#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kt3 n LYS 18 N 0.00 0.04 -3.59 1.47 5.02 -1.26 -5.04 118.16 114.81 3kt3 n LYS 18 Ca 0.00 0.07 -0.29 0.00 -2.02 0.00 0.00 58.31 56.07 3kt3 n LYS 18 Cb 0.00 -1.97 -0.15 0.00 -0.02 0.00 0.00 35.03 32.90 3kt3 n LYS 18 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3kt3 s SER 19 N -1.82 3.62 -0.06 4.39 1.04 -1.26 -5.00 113.70 114.60 3kt3 s SER 19 Ca 0.64 -1.51 0.03 0.00 0.48 0.00 0.00 55.95 55.58 3kt3 s SER 19 Cb -0.28 -0.51 0.18 0.00 0.10 0.00 0.00 66.02 65.50 3kt3 s SER 19 CO 0.60 -0.42 0.88 0.35 0.98 0.00 0.00 173.24 175.63 3kt3 n THR 20 N 4.98 0.82 -0.03 2.02 -2.24 -1.26 -3.91 114.28 114.66 3kt3 n THR 20 Ca -0.03 -0.34 0.03 0.00 -2.27 0.00 0.00 64.05 61.44 3kt3 n THR 20 Cb 0.41 -0.55 -0.11 0.00 -2.10 0.00 0.00 70.33 67.98 3kt3 n THR 20 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3kt3 n ASP 21 N 0.14 1.77 -4.21 3.42 4.64 -1.26 -5.03 116.55 116.02 3kt3 n ASP 21 Ca 0.08 0.00 -0.58 0.00 -1.38 0.00 0.00 54.79 52.91 3kt3 n ASP 21 Cb 0.53 1.38 -0.08 0.00 -1.04 0.00 0.00 41.12 41.91 3kt3 n ASP 21 CO 0.00 0.00 0.00 0.52 -0.82 0.00 0.00 177.20 176.90 3kt3 n VAL 22 N -2.15 0.00 -3.70 5.18 0.31 -1.25 -4.69 118.33 112.03 3kt3 n VAL 22 Ca -0.09 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.14 3kt3 n VAL 22 Cb 0.55 -0.22 -0.11 0.00 -0.91 0.00 0.00 33.84 33.15 3kt3 n VAL 22 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 3kt3 s LYS 23 N 1.33 0.39 0.34 5.55 2.20 -0.37 -4.92 119.74 124.25 3kt3 s LYS 23 Ca 0.89 0.78 -0.21 0.00 -0.36 0.00 0.00 55.97 57.08 3kt3 s LYS 23 Cb -1.26 -0.03 -0.10 0.00 -1.51 0.00 0.00 37.83 34.94 3kt3 s LYS 23 CO 0.63 -0.16 0.86 -1.21 -0.36 0.00 0.00 175.35 175.11 3kt3 s GLU 24 N 1.41 4.27 0.12 4.03 0.41 -1.26 -0.94 118.70 126.74 3kt3 s GLU 24 Ca -0.10 1.02 -0.35 0.00 -0.41 0.00 0.00 54.97 55.14 3kt3 s GLU 24 Cb -0.08 -2.52 -0.16 0.00 -1.78 0.00 0.00 34.13 29.59 3kt3 s GLU 24 CO -0.13 0.17 1.39 0.94 -0.49 0.00 0.00 175.26 177.14 3kt3 n GLN 25 N -0.02 1.47 -4.24 1.61 7.27 -1.26 -4.40 117.38 117.81 3kt3 n GLN 25 Ca 0.03 0.53 -0.32 0.00 0.07 0.00 0.00 57.00 57.31 3kt3 n GLN 25 Cb 0.52 -2.19 -0.16 0.00 2.41 0.00 0.00 30.24 30.82 3kt3 n GLN 25 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 3kt3 s VAL 26 N 0.51 1.87 -0.13 1.69 1.01 -0.80 -4.95 120.40 119.61 3kt3 s VAL 26 Ca 0.81 -0.84 -0.00 0.00 0.00 0.00 0.00 61.98 61.95 3kt3 s VAL 26 Cb -0.85 -1.70 0.03 0.00 0.00 0.00 0.00 36.38 33.85 3kt3 s VAL 26 CO 0.45 0.51 -0.09 -0.69 0.00 0.00 0.00 175.10 175.28 3kt3 s VAL 27 N 1.21 1.20 0.28 2.92 1.01 -1.26 -1.60 120.40 124.16 3kt3 s VAL 27 Ca 0.01 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.59 3kt3 s VAL 27 Cb -0.14 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 3kt3 s VAL 27 CO -0.09 0.37 0.11 0.42 0.00 0.00 0.00 175.10 175.91 3kt3 s THR 28 N 1.63 0.56 -0.34 3.92 -4.23 -0.18 -4.99 115.64 112.02 3kt3 s THR 28 Ca 0.05 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.72 3kt3 s THR 28 Cb -0.13 -2.61 0.16 0.00 1.34 0.00 0.00 72.50 71.26 3kt3 s THR 28 CO -0.09 0.00 1.49 -2.65 -0.54 0.00 0.00 174.62 172.83 3kt3 n PRO 29 N -0.53 0.11 0.00 3.99 -0.02 -1.13 -3.16 135.00 134.26 3kt3 n PRO 29 Ca -0.00 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 3kt3 n PRO 29 Cb 0.66 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 3kt3 n PRO 29 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3kt3 n TRP 30 N -2.08 0.00 -3.90 6.00 8.01 -1.26 -4.97 117.44 119.24 3kt3 n TRP 30 Ca -0.01 0.00 -0.11 0.00 -1.31 0.00 0.00 57.50 56.07 3kt3 n TRP 30 Cb 0.05 0.00 -0.12 0.00 -2.01 0.00 0.00 31.31 29.23 3kt3 n TRP 30 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 3kt3 s ASP 31 N -1.71 0.07 -0.24 -0.99 1.01 -1.19 -5.12 116.67 108.50 3kt3 s ASP 31 Ca 0.00 -0.18 -0.02 0.00 0.71 0.00 0.00 52.55 53.06 3kt3 s ASP 31 Cb 0.00 0.12 0.08 0.00 1.01 0.00 0.00 42.92 44.12 3kt3 s ASP 31 CO 0.00 -0.18 0.06 -0.69 0.21 0.00 0.00 175.17 174.57 3kt3 s VAL 32 N -0.76 0.63 0.17 -1.27 1.01 -1.26 -1.01 120.40 117.91 3kt3 s VAL 32 Ca -0.08 -0.88 0.11 0.00 0.00 0.00 0.00 61.98 61.12 3kt3 s VAL 32 Cb -0.05 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3kt3 s VAL 32 CO -0.00 -0.41 -0.21 -1.83 0.00 0.00 0.00 175.10 172.65 3kt3 s GLU 33 N 1.78 1.62 0.12 2.72 -1.05 -0.63 -4.62 118.70 118.64 3kt3 s GLU 33 Ca 0.03 -1.40 0.04 0.00 -0.15 0.00 0.00 54.97 53.49 3kt3 s GLU 33 Cb -0.17 -1.94 -0.17 0.00 -0.44 0.00 0.00 34.13 31.41 3kt3 s GLU 33 CO -0.16 0.43 1.28 0.78 0.95 0.00 0.00 175.26 178.53 3kt3 h GLY 34 N 3.36 0.10 0.00 -3.83 0.00 -1.87 -2.11 103.07 98.72 3kt3 h GLY 34 Ca -0.48 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 46.62 3kt3 h GLY 34 CO 0.47 0.20 0.00 0.61 0.00 0.00 0.00 176.54 177.82 3kt3 n GLY 35 N 1.27 1.14 3.14 4.60 0.00 -1.26 -4.39 105.19 109.68 3kt3 n GLY 35 Ca -0.02 -1.48 -0.27 0.00 0.00 0.00 0.00 46.02 44.24 3kt3 n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kt3 s VAL 36 N -1.10 1.55 0.09 1.61 1.01 -0.12 -1.03 120.40 122.42 3kt3 s VAL 36 Ca 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.24 3kt3 s VAL 36 Cb 0.00 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 35.05 3kt3 s VAL 36 CO 0.00 0.45 0.12 0.47 0.00 0.00 0.00 175.10 176.14 3kt3 n ASP 37 N 3.36 0.47 0.08 3.32 10.43 -0.13 -1.24 116.55 132.85 3kt3 n ASP 37 Ca -0.19 -1.26 0.13 0.00 2.57 0.00 0.00 54.79 56.04 3kt3 n ASP 37 Cb 0.53 -0.06 0.40 0.00 1.84 0.00 0.00 41.12 43.82 3kt3 n ASP 37 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3kt3 n GLU 38 N -1.14 0.23 -0.34 -1.24 1.02 -1.26 -3.33 120.64 114.57 3kt3 n GLU 38 Ca 0.02 0.16 0.06 0.00 -0.02 0.00 0.00 57.16 57.39 3kt3 n GLU 38 Cb 0.10 -1.74 0.22 0.00 -0.02 0.00 0.00 31.44 29.99 3kt3 n GLU 38 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3kt3 n GLN 39 N -2.13 2.51 0.00 3.49 1.13 -1.26 -5.05 117.38 116.08 3kt3 n GLN 39 Ca 0.05 -1.75 0.00 0.00 -1.94 0.00 0.00 57.00 53.37 3kt3 n GLN 39 Cb 0.42 -1.56 0.00 0.00 0.11 0.00 0.00 30.24 29.21 3kt3 n GLN 39 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3kt3 n GLY 40 N 0.95 -3.14 3.78 1.08 0.00 -1.21 -4.97 105.19 101.67 3kt3 n GLY 40 Ca 0.16 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.91 3kt3 n GLY 40 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3kt3 s ARG 41 N -0.70 3.99 0.54 1.61 1.70 -1.26 -0.95 118.95 123.87 3kt3 s ARG 41 Ca 0.00 1.64 -0.20 0.00 -0.47 0.00 0.00 55.73 56.70 3kt3 s ARG 41 Cb 0.00 -2.50 -0.05 0.00 -0.57 0.00 0.00 34.95 31.83 3kt3 s ARG 41 CO 0.00 -0.32 1.19 0.00 -1.08 0.00 0.00 175.30 175.09 3kt3 s ALA 42 N -1.59 2.73 -0.91 7.88 0.00 -0.20 -4.90 121.76 124.78 3kt3 s ALA 42 Ca 0.60 0.97 0.22 0.00 0.00 0.00 0.00 51.96 53.76 3kt3 s ALA 42 Cb -0.25 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.44 3kt3 s ALA 42 CO 0.31 -0.94 1.03 1.04 0.00 0.00 0.00 175.76 177.21 3kt3 n GLN 43 N -1.14 0.07 -4.05 0.00 6.02 -1.26 -4.79 117.38 112.23 3kt3 n GLN 43 Ca 0.11 -0.01 -0.08 0.00 -0.01 0.00 0.00 57.00 57.01 3kt3 n GLN 43 Cb 0.49 -1.51 -0.10 0.00 1.02 0.00 0.00 30.24 30.13 3kt3 n GLN 43 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3kt3 s ASN 44 N -3.18 0.39 0.06 1.08 -0.87 -1.26 -3.85 114.94 107.30 3kt3 s ASN 44 Ca 0.08 -0.80 -0.31 0.00 -1.57 0.00 0.00 52.86 50.26 3kt3 s ASN 44 Cb 0.16 0.16 -0.05 0.00 -0.02 0.00 0.00 41.25 41.50 3kt3 s ASN 44 CO 0.82 -0.48 1.18 -0.63 -2.57 0.00 0.00 177.10 175.42 3kt3 s ILE 45 N -2.94 4.09 -0.61 0.60 -1.09 -1.26 -4.96 121.20 115.02 3kt3 s ILE 45 Ca -0.02 1.50 -0.22 0.00 -2.23 0.00 0.00 60.65 59.68 3kt3 s ILE 45 Cb 0.01 -3.96 0.07 0.00 -1.58 0.00 0.00 42.46 36.99 3kt3 s ILE 45 CO -0.06 0.12 0.88 -0.62 -1.23 0.00 0.00 174.94 174.03 3kt3 s ASP 46 N 1.06 6.21 0.34 3.58 2.15 -1.26 -4.91 116.67 123.84 3kt3 s ASP 46 Ca 0.58 -0.91 0.18 0.00 0.43 0.00 0.00 52.55 52.83 3kt3 s ASP 46 Cb -0.29 -2.39 0.36 0.00 -0.30 0.00 0.00 42.92 40.30 3kt3 s ASP 46 CO 0.29 -1.29 1.58 1.88 -0.17 0.00 0.00 175.17 177.46 3kt3 h TYR 47 N 9.40 0.00 -0.47 -5.34 0.05 -1.99 -2.30 116.97 116.33 3kt3 h TYR 47 Ca -0.28 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.47 3kt3 h TYR 47 Cb 1.08 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 3kt3 h TYR 47 CO 0.91 0.37 0.16 -0.44 -1.05 0.00 0.00 178.16 178.12 3kt3 h ASP 48 N 0.00 0.66 0.37 3.88 3.32 -2.00 -2.28 116.42 120.38 3kt3 h ASP 48 Ca -0.00 -0.19 -0.11 0.00 0.02 0.00 0.00 57.03 56.74 3kt3 h ASP 48 Cb 1.15 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 3kt3 h ASP 48 CO 0.05 0.68 -0.48 0.50 -1.72 0.00 0.00 179.24 178.26 3kt3 h LYS 49 N 0.61 0.13 -0.57 3.56 3.64 -1.94 -2.83 116.57 119.17 3kt3 h LYS 49 Ca 0.15 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 3kt3 h LYS 49 Cb 0.24 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 3kt3 h LYS 49 CO -0.01 0.59 0.09 -0.07 -2.27 0.00 0.00 179.45 177.78 3kt3 h LEU 50 N 0.11 0.87 -0.61 5.20 3.38 -1.29 -0.25 115.31 122.72 3kt3 h LEU 50 Ca 0.00 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3kt3 h LEU 50 Cb 0.89 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 3kt3 h LEU 50 CO 0.07 0.88 0.39 0.40 0.09 0.00 0.00 178.44 180.28 3kt3 h ILE 51 N 0.87 1.13 -0.34 1.22 2.04 -1.17 -1.03 117.51 120.23 3kt3 h ILE 51 Ca 0.18 -0.27 -0.09 0.00 1.00 0.00 0.00 64.86 65.68 3kt3 h ILE 51 Cb 0.39 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 3kt3 h ILE 51 CO 0.01 0.15 -0.13 0.11 0.00 0.00 0.00 178.15 178.28 3kt3 h LYS 52 N 0.80 0.68 -0.77 2.37 1.57 -1.30 -1.11 116.57 118.80 3kt3 h LYS 52 Ca 0.23 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3kt3 h LYS 52 Cb -0.05 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3kt3 h LYS 52 CO -0.07 0.87 0.44 1.96 -0.57 0.00 0.00 179.45 182.08 3kt3 h GLN 53 N 0.46 1.07 0.00 3.15 4.20 -0.91 -3.11 115.11 119.97 3kt3 h GLN 53 Ca 0.08 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3kt3 h GLN 53 Cb 0.65 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.22 3kt3 h GLN 53 CO 0.04 0.78 -0.68 1.19 -0.67 0.00 0.00 178.83 179.49 3kt3 n PHE 54 N -4.45 0.30 -2.54 2.96 3.72 -0.40 -4.97 117.46 112.08 3kt3 n PHE 54 Ca 0.07 0.09 -0.07 0.00 -0.05 0.00 0.00 57.45 57.49 3kt3 n PHE 54 Cb 0.08 -0.47 0.01 0.00 -0.94 0.00 0.00 39.48 38.17 3kt3 n PHE 54 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kt3 n GLY 55 N 1.40 0.36 3.77 1.37 0.00 -0.51 -5.05 105.19 106.52 3kt3 n GLY 55 Ca 0.04 -0.50 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 3kt3 n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kt3 n THR 56 N -3.54 0.00 -4.69 2.61 -2.24 -0.68 -5.05 114.28 100.68 3kt3 n THR 56 Ca -0.03 -1.83 -0.32 0.00 -2.27 0.00 0.00 64.05 59.60 3kt3 n THR 56 Cb 0.53 -0.57 -0.12 0.00 -2.10 0.00 0.00 70.33 68.07 3kt3 n THR 56 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3kt3 s LYS 57 N -4.59 2.36 0.51 -0.78 1.02 -0.55 -4.81 119.74 112.90 3kt3 s LYS 57 Ca 0.59 -0.81 -0.17 0.00 0.02 0.00 0.00 55.97 55.60 3kt3 s LYS 57 Cb -0.05 -2.34 -0.08 0.00 -0.52 0.00 0.00 37.83 34.84 3kt3 s LYS 57 CO 0.38 0.59 0.99 -2.14 -0.92 0.00 0.00 175.35 174.24 3kt3 s PRO 58 N -1.18 3.93 -0.31 -1.68 0.02 -1.26 0.04 135.00 134.56 3kt3 s PRO 58 Ca 0.14 1.03 -0.29 0.00 0.02 0.00 0.00 61.00 61.90 3kt3 s PRO 58 Cb -0.11 -2.13 0.00 0.00 0.02 0.00 0.00 34.50 32.29 3kt3 s PRO 58 CO 0.04 -0.29 1.27 0.08 -0.33 0.00 0.00 177.00 177.77 3kt3 s VAL 59 N -2.50 4.18 0.62 3.83 1.01 0.20 -4.78 120.40 122.96 3kt3 s VAL 59 Ca 0.60 1.33 0.02 0.00 0.00 0.00 0.00 61.98 63.93 3kt3 s VAL 59 Cb -0.11 -4.19 0.08 0.00 0.00 0.00 0.00 36.38 32.16 3kt3 s VAL 59 CO 0.28 -0.49 0.86 0.20 0.00 0.00 0.00 175.10 175.95 3kt3 s ASN 60 N 2.66 4.89 0.34 3.32 0.01 -1.26 -4.94 114.94 119.96 3kt3 s ASN 60 Ca 0.55 -0.27 0.06 0.00 -0.71 0.00 0.00 52.86 52.49 3kt3 s ASN 60 Cb -0.16 -0.37 0.61 0.00 0.41 0.00 0.00 41.25 41.74 3kt3 s ASN 60 CO 0.22 -1.45 1.83 -0.08 -1.51 0.00 0.00 177.10 176.11 3kt3 h GLU 61 N -0.14 0.35 -0.60 -0.60 4.57 -1.99 -2.95 114.58 113.22 3kt3 h GLU 61 Ca -0.38 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 57.67 3kt3 h GLU 61 Cb 1.28 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.81 3kt3 h GLU 61 CO 0.46 0.52 0.28 1.49 -1.18 0.00 0.00 179.01 180.58 3kt3 h GLU 62 N 0.32 0.87 -0.37 1.92 4.57 -1.98 -0.92 114.58 118.99 3kt3 h GLU 62 Ca 0.06 -0.13 0.06 0.00 -1.18 0.00 0.00 59.36 58.17 3kt3 h GLU 62 Cb 0.50 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 28.88 3kt3 h GLU 62 CO 0.03 0.71 0.03 1.15 -1.18 0.00 0.00 179.01 179.75 3kt3 h THR 63 N 0.83 0.76 -0.35 0.32 2.02 -1.89 0.69 112.91 115.29 3kt3 h THR 63 Ca 0.21 -0.05 -0.12 0.00 0.77 0.00 0.00 66.41 67.22 3kt3 h THR 63 Cb 0.13 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 3kt3 h THR 63 CO -0.02 0.02 -0.26 -0.07 0.37 0.00 0.00 175.52 175.56 3kt3 h LEU 64 N 0.13 0.84 -0.07 2.58 3.38 -1.40 -0.81 115.31 119.96 3kt3 h LEU 64 Ca 0.18 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3kt3 h LEU 64 Cb 0.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3kt3 h LEU 64 CO -0.27 1.10 0.04 0.50 0.09 0.00 0.00 178.44 179.90 3kt3 h LYS 65 N 0.58 0.10 -0.39 1.13 3.64 -0.91 -1.94 116.57 118.79 3kt3 h LYS 65 Ca 0.07 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.34 3kt3 h LYS 65 Cb 0.83 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 3kt3 h LYS 65 CO 0.07 0.14 -0.17 -0.09 -2.27 0.00 0.00 179.45 177.14 3kt3 h ARG 66 N 0.03 0.72 -0.38 1.90 2.43 -0.87 -2.62 114.38 115.59 3kt3 h ARG 66 Ca 0.03 -0.26 0.01 0.00 -0.81 0.00 0.00 59.98 58.95 3kt3 h ARG 66 Cb 0.07 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 3kt3 h ARG 66 CO -0.00 0.84 0.24 0.35 -1.51 0.00 0.00 179.97 179.89 3kt3 h PHE 67 N 0.64 0.45 -0.41 2.20 3.57 -0.93 -0.23 116.94 122.23 3kt3 h PHE 67 Ca 0.10 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 3kt3 h PHE 67 Cb 0.64 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 3kt3 h PHE 67 CO 0.03 0.28 0.06 -0.22 -2.23 0.00 0.00 178.31 176.23 3kt3 h LYS 68 N 0.49 0.68 -0.10 1.11 3.64 -1.31 -1.56 116.57 119.52 3kt3 h LYS 68 Ca 0.14 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3kt3 h LYS 68 Cb -0.04 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.70 3kt3 h LYS 68 CO -0.04 0.72 0.06 0.37 -2.27 0.00 0.00 179.45 178.29 3kt3 h GLN 69 N 0.53 0.14 -0.51 1.90 4.15 -1.32 0.65 115.11 120.64 3kt3 h GLN 69 Ca 0.12 -0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.43 3kt3 h GLN 69 Cb 0.38 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.02 3kt3 h GLN 69 CO 0.01 0.14 -0.06 0.28 -1.93 0.00 0.00 178.83 177.27 3kt3 h VAL 70 N 0.10 1.27 0.00 2.39 2.07 -0.98 -3.33 116.25 117.76 3kt3 h VAL 70 Ca 0.04 -1.18 -0.22 0.00 0.82 0.00 0.00 66.70 66.16 3kt3 h VAL 70 Cb 0.04 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 3kt3 h VAL 70 CO -0.01 0.41 -2.19 0.35 0.02 0.00 0.00 177.57 176.16 3kt3 n THR 71 N -4.24 0.83 -0.89 2.57 -2.24 -0.60 -4.75 114.28 104.96 3kt3 n THR 71 Ca 0.01 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 3kt3 n THR 71 Cb 0.36 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3kt3 n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kt3 n GLY 72 N 1.62 0.89 3.80 3.38 0.00 0.23 -4.35 105.19 110.76 3kt3 n GLY 72 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 3kt3 n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kt3 s ARG 73 N -0.11 3.03 0.15 1.61 1.81 -1.24 -5.00 118.95 119.20 3kt3 s ARG 73 Ca 0.00 -0.59 -0.31 0.00 -1.72 0.00 0.00 55.73 53.11 3kt3 s ARG 73 Cb 0.00 -2.82 -0.08 0.00 -0.45 0.00 0.00 34.95 31.60 3kt3 s ARG 73 CO 0.00 0.59 1.33 -2.00 -0.68 0.00 0.00 175.30 174.54 3kt3 s GLU 74 N -2.25 4.37 0.41 3.54 2.56 -1.26 -4.02 118.70 122.04 3kt3 s GLU 74 Ca 0.29 2.03 -0.27 0.00 0.00 0.00 0.00 54.97 57.02 3kt3 s GLU 74 Cb -0.12 -3.23 -0.10 0.00 2.00 0.00 0.00 34.13 32.67 3kt3 s GLU 74 CO 0.21 -0.32 1.42 -2.30 -0.56 0.00 0.00 175.26 173.71 3kt3 n PRO 75 N 3.28 2.37 -1.80 4.30 -0.02 -1.26 -4.94 135.00 136.92 3kt3 n PRO 75 Ca 0.08 0.84 -0.38 0.00 -2.02 0.00 0.00 63.50 62.02 3kt3 n PRO 75 Cb 0.43 -2.58 0.04 0.00 -0.02 0.00 0.00 33.50 31.36 3kt3 n PRO 75 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3kt3 s HIS 76 N -1.15 2.31 0.59 6.00 2.46 -1.26 -4.73 115.29 119.50 3kt3 s HIS 76 Ca 0.57 1.38 0.30 0.00 0.47 0.00 0.00 55.06 57.79 3kt3 s HIS 76 Cb -0.48 -3.78 1.81 0.00 -0.13 0.00 0.00 32.58 30.00 3kt3 s HIS 76 CO 0.61 -2.84 2.23 1.12 -2.47 0.00 0.00 174.74 173.38 3kt3 h HIS 77 N 1.47 0.00 -0.91 3.88 2.07 -1.99 0.10 115.15 119.78 3kt3 h HIS 77 Ca -0.51 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.00 3kt3 h HIS 77 Cb 1.30 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.24 3kt3 h HIS 77 CO 0.46 0.00 0.51 0.74 -3.07 0.00 0.00 177.93 176.57 3kt3 h PHE 78 N 0.00 1.23 -0.06 6.12 0.04 -1.93 -1.16 116.94 121.17 3kt3 h PHE 78 Ca 0.02 -0.02 -0.15 0.00 2.80 0.00 0.00 57.97 60.62 3kt3 h PHE 78 Cb 0.11 -0.40 0.01 0.00 2.20 0.00 0.00 35.95 37.87 3kt3 h PHE 78 CO 0.00 0.84 -0.54 -0.07 -0.60 0.00 0.00 178.31 177.94 3kt3 h LEU 79 N 1.26 0.59 -1.08 1.54 3.38 -1.09 0.35 115.31 120.25 3kt3 h LEU 79 Ca 0.32 -0.68 0.03 0.00 0.09 0.00 0.00 57.88 57.63 3kt3 h LEU 79 Cb 0.00 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 3kt3 h LEU 79 CO -0.05 1.18 0.62 0.03 0.09 0.00 0.00 178.44 180.31 3kt3 h ARG 80 N 0.04 1.19 0.00 1.13 3.08 -1.21 -2.12 114.38 116.49 3kt3 h ARG 80 Ca -0.05 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3kt3 h ARG 80 Cb 1.20 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.99 3kt3 h ARG 80 CO 0.11 0.79 -0.30 1.63 -1.07 0.00 0.00 179.97 181.12 3kt3 n LYS 81 N -4.42 0.10 -1.16 0.04 5.02 -0.45 -4.93 118.16 112.35 3kt3 n LYS 81 Ca 0.12 0.05 -0.03 0.00 -2.02 0.00 0.00 58.31 56.43 3kt3 n LYS 81 Cb 0.07 -1.58 -0.01 0.00 -0.02 0.00 0.00 35.03 33.48 3kt3 n LYS 81 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kt3 n GLY 82 N 1.44 0.61 0.26 0.72 0.00 -0.80 -4.93 105.19 102.49 3kt3 n GLY 82 Ca 0.05 -0.91 -0.07 0.00 0.00 0.00 0.00 46.02 45.09 3kt3 n GLY 82 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3kt3 h LEU 83 N 0.00 0.73 -8.54 0.99 3.38 -0.60 -3.20 115.31 108.07 3kt3 h LEU 83 Ca -0.07 -0.27 -0.65 0.00 0.09 0.00 0.00 57.88 56.98 3kt3 h LEU 83 Cb 0.28 -0.20 -0.15 0.00 0.09 0.00 0.00 40.66 40.68 3kt3 h LEU 83 CO 0.10 0.96 0.23 -0.36 0.09 0.00 0.00 178.44 179.45 3kt3 s PHE 84 N -4.53 3.00 -0.08 1.13 0.40 -0.79 0.33 117.98 117.44 3kt3 s PHE 84 Ca -0.09 -0.12 0.13 0.00 -0.60 0.00 0.00 56.93 56.25 3kt3 s PHE 84 Cb 0.13 -3.57 -0.19 0.00 0.51 0.00 0.00 43.02 39.90 3kt3 s PHE 84 CO 0.83 -1.01 0.16 1.97 0.70 0.00 0.00 175.22 177.87 3kt3 n PHE 85 N 6.53 0.00 -4.20 0.36 -1.74 -0.34 -4.63 117.46 113.45 3kt3 n PHE 85 Ca -0.01 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.76 3kt3 n PHE 85 Cb 0.47 -0.51 -0.10 0.00 1.52 0.00 0.00 39.48 40.87 3kt3 n PHE 85 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 3kt3 s SER 86 N -4.18 1.02 0.14 5.98 1.04 -1.16 -0.63 113.70 115.91 3kt3 s SER 86 Ca -0.06 -1.11 -0.17 0.00 0.48 0.00 0.00 55.95 55.09 3kt3 s SER 86 Cb 0.06 0.14 0.04 0.00 0.10 0.00 0.00 66.02 66.36 3kt3 s SER 86 CO 0.56 -0.56 0.44 -1.83 0.98 0.00 0.00 173.24 172.84 3kt3 s GLU 87 N -3.91 1.16 -0.04 4.02 4.04 0.11 -0.37 118.70 123.71 3kt3 s GLU 87 Ca 0.19 -0.73 0.02 0.00 0.04 0.00 0.00 54.97 54.49 3kt3 s GLU 87 Cb 0.06 0.49 0.01 0.00 0.02 0.00 0.00 34.13 34.71 3kt3 s GLU 87 CO -0.00 -0.47 -0.09 1.03 -1.84 0.00 0.00 175.26 173.89 3kt3 s ARG 88 N -3.82 1.17 -0.80 -4.83 0.52 -0.41 -1.48 118.95 109.31 3kt3 s ARG 88 Ca 0.04 -0.29 -0.00 0.00 -0.52 0.00 0.00 55.73 54.96 3kt3 s ARG 88 Cb 0.01 -1.05 0.00 0.00 0.52 0.00 0.00 34.95 34.43 3kt3 s ARG 88 CO -0.10 0.04 0.01 -0.25 0.02 0.00 0.00 175.30 175.01 3kt3 n ASP 89 N 3.65 -3.18 0.21 0.23 8.00 -1.26 -1.29 116.55 122.91 3kt3 n ASP 89 Ca -0.22 0.26 0.06 0.00 0.71 0.00 0.00 54.79 55.61 3kt3 n ASP 89 Cb 0.52 -2.74 0.45 0.00 -0.02 0.00 0.00 41.12 39.33 3kt3 n ASP 89 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 3kt3 h PHE 90 N -0.01 0.00 -0.25 1.24 3.57 -1.90 -2.90 116.94 116.69 3kt3 h PHE 90 Ca -0.22 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.32 3kt3 h PHE 90 Cb 1.16 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.86 3kt3 h PHE 90 CO 0.75 0.31 -0.02 1.15 -2.23 0.00 0.00 178.31 178.27 3kt3 h THR 91 N 0.00 0.80 0.00 4.41 2.02 -1.99 -1.75 112.91 116.40 3kt3 h THR 91 Ca -0.00 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 3kt3 h THR 91 Cb 0.67 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 3kt3 h THR 91 CO 0.04 0.01 -0.17 0.07 0.37 0.00 0.00 175.52 175.84 3kt3 h LYS 92 N 0.06 0.00 -0.39 6.66 2.10 -1.91 0.43 116.57 123.52 3kt3 h LYS 92 Ca 0.12 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.65 3kt3 h LYS 92 Cb 0.16 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.48 3kt3 h LYS 92 CO -0.21 0.17 -0.21 0.82 -2.00 0.00 0.00 179.45 178.01 3kt3 h ILE 93 N 0.00 1.28 -0.66 0.07 1.08 -1.46 -1.03 117.51 116.80 3kt3 h ILE 93 Ca -0.00 -1.36 -0.07 0.00 -0.39 0.00 0.00 64.86 63.04 3kt3 h ILE 93 Cb 0.31 1.32 -0.03 0.00 -3.07 0.00 0.00 36.82 35.35 3kt3 h ILE 93 CO 0.02 0.45 0.13 -0.07 -0.69 0.00 0.00 178.15 177.99 3kt3 h LEU 94 N 0.64 1.03 -0.23 1.44 3.38 -0.40 -1.92 115.31 119.24 3kt3 h LEU 94 Ca 0.08 -0.25 0.04 0.00 0.09 0.00 0.00 57.88 57.84 3kt3 h LEU 94 Cb 0.77 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 3kt3 h LEU 94 CO 0.06 1.01 0.01 0.44 0.09 0.00 0.00 178.44 180.06 3kt3 h ASP 95 N 1.00 -0.07 -0.83 -0.43 3.32 -0.86 -0.74 116.42 117.81 3kt3 h ASP 95 Ca 0.20 0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.32 3kt3 h ASP 95 Cb 0.41 0.08 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 3kt3 h ASP 95 CO 0.01 -0.00 0.55 -0.07 -1.72 0.00 0.00 179.24 178.00 3kt3 h LEU 96 N 0.09 0.93 -0.39 1.55 3.38 -0.94 -1.38 115.31 118.54 3kt3 h LEU 96 Ca 0.11 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 3kt3 h LEU 96 Cb 0.13 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3kt3 h LEU 96 CO -0.17 0.66 -0.09 0.22 0.09 0.00 0.00 178.44 179.15 3kt3 h TYR 97 N 1.10 0.85 -0.68 1.13 3.20 -1.20 0.22 116.97 121.59 3kt3 h TYR 97 Ca 0.32 -0.18 0.08 0.00 3.14 0.00 0.00 58.73 62.09 3kt3 h TYR 97 Cb -0.08 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 37.94 3kt3 h TYR 97 CO -0.02 0.88 0.45 1.49 -1.64 0.00 0.00 178.16 179.33 3kt3 h GLU 98 N 0.56 0.60 -0.25 1.82 4.81 -0.59 -1.34 114.58 120.20 3kt3 h GLU 98 Ca 0.10 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3kt3 h GLU 98 Cb 0.61 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.85 3kt3 h GLU 98 CO 0.04 0.40 0.00 1.04 -0.73 0.00 0.00 179.01 179.75 3kt3 n GLN 99 N -4.48 1.97 -1.03 1.92 6.02 -0.57 0.20 117.38 121.41 3kt3 n GLN 99 Ca 0.11 -1.47 -0.01 0.00 -0.01 0.00 0.00 57.00 55.61 3kt3 n GLN 99 Cb 0.29 -1.42 -0.00 0.00 1.02 0.00 0.00 30.24 30.12 3kt3 n GLN 99 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kt3 n GLY 100 N 1.24 0.33 3.83 1.08 0.00 -0.51 -4.40 105.19 106.76 3kt3 n GLY 100 Ca 0.17 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3kt3 n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kt3 s LYS 101 N -1.29 3.62 0.27 1.61 1.02 0.75 -4.99 119.74 120.73 3kt3 s LYS 101 Ca 0.00 1.03 -0.10 0.00 0.02 0.00 0.00 55.97 56.92 3kt3 s LYS 101 Cb 0.00 -2.08 -0.07 0.00 -0.52 0.00 0.00 37.83 35.16 3kt3 s LYS 101 CO 0.00 -0.55 0.60 -1.25 -0.92 0.00 0.00 175.35 173.23 3kt3 s PRO 102 N -4.23 3.80 0.28 -1.68 0.04 -1.26 -4.31 135.00 127.63 3kt3 s PRO 102 Ca 0.60 0.31 -0.13 0.00 0.04 0.00 0.00 61.00 61.82 3kt3 s PRO 102 Cb -0.13 -2.59 0.01 0.00 0.04 0.00 0.00 34.50 31.84 3kt3 s PRO 102 CO 0.37 0.24 0.56 -0.59 0.04 0.00 0.00 177.00 177.61 3kt3 s PHE 103 N -1.95 0.31 0.30 0.56 -0.12 -1.26 -4.69 117.98 111.14 3kt3 s PHE 103 Ca 0.48 -0.71 0.03 0.00 -0.05 0.00 0.00 56.93 56.68 3kt3 s PHE 103 Cb -0.11 0.33 -0.06 0.00 -0.63 0.00 0.00 43.02 42.55 3kt3 s PHE 103 CO 0.23 -1.12 0.06 -0.59 -0.05 0.00 0.00 175.22 173.75 3kt3 s PHE 104 N -3.70 1.80 -0.04 3.49 -0.12 -1.07 -4.39 117.98 113.95 3kt3 s PHE 104 Ca 0.20 -1.02 -0.01 0.00 -0.05 0.00 0.00 56.93 56.05 3kt3 s PHE 104 Cb -0.02 -1.13 -0.04 0.00 -0.63 0.00 0.00 43.02 41.20 3kt3 s PHE 104 CO 0.10 -0.10 0.05 -0.51 -0.05 0.00 0.00 175.22 174.71 3kt3 s LEU 105 N -3.42 3.78 -0.12 -1.99 1.43 0.51 -0.24 118.68 118.64 3kt3 s LEU 105 Ca 0.36 0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 53.57 3kt3 s LEU 105 Cb 0.08 -2.08 0.06 0.00 0.03 0.00 0.00 46.19 44.28 3kt3 s LEU 105 CO 0.14 0.32 0.22 -0.47 0.23 0.00 0.00 176.35 176.79 3kt3 s TYR 106 N -1.07 -0.33 0.29 0.29 6.04 -0.77 -0.61 117.35 121.19 3kt3 s TYR 106 Ca 0.19 0.80 0.03 0.00 0.04 0.00 0.00 57.07 58.13 3kt3 s TYR 106 Cb -0.12 -0.14 -0.04 0.00 -1.04 0.00 0.00 41.96 40.63 3kt3 s TYR 106 CO 0.09 -0.34 0.17 -0.08 -1.54 0.00 0.00 175.55 173.85 3kt3 s THR 107 N 2.37 0.24 0.33 4.34 -1.32 -0.97 -3.75 115.64 116.87 3kt3 s THR 107 Ca 0.02 -2.00 -0.09 0.00 -1.21 0.00 0.00 61.69 58.41 3kt3 s THR 107 Cb -0.12 -2.51 0.01 0.00 -1.51 0.00 0.00 72.50 68.37 3kt3 s THR 107 CO -0.08 0.00 0.56 -0.83 -2.21 0.00 0.00 174.62 172.06 3kt3 s GLY 108 N -3.34 0.93 -0.19 6.08 0.00 -1.26 -1.68 107.32 107.87 3kt3 s GLY 108 Ca 0.37 -1.14 -0.13 0.00 0.00 0.00 0.00 44.72 43.82 3kt3 s GLY 108 CO 0.18 -0.71 0.47 -1.60 0.00 0.00 0.00 173.10 171.44 3kt3 s ARG 109 N -3.14 0.50 -0.52 2.90 6.06 0.23 -4.92 118.95 120.06 3kt3 s ARG 109 Ca 0.24 0.77 -0.16 0.00 -2.50 0.00 0.00 55.73 54.08 3kt3 s ARG 109 Cb -0.02 0.13 0.10 0.00 0.06 0.00 0.00 34.95 35.23 3kt3 s ARG 109 CO 0.15 -0.11 0.48 0.20 -2.50 0.00 0.00 175.30 173.52 3kt3 s GLY 110 N 0.88 2.03 -1.13 8.12 0.00 -1.26 -1.19 107.32 114.77 3kt3 s GLY 110 Ca -0.05 -2.32 -0.22 0.00 0.00 0.00 0.00 44.72 42.13 3kt3 s GLY 110 CO -0.07 1.19 1.79 2.56 0.00 0.00 0.00 173.10 178.57 3kt3 s PRO 111 N 1.75 3.15 0.00 2.90 0.04 -1.26 -4.71 135.00 136.87 3kt3 s PRO 111 Ca 0.05 -1.23 0.23 0.00 0.04 0.00 0.00 61.00 60.09 3kt3 s PRO 111 Cb -0.27 -5.32 0.29 0.00 0.04 0.00 0.00 34.50 29.25 3kt3 s PRO 111 CO 0.05 -3.03 1.30 -1.13 0.04 0.00 0.00 177.00 174.23 3kt3 n SER 112 N 11.53 3.16 -2.97 6.66 3.41 -1.26 -4.64 113.62 129.51 3kt3 n SER 112 Ca 0.43 -1.96 -0.10 0.00 -0.26 0.00 0.00 58.87 56.97 3kt3 n SER 112 Cb 0.47 -0.12 0.01 0.00 -0.26 0.00 0.00 64.21 64.31 3kt3 n SER 112 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3kt3 s SER 113 N -1.67 0.20 0.00 4.04 1.04 -1.26 -5.07 113.70 110.98 3kt3 s SER 113 Ca 0.32 -1.23 0.26 0.00 0.48 0.00 0.00 55.95 55.78 3kt3 s SER 113 Cb 0.20 0.82 0.73 0.00 0.10 0.00 0.00 66.02 67.88 3kt3 s SER 113 CO 0.30 -1.62 1.55 -0.90 0.98 0.00 0.00 173.24 173.55 3kt3 n ASP 114 N -1.44 0.98 -3.94 7.02 5.68 -1.26 -4.76 116.55 118.84 3kt3 n ASP 114 Ca -0.07 -0.84 -0.21 0.00 -0.50 0.00 0.00 54.79 53.18 3kt3 n ASP 114 Cb 0.60 0.15 -0.16 0.00 -1.14 0.00 0.00 41.12 40.57 3kt3 n ASP 114 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3kt3 s SER 115 N -2.54 1.14 0.80 -1.12 0.15 -1.26 -4.39 113.70 106.48 3kt3 s SER 115 Ca 0.23 -0.17 -0.11 0.00 0.70 0.00 0.00 55.95 56.60 3kt3 s SER 115 Cb 0.19 -0.52 0.07 0.00 -1.71 0.00 0.00 66.02 64.05 3kt3 s SER 115 CO 0.54 -0.02 1.09 -0.04 1.20 0.00 0.00 173.24 176.00 3kt3 s MET 116 N 0.76 2.04 0.44 5.44 -1.94 -1.26 -4.91 119.30 119.87 3kt3 s MET 116 Ca -0.12 0.89 0.07 0.00 -1.71 0.00 0.00 55.69 54.81 3kt3 s MET 116 Cb -0.14 -1.89 -0.03 0.00 2.01 0.00 0.00 34.83 34.78 3kt3 s MET 116 CO 0.01 -1.72 0.23 -3.38 -0.01 0.00 0.00 175.02 170.16 3kt3 s HIS 117 N -3.01 2.38 0.49 -0.03 -3.43 -1.26 -2.06 115.29 108.37 3kt3 s HIS 117 Ca 0.61 -0.65 0.20 0.00 -0.80 0.00 0.00 55.06 54.42 3kt3 s HIS 117 Cb -0.16 -1.95 1.23 0.00 -1.43 0.00 0.00 32.58 30.26 3kt3 s HIS 117 CO 0.56 0.03 1.99 1.25 -2.00 0.00 0.00 174.74 176.57 3kt3 h LEU 118 N 1.25 0.17 -1.17 5.38 5.85 -1.44 -0.46 115.31 124.89 3kt3 h LEU 118 Ca -0.42 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.29 3kt3 h LEU 118 Cb 1.27 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 3kt3 h LEU 118 CO 0.66 0.09 0.33 1.23 -0.34 0.00 0.00 178.44 180.42 3kt3 h GLY 119 N 0.18 0.97 2.00 3.75 0.00 -1.90 -2.62 103.07 105.45 3kt3 h GLY 119 Ca 0.26 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.14 3kt3 h GLY 119 CO -0.04 0.43 0.00 0.45 0.00 0.00 0.00 176.54 177.37 3kt3 h HIS 120 N 0.91 0.00 -0.07 5.60 3.86 -1.46 -2.76 115.15 121.24 3kt3 h HIS 120 Ca 0.23 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.37 3kt3 h HIS 120 Cb 0.06 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 3kt3 h HIS 120 CO 0.01 0.00 -0.25 0.52 0.86 0.00 0.00 177.93 179.07 3kt3 h MET 121 N 0.00 0.13 0.60 2.45 2.07 -1.54 -3.17 114.93 115.47 3kt3 h MET 121 Ca 0.00 -0.04 -0.02 0.00 -2.07 0.00 0.00 59.70 57.57 3kt3 h MET 121 Cb 0.30 -0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 30.00 3kt3 h MET 121 CO 0.00 0.37 -0.50 0.82 1.07 0.00 0.00 176.91 178.68 3kt3 h ILE 122 N 0.12 0.00 -0.78 -1.22 1.08 -1.64 0.67 117.51 115.74 3kt3 h ILE 122 Ca 0.02 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.50 3kt3 h ILE 122 Cb 0.51 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.22 3kt3 h ILE 122 CO 0.04 0.00 0.51 1.55 -0.69 0.00 0.00 178.15 179.56 3kt3 h PRO 123 N -1.06 1.01 -0.10 2.37 0.13 -1.77 -2.36 132.00 130.21 3kt3 h PRO 123 Ca -0.08 -0.06 -0.21 0.00 -0.87 0.00 0.00 66.00 64.78 3kt3 h PRO 123 Cb 0.89 -0.23 0.01 0.00 0.13 0.00 0.00 31.00 31.81 3kt3 h PRO 123 CO -0.01 0.67 -0.77 0.74 -0.23 0.00 0.00 178.00 178.40 3kt3 h PHE 124 N 1.04 0.97 -0.82 1.56 0.04 -1.42 -0.11 116.94 118.20 3kt3 h PHE 124 Ca 0.29 -0.46 -0.02 0.00 2.80 0.00 0.00 57.97 60.59 3kt3 h PHE 124 Cb -0.10 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 37.87 3kt3 h PHE 124 CO -0.00 1.28 0.45 0.28 -0.60 0.00 0.00 178.31 179.72 3kt3 h VAL 125 N 0.38 1.24 -0.42 -0.55 2.07 0.32 -0.44 116.25 118.86 3kt3 h VAL 125 Ca -0.07 -0.60 -0.13 0.00 0.82 0.00 0.00 66.70 66.72 3kt3 h VAL 125 Cb 1.41 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 3kt3 h VAL 125 CO 0.16 0.27 -0.25 0.15 0.02 0.00 0.00 177.57 177.91 3kt3 h PHE 126 N 1.15 1.07 -0.68 1.57 3.57 -1.35 -2.68 116.94 119.59 3kt3 h PHE 126 Ca 0.29 -0.28 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 3kt3 h PHE 126 Cb 0.03 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.50 3kt3 h PHE 126 CO 0.01 1.08 0.26 1.15 -2.23 0.00 0.00 178.31 178.58 3kt3 h THR 127 N 0.74 1.25 -0.50 4.41 2.02 -0.66 0.31 112.91 120.48 3kt3 h THR 127 Ca 0.09 -0.79 0.07 0.00 0.77 0.00 0.00 66.41 66.55 3kt3 h THR 127 Cb 0.83 0.49 -0.06 0.00 -1.74 0.00 0.00 68.15 67.67 3kt3 h THR 127 CO 0.07 0.31 0.18 0.50 0.37 0.00 0.00 175.52 176.95 3kt3 h LYS 128 N 0.97 0.35 0.35 6.66 3.64 -1.01 -0.69 116.57 126.84 3kt3 h LYS 128 Ca 0.22 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.57 3kt3 h LYS 128 Cb 0.23 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 3kt3 h LYS 128 CO -0.02 0.23 -0.17 2.35 -2.27 0.00 0.00 179.45 179.58 3kt3 h TRP 129 N 0.36 -0.43 -0.98 1.91 7.01 -1.11 -2.93 115.95 119.77 3kt3 h TRP 129 Ca 0.24 -0.01 0.20 0.00 2.11 0.00 0.00 58.89 61.43 3kt3 h TRP 129 Cb 0.25 0.14 -0.09 0.00 -2.10 0.00 0.00 29.16 27.36 3kt3 h TRP 129 CO -0.16 -0.15 0.62 -0.07 -2.79 0.00 0.00 178.44 175.88 3kt3 h LEU 130 N -0.67 0.64 -0.56 0.65 3.38 -0.75 -1.36 115.31 116.65 3kt3 h LEU 130 Ca -0.05 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3kt3 h LEU 130 Cb 0.47 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 3kt3 h LEU 130 CO 0.08 0.22 0.27 -0.61 0.09 0.00 0.00 178.44 178.49 3kt3 h GLN 131 N 0.62 0.81 0.00 1.13 4.15 -1.00 -1.77 115.11 119.06 3kt3 h GLN 131 Ca 0.55 -0.12 -0.18 0.00 0.77 0.00 0.00 58.65 59.67 3kt3 h GLN 131 Cb 1.05 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.57 3kt3 h GLN 131 CO -0.32 0.66 -0.86 1.05 -1.93 0.00 0.00 178.83 177.44 3kt3 h GLU 132 N 0.76 0.00 -0.03 1.69 4.11 -1.12 -0.42 114.58 119.57 3kt3 h GLU 132 Ca 0.19 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.41 3kt3 h GLU 132 Cb 0.12 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 3kt3 h GLU 132 CO -0.02 0.86 -0.86 0.28 0.07 0.00 0.00 179.01 179.33 3kt3 h VAL 133 N 0.00 1.39 0.00 -1.06 2.07 -1.21 -3.29 116.25 114.15 3kt3 h VAL 133 Ca -0.01 -2.32 0.00 0.00 0.82 0.00 0.00 66.70 65.19 3kt3 h VAL 133 Cb 1.65 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 33.72 3kt3 h VAL 133 CO 0.11 0.70 -1.33 0.49 0.02 0.00 0.00 177.57 177.56 3kt3 n PHE 134 N -3.78 0.03 -3.71 1.57 3.72 -0.67 -5.01 117.46 109.60 3kt3 n PHE 134 Ca -0.06 0.01 -0.28 0.00 -0.05 0.00 0.00 57.45 57.07 3kt3 n PHE 134 Cb 0.79 -0.23 0.03 0.00 -0.94 0.00 0.00 39.48 39.13 3kt3 n PHE 134 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3kt3 n ASP 135 N -1.81 -3.93 -4.47 4.37 2.03 -0.17 -4.93 116.55 107.63 3kt3 n ASP 135 Ca 0.01 -0.98 -0.23 0.00 0.52 0.00 0.00 54.79 54.11 3kt3 n ASP 135 Cb 0.42 -3.50 -0.10 0.00 -0.72 0.00 0.00 41.12 37.22 3kt3 n ASP 135 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3kt3 s VAL 136 N -3.58 2.17 0.56 5.18 -7.23 -1.19 -2.76 120.40 113.55 3kt3 s VAL 136 Ca 0.33 -2.27 -0.13 0.00 -1.81 0.00 0.00 61.98 58.09 3kt3 s VAL 136 Cb -0.11 -2.40 -0.06 0.00 0.56 0.00 0.00 36.38 34.37 3kt3 s VAL 136 CO 0.85 -0.35 0.99 -2.16 -0.31 0.00 0.00 175.10 174.13 3kt3 s PRO 137 N -3.59 3.77 -0.06 4.82 0.04 -1.26 -4.83 135.00 133.88 3kt3 s PRO 137 Ca 0.30 0.82 0.02 0.00 0.04 0.00 0.00 61.00 62.18 3kt3 s PRO 137 Cb -0.01 -2.13 0.02 0.00 0.04 0.00 0.00 34.50 32.42 3kt3 s PRO 137 CO 0.14 -0.40 -0.10 -1.17 0.04 0.00 0.00 177.00 175.51 3kt3 s LEU 138 N -4.59 1.56 -0.13 -3.56 2.96 -0.55 -0.36 118.68 114.01 3kt3 s LEU 138 Ca 0.57 -0.25 -0.01 0.00 -0.22 0.00 0.00 54.13 54.21 3kt3 s LEU 138 Cb -0.10 -0.73 -0.02 0.00 0.50 0.00 0.00 46.19 45.84 3kt3 s LEU 138 CO 0.42 0.01 -0.10 0.68 -1.32 0.00 0.00 176.35 176.04 3kt3 s VAL 139 N 0.75 3.36 -0.19 1.68 -7.23 0.22 -1.15 120.40 117.83 3kt3 s VAL 139 Ca -0.13 -0.56 0.01 0.00 -1.81 0.00 0.00 61.98 59.49 3kt3 s VAL 139 Cb -0.15 -2.42 0.03 0.00 0.56 0.00 0.00 36.38 34.39 3kt3 s VAL 139 CO 0.03 0.52 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.54 3kt3 s ILE 140 N 0.21 1.98 -0.21 -0.62 1.01 -0.01 -2.30 121.20 121.26 3kt3 s ILE 140 Ca -0.06 -1.04 -0.16 0.00 0.00 0.00 0.00 60.65 59.39 3kt3 s ILE 140 Cb -0.15 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 3kt3 s ILE 140 CO 0.04 0.39 0.43 -0.70 0.00 0.00 0.00 174.94 175.10 3kt3 s GLU 141 N 1.29 4.15 -0.40 2.79 2.12 -0.68 -1.45 118.70 126.52 3kt3 s GLU 141 Ca 0.02 0.23 -0.15 0.00 0.36 0.00 0.00 54.97 55.44 3kt3 s GLU 141 Cb -0.15 -3.56 0.02 0.00 0.26 0.00 0.00 34.13 30.70 3kt3 s GLU 141 CO -0.11 -0.11 0.29 -0.51 -0.54 0.00 0.00 175.26 174.28 3kt3 s LEU 142 N 1.53 5.04 -1.27 2.70 1.43 0.20 -0.60 118.68 127.71 3kt3 s LEU 142 Ca 0.20 -0.88 -0.06 0.00 -1.03 0.00 0.00 54.13 52.36 3kt3 s LEU 142 Cb -0.15 -2.15 0.17 0.00 0.03 0.00 0.00 46.19 44.09 3kt3 s LEU 142 CO 0.09 -0.43 2.11 0.35 0.23 0.00 0.00 176.35 178.69 3kt3 n THR 143 N 5.14 5.03 -0.32 5.49 -2.24 -0.33 -1.57 114.28 125.48 3kt3 n THR 143 Ca -0.11 -4.61 -0.04 0.00 -2.27 0.00 0.00 64.05 57.02 3kt3 n THR 143 Cb 0.47 -2.13 0.08 0.00 -2.10 0.00 0.00 70.33 66.66 3kt3 n THR 143 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3kt3 h ASP 144 N 5.00 1.03 -0.70 3.42 3.04 -1.87 -2.22 116.42 124.12 3kt3 h ASP 144 Ca 0.55 -0.07 0.03 0.00 -3.24 0.00 0.00 57.03 54.31 3kt3 h ASP 144 Cb 0.43 -0.26 -0.04 0.00 -1.04 0.00 0.00 39.33 38.42 3kt3 h ASP 144 CO 1.49 0.80 0.44 -2.24 -2.04 0.00 0.00 179.24 177.69 3kt3 h ASP 145 N 1.18 0.71 -0.37 4.15 3.04 -1.94 -1.12 116.42 122.07 3kt3 h ASP 145 Ca 0.31 0.00 0.05 0.00 -3.24 0.00 0.00 57.03 54.15 3kt3 h ASP 145 Cb -0.05 -0.15 -0.05 0.00 -1.04 0.00 0.00 39.33 38.04 3kt3 h ASP 145 CO -0.06 0.49 0.09 -0.08 -2.04 0.00 0.00 179.24 177.65 3kt3 h GLU 146 N 0.85 0.22 -0.25 4.15 4.81 -1.84 -0.64 114.58 121.89 3kt3 h GLU 146 Ca 0.28 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.37 3kt3 h GLU 146 Cb 0.02 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 3kt3 h GLU 146 CO -0.11 0.15 -0.35 0.87 -0.73 0.00 0.00 179.01 178.83 3kt3 h LYS 147 N 0.23 0.56 -0.30 1.92 1.79 -1.01 0.66 116.57 120.42 3kt3 h LYS 147 Ca 0.18 -0.26 0.02 0.00 -2.18 0.00 0.00 60.65 58.41 3kt3 h LYS 147 Cb 0.19 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 3kt3 h LYS 147 CO -0.21 0.83 0.15 0.35 -1.08 0.00 0.00 179.45 179.49 3kt3 h PHE 148 N 0.47 0.27 -0.68 -1.35 3.57 -0.99 -1.23 116.94 117.00 3kt3 h PHE 148 Ca 0.05 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 3kt3 h PHE 148 Cb 0.83 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 3kt3 h PHE 148 CO 0.03 0.15 0.26 -0.07 -2.23 0.00 0.00 178.31 176.46 3kt3 h LEU 149 N 0.31 0.92 0.00 0.59 4.07 -0.38 -3.27 115.31 117.56 3kt3 h LEU 149 Ca 0.12 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3kt3 h LEU 149 Cb 0.04 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.54 3kt3 h LEU 149 CO -0.09 0.83 -1.14 0.49 -1.08 0.00 0.00 178.44 177.45 3kt3 n PHE 150 N -4.30 0.40 -3.90 1.13 3.01 0.15 -4.66 117.46 109.30 3kt3 n PHE 150 Ca 0.06 0.12 -0.30 0.00 1.01 0.00 0.00 57.45 58.33 3kt3 n PHE 150 Cb 0.18 -0.57 -0.14 0.00 -0.01 0.00 0.00 39.48 38.94 3kt3 n PHE 150 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3kt3 s LYS 151 N -3.27 1.52 0.60 -1.08 1.02 -0.47 -4.99 119.74 113.06 3kt3 s LYS 151 Ca 0.01 -2.06 0.29 0.00 0.02 0.00 0.00 55.97 54.23 3kt3 s LYS 151 Cb 0.13 -2.92 1.49 0.00 -0.52 0.00 0.00 37.83 36.01 3kt3 s LYS 151 CO 0.81 -1.05 1.90 1.12 -0.92 0.00 0.00 175.35 177.21 3kt3 h HIS 152 N 7.12 0.00 0.00 3.18 2.07 -1.83 -1.41 115.15 124.28 3kt3 h HIS 152 Ca -0.06 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.37 3kt3 h HIS 152 Cb 0.96 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.92 3kt3 h HIS 152 CO 0.47 0.00 -0.43 -0.22 -3.07 0.00 0.00 177.93 174.68 3kt3 h LYS 153 N 0.00 0.00 -6.86 5.12 3.64 -1.94 -3.45 116.57 113.08 3kt3 h LYS 153 Ca 0.17 0.00 -0.47 0.00 -1.27 0.00 0.00 60.65 59.08 3kt3 h LYS 153 Cb 1.08 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 3kt3 h LYS 153 CO -0.00 0.43 0.24 -0.51 -2.27 0.00 0.00 179.45 177.34 3kt3 s LEU 154 N -7.10 4.12 0.43 5.20 1.43 -0.53 -5.08 118.68 117.15 3kt3 s LEU 154 Ca 0.00 1.58 0.08 0.00 -1.03 0.00 0.00 54.13 54.76 3kt3 s LEU 154 Cb 0.11 -4.16 0.00 0.00 0.03 0.00 0.00 46.19 42.17 3kt3 s LEU 154 CO 0.70 -0.20 0.50 0.42 0.23 0.00 0.00 176.35 178.00 3kt3 s THR 155 N -1.90 2.77 0.24 5.49 -4.23 -1.26 -4.93 115.64 111.82 3kt3 s THR 155 Ca 0.54 -1.16 -0.07 0.00 -1.18 0.00 0.00 61.69 59.83 3kt3 s THR 155 Cb -0.13 -2.93 0.22 0.00 1.34 0.00 0.00 72.50 71.00 3kt3 s THR 155 CO 0.18 0.00 1.87 0.40 -0.54 0.00 0.00 174.62 176.53 3kt3 h ILE 156 N 0.78 1.26 -0.21 2.99 1.08 -1.98 -2.58 117.51 118.85 3kt3 h ILE 156 Ca -0.40 -0.61 0.00 0.00 -0.39 0.00 0.00 64.86 63.46 3kt3 h ILE 156 Cb 1.28 -0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 34.99 3kt3 h ILE 156 CO 0.50 0.28 0.13 0.78 -0.69 0.00 0.00 178.15 179.16 3kt3 h ASN 157 N 1.29 0.25 -0.38 1.72 2.35 -1.99 -1.92 115.58 116.91 3kt3 h ASN 157 Ca 0.33 -0.03 0.08 0.00 -0.55 0.00 0.00 56.30 56.12 3kt3 h ASN 157 Cb -0.02 -0.06 -0.09 0.00 0.05 0.00 0.00 38.32 38.20 3kt3 h ASN 157 CO -0.06 0.21 -0.35 0.44 -1.65 0.00 0.00 177.43 176.02 3kt3 h ASP 158 N 0.27 -1.17 0.64 5.81 3.32 -1.86 -0.97 116.42 122.46 3kt3 h ASP 158 Ca 0.08 0.20 -0.14 0.00 0.02 0.00 0.00 57.03 57.18 3kt3 h ASP 158 Cb -0.00 0.53 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 3kt3 h ASP 158 CO -0.02 -0.34 -0.67 -0.37 -1.72 0.00 0.00 179.24 176.13 3kt3 h VAL 159 N -0.28 1.47 -0.57 -1.35 -1.51 -1.42 -0.17 116.25 112.41 3kt3 h VAL 159 Ca 0.16 -2.26 -0.01 0.00 -1.23 0.00 0.00 66.70 63.35 3kt3 h VAL 159 Cb 0.55 2.22 -0.03 0.00 -2.13 0.00 0.00 31.29 31.90 3kt3 h VAL 159 CO -0.54 0.65 0.31 0.11 -1.23 0.00 0.00 177.57 176.87 3kt3 h LYS 160 N 0.02 0.80 -0.12 5.19 1.57 -0.90 -0.78 116.57 122.35 3kt3 h LYS 160 Ca -0.01 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 3kt3 h LYS 160 Cb 1.18 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 3kt3 h LYS 160 CO 0.09 0.62 -0.15 -0.91 -0.57 0.00 0.00 179.45 178.53 3kt3 h ASN 161 N 0.77 0.34 -0.85 0.86 2.35 -0.93 -3.03 115.58 115.10 3kt3 h ASN 161 Ca 0.20 -0.50 0.10 0.00 -0.55 0.00 0.00 56.30 55.55 3kt3 h ASN 161 Cb 0.05 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.27 3kt3 h ASN 161 CO -0.03 0.78 0.55 -0.26 -1.65 0.00 0.00 177.43 176.81 3kt3 h PHE 162 N -0.08 0.85 -0.46 1.19 0.04 -0.99 -1.64 116.94 115.85 3kt3 h PHE 162 Ca 0.02 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.81 3kt3 h PHE 162 Cb 0.69 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.54 3kt3 h PHE 162 CO 0.09 0.39 0.30 0.00 -0.60 0.00 0.00 178.31 178.48 3kt3 h ALA 163 N 1.58 0.59 -0.44 2.45 0.00 -1.08 0.82 119.26 123.18 3kt3 h ALA 163 Ca 0.40 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.14 3kt3 h ALA 163 Cb 0.47 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3kt3 h ALA 163 CO -0.16 0.05 -0.21 0.00 0.00 0.00 0.00 179.25 178.93 3kt3 h ARG 164 N 0.62 0.91 -0.19 0.00 3.08 -1.28 -0.84 114.38 116.68 3kt3 h ARG 164 Ca 0.17 -0.40 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 3kt3 h ARG 164 Cb -0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3kt3 h ARG 164 CO -0.03 1.05 0.08 0.93 -1.07 0.00 0.00 179.97 180.92 3kt3 h GLU 165 N 0.75 0.29 -0.06 0.04 4.39 -1.11 -2.01 114.58 116.87 3kt3 h GLU 165 Ca 0.10 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.71 3kt3 h GLU 165 Cb 0.77 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 3kt3 h GLU 165 CO 0.06 0.36 -0.12 -0.91 -1.16 0.00 0.00 179.01 177.24 3kt3 h ASN 166 N 0.16 0.08 -0.65 1.42 2.35 -0.81 -1.99 115.58 116.14 3kt3 h ASN 166 Ca 0.06 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.73 3kt3 h ASN 166 Cb 0.18 -0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 3kt3 h ASN 166 CO -0.01 0.21 0.14 0.00 -1.65 0.00 0.00 177.43 176.13 3kt3 h ALA 167 N 1.80 0.85 -0.71 -0.83 0.00 -0.85 -0.42 119.26 119.11 3kt3 h ALA 167 Ca 0.02 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.69 3kt3 h ALA 167 Cb 0.27 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3kt3 h ALA 167 CO 0.02 0.59 0.46 0.87 0.00 0.00 0.00 179.25 181.19 3kt3 h LYS 168 N 0.97 0.91 -0.14 0.00 1.57 -0.77 0.05 116.57 119.17 3kt3 h LYS 168 Ca 0.20 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.95 3kt3 h LYS 168 Cb 0.39 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 3kt3 h LYS 168 CO 0.01 0.60 -0.02 -0.44 -0.57 0.00 0.00 179.45 179.03 3kt3 h ASP 169 N 0.94 -0.09 -0.46 0.86 3.32 -1.01 -0.51 116.42 119.47 3kt3 h ASP 169 Ca 0.27 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.37 3kt3 h ASP 169 Cb -0.08 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 3kt3 h ASP 169 CO -0.07 -0.03 0.28 0.40 -1.72 0.00 0.00 179.24 178.10 3kt3 h ILE 170 N 0.02 1.05 -0.90 0.35 2.04 -0.76 -2.27 117.51 117.05 3kt3 h ILE 170 Ca 0.06 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.75 3kt3 h ILE 170 Cb 0.09 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 36.57 3kt3 h ILE 170 CO -0.12 0.10 0.59 0.40 0.00 0.00 0.00 178.15 179.12 3kt3 h ILE 171 N 0.55 1.20 0.00 -0.67 2.04 -0.77 -2.02 117.51 117.84 3kt3 h ILE 171 Ca 0.18 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.64 3kt3 h ILE 171 Cb 0.01 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.00 3kt3 h ILE 171 CO -0.08 0.22 0.00 0.00 0.00 0.00 0.00 178.15 178.29 3kt3 h ALA 172 N 1.34 1.00 -0.38 1.87 0.00 -0.51 0.10 119.26 122.69 3kt3 h ALA 172 Ca 0.34 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 3kt3 h ALA 172 Cb -0.09 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3kt3 h ALA 172 CO -0.09 0.00 0.08 0.28 0.00 0.00 0.00 179.25 179.52 3kt3 h VAL 173 N 0.00 1.18 0.00 0.00 2.07 -1.09 -3.44 116.25 114.96 3kt3 h VAL 173 Ca 0.00 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.87 3kt3 h VAL 173 Cb 0.05 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3kt3 h VAL 173 CO 0.00 0.24 0.00 0.61 0.02 0.00 0.00 177.57 178.44 3kt3 n GLY 174 N -1.01 1.30 3.80 2.17 0.00 0.34 -5.02 105.19 106.77 3kt3 n GLY 174 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3kt3 n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kt3 s PHE 175 N -1.30 2.86 -0.10 1.61 0.40 -1.21 -5.07 117.98 115.17 3kt3 s PHE 175 Ca 0.00 1.46 -0.01 0.00 -0.60 0.00 0.00 56.93 57.79 3kt3 s PHE 175 Cb 0.00 -2.97 -0.03 0.00 0.51 0.00 0.00 43.02 40.54 3kt3 s PHE 175 CO 0.00 -1.52 -0.06 0.34 0.70 0.00 0.00 175.22 174.68 3kt3 s ASP 176 N -3.62 4.65 0.51 1.36 -1.08 -1.26 -4.98 116.67 112.25 3kt3 s ASP 176 Ca 0.60 -0.07 0.26 0.00 -0.52 0.00 0.00 52.55 52.81 3kt3 s ASP 176 Cb -0.15 -1.40 1.40 0.00 -1.46 0.00 0.00 42.92 41.31 3kt3 s ASP 176 CO 0.55 0.29 2.06 1.55 0.52 0.00 0.00 175.17 180.14 3kt3 h PRO 177 N 5.79 0.00 -0.88 4.34 0.13 -1.89 -2.57 132.00 136.91 3kt3 h PRO 177 Ca -0.42 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.86 3kt3 h PRO 177 Cb 1.18 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.22 3kt3 h PRO 177 CO 0.56 0.13 0.48 -0.22 -0.23 0.00 0.00 178.00 178.71 3kt3 h LYS 178 N 0.00 0.65 0.00 0.86 3.64 -1.92 -2.93 116.57 116.87 3kt3 h LYS 178 Ca -0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3kt3 h LYS 178 Cb 0.35 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3kt3 h LYS 178 CO 0.02 0.43 -0.09 0.27 -2.27 0.00 0.00 179.45 177.80 3kt3 n ASN 179 N -4.84 1.92 -3.86 4.20 2.04 -1.16 -1.57 115.26 111.99 3kt3 n ASN 179 Ca 0.18 -2.89 -0.19 0.00 -0.44 0.00 0.00 54.58 51.24 3kt3 n ASN 179 Cb 0.45 -0.39 -0.16 0.00 -2.53 0.00 0.00 39.78 37.15 3kt3 n ASN 179 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 3kt3 s THR 180 N -2.36 0.39 -0.21 5.53 2.01 -0.98 -1.48 115.64 118.55 3kt3 s THR 180 Ca 0.26 -0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.24 3kt3 s THR 180 Cb 0.23 -0.44 0.03 0.00 0.01 0.00 0.00 72.50 72.32 3kt3 s THR 180 CO 0.02 0.19 -0.16 0.12 -0.69 0.00 0.00 174.62 174.11 3kt3 s PHE 181 N 0.97 2.93 -0.26 4.92 5.36 -0.30 -4.58 117.98 127.02 3kt3 s PHE 181 Ca -0.10 -1.76 -0.05 0.00 -0.96 0.00 0.00 56.93 54.06 3kt3 s PHE 181 Cb -0.14 -1.95 0.01 0.00 -0.34 0.00 0.00 43.02 40.60 3kt3 s PHE 181 CO -0.01 -0.80 0.01 0.42 -1.46 0.00 0.00 175.22 173.38 3kt3 s ILE 182 N 1.26 3.53 0.06 3.12 1.01 -0.31 -0.83 121.20 129.03 3kt3 s ILE 182 Ca 0.01 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 60.01 3kt3 s ILE 182 Cb -0.15 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.53 3kt3 s ILE 182 CO -0.10 0.20 -0.17 0.72 0.00 0.00 0.00 174.94 175.59 3kt3 s PHE 183 N 1.45 1.51 0.00 3.97 -0.71 -0.53 -3.66 117.98 120.02 3kt3 s PHE 183 Ca 0.03 -0.39 -0.24 0.00 -1.04 0.00 0.00 56.93 55.30 3kt3 s PHE 183 Cb -0.16 -0.88 -0.05 0.00 -1.21 0.00 0.00 43.02 40.72 3kt3 s PHE 183 CO -0.01 0.09 0.72 0.45 -1.34 0.00 0.00 175.22 175.13 3kt3 s SER 184 N -1.37 7.10 0.14 1.98 0.15 -1.26 -0.63 113.70 119.81 3kt3 s SER 184 Ca 0.04 1.32 -0.23 0.00 0.70 0.00 0.00 55.95 57.78 3kt3 s SER 184 Cb -0.09 -2.43 0.01 0.00 -1.71 0.00 0.00 66.02 61.80 3kt3 s SER 184 CO 0.02 -0.01 1.64 0.44 1.20 0.00 0.00 173.24 176.53 3kt3 h ASP 185 N 6.01 -0.67 -0.83 5.45 3.32 -1.69 0.12 116.42 128.14 3kt3 h ASP 185 Ca -0.43 0.12 0.15 0.00 0.02 0.00 0.00 57.03 56.88 3kt3 h ASP 185 Cb 1.20 0.31 -0.06 0.00 0.22 0.00 0.00 39.33 41.01 3kt3 h ASP 185 CO 0.72 -0.26 0.54 -0.07 -1.72 0.00 0.00 179.24 178.46 3kt3 h LEU 186 N -0.24 0.54 0.18 1.55 3.38 -1.94 0.09 115.31 118.86 3kt3 h LEU 186 Ca 0.12 0.03 -0.35 0.00 0.09 0.00 0.00 57.88 57.77 3kt3 h LEU 186 Cb 0.42 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.10 3kt3 h LEU 186 CO -0.33 0.28 -1.77 -0.61 0.09 0.00 0.00 178.44 176.10 3kt3 h GLN 187 N 0.57 0.38 0.00 1.13 4.15 -1.81 -3.37 115.11 116.16 3kt3 h GLN 187 Ca 0.41 -0.65 0.00 0.00 0.77 0.00 0.00 58.65 59.19 3kt3 h GLN 187 Cb 0.78 0.24 0.00 0.00 0.21 0.00 0.00 27.48 28.71 3kt3 h GLN 187 CO -0.17 1.30 -0.72 -0.92 -1.93 0.00 0.00 178.83 176.39 3kt3 h TYR 188 N 0.10 0.00 -1.91 3.99 3.20 -0.59 -3.47 116.97 118.28 3kt3 h TYR 188 Ca -0.35 0.00 -0.64 0.00 3.14 0.00 0.00 58.73 60.88 3kt3 h TYR 188 Cb 2.09 0.00 0.05 0.00 1.54 0.00 0.00 36.73 40.41 3kt3 h TYR 188 CO 0.10 0.00 0.66 -0.12 -1.64 0.00 0.00 178.16 177.16 3kt3 n MET 189 N -2.47 1.59 0.00 1.82 1.56 0.00 -4.78 117.12 114.84 3kt3 n MET 189 Ca 0.02 0.58 0.00 0.00 -0.27 0.00 0.00 57.70 58.02 3kt3 n MET 189 Cb 0.50 -2.28 0.00 0.00 2.15 0.00 0.00 33.22 33.59 3kt3 n MET 189 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3kt3 n GLY 190 N 3.12 1.79 7.00 -5.12 0.00 -1.26 -4.96 105.19 105.76 3kt3 n GLY 190 Ca 0.19 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.30 3kt3 n GLY 190 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kt3 n GLY 191 N -1.90 2.08 0.25 -0.02 0.00 -1.26 -1.77 105.19 102.57 3kt3 n GLY 191 Ca 0.00 -0.38 0.07 0.00 0.00 0.00 0.00 46.02 45.71 3kt3 n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kt3 h ALA 192 N -0.62 1.84 0.23 4.61 0.00 -1.87 -2.25 119.26 121.20 3kt3 h ALA 192 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3kt3 h ALA 192 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3kt3 h ALA 192 CO 0.00 0.10 -0.11 0.35 0.00 0.00 0.00 179.25 179.58 3kt3 h PHE 193 N 0.00 -0.29 -0.88 0.00 3.57 -1.56 -1.88 116.94 115.90 3kt3 h PHE 193 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 3kt3 h PHE 193 Cb 0.14 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 3kt3 h PHE 193 CO 0.00 -0.14 0.53 -0.92 -2.23 0.00 0.00 178.31 175.55 3kt3 h TYR 194 N -0.36 1.15 -0.49 0.41 3.20 -0.88 -1.09 116.97 118.92 3kt3 h TYR 194 Ca -0.03 0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.91 3kt3 h TYR 194 Cb 0.27 -0.38 -0.06 0.00 1.54 0.00 0.00 36.73 38.11 3kt3 h TYR 194 CO -0.05 0.76 0.17 0.93 -1.64 0.00 0.00 178.16 178.33 3kt3 h GLU 195 N 1.20 0.33 -0.59 1.82 5.08 -1.27 0.93 114.58 122.09 3kt3 h GLU 195 Ca 0.31 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.57 3kt3 h GLU 195 Cb -0.06 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 3kt3 h GLU 195 CO -0.06 0.22 0.03 1.15 -1.00 0.00 0.00 179.01 179.35 3kt3 h THR 196 N 0.34 1.26 -0.35 1.13 2.02 -0.89 0.96 112.91 117.38 3kt3 h THR 196 Ca 0.24 -1.09 0.07 0.00 0.77 0.00 0.00 66.41 66.39 3kt3 h THR 196 Cb 0.25 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.42 3kt3 h THR 196 CO -0.25 0.40 -0.02 0.58 0.37 0.00 0.00 175.52 176.60 3kt3 h VAL 197 N 0.91 0.72 -0.11 3.16 2.07 -0.66 0.21 116.25 122.55 3kt3 h VAL 197 Ca 0.17 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.66 3kt3 h VAL 197 Cb 0.51 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 3kt3 h VAL 197 CO 0.02 0.01 0.07 0.58 0.02 0.00 0.00 177.57 178.27 3kt3 h VAL 198 N 0.07 1.05 -0.23 2.57 2.07 -0.50 0.39 116.25 121.68 3kt3 h VAL 198 Ca 0.17 -0.12 0.05 0.00 0.82 0.00 0.00 66.70 67.63 3kt3 h VAL 198 Cb 0.24 0.93 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 3kt3 h VAL 198 CO -0.31 0.04 -0.11 0.03 0.02 0.00 0.00 177.57 177.25 3kt3 h ARG 199 N 0.12 -0.07 -0.64 1.57 3.08 -0.39 -2.69 114.38 115.35 3kt3 h ARG 199 Ca 0.04 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 3kt3 h ARG 199 Cb 0.01 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 3kt3 h ARG 199 CO -0.01 -0.05 0.29 0.28 -1.07 0.00 0.00 179.97 179.41 3kt3 h VAL 200 N -0.08 1.23 0.00 2.04 2.07 -0.40 -2.93 116.25 118.18 3kt3 h VAL 200 Ca 0.12 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 3kt3 h VAL 200 Cb 0.26 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3kt3 h VAL 200 CO -0.28 0.27 -0.02 0.77 0.02 0.00 0.00 177.57 178.33 3kt3 h SER 201 N 0.90 0.00 1.35 0.57 4.64 -0.60 -0.36 113.55 120.04 3kt3 h SER 201 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3kt3 h SER 201 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3kt3 h SER 201 CO -0.02 0.02 0.00 -0.09 -0.87 0.00 0.00 176.83 175.86 3kt3 h ARG 202 N 0.00 0.00 -0.05 4.77 2.43 -1.30 -3.29 114.38 116.94 3kt3 h ARG 202 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3kt3 h ARG 202 Cb 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 3kt3 h ARG 202 CO 0.00 0.00 0.00 1.04 -1.51 0.00 0.00 179.97 179.50 3kt3 n GLN 203 N -2.93 2.23 -4.11 0.20 1.13 -0.15 -4.86 117.38 108.89 3kt3 n GLN 203 Ca 0.02 -1.78 -0.32 0.00 -1.94 0.00 0.00 57.00 52.98 3kt3 n GLN 203 Cb 0.38 -1.47 -0.16 0.00 0.11 0.00 0.00 30.24 29.10 3kt3 n GLN 203 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3kt3 s ILE 204 N -1.97 1.84 0.56 5.09 1.01 -1.22 -4.94 121.20 121.56 3kt3 s ILE 204 Ca 0.30 -0.80 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 3kt3 s ILE 204 Cb 0.20 -1.68 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 3kt3 s ILE 204 CO 0.31 0.50 0.93 0.42 0.00 0.00 0.00 174.94 177.10 3kt3 s THR 205 N 1.34 4.79 0.22 2.92 -4.23 -1.26 -4.94 115.64 114.47 3kt3 s THR 205 Ca 0.04 0.62 -0.08 0.00 -1.18 0.00 0.00 61.69 61.09 3kt3 s THR 205 Cb -0.13 -3.87 0.16 0.00 1.34 0.00 0.00 72.50 70.01 3kt3 s THR 205 CO -0.11 -1.02 1.74 1.23 -0.54 0.00 0.00 174.62 175.92 3kt3 h GLY 206 N -0.08 0.93 -0.01 3.99 0.00 -1.98 -1.87 103.07 104.05 3kt3 h GLY 206 Ca -0.45 -0.14 0.10 0.00 0.00 0.00 0.00 47.33 46.84 3kt3 h GLY 206 CO 0.62 -0.03 -0.15 1.76 0.00 0.00 0.00 176.54 178.75 3kt3 h SER 207 N 0.44 -0.53 -0.42 0.19 0.02 -1.99 -0.45 113.55 110.82 3kt3 h SER 207 Ca 0.33 0.15 0.02 0.00 -0.84 0.00 0.00 61.79 61.46 3kt3 h SER 207 Cb 0.43 0.33 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 3kt3 h SER 207 CO -0.32 -0.18 0.24 0.74 -1.14 0.00 0.00 176.83 176.17 3kt3 h THR 208 N -0.03 1.04 -0.47 -2.27 2.02 -1.79 0.42 112.91 111.83 3kt3 h THR 208 Ca 0.23 -0.17 0.06 0.00 0.77 0.00 0.00 66.41 67.30 3kt3 h THR 208 Cb 0.38 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.24 3kt3 h THR 208 CO -0.51 0.09 0.17 0.00 0.37 0.00 0.00 175.52 175.64 3kt3 h ALA 209 N 1.19 0.57 -0.47 6.16 0.00 -0.57 0.15 119.26 126.29 3kt3 h ALA 209 Ca 0.17 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 3kt3 h ALA 209 Cb 0.01 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3kt3 h ALA 209 CO -0.08 -0.22 -0.15 0.87 0.00 0.00 0.00 179.25 179.67 3kt3 h LYS 210 N 0.35 0.90 -0.17 0.00 1.57 -0.76 -0.74 116.57 117.71 3kt3 h LYS 210 Ca 0.22 -0.34 -0.21 0.00 -1.87 0.00 0.00 60.65 58.46 3kt3 h LYS 210 Cb 0.23 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3kt3 h LYS 210 CO -0.23 0.99 -0.71 0.00 -0.57 0.00 0.00 179.45 178.93 3kt3 h ALA 211 N 1.02 0.41 0.23 3.86 0.00 -0.38 -1.09 119.26 123.32 3kt3 h ALA 211 Ca 0.12 -0.58 -0.34 0.00 0.00 0.00 0.00 54.91 54.11 3kt3 h ALA 211 Cb 0.69 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.47 3kt3 h ALA 211 CO 0.05 0.70 -1.58 0.28 0.00 0.00 0.00 179.25 178.70 3kt3 h VAL 212 N 0.52 1.16 0.00 0.00 2.07 -0.74 -3.40 116.25 115.86 3kt3 h VAL 212 Ca -0.03 -2.64 0.00 0.00 0.82 0.00 0.00 66.70 64.85 3kt3 h VAL 212 Cb 1.32 2.95 0.00 0.00 -1.52 0.00 0.00 31.29 34.04 3kt3 h VAL 212 CO 0.14 0.83 -0.61 0.49 0.02 0.00 0.00 177.57 178.44 3kt3 n PHE 213 N -3.67 0.00 -0.82 1.57 3.72 -0.29 -4.99 117.46 112.99 3kt3 n PHE 213 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 3kt3 n PHE 213 Cb 1.10 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.60 3kt3 n PHE 213 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kt3 n GLY 214 N 1.35 0.65 3.68 1.37 0.00 -0.41 -5.01 105.19 106.82 3kt3 n GLY 214 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 3kt3 n GLY 214 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3kt3 n PHE 215 N -2.66 1.36 -4.37 1.61 3.72 -1.25 -5.00 117.46 110.87 3kt3 n PHE 215 Ca 0.00 0.41 -0.18 0.00 -0.05 0.00 0.00 57.45 57.63 3kt3 n PHE 215 Cb 0.00 -2.18 -0.05 0.00 -0.94 0.00 0.00 39.48 36.31 3kt3 n PHE 215 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 3kt3 n ASN 216 N -1.91 1.28 0.21 4.37 0.23 -1.26 -4.53 115.26 113.65 3kt3 n ASN 216 Ca 0.15 -2.55 0.14 0.00 -0.53 0.00 0.00 54.58 51.79 3kt3 n ASN 216 Cb 0.49 0.70 0.72 0.00 -2.08 0.00 0.00 39.78 39.60 3kt3 n ASN 216 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3kt3 h ASP 217 N 1.14 0.00 1.59 0.53 3.32 -2.02 -1.75 116.42 119.23 3kt3 h ASP 217 Ca -0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.82 3kt3 h ASP 217 Cb 0.87 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.42 3kt3 h ASP 217 CO 0.37 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 178.66 3kt3 h SER 218 N 0.00 0.00 -3.88 6.45 4.64 -2.02 -3.45 113.55 115.29 3kt3 h SER 218 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 3kt3 h SER 218 Cb 0.13 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.25 3kt3 h SER 218 CO 0.00 0.00 0.46 -1.81 -0.87 0.00 0.00 176.83 174.61 3kt3 s ASP 219 N -5.59 6.98 0.68 4.97 1.01 -0.66 -5.02 116.67 119.04 3kt3 s ASP 219 Ca 0.06 2.20 -0.14 0.00 0.71 0.00 0.00 52.55 55.38 3kt3 s ASP 219 Cb 0.08 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.41 3kt3 s ASP 219 CO 0.61 -0.35 1.10 0.00 0.21 0.00 0.00 175.17 176.74 3kt3 h ILE 221 N -0.21 0.65 -0.61 0.00 3.07 -1.96 -1.84 117.51 116.63 3kt3 h ILE 221 Ca -0.46 -0.43 0.00 0.00 1.55 0.00 0.00 64.86 65.53 3kt3 h ILE 221 Cb 1.24 1.26 -0.03 0.00 -0.27 0.00 0.00 36.82 39.03 3kt3 h ILE 221 CO 0.54 0.10 0.39 1.23 -1.05 0.00 0.00 178.15 179.36 3kt3 h GLY 222 N 0.61 0.86 0.88 0.16 0.00 -1.99 -1.37 103.07 102.23 3kt3 h GLY 222 Ca -0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 3kt3 h GLY 222 CO 0.01 0.33 0.07 0.50 0.00 0.00 0.00 176.54 177.45 3kt3 h LYS 223 N 0.82 0.24 -0.88 4.80 1.57 -1.68 -1.72 116.57 119.73 3kt3 h LYS 223 Ca 0.22 -0.04 0.11 0.00 -1.87 0.00 0.00 60.65 59.07 3kt3 h LYS 223 Cb -0.07 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.13 3kt3 h LYS 223 CO -0.05 0.32 0.57 0.74 -0.57 0.00 0.00 179.45 180.47 3kt3 h PHE 224 N 0.11 0.91 0.02 -1.35 -1.00 -1.33 -2.85 116.94 111.46 3kt3 h PHE 224 Ca 0.05 0.03 -0.24 0.00 2.81 0.00 0.00 57.97 60.62 3kt3 h PHE 224 Cb 0.17 -0.29 -0.03 0.00 3.61 0.00 0.00 35.95 39.41 3kt3 h PHE 224 CO -0.01 0.40 -1.17 1.25 -1.61 0.00 0.00 178.31 177.17 3kt3 h HIS 225 N 0.82 0.09 -0.92 -0.55 2.76 -1.08 -3.40 115.15 112.87 3kt3 h HIS 225 Ca 0.42 -0.07 0.19 0.00 -2.20 0.00 0.00 60.37 58.71 3kt3 h HIS 225 Cb 0.50 -0.00 -0.11 0.00 1.55 0.00 0.00 27.41 29.34 3kt3 h HIS 225 CO -0.00 1.06 0.49 0.35 -1.30 0.00 0.00 177.93 178.53 3kt3 h PHE 226 N 0.01 0.85 -1.20 5.26 3.57 -1.06 -0.89 116.94 123.49 3kt3 h PHE 226 Ca -0.08 0.04 0.34 0.00 3.53 0.00 0.00 57.97 61.80 3kt3 h PHE 226 Cb 1.85 -0.24 -0.09 0.00 2.79 0.00 0.00 35.95 40.26 3kt3 h PHE 226 CO 0.01 0.12 0.81 0.00 -2.23 0.00 0.00 178.31 177.03 3kt3 h ALA 227 N 1.64 2.72 -0.44 2.41 0.00 -1.78 0.21 119.26 124.03 3kt3 h ALA 227 Ca 0.54 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.57 3kt3 h ALA 227 Cb 0.90 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 3kt3 h ALA 227 CO -0.42 -1.16 -0.15 0.77 0.00 0.00 0.00 179.25 178.29 3kt3 h SER 228 N 0.18 -0.53 0.36 0.00 0.02 -1.47 0.57 113.55 112.69 3kt3 h SER 228 Ca 0.65 0.14 -0.02 0.00 -0.84 0.00 0.00 61.79 61.73 3kt3 h SER 228 Cb 2.10 0.32 0.00 0.00 0.14 0.00 0.00 62.40 64.96 3kt3 h SER 228 CO -0.21 -0.18 -0.17 0.40 -1.14 0.00 0.00 176.83 175.52 3kt3 h ILE 229 N -0.05 0.65 -0.64 3.27 2.04 -0.74 0.35 117.51 122.38 3kt3 h ILE 229 Ca 0.21 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3kt3 h ILE 229 Cb 0.37 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 3kt3 h ILE 229 CO -0.48 0.03 0.42 -0.61 0.00 0.00 0.00 178.15 177.51 3kt3 h GLN 230 N -0.58 0.85 -0.17 2.37 4.15 -1.43 -2.31 115.11 117.99 3kt3 h GLN 230 Ca -0.05 -0.06 -0.20 0.00 0.77 0.00 0.00 58.65 59.11 3kt3 h GLN 230 Cb 0.43 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 27.93 3kt3 h GLN 230 CO 0.08 0.57 -0.69 0.82 -1.93 0.00 0.00 178.83 177.68 3kt3 h ILE 231 N 0.87 1.30 -0.06 2.39 2.04 -0.68 -3.28 117.51 120.10 3kt3 h ILE 231 Ca 0.23 -1.93 -0.02 0.00 1.00 0.00 0.00 64.86 64.15 3kt3 h ILE 231 Cb -0.08 1.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.89 3kt3 h ILE 231 CO -0.05 0.61 -0.04 0.00 0.00 0.00 0.00 178.15 178.67 3kt3 h ALA 232 N 0.71 1.83 0.00 1.87 0.00 0.25 -2.00 119.26 121.92 3kt3 h ALA 232 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3kt3 h ALA 232 Cb 1.30 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3kt3 h ALA 232 CO 0.14 0.13 0.00 0.25 0.00 0.00 0.00 179.25 179.77 3kt3 n THR 233 N -4.44 0.20 0.71 0.00 -2.24 -1.09 -2.24 114.28 105.19 3kt3 n THR 233 Ca -0.02 0.03 0.10 0.00 -2.27 0.00 0.00 64.05 61.89 3kt3 n THR 233 Cb 0.15 -0.59 0.45 0.00 -2.10 0.00 0.00 70.33 68.24 3kt3 n THR 233 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kt3 n ALA 234 N -1.52 1.97 -3.01 6.98 0.00 -0.75 -4.76 120.51 119.42 3kt3 n ALA 234 Ca 0.06 -0.06 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 3kt3 n ALA 234 Cb 0.32 -1.35 -0.13 0.00 0.00 0.00 0.00 19.45 18.29 3kt3 n ALA 234 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3kt3 s PHE 235 N -3.02 2.99 0.05 0.00 0.08 -0.95 -4.44 117.98 112.69 3kt3 s PHE 235 Ca 0.10 -0.40 0.30 0.00 0.12 0.00 0.00 56.93 57.05 3kt3 s PHE 235 Cb 0.14 -1.96 1.55 0.00 -0.57 0.00 0.00 43.02 42.18 3kt3 s PHE 235 CO 0.39 -0.11 1.91 -1.00 -0.10 0.00 0.00 175.22 176.32 3kt3 h PRO 236 N 6.84 0.00 0.00 0.24 0.13 -1.81 -0.94 132.00 136.46 3kt3 h PRO 236 Ca -0.31 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3kt3 h PRO 236 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 3kt3 h PRO 236 CO 0.61 0.00 -0.01 0.66 -0.23 0.00 0.00 178.00 179.03 3kt3 h SER 237 N 0.00 0.00 0.86 1.44 4.64 -1.85 -0.01 113.55 118.62 3kt3 h SER 237 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kt3 h SER 237 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3kt3 h SER 237 CO 0.00 0.01 0.00 -1.20 -0.87 0.00 0.00 176.83 174.77 3kt3 n SER 238 N -3.47 0.51 -3.20 4.97 7.64 -0.36 -4.24 113.62 115.47 3kt3 n SER 238 Ca -0.03 0.60 -0.24 0.00 1.01 0.00 0.00 58.87 60.21 3kt3 n SER 238 Cb 0.10 -0.72 -0.06 0.00 -1.01 0.00 0.00 64.21 62.53 3kt3 n SER 238 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3kt3 n PHE 239 N -2.03 1.62 -0.12 1.43 3.72 -0.02 -3.74 117.46 118.32 3kt3 n PHE 239 Ca 0.04 -3.86 -0.10 0.00 -0.05 0.00 0.00 57.45 53.48 3kt3 n PHE 239 Cb 0.27 -0.45 0.04 0.00 -0.94 0.00 0.00 39.48 38.40 3kt3 n PHE 239 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3kt3 h PRO 240 N 3.60 0.88 -0.01 -1.08 0.13 -1.74 -0.79 132.00 132.99 3kt3 h PRO 240 Ca 0.12 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3kt3 h PRO 240 Cb 0.77 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.88 3kt3 h PRO 240 CO 0.63 1.03 -0.39 0.09 -0.23 0.00 0.00 178.00 179.13 3kt3 n ASN 241 N -4.10 1.75 -0.13 1.44 3.02 -1.26 -2.85 115.26 113.13 3kt3 n ASN 241 Ca -0.00 -1.35 -0.27 0.00 -0.03 0.00 0.00 54.58 52.94 3kt3 n ASN 241 Cb 0.46 0.35 -0.10 0.00 -0.61 0.00 0.00 39.78 39.88 3kt3 n ASN 241 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3kt3 n VAL 242 N -0.16 1.49 -0.12 2.41 0.31 -1.19 -3.27 118.33 117.79 3kt3 n VAL 242 Ca 0.10 -0.42 -0.25 0.00 -0.01 0.00 0.00 64.34 63.76 3kt3 n VAL 242 Cb 0.43 -1.76 -0.08 0.00 -0.91 0.00 0.00 33.84 31.52 3kt3 n VAL 242 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3kt3 n LEU 243 N -4.00 1.82 -3.27 7.52 4.77 -0.35 -1.39 117.00 122.10 3kt3 n LEU 243 Ca -0.52 0.31 -0.16 0.00 -0.03 0.00 0.00 56.01 55.62 3kt3 n LEU 243 Cb 0.90 -0.75 0.08 0.00 -2.33 0.00 0.00 43.42 41.33 3kt3 n LEU 243 CO 0.08 0.43 0.10 0.61 -1.33 0.00 0.00 177.39 177.28 3kt3 n GLY 244 N 1.41 -0.32 3.58 -0.72 0.00 -0.91 -4.86 105.19 103.37 3kt3 n GLY 244 Ca -0.46 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 3kt3 n GLY 244 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kt3 s LEU 245 N -6.06 3.05 0.25 0.99 1.43 -1.26 -5.09 118.68 111.99 3kt3 s LEU 245 Ca 0.01 -0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 52.47 3kt3 s LEU 245 Cb -0.00 -1.83 -0.15 0.00 0.03 0.00 0.00 46.19 44.25 3kt3 s LEU 245 CO 0.68 0.20 1.07 -2.65 0.23 0.00 0.00 176.35 175.88 3kt3 n PRO 246 N 0.90 1.30 -0.45 1.29 -0.02 -1.26 -4.75 135.00 132.01 3kt3 n PRO 246 Ca -0.14 0.46 0.38 0.00 -2.02 0.00 0.00 63.50 62.18 3kt3 n PRO 246 Cb 0.52 -1.87 0.70 0.00 -0.02 0.00 0.00 33.50 32.83 3kt3 n PRO 246 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3kt3 h ASP 247 N 2.51 0.15 -0.34 2.55 3.45 -1.96 0.19 116.42 122.98 3kt3 h ASP 247 Ca -0.41 0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.11 3kt3 h ASP 247 Cb 1.34 0.05 0.00 0.00 -0.56 0.00 0.00 39.33 40.16 3kt3 h ASP 247 CO 0.64 -0.05 0.00 0.29 -1.57 0.00 0.00 179.24 178.55 3kt3 n LYS 248 N -4.37 1.91 -2.16 3.56 5.02 -1.26 -4.40 118.16 116.46 3kt3 n LYS 248 Ca 0.34 -1.40 -0.42 0.00 -2.02 0.00 0.00 58.31 54.80 3kt3 n LYS 248 Cb 1.43 -1.35 -0.03 0.00 -0.02 0.00 0.00 35.03 35.06 3kt3 n LYS 248 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3kt3 s THR 249 N -1.55 3.58 0.60 -0.18 2.01 0.05 -4.30 115.64 115.86 3kt3 s THR 249 Ca 0.29 0.96 -0.05 0.00 0.31 0.00 0.00 61.69 63.21 3kt3 s THR 249 Cb 0.16 -3.62 0.02 0.00 0.01 0.00 0.00 72.50 69.07 3kt3 s THR 249 CO 0.22 -0.01 0.90 -2.16 -0.69 0.00 0.00 174.62 172.87 3kt3 s PRO 250 N 2.56 2.69 0.31 4.92 0.04 -1.26 -4.51 135.00 139.75 3kt3 s PRO 250 Ca 0.66 -0.20 0.10 0.00 0.04 0.00 0.00 61.00 61.59 3kt3 s PRO 250 Cb -0.33 -2.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.87 3kt3 s PRO 250 CO 0.27 -0.81 -0.02 0.00 0.04 0.00 0.00 177.00 176.49 3kt3 s LEU 252 N -3.68 3.31 -0.44 0.00 2.96 0.67 -0.92 118.68 120.58 3kt3 s LEU 252 Ca 0.33 -0.14 -0.04 0.00 -0.22 0.00 0.00 54.13 54.06 3kt3 s LEU 252 Cb -0.03 -1.82 0.12 0.00 0.50 0.00 0.00 46.19 44.96 3kt3 s LEU 252 CO 0.19 0.12 0.24 -0.63 -1.32 0.00 0.00 176.35 174.95 3kt3 s ILE 253 N 0.67 3.45 0.24 6.68 1.01 0.12 -1.84 121.20 131.52 3kt3 s ILE 253 Ca -0.01 -2.10 -0.30 0.00 0.00 0.00 0.00 60.65 58.24 3kt3 s ILE 253 Cb -0.14 -3.34 -0.09 0.00 0.01 0.00 0.00 42.46 38.90 3kt3 s ILE 253 CO 0.02 -0.72 0.94 -2.16 0.00 0.00 0.00 174.94 173.02 3kt3 s PRO 254 N 1.06 4.84 -0.01 2.79 0.04 -1.25 -1.97 135.00 140.51 3kt3 s PRO 254 Ca 0.09 1.47 -0.30 0.00 0.04 0.00 0.00 61.00 62.30 3kt3 s PRO 254 Cb -0.23 -3.26 0.12 0.00 0.04 0.00 0.00 34.50 31.17 3kt3 s PRO 254 CO -0.04 0.51 1.27 0.00 0.04 0.00 0.00 177.00 178.78 3kt3 s ALA 256 N -2.47 2.93 0.64 0.00 0.00 -1.26 -0.95 121.76 120.65 3kt3 s ALA 256 Ca 0.14 0.11 0.30 0.00 0.00 0.00 0.00 51.96 52.51 3kt3 s ALA 256 Cb 0.04 -3.14 1.63 0.00 0.00 0.00 0.00 23.12 21.65 3kt3 s ALA 256 CO -0.04 -0.72 1.95 0.97 0.00 0.00 0.00 175.76 177.93 3kt3 h ILE 257 N 0.05 0.13 0.00 0.00 6.09 -1.81 -2.08 117.51 119.88 3kt3 h ILE 257 Ca -0.45 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.04 3kt3 h ILE 257 Cb 1.20 0.68 0.00 0.00 0.47 0.00 0.00 36.82 39.17 3kt3 h ILE 257 CO 0.60 0.00 0.00 -2.24 -3.07 0.00 0.00 178.15 173.44 3kt3 h ASP 258 N 0.00 0.00 0.43 2.19 2.03 -1.88 -2.41 116.42 116.78 3kt3 h ASP 258 Ca 0.06 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.36 3kt3 h ASP 258 Cb 0.74 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.24 3kt3 h ASP 258 CO -0.00 0.00 -0.45 0.00 -1.03 0.00 0.00 179.24 177.76 3kt3 n GLN 259 N -3.08 0.19 -0.25 4.15 1.13 -0.78 -2.83 117.38 115.91 3kt3 n GLN 259 Ca -0.01 -0.11 0.02 0.00 -1.94 0.00 0.00 57.00 54.95 3kt3 n GLN 259 Cb 0.19 -1.50 0.15 0.00 0.11 0.00 0.00 30.24 29.19 3kt3 n GLN 259 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 3kt3 h ASP 260 N 0.27 0.49 -0.89 1.08 1.82 -1.60 -2.78 116.42 114.81 3kt3 h ASP 260 Ca 0.00 0.06 0.24 0.00 -0.39 0.00 0.00 57.03 56.94 3kt3 h ASP 260 Cb 0.50 -0.02 -0.14 0.00 0.68 0.00 0.00 39.33 40.34 3kt3 h ASP 260 CO 0.00 0.28 0.24 -0.65 -1.61 0.00 0.00 179.24 177.50 3kt3 h PRO 261 N 0.63 0.19 -0.78 0.28 0.11 -1.81 0.23 132.00 130.86 3kt3 h PRO 261 Ca 0.36 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 66.54 3kt3 h PRO 261 Cb 0.38 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 31.38 3kt3 h PRO 261 CO -0.27 0.13 0.44 1.88 -0.21 0.00 0.00 178.00 179.97 3kt3 h TYR 262 N 0.20 0.81 0.00 0.65 -1.99 -1.83 -3.13 116.97 111.68 3kt3 h TYR 262 Ca 0.56 0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.32 3kt3 h TYR 262 Cb 1.15 -0.25 0.00 0.00 2.00 0.00 0.00 36.73 39.64 3kt3 h TYR 262 CO -0.26 0.35 -0.70 1.19 -0.00 0.00 0.00 178.16 178.74 3kt3 n PHE 263 N -4.75 0.08 0.10 4.88 3.01 0.67 -1.77 117.46 119.69 3kt3 n PHE 263 Ca 0.12 0.02 -0.03 0.00 1.01 0.00 0.00 57.45 58.57 3kt3 n PHE 263 Cb 0.23 -0.26 -0.00 0.00 -0.01 0.00 0.00 39.48 39.45 3kt3 n PHE 263 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 3kt3 h ARG 264 N 0.00 0.00 -0.38 -1.08 0.11 -1.21 -2.08 114.38 109.74 3kt3 h ARG 264 Ca 0.00 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.98 3kt3 h ARG 264 Cb 0.55 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.62 3kt3 h ARG 264 CO 0.00 0.79 -0.17 0.28 0.10 0.00 0.00 179.97 180.97 3kt3 h VAL 265 N 0.00 1.28 -0.51 0.08 2.07 -1.47 -2.59 116.25 115.11 3kt3 h VAL 265 Ca -0.01 -1.30 0.06 0.00 0.82 0.00 0.00 66.70 66.28 3kt3 h VAL 265 Cb 1.50 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 32.52 3kt3 h VAL 265 CO 0.10 0.43 0.21 0.00 0.02 0.00 0.00 177.57 178.33 3kt3 h ARG 267 N 0.41 0.28 -0.10 0.00 3.08 -1.36 -0.35 114.38 116.35 3kt3 h ARG 267 Ca 0.24 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 60.09 3kt3 h ARG 267 Cb 0.22 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 3kt3 h ARG 267 CO -0.22 0.52 -0.41 0.22 -1.07 0.00 0.00 179.97 179.01 3kt3 h ASP 268 N 0.26 0.22 0.94 7.04 3.58 -1.02 -3.25 116.42 124.19 3kt3 h ASP 268 Ca 0.04 -0.09 -0.19 0.00 0.42 0.00 0.00 57.03 57.21 3kt3 h ASP 268 Cb 0.58 -0.06 -0.03 0.00 1.72 0.00 0.00 39.33 41.54 3kt3 h ASP 268 CO 0.04 0.62 -1.13 0.58 -2.88 0.00 0.00 179.24 176.47 3kt3 h VAL 269 N 0.18 1.02 -0.89 2.25 2.07 -0.52 -3.37 116.25 116.99 3kt3 h VAL 269 Ca 0.02 -2.62 0.05 0.00 0.82 0.00 0.00 66.70 64.97 3kt3 h VAL 269 Cb 0.81 2.45 -0.06 0.00 -1.52 0.00 0.00 31.29 32.97 3kt3 h VAL 269 CO 0.06 0.58 0.56 0.00 0.02 0.00 0.00 177.57 178.80 3kt3 h ALA 270 N 1.23 1.21 0.31 1.67 0.00 -1.12 -2.51 119.26 120.04 3kt3 h ALA 270 Ca -0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3kt3 h ALA 270 Cb 1.68 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3kt3 h ALA 270 CO 0.08 0.34 -0.15 -0.44 0.00 0.00 0.00 179.25 179.09 3kt3 h ASP 271 N 1.04 -0.35 -0.76 0.00 5.19 -1.73 0.35 116.42 120.16 3kt3 h ASP 271 Ca 0.38 -0.01 0.10 0.00 -0.62 0.00 0.00 57.03 56.88 3kt3 h ASP 271 Cb 0.12 0.09 -0.05 0.00 0.18 0.00 0.00 39.33 39.67 3kt3 h ASP 271 CO -0.16 -0.23 0.50 0.11 -3.12 0.00 0.00 179.24 176.34 3kt3 h LYS 272 N -0.44 0.66 -0.02 3.56 1.57 -1.71 -1.81 116.57 118.37 3kt3 h LYS 272 Ca -0.04 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3kt3 h LYS 272 Cb 0.34 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3kt3 h LYS 272 CO 0.07 0.44 0.00 1.28 -0.57 0.00 0.00 179.45 180.67 3kt3 n LEU 273 N -4.50 1.28 -2.65 2.94 4.77 -0.97 -4.93 117.00 112.95 3kt3 n LEU 273 Ca 0.13 -0.43 -0.20 0.00 -0.03 0.00 0.00 56.01 55.47 3kt3 n LEU 273 Cb 0.33 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 3kt3 n LEU 273 CO 0.33 0.22 -0.05 0.29 -1.33 0.00 0.00 177.39 176.84 3kt3 n LYS 274 N 0.01 -3.87 -4.04 3.23 4.76 -0.68 -5.03 118.16 112.53 3kt3 n LYS 274 Ca 0.20 0.86 -0.26 0.00 -2.87 0.00 0.00 58.31 56.23 3kt3 n LYS 274 Cb 0.32 -5.53 -0.04 0.00 -1.84 0.00 0.00 35.03 27.93 3kt3 n LYS 274 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3kt3 s TYR 275 N -3.09 2.10 0.01 2.13 2.02 0.07 -4.69 117.35 115.90 3kt3 s TYR 275 Ca 0.22 -0.73 -0.15 0.00 -0.37 0.00 0.00 57.07 56.04 3kt3 s TYR 275 Cb -0.10 -1.92 -0.06 0.00 -0.40 0.00 0.00 41.96 39.49 3kt3 s TYR 275 CO 0.27 -0.13 0.42 -1.12 -1.57 0.00 0.00 175.55 173.42 3kt3 s SER 276 N -4.09 6.82 0.23 2.29 0.01 -1.26 -4.16 113.70 113.54 3kt3 s SER 276 Ca 0.34 0.97 -0.31 0.00 1.31 0.00 0.00 55.95 58.27 3kt3 s SER 276 Cb 0.00 -2.25 -0.11 0.00 0.21 0.00 0.00 66.02 63.87 3kt3 s SER 276 CO 0.20 0.31 1.60 -0.54 0.41 0.00 0.00 173.24 175.22 3kt3 s LYS 277 N -1.13 4.17 0.51 12.44 1.02 -1.26 -4.79 119.74 130.71 3kt3 s LYS 277 Ca 0.25 2.48 -0.19 0.00 0.02 0.00 0.00 55.97 58.53 3kt3 s LYS 277 Cb -0.17 -3.08 -0.07 0.00 -0.52 0.00 0.00 37.83 33.99 3kt3 s LYS 277 CO 0.14 -0.62 1.03 -1.25 -0.92 0.00 0.00 175.35 173.73 3kt3 s PRO 278 N 0.38 3.71 0.30 -1.68 0.04 -1.26 -4.69 135.00 131.81 3kt3 s PRO 278 Ca 0.67 1.28 -0.07 0.00 0.04 0.00 0.00 61.00 62.92 3kt3 s PRO 278 Cb -0.46 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 31.93 3kt3 s PRO 278 CO 0.39 -0.49 0.59 0.00 0.04 0.00 0.00 177.00 177.53 3kt3 s ALA 279 N -2.16 3.56 0.02 8.56 0.00 -0.10 -4.86 121.76 126.79 3kt3 s ALA 279 Ca 0.65 -0.45 0.05 0.00 0.00 0.00 0.00 51.96 52.21 3kt3 s ALA 279 Cb -0.15 -2.40 -0.02 0.00 0.00 0.00 0.00 23.12 20.55 3kt3 s ALA 279 CO 0.25 0.23 -0.14 -0.51 0.00 0.00 0.00 175.76 175.59 3kt3 s LEU 280 N -3.50 2.11 -0.17 0.00 1.43 -0.41 0.12 118.68 118.27 3kt3 s LEU 280 Ca 0.46 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 3kt3 s LEU 280 Cb -0.11 -0.67 0.03 0.00 0.03 0.00 0.00 46.19 45.48 3kt3 s LEU 280 CO 0.29 0.10 -0.10 -0.76 0.23 0.00 0.00 176.35 176.10 3kt3 s LEU 281 N -0.80 1.86 -0.21 1.79 1.43 -0.83 -1.28 118.68 120.64 3kt3 s LEU 281 Ca 0.03 -0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 52.38 3kt3 s LEU 281 Cb -0.07 -1.12 -0.05 0.00 0.03 0.00 0.00 46.19 44.99 3kt3 s LEU 281 CO 0.01 -0.12 0.11 -1.00 0.23 0.00 0.00 176.35 175.57 3kt3 s HIS 282 N 1.50 3.30 0.26 0.29 3.76 0.50 -1.98 115.29 122.93 3kt3 s HIS 282 Ca 0.02 0.16 0.01 0.00 -0.15 0.00 0.00 55.06 55.10 3kt3 s HIS 282 Cb -0.15 -2.16 -0.04 0.00 1.11 0.00 0.00 32.58 31.34 3kt3 s HIS 282 CO -0.09 0.14 0.44 -1.54 -0.85 0.00 0.00 174.74 172.84 3kt3 s SER 283 N 0.63 6.34 1.04 1.40 1.04 -0.13 -1.20 113.70 122.82 3kt3 s SER 283 Ca 0.06 0.33 -0.14 0.00 0.48 0.00 0.00 55.95 56.68 3kt3 s SER 283 Cb -0.12 -1.98 0.21 0.00 0.10 0.00 0.00 66.02 64.22 3kt3 s SER 283 CO 0.01 -0.14 1.11 -0.13 0.98 0.00 0.00 173.24 175.07 3kt3 s ARG 284 N -3.85 0.12 0.00 4.02 0.52 0.15 -2.49 118.95 117.42 3kt3 s ARG 284 Ca 0.38 0.28 -0.22 0.00 -0.52 0.00 0.00 55.73 55.65 3kt3 s ARG 284 Cb -0.10 -1.72 -0.05 0.00 0.52 0.00 0.00 34.95 33.60 3kt3 s ARG 284 CO 0.32 -2.89 0.66 -0.06 0.02 0.00 0.00 175.30 173.35 3kt3 s PHE 285 N -3.07 3.68 -0.17 -0.53 0.08 -1.26 -4.87 117.98 111.85 3kt3 s PHE 285 Ca 0.67 1.28 -0.29 0.00 0.12 0.00 0.00 56.93 58.71 3kt3 s PHE 285 Cb -0.15 -2.70 -0.03 0.00 -0.57 0.00 0.00 43.02 39.57 3kt3 s PHE 285 CO 0.56 0.29 1.58 0.12 -0.10 0.00 0.00 175.22 177.67 3kt3 s PHE 286 N -0.01 2.17 0.65 0.36 5.36 -1.26 -4.97 117.98 120.28 3kt3 s PHE 286 Ca 0.34 0.51 -0.15 0.00 -0.96 0.00 0.00 56.93 56.67 3kt3 s PHE 286 Cb -0.19 -3.90 -0.01 0.00 -0.34 0.00 0.00 43.02 38.59 3kt3 s PHE 286 CO 0.19 -3.02 1.11 -2.14 -1.46 0.00 0.00 175.22 169.90 3kt3 s PRO 287 N 4.33 2.85 0.83 10.12 0.02 -1.26 -1.06 135.00 150.83 3kt3 s PRO 287 Ca 0.70 1.41 -0.10 0.00 0.02 0.00 0.00 61.00 63.03 3kt3 s PRO 287 Cb -0.27 -1.95 0.09 0.00 0.02 0.00 0.00 34.50 32.39 3kt3 s PRO 287 CO 0.27 -1.22 1.11 0.00 -0.33 0.00 0.00 177.00 176.84 3kt3 s ALA 288 N -2.28 1.91 0.44 -1.55 0.00 -0.74 -4.11 121.76 115.43 3kt3 s ALA 288 Ca 0.68 0.35 0.17 0.00 0.00 0.00 0.00 51.96 53.16 3kt3 s ALA 288 Cb -0.21 -3.33 1.10 0.00 0.00 0.00 0.00 23.12 20.68 3kt3 s ALA 288 CO 0.40 -2.17 1.92 1.25 0.00 0.00 0.00 175.76 177.16 3kt3 h LEU 289 N -1.43 0.35 -0.16 0.00 5.85 -1.67 0.95 115.31 119.20 3kt3 h LEU 289 Ca -0.44 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3kt3 h LEU 289 Cb 1.25 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.23 3kt3 h LEU 289 CO 0.48 0.18 0.00 0.00 -0.34 0.00 0.00 178.44 178.76 3kt3 n GLN 290 N -4.47 0.17 -0.33 1.25 3.00 -1.26 -1.52 117.38 114.23 3kt3 n GLN 290 Ca 0.14 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 3kt3 n GLN 290 Cb 0.56 -1.73 0.00 0.00 0.00 0.00 0.00 30.24 29.07 3kt3 n GLN 290 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kt3 n GLY 291 N 0.94 0.00 3.39 1.08 0.00 0.33 -4.59 105.19 106.34 3kt3 n GLY 291 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 3kt3 n GLY 291 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kt3 n SER 292 N 0.00 3.49 -4.32 1.61 3.41 -1.26 -4.24 113.62 112.31 3kt3 n SER 292 Ca 0.00 -2.76 -0.38 0.00 -0.26 0.00 0.00 58.87 55.46 3kt3 n SER 292 Cb 0.00 -1.60 -0.04 0.00 -0.26 0.00 0.00 64.21 62.31 3kt3 n SER 292 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 3kt3 n THR 293 N 6.79 -0.67 -4.24 6.66 5.66 -1.25 -4.96 114.28 122.27 3kt3 n THR 293 Ca 0.48 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 61.27 3kt3 n THR 293 Cb 0.44 -1.28 -0.12 0.00 -1.55 0.00 0.00 70.33 67.83 3kt3 n THR 293 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3kt3 s THR 294 N -3.26 1.43 0.07 1.09 2.01 -1.26 -4.19 115.64 111.53 3kt3 s THR 294 Ca 0.78 -1.56 -0.14 0.00 0.31 0.00 0.00 61.69 61.08 3kt3 s THR 294 Cb -0.43 -1.43 -0.06 0.00 0.01 0.00 0.00 72.50 70.59 3kt3 s THR 294 CO 0.95 -0.24 0.46 -1.59 -0.69 0.00 0.00 174.62 173.52 3kt3 s LYS 295 N -2.16 3.92 0.24 4.92 -2.85 -1.26 -1.78 119.74 120.77 3kt3 s LYS 295 Ca 0.05 0.41 -0.31 0.00 -1.00 0.00 0.00 55.97 55.12 3kt3 s LYS 295 Cb -0.08 -3.09 -0.12 0.00 -2.06 0.00 0.00 37.83 32.48 3kt3 s LYS 295 CO 0.04 0.60 1.61 -0.12 0.10 0.00 0.00 175.35 177.57 3kt3 n MET 296 N 1.31 2.56 -3.88 1.78 0.00 -0.22 -4.37 117.12 114.31 3kt3 n MET 296 Ca -0.10 0.92 -0.10 0.00 -0.00 0.00 0.00 57.70 58.42 3kt3 n MET 296 Cb 0.52 -2.70 -0.09 0.00 0.00 0.00 0.00 33.22 30.95 3kt3 n MET 296 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 3kt3 s SER 297 N 0.73 0.08 0.38 6.12 0.15 -1.26 -4.93 113.70 114.97 3kt3 s SER 297 Ca 0.70 -0.41 0.19 0.00 0.70 0.00 0.00 55.95 57.12 3kt3 s SER 297 Cb -0.54 0.26 0.72 0.00 -1.71 0.00 0.00 66.02 64.75 3kt3 s SER 297 CO 0.42 -0.53 1.76 0.00 1.20 0.00 0.00 173.24 176.09 3kt3 h ALA 298 N 3.58 1.03 -0.04 5.45 0.00 -1.97 -1.72 119.26 125.58 3kt3 h ALA 298 Ca -0.32 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.27 3kt3 h ALA 298 Cb 1.19 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 3kt3 h ALA 298 CO 0.48 0.45 0.22 0.77 0.00 0.00 0.00 179.25 181.18 3kt3 h SER 299 N 0.00 0.00 -2.86 0.00 0.02 -1.99 -3.39 113.55 105.33 3kt3 h SER 299 Ca -0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.38 3kt3 h SER 299 Cb 0.85 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.36 3kt3 h SER 299 CO 0.05 0.00 0.97 -1.81 -1.14 0.00 0.00 176.83 174.89 3kt3 s ASP 300 N -4.86 6.81 -0.39 3.07 1.01 -0.65 -5.01 116.67 116.66 3kt3 s ASP 300 Ca -0.04 1.74 -0.13 0.00 0.71 0.00 0.00 52.55 54.83 3kt3 s ASP 300 Cb 0.11 -2.54 0.02 0.00 1.01 0.00 0.00 42.92 41.52 3kt3 s ASP 300 CO 0.36 -0.87 0.26 -0.62 0.21 0.00 0.00 175.17 174.51 3kt3 s ASP 301 N 2.54 5.98 -1.63 0.27 3.68 -1.26 -4.13 116.67 122.11 3kt3 s ASP 301 Ca 0.60 -0.87 -0.17 0.00 2.13 0.00 0.00 52.55 54.25 3kt3 s ASP 301 Cb -0.24 -2.11 0.13 0.00 -1.45 0.00 0.00 42.92 39.25 3kt3 s ASP 301 CO 0.20 -0.40 0.89 0.35 0.13 0.00 0.00 175.17 176.33 3kt3 n THR 302 N 5.10 -1.48 -0.21 1.71 -2.24 -1.26 -4.80 114.28 111.11 3kt3 n THR 302 Ca -0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 3kt3 n THR 302 Cb 0.47 -2.23 0.00 0.00 -2.10 0.00 0.00 70.33 66.47 3kt3 n THR 302 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3kt3 n THR 303 N -4.53 0.00 -4.25 4.28 -1.04 -1.26 -4.97 114.28 102.51 3kt3 n THR 303 Ca 0.07 -0.37 -0.22 0.00 -2.04 0.00 0.00 64.05 61.49 3kt3 n THR 303 Cb 0.50 1.21 -0.12 0.00 -1.82 0.00 0.00 70.33 70.10 3kt3 n THR 303 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3kt3 s ALA 304 N -0.14 1.53 -0.28 2.41 0.00 -1.26 -1.69 121.76 122.34 3kt3 s ALA 304 Ca 0.00 -1.13 -0.09 0.00 0.00 0.00 0.00 51.96 50.74 3kt3 s ALA 304 Cb 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 3kt3 s ALA 304 CO 0.00 0.28 0.13 0.42 0.00 0.00 0.00 175.76 176.59 3kt3 s ILE 305 N -1.19 4.70 0.27 0.00 1.01 -1.26 -5.02 121.20 119.72 3kt3 s ILE 305 Ca 0.03 -0.15 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 3kt3 s ILE 305 Cb -0.10 -3.28 -0.05 0.00 0.01 0.00 0.00 42.46 39.04 3kt3 s ILE 305 CO 0.03 0.23 0.54 -0.36 0.00 0.00 0.00 174.94 175.38 3kt3 s PHE 306 N 1.66 3.47 -1.69 3.97 0.08 -1.26 -1.12 117.98 123.09 3kt3 s PHE 306 Ca 0.06 0.67 0.14 0.00 0.12 0.00 0.00 56.93 57.92 3kt3 s PHE 306 Cb -0.16 -2.12 0.76 0.00 -0.57 0.00 0.00 43.02 40.93 3kt3 s PHE 306 CO 0.07 0.21 1.32 -1.33 -0.10 0.00 0.00 175.22 175.38 3kt3 n MET 307 N -0.74 0.31 0.00 0.44 2.81 -0.87 -1.48 117.12 117.57 3kt3 n MET 307 Ca -0.01 0.09 0.11 0.00 -1.81 0.00 0.00 57.70 56.07 3kt3 n MET 307 Cb 0.53 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.53 3kt3 n MET 307 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3kt3 n THR 308 N -1.16 0.00 -1.79 2.03 -2.24 -1.26 -4.78 114.28 105.08 3kt3 n THR 308 Ca 0.08 -0.09 -0.41 0.00 -2.27 0.00 0.00 64.05 61.35 3kt3 n THR 308 Cb 0.08 0.98 -0.02 0.00 -2.10 0.00 0.00 70.33 69.28 3kt3 n THR 308 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3kt3 s ASP 309 N -2.80 6.39 0.72 3.42 1.01 -0.55 -5.01 116.67 119.86 3kt3 s ASP 309 Ca 0.13 2.92 -0.11 0.00 0.71 0.00 0.00 52.55 56.20 3kt3 s ASP 309 Cb 0.17 -2.63 0.02 0.00 1.01 0.00 0.00 42.92 41.49 3kt3 s ASP 309 CO 0.74 -0.90 1.07 0.42 0.21 0.00 0.00 175.17 176.71 3kt3 s THR 310 N 0.05 3.72 0.25 -1.27 -4.23 -1.26 -4.82 115.64 108.07 3kt3 s THR 310 Ca 0.63 0.56 -0.07 0.00 -1.18 0.00 0.00 61.69 61.63 3kt3 s THR 310 Cb -0.47 -3.37 0.28 0.00 1.34 0.00 0.00 72.50 70.28 3kt3 s THR 310 CO 0.47 -0.73 1.63 -0.65 -0.54 0.00 0.00 174.62 174.80 3kt3 h PRO 311 N -0.78 0.09 -0.86 3.99 0.11 -1.94 -1.54 132.00 131.06 3kt3 h PRO 311 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 3kt3 h PRO 311 Cb 1.23 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 3kt3 h PRO 311 CO 0.59 0.06 0.48 -0.22 -0.21 0.00 0.00 178.00 178.71 3kt3 h LYS 312 N 0.10 1.19 -0.32 1.05 3.64 -2.00 -2.40 116.57 117.83 3kt3 h LYS 312 Ca 0.42 -0.13 -0.16 0.00 -1.27 0.00 0.00 60.65 59.51 3kt3 h LYS 312 Cb 0.73 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 3kt3 h LYS 312 CO -0.67 0.86 -0.44 1.96 -2.27 0.00 0.00 179.45 178.89 3kt3 h GLN 313 N 1.20 0.82 -0.40 1.90 4.20 -1.68 -1.03 115.11 120.12 3kt3 h GLN 313 Ca 0.31 -0.45 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 3kt3 h GLN 313 Cb 0.01 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 3kt3 h GLN 313 CO -0.05 1.09 0.25 0.82 -0.67 0.00 0.00 178.83 180.27 3kt3 h ILE 314 N 0.66 1.12 -0.17 2.54 2.04 -1.18 -0.09 117.51 122.43 3kt3 h ILE 314 Ca 0.04 -0.27 0.03 0.00 1.00 0.00 0.00 64.86 65.66 3kt3 h ILE 314 Cb 1.01 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 3kt3 h ILE 314 CO 0.10 0.12 0.00 -0.61 0.00 0.00 0.00 178.15 177.77 3kt3 h GLN 315 N 0.53 0.06 -0.43 2.37 4.15 -1.29 -1.65 115.11 118.85 3kt3 h GLN 315 Ca 0.15 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.55 3kt3 h GLN 315 Cb -0.02 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 3kt3 h GLN 315 CO -0.03 0.04 0.24 -0.22 -1.93 0.00 0.00 178.83 176.93 3kt3 h LYS 316 N 0.06 0.59 -0.46 1.69 3.64 -0.95 -0.97 116.57 120.17 3kt3 h LYS 316 Ca 0.08 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 3kt3 h LYS 316 Cb 0.09 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 3kt3 h LYS 316 CO -0.13 0.46 0.17 0.87 -2.27 0.00 0.00 179.45 178.56 3kt3 h LYS 317 N 0.56 0.70 -0.13 1.90 1.57 -0.86 0.14 116.57 120.45 3kt3 h LYS 317 Ca 0.15 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3kt3 h LYS 317 Cb 0.04 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3kt3 h LYS 317 CO -0.03 0.65 0.03 0.82 -0.57 0.00 0.00 179.45 180.36 3kt3 h ILE 318 N 0.61 1.19 -0.16 1.86 1.08 -1.17 0.40 117.51 121.32 3kt3 h ILE 318 Ca 0.15 -0.60 -0.02 0.00 -0.39 0.00 0.00 64.86 64.00 3kt3 h ILE 318 Cb 0.22 1.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.31 3kt3 h ILE 318 CO -0.01 0.18 0.04 0.78 -0.69 0.00 0.00 178.15 178.45 3kt3 h ASN 319 N 0.02 0.25 0.10 1.72 2.35 -1.07 -2.61 115.58 116.33 3kt3 h ASN 319 Ca 0.04 -0.23 -0.24 0.00 -0.55 0.00 0.00 56.30 55.32 3kt3 h ASN 319 Cb 0.25 -0.07 0.02 0.00 0.05 0.00 0.00 38.32 38.58 3kt3 h ASN 319 CO -0.00 0.42 -1.00 0.50 -1.65 0.00 0.00 177.43 175.70 3kt3 h LYS 320 N 0.07 0.50 0.00 0.81 3.64 -0.77 -3.42 116.57 117.40 3kt3 h LYS 320 Ca 0.05 -0.67 -0.07 0.00 -1.27 0.00 0.00 60.65 58.69 3kt3 h LYS 320 Cb 0.27 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3kt3 h LYS 320 CO 0.00 1.29 -1.48 0.66 -2.27 0.00 0.00 179.45 177.65 3kt3 n TYR 321 N -3.97 0.00 -1.76 1.91 4.02 0.10 -4.97 117.16 112.49 3kt3 n TYR 321 Ca -0.13 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.34 3kt3 n TYR 321 Cb 0.88 -0.30 -0.03 0.00 -0.02 0.00 0.00 39.34 39.87 3kt3 n TYR 321 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3kt3 s ALA 322 N -2.43 3.64 0.26 -0.72 0.00 -0.98 -4.22 121.76 117.31 3kt3 s ALA 322 Ca -0.04 1.28 -0.30 0.00 0.00 0.00 0.00 51.96 52.91 3kt3 s ALA 322 Cb 0.04 -3.79 -0.10 0.00 0.00 0.00 0.00 23.12 19.27 3kt3 s ALA 322 CO 0.36 -1.41 1.42 0.12 0.00 0.00 0.00 175.76 176.25 3kt3 s PHE 323 N 3.79 3.01 -0.11 0.00 5.36 -0.57 -4.93 117.98 124.52 3kt3 s PHE 323 Ca 0.83 1.08 -0.03 0.00 -0.96 0.00 0.00 56.93 57.85 3kt3 s PHE 323 Cb -0.42 -3.80 -0.03 0.00 -0.34 0.00 0.00 43.02 38.42 3kt3 s PHE 323 CO 0.37 -2.56 0.01 0.45 -1.46 0.00 0.00 175.22 172.04 3kt3 s SER 324 N 0.25 5.31 0.00 6.13 0.15 -1.26 -2.11 113.70 122.16 3kt3 s SER 324 Ca 0.58 0.12 0.25 0.00 0.70 0.00 0.00 55.95 57.60 3kt3 s SER 324 Cb -0.42 -1.63 0.80 0.00 -1.71 0.00 0.00 66.02 63.06 3kt3 s SER 324 CO 0.45 0.32 1.60 0.61 1.20 0.00 0.00 173.24 177.42 3kt3 n GLY 325 N 2.54 0.34 0.00 9.45 0.00 -1.26 -4.90 105.19 111.36 3kt3 n GLY 325 Ca -0.18 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3kt3 n GLY 325 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kt3 n GLY 326 N 1.21 2.53 3.84 -0.02 0.00 -1.26 -0.52 105.19 110.96 3kt3 n GLY 326 Ca 0.18 -2.10 -0.26 0.00 0.00 0.00 0.00 46.02 43.83 3kt3 n GLY 326 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kt3 s GLN 327 N -0.15 3.04 0.09 1.61 -1.52 -1.26 -4.97 119.66 116.50 3kt3 s GLN 327 Ca 0.00 -0.80 -0.14 0.00 -1.95 0.00 0.00 55.36 52.47 3kt3 s GLN 327 Cb 0.00 -2.73 -0.16 0.00 -0.22 0.00 0.00 33.01 29.90 3kt3 s GLN 327 CO 0.00 0.49 1.29 -0.39 -0.25 0.00 0.00 175.29 176.43 3kt3 h VAL 328 N 1.93 1.29 -3.07 1.09 -1.51 -2.00 -3.43 116.25 110.54 3kt3 h VAL 328 Ca -0.48 -1.95 -0.60 0.00 -1.23 0.00 0.00 66.70 62.45 3kt3 h VAL 328 Cb 1.20 2.02 -0.04 0.00 -2.13 0.00 0.00 31.29 32.33 3kt3 h VAL 328 CO 0.64 0.61 -0.29 -0.94 -1.23 0.00 0.00 177.57 176.37 3kt3 s SER 329 N -7.04 6.58 0.15 4.19 1.04 -1.26 -5.01 113.70 112.34 3kt3 s SER 329 Ca -0.11 0.70 -0.19 0.00 0.48 0.00 0.00 55.95 56.83 3kt3 s SER 329 Cb 0.08 -2.14 0.03 0.00 0.10 0.00 0.00 66.02 64.09 3kt3 s SER 329 CO 0.89 0.17 1.68 0.00 0.98 0.00 0.00 173.24 176.96 3kt3 h ALA 330 N 3.61 0.13 -0.16 5.32 0.00 -1.99 -1.47 119.26 124.70 3kt3 h ALA 330 Ca -0.49 0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.58 3kt3 h ALA 330 Cb 1.19 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 19.19 3kt3 h ALA 330 CO 0.67 -0.51 -0.20 -0.44 0.00 0.00 0.00 179.25 178.78 3kt3 h ASP 331 N -0.06 -0.62 0.56 0.00 3.32 -1.98 0.71 116.42 118.35 3kt3 h ASP 331 Ca 0.14 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.23 3kt3 h ASP 331 Cb 0.27 0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 3kt3 h ASP 331 CO -0.31 -0.24 -0.31 0.25 -1.72 0.00 0.00 179.24 176.90 3kt3 h LEU 332 N -0.24 0.00 -0.28 1.55 5.85 -1.94 -2.27 115.31 117.98 3kt3 h LEU 332 Ca 0.11 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.67 3kt3 h LEU 332 Cb 0.40 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 3kt3 h LEU 332 CO -0.30 0.31 -0.45 -0.74 -0.34 0.00 0.00 178.44 176.93 3kt3 h HIS 333 N 0.00 0.99 -0.86 1.25 2.76 -0.35 0.30 115.15 119.24 3kt3 h HIS 333 Ca -0.00 -0.34 0.05 0.00 -2.20 0.00 0.00 60.37 57.87 3kt3 h HIS 333 Cb 0.68 -0.19 -0.05 0.00 1.55 0.00 0.00 27.41 29.40 3kt3 h HIS 333 CO 0.00 1.14 0.56 0.00 -1.30 0.00 0.00 177.93 178.33 3kt3 h ARG 334 N 0.55 1.00 0.03 5.26 2.47 -0.54 0.26 114.38 123.41 3kt3 h ARG 334 Ca 0.02 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 3kt3 h ARG 334 Cb 1.05 -0.23 0.00 0.00 -1.65 0.00 0.00 29.97 29.14 3kt3 h ARG 334 CO 0.10 0.66 -0.02 1.49 0.56 0.00 0.00 179.97 182.77 3kt3 h GLU 335 N 1.03 -0.04 0.00 0.04 4.81 -1.22 -3.39 114.58 115.81 3kt3 h GLU 335 Ca 0.35 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.42 3kt3 h GLU 335 Cb 0.10 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 3kt3 h GLU 335 CO -0.11 0.62 -1.77 1.28 -0.73 0.00 0.00 179.01 178.30 3kt3 n LEU 336 N -4.77 0.44 -0.62 1.64 4.77 0.08 -5.04 117.00 113.51 3kt3 n LEU 336 Ca -0.09 0.19 0.08 0.00 -0.03 0.00 0.00 56.01 56.17 3kt3 n LEU 336 Cb 0.34 0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.56 3kt3 n LEU 336 CO 0.31 0.18 -0.15 0.61 -1.33 0.00 0.00 177.39 177.00 3kt3 n GLY 337 N 1.44 -1.87 3.72 -0.72 0.00 0.91 -4.91 105.19 103.77 3kt3 n GLY 337 Ca -0.14 -1.35 -0.23 0.00 0.00 0.00 0.00 46.02 44.30 3kt3 n GLY 337 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kt3 s GLY 338 N -5.02 1.76 -0.45 -0.02 0.00 0.14 -4.56 107.32 99.17 3kt3 s GLY 338 Ca 0.00 -1.70 -0.10 0.00 0.00 0.00 0.00 44.72 42.92 3kt3 s GLY 338 CO 0.00 -1.69 0.32 0.21 0.00 0.00 0.00 173.10 171.93 3kt3 s ASN 339 N -3.79 5.72 0.52 1.64 2.47 0.32 -3.51 114.94 118.30 3kt3 s ASN 339 Ca 0.35 -1.69 0.29 0.00 0.42 0.00 0.00 52.86 52.23 3kt3 s ASN 339 Cb -0.05 -2.02 1.36 0.00 -1.45 0.00 0.00 41.25 39.09 3kt3 s ASN 339 CO 0.22 -0.63 2.00 1.55 -3.72 0.00 0.00 177.10 176.53 3kt3 h PRO 340 N 8.47 0.00 0.00 0.43 0.13 -1.88 -2.86 132.00 136.29 3kt3 h PRO 340 Ca -0.23 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.90 3kt3 h PRO 340 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3kt3 h PRO 340 CO 0.82 0.12 -0.02 -0.44 -0.23 0.00 0.00 178.00 178.26 3kt3 h ASP 341 N 0.00 0.00 -0.03 1.44 3.32 -1.98 -2.75 116.42 116.42 3kt3 h ASP 341 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3kt3 h ASP 341 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 3kt3 h ASP 341 CO 0.02 0.02 0.00 1.33 -1.72 0.00 0.00 179.24 178.88 3kt3 n VAL 342 N -3.12 0.07 -2.87 -1.35 0.24 -1.10 -4.99 118.33 105.21 3kt3 n VAL 342 Ca 0.00 -0.54 -0.42 0.00 -2.04 0.00 0.00 64.34 61.35 3kt3 n VAL 342 Cb 0.30 1.14 -0.04 0.00 -1.47 0.00 0.00 33.84 33.77 3kt3 n VAL 342 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3kt3 s ASP 343 N -0.78 6.68 0.19 -1.34 -1.08 -1.04 -4.47 116.67 114.84 3kt3 s ASP 343 Ca 0.11 0.63 -0.11 0.00 -0.52 0.00 0.00 52.55 52.66 3kt3 s ASP 343 Cb 0.08 -2.44 0.11 0.00 -1.46 0.00 0.00 42.92 39.21 3kt3 s ASP 343 CO 0.11 -0.74 1.79 0.58 0.52 0.00 0.00 175.17 177.44 3kt3 h VAL 344 N 5.71 1.22 -0.77 1.11 2.07 -1.74 0.14 116.25 123.99 3kt3 h VAL 344 Ca -0.24 -0.58 0.01 0.00 0.82 0.00 0.00 66.70 66.72 3kt3 h VAL 344 Cb 1.09 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 3kt3 h VAL 344 CO 0.94 0.25 0.51 0.00 0.02 0.00 0.00 177.57 179.28 3kt3 h ALA 345 N 1.17 0.98 -0.14 1.67 0.00 -1.93 0.71 119.26 121.72 3kt3 h ALA 345 Ca 0.23 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3kt3 h ALA 345 Cb 0.08 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3kt3 h ALA 345 CO -0.03 0.37 -0.02 -0.92 0.00 0.00 0.00 179.25 178.65 3kt3 h TYR 346 N 1.03 0.29 -0.67 0.00 5.03 -1.75 -2.17 116.97 118.73 3kt3 h TYR 346 Ca 0.29 -0.06 0.11 0.00 2.58 0.00 0.00 58.73 61.65 3kt3 h TYR 346 Cb -0.10 -0.07 -0.08 0.00 1.55 0.00 0.00 36.73 38.03 3kt3 h TYR 346 CO -0.02 0.52 0.26 1.96 -1.32 0.00 0.00 178.16 179.56 3kt3 h GLN 347 N -0.03 0.43 -0.56 1.82 1.08 -0.68 -0.99 115.11 116.18 3kt3 h GLN 347 Ca 0.04 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3kt3 h GLN 347 Cb 0.42 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.72 3kt3 h GLN 347 CO 0.01 0.28 0.29 1.88 -0.95 0.00 0.00 178.83 180.34 3kt3 h TYR 348 N 0.44 0.79 -0.87 2.96 -1.99 -0.81 -2.57 116.97 114.92 3kt3 h TYR 348 Ca 0.35 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 61.05 3kt3 h TYR 348 Cb 0.46 -0.25 -0.04 0.00 2.00 0.00 0.00 36.73 38.90 3kt3 h TYR 348 CO -0.16 0.59 0.54 -0.07 -0.00 0.00 0.00 178.16 179.06 3kt3 h LEU 349 N 0.76 1.03 -1.93 3.88 3.38 -0.70 -1.13 115.31 120.59 3kt3 h LEU 349 Ca 0.20 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3kt3 h LEU 349 Cb 0.08 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 3kt3 h LEU 349 CO -0.03 0.77 -0.07 0.77 0.09 0.00 0.00 178.44 179.97 3kt3 h SER 350 N 1.19 0.00 0.24 -0.43 4.64 -0.80 0.37 113.55 118.76 3kt3 h SER 350 Ca 0.31 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.30 3kt3 h SER 350 Cb -0.08 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.04 3kt3 h SER 350 CO -0.06 0.07 -1.53 -0.26 -0.87 0.00 0.00 176.83 174.18 3kt3 h PHE 351 N 0.00 0.92 -0.01 4.77 -1.00 -1.16 -3.41 116.94 117.05 3kt3 h PHE 351 Ca -0.00 -0.67 0.00 0.00 2.81 0.00 0.00 57.97 60.11 3kt3 h PHE 351 Cb 0.14 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 39.66 3kt3 h PHE 351 CO 0.00 1.59 -0.35 1.19 -1.61 0.00 0.00 178.31 179.13 3kt3 n PHE 352 N -3.70 0.00 -3.86 -0.55 3.72 -0.50 -4.86 117.46 107.72 3kt3 n PHE 352 Ca -0.19 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 56.85 3kt3 n PHE 352 Cb 1.09 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 39.50 3kt3 n PHE 352 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3kt3 s LYS 353 N -1.85 3.26 -0.98 -1.08 2.47 0.13 -4.96 119.74 116.73 3kt3 s LYS 353 Ca 0.11 -0.72 -0.15 0.00 -1.56 0.00 0.00 55.97 53.66 3kt3 s LYS 353 Cb 0.12 -3.13 0.19 0.00 -1.46 0.00 0.00 37.83 33.54 3kt3 s LYS 353 CO 0.40 -0.29 1.07 0.34 0.16 0.00 0.00 175.35 177.03 3kt3 s ASP 354 N 1.48 6.86 -0.37 1.43 2.15 -1.26 -4.76 116.67 122.20 3kt3 s ASP 354 Ca 0.04 -2.65 0.00 0.00 0.43 0.00 0.00 52.55 50.37 3kt3 s ASP 354 Cb -0.15 -2.31 0.18 0.00 -0.30 0.00 0.00 42.92 40.34 3kt3 s ASP 354 CO -0.01 -0.74 0.82 -0.62 -0.17 0.00 0.00 175.17 174.45 3kt3 s ASP 355 N 2.69 -0.98 0.27 -0.34 -1.08 -1.26 -5.05 116.67 110.92 3kt3 s ASP 355 Ca 0.30 -0.53 -0.03 0.00 -0.52 0.00 0.00 52.55 51.77 3kt3 s ASP 355 Cb -0.07 1.26 0.40 0.00 -1.46 0.00 0.00 42.92 43.05 3kt3 s ASP 355 CO -0.07 -0.11 1.89 0.44 0.52 0.00 0.00 175.17 177.84 3kt3 h ASP 356 N 6.20 1.05 0.27 -0.34 3.32 -1.99 -1.23 116.42 123.70 3kt3 h ASP 356 Ca 0.01 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 3kt3 h ASP 356 Cb 1.20 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.53 3kt3 h ASP 356 CO 0.02 0.68 -0.13 0.58 -1.72 0.00 0.00 179.24 178.67 3kt3 h VAL 357 N 1.20 0.78 -0.64 -1.35 2.07 -1.99 -0.93 116.25 115.39 3kt3 h VAL 357 Ca 0.42 -0.38 0.10 0.00 0.82 0.00 0.00 66.70 67.66 3kt3 h VAL 357 Cb 0.13 1.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.82 3kt3 h VAL 357 CO -0.16 0.08 0.25 0.15 0.02 0.00 0.00 177.57 177.91 3kt3 h PHE 358 N -0.56 0.44 -0.28 1.57 3.04 -1.95 -1.43 116.94 117.77 3kt3 h PHE 358 Ca -0.04 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.87 3kt3 h PHE 358 Cb 0.41 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 38.81 3kt3 h PHE 358 CO -0.01 0.11 -0.13 -0.07 -2.02 0.00 0.00 178.31 176.19 3kt3 h LEU 359 N 0.43 0.47 -0.07 0.59 4.07 -1.06 -1.52 115.31 118.23 3kt3 h LEU 359 Ca 0.33 -0.12 -0.13 0.00 0.08 0.00 0.00 57.88 58.04 3kt3 h LEU 359 Cb 0.41 -0.12 0.01 0.00 1.08 0.00 0.00 40.66 42.03 3kt3 h LEU 359 CO -0.32 0.63 -0.45 0.50 -1.08 0.00 0.00 178.44 177.72 3kt3 h LYS 360 N 0.44 0.43 -0.49 1.13 3.64 -0.70 -2.44 116.57 118.58 3kt3 h LYS 360 Ca 0.08 -0.37 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 3kt3 h LYS 360 Cb 0.50 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 3kt3 h LYS 360 CO 0.03 1.01 0.32 0.93 -2.27 0.00 0.00 179.45 179.47 3kt3 h GLU 361 N -0.03 0.65 -0.41 1.90 5.08 -1.16 -0.71 114.58 119.91 3kt3 h GLU 361 Ca -0.04 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3kt3 h GLU 361 Cb 1.11 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 3kt3 h GLU 361 CO 0.09 0.45 0.21 0.00 -1.00 0.00 0.00 179.01 178.76 3kt3 h TYR 363 N 0.42 0.37 -0.03 0.00 3.20 -0.91 -0.80 116.97 119.22 3kt3 h TYR 363 Ca 0.17 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.99 3kt3 h TYR 363 Cb 0.08 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.26 3kt3 h TYR 363 CO -0.10 0.15 -0.29 -0.44 -1.64 0.00 0.00 178.16 175.85 3kt3 h ASP 364 N 0.40 0.31 0.51 -2.11 3.32 -0.87 -2.77 116.42 115.21 3kt3 h ASP 364 Ca 0.22 -0.70 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 3kt3 h ASP 364 Cb 0.19 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 3kt3 h ASP 364 CO -0.19 0.96 -0.08 0.11 -1.72 0.00 0.00 179.24 178.32 3kt3 h LYS 365 N -0.32 0.00 0.08 3.56 6.56 -0.51 -0.84 116.57 125.09 3kt3 h LYS 365 Ca -0.03 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.40 3kt3 h LYS 365 Cb 0.98 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.66 3kt3 h LYS 365 CO 0.06 0.08 -0.69 -0.92 -2.06 0.00 0.00 179.45 175.92 3kt3 h TYR 366 N 0.00 0.54 -0.86 -1.35 3.20 -1.18 0.22 116.97 117.54 3kt3 h TYR 366 Ca -0.00 -0.35 0.02 0.00 3.14 0.00 0.00 58.73 61.54 3kt3 h TYR 366 Cb 0.35 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.54 3kt3 h TYR 366 CO 0.00 1.22 0.57 -0.22 -1.64 0.00 0.00 178.16 178.09 3kt3 h LYS 367 N -0.30 1.08 0.00 1.82 3.64 -1.15 0.41 116.57 122.06 3kt3 h LYS 367 Ca -0.11 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 3kt3 h LYS 367 Cb 1.47 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 3kt3 h LYS 367 CO 0.13 0.71 -0.22 -1.13 -2.27 0.00 0.00 179.45 176.68 3kt3 n SER 368 N -4.43 0.33 0.00 4.20 3.41 -0.36 -4.13 113.62 112.64 3kt3 n SER 368 Ca 0.11 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 3kt3 n SER 368 Cb 0.07 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 3kt3 n SER 368 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kt3 n GLY 369 N 1.46 0.78 0.14 5.00 0.00 -0.84 -4.68 105.19 107.04 3kt3 n GLY 369 Ca 0.06 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.09 3kt3 n GLY 369 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kt3 h GLU 370 N 3.16 0.00 -4.96 1.61 5.08 -1.09 -3.36 114.58 115.02 3kt3 h GLU 370 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 3kt3 h GLU 370 Cb 0.00 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.09 3kt3 h GLU 370 CO 0.00 0.58 -0.47 -1.17 -1.00 0.00 0.00 179.01 176.95 3kt3 s LEU 371 N -6.76 4.03 0.57 1.33 0.20 0.52 -4.99 118.68 113.58 3kt3 s LEU 371 Ca 0.02 0.05 -0.14 0.00 0.69 0.00 0.00 54.13 54.75 3kt3 s LEU 371 Cb 0.09 -2.18 -0.05 0.00 -0.43 0.00 0.00 46.19 43.62 3kt3 s LEU 371 CO 0.74 -0.07 1.01 -0.76 -0.29 0.00 0.00 176.35 176.99 3kt3 s LEU 372 N 1.78 3.43 0.18 -0.68 1.43 -1.26 -4.50 118.68 119.05 3kt3 s LEU 372 Ca 0.09 1.54 -0.13 0.00 -1.03 0.00 0.00 54.13 54.59 3kt3 s LEU 372 Cb -0.16 -4.50 0.12 0.00 0.03 0.00 0.00 46.19 41.69 3kt3 s LEU 372 CO 0.10 -0.80 1.81 -1.28 0.23 0.00 0.00 176.35 176.41 3kt3 h SER 373 N 0.29 0.50 -0.70 2.29 0.87 -1.96 0.18 113.55 115.02 3kt3 h SER 373 Ca -0.46 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.12 3kt3 h SER 373 Cb 1.19 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 63.02 3kt3 h SER 373 CO 0.61 0.35 0.46 1.23 -0.53 0.00 0.00 176.83 178.95 3kt3 h GLY 374 N 0.62 0.99 1.00 5.77 0.00 -1.94 0.15 103.07 109.67 3kt3 h GLY 374 Ca 0.22 -0.38 -0.16 0.00 0.00 0.00 0.00 47.33 47.01 3kt3 h GLY 374 CO -0.11 0.37 -0.53 0.83 0.00 0.00 0.00 176.54 177.10 3kt3 h GLU 375 N 0.95 0.66 -0.33 4.80 5.08 -1.83 -0.92 114.58 123.00 3kt3 h GLU 375 Ca 0.26 -0.48 0.07 0.00 -1.00 0.00 0.00 59.36 58.20 3kt3 h GLU 375 Cb -0.10 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.17 3kt3 h GLU 375 CO -0.05 1.10 -0.09 1.98 -1.00 0.00 0.00 179.01 180.95 3kt3 h MET 376 N 0.35 -0.01 -0.77 2.33 4.05 -0.60 -1.52 114.93 118.76 3kt3 h MET 376 Ca -0.02 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.44 3kt3 h MET 376 Cb 1.15 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 31.91 3kt3 h MET 376 CO 0.11 -0.01 0.49 0.87 0.23 0.00 0.00 176.91 178.61 3kt3 h LYS 377 N -0.01 0.92 -0.98 0.39 1.57 -0.89 -1.69 116.57 115.89 3kt3 h LYS 377 Ca 0.16 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3kt3 h LYS 377 Cb 0.25 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 3kt3 h LYS 377 CO -0.34 0.61 0.65 -0.22 -0.57 0.00 0.00 179.45 179.58 3kt3 h LYS 378 N 0.95 1.28 -0.31 3.15 3.64 -0.60 0.10 116.57 124.78 3kt3 h LYS 378 Ca 0.31 -0.08 -0.17 0.00 -1.27 0.00 0.00 60.65 59.44 3kt3 h LYS 378 Cb 0.02 -0.29 -0.00 0.00 -0.41 0.00 0.00 32.23 31.55 3kt3 h LYS 378 CO -0.11 0.85 -0.48 -0.07 -2.27 0.00 0.00 179.45 177.37 3kt3 h LEU 379 N 1.32 0.96 -0.13 5.20 3.38 -0.89 -2.37 115.31 122.78 3kt3 h LEU 379 Ca 0.36 -0.51 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3kt3 h LEU 379 Cb -0.15 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.32 3kt3 h LEU 379 CO -0.08 1.29 0.07 0.00 0.09 0.00 0.00 178.44 179.81 3kt3 h ILE 381 N 0.13 0.60 -0.47 0.00 2.04 -0.77 -0.13 117.51 118.90 3kt3 h ILE 381 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3kt3 h ILE 381 Cb 0.05 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 3kt3 h ILE 381 CO -0.01 0.00 0.31 -0.33 0.00 0.00 0.00 178.15 178.12 3kt3 h GLU 382 N -0.09 0.63 0.08 2.37 5.08 -1.34 0.18 114.58 121.48 3kt3 h GLU 382 Ca 0.14 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3kt3 h GLU 382 Cb 0.31 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3kt3 h GLU 382 CO -0.33 0.42 -0.04 1.15 -1.00 0.00 0.00 179.01 179.21 3kt3 h THR 383 N 0.64 0.94 -0.58 1.13 2.02 -1.13 -2.24 112.91 113.69 3kt3 h THR 383 Ca 0.17 -0.06 -0.09 0.00 0.77 0.00 0.00 66.41 67.20 3kt3 h THR 383 Cb -0.07 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3kt3 h THR 383 CO -0.04 0.02 -0.01 -0.07 0.37 0.00 0.00 175.52 175.79 3kt3 h LEU 384 N -0.13 1.00 -0.78 2.58 3.38 -0.81 -2.74 115.31 117.82 3kt3 h LEU 384 Ca -0.01 -0.28 0.03 0.00 0.09 0.00 0.00 57.88 57.71 3kt3 h LEU 384 Cb 0.10 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 3kt3 h LEU 384 CO 0.02 1.06 0.49 1.56 0.09 0.00 0.00 178.44 181.66 3kt3 h GLN 385 N 0.93 0.93 -0.57 1.13 4.20 -0.59 -1.00 115.11 120.15 3kt3 h GLN 385 Ca 0.17 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 3kt3 h GLN 385 Cb 0.55 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 3kt3 h GLN 385 CO 0.03 0.62 0.23 0.93 -0.67 0.00 0.00 178.83 179.97 3kt3 h GLU 386 N 0.96 0.85 0.11 1.46 5.08 -1.19 0.43 114.58 122.28 3kt3 h GLU 386 Ca 0.31 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 3kt3 h GLU 386 Cb 0.01 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.12 3kt3 h GLU 386 CO -0.11 0.74 -0.05 0.35 -1.00 0.00 0.00 179.01 178.93 3kt3 h PHE 387 N 0.78 -0.13 -0.66 4.33 3.57 -1.24 -2.21 116.94 121.38 3kt3 h PHE 387 Ca 0.19 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.64 3kt3 h PHE 387 Cb 0.20 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 3kt3 h PHE 387 CO 0.01 0.15 0.23 0.28 -2.23 0.00 0.00 178.31 176.75 3kt3 h VAL 388 N -0.42 1.24 -0.32 1.41 2.07 -1.14 -1.55 116.25 117.55 3kt3 h VAL 388 Ca -0.01 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 3kt3 h VAL 388 Cb 0.34 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 3kt3 h VAL 388 CO 0.02 0.31 0.15 0.50 0.02 0.00 0.00 177.57 178.57 3kt3 h LYS 389 N 0.97 0.46 -0.74 1.57 3.64 -0.89 0.38 116.57 121.95 3kt3 h LYS 389 Ca 0.22 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 3kt3 h LYS 389 Cb 0.24 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 3kt3 h LYS 389 CO -0.01 0.44 0.30 0.00 -2.27 0.00 0.00 179.45 177.91 3kt3 h ALA 390 N 1.00 1.15 0.46 5.00 0.00 -1.20 -1.48 119.26 124.19 3kt3 h ALA 390 Ca 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3kt3 h ALA 390 Cb 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3kt3 h ALA 390 CO -0.01 0.62 -0.22 0.35 0.00 0.00 0.00 179.25 179.99 3kt3 h PHE 391 N 1.06 -0.57 -0.29 0.00 3.57 -1.02 -2.64 116.94 117.05 3kt3 h PHE 391 Ca 0.25 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 3kt3 h PHE 391 Cb 0.18 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 3kt3 h PHE 391 CO 0.02 -0.33 0.07 1.96 -2.23 0.00 0.00 178.31 177.80 3kt3 h GLN 392 N -0.66 0.42 -0.60 1.11 4.20 -0.80 0.41 115.11 119.19 3kt3 h GLN 392 Ca -0.06 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.52 3kt3 h GLN 392 Cb 0.50 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 3kt3 h GLN 392 CO 0.10 0.39 0.10 0.93 -0.67 0.00 0.00 178.83 179.69 3kt3 h GLU 393 N 0.42 0.98 -0.17 1.46 5.08 -1.21 -1.80 114.58 119.34 3kt3 h GLU 393 Ca 0.10 -0.26 -0.16 0.00 -1.00 0.00 0.00 59.36 58.04 3kt3 h GLU 393 Cb 0.16 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3kt3 h GLU 393 CO -0.00 0.92 -0.53 0.00 -1.00 0.00 0.00 179.01 178.40 3kt3 h ARG 394 N 0.89 0.66 -0.78 2.33 3.08 -1.05 -3.30 114.38 116.20 3kt3 h ARG 394 Ca 0.18 -0.48 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 3kt3 h ARG 394 Cb 0.41 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 3kt3 h ARG 394 CO 0.01 1.10 0.46 -0.09 -1.07 0.00 0.00 179.97 180.39 3kt3 h ARG 395 N 0.34 1.06 0.00 0.04 2.43 -0.84 -2.04 114.38 115.37 3kt3 h ARG 395 Ca -0.02 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3kt3 h ARG 395 Cb 1.16 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 3kt3 h ARG 395 CO 0.11 0.75 0.00 0.00 -1.51 0.00 0.00 179.97 179.32 3kt3 h ALA 396 N 1.43 1.00 -0.01 2.80 0.00 -1.40 -2.48 119.26 120.60 3kt3 h ALA 396 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3kt3 h ALA 396 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3kt3 h ALA 396 CO -0.05 0.00 -0.34 1.04 0.00 0.00 0.00 179.25 179.90 3kt3 n GLN 397 N -3.00 1.17 -2.49 0.00 1.13 -0.77 -4.85 117.38 108.56 3kt3 n GLN 397 Ca -0.01 -0.86 -0.43 0.00 -1.94 0.00 0.00 57.00 53.76 3kt3 n GLN 397 Cb 0.20 -1.48 -0.02 0.00 0.11 0.00 0.00 30.24 29.05 3kt3 n GLN 397 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3kt3 s VAL 398 N -2.43 4.09 0.61 5.09 1.01 -0.94 -5.01 120.40 122.83 3kt3 s VAL 398 Ca 0.22 1.13 0.06 0.00 0.00 0.00 0.00 61.98 63.39 3kt3 s VAL 398 Cb 0.19 -4.41 0.10 0.00 0.00 0.00 0.00 36.38 32.25 3kt3 s VAL 398 CO 0.52 -0.86 0.85 1.51 0.00 0.00 0.00 175.10 177.12 3kt3 s ASP 399 N 3.04 4.88 0.30 3.32 1.47 -1.26 -4.95 116.67 123.47 3kt3 s ASP 399 Ca 0.54 -0.67 -0.02 0.00 1.18 0.00 0.00 52.55 53.58 3kt3 s ASP 399 Cb -0.10 0.15 0.45 0.00 -0.34 0.00 0.00 42.92 43.07 3kt3 s ASP 399 CO 0.31 -1.48 1.95 -0.33 0.68 0.00 0.00 175.17 176.30 3kt3 h GLU 400 N -0.03 1.04 -0.61 2.11 4.39 -1.99 -1.77 114.58 117.71 3kt3 h GLU 400 Ca -0.32 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.28 3kt3 h GLU 400 Cb 1.28 -0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 3kt3 h GLU 400 CO 0.41 0.71 0.30 1.49 -1.16 0.00 0.00 179.01 180.76 3kt3 h GLU 401 N 1.06 0.88 -0.54 2.33 4.81 -1.99 -1.57 114.58 119.56 3kt3 h GLU 401 Ca 0.28 -0.12 -0.08 0.00 -0.13 0.00 0.00 59.36 59.31 3kt3 h GLU 401 Cb -0.08 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 3kt3 h GLU 401 CO -0.06 0.70 0.02 1.15 -0.73 0.00 0.00 179.01 180.09 3kt3 h THR 402 N 0.84 1.26 -0.41 0.32 2.02 -1.87 -2.34 112.91 112.73 3kt3 h THR 402 Ca 0.21 -1.08 0.08 0.00 0.77 0.00 0.00 66.41 66.39 3kt3 h THR 402 Cb 0.10 0.89 -0.08 0.00 -1.74 0.00 0.00 68.15 67.33 3kt3 h THR 402 CO -0.03 0.39 -0.07 -0.07 0.37 0.00 0.00 175.52 176.10 3kt3 h LEU 403 N 0.82 -0.32 -1.35 2.58 3.38 -1.01 -2.48 115.31 116.93 3kt3 h LEU 403 Ca 0.16 0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.18 3kt3 h LEU 403 Cb 0.51 0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 3kt3 h LEU 403 CO 0.02 -0.11 -0.21 0.44 0.09 0.00 0.00 178.44 178.68 3kt3 h ASP 404 N 0.03 0.17 -0.15 -0.43 3.32 -1.11 -1.18 116.42 117.06 3kt3 h ASP 404 Ca 0.20 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3kt3 h ASP 404 Cb 0.30 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 3kt3 h ASP 404 CO -0.40 0.39 0.10 0.11 -1.72 0.00 0.00 179.24 177.72 3kt3 h LYS 405 N 0.16 0.20 0.08 3.56 1.57 -0.95 0.11 116.57 121.30 3kt3 h LYS 405 Ca 0.03 -0.01 -0.33 0.00 -1.87 0.00 0.00 60.65 58.47 3kt3 h LYS 405 Cb 0.46 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 3kt3 h LYS 405 CO 0.03 0.13 -1.78 0.74 -0.57 0.00 0.00 179.45 178.00 3kt3 h PHE 406 N 0.21 0.31 0.00 -1.35 0.04 -1.28 -3.42 116.94 111.44 3kt3 h PHE 406 Ca 0.06 -0.23 -0.37 0.00 2.80 0.00 0.00 57.97 60.23 3kt3 h PHE 406 Cb -0.02 -0.01 -0.07 0.00 2.20 0.00 0.00 35.95 38.05 3kt3 h PHE 406 CO -0.00 1.42 -2.35 -1.33 -0.60 0.00 0.00 178.31 175.45 3kt3 n MET 407 N -3.32 0.69 -2.25 1.51 2.81 -0.52 -1.17 117.12 114.87 3kt3 n MET 407 Ca -0.23 0.01 -0.42 0.00 -1.81 0.00 0.00 57.70 55.25 3kt3 n MET 407 Cb 1.05 -1.54 -0.03 0.00 -0.71 0.00 0.00 33.22 31.99 3kt3 n MET 407 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3kt3 s VAL 408 N -2.50 3.66 0.22 2.03 1.01 0.01 -4.78 120.40 120.05 3kt3 s VAL 408 Ca -0.10 1.12 -0.32 0.00 0.00 0.00 0.00 61.98 62.68 3kt3 s VAL 408 Cb 0.06 -3.72 -0.14 0.00 0.00 0.00 0.00 36.38 32.58 3kt3 s VAL 408 CO 0.82 0.04 1.29 -2.65 0.00 0.00 0.00 175.10 174.60 3kt3 n PRO 409 N 4.70 1.65 -3.68 2.72 -0.02 -1.26 -4.87 135.00 134.25 3kt3 n PRO 409 Ca 0.12 0.59 -0.14 0.00 -2.02 0.00 0.00 63.50 62.05 3kt3 n PRO 409 Cb 0.44 -2.17 -0.07 0.00 -0.02 0.00 0.00 33.50 31.68 3kt3 n PRO 409 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3kt3 s HIS 410 N -0.16 -0.29 -0.14 6.00 -3.43 -1.26 -5.07 115.29 110.94 3kt3 s HIS 410 Ca 0.70 0.36 -0.29 0.00 -0.80 0.00 0.00 55.06 55.02 3kt3 s HIS 410 Cb -0.73 0.20 -0.02 0.00 -1.43 0.00 0.00 32.58 30.59 3kt3 s HIS 410 CO 0.51 -0.51 1.33 0.21 -2.00 0.00 0.00 174.74 174.29 3kt3 s LYS 411 N -1.88 4.22 0.33 -0.38 2.47 -1.20 -4.36 119.74 118.95 3kt3 s LYS 411 Ca -0.09 1.76 -0.26 0.00 -1.56 0.00 0.00 55.97 55.81 3kt3 s LYS 411 Cb -0.02 -3.80 -0.09 0.00 -1.46 0.00 0.00 37.83 32.45 3kt3 s LYS 411 CO 0.02 -0.73 1.01 -0.51 0.16 0.00 0.00 175.35 175.30 3kt3 s LEU 412 N 3.58 4.35 -0.14 5.43 1.43 -0.49 -4.98 118.68 127.86 3kt3 s LEU 412 Ca 0.58 1.99 0.02 0.00 -1.03 0.00 0.00 54.13 55.70 3kt3 s LEU 412 Cb -0.24 -3.95 0.01 0.00 0.03 0.00 0.00 46.19 42.04 3kt3 s LEU 412 CO 0.17 -0.19 -0.20 -0.69 0.23 0.00 0.00 176.35 175.67 3kt3 s VAL 413 N -1.50 2.26 0.25 -1.59 1.01 -0.61 -4.95 120.40 115.27 3kt3 s VAL 413 Ca 0.50 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.57 3kt3 s VAL 413 Cb -0.23 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.23 3kt3 s VAL 413 CO 0.29 0.54 0.32 -2.67 0.00 0.00 0.00 175.10 173.58 3kt3 n TRP 414 N 4.02 -1.04 -1.06 5.22 2.14 -1.26 -4.16 117.44 121.29 3kt3 n TRP 414 Ca -0.20 -1.74 -0.02 0.00 2.07 0.00 0.00 57.50 57.61 3kt3 n TRP 414 Cb 0.52 0.36 -0.01 0.00 -0.81 0.00 0.00 31.31 31.37 3kt3 n TRP 414 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3kt3 n GLY 415 N -0.42 0.46 2.00 -1.67 0.00 -1.11 -4.90 105.19 99.55 3kt3 n GLY 415 Ca 0.01 -0.14 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 3kt3 n GLY 415 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kt3 n GLU 416 N -1.54 2.67 -4.10 1.61 1.02 -1.26 -4.93 120.64 114.12 3kt3 n GLU 416 Ca -0.02 -2.69 -0.11 0.00 -0.02 0.00 0.00 57.16 54.32 3kt3 n GLU 416 Cb 0.24 -2.08 -0.11 0.00 -0.02 0.00 0.00 31.44 29.48 3kt3 n GLU 416 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3kt3 s LYS 417 N -2.83 0.64 0.06 3.49 -2.85 -1.26 -5.11 119.74 111.88 3kt3 s LYS 417 Ca 0.50 -1.04 -0.30 0.00 -1.00 0.00 0.00 55.97 54.12 3kt3 s LYS 417 Cb 0.41 -0.13 -0.09 0.00 -2.06 0.00 0.00 37.83 35.96 3kt3 s LYS 417 CO 0.11 -0.01 1.89 -1.21 0.10 0.00 0.00 175.35 176.22 3kt3 s GLU 418 N -2.84 4.14 0.43 1.78 8.01 -1.26 -4.98 118.70 123.99 3kt3 s GLU 418 Ca 0.01 2.57 -0.23 0.00 0.01 0.00 0.00 54.97 57.33 3kt3 s GLU 418 Cb -0.01 -3.93 -0.08 0.00 -4.31 0.00 0.00 34.13 25.80 3kt3 s GLU 418 CO -0.04 -0.90 1.07 1.03 0.01 0.00 0.00 175.26 176.44 3kt3 s ARG 419 N 3.75 3.99 0.17 1.61 0.52 -1.26 -4.97 118.95 122.76 3kt3 s ARG 419 Ca 0.84 1.53 0.08 0.00 -0.52 0.00 0.00 55.73 57.67 3kt3 s ARG 419 Cb -0.43 -2.40 -0.01 0.00 0.52 0.00 0.00 34.95 32.62 3kt3 s ARG 419 CO 0.39 -0.30 1.39 -0.07 0.02 0.00 0.00 175.30 176.73 3kt3 h LEU 420 N 2.17 0.00 -7.68 2.53 4.07 -1.94 -3.43 115.31 111.03 3kt3 h LEU 420 Ca -0.49 0.00 -0.47 0.00 0.08 0.00 0.00 57.88 57.01 3kt3 h LEU 420 Cb 1.22 0.00 -0.36 0.00 1.08 0.00 0.00 40.66 42.60 3kt3 h LEU 420 CO 0.61 0.87 -0.78 0.54 -1.08 0.00 0.00 178.44 178.59 3kt3 s VAL 421 N -3.02 0.71 0.68 1.22 0.11 -1.26 -4.96 120.40 113.87 3kt3 s VAL 421 Ca 0.00 -0.14 -0.16 0.00 -2.93 0.00 0.00 61.98 58.76 3kt3 s VAL 421 Cb 0.11 -0.75 0.01 0.00 -1.53 0.00 0.00 36.38 34.21 3kt3 s VAL 421 CO 0.80 0.29 1.16 0.00 -3.33 0.00 0.00 175.10 174.02 3kt3 s ALA 422 N 1.44 2.35 0.95 1.54 0.00 -1.26 -4.99 121.76 121.78 3kt3 s ALA 422 Ca -0.02 0.73 -0.12 0.00 0.00 0.00 0.00 51.96 52.55 3kt3 s ALA 422 Cb -0.13 -3.39 0.09 0.00 0.00 0.00 0.00 23.12 19.69 3kt3 s ALA 422 CO -0.04 -1.48 0.71 -2.30 0.00 0.00 0.00 175.76 172.65 3kt3 n PRO 423 N -2.41 -0.48 -3.40 0.00 -0.02 -1.26 -4.98 135.00 122.44 3kt3 n PRO 423 Ca 0.12 -0.09 -0.27 0.00 -2.02 0.00 0.00 63.50 61.23 3kt3 n PRO 423 Cb 0.51 -2.07 -0.10 0.00 -0.02 0.00 0.00 33.50 31.82 3kt3 n PRO 423 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3kt3 s LYS 424 N -4.05 0.82 0.00 -0.52 1.02 0.13 -4.94 119.74 112.20 3kt3 s LYS 424 Ca 0.61 -1.93 0.31 0.00 0.02 0.00 0.00 55.97 54.97 3kt3 s LYS 424 Cb -0.22 -1.38 1.82 0.00 -0.52 0.00 0.00 37.83 37.54 3kt3 s LYS 424 CO 0.64 -1.35 2.15 -2.30 -0.92 0.00 0.00 175.35 173.57