#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 6.45 0.00 7.83 4.22 -1.26 -4.84 114.94 127.34 2ju8 s ASN 2 Ca 0.00 0.54 0.00 0.00 -2.14 0.00 0.00 52.86 51.26 2ju8 s ASN 2 Cb 0.00 -2.25 0.00 0.00 1.28 0.00 0.00 41.25 40.28 2ju8 s ASN 2 CO 0.00 -0.14 0.00 0.49 -2.04 0.00 0.00 177.10 175.41 2ju8 n PHE 3 N 4.74 0.00 -3.56 1.54 3.72 -1.26 -5.03 117.46 117.61 2ju8 n PHE 3 Ca -0.07 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 56.96 2ju8 n PHE 3 Cb 0.51 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.98 2ju8 n PHE 3 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2ju8 s SER 4 N -2.29 6.61 0.00 4.37 0.15 -1.26 -4.68 113.70 116.60 2ju8 s SER 4 Ca 0.00 0.72 0.00 0.00 0.70 0.00 0.00 55.95 57.37 2ju8 s SER 4 Cb 0.00 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 2ju8 s SER 4 CO 0.00 0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.29 2ju8 n GLY 5 N 2.46 3.00 3.83 9.45 0.00 -1.11 -5.02 105.19 117.81 2ju8 n GLY 5 Ca -0.14 -0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 2ju8 n GLY 5 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ju8 s LYS 6 N -1.52 3.89 0.09 1.61 -2.85 -1.26 -3.02 119.74 116.68 2ju8 s LYS 6 Ca 0.00 0.33 0.06 0.00 -1.00 0.00 0.00 55.97 55.36 2ju8 s LYS 6 Cb 0.00 -3.23 -0.03 0.00 -2.06 0.00 0.00 37.83 32.50 2ju8 s LYS 6 CO 0.00 0.66 -0.17 0.71 0.10 0.00 0.00 175.35 176.65 2ju8 s TYR 7 N -0.94 1.46 -0.16 1.78 2.02 0.61 -1.61 117.35 120.51 2ju8 s TYR 7 Ca 0.22 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.48 2ju8 s TYR 7 Cb -0.16 -0.81 0.01 0.00 -0.40 0.00 0.00 41.96 40.60 2ju8 s TYR 7 CO 0.12 0.12 -0.18 -1.14 -1.57 0.00 0.00 175.55 172.90 2ju8 s GLN 8 N -1.86 3.11 0.17 -0.62 2.00 -0.42 -1.12 119.66 120.91 2ju8 s GLN 8 Ca 0.02 -0.80 -0.30 0.00 -2.00 0.00 0.00 55.36 52.28 2ju8 s GLN 8 Cb -0.10 -2.57 -0.08 0.00 0.80 0.00 0.00 33.01 31.06 2ju8 s GLN 8 CO 0.03 -0.06 1.25 0.08 -0.50 0.00 0.00 175.29 176.09 2ju8 s VAL 9 N 0.97 3.48 -0.17 1.34 1.01 -0.51 -1.39 120.40 125.14 2ju8 s VAL 9 Ca -0.03 1.20 0.04 0.00 0.00 0.00 0.00 61.98 63.19 2ju8 s VAL 9 Cb -0.15 -3.76 -0.13 0.00 0.00 0.00 0.00 36.38 32.34 2ju8 s VAL 9 CO -0.04 0.17 -0.11 0.00 0.00 0.00 0.00 175.10 175.11 2ju8 n GLN 10 N 2.85 0.72 -3.83 2.72 6.02 -0.33 -3.88 117.38 121.65 2ju8 n GLN 10 Ca 0.06 0.08 -0.09 0.00 -0.01 0.00 0.00 57.00 57.04 2ju8 n GLN 10 Cb 0.44 -1.35 -0.03 0.00 1.02 0.00 0.00 30.24 30.31 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 -5.49 -0.23 0.04 1.08 0.15 -1.26 -4.94 113.70 103.05 2ju8 s SER 11 Ca -0.20 -0.61 -0.08 0.00 0.70 0.00 0.00 55.95 55.75 2ju8 s SER 11 Cb 0.06 0.64 -0.00 0.00 -1.71 0.00 0.00 66.02 65.00 2ju8 s SER 11 CO 0.44 -1.18 0.17 -1.58 1.20 0.00 0.00 173.24 172.29 2ju8 s GLN 12 N -3.92 0.67 -0.08 5.44 -0.44 -1.26 -2.98 119.66 117.09 2ju8 s GLN 12 Ca 0.13 -0.68 0.02 0.00 -2.50 0.00 0.00 55.36 52.33 2ju8 s GLN 12 Cb -0.03 0.27 -0.02 0.00 -1.64 0.00 0.00 33.01 31.59 2ju8 s GLN 12 CO 0.03 -0.19 -0.13 -1.21 0.50 0.00 0.00 175.29 174.29 2ju8 s GLU 13 N -2.62 2.80 0.15 1.67 2.02 -1.19 -4.96 118.70 116.57 2ju8 s GLU 13 Ca -0.05 -0.68 0.00 0.00 0.02 0.00 0.00 54.97 54.26 2ju8 s GLU 13 Cb -0.01 -2.48 0.00 0.00 0.10 0.00 0.00 34.13 31.75 2ju8 s GLU 13 CO -0.04 0.50 0.00 0.09 0.02 0.00 0.00 175.26 175.83 2ju8 n ASN 14 N 2.68 -6.93 0.08 -0.19 3.02 -1.26 -4.10 115.26 108.56 2ju8 n ASN 14 Ca -0.18 0.97 0.00 0.00 -0.03 0.00 0.00 54.58 55.34 2ju8 n ASN 14 Cb 0.52 -3.84 0.00 0.00 -0.61 0.00 0.00 39.78 35.85 2ju8 n ASN 14 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2ju8 n PHE 15 N 1.29 -1.08 -0.23 3.10 3.01 -1.26 -4.76 117.46 117.53 2ju8 n PHE 15 Ca 0.00 0.19 0.03 0.00 1.01 0.00 0.00 57.45 58.69 2ju8 n PHE 15 Cb 0.00 0.29 0.14 0.00 -0.01 0.00 0.00 39.48 39.90 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 0.14 -0.94 -1.08 5.08 -1.97 0.05 114.58 115.85 2ju8 h GLU 16 Ca 0.00 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2ju8 h GLU 16 Cb 0.00 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.16 2ju8 h GLU 16 CO 0.00 0.09 0.61 -1.35 -1.00 0.00 0.00 179.01 177.36 2ju8 h PRO 17 N 0.14 1.11 0.21 2.33 0.11 -2.00 -2.04 132.00 131.87 2ju8 h PRO 17 Ca 0.38 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.41 2ju8 h PRO 17 Cb 0.64 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 31.50 2ju8 h PRO 17 CO -0.57 0.74 -0.10 0.35 -0.21 0.00 0.00 178.00 178.20 2ju8 h PHE 18 N 1.15 -0.26 -0.76 0.65 3.57 -1.31 -1.04 116.94 118.95 2ju8 h PHE 18 Ca 0.39 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.90 2ju8 h PHE 18 Cb 0.07 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 2ju8 h PHE 18 CO -0.01 -0.02 0.50 0.00 -2.23 0.00 0.00 178.31 176.55 2ju8 h MET 19 N -0.46 0.98 -0.18 1.11 -0.00 -1.26 0.26 114.93 115.37 2ju8 h MET 19 Ca -0.03 -0.06 -0.08 0.00 -0.00 0.00 0.00 59.70 59.53 2ju8 h MET 19 Cb 0.35 -0.22 -0.00 0.00 -0.00 0.00 0.00 31.60 31.73 2ju8 h MET 19 CO 0.05 0.65 -0.20 0.87 -0.00 0.00 0.00 176.91 178.27 2ju8 h LYS 20 N 1.01 0.45 0.00 -0.10 1.57 -1.28 -0.62 116.57 117.60 2ju8 h LYS 20 Ca 0.28 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2ju8 h LYS 20 Cb -0.08 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2ju8 h LYS 20 CO -0.07 0.82 0.00 0.00 -0.57 0.00 0.00 179.45 179.63 2ju8 n ALA 21 N -2.45 -0.09 -0.35 3.86 0.00 -0.40 -4.05 120.51 117.03 2ju8 n ALA 21 Ca -0.06 0.00 0.25 0.00 0.00 0.00 0.00 53.44 53.63 2ju8 n ALA 21 Cb 0.40 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.38 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 0.33 0.00 0.00 1.85 -1.14 -3.45 114.93 112.52 2ju8 h MET 22 Ca 0.00 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.07 2ju8 h MET 22 Cb 0.00 -0.08 0.00 0.00 0.43 0.00 0.00 31.60 31.95 2ju8 h MET 22 CO 0.00 0.22 0.00 0.41 -0.40 0.00 0.00 176.91 177.14 2ju8 n GLY 23 N -1.45 1.28 3.79 1.39 0.00 -0.85 -5.06 105.19 104.29 2ju8 n GLY 23 Ca 0.28 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.96 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 3.87 -0.11 0.99 2.96 -0.30 -4.95 118.68 121.13 2ju8 s LEU 24 Ca 0.00 1.98 -0.27 0.00 -0.22 0.00 0.00 54.13 55.61 2ju8 s LEU 24 Cb 0.00 -4.52 -0.02 0.00 0.50 0.00 0.00 46.19 42.15 2ju8 s LEU 24 CO 0.00 -0.81 0.90 -2.84 -1.32 0.00 0.00 176.35 172.28 2ju8 s PRO 25 N -3.16 4.40 0.45 0.98 0.02 -1.26 -4.17 135.00 132.26 2ju8 s PRO 25 Ca 0.67 1.19 0.20 0.00 0.02 0.00 0.00 61.00 63.08 2ju8 s PRO 25 Cb -0.18 -3.53 1.18 0.00 0.02 0.00 0.00 34.50 31.99 2ju8 s PRO 25 CO 0.22 -0.24 1.89 1.05 -0.33 0.00 0.00 177.00 179.59 2ju8 h GLU 26 N 7.10 0.29 -0.30 5.54 4.11 -1.95 -0.37 114.58 129.01 2ju8 h GLU 26 Ca -0.33 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.09 2ju8 h GLU 26 Cb 1.16 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2ju8 h GLU 26 CO 0.82 0.19 0.19 -0.44 0.07 0.00 0.00 179.01 179.84 2ju8 h ASP 27 N 0.30 0.35 -0.40 3.06 5.19 -2.01 -2.14 116.42 120.77 2ju8 h ASP 27 Ca 0.41 -0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 56.74 2ju8 h ASP 27 Cb 1.15 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.55 2ju8 h ASP 27 CO -0.11 0.27 0.09 -0.07 -3.12 0.00 0.00 179.24 176.30 2ju8 h LEU 28 N 0.40 0.67 -0.23 1.55 4.07 -1.50 -2.84 115.31 117.43 2ju8 h LEU 28 Ca 0.11 -0.12 0.03 0.00 0.08 0.00 0.00 57.88 57.98 2ju8 h LEU 28 Cb -0.02 -0.18 -0.03 0.00 1.08 0.00 0.00 40.66 41.51 2ju8 h LEU 28 CO -0.02 0.68 0.05 0.40 -1.08 0.00 0.00 178.44 178.48 2ju8 h ILE 29 N 0.70 0.91 -0.70 1.22 2.04 -0.77 0.26 117.51 121.17 2ju8 h ILE 29 Ca 0.15 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.97 2ju8 h ILE 29 Cb 0.29 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2ju8 h ILE 29 CO 0.00 0.03 0.45 1.56 0.00 0.00 0.00 178.15 180.19 2ju8 h GLN 30 N 0.15 0.93 -0.08 2.37 1.08 -1.20 0.11 115.11 118.47 2ju8 h GLN 30 Ca 0.10 -0.07 -0.10 0.00 -1.45 0.00 0.00 58.65 57.13 2ju8 h GLN 30 Cb 0.09 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 2ju8 h GLN 30 CO -0.13 0.64 -0.41 0.87 -0.95 0.00 0.00 178.83 178.85 2ju8 h LYS 31 N 0.95 0.17 0.09 1.46 6.56 -1.26 -2.38 116.57 122.16 2ju8 h LYS 31 Ca 0.25 -0.08 -0.26 0.00 -1.06 0.00 0.00 60.65 59.51 2ju8 h LYS 31 Cb -0.08 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.57 2ju8 h LYS 31 CO -0.05 0.56 -1.18 0.78 -2.06 0.00 0.00 179.45 177.49 2ju8 h GLY 32 N 1.23 0.21 2.00 3.86 0.00 -0.36 -3.23 103.07 106.77 2ju8 h GLY 32 Ca 0.01 -0.54 -0.14 0.00 0.00 0.00 0.00 47.33 46.66 2ju8 h GLY 32 CO 0.06 0.48 -0.65 0.07 0.00 0.00 0.00 176.54 176.50 2ju8 h LYS 33 N 0.05 0.00 0.00 4.80 2.10 -0.76 -3.17 116.57 119.60 2ju8 h LYS 33 Ca -0.10 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.47 2ju8 h LYS 33 Cb 1.91 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 33.23 2ju8 h LYS 33 CO 0.18 0.65 -0.39 0.22 -2.00 0.00 0.00 179.45 178.11 2ju8 h ASP 34 N 0.00 0.00 -3.34 7.07 1.82 -1.51 -3.42 116.42 117.04 2ju8 h ASP 34 Ca -0.01 0.00 -0.66 0.00 -0.39 0.00 0.00 57.03 55.98 2ju8 h ASP 34 Cb 1.37 0.00 -0.27 0.00 0.68 0.00 0.00 39.33 41.10 2ju8 h ASP 34 CO 0.08 0.39 -0.74 -0.63 -1.61 0.00 0.00 179.24 176.73 2ju8 s ILE 35 N -3.46 3.21 -0.22 2.25 1.01 -1.20 -5.06 121.20 117.73 2ju8 s ILE 35 Ca 0.01 -0.57 -0.28 0.00 0.00 0.00 0.00 60.65 59.81 2ju8 s ILE 35 Cb 0.10 -2.41 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 2ju8 s ILE 35 CO 0.69 0.47 2.18 -1.59 0.00 0.00 0.00 174.94 176.70 2ju8 s LYS 36 N 0.98 3.17 1.16 2.79 -2.85 -1.26 -4.83 119.74 118.90 2ju8 s LYS 36 Ca -0.01 2.00 -0.16 0.00 -1.00 0.00 0.00 55.97 56.80 2ju8 s LYS 36 Cb -0.15 -4.35 0.26 0.00 -2.06 0.00 0.00 37.83 31.53 2ju8 s LYS 36 CO -0.00 -2.05 1.07 0.20 0.10 0.00 0.00 175.35 174.66 2ju8 s GLY 37 N 8.02 1.55 0.01 0.59 0.00 -1.25 -4.77 107.32 111.46 2ju8 s GLY 37 Ca 0.99 -0.62 0.03 0.00 0.00 0.00 0.00 44.72 45.11 2ju8 s GLY 37 CO 0.35 0.16 -0.10 0.54 0.00 0.00 0.00 173.10 174.05 2ju8 s VAL 38 N -2.84 0.76 -0.06 1.40 0.11 -1.19 -1.42 120.40 117.17 2ju8 s VAL 38 Ca 0.68 -0.60 -0.01 0.00 -2.93 0.00 0.00 61.98 59.12 2ju8 s VAL 38 Cb -0.15 -0.68 0.03 0.00 -1.53 0.00 0.00 36.38 34.04 2ju8 s VAL 38 CO 0.58 0.08 -0.00 -0.94 -3.33 0.00 0.00 175.10 171.49 2ju8 s SER 39 N -0.59 1.30 0.02 3.54 1.04 -0.28 -2.75 113.70 115.98 2ju8 s SER 39 Ca 0.01 -0.07 0.07 0.00 0.48 0.00 0.00 55.95 56.44 2ju8 s SER 39 Cb -0.05 -0.40 -0.02 0.00 0.10 0.00 0.00 66.02 65.65 2ju8 s SER 39 CO 0.00 -0.16 -0.20 -0.70 0.98 0.00 0.00 173.24 173.16 2ju8 s GLU 40 N 1.67 1.43 -0.13 4.02 2.12 -0.41 -0.29 118.70 127.11 2ju8 s GLU 40 Ca 0.00 -0.85 -0.00 0.00 0.36 0.00 0.00 54.97 54.48 2ju8 s GLU 40 Cb -0.13 -1.49 0.02 0.00 0.26 0.00 0.00 34.13 32.80 2ju8 s GLU 40 CO -0.04 0.39 -0.11 0.42 -0.54 0.00 0.00 175.26 175.38 2ju8 s ILE 41 N -0.69 1.30 -0.30 -3.70 1.01 -1.17 -2.12 121.20 115.54 2ju8 s ILE 41 Ca 0.07 -0.49 -0.07 0.00 0.00 0.00 0.00 60.65 60.17 2ju8 s ILE 41 Cb -0.08 -1.28 0.01 0.00 0.01 0.00 0.00 42.46 41.12 2ju8 s ILE 41 CO 0.01 0.39 0.08 -0.69 0.00 0.00 0.00 174.94 174.73 2ju8 s VAL 42 N 1.59 3.96 -0.32 2.92 1.01 -0.72 -2.74 120.40 126.10 2ju8 s VAL 42 Ca 0.05 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 2ju8 s VAL 42 Cb -0.13 -3.05 -0.00 0.00 0.00 0.00 0.00 36.38 33.20 2ju8 s VAL 42 CO -0.09 0.07 0.17 -2.28 0.00 0.00 0.00 175.10 172.97 2ju8 s HIS 43 N 1.50 3.19 -0.24 5.22 5.04 -1.26 -1.22 115.29 127.52 2ju8 s HIS 43 Ca 0.02 -0.55 -0.04 0.00 -1.54 0.00 0.00 55.06 52.95 2ju8 s HIS 43 Cb -0.17 -2.39 0.08 0.00 0.04 0.00 0.00 32.58 30.14 2ju8 s HIS 43 CO 0.02 -0.46 0.11 -1.21 -2.34 0.00 0.00 174.74 170.86 2ju8 s GLU 44 N 1.63 0.23 -1.11 2.88 0.41 -0.52 -4.93 118.70 117.29 2ju8 s GLU 44 Ca 0.05 -0.41 -0.19 0.00 -0.41 0.00 0.00 54.97 54.00 2ju8 s GLU 44 Cb -0.17 -1.54 -0.01 0.00 -1.78 0.00 0.00 34.13 30.63 2ju8 s GLU 44 CO 0.07 -0.87 0.79 0.41 -0.49 0.00 0.00 175.26 175.18 2ju8 n GLY 45 N 5.21 -1.02 4.48 -1.39 0.00 -1.26 -1.08 105.19 110.13 2ju8 n GLY 45 Ca -0.06 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2ju8 n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ju8 n LYS 46 N -4.03 0.00 -3.03 1.61 5.02 -1.26 -4.91 118.16 111.56 2ju8 n LYS 46 Ca -0.09 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.76 2ju8 n LYS 46 Cb 0.59 -2.42 -0.06 0.00 -0.02 0.00 0.00 35.03 33.12 2ju8 n LYS 46 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2ju8 s LYS 47 N 0.00 3.29 -0.08 1.97 3.01 -0.24 -2.68 119.74 125.02 2ju8 s LYS 47 Ca 0.00 -0.38 -0.02 0.00 -1.01 0.00 0.00 55.97 54.56 2ju8 s LYS 47 Cb 0.00 -3.99 -0.03 0.00 -1.01 0.00 0.00 37.83 32.79 2ju8 s LYS 47 CO 0.00 -1.17 0.01 0.08 0.51 0.00 0.00 175.35 174.79 2ju8 s VAL 48 N 3.12 4.40 -0.12 3.17 1.01 -0.83 -1.44 120.40 129.71 2ju8 s VAL 48 Ca 0.25 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.01 2ju8 s VAL 48 Cb -0.14 -2.87 -0.00 0.00 0.00 0.00 0.00 36.38 33.37 2ju8 s VAL 48 CO 0.19 0.58 -0.21 -0.54 0.00 0.00 0.00 175.10 175.12 2ju8 s LYS 49 N -0.97 3.12 -0.18 2.72 1.02 -0.36 -1.93 119.74 123.17 2ju8 s LYS 49 Ca 0.14 -0.82 -0.06 0.00 0.02 0.00 0.00 55.97 55.25 2ju8 s LYS 49 Cb -0.11 -2.43 -0.03 0.00 -0.52 0.00 0.00 37.83 34.73 2ju8 s LYS 49 CO 0.03 0.12 0.02 -1.17 -0.92 0.00 0.00 175.35 173.44 2ju8 s LEU 50 N 0.51 3.53 -0.10 3.17 1.98 -0.39 -1.76 118.68 125.62 2ju8 s LEU 50 Ca -0.13 -0.04 0.02 0.00 -2.89 0.00 0.00 54.13 51.08 2ju8 s LEU 50 Cb -0.17 -1.88 0.01 0.00 0.66 0.00 0.00 46.19 44.82 2ju8 s LEU 50 CO 0.05 0.15 -0.15 -0.89 -1.89 0.00 0.00 176.35 173.62 2ju8 s THR 51 N 0.52 1.44 -0.02 3.68 2.01 -0.90 -1.59 115.64 120.77 2ju8 s THR 51 Ca 0.00 -0.62 0.03 0.00 0.31 0.00 0.00 61.69 61.42 2ju8 s THR 51 Cb -0.13 -1.32 -0.00 0.00 0.01 0.00 0.00 72.50 71.06 2ju8 s THR 51 CO 0.02 0.43 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.64 2ju8 s ILE 52 N 0.93 0.87 -0.11 1.82 1.01 -0.19 -1.29 121.20 124.24 2ju8 s ILE 52 Ca -0.08 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.17 2ju8 s ILE 52 Cb -0.15 -0.76 -0.00 0.00 0.01 0.00 0.00 42.46 41.56 2ju8 s ILE 52 CO -0.00 0.26 -0.21 -0.89 0.00 0.00 0.00 174.94 174.10 2ju8 s THR 53 N 0.06 2.36 -0.26 2.92 2.01 -1.11 -0.84 115.64 120.77 2ju8 s THR 53 Ca -0.01 -0.91 0.02 0.00 0.31 0.00 0.00 61.69 61.10 2ju8 s THR 53 Cb -0.08 -1.93 0.06 0.00 0.01 0.00 0.00 72.50 70.57 2ju8 s THR 53 CO 0.00 0.55 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.09 2ju8 s TYR 54 N 0.33 3.08 0.00 4.92 2.02 -0.71 -3.16 117.35 123.84 2ju8 s TYR 54 Ca -0.16 -2.24 0.00 0.00 -0.37 0.00 0.00 57.07 54.29 2ju8 s TYR 54 Cb -0.17 -1.93 0.00 0.00 -0.40 0.00 0.00 41.96 39.46 2ju8 s TYR 54 CO 0.08 -0.86 0.00 0.41 -1.57 0.00 0.00 175.55 173.61 2ju8 n GLY 55 N 4.48 1.17 0.41 0.71 0.00 -1.26 -1.65 105.19 109.05 2ju8 n GLY 55 Ca -0.12 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2ju8 n GLY 55 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ju8 n SER 56 N 3.32 0.00 -4.52 1.61 2.88 -1.26 -5.09 113.62 110.56 2ju8 n SER 56 Ca 0.00 -1.71 -0.34 0.00 -1.33 0.00 0.00 58.87 55.49 2ju8 n SER 56 Cb 0.00 -0.14 -0.12 0.00 -0.75 0.00 0.00 64.21 63.20 2ju8 n SER 56 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2ju8 s LYS 57 N 0.00 3.01 -0.21 -1.46 2.20 -0.66 -5.11 119.74 117.53 2ju8 s LYS 57 Ca 0.00 -0.58 -0.07 0.00 -0.36 0.00 0.00 55.97 54.96 2ju8 s LYS 57 Cb 0.00 -2.64 -0.04 0.00 -1.51 0.00 0.00 37.83 33.64 2ju8 s LYS 57 CO 0.00 0.50 0.06 0.08 -0.36 0.00 0.00 175.35 175.63 2ju8 s VAL 58 N -0.38 4.56 -0.22 4.02 1.01 -1.26 -1.74 120.40 126.39 2ju8 s VAL 58 Ca 0.05 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 61.94 2ju8 s VAL 58 Cb -0.12 -3.08 0.03 0.00 0.00 0.00 0.00 36.38 33.21 2ju8 s VAL 58 CO 0.02 0.41 -0.15 -0.63 0.00 0.00 0.00 175.10 174.76 2ju8 s ILE 59 N 0.83 2.23 0.02 2.22 1.01 -0.02 -5.02 121.20 122.48 2ju8 s ILE 59 Ca 0.03 -1.18 0.08 0.00 0.00 0.00 0.00 60.65 59.58 2ju8 s ILE 59 Cb -0.14 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 2ju8 s ILE 59 CO 0.02 0.30 -0.24 -1.38 0.00 0.00 0.00 174.94 173.64 2ju8 s HIS 60 N 1.23 2.39 -0.01 3.97 -3.43 -1.26 -1.03 115.29 117.15 2ju8 s HIS 60 Ca -0.00 -0.37 -0.14 0.00 -0.80 0.00 0.00 55.06 53.74 2ju8 s HIS 60 Cb -0.16 -1.45 0.02 0.00 -1.43 0.00 0.00 32.58 29.57 2ju8 s HIS 60 CO -0.09 0.12 0.29 -0.80 -2.00 0.00 0.00 174.74 172.26 2ju8 s ASN 61 N -1.10 -0.17 -0.05 7.38 0.01 -0.62 -4.96 114.94 115.42 2ju8 s ASN 61 Ca 0.12 0.07 0.04 0.00 -0.71 0.00 0.00 52.86 52.38 2ju8 s ASN 61 Cb -0.10 0.31 -0.00 0.00 0.41 0.00 0.00 41.25 41.86 2ju8 s ASN 61 CO 0.02 -0.44 -0.18 -1.61 -1.51 0.00 0.00 177.10 173.39 2ju8 s GLU 62 N -1.31 1.90 0.01 -0.60 2.02 -1.26 -1.26 118.70 118.19 2ju8 s GLU 62 Ca -0.13 -0.63 -0.13 0.00 0.02 0.00 0.00 54.97 54.09 2ju8 s GLU 62 Cb -0.05 -1.62 0.02 0.00 0.10 0.00 0.00 34.13 32.57 2ju8 s GLU 62 CO 0.04 0.23 0.28 -0.59 0.02 0.00 0.00 175.26 175.24 2ju8 s PHE 63 N 0.09 -0.12 -0.15 1.61 -0.12 -0.81 -4.79 117.98 113.68 2ju8 s PHE 63 Ca -0.05 0.11 -0.04 0.00 -0.05 0.00 0.00 56.93 56.89 2ju8 s PHE 63 Cb -0.12 0.07 -0.03 0.00 -0.63 0.00 0.00 43.02 42.31 2ju8 s PHE 63 CO 0.03 -0.41 -0.01 0.99 -0.05 0.00 0.00 175.22 175.77 2ju8 s THR 64 N -1.73 4.14 0.88 -4.49 2.01 -1.26 -1.96 115.64 113.23 2ju8 s THR 64 Ca -0.11 -0.27 -0.12 0.00 0.31 0.00 0.00 61.69 61.50 2ju8 s THR 64 Cb -0.04 -2.82 0.11 0.00 0.01 0.00 0.00 72.50 69.76 2ju8 s THR 64 CO 0.02 0.50 1.07 0.00 -0.69 0.00 0.00 174.62 175.52 2ju8 n LEU 65 N 3.36 3.26 -3.33 4.42 -0.00 -1.09 -2.91 117.00 120.71 2ju8 n LEU 65 Ca -0.17 0.47 -0.22 0.00 -0.00 0.00 0.00 56.01 56.09 2ju8 n LEU 65 Cb 0.53 -1.45 -0.01 0.00 -0.00 0.00 0.00 43.42 42.48 2ju8 n LEU 65 CO 0.33 -2.19 -0.05 0.61 -0.00 0.00 0.00 177.39 176.09 2ju8 n GLY 66 N 0.53 -0.48 3.60 1.47 0.00 -0.06 -4.91 105.19 105.35 2ju8 n GLY 66 Ca 0.12 0.07 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 2ju8 n GLY 66 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ju8 s GLU 67 N -5.96 0.82 -0.17 1.61 2.56 -1.15 -5.04 118.70 111.37 2ju8 s GLU 67 Ca 0.38 0.71 -0.29 0.00 0.00 0.00 0.00 54.97 55.76 2ju8 s GLU 67 Cb -0.20 0.39 -0.01 0.00 2.00 0.00 0.00 34.13 36.31 2ju8 s GLU 67 CO 0.46 -0.15 1.26 -2.00 -0.56 0.00 0.00 175.26 174.27 2ju8 s GLU 68 N -0.10 4.23 0.23 4.30 2.12 -1.26 -3.96 118.70 124.27 2ju8 s GLU 68 Ca -0.02 1.66 0.11 0.00 0.36 0.00 0.00 54.97 57.08 2ju8 s GLU 68 Cb -0.04 -3.76 -0.05 0.00 0.26 0.00 0.00 34.13 30.54 2ju8 s GLU 68 CO 0.02 -0.71 -0.19 0.00 -0.54 0.00 0.00 175.26 173.84 2ju8 s GLU 70 N -3.12 3.58 0.08 0.00 2.12 -1.26 -1.18 118.70 118.92 2ju8 s GLU 70 Ca 0.26 -0.52 0.09 0.00 0.36 0.00 0.00 54.97 55.17 2ju8 s GLU 70 Cb -0.07 -3.22 -0.03 0.00 0.26 0.00 0.00 34.13 31.07 2ju8 s GLU 70 CO 0.13 -0.17 -0.25 -0.48 -0.54 0.00 0.00 175.26 173.96 2ju8 s LEU 71 N 1.51 2.34 -0.02 2.70 2.34 -0.50 -4.93 118.68 122.12 2ju8 s LEU 71 Ca 0.06 -0.61 -0.25 0.00 0.06 0.00 0.00 54.13 53.38 2ju8 s LEU 71 Cb -0.15 -1.33 -0.04 0.00 -0.56 0.00 0.00 46.19 44.12 2ju8 s LEU 71 CO 0.02 0.23 0.78 -0.70 -1.06 0.00 0.00 176.35 175.61 2ju8 s GLU 72 N -1.62 4.48 0.69 1.48 2.12 -1.26 -2.28 118.70 122.31 2ju8 s GLU 72 Ca 0.13 1.06 0.01 0.00 0.36 0.00 0.00 54.97 56.53 2ju8 s GLU 72 Cb -0.10 -3.42 0.12 0.00 0.26 0.00 0.00 34.13 30.98 2ju8 s GLU 72 CO 0.05 0.11 0.95 0.95 -0.54 0.00 0.00 175.26 176.77 2ju8 s THR 73 N 0.58 2.17 0.35 -1.70 -4.23 -0.94 -4.97 115.64 106.90 2ju8 s THR 73 Ca 0.41 -0.66 0.20 0.00 -1.18 0.00 0.00 61.69 60.46 2ju8 s THR 73 Cb -0.19 -2.51 0.19 0.00 1.34 0.00 0.00 72.50 71.33 2ju8 s THR 73 CO 0.22 0.00 1.92 0.00 -0.54 0.00 0.00 174.62 176.22 2ju8 h MET 74 N -0.38 0.00 0.00 3.99 -0.00 -1.97 -1.80 114.93 114.76 2ju8 h MET 74 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.34 2ju8 h MET 74 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.87 2ju8 h MET 74 CO 0.41 0.25 0.00 0.25 -0.00 0.00 0.00 176.91 177.82 2ju8 n THR 75 N -3.80 0.04 0.00 -0.10 -2.24 -1.26 -4.87 114.28 102.04 2ju8 n THR 75 Ca -0.01 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ju8 n THR 75 Cb 0.35 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 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 1.11 2.48 3.76 3.38 0.00 -0.68 -5.01 105.19 110.23 2ju8 n GLY 76 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.33 4.66 -0.18 1.61 2.12 -1.26 -4.70 118.70 120.61 2ju8 s GLU 77 Ca 0.00 1.73 -0.19 0.00 0.36 0.00 0.00 54.97 56.87 2ju8 s GLU 77 Cb 0.00 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 31.18 2ju8 s GLU 77 CO 0.00 0.25 0.54 0.15 -0.54 0.00 0.00 175.26 175.67 2ju8 s LYS 78 N -1.45 4.24 0.08 4.30 -0.14 -1.26 -2.21 119.74 123.29 2ju8 s LYS 78 Ca 0.44 0.48 0.09 0.00 -1.36 0.00 0.00 55.97 55.63 2ju8 s LYS 78 Cb -0.30 -3.54 -0.03 0.00 -1.68 0.00 0.00 37.83 32.28 2ju8 s LYS 78 CO 0.39 -0.10 -0.24 0.14 -0.76 0.00 0.00 175.35 174.77 2ju8 s VAL 79 N 1.46 2.01 -0.11 3.17 -7.23 -0.97 -4.98 120.40 113.75 2ju8 s VAL 79 Ca 0.26 -1.50 -0.03 0.00 -1.81 0.00 0.00 61.98 58.89 2ju8 s VAL 79 Cb -0.16 -1.76 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 2ju8 s VAL 79 CO 0.10 0.16 0.01 -0.54 -0.31 0.00 0.00 175.10 174.53 2ju8 s LYS 80 N -1.62 3.29 -0.06 4.82 1.02 -1.26 -1.41 119.74 124.51 2ju8 s LYS 80 Ca 0.11 -0.41 -0.09 0.00 0.02 0.00 0.00 55.97 55.60 2ju8 s LYS 80 Cb -0.10 -2.90 0.02 0.00 -0.52 0.00 0.00 37.83 34.33 2ju8 s LYS 80 CO 0.04 0.56 0.23 0.00 -0.92 0.00 0.00 175.35 175.25 2ju8 s ALA 81 N -0.47 -0.56 -0.34 5.17 0.00 -0.32 -4.50 121.76 120.73 2ju8 s ALA 81 Ca 0.09 0.46 -0.13 0.00 0.00 0.00 0.00 51.96 52.37 2ju8 s ALA 81 Cb -0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 2ju8 s ALA 81 CO 0.02 -0.15 0.26 0.08 0.00 0.00 0.00 175.76 175.97 2ju8 s VAL 82 N -0.38 5.27 -0.22 0.00 1.01 -1.18 -1.68 120.40 123.22 2ju8 s VAL 82 Ca -0.05 -0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.67 2ju8 s VAL 82 Cb -0.03 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 2ju8 s VAL 82 CO 0.01 -0.04 0.03 0.54 0.00 0.00 0.00 175.10 175.65 2ju8 s VAL 83 N 1.76 4.14 0.06 2.92 0.11 -1.25 -2.90 120.40 125.24 2ju8 s VAL 83 Ca 0.07 -0.24 0.03 0.00 -2.93 0.00 0.00 61.98 58.91 2ju8 s VAL 83 Cb -0.17 -2.90 -0.03 0.00 -1.53 0.00 0.00 36.38 31.75 2ju8 s VAL 83 CO 0.11 0.39 -0.09 -0.54 -3.33 0.00 0.00 175.10 171.64 2ju8 s LYS 84 N 1.23 0.67 -0.05 1.54 1.02 -0.78 -0.88 119.74 122.50 2ju8 s LYS 84 Ca 0.04 -0.91 -0.14 0.00 0.02 0.00 0.00 55.97 54.97 2ju8 s LYS 84 Cb -0.15 -0.43 -0.05 0.00 -0.52 0.00 0.00 37.83 36.68 2ju8 s LYS 84 CO 0.02 0.08 0.37 0.00 -0.92 0.00 0.00 175.35 174.90 2ju8 s MET 85 N -2.01 3.95 -0.01 1.68 0.23 -1.26 -1.56 119.30 120.33 2ju8 s MET 85 Ca -0.04 0.31 0.21 0.00 -1.03 0.00 0.00 55.69 55.14 2ju8 s MET 85 Cb -0.08 -3.27 -0.25 0.00 -1.53 0.00 0.00 34.83 29.71 2ju8 s MET 85 CO 0.00 0.59 0.80 -1.91 -2.03 0.00 0.00 175.02 172.48 2ju8 n GLU 86 N 2.25 0.19 0.00 3.16 4.07 0.04 -4.81 120.64 125.54 2ju8 n GLU 86 Ca -0.14 -0.04 0.00 0.00 -0.06 0.00 0.00 57.16 56.92 2ju8 n GLU 86 Cb 0.52 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.41 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 1.45 2.07 7.00 8.31 0.00 0.47 -4.85 105.19 119.64 2ju8 n GLY 87 Ca 0.02 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 0.00 0.00 1.61 9.92 -1.26 -1.76 116.55 125.06 2ju8 n ASP 88 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2ju8 n ASP 88 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2ju8 n ASP 88 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 2ju8 n ASN 89 N 2.19 0.00 -3.95 -2.24 0.23 0.16 -3.28 115.26 108.37 2ju8 n ASN 89 Ca 0.00 0.00 -0.26 0.00 -0.53 0.00 0.00 54.58 53.79 2ju8 n ASN 89 Cb 0.00 0.00 -0.17 0.00 -2.08 0.00 0.00 39.78 37.53 2ju8 n ASN 89 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2ju8 s LYS 90 N -1.21 1.64 -0.02 -3.83 -0.14 -0.72 -2.50 119.74 112.96 2ju8 s LYS 90 Ca 0.00 -0.33 0.00 0.00 -1.36 0.00 0.00 55.97 54.28 2ju8 s LYS 90 Cb 0.00 -1.57 0.03 0.00 -1.68 0.00 0.00 37.83 34.61 2ju8 s LYS 90 CO 0.00 -0.17 0.02 -1.64 -0.76 0.00 0.00 175.35 172.81 2ju8 s MET 91 N 1.34 0.04 -0.23 1.68 -1.94 -0.54 -0.40 119.30 119.25 2ju8 s MET 91 Ca -0.02 0.16 -0.04 0.00 -1.71 0.00 0.00 55.69 54.09 2ju8 s MET 91 Cb -0.14 -0.30 0.00 0.00 2.01 0.00 0.00 34.83 36.40 2ju8 s MET 91 CO -0.04 -0.16 -0.04 0.08 -0.01 0.00 0.00 175.02 174.85 2ju8 s VAL 92 N 1.06 3.30 -0.04 -6.03 1.01 -0.60 -2.70 120.40 116.40 2ju8 s VAL 92 Ca -0.09 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.25 2ju8 s VAL 92 Cb -0.13 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.71 2ju8 s VAL 92 CO -0.03 0.33 -0.04 0.28 0.00 0.00 0.00 175.10 175.65 2ju8 s THR 93 N 1.44 0.51 -0.09 3.92 -1.32 -1.14 -1.86 115.64 117.10 2ju8 s THR 93 Ca 0.04 -0.10 0.03 0.00 -1.21 0.00 0.00 61.69 60.44 2ju8 s THR 93 Cb -0.15 -0.54 0.01 0.00 -1.51 0.00 0.00 72.50 70.30 2ju8 s THR 93 CO -0.03 0.22 -0.18 0.42 -2.21 0.00 0.00 174.62 172.84 2ju8 s THR 94 N 0.94 1.59 -0.06 5.08 -4.23 -1.14 -2.98 115.64 114.84 2ju8 s THR 94 Ca -0.11 -0.73 -0.01 0.00 -1.18 0.00 0.00 61.69 59.66 2ju8 s THR 94 Cb -0.14 -1.42 0.03 0.00 1.34 0.00 0.00 72.50 72.31 2ju8 s THR 94 CO -0.00 0.46 0.00 0.72 -0.54 0.00 0.00 174.62 175.26 2ju8 s PHE 95 N 0.64 0.55 0.00 3.99 -0.71 -1.20 -3.10 117.98 118.16 2ju8 s PHE 95 Ca -0.14 -0.10 0.00 0.00 -1.04 0.00 0.00 56.93 55.65 2ju8 s PHE 95 Cb -0.16 -0.68 0.00 0.00 -1.21 0.00 0.00 43.02 40.97 2ju8 s PHE 95 CO 0.04 -0.26 0.00 1.63 -1.34 0.00 0.00 175.22 175.29 2ju8 n LYS 96 N 4.80 0.00 -0.03 1.99 5.02 -1.26 -2.04 118.16 126.64 2ju8 n LYS 96 Ca -0.13 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.17 2ju8 n LYS 96 Cb 0.50 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.53 2ju8 n LYS 96 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ju8 n GLY 97 N 0.00 -0.11 3.70 0.72 0.00 -1.26 -4.79 105.19 103.45 2ju8 n GLY 97 Ca 0.00 -0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.70 4.95 -0.27 -0.61 -1.09 -0.87 -4.86 121.20 116.75 2ju8 s ILE 98 Ca 0.03 0.02 -0.11 0.00 -2.23 0.00 0.00 60.65 58.36 2ju8 s ILE 98 Cb 0.02 -3.20 -0.05 0.00 -1.58 0.00 0.00 42.46 37.64 2ju8 s ILE 98 CO 0.02 0.51 0.18 -0.75 -1.23 0.00 0.00 174.94 173.66 2ju8 s LYS 99 N -0.05 3.99 -0.16 2.79 2.20 -1.23 -3.23 119.74 124.04 2ju8 s LYS 99 Ca 0.07 -0.31 0.01 0.00 -0.36 0.00 0.00 55.97 55.39 2ju8 s LYS 99 Cb -0.12 -3.62 0.02 0.00 -1.51 0.00 0.00 37.83 32.60 2ju8 s LYS 99 CO 0.01 -0.10 -0.18 -1.54 -0.36 0.00 0.00 175.35 173.17 2ju8 s SER 100 N 1.54 2.97 -0.12 1.43 1.04 -1.16 -2.84 113.70 116.55 2ju8 s SER 100 Ca 0.07 -0.59 0.01 0.00 0.48 0.00 0.00 55.95 55.92 2ju8 s SER 100 Cb -0.15 -1.37 0.02 0.00 0.10 0.00 0.00 66.02 64.61 2ju8 s SER 100 CO 0.09 -0.01 -0.14 -0.69 0.98 0.00 0.00 173.24 173.47 2ju8 s VAL 101 N 1.27 1.49 -0.12 5.02 1.01 -0.64 -2.88 120.40 125.56 2ju8 s VAL 101 Ca 0.03 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.40 2ju8 s VAL 101 Cb -0.13 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 2ju8 s VAL 101 CO -0.11 0.44 -0.12 -0.89 0.00 0.00 0.00 175.10 174.43 2ju8 s THR 102 N 1.24 3.15 -0.28 3.92 2.01 -1.10 -0.77 115.64 123.82 2ju8 s THR 102 Ca -0.01 -0.64 -0.11 0.00 0.31 0.00 0.00 61.69 61.24 2ju8 s THR 102 Cb -0.14 -2.31 -0.05 0.00 0.01 0.00 0.00 72.50 70.01 2ju8 s THR 102 CO -0.06 0.54 0.21 -0.70 -0.69 0.00 0.00 174.62 173.91 2ju8 s GLU 103 N 0.12 3.96 -0.35 4.92 2.12 -0.23 -1.47 118.70 127.78 2ju8 s GLU 103 Ca -0.06 -0.28 -0.17 0.00 0.36 0.00 0.00 54.97 54.82 2ju8 s GLU 103 Cb -0.15 -3.65 -0.01 0.00 0.26 0.00 0.00 34.13 30.58 2ju8 s GLU 103 CO 0.04 -0.18 0.45 0.12 -0.54 0.00 0.00 175.26 175.16 2ju8 s PHE 104 N 1.76 3.19 0.14 5.30 2.19 -1.04 -2.95 117.98 126.56 2ju8 s PHE 104 Ca 0.08 0.09 0.08 0.00 0.33 0.00 0.00 56.93 57.51 2ju8 s PHE 104 Cb -0.16 -2.82 -0.04 0.00 -1.31 0.00 0.00 43.02 38.70 2ju8 s PHE 104 CO 0.11 -0.49 -0.18 -0.80 1.83 0.00 0.00 175.22 175.68 2ju8 s ASN 105 N 1.75 2.50 -0.07 6.13 0.02 -1.25 0.38 114.94 124.39 2ju8 s ASN 105 Ca 0.16 -0.79 0.01 0.00 -1.02 0.00 0.00 52.86 51.22 2ju8 s ASN 105 Cb -0.16 -0.14 0.12 0.00 0.02 0.00 0.00 41.25 41.10 2ju8 s ASN 105 CO 0.13 -0.02 1.06 0.61 0.02 0.00 0.00 177.10 178.89 2ju8 n GLY 106 N 0.61 2.28 1.53 0.66 0.00 -1.26 -4.03 105.19 104.98 2ju8 n GLY 106 Ca -0.16 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 0.19 0.00 -3.73 1.61 8.00 -1.26 -5.00 116.55 116.35 2ju8 n ASP 107 Ca 0.09 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.40 2ju8 n ASP 107 Cb 0.64 0.21 -0.17 0.00 -0.02 0.00 0.00 41.12 41.78 2ju8 n ASP 107 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2ju8 s THR 108 N -1.77 0.02 -0.23 -3.53 2.01 -1.26 -1.96 115.64 108.93 2ju8 s THR 108 Ca 0.00 0.28 -0.09 0.00 0.31 0.00 0.00 61.69 62.19 2ju8 s THR 108 Cb 0.00 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 72.25 2ju8 s THR 108 CO 0.00 0.17 0.11 -0.63 -0.69 0.00 0.00 174.62 173.58 2ju8 s ILE 109 N 1.73 4.91 -0.04 1.82 1.09 -0.86 -3.93 121.20 125.92 2ju8 s ILE 109 Ca -0.00 0.02 0.05 0.00 -1.10 0.00 0.00 60.65 59.62 2ju8 s ILE 109 Cb -0.12 -3.28 -0.02 0.00 -1.06 0.00 0.00 42.46 37.97 2ju8 s ILE 109 CO -0.03 0.36 -0.17 -0.89 -0.10 0.00 0.00 174.94 174.11 2ju8 s THR 110 N 1.14 2.81 -0.03 2.92 2.01 -1.15 -2.11 115.64 121.23 2ju8 s THR 110 Ca 0.06 -0.82 0.07 0.00 0.31 0.00 0.00 61.69 61.32 2ju8 s THR 110 Cb -0.14 -2.08 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 2ju8 s THR 110 CO 0.04 0.59 -0.25 0.21 -0.69 0.00 0.00 174.62 174.52 2ju8 s ASN 111 N -0.67 3.13 -0.19 3.53 2.47 -1.14 -1.07 114.94 121.01 2ju8 s ASN 111 Ca 0.10 -0.45 0.01 0.00 0.42 0.00 0.00 52.86 52.94 2ju8 s ASN 111 Cb -0.11 -0.43 0.02 0.00 -1.45 0.00 0.00 41.25 39.28 2ju8 s ASN 111 CO 0.00 0.31 -0.18 -0.89 -3.72 0.00 0.00 177.10 172.62 2ju8 s THR 112 N -0.57 2.15 -0.15 -5.21 2.01 0.05 -2.62 115.64 111.29 2ju8 s THR 112 Ca 0.09 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 61.12 2ju8 s THR 112 Cb -0.10 -1.94 0.02 0.00 0.01 0.00 0.00 72.50 70.49 2ju8 s THR 112 CO -0.00 0.48 -0.15 -0.04 -0.69 0.00 0.00 174.62 174.22 2ju8 s MET 113 N 1.29 2.36 -0.10 4.92 -1.94 0.29 -1.62 119.30 124.50 2ju8 s MET 113 Ca 0.04 -0.58 0.01 0.00 -1.71 0.00 0.00 55.69 53.45 2ju8 s MET 113 Cb -0.14 -2.13 0.02 0.00 2.01 0.00 0.00 34.83 34.59 2ju8 s MET 113 CO -0.12 -0.22 -0.12 0.99 -0.01 0.00 0.00 175.02 175.54 2ju8 s THR 114 N 1.42 1.27 -0.17 2.05 2.01 -1.13 -0.44 115.64 120.65 2ju8 s THR 114 Ca 0.04 -0.51 -0.00 0.00 0.31 0.00 0.00 61.69 61.53 2ju8 s THR 114 Cb -0.13 -1.19 0.04 0.00 0.01 0.00 0.00 72.50 71.23 2ju8 s THR 114 CO -0.10 0.40 -0.07 -1.48 -0.69 0.00 0.00 174.62 172.67 2ju8 s LEU 115 N 1.07 1.77 0.00 4.42 2.34 -1.11 -3.50 118.68 123.67 2ju8 s LEU 115 Ca -0.06 -0.70 0.00 0.00 0.06 0.00 0.00 54.13 53.43 2ju8 s LEU 115 Cb -0.15 -1.01 0.00 0.00 -0.56 0.00 0.00 46.19 44.48 2ju8 s LEU 115 CO -0.02 -0.16 0.00 0.61 -1.06 0.00 0.00 176.35 175.72 2ju8 n GLY 116 N 4.82 1.63 0.00 -3.48 0.00 -1.26 -1.90 105.19 105.00 2ju8 n GLY 116 Ca -0.13 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 3.45 0.00 -4.78 1.61 8.00 -1.26 -5.11 116.55 118.47 2ju8 n ASP 117 Ca 0.00 -1.00 -0.39 0.00 0.71 0.00 0.00 54.79 54.11 2ju8 n ASP 117 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 2ju8 n ASP 117 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2ju8 s ILE 118 N 0.00 4.70 -0.26 0.53 1.01 -0.80 -5.06 121.20 121.33 2ju8 s ILE 118 Ca 0.00 1.39 -0.05 0.00 0.00 0.00 0.00 60.65 62.00 2ju8 s ILE 118 Cb 0.00 -3.99 0.00 0.00 0.01 0.00 0.00 42.46 38.48 2ju8 s ILE 118 CO 0.00 0.48 0.01 -0.69 0.00 0.00 0.00 174.94 174.74 2ju8 s VAL 119 N -0.71 3.58 -0.23 2.92 1.01 -1.26 -2.74 120.40 122.96 2ju8 s VAL 119 Ca 0.32 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.63 2ju8 s VAL 119 Cb -0.20 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.44 2ju8 s VAL 119 CO 0.21 0.24 -0.08 -0.47 0.00 0.00 0.00 175.10 174.99 2ju8 s TYR 120 N 1.47 2.99 -0.05 5.22 6.14 0.41 -4.41 117.35 129.12 2ju8 s TYR 120 Ca 0.03 -1.43 0.02 0.00 0.64 0.00 0.00 57.07 56.34 2ju8 s TYR 120 Cb -0.16 -2.04 0.01 0.00 0.42 0.00 0.00 41.96 40.19 2ju8 s TYR 120 CO -0.01 -0.70 -0.10 0.21 0.64 0.00 0.00 175.55 175.59 2ju8 s LYS 121 N 1.35 1.34 -0.11 4.97 2.20 -1.26 -0.55 119.74 127.69 2ju8 s LYS 121 Ca 0.02 -0.35 0.02 0.00 -0.36 0.00 0.00 55.97 55.31 2ju8 s LYS 121 Cb -0.15 -1.17 -0.01 0.00 -1.51 0.00 0.00 37.83 34.99 2ju8 s LYS 121 CO -0.06 0.06 -0.18 -0.98 -0.36 0.00 0.00 175.35 173.83 2ju8 s ARG 122 N 0.50 3.13 -0.27 4.03 1.70 -1.08 -3.14 118.95 123.82 2ju8 s ARG 122 Ca -0.10 -0.77 -0.10 0.00 -0.47 0.00 0.00 55.73 54.29 2ju8 s ARG 122 Cb -0.13 -2.45 -0.04 0.00 -0.57 0.00 0.00 34.95 31.76 2ju8 s ARG 122 CO 0.02 0.25 0.14 0.08 -1.08 0.00 0.00 175.30 174.71 2ju8 s VAL 123 N 0.22 4.88 -0.02 4.99 1.01 -1.16 -2.87 120.40 127.45 2ju8 s VAL 123 Ca -0.11 -0.02 0.08 0.00 0.00 0.00 0.00 61.98 61.93 2ju8 s VAL 123 Cb -0.16 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 2ju8 s VAL 123 CO 0.06 0.26 -0.25 -0.44 0.00 0.00 0.00 175.10 174.73 2ju8 s SER 124 N 1.69 3.13 -0.09 3.32 0.01 -0.90 -1.18 113.70 119.69 2ju8 s SER 124 Ca 0.07 -0.46 -0.02 0.00 1.31 0.00 0.00 55.95 56.85 2ju8 s SER 124 Cb -0.16 -0.37 -0.03 0.00 0.21 0.00 0.00 66.02 65.66 2ju8 s SER 124 CO 0.08 0.32 0.01 -0.75 0.41 0.00 0.00 173.24 173.30 2ju8 s LYS 125 N -0.66 2.99 0.05 12.44 2.36 -0.49 -2.03 119.74 134.41 2ju8 s LYS 125 Ca 0.10 -0.40 -0.31 0.00 -2.55 0.00 0.00 55.97 52.82 2ju8 s LYS 125 Cb -0.10 -2.80 -0.06 0.00 -1.05 0.00 0.00 37.83 33.81 2ju8 s LYS 125 CO -0.01 0.71 1.35 0.50 1.55 0.00 0.00 175.35 179.45 2ju8 s ARG 126 N -0.90 4.33 0.00 4.03 3.52 -0.83 -1.31 118.95 127.79 2ju8 s ARG 126 Ca 0.13 1.95 0.00 0.00 -0.13 0.00 0.00 55.73 57.69 2ju8 s ARG 126 Cb -0.11 -3.42 0.00 0.00 -1.56 0.00 0.00 34.95 29.86 2ju8 s ARG 126 CO 0.02 -0.46 0.00 0.44 -0.81 0.00 0.00 175.30 174.49