#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kin s ASP 3 N 0.00 1.04 0.47 0.00 1.11 -1.26 -5.15 116.67 112.88 3kin s ASP 3 Ca 0.00 -0.16 -0.21 0.00 0.18 0.00 0.00 52.55 52.36 3kin s ASP 3 Cb 0.00 0.65 -0.09 0.00 1.07 0.00 0.00 42.92 44.55 3kin s ASP 3 CO 0.00 -0.33 1.03 -2.84 1.18 0.00 0.00 175.17 174.21 3kin s PRO 4 N 2.41 3.91 0.08 8.23 0.02 -1.26 -5.07 135.00 143.31 3kin s PRO 4 Ca 0.09 1.35 0.04 0.00 0.02 0.00 0.00 61.00 62.50 3kin s PRO 4 Cb -0.15 -2.17 -0.04 0.00 0.02 0.00 0.00 34.50 32.16 3kin s PRO 4 CO -0.17 -0.34 0.01 0.00 -0.33 0.00 0.00 177.00 176.17 3kin s ALA 5 N -1.96 3.34 0.70 -1.55 0.00 -1.26 -5.11 121.76 115.91 3kin s ALA 5 Ca 0.65 -1.08 -0.13 0.00 0.00 0.00 0.00 51.96 51.40 3kin s ALA 5 Cb -0.16 -1.25 0.02 0.00 0.00 0.00 0.00 23.12 21.73 3kin s ALA 5 CO 0.20 0.70 1.11 -1.21 0.00 0.00 0.00 175.76 176.56 3kin s GLU 6 N -2.22 2.59 -0.30 0.00 0.41 -1.26 -5.05 118.70 112.87 3kin s GLU 6 Ca 0.26 1.33 -0.10 0.00 -0.41 0.00 0.00 54.97 56.05 3kin s GLU 6 Cb -0.12 -1.93 0.16 0.00 -1.78 0.00 0.00 34.13 30.46 3kin s GLU 6 CO 0.18 -1.40 0.78 0.00 -0.49 0.00 0.00 175.26 174.33 3kin s SER 8 N 2.77 5.60 0.06 0.00 0.01 -1.26 -4.94 113.70 115.93 3kin s SER 8 Ca 0.01 2.64 -0.31 0.00 1.31 0.00 0.00 55.95 59.61 3kin s SER 8 Cb -0.11 -2.63 -0.06 0.00 0.21 0.00 0.00 66.02 63.44 3kin s SER 8 CO -0.18 -1.34 1.25 -0.63 0.41 0.00 0.00 173.24 172.75 3kin s ILE 9 N -1.36 3.89 0.55 1.44 1.01 -1.26 -5.01 121.20 120.46 3kin s ILE 9 Ca 0.68 1.35 -0.16 0.00 0.00 0.00 0.00 60.65 62.51 3kin s ILE 9 Cb -0.37 -3.86 -0.06 0.00 0.01 0.00 0.00 42.46 38.17 3kin s ILE 9 CO 0.45 0.09 1.02 -0.54 0.00 0.00 0.00 174.94 175.95 3kin s LYS 10 N 1.25 3.68 -0.03 2.79 1.02 -1.26 -5.05 119.74 122.13 3kin s LYS 10 Ca 0.60 1.07 0.00 0.00 0.02 0.00 0.00 55.97 57.66 3kin s LYS 10 Cb -0.31 -2.09 0.03 0.00 -0.52 0.00 0.00 37.83 34.94 3kin s LYS 10 CO 0.29 -0.50 -0.00 0.08 -0.92 0.00 0.00 175.35 174.29 3kin s VAL 11 N -2.54 0.21 -0.11 3.17 1.01 -1.26 -5.03 120.40 115.86 3kin s VAL 11 Ca 0.61 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.64 3kin s VAL 11 Cb -0.13 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 3kin s VAL 11 CO 0.33 0.15 -0.03 -0.04 0.00 0.00 0.00 175.10 175.51 3kin s MET 12 N 1.02 3.17 -0.41 2.72 -1.94 -1.26 -2.03 119.30 120.57 3kin s MET 12 Ca -0.10 -0.49 -0.09 0.00 -1.71 0.00 0.00 55.69 53.30 3kin s MET 12 Cb -0.14 -2.78 0.08 0.00 2.01 0.00 0.00 34.83 34.01 3kin s MET 12 CO -0.02 0.52 0.25 0.00 -0.01 0.00 0.00 175.02 175.76 3kin s ARG 14 N 1.40 3.99 -0.08 0.00 3.52 -1.26 0.26 118.95 126.78 3kin s ARG 14 Ca 0.03 -0.33 0.01 0.00 -0.13 0.00 0.00 55.73 55.31 3kin s ARG 14 Cb -0.23 -3.29 -0.03 0.00 -1.56 0.00 0.00 34.95 29.84 3kin s ARG 14 CO 0.02 0.21 -0.10 -0.06 -0.81 0.00 0.00 175.30 174.56 3kin s PHE 15 N 0.55 2.85 0.19 5.12 0.08 0.19 -4.95 117.98 122.01 3kin s PHE 15 Ca 0.04 -0.17 0.04 0.00 0.12 0.00 0.00 56.93 56.96 3kin s PHE 15 Cb -0.13 -1.73 -0.03 0.00 -0.57 0.00 0.00 43.02 40.56 3kin s PHE 15 CO 0.01 0.16 0.28 0.50 -0.10 0.00 0.00 175.22 176.07 3kin s ARG 16 N -0.48 3.32 0.66 0.44 3.52 -1.26 -2.30 118.95 122.85 3kin s ARG 16 Ca 0.07 -0.73 -0.15 0.00 -0.13 0.00 0.00 55.73 54.79 3kin s ARG 16 Cb -0.12 -2.86 0.00 0.00 -1.56 0.00 0.00 34.95 30.41 3kin s ARG 16 CO 0.02 0.48 1.12 -1.25 -0.81 0.00 0.00 175.30 174.86 3kin s PRO 17 N -3.51 2.73 0.22 5.12 0.04 -1.26 -4.84 135.00 133.51 3kin s PRO 17 Ca 0.34 1.46 -0.30 0.00 0.04 0.00 0.00 61.00 62.53 3kin s PRO 17 Cb -0.10 -1.94 -0.10 0.00 0.04 0.00 0.00 34.50 32.40 3kin s PRO 17 CO 0.28 -1.31 1.47 -0.51 0.04 0.00 0.00 177.00 176.96 3kin s LEU 18 N -4.85 4.38 0.24 -3.56 1.43 -1.26 -4.99 118.68 110.08 3kin s LEU 18 Ca 0.68 2.64 0.05 0.00 -1.03 0.00 0.00 54.13 56.48 3kin s LEU 18 Cb -0.22 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.36 3kin s LEU 18 CO 0.41 -0.73 0.35 0.54 0.23 0.00 0.00 176.35 177.15 3kin s ASN 19 N 0.57 6.24 0.09 2.29 2.20 -1.26 -4.76 114.94 120.31 3kin s ASN 19 Ca 0.62 0.04 -0.07 0.00 -0.94 0.00 0.00 52.86 52.50 3kin s ASN 19 Cb -0.42 -1.81 0.08 0.00 -2.00 0.00 0.00 41.25 37.10 3kin s ASN 19 CO 0.40 -0.08 0.61 1.21 -2.94 0.00 0.00 177.10 176.30 3kin n GLU 20 N -1.39 -0.10 0.49 3.55 2.13 -1.26 0.33 120.64 124.38 3kin n GLU 20 Ca -0.09 0.60 -0.20 0.00 0.66 0.00 0.00 57.16 58.13 3kin n GLU 20 Cb 0.57 -0.89 -0.10 0.00 0.27 0.00 0.00 31.44 31.29 3kin n GLU 20 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3kin h ALA 21 N 0.50 -1.29 -0.71 4.31 0.00 -1.99 -1.78 119.26 118.30 3kin h ALA 21 Ca 0.13 -0.27 0.15 0.00 0.00 0.00 0.00 54.91 54.92 3kin h ALA 21 Cb 0.23 0.53 -0.13 0.00 0.00 0.00 0.00 17.79 18.42 3kin h ALA 21 CO -0.39 -1.23 -0.08 0.93 0.00 0.00 0.00 179.25 178.49 3kin h GLU 22 N -1.27 0.05 0.53 0.00 5.08 -0.50 -0.49 114.58 117.98 3kin h GLU 22 Ca -0.12 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 3kin h GLU 22 Cb 0.99 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 3kin h GLU 22 CO 0.18 0.04 -0.51 0.82 -1.00 0.00 0.00 179.01 178.54 3kin h ILE 23 N 0.06 0.01 -0.79 3.13 2.04 -0.84 -2.24 117.51 118.87 3kin h ILE 23 Ca 0.37 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.41 3kin h ILE 23 Cb 0.61 0.01 -0.14 0.00 -0.74 0.00 0.00 36.82 36.55 3kin h ILE 23 CO -0.67 0.00 -0.03 0.25 0.00 0.00 0.00 178.15 177.70 3kin h LEU 24 N -1.03 -0.43 0.00 1.44 5.85 -0.41 1.26 115.31 122.00 3kin h LEU 24 Ca -0.07 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3kin h LEU 24 Cb 0.89 0.39 0.00 0.00 0.37 0.00 0.00 40.66 42.31 3kin h LEU 24 CO -0.05 -0.21 0.00 -1.14 -0.34 0.00 0.00 178.44 176.69 3kin n ARG 25 N -5.39 0.45 -2.02 1.25 0.63 -0.28 -4.84 116.66 106.45 3kin n ARG 25 Ca 0.14 0.00 -0.19 0.00 -0.92 0.00 0.00 57.85 56.89 3kin n ARG 25 Cb 0.50 -1.38 -0.04 0.00 0.45 0.00 0.00 32.46 31.98 3kin n ARG 25 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3kin n GLY 26 N -0.10 0.51 3.72 5.14 0.00 0.43 -4.98 105.19 109.92 3kin n GLY 26 Ca 0.08 -0.10 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 3kin n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kin n ASP 27 N -1.36 1.94 -4.64 1.61 9.92 -0.87 -5.03 116.55 118.12 3kin n ASP 27 Ca -0.21 0.80 -0.31 0.00 -0.53 0.00 0.00 54.79 54.54 3kin n ASP 27 Cb 0.65 -1.55 -0.09 0.00 -0.64 0.00 0.00 41.12 39.49 3kin n ASP 27 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 3kin s LYS 28 N -3.47 2.54 -0.43 -1.24 0.00 -1.26 -4.82 119.74 111.07 3kin s LYS 28 Ca 0.82 -0.78 -0.28 0.00 0.00 0.00 0.00 55.97 55.73 3kin s LYS 28 Cb -0.37 -2.52 -0.01 0.00 0.00 0.00 0.00 37.83 34.92 3kin s LYS 28 CO 0.42 0.57 1.73 0.12 0.00 0.00 0.00 175.35 178.19 3kin s PHE 29 N -1.15 1.89 0.11 1.78 5.36 -1.26 -4.94 117.98 119.77 3kin s PHE 29 Ca 0.21 0.67 -0.06 0.00 -0.96 0.00 0.00 56.93 56.79 3kin s PHE 29 Cb -0.11 -4.16 -0.14 0.00 -0.34 0.00 0.00 43.02 38.27 3kin s PHE 29 CO 0.13 -2.57 1.27 -0.84 -1.46 0.00 0.00 175.22 171.74 3kin h ILE 30 N 6.75 1.39 -3.94 3.12 3.07 -1.97 -3.46 117.51 122.47 3kin h ILE 30 Ca -0.30 -2.47 -0.53 0.00 1.55 0.00 0.00 64.86 63.11 3kin h ILE 30 Cb 1.15 2.47 0.09 0.00 -0.27 0.00 0.00 36.82 40.26 3kin h ILE 30 CO 1.10 0.74 0.67 -2.16 -1.05 0.00 0.00 178.15 177.44 3kin s PRO 31 N -3.22 4.04 -0.17 0.16 0.04 -1.26 -3.82 135.00 130.77 3kin s PRO 31 Ca -0.06 2.30 0.01 0.00 0.04 0.00 0.00 61.00 63.28 3kin s PRO 31 Cb 0.08 -2.86 0.03 0.00 0.04 0.00 0.00 34.50 31.80 3kin s PRO 31 CO 0.88 -0.48 -0.12 0.21 0.04 0.00 0.00 177.00 177.52 3kin s LYS 32 N -2.14 2.15 -0.11 4.56 2.47 -0.17 -4.98 119.74 121.53 3kin s LYS 32 Ca 0.55 -0.69 -0.14 0.00 -1.56 0.00 0.00 55.97 54.13 3kin s LYS 32 Cb -0.41 -2.24 -0.05 0.00 -1.46 0.00 0.00 37.83 33.67 3kin s LYS 32 CO 0.54 -0.33 0.35 -0.06 0.16 0.00 0.00 175.35 176.01 3kin s PHE 33 N 1.45 3.55 -0.22 4.03 0.08 -1.26 -0.53 117.98 125.08 3kin s PHE 33 Ca 0.02 0.75 -0.01 0.00 0.12 0.00 0.00 56.93 57.81 3kin s PHE 33 Cb -0.14 -2.34 0.06 0.00 -0.57 0.00 0.00 43.02 40.03 3kin s PHE 33 CO -0.09 0.37 -0.01 0.21 -0.10 0.00 0.00 175.22 175.60 3kin s LYS 34 N -0.03 1.16 2.54 0.44 2.36 -1.14 -5.01 119.74 120.05 3kin s LYS 34 Ca 0.20 -0.75 0.00 0.00 -2.55 0.00 0.00 55.97 52.87 3kin s LYS 34 Cb -0.14 -2.36 0.00 0.00 -1.05 0.00 0.00 37.83 34.27 3kin s LYS 34 CO 0.08 -0.64 0.00 0.41 1.55 0.00 0.00 175.35 176.75 3kin n GLY 35 N 4.84 -0.85 0.64 5.54 0.00 -1.26 -3.11 105.19 111.00 3kin n GLY 35 Ca -0.10 -1.18 0.10 0.00 0.00 0.00 0.00 46.02 44.84 3kin n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kin n GLU 36 N 0.00 1.65 -0.12 1.61 1.02 -1.26 -4.64 120.64 118.90 3kin n GLU 36 Ca 0.00 -1.32 0.00 0.00 -0.02 0.00 0.00 57.16 55.82 3kin n GLU 36 Cb 0.00 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 3kin n GLU 36 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3kin n GLU 37 N 0.50 0.00 -4.69 3.49 0.28 -1.26 -0.59 120.64 118.38 3kin n GLU 37 Ca 0.10 -0.36 -0.30 0.00 -0.16 0.00 0.00 57.16 56.44 3kin n GLU 37 Cb 0.48 -0.29 -0.13 0.00 1.43 0.00 0.00 31.44 32.93 3kin n GLU 37 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 3kin s THR 38 N 0.00 2.50 -0.07 3.84 2.01 -1.18 0.42 115.64 123.16 3kin s THR 38 Ca 0.00 -1.35 -0.03 0.00 0.31 0.00 0.00 61.69 60.62 3kin s THR 38 Cb 0.00 -2.04 0.04 0.00 0.01 0.00 0.00 72.50 70.51 3kin s THR 38 CO 0.00 0.30 0.16 0.54 -0.69 0.00 0.00 174.62 174.93 3kin s VAL 39 N -0.92 -0.11 -0.09 3.82 0.11 0.16 -2.88 120.40 120.49 3kin s VAL 39 Ca 0.14 0.22 -0.02 0.00 -2.93 0.00 0.00 61.98 59.40 3kin s VAL 39 Cb -0.10 -0.27 -0.03 0.00 -1.53 0.00 0.00 36.38 34.45 3kin s VAL 39 CO 0.05 0.09 -0.02 -0.69 -3.33 0.00 0.00 175.10 171.20 3kin s VAL 40 N 1.49 4.15 -0.48 2.04 1.01 0.31 -0.30 120.40 128.62 3kin s VAL 40 Ca -0.06 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 3kin s VAL 40 Cb -0.12 -2.75 0.13 0.00 0.00 0.00 0.00 36.38 33.64 3kin s VAL 40 CO -0.06 0.58 0.31 -0.63 0.00 0.00 0.00 175.10 175.30 3kin s ILE 41 N -0.65 3.75 0.00 2.22 1.09 -1.26 -1.00 121.20 125.35 3kin s ILE 41 Ca 0.10 -2.12 0.00 0.00 -1.10 0.00 0.00 60.65 57.53 3kin s ILE 41 Cb -0.12 -3.50 0.00 0.00 -1.06 0.00 0.00 42.46 37.78 3kin s ILE 41 CO 0.02 -0.76 0.00 0.61 -0.10 0.00 0.00 174.94 174.71 3kin n GLY 42 N 4.51 0.89 2.32 6.18 0.00 -1.25 -2.34 105.19 115.50 3kin n GLY 42 Ca -0.02 0.50 -0.21 0.00 0.00 0.00 0.00 46.02 46.29 3kin n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3kin n GLN 43 N 0.00 3.14 -4.74 1.61 3.00 -1.26 -5.03 117.38 114.09 3kin n GLN 43 Ca 0.00 -4.14 -0.32 0.00 -0.01 0.00 0.00 57.00 52.53 3kin n GLN 43 Cb 0.00 -2.11 -0.08 0.00 0.00 0.00 0.00 30.24 28.05 3kin n GLN 43 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 3kin s GLY 44 N -3.56 2.98 0.33 1.08 0.00 -0.99 -5.09 107.32 102.07 3kin s GLY 44 Ca 0.45 -0.50 -0.29 0.00 0.00 0.00 0.00 44.72 44.38 3kin s GLY 44 CO -0.05 -2.18 1.51 1.17 0.00 0.00 0.00 173.10 173.56 3kin n LYS 45 N -1.23 2.59 -2.13 2.90 4.81 -1.26 -4.61 118.16 119.23 3kin n LYS 45 Ca -0.18 0.91 -0.36 0.00 -0.87 0.00 0.00 58.31 57.81 3kin n LYS 45 Cb 0.67 -2.65 0.01 0.00 0.02 0.00 0.00 35.03 33.08 3kin n LYS 45 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 3kin s PRO 46 N -1.30 3.37 -0.18 1.64 0.02 -1.26 -4.70 135.00 132.59 3kin s PRO 46 Ca 0.59 1.81 -0.07 0.00 0.02 0.00 0.00 61.00 63.35 3kin s PRO 46 Cb -0.50 -2.16 -0.04 0.00 0.02 0.00 0.00 34.50 31.82 3kin s PRO 46 CO 0.56 -0.88 0.05 0.71 -0.33 0.00 0.00 177.00 177.11 3kin s TYR 47 N -1.58 3.21 -0.15 6.54 1.51 0.59 -4.93 117.35 122.54 3kin s TYR 47 Ca 0.71 -0.01 0.02 0.00 -1.01 0.00 0.00 57.07 56.77 3kin s TYR 47 Cb -0.29 -2.07 0.02 0.00 -0.11 0.00 0.00 41.96 39.51 3kin s TYR 47 CO 0.34 0.10 -0.19 0.08 -1.11 0.00 0.00 175.55 174.77 3kin s VAL 48 N 0.42 1.90 0.37 0.71 1.01 -1.26 0.40 120.40 123.95 3kin s VAL 48 Ca 0.02 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.18 3kin s VAL 48 Cb -0.13 -1.71 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 3kin s VAL 48 CO 0.01 0.52 0.05 -0.36 0.00 0.00 0.00 175.10 175.31 3kin s PHE 49 N 1.08 2.09 0.17 5.22 0.08 0.17 -5.00 117.98 121.79 3kin s PHE 49 Ca -0.02 -0.92 -0.18 0.00 0.12 0.00 0.00 56.93 55.94 3kin s PHE 49 Cb -0.14 -1.43 0.11 0.00 -0.57 0.00 0.00 43.02 40.99 3kin s PHE 49 CO -0.06 0.11 1.64 -0.44 -0.10 0.00 0.00 175.22 176.37 3kin h ASP 50 N 1.93 -0.56 -4.90 1.36 5.19 -1.69 -3.42 116.42 114.32 3kin h ASP 50 Ca -0.41 0.15 -0.14 0.00 -0.62 0.00 0.00 57.03 56.01 3kin h ASP 50 Cb 1.25 0.33 -0.21 0.00 0.18 0.00 0.00 39.33 40.88 3kin h ASP 50 CO 0.72 -0.20 -0.40 -0.13 -3.12 0.00 0.00 179.24 176.11 3kin s ARG 51 N -6.18 0.54 -0.28 3.56 0.52 -1.22 -4.69 118.95 111.21 3kin s ARG 51 Ca -0.14 -0.27 0.03 0.00 -0.52 0.00 0.00 55.73 54.83 3kin s ARG 51 Cb 0.15 0.23 0.07 0.00 0.52 0.00 0.00 34.95 35.92 3kin s ARG 51 CO 0.71 -0.14 -0.07 0.08 0.02 0.00 0.00 175.30 175.90 3kin s VAL 52 N -1.26 2.14 -0.60 3.52 1.01 0.25 -1.48 120.40 123.98 3kin s VAL 52 Ca -0.13 -1.76 -0.20 0.00 0.00 0.00 0.00 61.98 59.89 3kin s VAL 52 Cb -0.06 -2.33 0.09 0.00 0.00 0.00 0.00 36.38 34.07 3kin s VAL 52 CO 0.03 -0.16 0.77 -0.76 0.00 0.00 0.00 175.10 174.98 3kin s LEU 53 N 1.08 5.00 1.02 3.92 1.43 0.71 -4.73 118.68 127.12 3kin s LEU 53 Ca -0.04 -1.19 -0.12 0.00 -1.03 0.00 0.00 54.13 51.74 3kin s LEU 53 Cb -0.20 -2.38 0.20 0.00 0.03 0.00 0.00 46.19 43.85 3kin s LEU 53 CO -0.06 -1.17 1.08 -2.84 0.23 0.00 0.00 176.35 173.58 3kin s PRO 54 N 3.10 0.22 0.52 1.29 0.02 -1.26 -0.64 135.00 138.25 3kin s PRO 54 Ca 0.16 0.76 0.25 0.00 0.02 0.00 0.00 61.00 62.18 3kin s PRO 54 Cb -0.21 -1.69 1.38 0.00 0.02 0.00 0.00 34.50 34.00 3kin s PRO 54 CO 0.09 -2.94 1.99 -1.35 -0.33 0.00 0.00 177.00 174.46 3kin h PRO 55 N -2.05 0.03 0.00 5.54 0.11 -1.78 -2.18 132.00 131.66 3kin h PRO 55 Ca -0.55 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.56 3kin h PRO 55 Cb 1.32 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3kin h PRO 55 CO 0.53 0.02 -0.10 -1.71 -0.21 0.00 0.00 178.00 176.53 3kin n ASN 56 N -4.38 0.63 -4.66 -2.05 2.85 -1.26 -4.78 115.26 101.61 3kin n ASN 56 Ca 0.10 0.47 -0.42 0.00 -0.11 0.00 0.00 54.58 54.62 3kin n ASN 56 Cb 0.62 -0.57 -0.03 0.00 1.24 0.00 0.00 39.78 41.03 3kin n ASN 56 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 3kin s THR 57 N -3.09 3.14 1.08 -0.44 2.01 -0.82 -4.96 115.64 112.56 3kin s THR 57 Ca 0.11 0.23 -0.18 0.00 0.31 0.00 0.00 61.69 62.16 3kin s THR 57 Cb 0.14 -3.15 0.26 0.00 0.01 0.00 0.00 72.50 69.76 3kin s THR 57 CO 0.60 -0.02 1.04 0.35 -0.69 0.00 0.00 174.62 175.90 3kin n THR 58 N 5.44 0.00 0.06 -0.82 -2.24 -1.26 -4.85 114.28 110.61 3kin n THR 58 Ca 0.19 -0.52 -0.09 0.00 -2.27 0.00 0.00 64.05 61.36 3kin n THR 58 Cb 0.41 -1.28 0.04 0.00 -2.10 0.00 0.00 70.33 67.40 3kin n THR 58 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3kin h GLN 59 N 0.00 0.34 0.94 -0.78 1.08 -1.87 -2.75 115.11 112.07 3kin h GLN 59 Ca -0.38 -0.28 -0.05 0.00 -1.45 0.00 0.00 58.65 56.49 3kin h GLN 59 Cb 1.13 0.06 0.01 0.00 -0.05 0.00 0.00 27.48 28.63 3kin h GLN 59 CO 0.25 0.93 -0.45 1.49 -0.95 0.00 0.00 178.83 180.10 3kin h GLU 60 N 0.23 -1.21 -0.75 1.46 4.81 -1.85 -2.40 114.58 114.86 3kin h GLU 60 Ca -0.03 0.08 0.13 0.00 -0.13 0.00 0.00 59.36 59.42 3kin h GLU 60 Cb 1.31 0.28 -0.14 0.00 0.63 0.00 0.00 28.75 30.83 3kin h GLU 60 CO 0.12 -0.81 -0.30 1.96 -0.73 0.00 0.00 179.01 179.25 3kin h GLN 61 N -1.31 -0.07 0.00 1.92 4.20 -1.94 0.41 115.11 118.33 3kin h GLN 61 Ca -0.13 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 3kin h GLN 61 Cb 0.97 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.76 3kin h GLN 61 CO 0.21 -0.05 -0.06 0.28 -0.67 0.00 0.00 178.83 178.54 3kin h VAL 62 N -0.07 0.30 0.01 -0.54 2.07 -1.47 0.83 116.25 117.38 3kin h VAL 62 Ca 0.31 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 3kin h VAL 62 Cb 0.57 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 3kin h VAL 62 CO -0.80 0.06 -0.01 0.22 0.02 0.00 0.00 177.57 177.07 3kin h TYR 63 N 0.00 -0.01 0.00 1.57 3.20 0.24 -2.54 116.97 119.42 3kin h TYR 63 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 3kin h TYR 63 Cb 0.30 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.57 3kin h TYR 63 CO 0.00 0.78 -0.06 -0.91 -1.64 0.00 0.00 178.16 176.33 3kin h ASN 64 N -0.94 0.00 0.00 -2.11 2.35 -0.45 0.84 115.58 115.27 3kin h ASN 64 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3kin h ASN 64 Cb 0.80 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.17 3kin h ASN 64 CO 0.00 0.06 -1.63 0.00 -1.65 0.00 0.00 177.43 174.22 3kin n ALA 65 N -2.31 3.35 -0.00 -0.83 0.00 0.25 -4.41 120.51 116.56 3kin n ALA 65 Ca -0.02 -0.51 -0.00 0.00 0.00 0.00 0.00 53.44 52.90 3kin n ALA 65 Cb 0.16 -0.71 -0.01 0.00 0.00 0.00 0.00 19.45 18.88 3kin n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kin n ALA 67 N -1.84 0.87 -0.31 0.00 0.00 0.26 -4.81 120.51 114.68 3kin n ALA 67 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.52 3kin n ALA 67 Cb 0.34 0.01 0.25 0.00 0.00 0.00 0.00 19.45 20.05 3kin n ALA 67 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3kin h LYS 68 N 0.00 0.64 0.00 0.00 3.64 -0.93 -1.33 116.57 118.59 3kin h LYS 68 Ca 0.00 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3kin h LYS 68 Cb 0.04 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 3kin h LYS 68 CO 0.00 0.42 -0.17 0.37 -2.27 0.00 0.00 179.45 177.80 3kin h GLN 69 N 0.66 0.00 -0.08 1.90 5.75 -1.86 -3.27 115.11 118.22 3kin h GLN 69 Ca 0.50 0.00 -0.21 0.00 -0.15 0.00 0.00 58.65 58.79 3kin h GLN 69 Cb 0.73 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.28 3kin h GLN 69 CO -0.37 0.17 -0.80 0.82 -2.65 0.00 0.00 178.83 176.00 3kin h ILE 70 N 0.00 1.35 -0.58 2.39 2.04 -1.56 -2.44 117.51 118.72 3kin h ILE 70 Ca -0.00 -2.17 0.01 0.00 1.00 0.00 0.00 64.86 63.71 3kin h ILE 70 Cb 0.93 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 39.13 3kin h ILE 70 CO 0.02 0.66 0.37 0.58 0.00 0.00 0.00 178.15 179.78 3kin h VAL 71 N 0.34 1.12 -0.51 1.67 2.07 -1.58 0.72 116.25 120.08 3kin h VAL 71 Ca -0.05 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.21 3kin h VAL 71 Cb 1.41 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3kin h VAL 71 CO 0.15 0.14 0.32 0.11 0.02 0.00 0.00 177.57 178.30 3kin h LYS 72 N 0.75 0.68 -0.43 1.57 1.57 -1.62 -1.29 116.57 117.80 3kin h LYS 72 Ca 0.22 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.83 3kin h LYS 72 Cb -0.05 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 3kin h LYS 72 CO -0.07 0.48 -0.19 -0.44 -0.57 0.00 0.00 179.45 178.66 3kin h ASP 73 N 0.68 0.85 -0.16 0.86 3.32 -1.01 -3.11 116.42 117.86 3kin h ASP 73 Ca 0.18 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 3kin h ASP 73 Cb -0.04 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 3kin h ASP 73 CO -0.04 1.03 0.06 0.58 -1.72 0.00 0.00 179.24 179.15 3kin h VAL 74 N 0.74 1.17 0.00 -1.35 2.07 -0.51 -1.47 116.25 116.89 3kin h VAL 74 Ca 0.11 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.12 3kin h VAL 74 Cb 0.72 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 3kin h VAL 74 CO 0.06 0.16 0.00 0.18 0.02 0.00 0.00 177.57 177.98 3kin n LEU 75 N -4.85 0.56 -1.01 2.57 4.77 -0.52 -1.80 117.00 116.72 3kin n LEU 75 Ca -0.05 0.74 0.11 0.00 -0.03 0.00 0.00 56.01 56.79 3kin n LEU 75 Cb 0.13 -0.79 0.16 0.00 -2.33 0.00 0.00 43.42 40.59 3kin n LEU 75 CO 0.35 -0.88 0.65 -0.62 -1.33 0.00 0.00 177.39 175.55 3kin n GLU 76 N -2.23 2.29 0.00 3.23 1.02 -0.94 -4.91 120.64 119.11 3kin n GLU 76 Ca -0.01 -2.06 0.00 0.00 -0.02 0.00 0.00 57.16 55.07 3kin n GLU 76 Cb 0.06 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 3kin n GLU 76 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3kin n GLY 77 N 1.34 1.00 3.88 0.62 0.00 -0.75 -4.96 105.19 106.33 3kin n GLY 77 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3kin n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kin s TYR 78 N -2.00 3.44 -0.34 1.61 2.02 -0.60 -4.44 117.35 117.04 3kin s TYR 78 Ca 0.00 0.80 -0.19 0.00 -0.37 0.00 0.00 57.07 57.31 3kin s TYR 78 Cb 0.00 -2.20 -0.00 0.00 -0.40 0.00 0.00 41.96 39.35 3kin s TYR 78 CO 0.00 0.31 0.55 -0.80 -1.57 0.00 0.00 175.55 174.04 3kin s ASN 79 N -2.37 6.37 -0.03 2.29 0.02 -1.26 -3.59 114.94 116.37 3kin s ASN 79 Ca 0.46 0.10 -0.01 0.00 -1.02 0.00 0.00 52.86 52.39 3kin s ASN 79 Cb -0.11 -2.29 -0.04 0.00 0.02 0.00 0.00 41.25 38.83 3kin s ASN 79 CO 0.22 -0.49 0.05 -0.83 0.02 0.00 0.00 177.10 176.07 3kin s GLY 80 N 1.74 1.96 -0.16 0.66 0.00 -1.10 -4.94 107.32 105.49 3kin s GLY 80 Ca 0.21 -0.85 -0.04 0.00 0.00 0.00 0.00 44.72 44.03 3kin s GLY 80 CO 0.13 -0.69 0.15 -1.59 0.00 0.00 0.00 173.10 171.10 3kin s THR 81 N -1.09 -0.21 -0.11 0.90 2.01 -1.26 -0.66 115.64 115.21 3kin s THR 81 Ca 0.19 -0.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.18 3kin s THR 81 Cb -0.12 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.84 3kin s THR 81 CO 0.10 -0.14 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.19 3kin s ILE 82 N 2.24 3.66 0.03 1.82 1.01 -0.45 -4.96 121.20 124.55 3kin s ILE 82 Ca 0.04 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.18 3kin s ILE 82 Cb -0.15 -2.55 -0.01 0.00 0.01 0.00 0.00 42.46 39.76 3kin s ILE 82 CO -0.09 0.54 0.07 0.72 0.00 0.00 0.00 174.94 176.18 3kin s PHE 83 N -0.12 0.20 -0.17 3.97 -0.12 -1.26 -1.52 117.98 118.96 3kin s PHE 83 Ca 0.01 -0.47 -0.05 0.00 -0.05 0.00 0.00 56.93 56.37 3kin s PHE 83 Cb -0.13 -0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.08 3kin s PHE 83 CO 0.03 -0.32 0.00 0.00 -0.05 0.00 0.00 175.22 174.88 3kin s ALA 84 N -2.25 3.14 -0.05 1.99 0.00 -0.56 -4.99 121.76 119.03 3kin s ALA 84 Ca -0.08 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.07 3kin s ALA 84 Cb -0.03 -1.72 0.01 0.00 0.00 0.00 0.00 23.12 21.37 3kin s ALA 84 CO -0.03 0.11 -0.14 -0.47 0.00 0.00 0.00 175.76 175.23 3kin s TYR 85 N 0.52 1.53 -0.04 0.00 6.14 -1.26 -2.71 117.35 121.53 3kin s TYR 85 Ca -0.01 -0.51 0.00 0.00 0.64 0.00 0.00 57.07 57.20 3kin s TYR 85 Cb -0.14 -1.08 0.00 0.00 0.42 0.00 0.00 41.96 41.17 3kin s TYR 85 CO 0.02 -0.23 0.00 0.41 0.64 0.00 0.00 175.55 176.39 3kin n GLY 86 N 3.52 -1.23 3.92 8.97 0.00 -1.26 -4.91 105.19 114.21 3kin n GLY 86 Ca -0.21 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.69 3kin n GLY 86 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3kin s GLN 87 N -0.22 3.49 0.17 1.61 -2.07 -1.26 -1.31 119.66 120.07 3kin s GLN 87 Ca 0.00 -0.37 -0.33 0.00 -1.82 0.00 0.00 55.36 52.84 3kin s GLN 87 Cb 0.00 -2.96 -0.16 0.00 -1.09 0.00 0.00 33.01 28.81 3kin s GLN 87 CO 0.00 0.53 1.22 2.41 -1.32 0.00 0.00 175.29 178.13 3kin n THR 88 N -0.02 0.78 -0.47 3.63 -1.04 -1.26 -1.09 114.28 114.81 3kin n THR 88 Ca -0.05 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 3kin n THR 88 Cb 0.52 -0.92 0.00 0.00 -1.82 0.00 0.00 70.33 68.11 3kin n THR 88 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 3kin n SER 89 N 2.11 0.00 -0.05 8.00 7.64 -1.26 -4.92 113.62 125.14 3kin n SER 89 Ca 0.15 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.89 3kin n SER 89 Cb 0.25 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.37 3kin n SER 89 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3kin h SER 90 N 0.00 0.41 0.00 6.43 4.64 -1.50 -3.48 113.55 120.04 3kin h SER 90 Ca 0.00 -0.52 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 3kin h SER 90 Cb 0.00 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 3kin h SER 90 CO 0.00 0.85 0.00 0.61 -0.87 0.00 0.00 176.83 177.42 3kin n GLY 91 N 0.33 0.01 0.32 -0.77 0.00 -1.26 -4.50 105.19 99.32 3kin n GLY 91 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.95 3kin n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kin h LYS 92 N 0.00 -0.05 -0.14 1.61 1.57 -1.91 -1.33 116.57 116.32 3kin h LYS 92 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.62 3kin h LYS 92 Cb 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 3kin h LYS 92 CO 0.00 -0.04 -0.62 1.15 -0.57 0.00 0.00 179.45 179.38 3kin h THR 93 N -0.06 1.34 -0.30 -0.16 2.02 -1.97 -0.76 112.91 113.04 3kin h THR 93 Ca 0.32 -1.92 -0.06 0.00 0.77 0.00 0.00 66.41 65.52 3kin h THR 93 Cb 0.56 1.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.87 3kin h THR 93 CO -0.78 0.59 -0.07 -0.74 0.37 0.00 0.00 175.52 174.89 3kin h HIS 94 N 0.35 0.50 0.00 3.16 -0.00 -1.80 0.86 115.15 118.22 3kin h HIS 94 Ca -0.01 -0.06 0.00 0.00 -0.00 0.00 0.00 60.37 60.30 3kin h HIS 94 Cb 1.16 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.43 3kin h HIS 94 CO 0.04 0.55 0.00 2.41 -0.00 0.00 0.00 177.93 180.93 3kin n THR 95 N -4.24 0.00 -0.24 6.26 -1.04 -0.55 -2.31 114.28 112.16 3kin n THR 95 Ca 0.01 0.89 0.05 0.00 -2.04 0.00 0.00 64.05 62.95 3kin n THR 95 Cb 0.28 -1.72 0.16 0.00 -1.82 0.00 0.00 70.33 67.23 3kin n THR 95 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 3kin h MET 96 N 0.00 0.24 0.00 -2.82 2.86 -1.17 -2.51 114.93 111.53 3kin h MET 96 Ca 0.00 -0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.52 3kin h MET 96 Cb 0.00 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 3kin h MET 96 CO 0.00 0.16 -1.41 -0.85 1.06 0.00 0.00 176.91 175.88 3kin n GLU 97 N -5.17 0.17 0.00 1.72 0.28 0.20 -0.43 120.64 117.41 3kin n GLU 97 Ca 0.13 0.05 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 3kin n GLU 97 Cb 0.43 -1.09 0.00 0.00 1.43 0.00 0.00 31.44 32.21 3kin n GLU 97 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3kin n GLY 98 N 3.07 0.85 2.88 -1.84 0.00 -0.61 -1.32 105.19 108.22 3kin n GLY 98 Ca -0.13 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 3kin n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kin n LYS 99 N 0.00 3.10 0.00 1.61 4.01 0.15 -4.76 118.16 122.27 3kin n LYS 99 Ca 0.00 -2.96 0.00 0.00 -0.51 0.00 0.00 58.31 54.84 3kin n LYS 99 Cb 0.00 -3.21 0.00 0.00 -0.51 0.00 0.00 35.03 31.31 3kin n LYS 99 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 3kin n LEU 100 N 5.75 0.00 -0.24 -0.35 4.32 -1.23 0.16 117.00 125.41 3kin n LEU 100 Ca 0.48 0.00 0.05 0.00 -0.02 0.00 0.00 56.01 56.52 3kin n LEU 100 Cb 0.39 0.00 0.10 0.00 -1.62 0.00 0.00 43.42 42.29 3kin n LEU 100 CO 0.85 0.00 0.57 1.41 -1.22 0.00 0.00 177.39 179.00 3kin n HIS 101 N -2.55 0.20 -3.56 -1.77 8.25 -1.26 -4.88 115.22 109.65 3kin n HIS 101 Ca 0.00 -0.70 -0.38 0.00 -0.26 0.00 0.00 57.72 56.39 3kin n HIS 101 Cb 0.00 -0.11 -0.10 0.00 1.12 0.00 0.00 29.99 30.90 3kin n HIS 101 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3kin s ASP 102 N -1.67 6.12 0.21 0.41 2.15 0.43 -4.98 116.67 119.33 3kin s ASP 102 Ca 0.19 0.12 -0.09 0.00 0.43 0.00 0.00 52.55 53.19 3kin s ASP 102 Cb 0.15 -2.14 0.27 0.00 -0.30 0.00 0.00 42.92 40.90 3kin s ASP 102 CO 0.05 -0.04 1.75 1.55 -0.17 0.00 0.00 175.17 178.31 3kin h PRO 103 N 8.02 0.43 0.12 4.34 0.13 -1.93 0.63 132.00 143.73 3kin h PRO 103 Ca -0.35 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.75 3kin h PRO 103 Cb 1.18 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3kin h PRO 103 CO 0.61 0.28 -0.06 0.37 -0.23 0.00 0.00 178.00 178.97 3kin h GLN 104 N 0.44 -0.16 -0.53 0.86 4.15 -1.94 -3.37 115.11 114.56 3kin h GLN 104 Ca 0.31 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.74 3kin h GLN 104 Cb 0.36 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.08 3kin h GLN 104 CO -0.29 0.26 0.00 1.28 -1.93 0.00 0.00 178.83 178.15 3kin n LEU 105 N -4.95 5.41 -4.79 -2.39 4.77 -1.12 -4.61 117.00 109.32 3kin n LEU 105 Ca -0.09 -2.92 -0.31 0.00 -0.03 0.00 0.00 56.01 52.66 3kin n LEU 105 Cb 0.25 -0.66 0.07 0.00 -2.33 0.00 0.00 43.42 40.75 3kin n LEU 105 CO 0.31 0.65 0.71 0.00 -1.33 0.00 0.00 177.39 177.72 3kin s MET 106 N -2.73 2.56 0.21 3.23 0.23 0.20 -0.67 119.30 122.33 3kin s MET 106 Ca 0.53 1.13 0.01 0.00 -1.03 0.00 0.00 55.69 56.33 3kin s MET 106 Cb 0.40 -1.94 0.01 0.00 -1.53 0.00 0.00 34.83 31.78 3kin s MET 106 CO 0.15 -1.41 0.10 0.41 -2.03 0.00 0.00 175.02 172.25 3kin n GLY 107 N -1.37 3.31 0.15 3.16 0.00 -0.43 -4.75 105.19 105.26 3kin n GLY 107 Ca 0.09 -2.24 -0.04 0.00 0.00 0.00 0.00 46.02 43.83 3kin n GLY 107 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3kin n ILE 108 N -0.82 -0.24 -0.16 -0.61 5.41 -0.94 -2.05 119.36 119.94 3kin n ILE 108 Ca -0.04 1.64 -0.08 0.00 1.00 0.00 0.00 62.75 65.28 3kin n ILE 108 Cb 0.25 -2.10 -0.06 0.00 -0.71 0.00 0.00 39.64 37.02 3kin n ILE 108 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3kin h ILE 109 N 0.00 0.00 -0.93 1.39 1.08 -1.04 0.17 117.51 118.19 3kin h ILE 109 Ca 0.06 0.00 0.23 0.00 -0.39 0.00 0.00 64.86 64.76 3kin h ILE 109 Cb 0.14 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 33.77 3kin h ILE 109 CO -0.33 0.00 0.45 -0.65 -0.69 0.00 0.00 178.15 176.93 3kin h PRO 110 N -0.13 0.43 -0.27 2.37 0.11 -1.66 -0.31 132.00 132.54 3kin h PRO 110 Ca 0.07 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.06 3kin h PRO 110 Cb 0.31 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 3kin h PRO 110 CO -0.45 0.28 -0.19 0.00 -0.21 0.00 0.00 178.00 177.43 3kin h ARG 111 N 0.44 0.61 0.00 1.05 3.08 -0.39 -2.39 114.38 116.77 3kin h ARG 111 Ca 0.59 -0.29 -0.02 0.00 0.07 0.00 0.00 59.98 60.33 3kin h ARG 111 Cb 1.13 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.17 3kin h ARG 111 CO -0.52 0.88 -0.09 0.82 -1.07 0.00 0.00 179.97 179.99 3kin h ILE 112 N 0.33 0.44 -0.38 2.04 2.04 0.33 0.46 117.51 122.78 3kin h ILE 112 Ca 0.05 -0.47 -0.13 0.00 1.00 0.00 0.00 64.86 65.32 3kin h ILE 112 Cb 0.73 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 3kin h ILE 112 CO 0.05 0.09 -0.29 0.00 0.00 0.00 0.00 178.15 178.01 3kin h ALA 113 N 1.91 0.78 0.19 1.87 0.00 -0.59 -2.72 119.26 120.70 3kin h ALA 113 Ca -0.00 -0.40 -0.35 0.00 0.00 0.00 0.00 54.91 54.16 3kin h ALA 113 Cb 0.31 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.97 3kin h ALA 113 CO 0.01 0.65 -1.71 0.45 0.00 0.00 0.00 179.25 178.65 3kin h HIS 114 N 0.69 0.74 0.80 0.00 3.86 -1.11 -3.35 115.15 116.78 3kin h HIS 114 Ca 0.08 -0.54 -0.04 0.00 -1.16 0.00 0.00 60.37 58.71 3kin h HIS 114 Cb 0.82 -0.03 0.01 0.00 1.06 0.00 0.00 27.41 29.27 3kin h HIS 114 CO 0.04 1.65 -0.40 -0.44 0.86 0.00 0.00 177.93 179.64 3kin h ASP 115 N 0.11 -0.97 -0.80 2.45 3.32 -0.99 -0.46 116.42 119.08 3kin h ASP 115 Ca -0.33 0.04 0.14 0.00 0.02 0.00 0.00 57.03 56.89 3kin h ASP 115 Cb 2.11 0.26 -0.14 0.00 0.22 0.00 0.00 39.33 41.78 3kin h ASP 115 CO 0.19 -0.67 -0.34 0.40 -1.72 0.00 0.00 179.24 177.10 3kin h ILE 116 N -1.10 0.10 0.00 0.35 2.04 -1.67 0.30 117.51 117.53 3kin h ILE 116 Ca -0.11 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 3kin h ILE 116 Cb 0.85 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 3kin h ILE 116 CO 0.16 0.00 -0.00 -0.26 0.00 0.00 0.00 178.15 178.05 3kin h PHE 117 N -0.07 0.00 -0.20 1.37 0.04 -1.67 -1.78 116.94 114.63 3kin h PHE 117 Ca 0.31 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.97 3kin h PHE 117 Cb 0.58 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.73 3kin h PHE 117 CO -0.74 0.00 -0.29 -0.44 -0.60 0.00 0.00 178.31 176.24 3kin h ASP 118 N 0.00 0.61 0.90 2.17 5.19 0.12 -1.83 116.42 123.57 3kin h ASP 118 Ca -0.00 -0.52 -0.04 0.00 -0.62 0.00 0.00 57.03 55.85 3kin h ASP 118 Cb 0.83 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 40.17 3kin h ASP 118 CO 0.00 1.00 -0.43 0.45 -3.12 0.00 0.00 179.24 177.14 3kin h HIS 119 N 0.23 -1.12 0.03 4.55 3.86 -0.72 -3.20 115.15 118.77 3kin h HIS 119 Ca 0.02 -0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 3kin h HIS 119 Cb 0.87 0.37 -0.05 0.00 1.06 0.00 0.00 27.41 29.65 3kin h HIS 119 CO 0.09 -0.69 -0.53 0.82 0.86 0.00 0.00 177.93 178.47 3kin h ILE 120 N -1.24 0.01 -0.92 2.45 2.04 -1.34 -1.39 117.51 117.12 3kin h ILE 120 Ca -0.12 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.00 3kin h ILE 120 Cb 0.93 0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 3kin h ILE 120 CO 0.20 0.00 0.79 1.88 0.00 0.00 0.00 178.15 181.02 3kin h TYR 121 N -0.69 0.00 0.00 1.37 -1.99 -1.42 -0.18 116.97 114.06 3kin h TYR 121 Ca 0.01 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.59 3kin h TYR 121 Cb 0.73 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.44 3kin h TYR 121 CO -0.50 0.00 -0.96 0.66 -0.00 0.00 0.00 178.16 177.37 3kin h SER 122 N 0.00 0.00 -2.37 3.88 4.64 -1.25 -3.47 113.55 114.98 3kin h SER 122 Ca 0.43 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 61.30 3kin h SER 122 Cb 2.01 0.00 0.23 0.00 -0.31 0.00 0.00 62.40 64.34 3kin h SER 122 CO -0.00 0.61 -1.05 0.23 -0.87 0.00 0.00 176.83 175.75 3kin n MET 123 N -3.10 -1.59 -2.68 4.77 2.81 -0.08 -4.95 117.12 112.30 3kin n MET 123 Ca -0.03 -0.45 -0.37 0.00 -1.81 0.00 0.00 57.70 55.04 3kin n MET 123 Cb 0.81 -1.72 -0.05 0.00 -0.71 0.00 0.00 33.22 31.55 3kin n MET 123 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3kin s ASP 124 N -1.86 7.20 0.41 7.83 -1.08 -1.26 -4.91 116.67 123.00 3kin s ASP 124 Ca 0.56 1.95 0.24 0.00 -0.52 0.00 0.00 52.55 54.78 3kin s ASP 124 Cb -0.12 -2.59 1.29 0.00 -1.46 0.00 0.00 42.92 40.03 3kin s ASP 124 CO 0.66 -0.17 1.70 1.05 0.52 0.00 0.00 175.17 178.92 3kin h GLU 125 N 3.15 0.00 0.00 4.34 4.11 -1.96 0.35 114.58 124.57 3kin h GLU 125 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3kin h GLU 125 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3kin h GLU 125 CO 0.65 0.00 0.00 -1.71 0.07 0.00 0.00 179.01 178.02 3kin n ASN 126 N -2.39 0.00 -4.52 3.06 5.15 -1.26 -4.59 115.26 110.71 3kin n ASN 126 Ca -0.02 -0.24 -0.39 0.00 -0.60 0.00 0.00 54.58 53.34 3kin n ASN 126 Cb 0.16 -0.23 -0.11 0.00 -0.53 0.00 0.00 39.78 39.07 3kin n ASN 126 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3kin s LEU 127 N -2.46 4.22 -0.42 1.20 1.43 0.11 -1.34 118.68 121.41 3kin s LEU 127 Ca 0.28 -0.33 -0.06 0.00 -1.03 0.00 0.00 54.13 53.00 3kin s LEU 127 Cb 0.18 -2.08 0.10 0.00 0.03 0.00 0.00 46.19 44.42 3kin s LEU 127 CO 0.39 -0.16 0.24 -1.61 0.23 0.00 0.00 176.35 175.44 3kin s GLU 128 N 1.70 2.28 0.13 1.70 2.02 0.17 -4.90 118.70 121.80 3kin s GLU 128 Ca 0.06 -1.69 -0.09 0.00 0.02 0.00 0.00 54.97 53.26 3kin s GLU 128 Cb -0.17 -3.69 -0.06 0.00 0.10 0.00 0.00 34.13 30.31 3kin s GLU 128 CO 0.09 -1.05 0.45 -0.06 0.02 0.00 0.00 175.26 174.71 3kin s PHE 129 N 1.27 3.53 -0.35 1.61 0.08 -1.26 -1.84 117.98 121.01 3kin s PHE 129 Ca 0.06 0.79 -0.00 0.00 0.12 0.00 0.00 56.93 57.89 3kin s PHE 129 Cb -0.24 -2.17 0.11 0.00 -0.57 0.00 0.00 43.02 40.16 3kin s PHE 129 CO -0.02 0.43 0.15 -1.01 -0.10 0.00 0.00 175.22 174.68 3kin s HIS 130 N -1.55 1.52 -0.24 0.36 3.76 -0.27 -5.01 115.29 113.86 3kin s HIS 130 Ca 0.38 -1.82 -0.14 0.00 -0.15 0.00 0.00 55.06 53.33 3kin s HIS 130 Cb -0.13 -1.58 -0.04 0.00 1.11 0.00 0.00 32.58 31.94 3kin s HIS 130 CO 0.20 -0.84 0.34 0.42 -0.85 0.00 0.00 174.74 174.01 3kin s ILE 131 N 1.27 5.22 -0.16 0.60 1.09 -1.26 -2.82 121.20 125.14 3kin s ILE 131 Ca 0.13 0.53 -0.00 0.00 -1.10 0.00 0.00 60.65 60.21 3kin s ILE 131 Cb -0.20 -3.67 0.04 0.00 -1.06 0.00 0.00 42.46 37.57 3kin s ILE 131 CO -0.16 0.23 -0.06 -1.59 -0.10 0.00 0.00 174.94 173.26 3kin s LYS 132 N 1.58 1.49 0.36 2.79 -2.85 -0.97 -0.49 119.74 121.65 3kin s LYS 132 Ca 0.15 -0.49 -0.02 0.00 -1.00 0.00 0.00 55.97 54.61 3kin s LYS 132 Cb -0.15 -1.96 -0.04 0.00 -2.06 0.00 0.00 37.83 33.62 3kin s LYS 132 CO 0.08 -0.40 0.60 0.14 0.10 0.00 0.00 175.35 175.87 3kin s VAL 133 N 1.63 5.04 0.04 1.79 -7.23 0.40 -1.61 120.40 120.47 3kin s VAL 133 Ca 0.01 -0.18 -0.02 0.00 -1.81 0.00 0.00 61.98 59.98 3kin s VAL 133 Cb -0.15 -3.83 -0.03 0.00 0.56 0.00 0.00 36.38 32.94 3kin s VAL 133 CO -0.08 -0.55 0.00 -0.44 -0.31 0.00 0.00 175.10 173.72 3kin s SER 134 N -3.80 0.33 -0.35 4.85 0.01 -0.73 -1.18 113.70 112.83 3kin s SER 134 Ca 0.43 -0.73 0.05 0.00 1.31 0.00 0.00 55.95 57.00 3kin s SER 134 Cb -0.10 0.18 0.17 0.00 0.21 0.00 0.00 66.02 66.47 3kin s SER 134 CO 0.36 -0.48 0.48 -0.47 0.41 0.00 0.00 173.24 173.54 3kin s TYR 135 N -2.83 -1.06 0.36 2.43 5.04 -1.26 -1.63 117.35 118.39 3kin s TYR 135 Ca -0.03 -0.02 0.09 0.00 -2.44 0.00 0.00 57.07 54.67 3kin s TYR 135 Cb 0.00 -0.06 -0.07 0.00 0.35 0.00 0.00 41.96 42.19 3kin s TYR 135 CO -0.06 -1.05 -0.04 -0.59 -1.34 0.00 0.00 175.55 172.47 3kin s PHE 136 N 1.99 2.46 0.13 4.97 -0.71 -1.12 -0.42 117.98 125.28 3kin s PHE 136 Ca 0.14 -0.53 0.07 0.00 -1.04 0.00 0.00 56.93 55.57 3kin s PHE 136 Cb -0.11 -1.51 -0.04 0.00 -1.21 0.00 0.00 43.02 40.16 3kin s PHE 136 CO -0.14 0.52 -0.16 -1.83 -1.34 0.00 0.00 175.22 172.28 3kin s GLU 137 N -3.66 1.07 -0.14 1.99 -1.05 -0.07 -1.20 118.70 115.64 3kin s GLU 137 Ca 0.34 -1.25 0.01 0.00 -0.15 0.00 0.00 54.97 53.92 3kin s GLU 137 Cb 0.04 -1.04 0.02 0.00 -0.44 0.00 0.00 34.13 32.71 3kin s GLU 137 CO 0.18 0.21 -0.14 0.42 0.95 0.00 0.00 175.26 176.87 3kin s ILE 138 N -1.95 1.57 -0.05 1.83 1.01 -0.16 0.56 121.20 124.01 3kin s ILE 138 Ca 0.09 -0.64 0.03 0.00 0.00 0.00 0.00 60.65 60.13 3kin s ILE 138 Cb -0.06 -1.46 0.01 0.00 0.01 0.00 0.00 42.46 40.95 3kin s ILE 138 CO 0.04 0.46 -0.13 -0.47 0.00 0.00 0.00 174.94 174.84 3kin s TYR 139 N 1.42 1.44 -1.12 3.97 5.04 0.13 -2.39 117.35 125.83 3kin s TYR 139 Ca 0.03 -0.48 -0.29 0.00 -2.44 0.00 0.00 57.07 53.89 3kin s TYR 139 Cb -0.13 -1.03 0.04 0.00 0.35 0.00 0.00 41.96 41.19 3kin s TYR 139 CO -0.09 -0.22 0.65 1.28 -1.34 0.00 0.00 175.55 175.82 3kin n LEU 140 N 3.58 -0.35 -2.61 6.97 4.77 -1.26 0.49 117.00 128.59 3kin n LEU 140 Ca -0.21 -1.23 -0.15 0.00 -0.03 0.00 0.00 56.01 54.39 3kin n LEU 140 Cb 0.52 -1.53 -0.00 0.00 -2.33 0.00 0.00 43.42 40.08 3kin n LEU 140 CO 0.25 0.75 -0.14 -0.67 -1.33 0.00 0.00 177.39 176.25 3kin n ASP 141 N -2.10 -4.14 -4.07 -1.43 2.03 -1.26 -4.97 116.55 100.61 3kin n ASP 141 Ca -0.14 0.07 -0.25 0.00 0.52 0.00 0.00 54.79 54.98 3kin n ASP 141 Cb 0.56 -3.49 -0.16 0.00 -0.72 0.00 0.00 41.12 37.31 3kin n ASP 141 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3kin s LYS 142 N -5.22 1.82 -0.25 -0.67 -0.14 0.18 -5.11 119.74 110.35 3kin s LYS 142 Ca 0.08 -0.50 -0.15 0.00 -1.36 0.00 0.00 55.97 54.04 3kin s LYS 142 Cb -0.04 -1.50 -0.04 0.00 -1.68 0.00 0.00 37.83 34.57 3kin s LYS 142 CO 0.10 0.10 0.37 0.42 -0.76 0.00 0.00 175.35 175.58 3kin s ILE 143 N 0.46 5.18 -0.26 2.17 1.01 -1.26 0.17 121.20 128.68 3kin s ILE 143 Ca -0.12 0.59 -0.00 0.00 0.00 0.00 0.00 60.65 61.12 3kin s ILE 143 Cb -0.15 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 38.66 3kin s ILE 143 CO 0.04 0.18 -0.07 -0.60 0.00 0.00 0.00 174.94 174.49 3kin s ARG 144 N 1.88 2.60 0.07 2.79 3.52 0.19 -2.53 118.95 127.47 3kin s ARG 144 Ca 0.16 -1.13 -0.32 0.00 -0.13 0.00 0.00 55.73 54.31 3kin s ARG 144 Cb -0.15 -2.97 -0.11 0.00 -1.56 0.00 0.00 34.95 30.16 3kin s ARG 144 CO 0.09 -0.48 1.85 -3.47 -0.81 0.00 0.00 175.30 172.48 3kin n ASP 145 N 4.59 3.88 0.13 -2.12 -0.08 -1.16 -0.89 116.55 120.90 3kin n ASP 145 Ca -0.15 0.98 0.13 0.00 -1.51 0.00 0.00 54.79 54.23 3kin n ASP 145 Cb 0.45 -1.50 0.34 0.00 2.34 0.00 0.00 41.12 42.75 3kin n ASP 145 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3kin h LEU 146 N 8.81 0.00 -0.53 -2.67 3.38 -1.06 -3.18 115.31 120.05 3kin h LEU 146 Ca -0.47 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3kin h LEU 146 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3kin h LEU 146 CO 0.94 0.00 -0.54 0.18 0.09 0.00 0.00 178.44 179.11 3kin n LEU 147 N -2.43 1.38 -3.10 1.67 4.77 -1.25 -4.35 117.00 113.69 3kin n LEU 147 Ca 0.05 -0.49 -0.12 0.00 -0.03 0.00 0.00 56.01 55.42 3kin n LEU 147 Cb 0.45 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.44 3kin n LEU 147 CO 0.31 0.27 -0.06 -0.62 -1.33 0.00 0.00 177.39 175.97 3kin s ASP 148 N -2.66 -0.17 0.24 -1.43 -1.08 -1.21 -5.02 116.67 105.33 3kin s ASP 148 Ca 0.17 -1.97 0.15 0.00 -0.52 0.00 0.00 52.55 50.38 3kin s ASP 148 Cb 0.18 1.01 0.84 0.00 -1.46 0.00 0.00 42.92 43.48 3kin s ASP 148 CO 0.64 -0.14 1.45 1.33 0.52 0.00 0.00 175.17 178.98 3kin n VAL 149 N 3.32 1.20 0.49 1.11 0.24 -1.21 -0.66 118.33 122.83 3kin n VAL 149 Ca 0.19 0.68 0.13 0.00 -2.04 0.00 0.00 64.34 63.30 3kin n VAL 149 Cb 0.52 -1.68 0.35 0.00 -1.47 0.00 0.00 33.84 31.56 3kin n VAL 149 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3kin h SER 150 N 0.00 0.00 -3.60 -1.34 0.02 -1.96 -3.41 113.55 103.26 3kin h SER 150 Ca 0.00 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.29 3kin h SER 150 Cb 0.08 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.46 3kin h SER 150 CO 0.00 0.00 -0.07 -0.54 -1.14 0.00 0.00 176.83 175.08 3kin s LYS 151 N -3.16 3.48 0.00 3.45 1.02 0.16 -4.91 119.74 119.78 3kin s LYS 151 Ca 0.09 -0.31 0.00 0.00 0.02 0.00 0.00 55.97 55.77 3kin s LYS 151 Cb 0.10 -3.86 0.00 0.00 -0.52 0.00 0.00 37.83 33.55 3kin s LYS 151 CO 0.60 -0.73 0.15 0.25 -0.92 0.00 0.00 175.35 174.71 3kin n THR 152 N 5.48 0.00 -2.67 2.17 -2.24 -1.26 -2.99 114.28 112.77 3kin n THR 152 Ca -0.05 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.48 3kin n THR 152 Cb 0.48 1.65 0.03 0.00 -2.10 0.00 0.00 70.33 70.40 3kin n THR 152 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kin n ASN 153 N -0.01 1.55 -4.70 3.42 5.15 -1.24 -4.37 115.26 115.05 3kin n ASN 153 Ca 0.00 -2.67 -0.40 0.00 -0.60 0.00 0.00 54.58 50.91 3kin n ASN 153 Cb 0.16 -0.52 0.02 0.00 -0.53 0.00 0.00 39.78 38.91 3kin n ASN 153 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3kin n LEU 154 N -0.13 4.40 -4.89 1.20 4.32 -1.05 -4.91 117.00 115.94 3kin n LEU 154 Ca 0.10 1.04 -0.21 0.00 -0.02 0.00 0.00 56.01 56.92 3kin n LEU 154 Cb 0.81 -1.51 -0.03 0.00 -1.62 0.00 0.00 43.42 41.07 3kin n LEU 154 CO 0.25 -0.75 -0.10 0.00 -1.22 0.00 0.00 177.39 175.58 3kin s ALA 155 N -1.26 3.77 -0.25 -1.18 0.00 -1.26 -4.43 121.76 117.16 3kin s ALA 155 Ca 0.65 -1.36 -0.05 0.00 0.00 0.00 0.00 51.96 51.19 3kin s ALA 155 Cb -0.47 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.16 3kin s ALA 155 CO 0.55 0.22 0.02 0.08 0.00 0.00 0.00 175.76 176.62 3kin s VAL 156 N -2.09 3.75 0.00 0.00 1.01 -1.26 -0.74 120.40 121.07 3kin s VAL 156 Ca 0.34 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.84 3kin s VAL 156 Cb -0.08 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.51 3kin s VAL 156 CO 0.27 0.30 0.00 1.41 0.00 0.00 0.00 175.10 177.08 3kin n HIS 157 N 4.84 -1.21 -4.37 5.22 8.25 -0.14 -4.86 115.22 122.94 3kin n HIS 157 Ca -0.17 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.03 3kin n HIS 157 Cb 0.50 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.44 3kin n HIS 157 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3kin s GLU 158 N -0.46 1.80 0.30 -0.41 2.02 -1.26 -1.84 118.70 118.86 3kin s GLU 158 Ca 0.00 -0.41 -0.05 0.00 0.02 0.00 0.00 54.97 54.52 3kin s GLU 158 Cb 0.00 -1.59 0.08 0.00 0.10 0.00 0.00 34.13 32.72 3kin s GLU 158 CO 0.00 -0.08 0.28 -0.40 0.02 0.00 0.00 175.26 175.08 3kin n ASP 159 N 4.22 -1.20 -0.37 -0.19 5.75 -1.11 -4.78 116.55 118.86 3kin n ASP 159 Ca -0.19 -0.69 -0.03 0.00 -0.01 0.00 0.00 54.79 53.87 3kin n ASP 159 Cb 0.51 -0.25 0.01 0.00 -1.03 0.00 0.00 41.12 40.36 3kin n ASP 159 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3kin n LYS 160 N -2.30 -0.26 -2.77 0.11 5.02 -1.26 -1.71 118.16 114.99 3kin n LYS 160 Ca 0.04 1.44 -0.36 0.00 -2.02 0.00 0.00 58.31 57.40 3kin n LYS 160 Cb 0.15 -2.13 -0.00 0.00 -0.02 0.00 0.00 35.03 33.03 3kin n LYS 160 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3kin n ASN 161 N -5.34 6.33 -2.64 4.39 0.23 -1.26 -4.91 115.26 112.05 3kin n ASN 161 Ca 0.08 -3.67 -0.12 0.00 -0.53 0.00 0.00 54.58 50.34 3kin n ASN 161 Cb 0.35 -0.97 -0.00 0.00 -2.08 0.00 0.00 39.78 37.08 3kin n ASN 161 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 3kin n ARG 162 N -0.03 -2.58 -3.66 -3.83 0.63 -0.69 -4.95 116.66 101.54 3kin n ARG 162 Ca 0.41 0.46 -0.39 0.00 -0.92 0.00 0.00 57.85 57.40 3kin n ARG 162 Cb 0.31 -5.06 -0.12 0.00 0.45 0.00 0.00 32.46 28.04 3kin n ARG 162 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3kin s VAL 163 N -2.57 4.34 0.39 5.15 1.01 -1.26 -4.82 120.40 122.65 3kin s VAL 163 Ca 0.08 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.02 3kin s VAL 163 Cb -0.04 -3.37 -0.15 0.00 0.00 0.00 0.00 36.38 32.81 3kin s VAL 163 CO 0.10 -0.14 0.23 -2.65 0.00 0.00 0.00 175.10 172.65 3kin n PRO 164 N 4.94 0.14 -3.61 2.72 -0.02 -1.26 -2.77 135.00 135.14 3kin n PRO 164 Ca -0.13 0.05 -0.07 0.00 -2.02 0.00 0.00 63.50 61.33 3kin n PRO 164 Cb 0.46 -1.13 -0.06 0.00 -0.02 0.00 0.00 33.50 32.76 3kin n PRO 164 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3kin s TYR 165 N -1.58 -0.28 -0.33 6.00 1.13 -0.77 -4.86 117.35 116.66 3kin s TYR 165 Ca 0.61 0.55 -0.29 0.00 -1.41 0.00 0.00 57.07 56.53 3kin s TYR 165 Cb -0.65 0.45 0.01 0.00 -1.10 0.00 0.00 41.96 40.66 3kin s TYR 165 CO 0.61 -0.21 1.30 0.08 -2.51 0.00 0.00 175.55 174.82 3kin s VAL 166 N -0.68 4.12 0.40 -3.49 1.01 -1.26 -0.97 120.40 119.53 3kin s VAL 166 Ca 0.03 1.24 -0.13 0.00 0.00 0.00 0.00 61.98 63.12 3kin s VAL 166 Cb -0.02 -4.21 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 3kin s VAL 166 CO -0.04 -0.56 0.80 -0.75 0.00 0.00 0.00 175.10 174.55 3kin s LYS 167 N 4.30 3.89 0.00 2.72 2.20 0.08 -4.24 119.74 128.69 3kin s LYS 167 Ca 0.56 0.63 0.00 0.00 -0.36 0.00 0.00 55.97 56.80 3kin s LYS 167 Cb -0.15 -2.35 0.00 0.00 -1.51 0.00 0.00 37.83 33.82 3kin s LYS 167 CO 0.25 -0.02 0.00 0.41 -0.36 0.00 0.00 175.35 175.63 3kin n GLY 168 N -1.05 0.31 3.60 5.54 0.00 -1.26 -4.28 105.19 108.05 3kin n GLY 168 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 3kin n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kin s THR 170 N -2.85 5.04 -0.25 0.00 2.01 -1.26 -5.07 115.64 113.26 3kin s THR 170 Ca 0.68 1.09 -0.01 0.00 0.31 0.00 0.00 61.69 63.76 3kin s THR 170 Cb -0.17 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.50 3kin s THR 170 CO 0.58 0.40 -0.08 -1.61 -0.69 0.00 0.00 174.62 173.22 3kin s GLU 171 N 0.06 2.77 -0.20 4.92 2.02 -1.26 -4.39 118.70 122.61 3kin s GLU 171 Ca 0.28 -1.01 -0.08 0.00 0.02 0.00 0.00 54.97 54.18 3kin s GLU 171 Cb -0.17 -2.95 -0.04 0.00 0.10 0.00 0.00 34.13 31.08 3kin s GLU 171 CO 0.14 -0.41 0.07 1.03 0.02 0.00 0.00 175.26 176.11 3kin s ARG 172 N 1.30 3.91 -0.37 1.61 1.81 -0.33 -4.91 118.95 121.96 3kin s ARG 172 Ca -0.01 -0.37 -0.29 0.00 -1.72 0.00 0.00 55.73 53.34 3kin s ARG 172 Cb -0.17 -3.26 0.02 0.00 -0.45 0.00 0.00 34.95 31.09 3kin s ARG 172 CO -0.05 0.15 1.14 -0.06 -0.68 0.00 0.00 175.30 175.80 3kin s PHE 173 N 0.71 2.94 0.22 -0.53 0.08 -1.26 -0.45 117.98 119.69 3kin s PHE 173 Ca 0.04 0.97 0.03 0.00 0.12 0.00 0.00 56.93 58.09 3kin s PHE 173 Cb -0.13 -4.00 -0.03 0.00 -0.57 0.00 0.00 43.02 38.28 3kin s PHE 173 CO 0.02 -1.12 0.36 0.14 -0.10 0.00 0.00 175.22 174.52 3kin s VAL 174 N 4.10 5.26 0.00 -0.44 -7.23 0.36 -4.98 120.40 117.47 3kin s VAL 174 Ca 0.48 -0.79 0.07 0.00 -1.81 0.00 0.00 61.98 59.93 3kin s VAL 174 Cb -0.11 -3.82 0.11 0.00 0.56 0.00 0.00 36.38 33.12 3kin s VAL 174 CO 0.23 -0.27 0.96 -1.20 -0.31 0.00 0.00 175.10 174.50 3kin n SER 175 N -1.14 0.17 -3.61 4.85 7.64 -1.26 -4.29 113.62 115.97 3kin n SER 175 Ca -0.08 -1.84 -0.03 0.00 1.01 0.00 0.00 58.87 57.93 3kin n SER 175 Cb 0.56 -0.15 -0.01 0.00 -1.01 0.00 0.00 64.21 63.59 3kin n SER 175 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3kin s SER 176 N -1.09 -0.16 0.33 6.43 1.04 -1.26 -4.98 113.70 114.00 3kin s SER 176 Ca 0.09 -0.11 0.07 0.00 0.48 0.00 0.00 55.95 56.48 3kin s SER 176 Cb 0.10 0.25 0.58 0.00 0.10 0.00 0.00 66.02 67.05 3kin s SER 176 CO -0.04 -0.44 1.79 -0.65 0.98 0.00 0.00 173.24 174.88 3kin h PRO 177 N 2.00 0.29 -0.41 4.02 0.11 -1.93 -3.10 132.00 132.98 3kin h PRO 177 Ca -0.20 -0.10 -0.14 0.00 0.11 0.00 0.00 66.00 65.66 3kin h PRO 177 Cb 1.20 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3kin h PRO 177 CO 0.26 0.54 -0.32 0.93 -0.21 0.00 0.00 178.00 179.20 3kin h GLU 178 N 0.26 0.91 0.00 1.05 3.07 -1.95 -2.03 114.58 115.89 3kin h GLU 178 Ca 0.04 -0.43 -0.00 0.00 -0.50 0.00 0.00 59.36 58.46 3kin h GLU 178 Cb 0.60 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.51 3kin h GLU 178 CO 0.04 1.09 -0.02 0.93 -1.40 0.00 0.00 179.01 179.66 3kin h GLU 179 N 0.76 0.00 0.11 2.33 5.08 -1.92 -2.08 114.58 118.86 3kin h GLU 179 Ca 0.08 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.15 3kin h GLU 179 Cb 0.89 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 3kin h GLU 179 CO 0.08 0.02 -1.41 0.28 -1.00 0.00 0.00 179.01 176.97 3kin h VAL 180 N 0.00 1.29 0.16 3.13 2.07 -1.48 -2.99 116.25 118.43 3kin h VAL 180 Ca -0.00 -2.91 -0.01 0.00 0.82 0.00 0.00 66.70 64.60 3kin h VAL 180 Cb 0.60 2.82 0.00 0.00 -1.52 0.00 0.00 31.29 33.19 3kin h VAL 180 CO 0.00 0.84 -0.08 0.24 0.02 0.00 0.00 177.57 178.59 3kin h MET 181 N 0.07 -0.21 -0.84 1.57 2.86 -1.02 -0.63 114.93 116.73 3kin h MET 181 Ca -0.20 0.01 0.21 0.00 -2.06 0.00 0.00 59.70 57.67 3kin h MET 181 Cb 1.99 0.05 -0.13 0.00 0.06 0.00 0.00 31.60 33.56 3kin h MET 181 CO 0.17 -0.08 0.20 -0.44 1.06 0.00 0.00 176.91 177.82 3kin h ASP 182 N -0.28 -0.04 0.15 1.22 3.32 -1.49 1.22 116.42 120.51 3kin h ASP 182 Ca -0.02 0.19 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 3kin h ASP 182 Cb 0.22 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 3kin h ASP 182 CO 0.04 -0.13 -0.25 0.58 -1.72 0.00 0.00 179.24 177.76 3kin h VAL 183 N 0.21 1.23 0.18 -1.35 2.07 -1.21 -1.08 116.25 116.30 3kin h VAL 183 Ca 0.51 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 3kin h VAL 183 Cb 0.98 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 3kin h VAL 183 CO -0.63 0.32 -0.09 0.40 0.02 0.00 0.00 177.57 177.59 3kin h ILE 184 N 0.17 0.90 -0.58 4.57 2.04 0.28 -2.71 117.51 122.18 3kin h ILE 184 Ca 0.03 -0.91 0.11 0.00 1.00 0.00 0.00 64.86 65.09 3kin h ILE 184 Cb 0.54 1.41 -0.11 0.00 -0.74 0.00 0.00 36.82 37.91 3kin h ILE 184 CO 0.04 0.19 -0.17 0.44 0.00 0.00 0.00 178.15 178.65 3kin h ASP 185 N -0.73 -0.62 -0.09 1.72 3.32 0.02 -0.60 116.42 119.45 3kin h ASP 185 Ca -0.03 0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.23 3kin h ASP 185 Cb 0.50 0.39 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 3kin h ASP 185 CO 0.04 -0.21 -0.04 -0.08 -1.72 0.00 0.00 179.24 177.23 3kin h GLU 186 N -0.03 -0.03 0.00 3.56 4.81 -1.25 -2.13 114.58 119.52 3kin h GLU 186 Ca 0.27 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.50 3kin h GLU 186 Cb 0.45 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 3kin h GLU 186 CO -0.61 -0.02 -0.04 0.78 -0.73 0.00 0.00 179.01 178.39 3kin h GLY 187 N -0.03 0.00 1.11 1.92 0.00 -1.08 -2.04 103.07 102.95 3kin h GLY 187 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.21 3kin h GLY 187 CO -0.11 0.00 -0.49 1.70 0.00 0.00 0.00 176.54 177.64 3kin h LYS 188 N 0.00 0.85 0.06 4.80 3.64 -0.50 -2.57 116.57 122.84 3kin h LYS 188 Ca -0.00 -0.52 -0.00 0.00 -1.27 0.00 0.00 60.65 58.85 3kin h LYS 188 Cb 0.59 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 3kin h LYS 188 CO 0.01 1.16 -0.03 0.00 -2.27 0.00 0.00 179.45 178.32 3kin h ALA 189 N 0.68 -0.52 -1.29 5.00 0.00 -1.23 -3.23 119.26 118.68 3kin h ALA 189 Ca 0.02 -0.02 0.37 0.00 0.00 0.00 0.00 54.91 55.29 3kin h ALA 189 Cb 1.10 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.86 3kin h ALA 189 CO 0.11 -0.51 1.10 0.09 0.00 0.00 0.00 179.25 180.04 3kin n ASN 190 N -2.35 0.00 0.17 0.00 3.02 -0.78 0.18 115.26 115.49 3kin n ASN 190 Ca -0.01 0.73 0.06 0.00 -0.03 0.00 0.00 54.58 55.33 3kin n ASN 190 Cb 0.03 -0.32 0.52 0.00 -0.61 0.00 0.00 39.78 39.40 3kin n ASN 190 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 3kin h ARG 191 N 0.00 0.16 -0.07 3.52 2.43 -1.47 -2.35 114.38 116.60 3kin h ARG 191 Ca 0.61 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.76 3kin h ARG 191 Cb 2.80 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 32.31 3kin h ARG 191 CO -0.01 0.18 0.03 0.45 -1.51 0.00 0.00 179.97 179.12 3kin h HIS 192 N 0.17 0.11 -0.30 2.20 3.86 0.17 -3.41 115.15 117.93 3kin h HIS 192 Ca 0.04 -0.01 -0.69 0.00 -1.16 0.00 0.00 60.37 58.56 3kin h HIS 192 Cb 0.11 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.53 3kin h HIS 192 CO 0.00 0.20 0.93 0.28 0.86 0.00 0.00 177.93 180.20 3kin n VAL 193 N -4.96 0.00 -0.78 2.45 0.31 -0.89 0.21 118.33 114.67 3kin n VAL 193 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 3kin n VAL 193 Cb 0.09 -0.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.60 3kin n VAL 193 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kin n ALA 194 N 5.31 0.00 -4.08 3.52 0.00 -1.26 -5.04 120.51 118.97 3kin n ALA 194 Ca 0.39 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.51 3kin n ALA 194 Cb -0.04 -0.09 -0.16 0.00 0.00 0.00 0.00 19.45 19.16 3kin n ALA 194 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3kin s VAL 195 N -2.00 2.05 -0.10 0.00 1.01 0.57 -4.99 120.40 116.94 3kin s VAL 195 Ca 0.00 -0.94 -0.26 0.00 0.00 0.00 0.00 61.98 60.79 3kin s VAL 195 Cb 0.00 -1.85 -0.28 0.00 0.00 0.00 0.00 36.38 34.25 3kin s VAL 195 CO 0.00 0.54 0.82 0.71 0.00 0.00 0.00 175.10 177.17 3kin h THR 196 N 5.93 1.66 -3.57 3.92 1.35 -1.97 -3.43 112.91 116.81 3kin h THR 196 Ca -0.45 -2.43 -0.61 0.00 -0.55 0.00 0.00 66.41 62.37 3kin h THR 196 Cb 1.14 3.30 -0.38 0.00 -1.73 0.00 0.00 68.15 70.48 3kin h THR 196 CO 0.63 0.66 -0.79 0.21 -0.25 0.00 0.00 175.52 175.98 3kin s ASN 197 N -6.57 3.67 0.01 5.36 3.84 -1.26 -5.00 114.94 114.99 3kin s ASN 197 Ca -0.17 -1.08 -0.24 0.00 0.21 0.00 0.00 52.86 51.59 3kin s ASN 197 Cb -0.01 -1.17 -0.17 0.00 -0.55 0.00 0.00 41.25 39.35 3kin s ASN 197 CO 0.75 -0.21 1.34 -0.03 -2.79 0.00 0.00 177.10 176.16 3kin h MET 198 N 7.97 0.13 -0.74 0.43 1.85 -1.98 0.34 114.93 122.93 3kin h MET 198 Ca -0.20 -0.06 0.12 0.00 -0.61 0.00 0.00 59.70 58.94 3kin h MET 198 Cb 1.08 -0.00 -0.13 0.00 0.43 0.00 0.00 31.60 32.98 3kin h MET 198 CO 0.42 0.53 -0.39 -0.91 -0.40 0.00 0.00 176.91 176.16 3kin h ASN 199 N -0.27 -1.38 -0.60 1.39 2.35 -1.99 1.00 115.58 116.07 3kin h ASN 199 Ca 0.01 0.26 -0.05 0.00 -0.55 0.00 0.00 56.30 55.98 3kin h ASN 199 Cb 0.49 0.68 -0.03 0.00 0.05 0.00 0.00 38.32 39.51 3kin h ASN 199 CO 0.01 -0.30 0.21 -0.08 -1.65 0.00 0.00 177.43 175.61 3kin h GLU 200 N -0.12 0.95 0.29 0.81 4.57 -1.97 -1.98 114.58 117.14 3kin h GLU 200 Ca 0.25 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 3kin h GLU 200 Cb 0.56 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3kin h GLU 200 CO -0.80 0.81 -0.18 1.25 -1.18 0.00 0.00 179.01 178.91 3kin h HIS 201 N 0.93 -0.49 -0.19 0.92 2.76 0.30 -2.85 115.15 116.52 3kin h HIS 201 Ca 0.21 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.41 3kin h HIS 201 Cb 0.25 0.18 -0.07 0.00 1.55 0.00 0.00 27.41 29.32 3kin h HIS 201 CO 0.02 -0.27 -0.52 0.77 -1.30 0.00 0.00 177.93 176.63 3kin h SER 202 N -0.45 -1.65 0.00 3.26 0.02 0.03 0.54 113.55 115.30 3kin h SER 202 Ca -0.04 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 3kin h SER 202 Cb 0.36 0.66 0.00 0.00 0.14 0.00 0.00 62.40 63.56 3kin h SER 202 CO 0.04 -0.46 0.75 -1.20 -1.14 0.00 0.00 176.83 174.82 3kin n SER 203 N -5.43 0.00 0.00 3.07 7.64 -0.74 0.13 113.62 118.29 3kin n SER 203 Ca -0.05 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.13 3kin n SER 203 Cb 0.37 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 3kin n SER 203 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3kin n ARG 204 N -1.83 0.66 -4.90 1.43 1.74 0.16 -2.82 116.66 111.10 3kin n ARG 204 Ca 0.00 -0.66 -0.26 0.00 -0.77 0.00 0.00 57.85 56.16 3kin n ARG 204 Cb 0.75 -0.70 -0.15 0.00 -1.02 0.00 0.00 32.46 31.34 3kin n ARG 204 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3kin s SER 205 N -0.26 2.19 -0.18 0.55 1.04 0.36 -4.55 113.70 112.85 3kin s SER 205 Ca 0.00 -0.34 -0.16 0.00 0.48 0.00 0.00 55.95 55.93 3kin s SER 205 Cb 0.00 -0.24 -0.04 0.00 0.10 0.00 0.00 66.02 65.84 3kin s SER 205 CO 0.00 0.23 0.40 -1.00 0.98 0.00 0.00 173.24 173.85 3kin s HIS 206 N -0.45 3.42 -0.35 5.02 3.76 -1.01 -4.21 115.29 121.47 3kin s HIS 206 Ca 0.07 0.67 -0.12 0.00 -0.15 0.00 0.00 55.06 55.54 3kin s HIS 206 Cb -0.07 -2.51 0.00 0.00 1.11 0.00 0.00 32.58 31.11 3kin s HIS 206 CO -0.01 0.06 0.22 0.45 -0.85 0.00 0.00 174.74 174.62 3kin s SER 207 N 0.87 5.88 -0.38 1.40 0.15 -0.95 -0.99 113.70 119.69 3kin s SER 207 Ca 0.20 -0.65 -0.04 0.00 0.70 0.00 0.00 55.95 56.16 3kin s SER 207 Cb -0.15 -2.09 0.08 0.00 -1.71 0.00 0.00 66.02 62.16 3kin s SER 207 CO 0.08 -0.29 0.15 -0.63 1.20 0.00 0.00 173.24 173.75 3kin s ILE 208 N 1.65 3.49 0.07 6.45 1.01 -0.34 -1.75 121.20 131.79 3kin s ILE 208 Ca 0.05 -1.63 -0.21 0.00 0.00 0.00 0.00 60.65 58.86 3kin s ILE 208 Cb -0.18 -3.19 -0.07 0.00 0.01 0.00 0.00 42.46 39.04 3kin s ILE 208 CO 0.09 -0.44 0.64 0.12 0.00 0.00 0.00 174.94 175.34 3kin s PHE 209 N 1.27 3.79 -0.27 3.97 5.36 -0.76 -2.78 117.98 128.55 3kin s PHE 209 Ca 0.03 1.35 -0.02 0.00 -0.96 0.00 0.00 56.93 57.32 3kin s PHE 209 Cb -0.22 -2.61 0.09 0.00 -0.34 0.00 0.00 43.02 39.94 3kin s PHE 209 CO -0.01 0.49 0.09 -1.17 -1.46 0.00 0.00 175.22 173.16 3kin s LEU 210 N -0.81 1.46 -0.28 6.12 2.96 -0.65 -1.86 118.68 125.62 3kin s LEU 210 Ca 0.32 -1.32 -0.23 0.00 -0.22 0.00 0.00 54.13 52.68 3kin s LEU 210 Cb -0.20 -0.64 -0.01 0.00 0.50 0.00 0.00 46.19 45.84 3kin s LEU 210 CO 0.20 -0.39 0.74 -0.63 -1.32 0.00 0.00 176.35 174.95 3kin s ILE 211 N 1.83 4.87 -0.45 6.68 1.01 -0.61 -1.78 121.20 132.74 3kin s ILE 211 Ca 0.07 1.24 -0.06 0.00 0.00 0.00 0.00 60.65 61.90 3kin s ILE 211 Cb -0.17 -4.07 0.12 0.00 0.01 0.00 0.00 42.46 38.35 3kin s ILE 211 CO -0.24 -0.12 0.28 0.21 0.00 0.00 0.00 174.94 175.07 3kin s ASN 212 N 1.51 5.46 -0.02 3.58 3.84 -0.63 -0.11 114.94 128.56 3kin s ASN 212 Ca 0.31 -2.02 -0.11 0.00 0.21 0.00 0.00 52.86 51.25 3kin s ASN 212 Cb -0.15 -1.91 -0.05 0.00 -0.55 0.00 0.00 41.25 38.59 3kin s ASN 212 CO 0.10 -0.60 0.31 -0.63 -2.79 0.00 0.00 177.10 173.48 3kin s ILE 213 N 1.18 5.22 -0.06 -5.21 1.09 -0.04 -2.29 121.20 121.09 3kin s ILE 213 Ca 0.08 0.50 -0.02 0.00 -1.10 0.00 0.00 60.65 60.10 3kin s ILE 213 Cb -0.24 -3.59 0.04 0.00 -1.06 0.00 0.00 42.46 37.61 3kin s ILE 213 CO -0.03 0.52 0.10 -0.54 -0.10 0.00 0.00 174.94 174.89 3kin s LYS 214 N -1.28 -0.03 0.10 2.79 1.02 -1.13 -0.60 119.74 120.62 3kin s LYS 214 Ca 0.23 0.44 0.09 0.00 0.02 0.00 0.00 55.97 56.75 3kin s LYS 214 Cb -0.14 -0.40 -0.04 0.00 -0.52 0.00 0.00 37.83 36.73 3kin s LYS 214 CO 0.12 -0.31 -0.21 1.14 -0.92 0.00 0.00 175.35 175.17 3kin s GLN 215 N 2.13 1.73 -0.02 1.68 -2.07 0.12 -1.11 119.66 122.11 3kin s GLN 215 Ca 0.03 -1.19 0.01 0.00 -1.82 0.00 0.00 55.36 52.39 3kin s GLN 215 Cb -0.12 -2.06 0.02 0.00 -1.09 0.00 0.00 33.01 29.76 3kin s GLN 215 CO -0.04 0.49 -0.01 -2.00 -1.32 0.00 0.00 175.29 172.41 3kin s GLU 216 N -1.92 0.28 -0.43 9.60 2.12 -0.77 -1.40 118.70 126.19 3kin s GLU 216 Ca 0.16 0.03 -0.20 0.00 0.36 0.00 0.00 54.97 55.32 3kin s GLU 216 Cb -0.10 -0.42 0.02 0.00 0.26 0.00 0.00 34.13 33.89 3kin s GLU 216 CO 0.07 -0.09 0.60 1.21 -0.54 0.00 0.00 175.26 176.51 3kin s ASN 217 N 0.75 6.30 0.51 -1.70 3.84 -0.45 -0.65 114.94 123.54 3kin s ASN 217 Ca -0.08 -0.40 0.30 0.00 0.21 0.00 0.00 52.86 52.90 3kin s ASN 217 Cb -0.11 -2.30 1.22 0.00 -0.55 0.00 0.00 41.25 39.52 3kin s ASN 217 CO -0.01 -0.73 1.94 -0.37 -2.79 0.00 0.00 177.10 175.14 3kin h VAL 218 N 5.84 0.21 0.00 -5.21 -1.51 -1.55 0.62 116.25 114.65 3kin h VAL 218 Ca -0.26 -0.71 0.00 0.00 -1.23 0.00 0.00 66.70 64.50 3kin h VAL 218 Cb 1.10 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 31.85 3kin h VAL 218 CO 0.87 0.08 0.00 1.21 -1.23 0.00 0.00 177.57 178.50 3kin n GLU 219 N -3.22 0.00 0.00 5.19 2.13 -1.26 -4.22 120.64 119.26 3kin n GLU 219 Ca 0.00 0.07 0.08 0.00 0.66 0.00 0.00 57.16 57.97 3kin n GLU 219 Cb 0.34 -0.74 0.36 0.00 0.27 0.00 0.00 31.44 31.67 3kin n GLU 219 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3kin n THR 220 N -0.70 0.84 -0.52 6.31 -2.24 -1.25 -4.89 114.28 111.83 3kin n THR 220 Ca 0.00 0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 3kin n THR 220 Cb 0.00 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.30 3kin n THR 220 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3kin n GLU 221 N -1.47 0.00 -1.86 -0.78 -0.58 0.22 -4.98 120.64 111.19 3kin n GLU 221 Ca 0.04 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.37 3kin n GLU 221 Cb 0.18 -3.67 -0.02 0.00 -0.57 0.00 0.00 31.44 27.36 3kin n GLU 221 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 3kin s LYS 222 N -0.51 4.18 -0.04 3.49 2.20 -1.24 -4.63 119.74 123.19 3kin s LYS 222 Ca 0.00 2.47 0.06 0.00 -0.36 0.00 0.00 55.97 58.14 3kin s LYS 222 Cb 0.00 -3.07 -0.02 0.00 -1.51 0.00 0.00 37.83 33.23 3kin s LYS 222 CO 0.00 -0.58 -0.22 0.15 -0.36 0.00 0.00 175.35 174.34 3kin s LYS 223 N -0.01 2.33 0.04 4.03 1.02 -1.26 -1.34 119.74 124.55 3kin s LYS 223 Ca 0.64 -0.85 -0.01 0.00 0.02 0.00 0.00 55.97 55.77 3kin s LYS 223 Cb -0.46 -2.17 -0.03 0.00 -0.52 0.00 0.00 37.83 34.65 3kin s LYS 223 CO 0.42 0.54 -0.01 -0.51 -0.92 0.00 0.00 175.35 174.87 3kin s LEU 224 N -0.53 2.31 -0.07 3.17 1.02 -0.49 -5.00 118.68 119.08 3kin s LEU 224 Ca 0.07 -0.79 -0.03 0.00 0.02 0.00 0.00 54.13 53.40 3kin s LEU 224 Cb -0.11 0.24 0.03 0.00 0.02 0.00 0.00 46.19 46.38 3kin s LEU 224 CO 0.00 -0.51 0.15 -0.94 0.02 0.00 0.00 176.35 175.08 3kin s SER 225 N -2.40 -0.13 0.08 2.29 1.04 -1.26 0.11 113.70 113.43 3kin s SER 225 Ca -0.01 0.31 0.08 0.00 0.48 0.00 0.00 55.95 56.81 3kin s SER 225 Cb 0.02 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 3kin s SER 225 CO -0.07 -0.13 -0.19 -0.83 0.98 0.00 0.00 173.24 173.00 3kin s GLY 226 N 0.94 1.62 -0.34 7.32 0.00 0.23 -4.59 107.32 112.51 3kin s GLY 226 Ca -0.07 -1.29 -0.02 0.00 0.00 0.00 0.00 44.72 43.34 3kin s GLY 226 CO -0.05 -1.23 0.07 1.25 0.00 0.00 0.00 173.10 173.14 3kin s LYS 227 N -1.81 2.23 -0.41 2.90 2.47 -1.26 -0.86 119.74 123.00 3kin s LYS 227 Ca 0.16 -1.48 -0.17 0.00 -1.56 0.00 0.00 55.97 52.92 3kin s LYS 227 Cb -0.10 -3.31 0.02 0.00 -1.46 0.00 0.00 37.83 32.97 3kin s LYS 227 CO 0.07 -0.78 0.43 -1.17 0.16 0.00 0.00 175.35 174.07 3kin s LEU 228 N 1.20 4.80 -0.43 5.43 2.96 0.84 -2.72 118.68 130.76 3kin s LEU 228 Ca 0.00 -0.61 -0.13 0.00 -0.22 0.00 0.00 54.13 53.18 3kin s LEU 228 Cb -0.21 -2.39 0.06 0.00 0.50 0.00 0.00 46.19 44.15 3kin s LEU 228 CO -0.02 -0.56 0.30 -0.31 -1.32 0.00 0.00 176.35 174.44 3kin s TYR 229 N 2.14 3.27 -0.56 5.38 2.02 0.16 -1.58 117.35 128.19 3kin s TYR 229 Ca 0.12 -1.09 -0.14 0.00 -0.37 0.00 0.00 57.07 55.60 3kin s TYR 229 Cb -0.17 -2.88 0.14 0.00 -0.40 0.00 0.00 41.96 38.64 3kin s TYR 229 CO 0.13 -0.76 0.49 -0.51 -1.57 0.00 0.00 175.55 173.34 3kin s LEU 230 N 1.56 6.13 -0.13 -1.29 1.43 -0.78 -1.34 118.68 124.26 3kin s LEU 230 Ca 0.03 -1.94 -0.05 0.00 -1.03 0.00 0.00 54.13 51.14 3kin s LEU 230 Cb -0.22 -2.16 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 3kin s LEU 230 CO 0.06 -0.78 0.06 -0.69 0.23 0.00 0.00 176.35 175.22 3kin s VAL 231 N 1.36 4.80 -0.65 -1.59 1.01 -0.58 -1.84 120.40 122.92 3kin s VAL 231 Ca 0.05 -0.05 0.02 0.00 0.00 0.00 0.00 61.98 62.01 3kin s VAL 231 Cb -0.27 -3.10 0.16 0.00 0.00 0.00 0.00 36.38 33.18 3kin s VAL 231 CO 0.01 0.55 0.44 -0.62 0.00 0.00 0.00 175.10 175.48 3kin s ASP 232 N -0.42 4.91 1.37 3.32 -1.08 -0.72 -1.50 116.67 122.55 3kin s ASP 232 Ca 0.09 -3.34 -0.22 0.00 -0.52 0.00 0.00 52.55 48.56 3kin s ASP 232 Cb -0.12 -1.72 0.35 0.00 -1.46 0.00 0.00 42.92 39.96 3kin s ASP 232 CO 0.02 -0.21 0.97 -0.76 0.52 0.00 0.00 175.17 175.71 3kin s LEU 233 N -0.76 -0.66 0.38 -1.34 1.43 -1.10 -2.23 118.68 114.40 3kin s LEU 233 Ca 0.21 0.82 -0.03 0.00 -1.03 0.00 0.00 54.13 54.10 3kin s LEU 233 Cb -0.16 -2.32 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 3kin s LEU 233 CO -0.07 -5.08 0.63 0.00 0.23 0.00 0.00 176.35 172.05 3kin s ALA 234 N -2.44 3.58 0.35 4.21 0.00 -1.26 -4.75 121.76 121.45 3kin s ALA 234 Ca 0.69 -0.70 -0.24 0.00 0.00 0.00 0.00 51.96 51.71 3kin s ALA 234 Cb -0.13 -2.31 -0.14 0.00 0.00 0.00 0.00 23.12 20.54 3kin s ALA 234 CO 0.58 -0.07 0.56 0.41 0.00 0.00 0.00 175.76 177.24 3kin n GLY 235 N -1.75 -1.49 0.81 0.00 0.00 -1.13 -4.71 105.19 96.92 3kin n GLY 235 Ca -0.02 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.23 3kin n GLY 235 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kin n SER 236 N 1.56 2.95 -4.66 1.61 3.41 -0.43 -4.86 113.62 113.20 3kin n SER 236 Ca 0.12 -1.88 -0.44 0.00 -0.26 0.00 0.00 58.87 56.42 3kin n SER 236 Cb 0.35 -0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 64.07 3kin n SER 236 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3kin n GLU 237 N 0.92 1.89 0.00 4.33 0.00 -1.26 -4.96 120.64 121.56 3kin n GLU 237 Ca 0.14 0.67 0.00 0.00 0.00 0.00 0.00 57.16 57.97 3kin n GLU 237 Cb 0.46 -2.25 0.00 0.00 0.00 0.00 0.00 31.44 29.65 3kin n GLU 237 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3kin n LYS 238 N 1.41 0.48 0.00 3.44 4.01 -1.26 -5.08 118.16 121.16 3kin n LYS 238 Ca 0.10 0.00 0.16 0.00 -0.51 0.00 0.00 58.31 58.06 3kin n LYS 238 Cb 0.32 0.00 0.94 0.00 -0.51 0.00 0.00 35.03 35.78 3kin n LYS 238 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57