0.24 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2ju8 h LYS 20 Cb -0.07 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.13 2ju8 h LYS 20 CO -0.05 0.41 0.00 0.00 -0.57 0.00 0.00 179.45 179.23 2ju8 n ALA 21 N -2.23 -0.06 0.05 3.86 0.00 -1.06 -3.86 120.51 117.21 2ju8 n ALA 21 Ca -0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 2ju8 n ALA 21 Cb 0.06 0.00 0.46 0.00 0.00 0.00 0.00 19.45 19.97 2ju8 n ALA 21 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2ju8 h MET 22 N 0.00 0.00 0.00 0.00 1.85 -1.63 -3.43 114.93 111.72 2ju8 h MET 22 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 2ju8 h MET 22 Cb 0.00 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.03 2ju8 h MET 22 CO 0.00 0.00 0.00 0.41 -0.40 0.00 0.00 176.91 176.92 2ju8 n GLY 23 N -1.55 0.85 3.78 1.39 0.00 -0.83 -5.06 105.19 103.77 2ju8 n GLY 23 Ca 0.11 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 2ju8 n GLY 23 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ju8 s LEU 24 N 0.00 4.05 -0.01 0.99 2.96 -0.22 -4.98 118.68 121.47 2ju8 s LEU 24 Ca 0.00 2.04 -0.30 0.00 -0.22 0.00 0.00 54.13 55.65 2ju8 s LEU 24 Cb 0.00 -4.29 -0.03 0.00 0.50 0.00 0.00 46.19 42.37 2ju8 s LEU 24 CO 0.00 -0.62 1.07 -2.16 -1.32 0.00 0.00 176.35 173.32 2ju8 s PRO 25 N -2.71 4.48 0.59 0.98 0.04 -1.26 -4.21 135.00 132.90 2ju8 s PRO 25 Ca 0.61 1.53 0.29 0.00 0.04 0.00 0.00 61.00 63.47 2ju8 s PRO 25 Cb -0.21 -3.46 1.49 0.00 0.04 0.00 0.00 34.50 32.35 2ju8 s PRO 25 CO 0.26 -0.20 1.91 1.49 0.04 0.00 0.00 177.00 180.50 2ju8 h GLU 26 N 6.94 0.00 -0.33 4.56 4.81 -1.93 -0.62 114.58 128.01 2ju8 h GLU 26 Ca -0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2ju8 h GLU 26 Cb 1.20 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 2ju8 h GLU 26 CO 0.80 0.00 0.22 -0.44 -0.73 0.00 0.00 179.01 178.86 2ju8 h ASP 27 N 0.00 0.38 -0.53 1.04 5.19 -1.99 0.31 116.42 120.82 2ju8 h ASP 27 Ca 0.21 -0.01 -0.09 0.00 -0.62 0.00 0.00 57.03 56.51 2ju8 h ASP 27 Cb 1.14 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.54 2ju8 h ASP 27 CO -0.00 0.28 -0.03 -0.07 -3.12 0.00 0.00 179.24 176.30 2ju8 h LEU 28 N 0.45 0.95 -0.29 1.55 4.07 -1.51 -1.45 115.31 119.08 2ju8 h LEU 28 Ca 0.12 -0.32 -0.02 0.00 0.08 0.00 0.00 57.88 57.74 2ju8 h LEU 28 Cb -0.05 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.42 2ju8 h LEU 28 CO -0.03 1.05 0.10 0.40 -1.08 0.00 0.00 178.44 178.88 2ju8 h ILE 29 N 0.84 1.19 -0.67 1.22 2.04 -1.34 -0.91 117.51 119.88 2ju8 h ILE 29 Ca 0.15 -0.60 -0.05 0.00 1.00 0.00 0.00 64.86 65.35 2ju8 h ILE 29 Cb 0.58 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 2ju8 h ILE 29 CO 0.03 0.20 0.21 1.56 0.00 0.00 0.00 178.15 180.15 2ju8 h GLN 30 N 0.31 1.02 -0.09 2.37 1.08 -0.88 -1.46 115.11 117.46 2ju8 h GLN 30 Ca 0.09 -0.21 -0.09 0.00 -1.45 0.00 0.00 58.65 57.00 2ju8 h GLN 30 Cb 0.22 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 2ju8 h GLN 30 CO -0.00 0.87 -0.36 0.87 -0.95 0.00 0.00 178.83 179.26 2ju8 h LYS 31 N 0.98 0.17 -0.01 1.46 1.57 -1.07 -2.65 116.57 117.03 2ju8 h LYS 31 Ca 0.22 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 2ju8 h LYS 31 Cb 0.28 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2ju8 h LYS 31 CO -0.01 0.51 -0.04 0.78 -0.57 0.00 0.00 179.45 180.13 2ju8 h GLY 32 N 1.13 0.04 2.00 3.86 0.00 -0.59 -2.96 103.07 106.55 2ju8 h GLY 32 Ca 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 2ju8 h GLY 32 CO 0.05 0.05 -0.01 0.07 0.00 0.00 0.00 176.54 176.70 2ju8 h LYS 33 N -0.60 0.00 -0.10 4.80 2.10 -1.29 -2.50 116.57 118.98 2ju8 h LYS 33 Ca -0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.62 2ju8 h LYS 33 Cb 0.69 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.02 2ju8 h LYS 33 CO 0.01 0.01 -0.06 0.22 -2.00 0.00 0.00 179.45 177.63 2ju8 h ASP 34 N 0.00 0.22 -3.47 7.07 3.58 -1.48 -3.42 116.42 118.92 2ju8 h ASP 34 Ca -0.00 -0.44 -0.61 0.00 0.42 0.00 0.00 57.03 56.40 2ju8 h ASP 34 Cb 0.02 -0.06 -0.11 0.00 1.72 0.00 0.00 39.33 40.90 2ju8 h ASP 34 CO 0.00 0.61 0.17 -0.63 -2.88 0.00 0.00 179.24 176.51 2ju8 s ILE 35 N -4.46 4.98 0.05 2.25 -1.09 -0.94 -5.01 121.20 116.98 2ju8 s ILE 35 Ca -0.15 1.14 -0.31 0.00 -2.23 0.00 0.00 60.65 59.10 2ju8 s ILE 35 Cb 0.04 -3.94 -0.10 0.00 -1.58 0.00 0.00 42.46 36.89 2ju8 s ILE 35 CO 0.72 0.03 1.93 0.29 -1.23 0.00 0.00 174.94 176.68 2ju8 n LYS 36 N 5.69 2.77 -1.58 2.79 4.76 -1.26 -4.84 118.16 126.49 2ju8 n LYS 36 Ca -0.01 1.01 -0.31 0.00 -2.87 0.00 0.00 58.31 56.14 2ju8 n LYS 36 Cb 0.49 -2.94 0.05 0.00 -1.84 0.00 0.00 35.03 30.79 2ju8 n LYS 36 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2ju8 s GLY 37 N 3.95 1.75 -0.04 0.72 0.00 -1.26 -4.83 107.32 107.61 2ju8 s GLY 37 Ca 0.88 0.18 0.06 0.00 0.00 0.00 0.00 44.72 45.84 2ju8 s GLY 37 CO 0.42 0.50 -0.22 0.14 0.00 0.00 0.00 173.10 173.95 2ju8 s VAL 38 N -2.90 1.76 -0.04 1.40 1.01 -1.19 -1.63 120.40 118.82 2ju8 s VAL 38 Ca 0.60 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.67 2ju8 s VAL 38 Cb -0.15 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.76 2ju8 s VAL 38 CO 0.52 0.50 -0.04 -0.94 0.00 0.00 0.00 175.10 175.14 2ju8 s SER 39 N -0.19 0.77 -0.05 3.32 1.04 -0.69 -2.50 113.70 115.40 2ju8 s SER 39 Ca -0.01 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.33 2ju8 s SER 39 Cb -0.12 -0.36 0.02 0.00 0.10 0.00 0.00 66.02 65.67 2ju8 s SER 39 CO 0.02 -0.05 -0.03 -0.70 0.98 0.00 0.00 173.24 173.46 2ju8 s GLU 40 N 0.81 0.75 -0.17 4.02 2.12 -0.65 -0.86 118.70 124.72 2ju8 s GLU 40 Ca -0.10 -0.03 -0.02 0.00 0.36 0.00 0.00 54.97 55.18 2ju8 s GLU 40 Cb -0.13 -0.89 -0.01 0.00 0.26 0.00 0.00 34.13 33.36 2ju8 s GLU 40 CO -0.00 -0.16 -0.09 0.42 -0.54 0.00 0.00 175.26 174.89 2ju8 s ILE 41 N 1.27 3.20 -0.31 -3.70 1.01 -1.03 -1.56 121.20 120.09 2ju8 s ILE 41 Ca -0.05 -0.58 -0.08 0.00 0.00 0.00 0.00 60.65 59.93 2ju8 s ILE 41 Cb -0.14 -2.40 0.00 0.00 0.01 0.00 0.00 42.46 39.94 2ju8 s ILE 41 CO -0.02 0.48 0.12 -0.69 0.00 0.00 0.00 174.94 174.83 2ju8 s VAL 42 N 0.88 4.25 -0.31 2.92 1.01 -0.38 -2.86 120.40 125.91 2ju8 s VAL 42 Ca -0.02 -0.61 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 2ju8 s VAL 42 Cb -0.15 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.01 2ju8 s VAL 42 CO 0.00 0.05 0.20 -2.28 0.00 0.00 0.00 175.10 173.07 2ju8 s HIS 43 N 1.55 3.21 -0.28 5.22 5.04 -1.26 -1.85 115.29 126.92 2ju8 s HIS 43 Ca 0.03 -0.24 -0.03 0.00 -1.54 0.00 0.00 55.06 53.28 2ju8 s HIS 43 Cb -0.17 -2.41 0.09 0.00 0.04 0.00 0.00 32.58 30.13 2ju8 s HIS 43 CO 0.04 -0.34 0.11 -2.00 -2.34 0.00 0.00 174.74 170.22 2ju8 s GLU 44 N 1.70 0.34 4.10 2.88 -6.30 -1.00 -4.96 118.70 115.46 2ju8 s GLU 44 Ca 0.06 -0.61 0.00 0.00 -2.50 0.00 0.00 54.97 51.92 2ju8 s GLU 44 Cb -0.17 -1.50 0.00 0.00 0.00 0.00 0.00 34.13 32.46 2ju8 s GLU 44 CO 0.09 -0.95 0.00 0.41 0.02 0.00 0.00 175.26 174.83 2ju8 n GLY 45 N 5.14 0.55 0.01 -1.50 0.00 -1.26 -0.48 105.19 107.65 2ju8 n GLY 45 Ca -0.05 0.61 0.01 0.00 0.00 0.00 0.00 46.02 46.59 2ju8 n GLY 45 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2ju8 n LYS 46 N 0.00 5.65 -3.28 1.61 2.85 -1.26 -4.96 118.16 118.77 2ju8 n LYS 46 Ca 0.00 -0.06 -0.43 0.00 -1.05 0.00 0.00 58.31 56.77 2ju8 n LYS 46 Cb 0.00 -0.64 -0.08 0.00 -0.65 0.00 0.00 35.03 33.66 2ju8 n LYS 46 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2ju8 s LYS 47 N -1.11 3.23 -0.09 -1.58 1.02 0.37 -2.02 119.74 119.56 2ju8 s LYS 47 Ca 0.01 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.43 2ju8 s LYS 47 Cb 0.02 -3.93 -0.02 0.00 -0.52 0.00 0.00 37.83 33.38 2ju8 s LYS 47 CO 0.08 -0.82 -0.16 0.08 -0.92 0.00 0.00 175.35 173.61 2ju8 s VAL 48 N 2.27 2.86 -0.11 3.17 1.01 -0.78 -2.37 120.40 126.45 2ju8 s VAL 48 Ca 0.15 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.36 2ju8 s VAL 48 Cb -0.16 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 2ju8 s VAL 48 CO 0.14 0.55 -0.10 -0.54 0.00 0.00 0.00 175.10 175.16 2ju8 s LYS 49 N -0.03 3.22 -0.15 2.72 1.02 -0.77 -1.29 119.74 124.46 2ju8 s LYS 49 Ca -0.04 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.33 2ju8 s LYS 49 Cb -0.14 -2.66 -0.01 0.00 -0.52 0.00 0.00 37.83 34.50 2ju8 s LYS 49 CO 0.04 0.36 -0.15 -1.17 -0.92 0.00 0.00 175.35 173.52 2ju8 s LEU 50 N -0.01 2.54 -0.13 3.17 0.20 -0.35 -1.25 118.68 122.86 2ju8 s LEU 50 Ca -0.02 -0.43 0.03 0.00 0.69 0.00 0.00 54.13 54.40 2ju8 s LEU 50 Cb -0.14 -1.58 0.00 0.00 -0.43 0.00 0.00 46.19 44.05 2ju8 s LEU 50 CO 0.03 0.11 -0.21 -0.89 -0.29 0.00 0.00 176.35 175.10 2ju8 s THR 51 N 0.69 2.24 -0.06 3.68 2.01 -0.60 -1.25 115.64 122.35 2ju8 s THR 51 Ca -0.07 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 61.03 2ju8 s THR 51 Cb -0.16 -1.89 0.00 0.00 0.01 0.00 0.00 72.50 70.47 2ju8 s THR 51 CO 0.02 0.55 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.70 2ju8 s ILE 52 N 0.59 1.38 -0.10 1.82 -1.09 -0.09 -1.64 121.20 122.07 2ju8 s ILE 52 Ca -0.12 -0.66 0.03 0.00 -2.23 0.00 0.00 60.65 57.67 2ju8 s ILE 52 Cb -0.16 -1.21 -0.01 0.00 -1.58 0.00 0.00 42.46 39.50 2ju8 s ILE 52 CO 0.03 0.40 -0.20 -0.89 -1.23 0.00 0.00 174.94 173.05 2ju8 s THR 53 N 0.27 2.39 -0.27 2.92 2.01 -1.04 -0.68 115.64 121.25 2ju8 s THR 53 Ca -0.09 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.03 2ju8 s THR 53 Cb -0.13 -1.94 0.07 0.00 0.01 0.00 0.00 72.50 70.50 2ju8 s THR 53 CO 0.03 0.55 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.13 2ju8 s TYR 54 N 0.27 3.15 0.00 4.92 2.02 -0.59 -3.14 117.35 123.98 2ju8 s TYR 54 Ca -0.14 -2.31 0.00 0.00 -0.37 0.00 0.00 57.07 54.25 2ju8 s TYR 54 Cb -0.17 -2.00 0.00 0.00 -0.40 0.00 0.00 41.96 39.39 2ju8 s TYR 54 CO 0.07 -0.87 0.00 0.41 -1.57 0.00 0.00 175.55 173.59 2ju8 n GLY 55 N 4.46 1.15 0.25 0.71 0.00 -1.26 -1.67 105.19 108.83 2ju8 n GLY 55 Ca -0.11 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2ju8 n GLY 55 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ju8 n SER 56 N 3.37 0.00 -4.49 1.61 3.41 -1.26 -5.07 113.62 111.19 2ju8 n SER 56 Ca 0.00 -1.50 -0.34 0.00 -0.26 0.00 0.00 58.87 56.78 2ju8 n SER 56 Cb 0.00 -0.10 -0.12 0.00 -0.26 0.00 0.00 64.21 63.73 2ju8 n SER 56 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2ju8 s LYS 57 N -0.00 3.60 -0.17 4.33 2.20 -0.67 -5.10 119.74 123.92 2ju8 s LYS 57 Ca 0.00 -0.54 -0.11 0.00 -0.36 0.00 0.00 55.97 54.96 2ju8 s LYS 57 Cb 0.00 -2.86 -0.05 0.00 -1.51 0.00 0.00 37.83 33.41 2ju8 s LYS 57 CO 0.00 0.26 0.18 0.54 -0.36 0.00 0.00 175.35 175.97 2ju8 s VAL 58 N 0.30 5.39 -0.21 4.02 0.11 -1.26 -1.55 120.40 127.20 2ju8 s VAL 58 Ca -0.04 0.30 0.02 0.00 -2.93 0.00 0.00 61.98 59.32 2ju8 s VAL 58 Cb -0.14 -3.51 0.04 0.00 -1.53 0.00 0.00 36.38 31.24 2ju8 s VAL 58 CO 0.03 0.45 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.47 2ju8 s ILE 59 N 0.17 2.03 -0.15 7.04 1.01 0.15 -5.01 121.20 126.44 2ju8 s ILE 59 Ca 0.11 -1.17 -0.01 0.00 0.00 0.00 0.00 60.65 59.58 2ju8 s ILE 59 Cb -0.12 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.37 2ju8 s ILE 59 CO 0.01 0.30 -0.11 -2.28 0.00 0.00 0.00 174.94 172.86 2ju8 s HIS 60 N 1.25 2.86 0.12 3.97 2.46 -1.26 -0.91 115.29 123.78 2ju8 s HIS 60 Ca -0.00 -0.65 0.02 0.00 0.47 0.00 0.00 55.06 54.89 2ju8 s HIS 60 Cb -0.16 -1.90 -0.04 0.00 -0.13 0.00 0.00 32.58 30.35 2ju8 s HIS 60 CO -0.10 -0.24 -0.05 -0.80 -2.47 0.00 0.00 174.74 171.09 2ju8 s ASN 61 N 0.51 1.18 -0.06 9.88 0.02 -0.38 -5.02 114.94 121.07 2ju8 s ASN 61 Ca -0.07 -1.06 -0.06 0.00 -1.02 0.00 0.00 52.86 50.65 2ju8 s ASN 61 Cb -0.15 0.10 0.02 0.00 0.02 0.00 0.00 41.25 41.23 2ju8 s ASN 61 CO 0.04 -0.49 0.17 -1.83 0.02 0.00 0.00 177.10 175.00 2ju8 s GLU 62 N -3.85 0.19 0.01 -0.60 -1.05 -1.26 -1.21 118.70 110.92 2ju8 s GLU 62 Ca 0.16 0.23 -0.12 0.00 -0.15 0.00 0.00 54.97 55.09 2ju8 s GLU 62 Cb 0.05 0.09 0.02 0.00 -0.44 0.00 0.00 34.13 33.85 2ju8 s GLU 62 CO -0.02 -0.02 0.26 -0.59 0.95 0.00 0.00 175.26 175.83 2ju8 s PHE 63 N 0.10 -0.09 -0.18 4.83 -0.12 -0.41 -4.92 117.98 117.20 2ju8 s PHE 63 Ca -0.00 0.04 -0.08 0.00 -0.05 0.00 0.00 56.93 56.84 2ju8 s PHE 63 Cb -0.01 0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.38 2ju8 s PHE 63 CO 0.00 -0.40 0.08 0.99 -0.05 0.00 0.00 175.22 175.84 2ju8 s THR 64 N -1.79 4.95 0.25 -4.49 2.01 -1.26 -1.86 115.64 113.45 2ju8 s THR 64 Ca -0.11 0.02 -0.30 0.00 0.31 0.00 0.00 61.69 61.62 2ju8 s THR 64 Cb -0.04 -3.23 -0.09 0.00 0.01 0.00 0.00 72.50 69.15 2ju8 s THR 64 CO 0.01 0.47 1.26 -0.76 -0.69 0.00 0.00 174.62 174.91 2ju8 s LEU 65 N 0.27 4.45 -0.36 4.42 1.43 -0.85 -2.83 118.68 125.20 2ju8 s LEU 65 Ca 0.05 2.44 0.00 0.00 -1.03 0.00 0.00 54.13 55.59 2ju8 s LEU 65 Cb -0.12 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.48 2ju8 s LEU 65 CO -0.00 -0.44 0.00 0.61 0.23 0.00 0.00 176.35 176.74 2ju8 n GLY 66 N 1.73 0.62 3.15 -3.19 0.00 -0.51 -5.00 105.19 101.99 2ju8 n GLY 66 Ca 0.03 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.54 2ju8 n GLY 66 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ju8 s GLU 67 N -1.62 0.44 -0.18 1.61 0.41 -1.13 -5.03 118.70 113.20 2ju8 s GLU 67 Ca 0.00 -0.04 -0.29 0.00 -0.41 0.00 0.00 54.97 54.23 2ju8 s GLU 67 Cb 0.00 0.20 -0.01 0.00 -1.78 0.00 0.00 34.13 32.54 2ju8 s GLU 67 CO 0.00 -0.10 1.20 -2.00 -0.49 0.00 0.00 175.26 173.87 2ju8 s GLU 68 N -0.73 4.24 0.14 1.61 2.12 -1.26 -4.06 118.70 120.76 2ju8 s GLU 68 Ca -0.08 1.57 0.10 0.00 0.36 0.00 0.00 54.97 56.93 2ju8 s GLU 68 Cb -0.05 -3.73 -0.04 0.00 0.26 0.00 0.00 34.13 30.57 2ju8 s GLU 68 CO 0.02 -0.69 -0.23 0.00 -0.54 0.00 0.00 175.26 173.82 2ju8 s GLU 70 N -2.24 3.95 0.08 0.00 2.12 -1.26 -1.51 118.70 119.84 2ju8 s GLU 70 Ca 0.17 -0.23 0.10 0.00 0.36 0.00 0.00 54.97 55.37 2ju8 s GLU 70 Cb -0.10 -3.66 -0.03 0.00 0.26 0.00 0.00 34.13 30.60 2ju8 s GLU 70 CO 0.08 -0.22 -0.27 -1.17 -0.54 0.00 0.00 175.26 173.15 2ju8 s LEU 71 N 1.85 2.23 -0.14 2.70 2.96 0.23 -4.93 118.68 123.57 2ju8 s LEU 71 Ca 0.09 -0.65 -0.25 0.00 -0.22 0.00 0.00 54.13 53.11 2ju8 s LEU 71 Cb -0.16 -1.27 -0.02 0.00 0.50 0.00 0.00 46.19 45.24 2ju8 s LEU 71 CO 0.11 0.23 0.79 -0.70 -1.32 0.00 0.00 176.35 175.46 2ju8 s GLU 72 N -1.55 4.33 0.92 1.98 2.12 -1.26 -2.02 118.70 123.22 2ju8 s GLU 72 Ca 0.13 0.96 -0.13 0.00 0.36 0.00 0.00 54.97 56.29 2ju8 s GLU 72 Cb -0.10 -3.54 0.15 0.00 0.26 0.00 0.00 34.13 30.89 2ju8 s GLU 72 CO 0.04 -0.23 1.14 0.95 -0.54 0.00 0.00 175.26 176.62 2ju8 s THR 73 N 1.81 1.98 -0.60 -1.70 -4.23 -0.45 -4.90 115.64 107.55 2ju8 s THR 73 Ca 0.38 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 61.07 2ju8 s THR 73 Cb -0.17 -2.75 0.19 0.00 1.34 0.00 0.00 72.50 71.11 2ju8 s THR 73 CO 0.14 0.00 1.57 1.15 -0.54 0.00 0.00 174.62 176.94 2ju8 n MET 74 N -3.80 0.12 0.06 3.99 0.00 -1.26 -1.67 117.12 114.56 2ju8 n MET 74 Ca 0.07 0.43 0.09 0.00 0.00 0.00 0.00 57.70 58.29 2ju8 n MET 74 Cb 0.59 -1.76 -0.06 0.00 0.00 0.00 0.00 33.22 31.99 2ju8 n MET 74 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2ju8 n THR 75 N -1.99 0.59 0.00 3.17 -2.24 -1.26 -4.96 114.28 107.58 2ju8 n THR 75 Ca 0.01 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2ju8 n THR 75 Cb 0.15 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 2ju8 n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ju8 n GLY 76 N 1.26 1.00 3.82 3.38 0.00 -0.67 -5.10 105.19 108.89 2ju8 n GLY 76 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 2ju8 n GLY 76 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ju8 s GLU 77 N -0.69 4.09 -0.22 1.61 2.12 -1.26 -4.80 118.70 119.55 2ju8 s GLU 77 Ca 0.00 0.61 -0.23 0.00 0.36 0.00 0.00 54.97 55.71 2ju8 s GLU 77 Cb 0.00 -3.15 -0.01 0.00 0.26 0.00 0.00 34.13 31.22 2ju8 s GLU 77 CO 0.00 0.61 0.74 0.15 -0.54 0.00 0.00 175.26 176.22 2ju8 s LYS 78 N -1.33 4.19 0.10 4.30 -0.14 -1.26 -1.35 119.74 124.25 2ju8 s LYS 78 Ca 0.30 0.80 0.08 0.00 -1.36 0.00 0.00 55.97 55.79 2ju8 s LYS 78 Cb -0.18 -3.62 -0.03 0.00 -1.68 0.00 0.00 37.83 32.32 2ju8 s LYS 78 CO 0.18 -0.41 -0.20 0.14 -0.76 0.00 0.00 175.35 174.30 2ju8 s VAL 79 N 2.47 1.67 -0.11 3.17 -7.23 -0.85 -4.98 120.40 114.53 2ju8 s VAL 79 Ca 0.32 -1.54 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 2ju8 s VAL 79 Cb -0.16 -1.53 -0.02 0.00 0.56 0.00 0.00 36.38 35.23 2ju8 s VAL 79 CO 0.09 -0.08 -0.12 -0.54 -0.31 0.00 0.00 175.10 174.13 2ju8 s LYS 80 N -1.93 3.18 -0.06 4.82 1.02 -1.26 -0.60 119.74 124.91 2ju8 s LYS 80 Ca 0.06 -0.67 -0.08 0.00 0.02 0.00 0.00 55.97 55.30 2ju8 s LYS 80 Cb -0.10 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.63 2ju8 s LYS 80 CO 0.04 0.33 0.21 0.00 -0.92 0.00 0.00 175.35 175.01 2ju8 s ALA 81 N 0.05 -0.52 -0.30 5.17 0.00 -0.57 -4.17 121.76 121.42 2ju8 s ALA 81 Ca -0.04 0.42 -0.13 0.00 0.00 0.00 0.00 51.96 52.21 2ju8 s ALA 81 Cb -0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 2ju8 s ALA 81 CO 0.04 -0.14 0.28 0.08 0.00 0.00 0.00 175.76 176.02 2ju8 s VAL 82 N -0.37 5.24 -0.24 0.00 1.01 -1.14 -2.00 120.40 122.90 2ju8 s VAL 82 Ca -0.05 0.15 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 2ju8 s VAL 82 Cb -0.03 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 2ju8 s VAL 82 CO 0.01 0.10 0.01 0.54 0.00 0.00 0.00 175.10 175.76 2ju8 s VAL 83 N 1.88 3.77 0.15 2.92 0.11 -1.26 -2.99 120.40 124.98 2ju8 s VAL 83 Ca 0.10 -0.39 0.10 0.00 -2.93 0.00 0.00 61.98 58.85 2ju8 s VAL 83 Cb -0.16 -2.76 -0.04 0.00 -1.53 0.00 0.00 36.38 31.89 2ju8 s VAL 83 CO 0.11 0.36 -0.21 -0.54 -3.33 0.00 0.00 175.10 171.49 2ju8 s LYS 84 N 1.53 1.64 -0.05 1.54 1.02 -0.54 -1.43 119.74 123.46 2ju8 s LYS 84 Ca 0.06 -1.32 0.04 0.00 0.02 0.00 0.00 55.97 54.77 2ju8 s LYS 84 Cb -0.15 -1.99 -0.02 0.00 -0.52 0.00 0.00 37.83 35.15 2ju8 s LYS 84 CO -0.00 0.45 -0.17 0.00 -0.92 0.00 0.00 175.35 174.71 2ju8 s MET 85 N -2.32 2.48 -0.01 1.68 0.23 -1.26 -2.73 119.30 117.36 2ju8 s MET 85 Ca 0.18 -0.75 0.15 0.00 -1.03 0.00 0.00 55.69 54.25 2ju8 s MET 85 Cb -0.10 -2.32 -0.21 0.00 -1.53 0.00 0.00 34.83 30.68 2ju8 s MET 85 CO 0.09 0.58 0.47 -1.91 -2.03 0.00 0.00 175.02 172.23 2ju8 n GLU 86 N 2.42 1.13 -1.47 3.16 4.07 -0.89 -4.98 120.64 124.08 2ju8 n GLU 86 Ca -0.17 -0.08 -0.16 0.00 -0.06 0.00 0.00 57.16 56.69 2ju8 n GLU 86 Cb 0.52 -1.30 -0.07 0.00 -0.06 0.00 0.00 31.44 30.53 2ju8 n GLU 86 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2ju8 n GLY 87 N 1.50 1.58 2.53 8.31 0.00 -1.26 -4.89 105.19 112.97 2ju8 n GLY 87 Ca -0.00 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 2ju8 n GLY 87 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ju8 n ASP 88 N -1.07 -1.73 -0.78 1.61 8.00 -1.26 -4.34 116.55 116.97 2ju8 n ASP 88 Ca -0.16 -2.82 -0.08 0.00 0.71 0.00 0.00 54.79 52.44 2ju8 n ASP 88 Cb 0.60 0.64 -0.03 0.00 -0.02 0.00 0.00 41.12 42.31 2ju8 n ASP 88 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2ju8 n ASN 89 N 2.25 -3.94 -3.89 -2.24 3.02 -0.75 -4.84 115.26 104.86 2ju8 n ASN 89 Ca 0.20 0.20 -0.19 0.00 -0.03 0.00 0.00 54.58 54.75 2ju8 n ASN 89 Cb 0.55 -3.08 -0.16 0.00 -0.61 0.00 0.00 39.78 36.48 2ju8 n ASN 89 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2ju8 s LYS 90 N -2.39 0.73 -0.05 3.52 1.02 -1.26 -2.81 119.74 118.50 2ju8 s LYS 90 Ca 0.00 -0.09 -0.02 0.00 0.02 0.00 0.00 55.97 55.88 2ju8 s LYS 90 Cb 0.00 -0.75 0.04 0.00 -0.52 0.00 0.00 37.83 36.59 2ju8 s LYS 90 CO 0.00 -0.07 0.09 -1.64 -0.92 0.00 0.00 175.35 172.81 2ju8 s MET 91 N 0.83 -0.01 -0.23 1.68 -1.94 0.96 -2.10 119.30 118.49 2ju8 s MET 91 Ca -0.11 0.38 -0.04 0.00 -1.71 0.00 0.00 55.69 54.21 2ju8 s MET 91 Cb -0.14 -0.33 -0.00 0.00 2.01 0.00 0.00 34.83 36.37 2ju8 s MET 91 CO 0.00 -0.26 -0.03 0.08 -0.01 0.00 0.00 175.02 174.80 2ju8 s VAL 92 N 1.77 3.37 -0.09 -6.03 1.01 -1.11 -1.73 120.40 117.59 2ju8 s VAL 92 Ca -0.01 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 2ju8 s VAL 92 Cb -0.12 -2.58 0.03 0.00 0.00 0.00 0.00 36.38 33.71 2ju8 s VAL 92 CO -0.04 0.36 -0.01 0.28 0.00 0.00 0.00 175.10 175.68 2ju8 s THR 93 N 1.46 0.52 -0.12 3.92 -1.32 -1.10 -1.46 115.64 117.54 2ju8 s THR 93 Ca 0.05 0.01 0.03 0.00 -1.21 0.00 0.00 61.69 60.57 2ju8 s THR 93 Cb -0.15 -0.66 0.00 0.00 -1.51 0.00 0.00 72.50 70.18 2ju8 s THR 93 CO -0.03 0.26 -0.22 -0.89 -2.21 0.00 0.00 174.62 171.53 2ju8 s THR 94 N 1.91 2.15 -0.03 5.08 2.01 -1.16 -2.91 115.64 122.68 2ju8 s THR 94 Ca 0.05 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 61.08 2ju8 s THR 94 Cb -0.12 -1.84 0.02 0.00 0.01 0.00 0.00 72.50 70.57 2ju8 s THR 94 CO -0.06 0.55 -0.03 0.72 -0.69 0.00 0.00 174.62 175.11 2ju8 s PHE 95 N 0.50 0.55 0.00 4.92 -0.71 -1.22 -2.90 117.98 119.11 2ju8 s PHE 95 Ca -0.14 -0.11 0.00 0.00 -1.04 0.00 0.00 56.93 55.63 2ju8 s PHE 95 Cb -0.17 -0.52 0.00 0.00 -1.21 0.00 0.00 43.02 41.12 2ju8 s PHE 95 CO 0.05 -0.14 0.00 1.63 -1.34 0.00 0.00 175.22 175.42 2ju8 n LYS 96 N 3.90 0.00 0.00 1.99 4.76 -1.26 -1.57 118.16 125.99 2ju8 n LYS 96 Ca -0.24 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.20 2ju8 n LYS 96 Cb 0.52 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.71 2ju8 n LYS 96 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ju8 n GLY 97 N 0.00 0.77 3.79 0.72 0.00 -1.26 -5.11 105.19 104.10 2ju8 n GLY 97 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2ju8 n GLY 97 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ju8 s ILE 98 N 0.00 4.91 -0.27 -0.61 1.09 -0.61 -5.06 121.20 120.65 2ju8 s ILE 98 Ca 0.00 1.12 -0.13 0.00 -1.10 0.00 0.00 60.65 60.54 2ju8 s ILE 98 Cb 0.00 -3.87 -0.04 0.00 -1.06 0.00 0.00 42.46 37.49 2ju8 s ILE 98 CO 0.00 0.48 0.30 -0.75 -0.10 0.00 0.00 174.94 174.87 2ju8 s LYS 99 N -0.54 4.00 -0.16 2.79 2.36 -1.26 -3.42 119.74 123.51 2ju8 s LYS 99 Ca 0.28 -0.10 0.01 0.00 -2.55 0.00 0.00 55.97 53.62 2ju8 s LYS 99 Cb -0.18 -3.65 0.02 0.00 -1.05 0.00 0.00 37.83 32.97 2ju8 s LYS 99 CO 0.16 -0.22 -0.18 -1.12 1.55 0.00 0.00 175.35 175.54 2ju8 s SER 100 N 1.64 2.92 -0.16 1.43 0.01 -1.15 -2.93 113.70 115.46 2ju8 s SER 100 Ca 0.12 -0.57 0.02 0.00 1.31 0.00 0.00 55.95 56.83 2ju8 s SER 100 Cb -0.16 -1.34 0.01 0.00 0.21 0.00 0.00 66.02 64.75 2ju8 s SER 100 CO 0.10 -0.00 -0.21 -0.69 0.41 0.00 0.00 173.24 172.85 2ju8 s VAL 101 N 1.26 2.05 -0.14 3.43 1.01 -0.67 -2.71 120.40 124.62 2ju8 s VAL 101 Ca 0.02 -0.95 -0.00 0.00 0.00 0.00 0.00 61.98 61.05 2ju8 s VAL 101 Cb -0.13 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 2ju8 s VAL 101 CO -0.10 0.54 -0.13 -0.89 0.00 0.00 0.00 175.10 174.53 2ju8 s THR 102 N 1.05 3.00 -0.27 3.92 2.01 -0.71 -0.45 115.64 124.20 2ju8 s THR 102 Ca -0.01 -0.67 -0.14 0.00 0.31 0.00 0.00 61.69 61.17 2ju8 s THR 102 Cb -0.14 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 2ju8 s THR 102 CO -0.07 0.52 0.34 -0.70 -0.69 0.00 0.00 174.62 174.01 2ju8 s GLU 103 N 0.48 4.01 -0.32 4.92 2.12 -0.16 -0.03 118.70 129.71 2ju8 s GLU 103 Ca -0.09 -0.02 -0.17 0.00 0.36 0.00 0.00 54.97 55.05 2ju8 s GLU 103 Cb -0.16 -3.65 -0.01 0.00 0.26 0.00 0.00 34.13 30.57 2ju8 s GLU 103 CO 0.04 -0.24 0.44 0.12 -0.54 0.00 0.00 175.26 175.09 2ju8 s PHE 104 N 1.96 3.21 0.14 5.30 2.19 -1.12 -2.93 117.98 126.72 2ju8 s PHE 104 Ca 0.14 0.21 0.08 0.00 0.33 0.00 0.00 56.93 57.68 2ju8 s PHE 104 Cb -0.16 -2.77 -0.04 0.00 -1.31 0.00 0.00 43.02 38.75 2ju8 s PHE 104 CO 0.10 -0.43 -0.19 -0.80 1.83 0.00 0.00 175.22 175.73 2ju8 s ASN 105 N 1.71 2.57 -0.05 6.13 0.02 -1.24 -1.81 114.94 122.26 2ju8 s ASN 105 Ca 0.16 -0.79 0.02 0.00 -1.02 0.00 0.00 52.86 51.23 2ju8 s ASN 105 Cb -0.16 -0.14 0.13 0.00 0.02 0.00 0.00 41.25 41.10 2ju8 s ASN 105 CO 0.12 -0.01 0.86 0.61 0.02 0.00 0.00 177.10 178.71 2ju8 n GLY 106 N 0.63 1.98 1.01 0.66 0.00 -1.26 -3.97 105.19 104.25 2ju8 n GLY 106 Ca -0.16 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2ju8 n GLY 106 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ju8 n ASP 107 N 0.15 0.00 -3.73 1.61 9.92 -1.26 -5.00 116.55 118.24 2ju8 n ASP 107 Ca 0.07 0.00 -0.16 0.00 -0.53 0.00 0.00 54.79 54.16 2ju8 n ASP 107 Cb 0.51 0.08 -0.16 0.00 -0.64 0.00 0.00 41.12 40.91 2ju8 n ASP 107 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2ju8 s THR 108 N -1.51 -0.08 -0.26 -3.53 2.01 -1.25 -2.45 115.64 108.56 2ju8 s THR 108 Ca 0.00 0.28 -0.10 0.00 0.31 0.00 0.00 61.69 62.19 2ju8 s THR 108 Cb 0.00 -0.13 -0.04 0.00 0.01 0.00 0.00 72.50 72.34 2ju8 s THR 108 CO 0.00 0.12 0.14 -0.63 -0.69 0.00 0.00 174.62 173.56 2ju8 s ILE 109 N 1.46 4.95 -0.04 1.82 1.09 -0.89 -3.73 121.20 125.87 2ju8 s ILE 109 Ca -0.04 0.05 0.05 0.00 -1.10 0.00 0.00 60.65 59.60 2ju8 s ILE 109 Cb -0.13 -3.34 -0.02 0.00 -1.06 0.00 0.00 42.46 37.91 2ju8 s ILE 109 CO -0.03 0.30 -0.18 -0.89 -0.10 0.00 0.00 174.94 174.03 2ju8 s THR 110 N 1.60 2.76 0.01 2.92 2.01 -1.15 -2.85 115.64 120.93 2ju8 s THR 110 Ca 0.07 -0.84 0.07 0.00 0.31 0.00 0.00 61.69 61.30 2ju8 s THR 110 Cb -0.15 -2.05 -0.02 0.00 0.01 0.00 0.00 72.50 70.29 2ju8 s THR 110 CO 0.08 0.59 -0.21 0.21 -0.69 0.00 0.00 174.62 174.59 2ju8 s ASN 111 N -0.68 2.48 -0.17 3.53 3.04 -1.15 -0.99 114.94 121.00 2ju8 s ASN 111 Ca 0.11 -0.44 0.00 0.00 0.04 0.00 0.00 52.86 52.57 2ju8 s ASN 111 Cb -0.11 -0.25 0.01 0.00 -1.54 0.00 0.00 41.25 39.36 2ju8 s ASN 111 CO 0.00 0.22 -0.17 -0.89 -3.04 0.00 0.00 177.10 173.22 2ju8 s THR 112 N -0.61 2.45 -0.14 -5.21 2.01 0.40 -2.59 115.64 111.94 2ju8 s THR 112 Ca 0.08 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.25 2ju8 s THR 112 Cb -0.08 -2.03 0.02 0.00 0.01 0.00 0.00 72.50 70.42 2ju8 s THR 112 CO 0.00 0.52 -0.14 -0.04 -0.69 0.00 0.00 174.62 174.27 2ju8 s MET 113 N 1.02 2.27 -0.20 4.92 -1.94 0.12 -1.68 119.30 123.81 2ju8 s MET 113 Ca -0.02 -0.55 -0.03 0.00 -1.71 0.00 0.00 55.69 53.39 2ju8 s MET 113 Cb -0.15 -2.07 -0.00 0.00 2.01 0.00 0.00 34.83 34.62 2ju8 s MET 113 CO -0.04 -0.21 -0.08 0.99 -0.01 0.00 0.00 175.02 175.66 2ju8 s THR 114 N 1.42 3.11 -0.14 2.05 2.01 -1.15 -0.95 115.64 122.00 2ju8 s THR 114 Ca 0.03 -0.59 -0.04 0.00 0.31 0.00 0.00 61.69 61.40 2ju8 s THR 114 Cb -0.13 -2.39 0.07 0.00 0.01 0.00 0.00 72.50 70.06 2ju8 s THR 114 CO -0.09 0.46 0.20 -0.22 -0.69 0.00 0.00 174.62 174.28 2ju8 s LEU 115 N 1.28 -0.12 -1.00 4.42 1.98 -0.93 -4.09 118.68 120.21 2ju8 s LEU 115 Ca 0.03 0.15 -0.04 0.00 -2.89 0.00 0.00 54.13 51.38 2ju8 s LEU 115 Cb -0.14 0.39 0.00 0.00 0.66 0.00 0.00 46.19 47.10 2ju8 s LEU 115 CO -0.04 -0.28 0.86 0.61 -1.89 0.00 0.00 176.35 175.61 2ju8 n GLY 116 N 5.33 -0.19 3.30 7.98 0.00 -1.26 -2.06 105.19 118.29 2ju8 n GLY 116 Ca -0.05 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2ju8 n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ju8 n ASP 117 N -2.22 -1.58 -4.79 1.61 9.92 -1.26 -4.96 116.55 113.27 2ju8 n ASP 117 Ca -0.08 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 53.79 2ju8 n ASP 117 Cb 0.58 -1.83 -0.06 0.00 -0.64 0.00 0.00 41.12 39.17 2ju8 n ASP 117 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2ju8 s ILE 118 N -1.88 4.79 -0.28 0.53 1.01 -0.87 -5.06 121.20 119.44 2ju8 s ILE 118 Ca 0.00 1.26 -0.07 0.00 0.00 0.00 0.00 60.65 61.84 2ju8 s ILE 118 Cb 0.00 -3.93 -0.00 0.00 0.01 0.00 0.00 42.46 38.54 2ju8 s ILE 118 CO 0.00 0.49 0.08 -0.69 0.00 0.00 0.00 174.94 174.82 2ju8 s VAL 119 N -0.71 4.09 -0.23 2.92 1.01 -1.26 -2.19 120.40 124.03 2ju8 s VAL 119 Ca 0.30 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 2ju8 s VAL 119 Cb -0.19 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.15 2ju8 s VAL 119 CO 0.19 0.17 -0.06 -0.47 0.00 0.00 0.00 175.10 174.93 2ju8 s TYR 120 N 1.54 2.97 -0.07 5.22 6.14 -0.12 -4.38 117.35 128.65 2ju8 s TYR 120 Ca 0.04 -1.16 0.02 0.00 0.64 0.00 0.00 57.07 56.61 2ju8 s TYR 120 Cb -0.16 -2.08 0.01 0.00 0.42 0.00 0.00 41.96 40.15 2ju8 s TYR 120 CO 0.03 -0.62 -0.13 0.21 0.64 0.00 0.00 175.55 175.68 2ju8 s LYS 121 N 1.42 1.80 -0.13 4.97 2.20 -1.25 -0.71 119.74 128.05 2ju8 s LYS 121 Ca 0.04 -0.44 -0.04 0.00 -0.36 0.00 0.00 55.97 55.17 2ju8 s LYS 121 Cb -0.15 -1.49 -0.03 0.00 -1.51 0.00 0.00 37.83 34.66 2ju8 s LYS 121 CO -0.04 0.02 -0.01 -0.98 -0.36 0.00 0.00 175.35 173.98 2ju8 s ARG 122 N 0.69 3.46 -0.22 4.03 1.70 -1.07 -2.55 118.95 125.00 2ju8 s ARG 122 Ca -0.14 -0.45 -0.03 0.00 -0.47 0.00 0.00 55.73 54.64 2ju8 s ARG 122 Cb -0.16 -2.92 -0.00 0.00 -0.57 0.00 0.00 34.95 31.30 2ju8 s ARG 122 CO 0.03 0.42 -0.06 0.08 -1.08 0.00 0.00 175.30 174.70 2ju8 s VAL 123 N -0.11 3.25 0.00 4.99 1.01 -1.03 -2.95 120.40 125.57 2ju8 s VAL 123 Ca 0.04 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.51 2ju8 s VAL 123 Cb -0.13 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.76 2ju8 s VAL 123 CO 0.02 0.42 -0.11 -0.94 0.00 0.00 0.00 175.10 174.49 2ju8 s SER 124 N 1.46 1.32 0.06 3.32 1.04 -1.13 -1.47 113.70 118.30 2ju8 s SER 124 Ca 0.06 -0.25 0.02 0.00 0.48 0.00 0.00 55.95 56.26 2ju8 s SER 124 Cb -0.14 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 2ju8 s SER 124 CO -0.04 0.10 0.07 -1.59 0.98 0.00 0.00 173.24 172.76 2ju8 s LYS 125 N -0.46 2.88 -0.12 4.02 -2.85 -0.69 -2.09 119.74 120.44 2ju8 s LYS 125 Ca 0.03 -0.66 -0.25 0.00 -1.00 0.00 0.00 55.97 54.09 2ju8 s LYS 125 Cb -0.05 -2.73 -0.02 0.00 -2.06 0.00 0.00 37.83 32.97 2ju8 s LYS 125 CO -0.00 0.58 0.80 0.50 0.10 0.00 0.00 175.35 177.33 2ju8 s ARG 126 N -2.20 4.37 0.00 1.78 3.52 -1.03 -1.62 118.95 123.78 2ju8 s ARG 126 Ca 0.27 1.01 0.04 0.00 -0.13 0.00 0.00 55.73 56.92 2ju8 s ARG 126 Cb -0.12 -3.52 0.03 0.00 -1.56 0.00 0.00 34.95 29.78 2ju8 s ARG 126 CO 0.19 -0.17 0.64 0.44 -0.81 0.00 0.00 175.30 175.59