#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k43 s LYS 2 N 0.00 4.40 0.31 2.98 1.02 -0.65 -4.57 119.74 123.23 2k43 s LYS 2 Ca 0.00 2.10 0.00 0.00 0.02 0.00 0.00 55.97 58.09 2k43 s LYS 2 Cb 0.00 -3.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.16 2k43 s LYS 2 CO 0.00 -0.19 0.00 1.17 -0.92 0.00 0.00 175.35 175.41 2k43 n LYS 3 N 1.85 0.00 -3.29 1.68 3.00 -1.26 -4.96 118.16 115.17 2k43 n LYS 3 Ca 0.03 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.96 2k43 n LYS 3 Cb 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.40 2k43 n LYS 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2k43 s PRO 4 N -2.00 4.19 0.43 1.64 0.05 -1.26 -4.23 135.00 133.82 2k43 s PRO 4 Ca 0.00 0.67 0.03 0.00 0.05 0.00 0.00 61.00 61.75 2k43 s PRO 4 Cb 0.00 -3.27 0.00 0.00 0.05 0.00 0.00 34.50 31.28 2k43 s PRO 4 CO 0.00 0.57 0.63 -1.59 0.05 0.00 0.00 177.00 176.65 2k43 s LYS 5 N -0.82 2.98 0.13 4.56 -2.85 0.32 -1.68 119.74 122.38 2k43 s LYS 5 Ca 0.28 -0.72 0.04 0.00 -1.00 0.00 0.00 55.97 54.57 2k43 s LYS 5 Cb -0.19 -2.63 -0.04 0.00 -2.06 0.00 0.00 37.83 32.91 2k43 s LYS 5 CO 0.17 -0.25 0.15 -1.17 0.10 0.00 0.00 175.35 174.36 2k43 s LEU 6 N -4.47 3.95 -0.51 2.77 2.96 0.22 -1.92 118.68 121.68 2k43 s LEU 6 Ca 0.49 -0.01 -0.20 0.00 -0.22 0.00 0.00 54.13 54.19 2k43 s LEU 6 Cb -0.10 -2.57 0.05 0.00 0.50 0.00 0.00 46.19 44.08 2k43 s LEU 6 CO 0.36 0.10 0.68 -0.22 -1.32 0.00 0.00 176.35 175.95 2k43 s LEU 7 N -2.90 4.78 -0.25 -0.68 1.98 -1.26 -3.23 118.68 117.12 2k43 s LEU 7 Ca 0.31 -0.77 -0.12 0.00 -2.89 0.00 0.00 54.13 50.66 2k43 s LEU 7 Cb -0.11 -2.53 -0.05 0.00 0.66 0.00 0.00 46.19 44.16 2k43 s LEU 7 CO 0.24 -0.94 0.24 -0.47 -1.89 0.00 0.00 176.35 173.54 2k43 s TYR 8 N 2.86 3.29 0.20 5.38 6.14 -0.92 -3.68 117.35 130.63 2k43 s TYR 8 Ca 0.18 0.30 0.10 0.00 0.64 0.00 0.00 57.07 58.29 2k43 s TYR 8 Cb -0.18 -2.38 -0.04 0.00 0.42 0.00 0.00 41.96 39.77 2k43 s TYR 8 CO 0.14 -0.04 -0.20 0.00 0.64 0.00 0.00 175.55 176.08 2k43 s SER 10 N -2.92 5.79 -0.40 0.00 1.04 -0.72 -4.48 113.70 112.01 2k43 s SER 10 Ca 0.21 2.25 -0.29 0.00 0.48 0.00 0.00 55.95 58.61 2k43 s SER 10 Cb -0.06 -2.59 0.02 0.00 0.10 0.00 0.00 66.02 63.49 2k43 s SER 10 CO 0.10 -1.18 1.21 0.21 0.98 0.00 0.00 173.24 174.56 2k43 s ASN 11 N -1.61 6.65 -0.13 7.02 2.47 -1.26 -4.80 114.94 123.29 2k43 s ASN 11 Ca 0.70 0.80 0.16 0.00 0.42 0.00 0.00 52.86 54.94 2k43 s ASN 11 Cb -0.26 -2.54 0.40 0.00 -1.45 0.00 0.00 41.25 37.39 2k43 s ASN 11 CO 0.30 -1.17 1.19 0.61 -3.72 0.00 0.00 177.10 174.31 2k43 n GLY 12 N 4.58 3.57 2.63 1.21 0.00 -1.26 -5.04 105.19 110.88 2k43 n GLY 12 Ca 0.13 -1.10 -0.21 0.00 0.00 0.00 0.00 46.02 44.85 2k43 n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k43 n GLY 13 N -0.56 -0.09 3.24 -0.02 0.00 -1.26 -4.89 105.19 101.61 2k43 n GLY 13 Ca 0.14 0.59 -0.13 0.00 0.00 0.00 0.00 46.02 46.62 2k43 n GLY 13 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k43 s HIS 14 N -1.24 1.21 -0.02 1.61 3.76 -1.26 -4.64 115.29 114.71 2k43 s HIS 14 Ca 0.17 -1.13 0.03 0.00 -0.15 0.00 0.00 55.06 53.98 2k43 s HIS 14 Cb -0.02 -0.68 -0.00 0.00 1.11 0.00 0.00 32.58 32.98 2k43 s HIS 14 CO 0.51 -0.34 -0.11 -0.06 -0.85 0.00 0.00 174.74 173.88 2k43 s PHE 15 N -3.81 1.09 -0.38 1.40 0.08 -0.23 -4.77 117.98 111.37 2k43 s PHE 15 Ca 0.28 -0.24 -0.26 0.00 0.12 0.00 0.00 56.93 56.83 2k43 s PHE 15 Cb 0.07 -0.72 0.02 0.00 -0.57 0.00 0.00 43.02 41.81 2k43 s PHE 15 CO 0.06 -0.06 0.96 -1.17 -0.10 0.00 0.00 175.22 174.92 2k43 s LEU 16 N -0.11 3.96 0.14 -0.37 2.96 -1.24 -0.00 118.68 124.02 2k43 s LEU 16 Ca 0.02 0.61 0.07 0.00 -0.22 0.00 0.00 54.13 54.60 2k43 s LEU 16 Cb -0.06 -3.32 -0.04 0.00 0.50 0.00 0.00 46.19 43.27 2k43 s LEU 16 CO 0.00 -0.90 -0.16 0.00 -1.32 0.00 0.00 176.35 173.96 2k43 s ARG 17 N 3.59 1.15 -0.03 1.98 1.70 0.51 -4.56 118.95 123.30 2k43 s ARG 17 Ca 0.40 -1.32 -0.17 0.00 -0.47 0.00 0.00 55.73 54.17 2k43 s ARG 17 Cb -0.11 -1.12 -0.05 0.00 -0.57 0.00 0.00 34.95 33.09 2k43 s ARG 17 CO 0.20 0.22 0.47 0.96 -1.08 0.00 0.00 175.30 176.07 2k43 s ILE 18 N -2.08 5.03 -0.08 4.99 -4.36 -1.24 -1.42 121.20 122.04 2k43 s ILE 18 Ca 0.12 0.97 -0.01 0.00 -0.26 0.00 0.00 60.65 61.48 2k43 s ILE 18 Cb -0.05 -3.80 -0.03 0.00 1.25 0.00 0.00 42.46 39.83 2k43 s ILE 18 CO 0.05 0.47 -0.03 -0.22 0.24 0.00 0.00 174.94 175.45 2k43 s LEU 19 N -0.39 3.38 0.00 0.37 0.20 -0.39 -4.99 118.68 116.86 2k43 s LEU 19 Ca 0.26 0.06 0.00 0.00 0.69 0.00 0.00 54.13 55.14 2k43 s LEU 19 Cb -0.17 -1.76 0.00 0.00 -0.43 0.00 0.00 46.19 43.84 2k43 s LEU 19 CO 0.13 0.37 0.57 -2.65 -0.29 0.00 0.00 176.35 174.48 2k43 n PRO 20 N 2.18 0.61 0.04 0.98 -0.02 -1.26 -0.81 135.00 136.73 2k43 n PRO 20 Ca -0.18 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.41 2k43 n PRO 20 Cb 0.53 -1.04 0.05 0.00 -0.02 0.00 0.00 33.50 33.01 2k43 n PRO 20 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2k43 n ASP 21 N -0.40 0.64 0.00 2.55 8.00 -1.26 -4.97 116.55 121.10 2k43 n ASP 21 Ca 0.00 -0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.45 2k43 n ASP 21 Cb 0.02 0.66 0.00 0.00 -0.02 0.00 0.00 41.12 41.78 2k43 n ASP 21 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k43 n GLY 22 N 1.33 0.69 3.08 0.44 0.00 0.01 -5.09 105.19 105.65 2k43 n GLY 22 Ca 0.02 -0.15 -0.15 0.00 0.00 0.00 0.00 46.02 45.74 2k43 n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k43 s THR 23 N -0.73 0.69 -0.26 2.61 2.01 -1.12 -4.01 115.64 114.83 2k43 s THR 23 Ca 0.00 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 61.02 2k43 s THR 23 Cb 0.00 -0.70 0.07 0.00 0.01 0.00 0.00 72.50 71.88 2k43 s THR 23 CO 0.00 -0.24 -0.03 0.54 -0.69 0.00 0.00 174.62 174.20 2k43 s VAL 24 N -1.13 1.66 0.11 3.82 0.11 -1.13 -1.27 120.40 122.57 2k43 s VAL 24 Ca -0.06 -1.46 0.06 0.00 -2.93 0.00 0.00 61.98 57.59 2k43 s VAL 24 Cb -0.09 -1.98 -0.04 0.00 -1.53 0.00 0.00 36.38 32.75 2k43 s VAL 24 CO 0.01 -0.23 -0.14 1.51 -3.33 0.00 0.00 175.10 172.92 2k43 s ASP 25 N 1.31 1.92 0.12 3.54 1.47 -0.51 -2.83 116.67 121.69 2k43 s ASP 25 Ca -0.02 -0.78 -0.31 0.00 1.18 0.00 0.00 52.55 52.62 2k43 s ASP 25 Cb -0.19 -0.06 -0.08 0.00 -0.34 0.00 0.00 42.92 42.25 2k43 s ASP 25 CO -0.08 -0.14 1.36 -0.83 0.68 0.00 0.00 175.17 176.16 2k43 s GLY 26 N -2.35 2.09 -0.04 2.12 0.00 -0.37 -0.36 107.32 108.41 2k43 s GLY 26 Ca 0.07 1.09 -0.09 0.00 0.00 0.00 0.00 44.72 45.79 2k43 s GLY 26 CO 0.03 2.27 0.22 -1.59 0.00 0.00 0.00 173.10 174.03 2k43 s THR 27 N 0.94 0.04 -0.52 0.90 2.01 1.00 -4.67 115.64 115.34 2k43 s THR 27 Ca 0.63 -0.33 -0.23 0.00 0.31 0.00 0.00 61.69 62.07 2k43 s THR 27 Cb -0.36 -0.43 0.04 0.00 0.01 0.00 0.00 72.50 71.76 2k43 s THR 27 CO 0.31 -0.18 0.85 -0.60 -0.69 0.00 0.00 174.62 174.31 2k43 s ARG 28 N -0.69 3.30 -0.18 4.92 3.52 -1.26 -1.06 118.95 127.51 2k43 s ARG 28 Ca -0.08 -0.36 -0.04 0.00 -0.13 0.00 0.00 55.73 55.12 2k43 s ARG 28 Cb -0.04 -4.04 0.09 0.00 -1.56 0.00 0.00 34.95 29.39 2k43 s ARG 28 CO 0.02 -1.36 0.26 -0.51 -0.81 0.00 0.00 175.30 172.90 2k43 s ASP 29 N 2.67 0.77 0.00 -2.12 1.01 -1.26 -4.98 116.67 112.77 2k43 s ASP 29 Ca 0.27 0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.73 2k43 s ASP 29 Cb -0.14 0.62 0.00 0.00 1.01 0.00 0.00 42.92 44.41 2k43 s ASP 29 CO 0.18 -0.28 0.74 -2.11 0.21 0.00 0.00 175.17 173.91 2k43 n ARG 30 N 5.34 1.47 -0.08 8.23 0.00 -1.26 -4.58 116.66 125.78 2k43 n ARG 30 Ca -0.05 -0.99 0.08 0.00 -0.00 0.00 0.00 57.85 56.89 2k43 n ARG 30 Cb 0.50 -0.76 0.12 0.00 -0.00 0.00 0.00 32.46 32.31 2k43 n ARG 30 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2k43 n SER 31 N -0.25 2.68 -3.53 2.89 7.64 -1.26 -4.99 113.62 116.80 2k43 n SER 31 Ca 0.00 -1.78 -0.18 0.00 1.01 0.00 0.00 58.87 57.92 2k43 n SER 31 Cb 0.36 -0.11 -0.03 0.00 -1.01 0.00 0.00 64.21 63.42 2k43 n SER 31 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2k43 n ASP 32 N 0.94 2.69 -3.22 6.43 -0.08 -1.26 -5.06 116.55 116.99 2k43 n ASP 32 Ca 0.12 -2.24 -0.37 0.00 -1.51 0.00 0.00 54.79 50.79 2k43 n ASP 32 Cb 0.44 0.17 0.01 0.00 2.34 0.00 0.00 41.12 44.08 2k43 n ASP 32 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k43 n GLN 33 N -0.79 4.18 0.00 -0.67 6.02 -1.26 -4.53 117.38 120.33 2k43 n GLN 33 Ca -0.11 -4.41 0.00 0.00 -0.01 0.00 0.00 57.00 52.47 2k43 n GLN 33 Cb 0.36 -2.36 0.00 0.00 1.02 0.00 0.00 30.24 29.27 2k43 n GLN 33 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2k43 n HIS 34 N -0.25 0.00 0.03 1.08 8.25 -1.26 -4.64 115.22 118.42 2k43 n HIS 34 Ca 0.45 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.90 2k43 n HIS 34 Cb 0.32 0.00 0.17 0.00 1.12 0.00 0.00 29.99 31.60 2k43 n HIS 34 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2k43 n ILE 35 N -1.63 1.55 -3.51 1.59 -0.00 -1.26 -3.68 119.36 112.43 2k43 n ILE 35 Ca 0.00 -0.75 -0.42 0.00 -0.00 0.00 0.00 62.75 61.58 2k43 n ILE 35 Cb 0.29 -0.49 -0.08 0.00 -0.00 0.00 0.00 39.64 39.36 2k43 n ILE 35 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2k43 s GLN 36 N -1.80 2.61 -0.05 6.28 0.00 -1.26 -4.18 119.66 121.26 2k43 s GLN 36 Ca 0.27 -1.70 0.02 0.00 -0.00 0.00 0.00 55.36 53.95 2k43 s GLN 36 Cb 0.21 -3.99 -0.03 0.00 0.00 0.00 0.00 33.01 29.20 2k43 s GLN 36 CO 0.07 -1.19 -0.09 -0.48 0.00 0.00 0.00 175.29 173.60 2k43 s LEU 37 N 1.43 3.02 -0.47 2.60 2.34 -0.81 -2.82 118.68 123.97 2k43 s LEU 37 Ca 0.05 -0.11 -0.23 0.00 0.06 0.00 0.00 54.13 53.90 2k43 s LEU 37 Cb -0.26 -1.66 0.03 0.00 -0.56 0.00 0.00 46.19 43.73 2k43 s LEU 37 CO 0.01 0.34 0.78 -1.58 -1.06 0.00 0.00 176.35 174.83 2k43 s GLN 38 N -0.91 3.34 -0.23 1.48 2.00 0.20 0.12 119.66 125.65 2k43 s GLN 38 Ca 0.13 -0.25 -0.21 0.00 -2.00 0.00 0.00 55.36 53.02 2k43 s GLN 38 Cb -0.11 -3.98 -0.02 0.00 0.80 0.00 0.00 33.01 29.71 2k43 s GLN 38 CO 0.02 -1.18 0.67 -1.17 -0.50 0.00 0.00 175.29 173.13 2k43 s LEU 39 N 3.27 4.09 0.60 3.68 2.96 -1.26 -0.61 118.68 131.42 2k43 s LEU 39 Ca 0.27 0.81 -0.02 0.00 -0.22 0.00 0.00 54.13 54.97 2k43 s LEU 39 Cb -0.13 -2.93 0.04 0.00 0.50 0.00 0.00 46.19 43.66 2k43 s LEU 39 CO 0.20 -0.37 0.87 -0.44 -1.32 0.00 0.00 176.35 175.30 2k43 s SER 40 N 1.36 5.18 -0.05 3.68 0.01 0.41 -4.94 113.70 119.35 2k43 s SER 40 Ca 0.29 0.26 0.03 0.00 1.31 0.00 0.00 55.95 57.84 2k43 s SER 40 Cb -0.16 -1.10 -0.03 0.00 0.21 0.00 0.00 66.02 64.95 2k43 s SER 40 CO 0.09 -1.27 -0.14 0.00 0.41 0.00 0.00 173.24 172.33 2k43 s ALA 41 N -2.95 2.67 -0.67 1.44 0.00 -1.26 -2.85 121.76 118.14 2k43 s ALA 41 Ca 0.57 -0.97 -0.26 0.00 0.00 0.00 0.00 51.96 51.30 2k43 s ALA 41 Cb -0.10 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 2k43 s ALA 41 CO 0.41 0.54 1.94 -1.83 0.00 0.00 0.00 175.76 176.82 2k43 s GLU 42 N -0.69 2.54 0.00 0.00 1.03 -0.19 -4.63 118.70 116.76 2k43 s GLU 42 Ca 0.10 0.47 0.00 0.00 0.03 0.00 0.00 54.97 55.58 2k43 s GLU 42 Cb -0.11 -4.56 0.00 0.00 -0.80 0.00 0.00 34.13 28.66 2k43 s GLU 42 CO 0.01 -2.96 0.00 0.45 -1.33 0.00 0.00 175.26 171.42 2k43 n SER 43 N 13.43 0.00 -4.56 0.83 2.88 -1.24 -4.56 113.62 120.41 2k43 n SER 43 Ca 0.27 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.39 2k43 n SER 43 Cb 0.51 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.94 2k43 n SER 43 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2k43 s VAL 44 N 0.01 3.99 0.00 2.46 1.01 -1.26 -4.59 120.40 122.02 2k43 s VAL 44 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2k43 s VAL 44 Cb 0.00 -4.76 0.00 0.00 0.00 0.00 0.00 36.38 31.62 2k43 s VAL 44 CO 0.00 -1.47 0.00 0.61 0.00 0.00 0.00 175.10 174.24 2k43 n GLY 45 N 5.17 -0.42 2.99 4.51 0.00 -1.26 -4.87 105.19 111.31 2k43 n GLY 45 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2k43 n GLY 45 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k43 s GLU 46 N -4.24 2.08 -0.07 1.61 -1.05 -1.26 -0.84 118.70 114.93 2k43 s GLU 46 Ca 0.00 -0.54 0.01 0.00 -0.15 0.00 0.00 54.97 54.30 2k43 s GLU 46 Cb 0.00 -2.05 -0.03 0.00 -0.44 0.00 0.00 34.13 31.61 2k43 s GLU 46 CO 0.00 -0.28 -0.09 0.14 0.95 0.00 0.00 175.26 175.98 2k43 s VAL 47 N 1.52 3.51 -0.03 1.83 -7.23 -0.79 -1.02 120.40 118.18 2k43 s VAL 47 Ca 0.04 -0.55 0.07 0.00 -1.81 0.00 0.00 61.98 59.73 2k43 s VAL 47 Cb -0.13 -2.42 -0.02 0.00 0.56 0.00 0.00 36.38 34.37 2k43 s VAL 47 CO -0.10 0.59 -0.24 -0.47 -0.31 0.00 0.00 175.10 174.57 2k43 s TYR 48 N -0.72 2.23 -0.29 2.82 6.14 -1.13 -2.83 117.35 123.56 2k43 s TYR 48 Ca 0.11 -0.50 -0.05 0.00 0.64 0.00 0.00 57.07 57.27 2k43 s TYR 48 Cb -0.11 -1.45 0.03 0.00 0.42 0.00 0.00 41.96 40.85 2k43 s TYR 48 CO 0.01 -0.09 0.03 0.42 0.64 0.00 0.00 175.55 176.56 2k43 s ILE 49 N -0.43 3.48 0.21 3.14 -1.09 -1.26 -0.44 121.20 124.80 2k43 s ILE 49 Ca 0.05 -0.97 0.10 0.00 -2.23 0.00 0.00 60.65 57.61 2k43 s ILE 49 Cb -0.11 -2.85 -0.04 0.00 -1.58 0.00 0.00 42.46 37.88 2k43 s ILE 49 CO 0.00 0.04 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.05 2k43 s LYS 50 N 1.40 1.80 0.02 2.79 1.02 0.22 -4.69 119.74 122.30 2k43 s LYS 50 Ca -0.00 -1.46 -0.27 0.00 0.02 0.00 0.00 55.97 54.26 2k43 s LYS 50 Cb -0.18 -1.97 -0.04 0.00 -0.52 0.00 0.00 37.83 35.11 2k43 s LYS 50 CO 0.00 0.40 0.87 -1.12 -0.92 0.00 0.00 175.35 174.58 2k43 s SER 51 N -2.92 7.28 0.00 2.83 0.01 -1.23 0.61 113.70 120.27 2k43 s SER 51 Ca 0.24 1.54 0.00 0.00 1.31 0.00 0.00 55.95 59.05 2k43 s SER 51 Cb -0.08 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2k43 s SER 51 CO 0.13 -0.12 0.00 0.41 0.41 0.00 0.00 173.24 174.07 2k43 n THR 52 N 3.36 0.00 -0.08 1.44 -1.04 -1.19 -4.64 114.28 112.13 2k43 n THR 52 Ca 0.02 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.80 2k43 n THR 52 Cb 0.50 -0.05 -0.12 0.00 -1.82 0.00 0.00 70.33 68.85 2k43 n THR 52 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2k43 n GLU 53 N 0.00 0.61 -0.47 -2.82 4.07 -1.26 -4.60 120.64 116.18 2k43 n GLU 53 Ca 0.00 0.48 0.05 0.00 -0.06 0.00 0.00 57.16 57.63 2k43 n GLU 53 Cb 0.00 -1.72 0.22 0.00 -0.06 0.00 0.00 31.44 29.88 2k43 n GLU 53 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2k43 n THR 54 N -4.18 2.27 0.11 6.31 -2.24 -1.26 -4.94 114.28 110.36 2k43 n THR 54 Ca -0.34 -2.26 0.11 0.00 -2.27 0.00 0.00 64.05 59.28 2k43 n THR 54 Cb 0.79 -0.27 0.02 0.00 -2.10 0.00 0.00 70.33 68.76 2k43 n THR 54 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2k43 h GLY 55 N 1.16 0.00 0.00 3.38 0.00 -1.74 -3.41 103.07 102.46 2k43 h GLY 55 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2k43 h GLY 55 CO 0.21 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.69 2k43 n GLN 56 N -2.76 0.00 -2.61 4.80 6.02 -1.21 -4.10 117.38 117.52 2k43 n GLN 56 Ca -0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 2k43 n GLN 56 Cb 0.57 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.84 2k43 n GLN 56 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 2k43 n TYR 57 N -1.37 2.56 -2.31 1.08 9.36 -1.02 -3.57 117.16 121.90 2k43 n TYR 57 Ca 0.00 -2.64 -0.43 0.00 3.32 0.00 0.00 57.90 58.15 2k43 n TYR 57 Cb 0.00 -1.46 -0.02 0.00 -0.63 0.00 0.00 39.34 37.22 2k43 n TYR 57 CO 0.00 0.00 0.00 -1.17 0.22 0.00 0.00 176.86 175.91 2k43 s LEU 58 N -2.61 4.01 -0.23 2.98 0.20 -1.24 -3.27 118.68 118.52 2k43 s LEU 58 Ca 0.38 1.55 -0.04 0.00 0.69 0.00 0.00 54.13 56.71 2k43 s LEU 58 Cb 0.12 -3.54 0.08 0.00 -0.43 0.00 0.00 46.19 42.42 2k43 s LEU 58 CO -0.01 -1.02 0.10 0.00 -0.29 0.00 0.00 176.35 175.13 2k43 s ALA 59 N 4.30 0.73 -0.26 5.97 0.00 -0.23 -1.52 121.76 130.75 2k43 s ALA 59 Ca 0.61 -0.82 -0.26 0.00 0.00 0.00 0.00 51.96 51.50 2k43 s ALA 59 Cb -0.22 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.65 2k43 s ALA 59 CO 0.23 -1.40 0.90 -1.64 0.00 0.00 0.00 175.76 173.84 2k43 s MET 60 N 2.01 4.14 -0.13 0.00 -1.94 -1.22 -2.21 119.30 119.95 2k43 s MET 60 Ca 0.05 0.98 -0.01 0.00 -1.71 0.00 0.00 55.69 55.00 2k43 s MET 60 Cb -0.16 -3.67 -0.02 0.00 2.01 0.00 0.00 34.83 32.99 2k43 s MET 60 CO -0.21 -0.62 -0.12 0.34 -0.01 0.00 0.00 175.02 174.40 2k43 s ASP 61 N 1.40 4.14 0.00 3.03 2.15 -1.14 -4.39 116.67 121.86 2k43 s ASP 61 Ca 0.38 -0.29 0.00 0.00 0.43 0.00 0.00 52.55 53.06 2k43 s ASP 61 Cb -0.15 -1.64 0.00 0.00 -0.30 0.00 0.00 42.92 40.84 2k43 s ASP 61 CO 0.09 0.17 0.00 0.41 -0.17 0.00 0.00 175.17 175.67 2k43 n THR 62 N 3.53 0.00 -0.49 1.71 -1.04 -1.26 -2.64 114.28 114.09 2k43 n THR 62 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 2k43 n THR 62 Cb 0.53 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.04 2k43 n THR 62 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2k43 n ASP 63 N 0.10 -1.47 -0.07 8.00 2.03 -1.26 -4.92 116.55 118.96 2k43 n ASP 63 Ca 0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 2k43 n ASP 63 Cb 0.00 -0.25 -0.06 0.00 -0.72 0.00 0.00 41.12 40.10 2k43 n ASP 63 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k43 n GLY 64 N -2.49 -0.21 3.21 0.27 0.00 -1.08 -4.34 105.19 100.55 2k43 n GLY 64 Ca 0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 2k43 n GLY 64 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k43 s LEU 65 N -6.17 2.06 -0.26 0.99 1.02 -1.22 0.11 118.68 115.20 2k43 s LEU 65 Ca -0.19 -0.54 -0.08 0.00 0.02 0.00 0.00 54.13 53.34 2k43 s LEU 65 Cb 0.06 -1.37 -0.03 0.00 0.02 0.00 0.00 46.19 44.87 2k43 s LEU 65 CO 0.29 0.15 0.10 -0.76 0.02 0.00 0.00 176.35 176.15 2k43 s LEU 66 N 0.36 3.60 0.06 1.79 1.43 -0.11 -2.91 118.68 122.92 2k43 s LEU 66 Ca -0.19 -0.22 0.08 0.00 -1.03 0.00 0.00 54.13 52.78 2k43 s LEU 66 Cb -0.18 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2k43 s LEU 66 CO 0.09 -0.06 -0.23 -0.72 0.23 0.00 0.00 176.35 175.66 2k43 s TYR 67 N 1.63 2.00 -0.28 0.29 1.13 -0.94 -4.32 117.35 116.86 2k43 s TYR 67 Ca 0.06 -0.39 -0.17 0.00 -1.41 0.00 0.00 57.07 55.16 2k43 s TYR 67 Cb -0.15 -1.17 0.11 0.00 -1.10 0.00 0.00 41.96 39.65 2k43 s TYR 67 CO 0.05 0.15 0.85 0.20 -2.51 0.00 0.00 175.55 174.29 2k43 s GLY 68 N -1.41 -0.29 0.20 5.49 0.00 -1.23 -1.06 107.32 109.02 2k43 s GLY 68 Ca 0.09 2.79 0.00 0.00 0.00 0.00 0.00 44.72 47.60 2k43 s GLY 68 CO 0.03 2.46 0.00 1.44 0.00 0.00 0.00 173.10 177.03 2k43 n SER 69 N 3.87 -0.94 -0.04 1.64 7.64 -1.20 -2.86 113.62 121.74 2k43 n SER 69 Ca -0.19 0.36 -0.20 0.00 1.01 0.00 0.00 58.87 59.85 2k43 n SER 69 Cb 0.58 1.04 -0.13 0.00 -1.01 0.00 0.00 64.21 64.69 2k43 n SER 69 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2k43 h GLN 70 N 0.00 0.14 -4.64 1.43 4.20 -1.84 -2.70 115.11 111.69 2k43 h GLN 70 Ca 0.00 -0.23 -0.25 0.00 0.06 0.00 0.00 58.65 58.23 2k43 h GLN 70 Cb 0.00 0.09 -0.17 0.00 0.30 0.00 0.00 27.48 27.69 2k43 h GLN 70 CO 0.00 1.11 -0.71 0.99 -0.67 0.00 0.00 178.83 179.55 2k43 s THR 71 N -2.40 0.65 -0.39 -0.54 2.01 -1.25 -4.61 115.64 109.11 2k43 s THR 71 Ca -0.22 -1.59 -0.04 0.00 0.31 0.00 0.00 61.69 60.15 2k43 s THR 71 Cb 0.03 -1.25 0.09 0.00 0.01 0.00 0.00 72.50 71.38 2k43 s THR 71 CO 0.71 -0.67 0.18 -2.16 -0.69 0.00 0.00 174.62 171.99 2k43 s PRO 72 N -2.91 2.23 0.63 4.92 0.04 -1.24 -2.96 135.00 135.71 2k43 s PRO 72 Ca 0.03 -1.62 0.01 0.00 0.04 0.00 0.00 61.00 59.46 2k43 s PRO 72 Cb -0.01 -3.55 0.12 0.00 0.04 0.00 0.00 34.50 31.10 2k43 s PRO 72 CO -0.03 -0.95 0.86 0.09 0.04 0.00 0.00 177.00 177.01 2k43 n ASN 73 N 4.68 1.26 -4.24 6.66 3.02 -1.26 -4.99 115.26 120.39 2k43 n ASN 73 Ca -0.06 -2.04 -0.42 0.00 -0.03 0.00 0.00 54.58 52.02 2k43 n ASN 73 Cb 0.42 -0.55 -0.08 0.00 -0.61 0.00 0.00 39.78 38.96 2k43 n ASN 73 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2k43 s GLU 74 N -4.74 2.61 0.00 3.52 -1.05 -1.26 -3.56 118.70 114.22 2k43 s GLU 74 Ca 0.58 -1.71 0.00 0.00 -0.15 0.00 0.00 54.97 53.69 2k43 s GLU 74 Cb -0.03 -4.00 0.00 0.00 -0.44 0.00 0.00 34.13 29.66 2k43 s GLU 74 CO 0.38 -1.20 0.00 0.39 0.95 0.00 0.00 175.26 175.79 2k43 n GLU 75 N 4.99 2.69 0.00 -4.83 4.71 -1.26 -4.75 120.64 122.19 2k43 n GLU 75 Ca -0.09 0.00 0.11 0.00 -0.01 0.00 0.00 57.16 57.16 2k43 n GLU 75 Cb 0.41 -0.72 0.60 0.00 -1.01 0.00 0.00 31.44 30.72 2k43 n GLU 75 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2k43 s LEU 77 N -2.32 4.19 0.19 0.00 0.20 -1.26 -4.16 118.68 115.52 2k43 s LEU 77 Ca 0.26 1.37 0.06 0.00 0.69 0.00 0.00 54.13 56.51 2k43 s LEU 77 Cb 0.15 -3.43 -0.05 0.00 -0.43 0.00 0.00 46.19 42.43 2k43 s LEU 77 CO 0.30 -0.47 -0.10 -0.36 -0.29 0.00 0.00 176.35 175.42 2k43 s PHE 78 N 2.30 1.50 -0.06 5.38 0.08 -1.13 -3.22 117.98 122.84 2k43 s PHE 78 Ca 0.44 -0.71 -0.15 0.00 0.12 0.00 0.00 56.93 56.63 2k43 s PHE 78 Cb -0.17 -0.75 -0.05 0.00 -0.57 0.00 0.00 43.02 41.47 2k43 s PHE 78 CO 0.13 0.18 0.38 -1.17 -0.10 0.00 0.00 175.22 174.65 2k43 s LEU 79 N -3.25 4.39 -0.12 -0.37 0.20 0.12 -1.89 118.68 117.74 2k43 s LEU 79 Ca 0.21 0.82 -0.15 0.00 0.69 0.00 0.00 54.13 55.70 2k43 s LEU 79 Cb 0.02 -2.54 -0.05 0.00 -0.43 0.00 0.00 46.19 43.19 2k43 s LEU 79 CO 0.04 0.22 0.35 -0.70 -0.29 0.00 0.00 176.35 175.98 2k43 s GLU 80 N -0.45 4.19 -0.17 1.98 2.56 -0.02 -0.25 118.70 126.54 2k43 s GLU 80 Ca 0.22 0.23 0.00 0.00 0.00 0.00 0.00 54.97 55.42 2k43 s GLU 80 Cb -0.15 -3.39 0.03 0.00 2.00 0.00 0.00 34.13 32.62 2k43 s GLU 80 CO 0.10 0.31 -0.10 0.50 -0.56 0.00 0.00 175.26 175.52 2k43 s ARG 81 N 0.21 1.89 -0.29 4.30 3.52 -0.54 -4.85 118.95 123.19 2k43 s ARG 81 Ca 0.20 -0.61 -0.15 0.00 -0.13 0.00 0.00 55.73 55.03 2k43 s ARG 81 Cb -0.14 -2.13 -0.03 0.00 -1.56 0.00 0.00 34.95 31.09 2k43 s ARG 81 CO 0.07 -0.36 0.39 -0.48 -0.81 0.00 0.00 175.30 174.11 2k43 s LEU 82 N 1.52 4.13 0.31 -0.88 0.05 -1.26 0.04 118.68 122.58 2k43 s LEU 82 Ca 0.02 0.18 -0.15 0.00 0.05 0.00 0.00 54.13 54.23 2k43 s LEU 82 Cb -0.15 -2.43 -0.09 0.00 -2.05 0.00 0.00 46.19 41.48 2k43 s LEU 82 CO -0.09 -0.24 0.72 -1.61 -0.55 0.00 0.00 176.35 174.58 2k43 s GLU 83 N 2.10 4.00 0.00 1.48 0.41 0.15 -4.99 118.70 121.84 2k43 s GLU 83 Ca 0.15 0.64 0.26 0.00 -0.41 0.00 0.00 54.97 55.61 2k43 s GLU 83 Cb -0.16 -2.48 0.75 0.00 -1.78 0.00 0.00 34.13 30.47 2k43 s GLU 83 CO 0.10 0.19 1.58 0.39 -0.49 0.00 0.00 175.26 177.03 2k43 n GLU 84 N -0.28 1.89 -0.94 1.61 1.02 -1.26 -3.17 120.64 119.52 2k43 n GLU 84 Ca 0.03 -1.30 -0.20 0.00 -0.02 0.00 0.00 57.16 55.67 2k43 n GLU 84 Cb 0.53 -1.47 0.08 0.00 -0.02 0.00 0.00 31.44 30.57 2k43 n GLU 84 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2k43 n ASN 85 N 0.57 5.31 -3.69 1.62 3.02 -1.26 -4.84 115.26 115.99 2k43 n ASN 85 Ca 0.17 -3.20 -0.23 0.00 -0.03 0.00 0.00 54.58 51.29 2k43 n ASN 85 Cb 0.43 -0.89 0.05 0.00 -0.61 0.00 0.00 39.78 38.76 2k43 n ASN 85 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2k43 n HIS 86 N -0.33 -2.18 -4.84 3.10 8.25 -1.22 -5.02 115.22 112.99 2k43 n HIS 86 Ca 0.41 0.90 -0.26 0.00 -0.26 0.00 0.00 57.72 58.50 2k43 n HIS 86 Cb 0.92 -4.50 -0.15 0.00 1.12 0.00 0.00 29.99 27.38 2k43 n HIS 86 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2k43 s TYR 87 N -3.49 1.84 -0.08 4.41 2.02 -1.19 -4.94 117.35 115.92 2k43 s TYR 87 Ca 0.23 -0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 56.56 2k43 s TYR 87 Cb -0.11 -1.14 -0.03 0.00 -0.40 0.00 0.00 41.96 40.28 2k43 s TYR 87 CO 0.79 0.03 -0.01 -0.80 -1.57 0.00 0.00 175.55 174.00 2k43 s ASN 88 N -0.82 5.17 0.13 2.29 -0.87 0.33 -0.67 114.94 120.50 2k43 s ASN 88 Ca 0.08 0.12 0.08 0.00 -1.57 0.00 0.00 52.86 51.57 2k43 s ASN 88 Cb -0.08 -1.43 -0.04 0.00 -0.02 0.00 0.00 41.25 39.68 2k43 s ASN 88 CO 0.00 0.37 -0.19 -0.89 -2.57 0.00 0.00 177.10 173.82 2k43 s THR 89 N -0.89 1.73 -0.10 1.60 2.01 0.11 -2.58 115.64 117.52 2k43 s THR 89 Ca 0.14 -1.70 0.02 0.00 0.31 0.00 0.00 61.69 60.46 2k43 s THR 89 Cb -0.11 -1.67 0.01 0.00 0.01 0.00 0.00 72.50 70.74 2k43 s THR 89 CO 0.03 -0.18 -0.16 -0.31 -0.69 0.00 0.00 174.62 173.30 2k43 s TYR 90 N -1.57 1.98 0.00 4.92 2.02 -1.26 -1.47 117.35 121.97 2k43 s TYR 90 Ca 0.10 -0.86 -0.01 0.00 -0.37 0.00 0.00 57.07 55.93 2k43 s TYR 90 Cb -0.08 -1.40 -0.04 0.00 -0.40 0.00 0.00 41.96 40.04 2k43 s TYR 90 CO 0.05 -0.42 0.12 -1.50 -1.57 0.00 0.00 175.55 172.23 2k43 s ILE 91 N 0.76 4.98 -0.18 2.71 1.10 0.65 -0.98 121.20 130.25 2k43 s ILE 91 Ca -0.11 -0.35 -0.25 0.00 -0.51 0.00 0.00 60.65 59.42 2k43 s ILE 91 Cb -0.16 -3.31 -0.01 0.00 0.15 0.00 0.00 42.46 39.13 2k43 s ILE 91 CO 0.02 0.32 0.84 -0.94 -2.11 0.00 0.00 174.94 173.06 2k43 s SER 92 N -1.89 6.95 0.00 4.50 1.04 -1.20 0.10 113.70 123.20 2k43 s SER 92 Ca 0.25 1.17 0.31 0.00 0.48 0.00 0.00 55.95 58.16 2k43 s SER 92 Cb -0.12 -2.45 1.74 0.00 0.10 0.00 0.00 66.02 65.28 2k43 s SER 92 CO 0.17 -0.42 2.14 1.17 0.98 0.00 0.00 173.24 177.28 2k43 n LYS 93 N 5.33 0.79 0.00 4.02 4.81 -1.20 0.15 118.16 132.06 2k43 n LYS 93 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.49 2k43 n LYS 93 Cb 0.49 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.04 2k43 n LYS 93 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2k43 n LYS 94 N -1.10 0.00 -1.11 1.64 4.76 -1.26 -4.59 118.16 116.50 2k43 n LYS 94 Ca 0.20 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.39 2k43 n LYS 94 Cb 0.15 -0.27 0.09 0.00 -1.84 0.00 0.00 35.03 33.16 2k43 n LYS 94 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2k43 n HIS 95 N -0.10 2.56 -0.29 2.13 8.25 -1.15 -4.54 115.22 122.09 2k43 n HIS 95 Ca 0.00 -2.32 0.10 0.00 -0.26 0.00 0.00 57.72 55.24 2k43 n HIS 95 Cb 0.00 -1.13 0.25 0.00 1.12 0.00 0.00 29.99 30.23 2k43 n HIS 95 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2k43 h ALA 96 N 1.62 1.27 0.00 -1.41 0.00 0.12 -0.72 119.26 120.14 2k43 h ALA 96 Ca 0.50 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.52 2k43 h ALA 96 Cb 1.35 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 2k43 h ALA 96 CO 1.17 -0.29 -0.16 1.05 0.00 0.00 0.00 179.25 181.02 2k43 h GLU 97 N 0.41 0.00 -0.02 0.00 -0.00 -1.83 -0.68 114.58 112.47 2k43 h GLU 97 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.86 2k43 h GLU 97 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.63 2k43 h GLU 97 CO -0.49 0.16 -0.02 1.17 -0.00 0.00 0.00 179.01 179.83 2k43 n LYS 98 N -3.71 1.85 -0.97 1.06 4.81 -0.39 -4.92 118.16 115.89 2k43 n LYS 98 Ca -0.02 -1.28 0.00 0.00 -0.87 0.00 0.00 58.31 56.15 2k43 n LYS 98 Cb 0.27 -1.47 0.00 0.00 0.02 0.00 0.00 35.03 33.85 2k43 n LYS 98 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2k43 n ASN 99 N 0.54 -2.92 -4.82 3.14 5.03 -0.26 -5.03 115.26 110.94 2k43 n ASN 99 Ca 0.17 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 55.29 2k43 n ASN 99 Cb 0.44 -0.49 -0.02 0.00 -1.02 0.00 0.00 39.78 38.69 2k43 n ASN 99 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 2k43 s TRP 100 N -2.00 3.24 0.12 3.10 0.52 -0.55 -4.92 118.94 118.44 2k43 s TRP 100 Ca 0.00 1.51 0.08 0.00 0.02 0.00 0.00 56.10 57.71 2k43 s TRP 100 Cb 0.00 -2.90 -0.04 0.00 -1.15 0.00 0.00 33.47 29.38 2k43 s TRP 100 CO 0.00 -0.62 -0.13 -0.06 0.02 0.00 0.00 176.95 176.15 2k43 s PHE 101 N -2.44 2.65 -0.32 -1.98 0.40 -1.26 -3.25 117.98 111.78 2k43 s PHE 101 Ca 0.62 -0.20 -0.24 0.00 -0.60 0.00 0.00 56.93 56.50 2k43 s PHE 101 Cb -0.12 -1.39 0.01 0.00 0.51 0.00 0.00 43.02 42.02 2k43 s PHE 101 CO 0.29 0.42 0.85 0.08 0.70 0.00 0.00 175.22 177.56 2k43 s VAL 102 N -1.22 4.72 -0.06 -0.44 1.01 -0.15 -4.66 120.40 119.60 2k43 s VAL 102 Ca 0.20 1.22 0.04 0.00 0.00 0.00 0.00 61.98 63.44 2k43 s VAL 102 Cb -0.11 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2k43 s VAL 102 CO 0.12 -0.35 -0.17 -0.83 0.00 0.00 0.00 175.10 173.88 2k43 s GLY 103 N 1.69 0.94 -0.10 4.51 0.00 -1.26 -4.50 107.32 108.60 2k43 s GLY 103 Ca 0.35 -0.65 -0.00 0.00 0.00 0.00 0.00 44.72 44.42 2k43 s GLY 103 CO 0.14 -0.22 -0.07 -2.27 0.00 0.00 0.00 173.10 170.69 2k43 s LEU 104 N 0.25 1.14 -0.61 0.66 2.96 -1.17 -1.38 118.68 120.53 2k43 s LEU 104 Ca -0.09 -0.25 -0.16 0.00 -0.22 0.00 0.00 54.13 53.42 2k43 s LEU 104 Cb -0.13 -0.74 0.15 0.00 0.50 0.00 0.00 46.19 45.96 2k43 s LEU 104 CO 0.03 -0.11 0.57 -0.75 -1.32 0.00 0.00 176.35 174.78 2k43 s LYS 105 N 1.58 3.13 0.44 1.98 2.36 -0.95 -4.57 119.74 123.71 2k43 s LYS 105 Ca 0.02 -1.85 0.23 0.00 -2.55 0.00 0.00 55.97 51.82 2k43 s LYS 105 Cb -0.13 -4.33 0.96 0.00 -1.05 0.00 0.00 37.83 33.28 2k43 s LYS 105 CO -0.06 -1.34 1.85 1.57 1.55 0.00 0.00 175.35 178.92 2k43 h LYS 106 N 8.66 0.00 0.00 4.03 2.10 -1.90 1.14 116.57 130.60 2k43 h LYS 106 Ca -0.21 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.44 2k43 h LYS 106 Cb 1.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 2k43 h LYS 106 CO 0.98 0.24 0.00 -1.71 -2.00 0.00 0.00 179.45 176.96 2k43 n ASN 107 N -3.47 0.00 0.00 7.07 5.15 -1.26 -1.69 115.26 121.06 2k43 n ASN 107 Ca -0.00 0.46 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 2k43 n ASN 107 Cb 0.41 -0.48 0.00 0.00 -0.53 0.00 0.00 39.78 39.18 2k43 n ASN 107 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k43 n GLY 108 N 0.19 0.40 3.63 8.20 0.00 -0.22 -4.89 105.19 112.50 2k43 n GLY 108 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 2k43 n GLY 108 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k43 s SER 109 N 1.00 -0.39 -0.59 1.61 0.15 0.38 -1.24 113.70 114.62 2k43 s SER 109 Ca 0.00 -0.27 -0.21 0.00 0.70 0.00 0.00 55.95 56.17 2k43 s SER 109 Cb 0.00 0.62 0.08 0.00 -1.71 0.00 0.00 66.02 65.00 2k43 s SER 109 CO 0.00 -1.07 0.79 0.00 1.20 0.00 0.00 173.24 174.15 2k43 s LYS 111 N 3.21 0.53 -0.37 0.00 0.00 -1.23 -0.93 119.74 120.96 2k43 s LYS 111 Ca 0.18 -0.63 0.02 0.00 0.00 0.00 0.00 55.97 55.53 2k43 s LYS 111 Cb -0.20 -1.84 0.15 0.00 0.00 0.00 0.00 37.83 35.94 2k43 s LYS 111 CO 0.10 -0.84 0.30 1.03 0.00 0.00 0.00 175.35 175.95 2k43 s ARG 112 N 1.85 0.64 0.00 1.78 0.52 0.16 -4.69 118.95 119.21 2k43 s ARG 112 Ca 0.05 -1.25 0.00 0.00 -0.52 0.00 0.00 55.73 54.01 2k43 s ARG 112 Cb -0.17 -1.06 0.00 0.00 0.52 0.00 0.00 34.95 34.24 2k43 s ARG 112 CO -0.20 -1.23 0.00 0.41 0.02 0.00 0.00 175.30 174.30 2k43 n GLY 113 N 3.93 -0.31 0.33 -3.53 0.00 0.29 -4.05 105.19 101.84 2k43 n GLY 113 Ca 0.14 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.34 2k43 n GLY 113 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2k43 h PRO 114 N 0.00 0.00 0.00 1.61 0.11 -1.93 -2.08 132.00 129.70 2k43 h PRO 114 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2k43 h PRO 114 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2k43 h PRO 114 CO 0.00 0.00 -1.45 0.54 -0.21 0.00 0.00 178.00 176.88 2k43 n ARG 115 N -3.58 0.46 -1.90 1.05 3.00 -1.26 -4.87 116.66 109.56 2k43 n ARG 115 Ca -0.01 -0.10 -0.41 0.00 -0.01 0.00 0.00 57.85 57.33 2k43 n ARG 115 Cb 0.22 -1.48 -0.03 0.00 0.00 0.00 0.00 32.46 31.17 2k43 n ARG 115 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2k43 s THR 116 N -3.19 3.32 -4.92 0.55 -4.23 -0.79 -3.47 115.64 102.92 2k43 s THR 116 Ca 0.00 0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.80 2k43 s THR 116 Cb 0.14 -3.55 0.00 0.00 1.34 0.00 0.00 72.50 70.43 2k43 s THR 116 CO 0.85 -0.43 0.00 1.41 -0.54 0.00 0.00 174.62 175.91 2k43 n HIS 117 N 11.81 0.00 -2.77 3.99 8.25 -1.26 -4.23 115.22 131.01 2k43 n HIS 117 Ca 0.25 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.28 2k43 n HIS 117 Cb 0.49 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.59 2k43 n HIS 117 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 2k43 s TYR 118 N -2.12 3.10 -0.17 4.41 1.13 -1.26 -3.95 117.35 118.50 2k43 s TYR 118 Ca 0.00 -1.76 -0.02 0.00 -1.41 0.00 0.00 57.07 53.88 2k43 s TYR 118 Cb 0.00 -4.51 -0.09 0.00 -1.10 0.00 0.00 41.96 36.25 2k43 s TYR 118 CO 0.00 -1.61 -0.17 0.41 -2.51 0.00 0.00 175.55 171.67 2k43 n GLY 119 N 4.98 -0.24 2.94 5.49 0.00 -1.23 -5.06 105.19 112.08 2k43 n GLY 119 Ca 0.40 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 46.20 2k43 n GLY 119 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k43 s GLN 120 N -2.32 0.10 -0.01 1.61 1.11 -1.25 -5.03 119.66 113.87 2k43 s GLN 120 Ca -0.23 0.01 0.04 0.00 0.01 0.00 0.00 55.36 55.20 2k43 s GLN 120 Cb 0.07 0.04 0.13 0.00 -1.01 0.00 0.00 33.01 32.25 2k43 s GLN 120 CO 0.35 -0.01 1.05 1.63 0.01 0.00 0.00 175.29 178.31 2k43 n LYS 121 N 2.89 1.40 0.00 2.91 5.02 -1.26 -3.13 118.16 125.99 2k43 n LYS 121 Ca -0.13 -0.54 0.08 0.00 -2.02 0.00 0.00 58.31 55.70 2k43 n LYS 121 Cb 0.59 -1.20 0.47 0.00 -0.02 0.00 0.00 35.03 34.88 2k43 n LYS 121 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2k43 n ALA 122 N -0.04 2.27 1.45 7.82 0.00 -1.26 -0.86 120.51 129.88 2k43 n ALA 122 Ca 0.05 -0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.52 2k43 n ALA 122 Cb 0.17 -1.26 0.49 0.00 0.00 0.00 0.00 19.45 18.86 2k43 n ALA 122 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2k43 n ILE 123 N -0.87 0.03 -3.30 0.00 5.41 -1.19 -3.07 119.36 116.37 2k43 n ILE 123 Ca 0.12 -0.27 -0.44 0.00 1.00 0.00 0.00 62.75 63.16 2k43 n ILE 123 Cb 0.05 0.51 -0.07 0.00 -0.71 0.00 0.00 39.64 39.42 2k43 n ILE 123 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2k43 s LEU 124 N -1.94 5.27 0.22 1.39 1.43 -0.04 -4.65 118.68 120.36 2k43 s LEU 124 Ca 0.37 -1.07 0.08 0.00 -1.03 0.00 0.00 54.13 52.48 2k43 s LEU 124 Cb 0.21 -2.30 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 2k43 s LEU 124 CO 0.32 -0.71 -0.14 -0.36 0.23 0.00 0.00 176.35 175.69 2k43 s PHE 125 N 2.06 1.82 0.01 0.29 0.40 -1.07 -1.75 117.98 119.74 2k43 s PHE 125 Ca 0.09 -0.56 0.05 0.00 -0.60 0.00 0.00 56.93 55.92 2k43 s PHE 125 Cb -0.21 -0.86 -0.02 0.00 0.51 0.00 0.00 43.02 42.44 2k43 s PHE 125 CO 0.10 0.40 -0.16 -0.51 0.70 0.00 0.00 175.22 175.74 2k43 s LEU 126 N -3.36 2.08 -0.42 -0.37 1.02 -0.15 -0.51 118.68 116.98 2k43 s LEU 126 Ca 0.24 -0.36 -0.12 0.00 0.02 0.00 0.00 54.13 53.91 2k43 s LEU 126 Cb -0.01 -0.80 0.05 0.00 0.02 0.00 0.00 46.19 45.46 2k43 s LEU 126 CO 0.09 0.16 0.28 -2.16 0.02 0.00 0.00 176.35 174.74 2k43 s PRO 127 N -0.65 2.82 -0.23 1.29 0.04 -1.26 -2.16 135.00 134.84 2k43 s PRO 127 Ca 0.05 -1.26 0.01 0.00 0.04 0.00 0.00 61.00 59.85 2k43 s PRO 127 Cb -0.07 -3.88 0.05 0.00 0.04 0.00 0.00 34.50 30.64 2k43 s PRO 127 CO 0.00 -0.87 -0.08 -0.51 0.04 0.00 0.00 177.00 175.58 2k43 s LEU 128 N 1.56 2.64 0.64 -3.56 1.43 -1.20 -4.91 118.68 115.28 2k43 s LEU 128 Ca 0.03 -1.11 -0.09 0.00 -1.03 0.00 0.00 54.13 51.93 2k43 s LEU 128 Cb -0.22 -1.28 0.01 0.00 0.03 0.00 0.00 46.19 44.73 2k43 s LEU 128 CO 0.06 -0.19 1.00 -2.16 0.23 0.00 0.00 176.35 175.28 2k43 s PRO 129 N 1.33 2.96 0.29 1.29 0.05 -1.26 0.71 135.00 140.37 2k43 s PRO 129 Ca -0.05 0.27 -0.30 0.00 0.05 0.00 0.00 61.00 60.97 2k43 s PRO 129 Cb -0.18 -2.15 -0.13 0.00 0.05 0.00 0.00 34.50 32.10 2k43 s PRO 129 CO -0.07 -0.83 1.40 1.55 0.05 0.00 0.00 177.00 179.10 2k43 n VAL 130 N -2.78 1.38 -2.85 -0.36 3.14 -0.67 -4.80 118.33 111.39 2k43 n VAL 130 Ca 0.06 -0.35 -0.29 0.00 -2.96 0.00 0.00 64.34 60.80 2k43 n VAL 130 Cb 0.57 -1.61 -0.02 0.00 -1.06 0.00 0.00 33.84 31.72 2k43 n VAL 130 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2k43 s SER 131 N 0.09 6.41 -0.27 6.55 0.01 -1.26 -0.56 113.70 124.67 2k43 s SER 131 Ca 0.62 0.98 -0.18 0.00 1.31 0.00 0.00 55.95 58.68 2k43 s SER 131 Cb -0.59 -2.26 -0.02 0.00 0.21 0.00 0.00 66.02 63.36 2k43 s SER 131 CO 0.55 -0.44 0.54 -0.44 0.41 0.00 0.00 173.24 173.86 2k43 s SER 132 N -3.55 6.45 0.00 2.44 0.01 -1.26 -2.93 113.70 114.86 2k43 s SER 132 Ca 0.48 0.49 0.19 0.00 1.31 0.00 0.00 55.95 58.42 2k43 s SER 132 Cb -0.10 -2.29 0.15 0.00 0.21 0.00 0.00 66.02 63.98 2k43 s SER 132 CO 0.36 -0.33 1.09 0.47 0.41 0.00 0.00 173.24 175.24