#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kt3 s LYS 18 N 0.00 4.60 -0.26 3.23 3.01 -1.26 -5.05 119.74 124.01 3kt3 s LYS 18 Ca 0.00 1.34 -0.10 0.00 -1.01 0.00 0.00 55.97 56.20 3kt3 s LYS 18 Cb 0.00 -2.84 -0.04 0.00 -1.01 0.00 0.00 37.83 33.94 3kt3 s LYS 18 CO 0.00 0.30 0.15 0.45 0.51 0.00 0.00 175.35 176.76 3kt3 s SER 19 N -1.58 5.79 -0.14 2.83 0.15 -1.26 -4.96 113.70 114.53 3kt3 s SER 19 Ca 0.49 -0.04 0.17 0.00 0.70 0.00 0.00 55.95 57.27 3kt3 s SER 19 Cb -0.19 -2.06 0.73 0.00 -1.71 0.00 0.00 66.02 62.79 3kt3 s SER 19 CO 0.24 -0.03 1.64 0.41 1.20 0.00 0.00 173.24 176.71 3kt3 n THR 20 N 4.89 2.03 0.32 6.45 -1.04 -1.26 -4.29 114.28 121.38 3kt3 n THR 20 Ca -0.15 -1.27 0.06 0.00 -2.04 0.00 0.00 64.05 60.65 3kt3 n THR 20 Cb 0.52 0.04 -0.08 0.00 -1.82 0.00 0.00 70.33 68.99 3kt3 n THR 20 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 3kt3 n ASP 21 N 0.96 1.26 -4.45 8.00 -0.08 -1.26 -5.01 116.55 115.96 3kt3 n ASP 21 Ca 0.26 -0.45 -0.53 0.00 -1.51 0.00 0.00 54.79 52.55 3kt3 n ASP 21 Cb 0.95 1.23 -0.08 0.00 2.34 0.00 0.00 41.12 45.56 3kt3 n ASP 21 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 3kt3 n VAL 22 N -1.55 0.18 -3.78 5.18 0.31 -1.26 -4.68 118.33 112.73 3kt3 n VAL 22 Ca 0.00 -0.18 -0.13 0.00 -0.01 0.00 0.00 64.34 64.03 3kt3 n VAL 22 Cb 0.24 -1.37 -0.09 0.00 -0.91 0.00 0.00 33.84 31.71 3kt3 n VAL 22 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3kt3 s LYS 23 N 5.72 0.59 0.54 5.55 -2.85 -1.06 -4.98 119.74 123.25 3kt3 s LYS 23 Ca 1.09 -0.13 -0.17 0.00 -1.00 0.00 0.00 55.97 55.77 3kt3 s LYS 23 Cb -1.01 0.26 -0.06 0.00 -2.06 0.00 0.00 37.83 34.96 3kt3 s LYS 23 CO 0.55 -0.15 1.01 -2.00 0.10 0.00 0.00 175.35 174.86 3kt3 s GLU 24 N -1.11 3.72 0.61 1.78 2.56 -1.26 -0.71 118.70 124.30 3kt3 s GLU 24 Ca -0.12 1.08 -0.19 0.00 0.00 0.00 0.00 54.97 55.74 3kt3 s GLU 24 Cb -0.05 -2.10 -0.03 0.00 2.00 0.00 0.00 34.13 33.96 3kt3 s GLU 24 CO 0.03 -0.47 1.26 1.14 -0.56 0.00 0.00 175.26 176.66 3kt3 s GLN 25 N -3.99 2.80 -0.18 4.30 -2.07 -1.26 -4.55 119.66 114.71 3kt3 s GLN 25 Ca 0.61 1.97 -0.00 0.00 -1.82 0.00 0.00 55.36 56.12 3kt3 s GLN 25 Cb -0.12 -1.92 0.01 0.00 -1.09 0.00 0.00 33.01 29.88 3kt3 s GLN 25 CO 0.32 -1.38 -0.16 0.08 -1.32 0.00 0.00 175.29 172.83 3kt3 s VAL 26 N -1.47 2.48 -0.12 3.63 1.01 -0.06 -4.90 120.40 120.98 3kt3 s VAL 26 Ca 0.79 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.97 3kt3 s VAL 26 Cb -0.35 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 33.99 3kt3 s VAL 26 CO 0.37 0.51 -0.14 -0.69 0.00 0.00 0.00 175.10 175.16 3kt3 s VAL 27 N 1.15 1.44 0.02 2.92 1.01 -1.26 -1.46 120.40 124.22 3kt3 s VAL 27 Ca 0.01 -0.59 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 3kt3 s VAL 27 Cb -0.14 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 34.91 3kt3 s VAL 27 CO -0.06 0.43 0.22 -0.89 0.00 0.00 0.00 175.10 174.80 3kt3 s THR 28 N 1.18 0.09 -0.84 3.92 2.01 0.23 -5.00 115.64 117.23 3kt3 s THR 28 Ca -0.03 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.26 3kt3 s THR 28 Cb -0.14 -0.72 0.00 0.00 0.01 0.00 0.00 72.50 71.65 3kt3 s THR 28 CO -0.04 -0.39 0.82 -2.65 -0.69 0.00 0.00 174.62 171.66 3kt3 n PRO 29 N 1.01 0.00 0.00 4.92 -0.02 -1.15 -2.85 135.00 136.91 3kt3 n PRO 29 Ca -0.20 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3kt3 n PRO 29 Cb 0.57 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 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 -1.32 0.00 -4.20 6.00 8.01 -1.26 -4.98 117.44 119.69 3kt3 n TRP 30 Ca 0.00 0.00 -0.16 0.00 -1.31 0.00 0.00 57.50 56.03 3kt3 n TRP 30 Cb 0.11 0.00 -0.13 0.00 -2.01 0.00 0.00 31.31 29.28 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 -1.54 0.99 -0.07 -0.99 1.11 -1.13 -5.12 116.67 109.91 3kt3 s ASP 31 Ca 0.00 -0.33 -0.03 0.00 0.18 0.00 0.00 52.55 52.37 3kt3 s ASP 31 Cb 0.00 -0.05 0.04 0.00 1.07 0.00 0.00 42.92 43.98 3kt3 s ASP 31 CO 0.00 -0.02 0.12 0.54 1.18 0.00 0.00 175.17 176.99 3kt3 s VAL 32 N -0.70 -0.20 0.00 -1.27 0.11 -1.25 -0.60 120.40 116.50 3kt3 s VAL 32 Ca -0.02 0.35 -0.02 0.00 -2.93 0.00 0.00 61.98 59.37 3kt3 s VAL 32 Cb -0.06 -0.26 -0.01 0.00 -1.53 0.00 0.00 36.38 34.52 3kt3 s VAL 32 CO 0.00 0.13 0.03 -1.83 -3.33 0.00 0.00 175.10 170.10 3kt3 s GLU 33 N 2.24 0.26 0.74 1.54 -1.05 -0.53 -4.55 118.70 117.34 3kt3 s GLU 33 Ca 0.04 -0.35 -0.11 0.00 -0.15 0.00 0.00 54.97 54.40 3kt3 s GLU 33 Cb -0.12 0.10 0.03 0.00 -0.44 0.00 0.00 34.13 33.70 3kt3 s GLU 33 CO -0.05 -0.05 1.07 0.20 0.95 0.00 0.00 175.26 177.39 3kt3 s GLY 34 N -0.96 1.67 0.71 -3.83 0.00 -1.24 -0.88 107.32 102.79 3kt3 s GLY 34 Ca -0.11 0.13 -0.11 0.00 0.00 0.00 0.00 44.72 44.64 3kt3 s GLY 34 CO -0.00 0.47 1.07 -0.32 0.00 0.00 0.00 173.10 174.31 3kt3 s GLY 35 N -3.64 1.66 -0.07 0.20 0.00 -1.26 -4.51 107.32 99.70 3kt3 s GLY 35 Ca 0.60 0.00 0.04 0.00 0.00 0.00 0.00 44.72 45.35 3kt3 s GLY 35 CO 0.55 0.33 -0.19 0.14 0.00 0.00 0.00 173.10 173.94 3kt3 s VAL 36 N -3.09 1.62 0.46 1.40 1.01 0.11 -0.49 120.40 121.43 3kt3 s VAL 36 Ca 0.58 -0.78 0.07 0.00 0.00 0.00 0.00 61.98 61.85 3kt3 s VAL 36 Cb -0.14 -1.41 0.07 0.00 0.00 0.00 0.00 36.38 34.90 3kt3 s VAL 36 CO 0.55 0.46 0.57 0.47 0.00 0.00 0.00 175.10 177.15 3kt3 n ASP 37 N 3.44 1.85 0.24 3.32 8.00 0.98 -2.55 116.55 131.83 3kt3 n ASP 37 Ca -0.20 -2.30 0.12 0.00 0.71 0.00 0.00 54.79 53.12 3kt3 n ASP 37 Cb 0.52 -0.27 0.49 0.00 -0.02 0.00 0.00 41.12 41.84 3kt3 n ASP 37 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3kt3 h GLU 38 N 0.00 0.00 -0.78 -1.24 4.57 -1.99 -3.11 114.58 112.03 3kt3 h GLU 38 Ca -0.23 0.00 -0.43 0.00 -1.18 0.00 0.00 59.36 57.52 3kt3 h GLU 38 Cb 1.01 0.00 -0.25 0.00 -0.16 0.00 0.00 28.75 29.35 3kt3 h GLU 38 CO 0.34 0.15 0.39 0.00 -1.18 0.00 0.00 179.01 178.71 3kt3 n GLN 39 N -3.27 2.22 0.00 1.92 0.00 -1.26 -5.07 117.38 111.91 3kt3 n GLN 39 Ca 0.01 -3.15 0.00 0.00 0.00 0.00 0.00 57.00 53.86 3kt3 n GLN 39 Cb 0.41 -2.08 0.00 0.00 0.00 0.00 0.00 30.24 28.57 3kt3 n GLN 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kt3 n GLY 40 N -1.10 0.28 3.76 2.61 0.00 -1.17 -4.95 105.19 104.62 3kt3 n GLY 40 Ca 0.51 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.25 4.44 0.55 1.61 1.70 -1.26 -0.01 118.95 124.72 3kt3 s ARG 41 Ca 0.00 2.09 -0.21 0.00 -0.47 0.00 0.00 55.73 57.14 3kt3 s ARG 41 Cb 0.00 -3.11 -0.05 0.00 -0.57 0.00 0.00 34.95 31.22 3kt3 s ARG 41 CO 0.00 -0.08 1.31 0.00 -1.08 0.00 0.00 175.30 175.45 3kt3 s ALA 42 N -1.07 2.76 -0.32 7.88 0.00 0.36 -4.88 121.76 126.49 3kt3 s ALA 42 Ca 0.48 1.24 0.23 0.00 0.00 0.00 0.00 51.96 53.91 3kt3 s ALA 42 Cb -0.37 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.24 3kt3 s ALA 42 CO 0.49 -1.29 1.03 1.04 0.00 0.00 0.00 175.76 177.03 3kt3 n GLN 43 N -1.11 0.53 -4.27 0.00 6.02 -1.26 -4.83 117.38 112.45 3kt3 n GLN 43 Ca 0.11 0.07 -0.15 0.00 -0.01 0.00 0.00 57.00 57.02 3kt3 n GLN 43 Cb 0.46 -1.75 -0.10 0.00 1.02 0.00 0.00 30.24 29.87 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 -4.95 1.74 -0.07 1.08 0.01 -1.26 -4.10 114.94 107.39 3kt3 s ASN 44 Ca 0.00 -1.10 -0.27 0.00 -0.71 0.00 0.00 52.86 50.78 3kt3 s ASN 44 Cb 0.11 0.01 -0.02 0.00 0.41 0.00 0.00 41.25 41.76 3kt3 s ASN 44 CO 0.79 -0.42 0.88 -0.63 -1.51 0.00 0.00 177.10 176.22 3kt3 s ILE 45 N -3.39 4.90 -0.68 0.60 1.01 -1.26 -4.78 121.20 117.59 3kt3 s ILE 45 Ca 0.21 1.80 -0.25 0.00 0.00 0.00 0.00 60.65 62.42 3kt3 s ILE 45 Cb 0.04 -4.21 0.05 0.00 0.01 0.00 0.00 42.46 38.35 3kt3 s ILE 45 CO 0.03 0.13 1.10 -0.62 0.00 0.00 0.00 174.94 175.58 3kt3 s ASP 46 N 1.00 6.19 0.32 3.58 -1.08 -1.26 -4.89 116.67 120.53 3kt3 s ASP 46 Ca 0.45 -0.69 0.16 0.00 -0.52 0.00 0.00 52.55 51.95 3kt3 s ASP 46 Cb -0.19 -2.48 0.42 0.00 -1.46 0.00 0.00 42.92 39.21 3kt3 s ASP 46 CO 0.20 -1.60 1.61 1.88 0.52 0.00 0.00 175.17 177.78 3kt3 h TYR 47 N 9.75 0.00 0.00 -5.34 0.05 -1.99 -2.41 116.97 117.02 3kt3 h TYR 47 Ca -0.28 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.41 3kt3 h TYR 47 Cb 1.06 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.79 3kt3 h TYR 47 CO 1.03 0.48 -0.43 -0.44 -1.05 0.00 0.00 178.16 177.75 3kt3 h ASP 48 N 0.00 0.00 -0.29 3.88 3.32 -2.00 -2.09 116.42 119.25 3kt3 h ASP 48 Ca -0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 3kt3 h ASP 48 Cb 1.12 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.66 3kt3 h ASP 48 CO 0.06 0.43 -0.32 0.50 -1.72 0.00 0.00 179.24 178.20 3kt3 h LYS 49 N 0.00 0.72 -0.90 3.56 1.63 -1.87 -3.23 116.57 116.48 3kt3 h LYS 49 Ca -0.00 -0.39 -0.01 0.00 -0.85 0.00 0.00 60.65 59.39 3kt3 h LYS 49 Cb 0.87 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.48 3kt3 h LYS 49 CO 0.06 1.01 0.52 -0.07 -3.45 0.00 0.00 179.45 177.52 3kt3 h LEU 50 N 0.47 1.09 -0.73 5.20 3.38 -1.26 -1.11 115.31 122.35 3kt3 h LEU 50 Ca 0.04 -0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.04 3kt3 h LEU 50 Cb 0.90 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 41.29 3kt3 h LEU 50 CO 0.08 0.86 0.34 0.40 0.09 0.00 0.00 178.44 180.20 3kt3 h ILE 51 N 1.24 0.77 0.02 1.22 2.04 -1.40 0.14 117.51 121.54 3kt3 h ILE 51 Ca 0.32 -0.19 -0.26 0.00 1.00 0.00 0.00 64.86 65.74 3kt3 h ILE 51 Cb -0.02 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.21 3kt3 h ILE 51 CO -0.06 0.10 -1.34 0.07 0.00 0.00 0.00 178.15 176.92 3kt3 h LYS 52 N 0.54 0.05 -0.70 2.37 2.10 -1.58 0.12 116.57 119.47 3kt3 h LYS 52 Ca 0.38 -0.09 0.04 0.00 -2.00 0.00 0.00 60.65 58.98 3kt3 h LYS 52 Cb 0.48 0.03 -0.05 0.00 -0.90 0.00 0.00 32.23 31.79 3kt3 h LYS 52 CO -0.32 0.86 0.42 1.96 -2.00 0.00 0.00 179.45 180.37 3kt3 h GLN 53 N 0.01 0.78 0.00 0.07 4.20 -0.76 -2.98 115.11 116.43 3kt3 h GLN 53 Ca -0.15 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.52 3kt3 h GLN 53 Cb 1.90 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 29.50 3kt3 h GLN 53 CO 0.12 0.52 -0.91 1.19 -0.67 0.00 0.00 178.83 179.08 3kt3 n PHE 54 N -4.70 0.42 -1.89 2.96 0.99 0.44 -4.98 117.46 110.69 3kt3 n PHE 54 Ca 0.08 0.12 -0.04 0.00 -0.00 0.00 0.00 57.45 57.61 3kt3 n PHE 54 Cb 0.13 -0.56 -0.01 0.00 -1.00 0.00 0.00 39.48 38.04 3kt3 n PHE 54 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3kt3 n GLY 55 N 1.34 0.29 3.97 1.37 0.00 -0.28 -5.05 105.19 106.82 3kt3 n GLY 55 Ca 0.02 -0.74 -0.26 0.00 0.00 0.00 0.00 46.02 45.04 3kt3 n GLY 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kt3 s THR 56 N -2.20 2.08 -0.13 2.61 -4.23 0.26 -5.00 115.64 109.03 3kt3 s THR 56 Ca 0.00 -0.37 -0.01 0.00 -1.18 0.00 0.00 61.69 60.13 3kt3 s THR 56 Cb 0.00 -2.71 -0.02 0.00 1.34 0.00 0.00 72.50 71.11 3kt3 s THR 56 CO 0.00 0.00 -0.10 -0.75 -0.54 0.00 0.00 174.62 173.23 3kt3 s LYS 57 N -5.42 3.39 0.49 3.99 2.20 -0.69 -4.73 119.74 118.98 3kt3 s LYS 57 Ca 0.69 -0.62 -0.23 0.00 -0.36 0.00 0.00 55.97 55.45 3kt3 s LYS 57 Cb -0.05 -2.71 -0.06 0.00 -1.51 0.00 0.00 37.83 33.50 3kt3 s LYS 57 CO 0.48 0.27 1.27 -1.25 -0.36 0.00 0.00 175.35 175.76 3kt3 s PRO 58 N 0.22 3.51 -0.44 4.03 0.04 -1.26 -0.31 135.00 140.79 3kt3 s PRO 58 Ca -0.06 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 62.73 3kt3 s PRO 58 Cb -0.15 -2.39 0.01 0.00 0.04 0.00 0.00 34.50 32.02 3kt3 s PRO 58 CO 0.04 -0.83 1.41 0.08 0.04 0.00 0.00 177.00 177.74 3kt3 s VAL 59 N -1.40 3.89 0.83 -0.36 1.01 0.35 -4.79 120.40 119.92 3kt3 s VAL 59 Ca 0.66 0.88 -0.07 0.00 0.00 0.00 0.00 61.98 63.45 3kt3 s VAL 59 Cb -0.35 -4.25 0.16 0.00 0.00 0.00 0.00 36.38 31.95 3kt3 s VAL 59 CO 0.43 -0.83 1.14 0.20 0.00 0.00 0.00 175.10 176.04 3kt3 s ASN 60 N 4.01 3.76 0.17 3.32 0.01 -1.26 -4.95 114.94 120.00 3kt3 s ASN 60 Ca 0.60 -0.13 0.07 0.00 -0.71 0.00 0.00 52.86 52.69 3kt3 s ASN 60 Cb -0.13 -0.08 -0.03 0.00 0.41 0.00 0.00 41.25 41.42 3kt3 s ASN 60 CO 0.32 -2.28 1.38 -0.33 -1.51 0.00 0.00 177.10 174.68 3kt3 h GLU 61 N -1.03 0.05 -0.39 -0.60 3.07 -1.97 -2.87 114.58 110.83 3kt3 h GLU 61 Ca -0.39 -0.06 0.01 0.00 -0.50 0.00 0.00 59.36 58.42 3kt3 h GLU 61 Cb 1.25 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.16 3kt3 h GLU 61 CO 0.38 0.90 0.25 1.49 -1.40 0.00 0.00 179.01 180.63 3kt3 h GLU 62 N 0.02 0.50 -0.64 2.33 4.22 -1.99 -0.43 114.58 118.59 3kt3 h GLU 62 Ca -0.02 -0.03 0.03 0.00 0.08 0.00 0.00 59.36 59.42 3kt3 h GLU 62 Cb 1.55 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.65 3kt3 h GLU 62 CO 0.12 0.33 0.39 1.15 -2.18 0.00 0.00 179.01 178.82 3kt3 h THR 63 N 0.51 1.06 -0.78 0.32 2.02 -1.92 -1.92 112.91 112.20 3kt3 h THR 63 Ca 0.15 -0.26 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 3kt3 h THR 63 Cb -0.04 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 3kt3 h THR 63 CO -0.05 0.14 0.28 -0.07 0.37 0.00 0.00 175.52 176.19 3kt3 h LEU 64 N 0.76 1.10 0.54 2.58 3.38 -1.25 -2.15 115.31 120.28 3kt3 h LEU 64 Ca 0.26 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3kt3 h LEU 64 Cb 0.05 -0.29 0.01 0.00 0.09 0.00 0.00 40.66 40.51 3kt3 h LEU 64 CO -0.12 1.00 -0.26 0.11 0.09 0.00 0.00 178.44 179.26 3kt3 h LYS 65 N 1.15 -0.70 -1.13 1.13 1.57 -0.81 -2.89 116.57 114.89 3kt3 h LYS 65 Ca 0.26 0.05 0.32 0.00 -1.87 0.00 0.00 60.65 59.40 3kt3 h LYS 65 Cb 0.26 0.16 -0.10 0.00 0.08 0.00 0.00 32.23 32.63 3kt3 h LYS 65 CO -0.02 -0.47 0.73 -0.09 -0.57 0.00 0.00 179.45 179.04 3kt3 h ARG 66 N -0.77 0.27 0.20 3.15 9.65 -1.39 -1.41 114.38 124.08 3kt3 h ARG 66 Ca -0.07 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.78 3kt3 h ARG 66 Cb 0.56 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.08 3kt3 h ARG 66 CO 0.12 0.18 -0.10 0.35 2.80 0.00 0.00 179.97 183.32 3kt3 h PHE 67 N 0.28 -0.25 0.00 2.20 3.57 -1.32 -2.46 116.94 118.95 3kt3 h PHE 67 Ca 0.65 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 62.07 3kt3 h PHE 67 Cb 1.85 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 40.67 3kt3 h PHE 67 CO -0.00 -0.01 -0.35 1.57 -2.23 0.00 0.00 178.31 177.29 3kt3 h LYS 68 N -0.47 0.00 -0.01 1.11 2.10 -1.05 -0.32 116.57 117.93 3kt3 h LYS 68 Ca -0.03 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.41 3kt3 h LYS 68 Cb 0.36 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.69 3kt3 h LYS 68 CO 0.05 0.35 -0.89 -0.56 -2.00 0.00 0.00 179.45 176.39 3kt3 h GLN 69 N 0.00 0.35 0.08 0.07 3.07 -1.48 0.20 115.11 117.40 3kt3 h GLN 69 Ca -0.00 -0.36 -0.28 0.00 0.09 0.00 0.00 58.65 58.10 3kt3 h GLN 69 Cb 0.72 0.10 0.02 0.00 0.08 0.00 0.00 27.48 28.40 3kt3 h GLN 69 CO 0.04 1.04 -1.16 0.28 0.09 0.00 0.00 178.83 179.12 3kt3 h VAL 70 N 0.20 1.33 0.00 1.86 2.07 -1.12 -3.38 116.25 117.22 3kt3 h VAL 70 Ca -0.06 -2.50 -0.37 0.00 0.82 0.00 0.00 66.70 64.59 3kt3 h VAL 70 Cb 1.52 2.63 -0.07 0.00 -1.52 0.00 0.00 31.29 33.85 3kt3 h VAL 70 CO 0.15 0.76 -2.33 0.35 0.02 0.00 0.00 177.57 176.51 3kt3 n THR 71 N -3.76 1.43 -1.00 2.57 -2.24 -0.16 -4.75 114.28 106.37 3kt3 n THR 71 Ca -0.11 -0.81 -0.00 0.00 -2.27 0.00 0.00 64.05 60.86 3kt3 n THR 71 Cb 0.95 -0.67 -0.00 0.00 -2.10 0.00 0.00 70.33 68.51 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 1.81 0.47 3.51 3.38 0.00 0.71 -4.35 105.19 110.73 3kt3 n GLY 72 Ca -0.33 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.25 2.03 0.08 1.61 1.81 -1.25 -5.03 118.95 117.95 3kt3 s ARG 73 Ca 0.00 -1.04 -0.31 0.00 -1.72 0.00 0.00 55.73 52.66 3kt3 s ARG 73 Cb 0.00 -2.22 -0.08 0.00 -0.45 0.00 0.00 34.95 32.20 3kt3 s ARG 73 CO 0.00 0.52 1.49 -1.21 -0.68 0.00 0.00 175.30 175.42 3kt3 s GLU 74 N -1.90 4.26 0.44 3.54 0.41 -1.26 -4.20 118.70 119.98 3kt3 s GLU 74 Ca 0.18 2.16 -0.23 0.00 -0.41 0.00 0.00 54.97 56.67 3kt3 s GLU 74 Cb -0.11 -3.41 -0.11 0.00 -1.78 0.00 0.00 34.13 28.72 3kt3 s GLU 74 CO 0.10 -0.58 0.78 -2.30 -0.49 0.00 0.00 175.26 172.76 3kt3 n PRO 75 N 4.78 0.92 -1.91 0.39 -0.02 -1.26 -4.93 135.00 132.98 3kt3 n PRO 75 Ca 0.13 0.34 -0.36 0.00 -2.02 0.00 0.00 63.50 61.59 3kt3 n PRO 75 Cb 0.42 -1.79 0.05 0.00 -0.02 0.00 0.00 33.50 32.15 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 -1.39 2.28 0.50 6.00 2.46 -1.26 -4.78 115.29 119.09 3kt3 s HIS 76 Ca 0.64 1.49 0.20 0.00 0.47 0.00 0.00 55.06 57.86 3kt3 s HIS 76 Cb -0.57 -3.58 1.32 0.00 -0.13 0.00 0.00 32.58 29.62 3kt3 s HIS 76 CO 0.56 -2.51 2.11 1.12 -2.47 0.00 0.00 174.74 173.56 3kt3 h HIS 77 N 0.83 0.00 -0.92 3.88 2.07 -2.00 0.88 115.15 119.89 3kt3 h HIS 77 Ca -0.51 0.00 0.05 0.00 -2.85 0.00 0.00 60.37 57.07 3kt3 h HIS 77 Cb 1.31 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 31.23 3kt3 h HIS 77 CO 0.45 0.07 0.58 0.74 -3.07 0.00 0.00 177.93 176.70 3kt3 h PHE 78 N 0.00 1.09 -0.24 6.12 0.04 -1.93 -0.84 116.94 121.17 3kt3 h PHE 78 Ca -0.00 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.71 3kt3 h PHE 78 Cb 0.14 -0.36 -0.00 0.00 2.20 0.00 0.00 35.95 37.93 3kt3 h PHE 78 CO 0.00 0.58 -0.19 -0.07 -0.60 0.00 0.00 178.31 178.03 3kt3 h LEU 79 N 1.09 0.59 0.41 1.54 3.38 -1.12 0.32 115.31 121.53 3kt3 h LEU 79 Ca 0.39 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3kt3 h LEU 79 Cb 0.12 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3kt3 h LEU 79 CO -0.16 0.92 -0.20 0.03 0.09 0.00 0.00 178.44 179.12 3kt3 h ARG 80 N 0.27 -0.54 0.00 1.13 3.08 -1.21 -2.93 114.38 114.18 3kt3 h ARG 80 Ca 0.05 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3kt3 h ARG 80 Cb 0.73 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.90 3kt3 h ARG 80 CO 0.05 -0.33 0.00 1.63 -1.07 0.00 0.00 179.97 180.25 3kt3 n LYS 81 N -5.31 0.22 -1.24 0.04 5.02 -0.34 -4.83 118.16 111.72 3kt3 n LYS 81 Ca -0.11 0.14 -0.08 0.00 -2.02 0.00 0.00 58.31 56.23 3kt3 n LYS 81 Cb 0.25 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.72 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 -0.14 1.02 0.24 0.72 0.00 -0.99 -4.92 105.19 101.12 3kt3 n GLY 82 Ca 0.07 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.38 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 0.68 -8.54 0.99 4.07 -0.65 -3.28 115.31 108.58 3kt3 h LEU 83 Ca -0.17 -0.29 -0.68 0.00 0.08 0.00 0.00 57.88 56.81 3kt3 h LEU 83 Cb 0.56 -0.19 -0.18 0.00 1.08 0.00 0.00 40.66 41.93 3kt3 h LEU 83 CO 0.25 0.98 -0.12 -0.36 -1.08 0.00 0.00 178.44 178.11 3kt3 s PHE 84 N -4.32 3.14 -0.03 1.13 0.40 -0.83 -0.37 117.98 117.11 3kt3 s PHE 84 Ca -0.08 -0.31 0.13 0.00 -0.60 0.00 0.00 56.93 56.06 3kt3 s PHE 84 Cb 0.12 -3.03 -0.20 0.00 0.51 0.00 0.00 43.02 40.43 3kt3 s PHE 84 CO 0.83 -0.75 0.27 1.97 0.70 0.00 0.00 175.22 178.23 3kt3 n PHE 85 N 5.77 0.00 -4.09 0.36 -1.74 -0.57 -4.66 117.46 112.53 3kt3 n PHE 85 Ca -0.06 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.75 3kt3 n PHE 85 Cb 0.47 -0.32 -0.10 0.00 1.52 0.00 0.00 39.48 41.06 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 -3.57 0.36 0.17 5.98 1.04 -1.19 -0.50 113.70 115.98 3kt3 s SER 86 Ca -0.05 -1.05 -0.10 0.00 0.48 0.00 0.00 55.95 55.24 3kt3 s SER 86 Cb 0.08 0.27 -0.01 0.00 0.10 0.00 0.00 66.02 66.46 3kt3 s SER 86 CO 0.54 -0.68 0.31 -1.83 0.98 0.00 0.00 173.24 172.55 3kt3 s GLU 87 N -3.97 1.18 -0.06 4.02 4.04 0.58 -0.61 118.70 123.89 3kt3 s GLU 87 Ca 0.14 -1.16 -0.01 0.00 0.04 0.00 0.00 54.97 53.99 3kt3 s GLU 87 Cb 0.07 0.39 0.03 0.00 0.02 0.00 0.00 34.13 34.64 3kt3 s GLU 87 CO -0.05 -0.44 -0.00 1.03 -1.84 0.00 0.00 175.26 173.96 3kt3 s ARG 88 N -3.96 0.52 -1.41 -4.83 0.52 -0.66 -1.70 118.95 107.41 3kt3 s ARG 88 Ca 0.17 0.10 -0.10 0.00 -0.52 0.00 0.00 55.73 55.37 3kt3 s ARG 88 Cb 0.03 -0.81 0.07 0.00 0.52 0.00 0.00 34.95 34.76 3kt3 s ARG 88 CO 0.00 -0.24 0.65 -0.25 0.02 0.00 0.00 175.30 175.48 3kt3 n ASP 89 N 4.79 -4.39 0.20 0.23 8.00 -1.26 -0.59 116.55 123.53 3kt3 n ASP 89 Ca -0.13 -0.50 0.06 0.00 0.71 0.00 0.00 54.79 54.93 3kt3 n ASP 89 Cb 0.50 -3.58 0.38 0.00 -0.02 0.00 0.00 41.12 38.40 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 -1.34 0.00 -0.41 1.24 3.57 -1.90 -2.96 116.94 115.14 3kt3 h PHE 90 Ca -0.49 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.09 3kt3 h PHE 90 Cb 1.33 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.99 3kt3 h PHE 90 CO 0.62 0.35 -0.13 1.15 -2.23 0.00 0.00 178.31 178.07 3kt3 h THR 91 N 0.00 0.53 0.00 4.41 2.02 -1.99 -2.07 112.91 115.81 3kt3 h THR 91 Ca -0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 3kt3 h THR 91 Cb 0.81 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 3kt3 h THR 91 CO 0.05 0.00 -0.30 0.07 0.37 0.00 0.00 175.52 175.70 3kt3 h LYS 92 N -0.04 0.00 -0.34 6.66 2.10 -1.92 -1.24 116.57 121.80 3kt3 h LYS 92 Ca 0.20 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.69 3kt3 h LYS 92 Cb 0.35 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.67 3kt3 h LYS 92 CO -0.45 0.30 -0.42 0.82 -2.00 0.00 0.00 179.45 177.71 3kt3 h ILE 93 N 0.00 1.28 -0.59 0.07 1.08 -1.48 -2.34 117.51 115.53 3kt3 h ILE 93 Ca -0.00 -1.59 -0.08 0.00 -0.39 0.00 0.00 64.86 62.79 3kt3 h ILE 93 Cb 0.77 1.46 -0.02 0.00 -3.07 0.00 0.00 36.82 35.95 3kt3 h ILE 93 CO 0.04 0.53 0.04 -0.07 -0.69 0.00 0.00 178.15 178.00 3kt3 h LEU 94 N 0.69 0.98 -0.67 1.44 3.38 -0.91 -2.54 115.31 117.67 3kt3 h LEU 94 Ca 0.05 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.80 3kt3 h LEU 94 Cb 1.00 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 3kt3 h LEU 94 CO 0.10 1.02 0.37 0.44 0.09 0.00 0.00 178.44 180.46 3kt3 h ASP 95 N 0.90 0.54 -0.63 -0.43 3.32 -1.18 -1.26 116.42 117.69 3kt3 h ASP 95 Ca 0.17 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 3kt3 h ASP 95 Cb 0.49 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 3kt3 h ASP 95 CO 0.02 0.35 0.10 -0.07 -1.72 0.00 0.00 179.24 177.92 3kt3 h LEU 96 N 0.68 1.01 -0.58 1.55 3.38 -1.19 -1.93 115.31 118.23 3kt3 h LEU 96 Ca 0.31 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 3kt3 h LEU 96 Cb 0.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3kt3 h LEU 96 CO -0.19 1.00 -0.33 0.22 0.09 0.00 0.00 178.44 179.24 3kt3 h TYR 97 N 0.99 0.91 0.00 1.13 3.20 -1.22 0.23 116.97 122.21 3kt3 h TYR 97 Ca 0.20 -0.25 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 3kt3 h TYR 97 Cb 0.43 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.49 3kt3 h TYR 97 CO 0.03 1.00 -0.06 1.49 -1.64 0.00 0.00 178.16 178.98 3kt3 h GLU 98 N 0.66 0.00 -0.03 1.82 4.81 -0.90 -2.44 114.58 118.50 3kt3 h GLU 98 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3kt3 h GLU 98 Cb 0.87 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.25 3kt3 h GLU 98 CO 0.08 0.06 -0.09 1.04 -0.73 0.00 0.00 179.01 179.38 3kt3 n GLN 99 N -4.15 2.08 -0.97 1.92 6.02 -0.75 0.79 117.38 122.33 3kt3 n GLN 99 Ca -0.03 -1.70 0.00 0.00 -0.01 0.00 0.00 57.00 55.26 3kt3 n GLN 99 Cb 0.15 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 29.94 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 1.35 0.30 3.82 1.08 0.00 -0.80 -4.30 105.19 106.65 3kt3 n GLY 100 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.88 3.81 0.33 1.61 1.02 0.00 -4.99 119.74 120.64 3kt3 s LYS 101 Ca 0.00 1.10 -0.03 0.00 0.02 0.00 0.00 55.97 57.05 3kt3 s LYS 101 Cb 0.00 -2.11 -0.04 0.00 -0.52 0.00 0.00 37.83 35.15 3kt3 s LYS 101 CO 0.00 -0.39 0.58 -1.25 -0.92 0.00 0.00 175.35 173.37 3kt3 s PRO 102 N -3.82 3.58 0.28 -1.68 0.04 -1.26 -4.29 135.00 127.85 3kt3 s PRO 102 Ca 0.62 -0.07 -0.15 0.00 0.04 0.00 0.00 61.00 61.44 3kt3 s PRO 102 Cb -0.12 -2.62 0.01 0.00 0.04 0.00 0.00 34.50 31.81 3kt3 s PRO 102 CO 0.28 0.15 0.59 -0.59 0.04 0.00 0.00 177.00 177.47 3kt3 s PHE 103 N -2.23 0.20 0.29 0.56 -0.12 -1.26 -4.75 117.98 110.67 3kt3 s PHE 103 Ca 0.43 -0.62 0.04 0.00 -0.05 0.00 0.00 56.93 56.73 3kt3 s PHE 103 Cb -0.10 0.40 -0.06 0.00 -0.63 0.00 0.00 43.02 42.63 3kt3 s PHE 103 CO 0.33 -1.14 0.04 -0.59 -0.05 0.00 0.00 175.22 173.82 3kt3 s PHE 104 N -3.77 1.80 -0.08 3.49 -0.12 -1.17 -4.38 117.98 113.76 3kt3 s PHE 104 Ca 0.19 -0.96 -0.01 0.00 -0.05 0.00 0.00 56.93 56.09 3kt3 s PHE 104 Cb -0.03 -1.12 -0.03 0.00 -0.63 0.00 0.00 43.02 41.21 3kt3 s PHE 104 CO 0.09 -0.04 -0.02 -0.51 -0.05 0.00 0.00 175.22 174.70 3kt3 s LEU 105 N -3.41 3.44 -0.06 -1.99 1.43 0.22 -0.94 118.68 117.38 3kt3 s LEU 105 Ca 0.34 0.09 -0.02 0.00 -1.03 0.00 0.00 54.13 53.51 3kt3 s LEU 105 Cb 0.07 -1.78 0.04 0.00 0.03 0.00 0.00 46.19 44.55 3kt3 s LEU 105 CO 0.13 0.37 0.08 -0.47 0.23 0.00 0.00 176.35 176.70 3kt3 s TYR 106 N -0.85 0.01 0.19 0.29 6.04 -0.85 -0.58 117.35 121.59 3kt3 s TYR 106 Ca 0.13 0.31 -0.02 0.00 0.04 0.00 0.00 57.07 57.53 3kt3 s TYR 106 Cb -0.11 -0.44 -0.04 0.00 -1.04 0.00 0.00 41.96 40.33 3kt3 s TYR 106 CO 0.02 -0.22 0.14 -0.08 -1.54 0.00 0.00 175.55 173.86 3kt3 s THR 107 N 2.20 0.02 0.33 4.34 -1.32 -1.06 -3.75 115.64 116.41 3kt3 s THR 107 Ca 0.04 -1.93 -0.01 0.00 -1.21 0.00 0.00 61.69 58.58 3kt3 s THR 107 Cb -0.12 -2.36 0.01 0.00 -1.51 0.00 0.00 72.50 68.51 3kt3 s THR 107 CO -0.04 -0.11 0.44 0.61 -2.21 0.00 0.00 174.62 173.31 3kt3 n GLY 108 N -0.23 2.23 3.41 6.08 0.00 -1.26 -1.80 105.19 113.61 3kt3 n GLY 108 Ca -0.00 -1.62 -0.11 0.00 0.00 0.00 0.00 46.02 44.29 3kt3 n GLY 108 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3kt3 s ARG 109 N -2.78 0.54 -0.52 1.61 6.06 0.36 -4.91 118.95 119.31 3kt3 s ARG 109 Ca 0.28 0.86 -0.19 0.00 -2.50 0.00 0.00 55.73 54.19 3kt3 s ARG 109 Cb -0.01 0.13 0.07 0.00 0.06 0.00 0.00 34.95 35.21 3kt3 s ARG 109 CO 0.20 -0.12 0.61 0.20 -2.50 0.00 0.00 175.30 173.68 3kt3 s GLY 110 N 1.04 1.82 -1.15 8.12 0.00 -1.26 -1.31 107.32 114.57 3kt3 s GLY 110 Ca -0.06 -1.92 -0.22 0.00 0.00 0.00 0.00 44.72 42.53 3kt3 s GLY 110 CO -0.09 1.44 1.81 2.56 0.00 0.00 0.00 173.10 178.81 3kt3 s PRO 111 N 2.49 3.11 0.00 2.90 0.04 -1.26 -4.69 135.00 137.59 3kt3 s PRO 111 Ca 0.13 -1.28 0.25 0.00 0.04 0.00 0.00 61.00 60.13 3kt3 s PRO 111 Cb -0.21 -5.32 0.43 0.00 0.04 0.00 0.00 34.50 29.44 3kt3 s PRO 111 CO 0.10 -3.12 1.37 -1.13 0.04 0.00 0.00 177.00 174.26 3kt3 n SER 112 N 11.74 1.72 -3.29 6.66 3.41 -1.26 -4.66 113.62 127.93 3kt3 n SER 112 Ca 0.44 -1.35 -0.10 0.00 -0.26 0.00 0.00 58.87 57.60 3kt3 n SER 112 Cb 0.47 0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.65 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 -2.36 0.11 0.21 4.04 1.04 -1.26 -5.07 113.70 110.41 3kt3 s SER 113 Ca 0.24 -1.08 -0.07 0.00 0.48 0.00 0.00 55.95 55.53 3kt3 s SER 113 Cb 0.19 0.76 0.16 0.00 0.10 0.00 0.00 66.02 67.24 3kt3 s SER 113 CO 0.49 -1.49 1.69 0.44 0.98 0.00 0.00 173.24 175.35 3kt3 h ASP 114 N 2.05 0.96 -4.24 7.02 5.19 -1.94 -3.44 116.42 122.02 3kt3 h ASP 114 Ca -0.28 -0.26 -0.56 0.00 -0.62 0.00 0.00 57.03 55.31 3kt3 h ASP 114 Cb 1.25 -0.26 -0.30 0.00 0.18 0.00 0.00 39.33 40.20 3kt3 h ASP 114 CO 0.36 1.01 -0.84 -0.55 -3.12 0.00 0.00 179.24 176.10 3kt3 s SER 115 N -6.59 2.15 0.88 6.45 0.15 -1.26 -4.12 113.70 111.36 3kt3 s SER 115 Ca -0.11 -0.34 -0.12 0.00 0.70 0.00 0.00 55.95 56.09 3kt3 s SER 115 Cb 0.14 -0.33 0.12 0.00 -1.71 0.00 0.00 66.02 64.24 3kt3 s SER 115 CO 0.84 0.21 1.10 -0.04 1.20 0.00 0.00 173.24 176.55 3kt3 s MET 116 N -0.31 1.38 0.37 5.44 -1.94 -1.26 -4.92 119.30 118.06 3kt3 s MET 116 Ca 0.04 0.63 0.08 0.00 -1.71 0.00 0.00 55.69 54.73 3kt3 s MET 116 Cb -0.08 -1.84 -0.07 0.00 2.01 0.00 0.00 34.83 34.85 3kt3 s MET 116 CO 0.00 -2.10 -0.03 -3.38 -0.01 0.00 0.00 175.02 169.50 3kt3 s HIS 117 N -3.07 2.48 0.52 -0.03 -3.43 -1.26 -2.27 115.29 108.23 3kt3 s HIS 117 Ca 0.63 -0.57 0.34 0.00 -0.80 0.00 0.00 55.06 54.66 3kt3 s HIS 117 Cb -0.16 -1.58 1.49 0.00 -1.43 0.00 0.00 32.58 30.89 3kt3 s HIS 117 CO 0.56 0.50 1.80 -0.07 -2.00 0.00 0.00 174.74 175.53 3kt3 h LEU 118 N 1.87 0.07 -1.13 5.38 3.38 -1.56 0.11 115.31 123.42 3kt3 h LEU 118 Ca -0.43 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.56 3kt3 h LEU 118 Cb 1.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 3kt3 h LEU 118 CO 0.74 0.01 0.57 1.23 0.09 0.00 0.00 178.44 181.08 3kt3 h GLY 119 N 0.06 1.22 2.00 0.83 0.00 -1.90 -2.60 103.07 102.69 3kt3 h GLY 119 Ca 0.57 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 47.40 3kt3 h GLY 119 CO -0.05 0.46 -0.16 0.45 0.00 0.00 0.00 176.54 177.23 3kt3 h HIS 120 N 1.18 0.00 -0.10 5.60 3.86 -1.14 -2.68 115.15 121.86 3kt3 h HIS 120 Ca 0.32 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.50 3kt3 h HIS 120 Cb -0.12 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 3kt3 h HIS 120 CO 0.00 0.16 -0.07 0.52 0.86 0.00 0.00 177.93 179.40 3kt3 h MET 121 N 0.00 0.15 0.45 2.45 2.07 -1.53 -3.19 114.93 115.33 3kt3 h MET 121 Ca -0.00 -0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 57.59 3kt3 h MET 121 Cb 0.46 -0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 30.15 3kt3 h MET 121 CO 0.02 0.24 -0.37 0.82 1.07 0.00 0.00 176.91 178.69 3kt3 h ILE 122 N 0.15 0.24 -0.07 -1.22 1.08 -1.58 0.47 117.51 116.59 3kt3 h ILE 122 Ca 0.03 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.42 3kt3 h ILE 122 Cb 0.23 0.24 -0.01 0.00 -3.07 0.00 0.00 36.82 34.21 3kt3 h ILE 122 CO 0.01 0.00 -0.36 1.55 -0.69 0.00 0.00 178.15 178.66 3kt3 h PRO 123 N -0.82 0.13 0.00 2.37 0.13 -1.76 -2.89 132.00 129.17 3kt3 h PRO 123 Ca -0.04 -0.05 -0.21 0.00 -0.87 0.00 0.00 66.00 64.82 3kt3 h PRO 123 Cb 0.71 -0.01 0.02 0.00 0.13 0.00 0.00 31.00 31.85 3kt3 h PRO 123 CO -0.02 0.48 -0.82 0.74 -0.23 0.00 0.00 178.00 178.15 3kt3 h PHE 124 N 0.11 0.82 -0.68 1.56 0.04 -1.44 -1.35 116.94 116.01 3kt3 h PHE 124 Ca 0.01 -0.45 -0.01 0.00 2.80 0.00 0.00 57.97 60.32 3kt3 h PHE 124 Cb 0.70 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.73 3kt3 h PHE 124 CO 0.01 1.28 0.37 0.28 -0.60 0.00 0.00 178.31 179.64 3kt3 h VAL 125 N 0.13 1.21 -0.25 -0.55 2.07 -0.13 -0.82 116.25 117.91 3kt3 h VAL 125 Ca -0.10 -0.54 -0.05 0.00 0.82 0.00 0.00 66.70 66.83 3kt3 h VAL 125 Cb 1.51 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3kt3 h VAL 125 CO 0.16 0.23 -0.08 0.15 0.02 0.00 0.00 177.57 178.05 3kt3 h PHE 126 N 0.93 0.43 -0.15 1.57 3.57 -1.52 -2.48 116.94 119.28 3kt3 h PHE 126 Ca 0.24 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.61 3kt3 h PHE 126 Cb 0.04 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.66 3kt3 h PHE 126 CO -0.00 0.49 -0.22 1.15 -2.23 0.00 0.00 178.31 177.49 3kt3 h THR 127 N 0.39 1.35 -0.79 4.41 2.02 -0.73 -0.81 112.91 118.75 3kt3 h THR 127 Ca 0.08 -1.44 0.11 0.00 0.77 0.00 0.00 66.41 65.93 3kt3 h THR 127 Cb 0.39 1.92 -0.08 0.00 -1.74 0.00 0.00 68.15 68.64 3kt3 h THR 127 CO 0.02 0.43 0.42 0.50 0.37 0.00 0.00 175.52 177.26 3kt3 h LYS 128 N 0.05 0.66 -0.23 6.66 3.64 -1.04 0.64 116.57 126.95 3kt3 h LYS 128 Ca 0.02 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 3kt3 h LYS 128 Cb 0.79 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3kt3 h LYS 128 CO 0.05 0.44 0.04 2.35 -2.27 0.00 0.00 179.45 180.05 3kt3 h TRP 129 N 0.68 0.40 -0.60 1.91 7.01 -1.36 -2.62 115.95 121.37 3kt3 h TRP 129 Ca 0.40 -0.05 0.02 0.00 2.11 0.00 0.00 58.89 61.36 3kt3 h TRP 129 Cb 0.45 -0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.37 3kt3 h TRP 129 CO -0.09 0.50 0.40 -0.07 -2.79 0.00 0.00 178.44 176.39 3kt3 h LEU 130 N 0.18 0.65 -0.10 0.65 3.38 -0.45 -1.33 115.31 118.29 3kt3 h LEU 130 Ca 0.07 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3kt3 h LEU 130 Cb 0.32 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3kt3 h LEU 130 CO 0.00 0.46 0.00 -0.61 0.09 0.00 0.00 178.44 178.39 3kt3 h GLN 131 N 0.76 0.17 -0.15 1.13 4.15 -0.77 -1.96 115.11 118.43 3kt3 h GLN 131 Ca 0.23 -0.05 -0.16 0.00 0.77 0.00 0.00 58.65 59.44 3kt3 h GLN 131 Cb -0.01 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 3kt3 h GLN 131 CO -0.06 0.42 -0.58 1.05 -1.93 0.00 0.00 178.83 177.73 3kt3 h GLU 132 N -0.11 0.49 -0.10 1.69 4.11 -1.27 0.51 114.58 119.91 3kt3 h GLU 132 Ca 0.03 -0.33 -0.02 0.00 0.07 0.00 0.00 59.36 59.12 3kt3 h GLU 132 Cb 0.35 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 3kt3 h GLU 132 CO 0.00 0.94 0.00 0.28 0.07 0.00 0.00 179.01 180.30 3kt3 h VAL 133 N 0.37 1.25 0.00 -1.06 2.07 -1.27 -3.25 116.25 114.36 3kt3 h VAL 133 Ca 0.00 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.73 3kt3 h VAL 133 Cb 1.12 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 3kt3 h VAL 133 CO 0.11 0.22 -0.56 -0.26 0.02 0.00 0.00 177.57 177.10 3kt3 h PHE 134 N -0.10 0.00 -6.05 1.57 0.04 -1.39 -3.49 116.94 107.51 3kt3 h PHE 134 Ca 0.03 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.45 3kt3 h PHE 134 Cb 0.34 0.00 0.08 0.00 2.20 0.00 0.00 35.95 38.57 3kt3 h PHE 134 CO 0.03 0.00 -0.79 -3.47 -0.60 0.00 0.00 178.31 173.48 3kt3 n ASP 135 N -2.21 -5.86 -4.28 2.17 2.03 0.16 -4.90 116.55 103.66 3kt3 n ASP 135 Ca 0.03 -0.82 -0.16 0.00 0.52 0.00 0.00 54.79 54.36 3kt3 n ASP 135 Cb 0.45 -3.71 -0.10 0.00 -0.72 0.00 0.00 41.12 37.04 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 -3.32 1.41 0.52 5.18 -7.23 -1.18 -2.76 120.40 113.03 3kt3 s VAL 136 Ca 0.34 -2.06 -0.17 0.00 -1.81 0.00 0.00 61.98 58.28 3kt3 s VAL 136 Cb -0.11 -1.87 -0.07 0.00 0.56 0.00 0.00 36.38 34.89 3kt3 s VAL 136 CO 0.83 -0.64 1.00 -2.16 -0.31 0.00 0.00 175.10 173.82 3kt3 s PRO 137 N -3.53 3.87 -0.07 4.82 0.04 -1.26 -4.84 135.00 134.03 3kt3 s PRO 137 Ca 0.18 1.00 0.01 0.00 0.04 0.00 0.00 61.00 62.23 3kt3 s PRO 137 Cb 0.00 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.44 3kt3 s PRO 137 CO 0.03 -0.34 -0.09 -1.17 0.04 0.00 0.00 177.00 175.47 3kt3 s LEU 138 N -4.10 1.47 -0.18 -3.56 2.96 0.30 -0.61 118.68 114.96 3kt3 s LEU 138 Ca 0.60 -0.25 -0.03 0.00 -0.22 0.00 0.00 54.13 54.23 3kt3 s LEU 138 Cb -0.11 -0.73 -0.01 0.00 0.50 0.00 0.00 46.19 45.84 3kt3 s LEU 138 CO 0.31 -0.02 -0.07 0.68 -1.32 0.00 0.00 176.35 175.93 3kt3 s VAL 139 N 0.93 3.39 -0.19 1.68 -7.23 0.25 -0.25 120.40 118.98 3kt3 s VAL 139 Ca -0.10 -0.52 -0.01 0.00 -1.81 0.00 0.00 61.98 59.54 3kt3 s VAL 139 Cb -0.15 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.30 3kt3 s VAL 139 CO 0.01 0.47 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.52 3kt3 s ILE 140 N 0.84 2.78 -0.22 -0.62 1.01 0.20 -2.55 121.20 122.65 3kt3 s ILE 140 Ca -0.02 -0.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.80 3kt3 s ILE 140 Cb -0.15 -2.21 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 3kt3 s ILE 140 CO 0.01 0.49 0.24 -0.70 0.00 0.00 0.00 174.94 174.98 3kt3 s GLU 141 N 1.19 4.13 -0.41 2.79 2.12 -0.75 -1.49 118.70 126.28 3kt3 s GLU 141 Ca 0.02 -0.09 -0.13 0.00 0.36 0.00 0.00 54.97 55.13 3kt3 s GLU 141 Cb -0.14 -3.52 0.04 0.00 0.26 0.00 0.00 34.13 30.76 3kt3 s GLU 141 CO -0.05 0.06 0.29 -0.51 -0.54 0.00 0.00 175.26 174.50 3kt3 s LEU 142 N 1.05 5.09 -1.29 2.70 1.43 0.16 -0.49 118.68 127.33 3kt3 s LEU 142 Ca 0.12 -1.06 -0.07 0.00 -1.03 0.00 0.00 54.13 52.10 3kt3 s LEU 142 Cb -0.14 -2.11 0.15 0.00 0.03 0.00 0.00 46.19 44.12 3kt3 s LEU 142 CO 0.05 -0.47 2.17 0.35 0.23 0.00 0.00 176.35 178.68 3kt3 n THR 143 N 5.10 4.97 -0.14 5.49 -2.24 -0.43 -0.91 114.28 126.12 3kt3 n THR 143 Ca -0.11 -4.44 -0.02 0.00 -2.27 0.00 0.00 64.05 57.21 3kt3 n THR 143 Cb 0.46 -2.16 0.22 0.00 -2.10 0.00 0.00 70.33 66.75 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 0.76 -0.57 3.42 3.04 -1.86 -2.41 116.42 123.81 3kt3 h ASP 144 Ca 0.58 -0.10 -0.01 0.00 -3.24 0.00 0.00 57.03 54.25 3kt3 h ASP 144 Cb 0.42 -0.20 -0.03 0.00 -1.04 0.00 0.00 39.33 38.49 3kt3 h ASP 144 CO 1.52 0.70 0.30 -2.24 -2.04 0.00 0.00 179.24 177.48 3kt3 h ASP 145 N 0.82 0.72 -0.12 4.15 3.04 -1.93 -1.61 116.42 121.50 3kt3 h ASP 145 Ca 0.19 -0.10 0.04 0.00 -3.24 0.00 0.00 57.03 53.92 3kt3 h ASP 145 Cb 0.19 -0.18 -0.05 0.00 -1.04 0.00 0.00 39.33 38.24 3kt3 h ASP 145 CO -0.02 0.62 -0.17 -0.08 -2.04 0.00 0.00 179.24 177.55 3kt3 h GLU 146 N 0.77 -0.21 -0.72 4.15 4.81 -1.87 -0.56 114.58 120.94 3kt3 h GLU 146 Ca 0.20 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 3kt3 h GLU 146 Cb 0.06 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 3kt3 h GLU 146 CO -0.03 -0.14 0.36 0.87 -0.73 0.00 0.00 179.01 179.34 3kt3 h LYS 147 N -0.22 1.03 -0.51 1.92 6.56 -1.28 -0.18 116.57 123.88 3kt3 h LYS 147 Ca 0.09 -0.13 0.01 0.00 -1.06 0.00 0.00 60.65 59.56 3kt3 h LYS 147 Cb 0.35 -0.19 -0.03 0.00 -0.57 0.00 0.00 32.23 31.79 3kt3 h LYS 147 CO -0.24 0.78 0.34 0.35 -2.06 0.00 0.00 179.45 178.61 3kt3 h PHE 148 N 1.02 0.64 -0.47 -1.35 3.57 -1.00 -1.10 116.94 118.26 3kt3 h PHE 148 Ca 0.25 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.70 3kt3 h PHE 148 Cb 0.09 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 3kt3 h PHE 148 CO 0.01 0.40 0.02 -0.07 -2.23 0.00 0.00 178.31 176.43 3kt3 h LEU 149 N 0.68 0.72 0.00 0.59 4.07 0.10 -3.30 115.31 118.17 3kt3 h LEU 149 Ca 0.19 -0.16 -0.03 0.00 0.08 0.00 0.00 57.88 57.96 3kt3 h LEU 149 Cb -0.07 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.48 3kt3 h LEU 149 CO -0.05 0.78 -1.64 0.49 -1.08 0.00 0.00 178.44 176.95 3kt3 n PHE 150 N -4.23 0.40 -3.79 1.13 3.01 -0.20 -4.68 117.46 109.11 3kt3 n PHE 150 Ca 0.03 0.12 -0.35 0.00 1.01 0.00 0.00 57.45 58.25 3kt3 n PHE 150 Cb 0.28 -0.73 -0.11 0.00 -0.01 0.00 0.00 39.48 38.91 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 -3.37 2.16 0.53 -1.08 -0.14 -0.42 -4.97 119.74 112.46 3kt3 s LYS 151 Ca -0.05 -2.17 0.26 0.00 -1.36 0.00 0.00 55.97 52.65 3kt3 s LYS 151 Cb 0.12 -3.58 1.42 0.00 -1.68 0.00 0.00 37.83 34.10 3kt3 s LYS 151 CO 0.86 -1.10 1.98 1.12 -0.76 0.00 0.00 175.35 177.45 3kt3 h HIS 152 N 7.48 0.00 0.00 3.18 2.07 -1.83 -2.67 115.15 123.38 3kt3 h HIS 152 Ca -0.07 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.41 3kt3 h HIS 152 Cb 0.99 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.97 3kt3 h HIS 152 CO 0.60 0.00 -0.15 0.87 -3.07 0.00 0.00 177.93 176.18 3kt3 h LYS 153 N 0.00 0.00 -6.20 5.12 1.79 -1.93 -3.46 116.57 111.89 3kt3 h LYS 153 Ca 0.27 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 58.21 3kt3 h LYS 153 Cb 1.09 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.68 3kt3 h LYS 153 CO -0.00 0.15 -0.55 -0.48 -1.08 0.00 0.00 179.45 177.49 3kt3 s LEU 154 N -7.93 3.73 0.41 2.94 2.34 -1.01 -5.12 118.68 114.04 3kt3 s LEU 154 Ca -0.03 -0.27 0.08 0.00 0.06 0.00 0.00 54.13 53.97 3kt3 s LEU 154 Cb 0.14 -2.28 0.01 0.00 -0.56 0.00 0.00 46.19 43.50 3kt3 s LEU 154 CO 0.64 -0.01 0.55 0.28 -1.06 0.00 0.00 176.35 176.75 3kt3 s THR 155 N -2.06 3.08 0.24 5.48 -1.32 -1.26 -4.92 115.64 114.89 3kt3 s THR 155 Ca 0.32 -1.02 -0.06 0.00 -1.21 0.00 0.00 61.69 59.72 3kt3 s THR 155 Cb -0.08 -3.04 0.24 0.00 -1.51 0.00 0.00 72.50 68.11 3kt3 s THR 155 CO 0.24 -0.01 1.91 0.40 -2.21 0.00 0.00 174.62 174.94 3kt3 h ILE 156 N 0.68 1.21 -0.48 5.08 1.08 -1.98 -2.58 117.51 120.53 3kt3 h ILE 156 Ca -0.41 -0.43 -0.02 0.00 -0.39 0.00 0.00 64.86 63.61 3kt3 h ILE 156 Cb 1.28 -0.15 -0.02 0.00 -3.07 0.00 0.00 36.82 34.85 3kt3 h ILE 156 CO 0.46 0.23 0.21 0.78 -0.69 0.00 0.00 178.15 179.14 3kt3 h ASN 157 N 1.26 0.65 -0.08 1.72 4.21 -1.99 -2.31 115.58 119.03 3kt3 h ASN 157 Ca 0.36 -0.15 0.04 0.00 1.21 0.00 0.00 56.30 57.75 3kt3 h ASN 157 Cb -0.09 -0.17 -0.06 0.00 -1.12 0.00 0.00 38.32 36.88 3kt3 h ASN 157 CO -0.09 0.62 -0.42 0.44 -1.29 0.00 0.00 177.43 176.69 3kt3 h ASP 158 N 0.63 -1.29 0.72 5.81 3.32 -1.86 -0.65 116.42 123.10 3kt3 h ASP 158 Ca 0.16 0.17 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 3kt3 h ASP 158 Cb 0.17 0.52 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 3kt3 h ASP 158 CO -0.02 -0.44 -0.15 -0.37 -1.72 0.00 0.00 179.24 176.55 3kt3 h VAL 159 N -0.52 0.46 -0.17 -1.35 -1.51 -1.46 0.10 116.25 111.80 3kt3 h VAL 159 Ca 0.07 -0.80 -0.21 0.00 -1.23 0.00 0.00 66.70 64.52 3kt3 h VAL 159 Cb 0.63 1.56 0.01 0.00 -2.13 0.00 0.00 31.29 31.36 3kt3 h VAL 159 CO -0.37 0.15 -0.73 0.11 -1.23 0.00 0.00 177.57 175.50 3kt3 h LYS 160 N 0.00 0.77 0.13 5.19 1.57 -0.90 -0.98 116.57 122.36 3kt3 h LYS 160 Ca -0.00 -0.60 -0.01 0.00 -1.87 0.00 0.00 60.65 58.17 3kt3 h LYS 160 Cb 0.55 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.98 3kt3 h LYS 160 CO 0.02 1.21 -0.06 -0.91 -0.57 0.00 0.00 179.45 179.14 3kt3 h ASN 161 N 0.54 -0.15 -0.88 0.86 2.35 -0.53 -2.85 115.58 114.92 3kt3 h ASN 161 Ca -0.04 -0.21 0.14 0.00 -0.55 0.00 0.00 56.30 55.64 3kt3 h ASN 161 Cb 1.35 0.04 -0.07 0.00 0.05 0.00 0.00 38.32 39.69 3kt3 h ASN 161 CO 0.15 0.13 0.57 -0.26 -1.65 0.00 0.00 177.43 176.37 3kt3 h PHE 162 N -0.43 0.81 -0.39 1.19 0.04 -0.84 -0.71 116.94 116.61 3kt3 h PHE 162 Ca -0.02 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 3kt3 h PHE 162 Cb 0.35 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 3kt3 h PHE 162 CO 0.01 0.30 0.22 0.00 -0.60 0.00 0.00 178.31 178.24 3kt3 h ALA 163 N 1.60 0.50 0.09 2.45 0.00 -1.13 0.92 119.26 123.69 3kt3 h ALA 163 Ca 0.44 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 3kt3 h ALA 163 Cb 0.71 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3kt3 h ALA 163 CO -0.20 0.02 -0.04 0.00 0.00 0.00 0.00 179.25 179.03 3kt3 h ARG 164 N 0.50 -0.12 -0.71 0.00 3.08 -0.94 0.14 114.38 116.34 3kt3 h ARG 164 Ca 0.14 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 3kt3 h ARG 164 Cb 0.04 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 3kt3 h ARG 164 CO -0.02 0.03 0.36 0.93 -1.07 0.00 0.00 179.97 180.19 3kt3 h GLU 165 N -0.23 1.01 -0.08 0.04 4.39 -1.16 -1.68 114.58 116.86 3kt3 h GLU 165 Ca -0.01 -0.14 -0.10 0.00 0.34 0.00 0.00 59.36 59.45 3kt3 h GLU 165 Cb 0.19 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 3kt3 h GLU 165 CO 0.02 0.78 -0.40 -0.91 -1.16 0.00 0.00 179.01 177.34 3kt3 h ASN 166 N 0.99 0.18 -0.52 1.42 -0.26 -0.77 -2.10 115.58 114.51 3kt3 h ASN 166 Ca 0.25 -0.07 -0.02 0.00 -0.56 0.00 0.00 56.30 55.89 3kt3 h ASN 166 Cb 0.09 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.27 3kt3 h ASN 166 CO -0.03 0.57 0.23 0.00 -1.06 0.00 0.00 177.43 177.14 3kt3 h ALA 167 N 1.44 0.67 -0.34 -0.83 0.00 -0.47 -0.93 119.26 118.81 3kt3 h ALA 167 Ca 0.01 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.83 3kt3 h ALA 167 Cb 0.78 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3kt3 h ALA 167 CO 0.06 0.26 0.11 0.87 0.00 0.00 0.00 179.25 180.55 3kt3 h LYS 168 N 0.70 0.25 -0.51 0.00 1.57 -1.07 -0.92 116.57 116.59 3kt3 h LYS 168 Ca 0.18 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.01 3kt3 h LYS 168 Cb 0.15 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 3kt3 h LYS 168 CO -0.02 0.17 0.21 -0.44 -0.57 0.00 0.00 179.45 178.79 3kt3 h ASP 169 N 0.26 0.24 -0.59 0.86 3.32 -1.10 -0.57 116.42 118.84 3kt3 h ASP 169 Ca 0.15 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.26 3kt3 h ASP 169 Cb 0.13 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 3kt3 h ASP 169 CO -0.16 0.17 0.37 0.40 -1.72 0.00 0.00 179.24 178.30 3kt3 h ILE 170 N 0.40 1.17 -0.91 0.35 2.04 -0.78 -2.53 117.51 117.26 3kt3 h ILE 170 Ca 0.24 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3kt3 h ILE 170 Cb 0.23 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 3kt3 h ILE 170 CO -0.22 0.17 0.51 0.40 0.00 0.00 0.00 178.15 179.00 3kt3 h ILE 171 N 0.80 1.26 0.00 -0.67 2.04 -0.62 -2.34 117.51 117.98 3kt3 h ILE 171 Ca 0.21 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 3kt3 h ILE 171 Cb -0.05 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.05 3kt3 h ILE 171 CO -0.04 0.29 -0.00 0.00 0.00 0.00 0.00 178.15 178.39 3kt3 h ALA 172 N 1.29 1.04 -0.21 1.87 0.00 -0.68 0.18 119.26 122.74 3kt3 h ALA 172 Ca 0.32 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 3kt3 h ALA 172 Cb 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3kt3 h ALA 172 CO -0.05 0.00 0.10 0.28 0.00 0.00 0.00 179.25 179.58 3kt3 h VAL 173 N 0.00 1.08 0.00 0.00 2.07 -1.27 -3.44 116.25 114.69 3kt3 h VAL 173 Ca -0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3kt3 h VAL 173 Cb 0.07 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3kt3 h VAL 173 CO 0.00 0.09 0.00 0.61 0.02 0.00 0.00 177.57 178.29 3kt3 n GLY 174 N -1.38 0.91 3.93 2.17 0.00 0.62 -5.01 105.19 106.43 3kt3 n GLY 174 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.75 3.40 -0.15 1.61 0.40 -1.17 -5.07 117.98 116.25 3kt3 s PHE 175 Ca 0.00 0.48 -0.03 0.00 -0.60 0.00 0.00 56.93 56.78 3kt3 s PHE 175 Cb 0.00 -2.24 -0.02 0.00 0.51 0.00 0.00 43.02 41.27 3kt3 s PHE 175 CO 0.00 -0.25 -0.06 0.34 0.70 0.00 0.00 175.22 175.95 3kt3 s ASP 176 N -4.14 4.58 0.61 1.36 3.68 -1.26 -5.01 116.67 116.49 3kt3 s ASP 176 Ca 0.46 -0.19 0.36 0.00 2.13 0.00 0.00 52.55 55.31 3kt3 s ASP 176 Cb -0.10 -1.74 2.02 0.00 -1.45 0.00 0.00 42.92 41.66 3kt3 s ASP 176 CO 0.40 0.16 2.28 1.55 0.13 0.00 0.00 175.17 179.69 3kt3 h PRO 177 N 6.76 0.00 -0.69 4.34 0.13 -1.88 -2.21 132.00 138.45 3kt3 h PRO 177 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3kt3 h PRO 177 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 3kt3 h PRO 177 CO 0.61 0.01 0.44 0.87 -0.23 0.00 0.00 178.00 179.71 3kt3 h LYS 178 N 0.00 0.92 0.00 0.86 6.56 -1.93 -3.22 116.57 119.76 3kt3 h LYS 178 Ca -0.00 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.53 3kt3 h LYS 178 Cb 0.06 -0.20 0.00 0.00 -0.57 0.00 0.00 32.23 31.52 3kt3 h LYS 178 CO 0.00 0.63 -0.06 0.27 -2.06 0.00 0.00 179.45 178.23 3kt3 n ASN 179 N -4.42 1.59 -3.91 0.86 6.94 -1.11 -1.32 115.26 113.88 3kt3 n ASN 179 Ca 0.07 -2.20 -0.24 0.00 -0.02 0.00 0.00 54.58 52.20 3kt3 n ASN 179 Cb 0.05 -0.16 -0.17 0.00 -2.36 0.00 0.00 39.78 37.14 3kt3 n ASN 179 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 3kt3 s THR 180 N -1.34 0.82 -0.24 5.53 2.01 -0.85 -0.54 115.64 121.04 3kt3 s THR 180 Ca 0.10 -0.23 -0.03 0.00 0.31 0.00 0.00 61.69 61.84 3kt3 s THR 180 Cb 0.09 -0.83 0.01 0.00 0.01 0.00 0.00 72.50 71.78 3kt3 s THR 180 CO 0.01 0.31 -0.06 0.12 -0.69 0.00 0.00 174.62 174.31 3kt3 s PHE 181 N 1.23 3.01 -0.20 4.92 5.36 0.65 -4.57 117.98 128.38 3kt3 s PHE 181 Ca -0.05 -1.32 -0.04 0.00 -0.96 0.00 0.00 56.93 54.56 3kt3 s PHE 181 Cb -0.14 -2.08 -0.02 0.00 -0.34 0.00 0.00 43.02 40.44 3kt3 s PHE 181 CO -0.02 -0.67 -0.02 0.42 -1.46 0.00 0.00 175.22 173.47 3kt3 s ILE 182 N 1.39 3.75 -0.00 3.12 1.01 -0.75 -0.62 121.20 129.09 3kt3 s ILE 182 Ca 0.03 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.32 3kt3 s ILE 182 Cb -0.16 -2.69 -0.01 0.00 0.01 0.00 0.00 42.46 39.62 3kt3 s ILE 182 CO -0.04 0.44 -0.09 0.72 0.00 0.00 0.00 174.94 175.97 3kt3 s PHE 183 N 1.01 0.76 0.09 3.97 -0.71 -0.55 -3.70 117.98 118.85 3kt3 s PHE 183 Ca 0.01 -0.15 -0.30 0.00 -1.04 0.00 0.00 56.93 55.45 3kt3 s PHE 183 Cb -0.14 -0.49 -0.06 0.00 -1.21 0.00 0.00 43.02 41.12 3kt3 s PHE 183 CO 0.01 -0.01 1.06 0.45 -1.34 0.00 0.00 175.22 175.38 3kt3 s SER 184 N -0.24 7.31 0.14 1.98 0.15 -1.26 -0.67 113.70 121.12 3kt3 s SER 184 Ca 0.03 1.89 -0.20 0.00 0.70 0.00 0.00 55.95 58.38 3kt3 s SER 184 Cb -0.03 -2.59 0.01 0.00 -1.71 0.00 0.00 66.02 61.70 3kt3 s SER 184 CO -0.00 -0.24 1.68 0.44 1.20 0.00 0.00 173.24 176.32 3kt3 h ASP 185 N 6.00 -0.33 -1.00 5.45 3.32 -1.42 -0.50 116.42 127.95 3kt3 h ASP 185 Ca -0.43 0.09 0.05 0.00 0.02 0.00 0.00 57.03 56.76 3kt3 h ASP 185 Cb 1.21 0.19 -0.06 0.00 0.22 0.00 0.00 39.33 40.89 3kt3 h ASP 185 CO 0.75 -0.12 0.65 -0.07 -1.72 0.00 0.00 179.24 178.72 3kt3 h LEU 186 N -0.05 1.06 0.00 1.55 3.38 -1.94 -1.04 115.31 118.27 3kt3 h LEU 186 Ca 0.12 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.97 3kt3 h LEU 186 Cb 0.24 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3kt3 h LEU 186 CO -0.28 0.70 -0.66 -0.61 0.09 0.00 0.00 178.44 177.68 3kt3 h GLN 187 N 1.21 0.00 0.00 1.13 4.15 -1.84 -3.34 115.11 116.43 3kt3 h GLN 187 Ca 0.41 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.83 3kt3 h GLN 187 Cb 0.09 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.78 3kt3 h GLN 187 CO -0.15 0.54 -0.85 0.98 -1.93 0.00 0.00 178.83 177.43 3kt3 n TYR 188 N -3.21 0.00 -1.67 3.99 9.36 -0.24 -4.98 117.16 120.40 3kt3 n TYR 188 Ca 0.00 0.00 -0.45 0.00 3.32 0.00 0.00 57.90 60.77 3kt3 n TYR 188 Cb 0.77 -0.06 -0.04 0.00 -0.63 0.00 0.00 39.34 39.39 3kt3 n TYR 188 CO 0.00 0.00 0.00 -0.12 0.22 0.00 0.00 176.86 176.96 3kt3 n MET 189 N -1.46 2.16 0.00 2.98 1.56 -0.41 -4.79 117.12 117.16 3kt3 n MET 189 Ca 0.02 0.78 0.00 0.00 -0.27 0.00 0.00 57.70 58.22 3kt3 n MET 189 Cb 0.25 -2.52 0.00 0.00 2.15 0.00 0.00 33.22 33.10 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 3.09 1.30 7.00 -5.12 0.00 -1.26 -4.95 105.19 105.25 3kt3 n GLY 190 Ca 0.15 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.20 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 -1.87 1.95 0.23 -0.02 0.00 -1.26 -1.06 105.19 103.16 3kt3 n GLY 191 Ca 0.00 -0.35 0.05 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.48 1.73 0.36 4.61 0.00 -1.88 -1.94 119.26 121.65 3kt3 h ALA 192 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3kt3 h ALA 192 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3kt3 h ALA 192 CO 0.00 0.20 -0.19 0.35 0.00 0.00 0.00 179.25 179.62 3kt3 h PHE 193 N 0.04 -0.48 -0.47 0.00 3.57 -1.56 -1.54 116.94 116.50 3kt3 h PHE 193 Ca 0.01 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 3kt3 h PHE 193 Cb 0.26 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3kt3 h PHE 193 CO 0.00 -0.30 0.16 -0.92 -2.23 0.00 0.00 178.31 175.03 3kt3 h TYR 194 N -0.50 0.68 -0.58 0.41 3.20 -0.75 -1.22 116.97 118.20 3kt3 h TYR 194 Ca -0.05 -0.04 0.06 0.00 3.14 0.00 0.00 58.73 61.85 3kt3 h TYR 194 Cb 0.40 -0.21 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 3kt3 h TYR 194 CO -0.06 0.55 0.29 0.93 -1.64 0.00 0.00 178.16 178.22 3kt3 h GLU 195 N 0.67 0.52 -0.44 1.82 5.08 -1.12 0.02 114.58 121.13 3kt3 h GLU 195 Ca 0.16 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 3kt3 h GLU 195 Cb 0.17 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 3kt3 h GLU 195 CO -0.01 0.34 -0.04 1.15 -1.00 0.00 0.00 179.01 179.46 3kt3 h THR 196 N 0.54 1.27 -0.42 1.13 2.02 -0.71 -0.47 112.91 116.26 3kt3 h THR 196 Ca 0.27 -1.10 0.08 0.00 0.77 0.00 0.00 66.41 66.43 3kt3 h THR 196 Cb 0.21 1.10 -0.08 0.00 -1.74 0.00 0.00 68.15 67.64 3kt3 h THR 196 CO -0.20 0.38 -0.10 0.58 0.37 0.00 0.00 175.52 176.55 3kt3 h VAL 197 N 0.63 0.58 -0.13 3.16 2.07 -0.78 0.20 116.25 121.99 3kt3 h VAL 197 Ca 0.12 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.64 3kt3 h VAL 197 Cb 0.55 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3kt3 h VAL 197 CO 0.03 0.00 0.07 0.58 0.02 0.00 0.00 177.57 178.27 3kt3 h VAL 198 N 0.00 1.09 -0.57 2.57 2.07 -0.80 -0.21 116.25 120.41 3kt3 h VAL 198 Ca 0.20 -0.24 0.09 0.00 0.82 0.00 0.00 66.70 67.57 3kt3 h VAL 198 Cb 0.31 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 31.02 3kt3 h VAL 198 CO -0.43 0.08 0.19 0.03 0.02 0.00 0.00 177.57 177.47 3kt3 h ARG 199 N 0.12 0.35 -0.36 1.57 3.08 -0.55 -2.56 114.38 116.03 3kt3 h ARG 199 Ca 0.05 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 3kt3 h ARG 199 Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3kt3 h ARG 199 CO -0.01 0.23 -0.01 0.28 -1.07 0.00 0.00 179.97 179.39 3kt3 h VAL 200 N 0.36 1.26 0.00 2.04 2.07 -0.40 -3.03 116.25 118.55 3kt3 h VAL 200 Ca 0.29 -1.01 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 3kt3 h VAL 200 Cb 0.35 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3kt3 h VAL 200 CO -0.30 0.33 -0.01 0.77 0.02 0.00 0.00 177.57 178.38 3kt3 h SER 201 N 0.45 0.00 1.29 0.57 4.64 -0.66 0.73 113.55 120.56 3kt3 h SER 201 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3kt3 h SER 201 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 3kt3 h SER 201 CO 0.02 0.01 0.00 -1.14 -0.87 0.00 0.00 176.83 174.85 3kt3 n ARG 202 N -3.59 0.26 0.00 4.77 0.63 -1.00 -3.77 116.66 113.96 3kt3 n ARG 202 Ca -0.03 0.28 0.11 0.00 -0.92 0.00 0.00 57.85 57.29 3kt3 n ARG 202 Cb 0.10 -1.84 0.08 0.00 0.45 0.00 0.00 32.46 31.25 3kt3 n ARG 202 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 3kt3 n GLN 203 N -2.29 2.02 -4.08 -0.14 1.13 0.25 -4.89 117.38 109.37 3kt3 n GLN 203 Ca 0.05 -1.74 -0.32 0.00 -1.94 0.00 0.00 57.00 53.05 3kt3 n GLN 203 Cb 0.38 -1.43 -0.16 0.00 0.11 0.00 0.00 30.24 29.14 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 -1.91 1.84 0.61 5.09 1.01 -1.22 -4.96 121.20 121.67 3kt3 s ILE 204 Ca 0.25 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 60.00 3kt3 s ILE 204 Cb 0.18 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 3kt3 s ILE 204 CO 0.30 0.50 1.01 0.42 0.00 0.00 0.00 174.94 177.17 3kt3 s THR 205 N 1.37 4.58 0.23 2.92 -4.23 -1.26 -4.94 115.64 114.30 3kt3 s THR 205 Ca 0.05 0.74 -0.08 0.00 -1.18 0.00 0.00 61.69 61.21 3kt3 s THR 205 Cb -0.13 -3.82 0.19 0.00 1.34 0.00 0.00 72.50 70.08 3kt3 s THR 205 CO -0.12 -1.04 1.87 1.23 -0.54 0.00 0.00 174.62 176.02 3kt3 h GLY 206 N -0.29 1.18 0.26 3.99 0.00 -1.99 -1.90 103.07 104.32 3kt3 h GLY 206 Ca -0.44 -0.40 0.11 0.00 0.00 0.00 0.00 47.33 46.60 3kt3 h GLY 206 CO 0.62 0.34 0.19 1.76 0.00 0.00 0.00 176.54 179.45 3kt3 h SER 207 N 1.02 0.12 -0.11 0.19 0.02 -1.99 -0.66 113.55 112.14 3kt3 h SER 207 Ca 0.32 0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 61.37 3kt3 h SER 207 Cb 0.00 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 3kt3 h SER 207 CO -0.11 0.07 0.06 0.74 -1.14 0.00 0.00 176.83 176.45 3kt3 h THR 208 N 0.34 1.09 -0.93 -2.27 2.02 -1.82 0.11 112.91 111.45 3kt3 h THR 208 Ca 0.32 -0.25 0.08 0.00 0.77 0.00 0.00 66.41 67.33 3kt3 h THR 208 Cb 0.45 1.05 -0.07 0.00 -1.74 0.00 0.00 68.15 67.85 3kt3 h THR 208 CO -0.36 0.08 0.58 0.00 0.37 0.00 0.00 175.52 176.18 3kt3 h ALA 209 N 0.96 1.31 -0.23 6.16 0.00 -0.78 0.31 119.26 127.00 3kt3 h ALA 209 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 3kt3 h ALA 209 Cb 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3kt3 h ALA 209 CO -0.01 0.28 -0.42 0.87 0.00 0.00 0.00 179.25 179.97 3kt3 h LYS 210 N 1.00 0.69 -0.53 0.00 1.57 -0.93 -1.28 116.57 117.10 3kt3 h LYS 210 Ca 0.42 -0.44 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 3kt3 h LYS 210 Cb 0.27 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 3kt3 h LYS 210 CO -0.21 1.06 0.03 0.00 -0.57 0.00 0.00 179.45 179.76 3kt3 h ALA 211 N 0.63 0.71 0.15 3.86 0.00 -0.45 0.31 119.26 124.47 3kt3 h ALA 211 Ca 0.01 -0.28 -0.32 0.00 0.00 0.00 0.00 54.91 54.32 3kt3 h ALA 211 Cb 1.02 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3kt3 h ALA 211 CO 0.10 0.50 -1.58 0.28 0.00 0.00 0.00 179.25 178.55 3kt3 h VAL 212 N 0.79 1.12 0.00 0.00 2.07 -1.00 -3.39 116.25 115.83 3kt3 h VAL 212 Ca 0.15 -2.71 0.00 0.00 0.82 0.00 0.00 66.70 64.96 3kt3 h VAL 212 Cb 0.49 2.80 0.00 0.00 -1.52 0.00 0.00 31.29 33.06 3kt3 h VAL 212 CO 0.02 0.83 -0.65 0.49 0.02 0.00 0.00 177.57 178.28 3kt3 n PHE 213 N -3.52 0.00 -0.91 1.57 3.72 -0.48 -4.97 117.46 112.85 3kt3 n PHE 213 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 3kt3 n PHE 213 Cb 1.06 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 39.55 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 1.40 0.47 3.74 1.37 0.00 0.10 -5.01 105.19 107.27 3kt3 n GLY 214 Ca 0.01 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.02 3kt3 n GLY 214 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kt3 s PHE 215 N -2.00 2.28 0.45 1.61 0.08 -1.25 -5.00 117.98 114.15 3kt3 s PHE 215 Ca 0.00 1.53 0.03 0.00 0.12 0.00 0.00 56.93 58.61 3kt3 s PHE 215 Cb 0.00 -3.50 -0.01 0.00 -0.57 0.00 0.00 43.02 38.93 3kt3 s PHE 215 CO 0.00 -2.39 0.12 0.54 -0.10 0.00 0.00 175.22 173.40 3kt3 s ASN 216 N -1.68 3.16 0.47 1.36 6.03 -1.26 -4.57 114.94 118.43 3kt3 s ASN 216 Ca 0.77 -1.74 0.32 0.00 -1.03 0.00 0.00 52.86 51.18 3kt3 s ASN 216 Cb -0.31 0.64 1.66 0.00 -3.03 0.00 0.00 41.25 40.21 3kt3 s ASN 216 CO 0.37 -0.99 1.96 0.44 -2.03 0.00 0.00 177.10 176.85 3kt3 h ASP 217 N 1.63 0.00 1.67 3.54 3.32 -2.02 -1.19 116.42 123.37 3kt3 h ASP 217 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 3kt3 h ASP 217 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 3kt3 h ASP 217 CO 0.57 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 178.86 3kt3 h SER 218 N 0.00 0.00 -3.96 6.45 4.64 -2.02 -3.45 113.55 115.21 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 0.06 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.19 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 -5.79 6.55 0.61 4.97 1.01 -0.45 -5.02 116.67 118.56 3kt3 s ASP 219 Ca 0.06 2.22 -0.16 0.00 0.71 0.00 0.00 52.55 55.38 3kt3 s ASP 219 Cb 0.07 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.38 3kt3 s ASP 219 CO 0.62 -0.65 1.09 0.00 0.21 0.00 0.00 175.17 176.44 3kt3 h ILE 221 N 0.37 0.53 -0.55 0.00 3.07 -1.95 -1.28 117.51 117.71 3kt3 h ILE 221 Ca -0.47 -0.37 -0.02 0.00 1.55 0.00 0.00 64.86 65.55 3kt3 h ILE 221 Cb 1.24 1.24 -0.03 0.00 -0.27 0.00 0.00 36.82 39.00 3kt3 h ILE 221 CO 0.56 0.08 0.26 1.23 -1.05 0.00 0.00 178.15 179.23 3kt3 h GLY 222 N 0.61 0.82 0.53 0.16 0.00 -1.98 -1.78 103.07 101.43 3kt3 h GLY 222 Ca -0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 3kt3 h GLY 222 CO 0.01 0.36 -0.07 0.50 0.00 0.00 0.00 176.54 177.34 3kt3 h LYS 223 N 0.77 0.12 -0.99 4.80 1.57 -1.58 -2.53 116.57 118.72 3kt3 h LYS 223 Ca 0.19 -0.07 0.15 0.00 -1.87 0.00 0.00 60.65 59.05 3kt3 h LYS 223 Cb 0.09 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.31 3kt3 h LYS 223 CO -0.03 0.65 0.62 0.74 -0.57 0.00 0.00 179.45 180.86 3kt3 h PHE 224 N -0.41 1.07 0.06 -1.35 -1.00 -1.41 -2.82 116.94 111.08 3kt3 h PHE 224 Ca 0.00 0.03 -0.24 0.00 2.81 0.00 0.00 57.97 60.58 3kt3 h PHE 224 Cb 0.65 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.86 3kt3 h PHE 224 CO 0.12 0.35 -1.08 1.25 -1.61 0.00 0.00 178.31 177.34 3kt3 h HIS 225 N 0.86 0.28 -0.67 -0.55 2.76 -1.33 -3.40 115.15 113.10 3kt3 h HIS 225 Ca 0.52 -0.19 0.14 0.00 -2.20 0.00 0.00 60.37 58.65 3kt3 h HIS 225 Cb 0.69 -0.02 -0.11 0.00 1.55 0.00 0.00 27.41 29.53 3kt3 h HIS 225 CO -0.00 1.12 0.04 0.35 -1.30 0.00 0.00 177.93 178.14 3kt3 h PHE 226 N 0.06 0.03 -0.86 5.26 3.57 -1.18 -1.41 116.94 122.41 3kt3 h PHE 226 Ca -0.07 0.05 0.33 0.00 3.53 0.00 0.00 57.97 61.81 3kt3 h PHE 226 Cb 1.80 0.09 -0.16 0.00 2.79 0.00 0.00 35.95 40.47 3kt3 h PHE 226 CO 0.03 -0.16 0.35 0.00 -2.23 0.00 0.00 178.31 176.30 3kt3 n ALA 227 N -2.79 0.77 -0.31 2.41 0.00 -1.26 0.93 120.51 120.25 3kt3 n ALA 227 Ca 0.11 0.89 0.17 0.00 0.00 0.00 0.00 53.44 54.62 3kt3 n ALA 227 Cb 0.40 -0.83 0.36 0.00 0.00 0.00 0.00 19.45 19.39 3kt3 n ALA 227 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3kt3 h SER 228 N 0.00 0.20 -0.03 0.00 0.02 -1.57 0.21 113.55 112.39 3kt3 h SER 228 Ca 0.68 0.20 -0.03 0.00 -0.84 0.00 0.00 61.79 61.79 3kt3 h SER 228 Cb 1.72 0.22 0.00 0.00 0.14 0.00 0.00 62.40 64.48 3kt3 h SER 228 CO -0.70 -0.15 -0.10 0.40 -1.14 0.00 0.00 176.83 175.13 3kt3 h ILE 229 N 0.25 1.49 -0.33 3.27 2.04 0.36 0.15 117.51 124.74 3kt3 h ILE 229 Ca 0.63 -1.58 -0.05 0.00 1.00 0.00 0.00 64.86 64.86 3kt3 h ILE 229 Cb 1.34 2.47 -0.02 0.00 -0.74 0.00 0.00 36.82 39.87 3kt3 h ILE 229 CO -0.64 0.43 -0.00 -0.61 0.00 0.00 0.00 178.15 177.32 3kt3 h GLN 230 N -0.48 0.52 -0.11 2.37 4.15 -1.43 -2.77 115.11 117.36 3kt3 h GLN 230 Ca -0.01 -0.11 -0.20 0.00 0.77 0.00 0.00 58.65 59.10 3kt3 h GLN 230 Cb 0.75 -0.08 0.01 0.00 0.21 0.00 0.00 27.48 28.38 3kt3 h GLN 230 CO 0.02 0.55 -0.72 0.82 -1.93 0.00 0.00 178.83 177.57 3kt3 h ILE 231 N 0.50 1.31 -0.77 2.39 2.04 -0.58 -3.32 117.51 119.08 3kt3 h ILE 231 Ca 0.11 -1.97 -0.00 0.00 1.00 0.00 0.00 64.86 64.00 3kt3 h ILE 231 Cb 0.32 2.12 -0.04 0.00 -0.74 0.00 0.00 36.82 38.49 3kt3 h ILE 231 CO 0.01 0.61 0.48 0.00 0.00 0.00 0.00 178.15 179.25 3kt3 h ALA 232 N 0.50 1.39 0.00 1.87 0.00 -0.46 -1.92 119.26 120.63 3kt3 h ALA 232 Ca -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3kt3 h ALA 232 Cb 1.36 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3kt3 h ALA 232 CO 0.15 0.54 0.00 -2.37 0.00 0.00 0.00 179.25 177.56 3kt3 n THR 233 N -4.39 0.98 0.50 0.00 5.66 -1.07 -1.63 114.28 114.33 3kt3 n THR 233 Ca 0.08 0.25 0.12 0.00 -3.05 0.00 0.00 64.05 61.46 3kt3 n THR 233 Cb 0.05 -1.05 0.46 0.00 -1.55 0.00 0.00 70.33 68.24 3kt3 n THR 233 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3kt3 n ALA 234 N -1.56 1.93 -2.77 1.79 0.00 -0.72 -4.78 120.51 114.40 3kt3 n ALA 234 Ca 0.03 0.04 -0.35 0.00 0.00 0.00 0.00 53.44 53.16 3kt3 n ALA 234 Cb 0.18 -1.42 -0.09 0.00 0.00 0.00 0.00 19.45 18.11 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 -3.22 3.21 0.46 0.00 0.08 -0.65 -4.45 117.98 113.42 3kt3 s PHE 235 Ca 0.07 0.13 0.25 0.00 0.12 0.00 0.00 56.93 57.51 3kt3 s PHE 235 Cb 0.11 -1.90 1.45 0.00 -0.57 0.00 0.00 43.02 42.11 3kt3 s PHE 235 CO 0.48 0.36 2.10 -1.00 -0.10 0.00 0.00 175.22 177.06 3kt3 h PRO 236 N 5.71 0.00 -0.04 0.24 0.13 -1.81 -2.49 132.00 133.74 3kt3 h PRO 236 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.69 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 0.60 0.10 0.17 0.66 -0.23 0.00 0.00 178.00 179.30 3kt3 h SER 237 N 0.00 0.00 0.84 1.44 4.64 -1.85 0.17 113.55 118.79 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 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3kt3 h SER 237 CO 0.01 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.77 3kt3 n SER 238 N -3.15 0.39 -3.21 4.97 7.64 -0.94 -4.11 113.62 115.21 3kt3 n SER 238 Ca -0.02 0.57 -0.24 0.00 1.01 0.00 0.00 58.87 60.20 3kt3 n SER 238 Cb 0.24 -0.66 -0.06 0.00 -1.01 0.00 0.00 64.21 62.72 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 -1.91 0.98 0.14 1.43 3.72 0.60 -3.85 117.46 118.58 3kt3 n PHE 239 Ca 0.04 -3.78 0.00 0.00 -0.05 0.00 0.00 57.45 53.66 3kt3 n PHE 239 Cb 0.27 -0.42 0.17 0.00 -0.94 0.00 0.00 39.48 38.55 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 3.72 0.00 -0.32 -1.08 0.13 -1.71 -0.61 132.00 132.13 3kt3 h PRO 240 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3kt3 h PRO 240 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3kt3 h PRO 240 CO 0.58 0.59 0.00 0.09 -0.23 0.00 0.00 178.00 179.03 3kt3 n ASN 241 N -3.62 2.96 -0.04 1.44 3.02 -1.26 -3.30 115.26 114.46 3kt3 n ASN 241 Ca -0.01 -1.87 -0.09 0.00 -0.03 0.00 0.00 54.58 52.58 3kt3 n ASN 241 Cb 0.64 -0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 39.57 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 0.96 0.52 -0.11 2.41 0.31 -1.17 -3.44 118.33 117.80 3kt3 n VAL 242 Ca 0.14 -0.10 -0.24 0.00 -0.01 0.00 0.00 64.34 64.13 3kt3 n VAL 242 Cb 0.47 -1.63 -0.11 0.00 -0.91 0.00 0.00 33.84 31.66 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 -3.41 1.91 -2.31 7.52 4.77 -0.27 -1.76 117.00 123.45 3kt3 n LEU 243 Ca -0.17 0.39 -0.18 0.00 -0.03 0.00 0.00 56.01 56.02 3kt3 n LEU 243 Cb 0.60 -0.93 0.01 0.00 -2.33 0.00 0.00 43.42 40.77 3kt3 n LEU 243 CO 0.01 0.37 -0.11 0.61 -1.33 0.00 0.00 177.39 176.95 3kt3 n GLY 244 N 1.41 -0.35 3.87 -0.72 0.00 -1.01 -4.87 105.19 103.52 3kt3 n GLY 244 Ca -0.38 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.29 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 -5.41 4.09 0.80 0.99 1.43 -1.26 -5.09 118.68 114.22 3kt3 s LEU 245 Ca 0.13 0.05 -0.15 0.00 -1.03 0.00 0.00 54.13 53.13 3kt3 s LEU 245 Cb -0.06 -2.68 0.01 0.00 0.03 0.00 0.00 46.19 43.48 3kt3 s LEU 245 CO 0.16 0.08 0.67 -2.65 0.23 0.00 0.00 176.35 174.84 3kt3 n PRO 246 N -0.32 0.15 0.20 1.29 -0.02 -1.26 -4.75 135.00 130.29 3kt3 n PRO 246 Ca -0.07 0.10 0.08 0.00 -2.02 0.00 0.00 63.50 61.59 3kt3 n PRO 246 Cb 0.54 -1.99 0.60 0.00 -0.02 0.00 0.00 33.50 32.63 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 -0.76 0.09 -0.31 2.55 3.45 -1.95 -2.47 116.42 117.01 3kt3 h ASP 247 Ca -0.45 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.01 3kt3 h ASP 247 Cb 1.32 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 40.07 3kt3 h ASP 247 CO 0.41 0.06 0.00 0.29 -1.57 0.00 0.00 179.24 178.44 3kt3 n LYS 248 N -4.52 1.77 -2.30 3.56 5.02 -1.26 -4.33 118.16 116.11 3kt3 n LYS 248 Ca -0.01 -1.20 -0.43 0.00 -2.02 0.00 0.00 58.31 54.65 3kt3 n LYS 248 Cb 0.11 -1.28 -0.02 0.00 -0.02 0.00 0.00 35.03 33.81 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 -1.58 4.02 0.72 -0.18 2.01 -0.93 -4.32 115.64 115.37 3kt3 s THR 249 Ca 0.24 1.20 -0.10 0.00 0.31 0.00 0.00 61.69 63.34 3kt3 s THR 249 Cb 0.13 -3.90 0.05 0.00 0.01 0.00 0.00 72.50 68.79 3kt3 s THR 249 CO 0.17 -0.25 1.07 -2.16 -0.69 0.00 0.00 174.62 172.77 3kt3 s PRO 250 N 4.00 2.42 0.30 4.92 0.04 -1.26 -4.45 135.00 140.96 3kt3 s PRO 250 Ca 0.61 0.10 0.11 0.00 0.04 0.00 0.00 61.00 61.87 3kt3 s PRO 250 Cb -0.23 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 3kt3 s PRO 250 CO 0.22 -1.22 -0.16 0.00 0.04 0.00 0.00 177.00 175.88 3kt3 s LEU 252 N -3.55 3.43 -0.39 0.00 2.96 -0.12 0.25 118.68 121.28 3kt3 s LEU 252 Ca 0.31 -0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 53.99 3kt3 s LEU 252 Cb -0.03 -1.90 0.07 0.00 0.50 0.00 0.00 46.19 44.84 3kt3 s LEU 252 CO 0.16 0.03 0.20 -0.63 -1.32 0.00 0.00 176.35 174.79 3kt3 s ILE 253 N 1.20 3.93 0.12 6.68 1.01 0.19 -2.01 121.20 132.32 3kt3 s ILE 253 Ca 0.04 -1.41 -0.26 0.00 0.00 0.00 0.00 60.65 59.02 3kt3 s ILE 253 Cb -0.14 -3.38 -0.07 0.00 0.01 0.00 0.00 42.46 38.87 3kt3 s ILE 253 CO 0.03 -0.42 0.81 -2.84 0.00 0.00 0.00 174.94 172.51 3kt3 s PRO 254 N 1.37 4.58 -0.10 2.79 0.02 -1.25 -1.51 135.00 140.91 3kt3 s PRO 254 Ca 0.02 1.19 -0.33 0.00 0.02 0.00 0.00 61.00 61.90 3kt3 s PRO 254 Cb -0.22 -3.32 0.13 0.00 0.02 0.00 0.00 34.50 31.12 3kt3 s PRO 254 CO 0.01 0.41 1.29 0.00 -0.33 0.00 0.00 177.00 178.38 3kt3 s ALA 256 N -2.34 2.56 0.25 0.00 0.00 -1.26 -0.77 121.76 120.20 3kt3 s ALA 256 Ca 0.13 0.23 0.27 0.00 0.00 0.00 0.00 51.96 52.58 3kt3 s ALA 256 Cb 0.03 -3.22 1.45 0.00 0.00 0.00 0.00 23.12 21.37 3kt3 s ALA 256 CO -0.04 -1.30 1.79 0.97 0.00 0.00 0.00 175.76 177.18 3kt3 h ILE 257 N -0.55 0.00 0.00 0.00 6.09 -1.82 -2.49 117.51 118.74 3kt3 h ILE 257 Ca -0.45 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.01 3kt3 h ILE 257 Cb 1.22 0.59 -0.00 0.00 0.47 0.00 0.00 36.82 39.10 3kt3 h ILE 257 CO 0.55 0.00 -0.16 -2.24 -3.07 0.00 0.00 178.15 173.23 3kt3 h ASP 258 N 0.00 0.00 0.32 2.19 2.03 -1.89 -2.66 116.42 116.41 3kt3 h ASP 258 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3kt3 h ASP 258 Cb 0.30 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.80 3kt3 h ASP 258 CO 0.00 0.16 -0.14 0.00 -1.03 0.00 0.00 179.24 178.23 3kt3 n GLN 259 N -3.56 0.75 -0.28 4.15 1.13 -0.94 -2.92 117.38 115.72 3kt3 n GLN 259 Ca -0.01 -0.31 -0.03 0.00 -1.94 0.00 0.00 57.00 54.70 3kt3 n GLN 259 Cb 0.30 -1.49 0.08 0.00 0.11 0.00 0.00 30.24 29.24 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 0.77 0.83 -0.75 1.08 1.82 -1.66 -2.79 116.42 115.71 3kt3 h ASP 260 Ca 0.00 -0.01 0.15 0.00 -0.39 0.00 0.00 57.03 56.78 3kt3 h ASP 260 Cb 0.39 -0.19 -0.05 0.00 0.68 0.00 0.00 39.33 40.16 3kt3 h ASP 260 CO 0.00 0.58 0.50 1.55 -1.61 0.00 0.00 179.24 180.26 3kt3 h PRO 261 N 0.98 0.38 -0.67 0.28 0.13 -1.82 0.17 132.00 131.45 3kt3 h PRO 261 Ca 0.30 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 65.45 3kt3 h PRO 261 Cb -0.03 -0.09 -0.05 0.00 0.13 0.00 0.00 31.00 30.96 3kt3 h PRO 261 CO -0.09 0.25 0.40 1.88 -0.23 0.00 0.00 178.00 180.21 3kt3 h TYR 262 N 0.40 0.74 -0.00 1.56 -1.99 -1.82 -3.10 116.97 112.75 3kt3 h TYR 262 Ca 0.37 0.02 0.00 0.00 2.00 0.00 0.00 58.73 61.12 3kt3 h TYR 262 Cb 0.86 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 39.36 3kt3 h TYR 262 CO -0.00 0.39 -0.53 1.19 -0.00 0.00 0.00 178.16 179.21 3kt3 n PHE 263 N -4.73 0.00 0.04 4.88 3.01 0.00 -2.19 117.46 118.48 3kt3 n PHE 263 Ca 0.08 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.47 3kt3 n PHE 263 Cb 0.13 -0.12 0.12 0.00 -0.01 0.00 0.00 39.48 39.59 3kt3 n PHE 263 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 3kt3 h ARG 264 N 0.76 0.40 0.05 -1.08 2.43 -0.71 -2.23 114.38 114.00 3kt3 h ARG 264 Ca 0.00 -0.24 -0.28 0.00 -0.81 0.00 0.00 59.98 58.65 3kt3 h ARG 264 Cb 0.54 0.02 0.02 0.00 -0.42 0.00 0.00 29.97 30.14 3kt3 h ARG 264 CO 0.00 0.82 -1.13 0.28 -1.51 0.00 0.00 179.97 178.43 3kt3 h VAL 265 N 0.31 1.28 -0.66 0.20 2.07 -1.48 -2.89 116.25 115.09 3kt3 h VAL 265 Ca 0.01 -2.34 0.09 0.00 0.82 0.00 0.00 66.70 65.28 3kt3 h VAL 265 Cb 1.01 2.51 -0.07 0.00 -1.52 0.00 0.00 31.29 33.22 3kt3 h VAL 265 CO 0.09 0.72 0.29 0.00 0.02 0.00 0.00 177.57 178.69 3kt3 h ARG 267 N 0.51 0.55 0.00 0.00 3.08 -1.46 0.63 114.38 117.69 3kt3 h ARG 267 Ca 0.33 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 3kt3 h ARG 267 Cb 0.37 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 3kt3 h ARG 267 CO -0.28 0.65 -0.06 0.22 -1.07 0.00 0.00 179.97 179.43 3kt3 h ASP 268 N 0.37 0.00 0.31 7.04 3.58 -1.20 -2.97 116.42 123.55 3kt3 h ASP 268 Ca 0.10 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 57.22 3kt3 h ASP 268 Cb 0.38 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.40 3kt3 h ASP 268 CO 0.01 0.06 -1.84 0.52 -2.88 0.00 0.00 179.24 175.10 3kt3 n VAL 269 N -4.28 1.71 -0.28 2.25 0.31 -0.15 -4.48 118.33 113.40 3kt3 n VAL 269 Ca -0.03 -0.73 0.01 0.00 -0.01 0.00 0.00 64.34 63.58 3kt3 n VAL 269 Cb 0.14 -1.40 0.07 0.00 -0.91 0.00 0.00 33.84 31.74 3kt3 n VAL 269 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kt3 h ALA 270 N 0.53 0.36 -0.41 3.52 0.00 -0.70 -1.94 119.26 120.63 3kt3 h ALA 270 Ca -0.35 0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3kt3 h ALA 270 Cb 2.03 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 20.51 3kt3 h ALA 270 CO 0.09 -0.49 0.12 0.38 0.00 0.00 0.00 179.25 179.34 3kt3 h ASP 271 N -0.04 0.60 -0.72 0.00 3.04 -1.71 0.84 116.42 118.44 3kt3 h ASP 271 Ca 0.35 -0.22 0.15 0.00 -3.24 0.00 0.00 57.03 54.08 3kt3 h ASP 271 Cb 0.59 -0.16 -0.05 0.00 -1.04 0.00 0.00 39.33 38.67 3kt3 h ASP 271 CO -0.83 0.66 0.49 0.11 -2.04 0.00 0.00 179.24 177.63 3kt3 h LYS 272 N 0.52 0.33 -0.34 4.15 1.57 -1.59 -0.79 116.57 120.42 3kt3 h LYS 272 Ca 0.13 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3kt3 h LYS 272 Cb 0.28 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3kt3 h LYS 272 CO -0.00 0.22 0.00 1.28 -0.57 0.00 0.00 179.45 180.38 3kt3 n LEU 273 N -4.46 2.37 -2.03 2.94 4.77 -1.04 -4.92 117.00 114.62 3kt3 n LEU 273 Ca 0.14 -1.08 -0.20 0.00 -0.03 0.00 0.00 56.01 54.84 3kt3 n LEU 273 Cb 0.55 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 3kt3 n LEU 273 CO 0.34 0.54 -0.23 0.29 -1.33 0.00 0.00 177.39 176.99 3kt3 n LYS 274 N 0.78 -1.51 -3.51 3.23 4.76 -0.30 -5.02 118.16 116.59 3kt3 n LYS 274 Ca 0.17 1.02 -0.23 0.00 -2.87 0.00 0.00 58.31 56.40 3kt3 n LYS 274 Cb 0.41 -5.54 0.01 0.00 -1.84 0.00 0.00 35.03 28.07 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 -2.91 1.79 -0.12 2.13 2.02 0.26 -4.66 117.35 115.87 3kt3 s TYR 275 Ca 0.00 -0.72 -0.06 0.00 -0.37 0.00 0.00 57.07 55.91 3kt3 s TYR 275 Cb 0.00 -2.08 -0.04 0.00 -0.40 0.00 0.00 41.96 39.45 3kt3 s TYR 275 CO 0.00 -0.64 0.12 -1.12 -1.57 0.00 0.00 175.55 172.35 3kt3 s SER 276 N -4.39 6.26 0.31 2.29 0.01 -1.26 -3.91 113.70 113.01 3kt3 s SER 276 Ca 0.47 0.43 -0.29 0.00 1.31 0.00 0.00 55.95 57.86 3kt3 s SER 276 Cb -0.04 -2.00 -0.11 0.00 0.21 0.00 0.00 66.02 64.08 3kt3 s SER 276 CO 0.29 0.41 1.46 -0.54 0.41 0.00 0.00 173.24 175.26 3kt3 s LYS 277 N -1.02 4.22 0.54 12.44 1.02 -1.26 -4.73 119.74 130.95 3kt3 s LYS 277 Ca 0.15 2.41 -0.16 0.00 0.02 0.00 0.00 55.97 58.39 3kt3 s LYS 277 Cb -0.12 -3.05 -0.07 0.00 -0.52 0.00 0.00 37.83 34.08 3kt3 s LYS 277 CO 0.04 -0.44 1.01 -1.25 -0.92 0.00 0.00 175.35 173.78 3kt3 s PRO 278 N -1.12 3.77 0.13 -1.68 0.04 -1.26 -4.56 135.00 130.31 3kt3 s PRO 278 Ca 0.56 1.01 -0.04 0.00 0.04 0.00 0.00 61.00 62.57 3kt3 s PRO 278 Cb -0.44 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 31.94 3kt3 s PRO 278 CO 0.51 -0.43 0.35 0.00 0.04 0.00 0.00 177.00 177.47 3kt3 s ALA 279 N -2.62 3.83 0.01 8.56 0.00 0.14 -4.84 121.76 126.85 3kt3 s ALA 279 Ca 0.60 -0.61 0.07 0.00 0.00 0.00 0.00 51.96 52.02 3kt3 s ALA 279 Cb -0.11 -2.07 -0.02 0.00 0.00 0.00 0.00 23.12 20.91 3kt3 s ALA 279 CO 0.34 0.70 -0.21 -0.51 0.00 0.00 0.00 175.76 176.08 3kt3 s LEU 280 N -2.61 2.10 -0.22 0.00 1.43 0.25 0.55 118.68 120.18 3kt3 s LEU 280 Ca 0.40 -0.44 -0.00 0.00 -1.03 0.00 0.00 54.13 53.05 3kt3 s LEU 280 Cb -0.12 -1.02 0.06 0.00 0.03 0.00 0.00 46.19 45.13 3kt3 s LEU 280 CO 0.25 0.21 -0.03 -0.76 0.23 0.00 0.00 176.35 176.25 3kt3 s LEU 281 N -0.81 2.13 -0.19 1.79 1.43 -0.57 -1.66 118.68 120.80 3kt3 s LEU 281 Ca 0.08 -1.03 -0.12 0.00 -1.03 0.00 0.00 54.13 52.03 3kt3 s LEU 281 Cb -0.08 -1.01 -0.05 0.00 0.03 0.00 0.00 46.19 45.08 3kt3 s LEU 281 CO 0.00 -0.25 0.21 -1.00 0.23 0.00 0.00 176.35 175.55 3kt3 s HIS 282 N 1.53 3.40 0.37 0.29 3.76 0.22 -1.69 115.29 123.18 3kt3 s HIS 282 Ca -0.04 0.42 0.02 0.00 -0.15 0.00 0.00 55.06 55.31 3kt3 s HIS 282 Cb -0.18 -2.27 -0.02 0.00 1.11 0.00 0.00 32.58 31.22 3kt3 s HIS 282 CO -0.07 0.20 0.56 -1.54 -0.85 0.00 0.00 174.74 173.05 3kt3 s SER 283 N 0.59 6.06 0.92 1.40 1.04 0.05 -1.52 113.70 122.26 3kt3 s SER 283 Ca 0.12 0.24 -0.13 0.00 0.48 0.00 0.00 55.95 56.66 3kt3 s SER 283 Cb -0.12 -1.68 0.15 0.00 0.10 0.00 0.00 66.02 64.46 3kt3 s SER 283 CO 0.02 -0.45 1.14 -0.13 0.98 0.00 0.00 173.24 174.80 3kt3 s ARG 284 N -4.35 1.04 -0.01 4.02 0.52 0.50 -2.58 118.95 118.09 3kt3 s ARG 284 Ca 0.43 0.26 -0.24 0.00 -0.52 0.00 0.00 55.73 55.67 3kt3 s ARG 284 Cb -0.10 -1.83 -0.05 0.00 0.52 0.00 0.00 34.95 33.50 3kt3 s ARG 284 CO 0.35 -2.26 0.72 -0.06 0.02 0.00 0.00 175.30 174.08 3kt3 s PHE 285 N -3.28 3.66 -0.24 -0.53 0.08 -1.26 -4.87 117.98 111.54 3kt3 s PHE 285 Ca 0.64 1.35 -0.29 0.00 0.12 0.00 0.00 56.93 58.75 3kt3 s PHE 285 Cb -0.14 -2.80 -0.02 0.00 -0.57 0.00 0.00 43.02 39.49 3kt3 s PHE 285 CO 0.53 0.19 1.57 0.12 -0.10 0.00 0.00 175.22 177.54 3kt3 s PHE 286 N 0.34 2.18 0.69 0.36 5.36 -1.26 -4.97 117.98 120.69 3kt3 s PHE 286 Ca 0.38 0.59 -0.15 0.00 -0.96 0.00 0.00 56.93 56.78 3kt3 s PHE 286 Cb -0.19 -3.98 0.02 0.00 -0.34 0.00 0.00 43.02 38.53 3kt3 s PHE 286 CO 0.20 -2.76 1.17 -2.14 -1.46 0.00 0.00 175.22 170.24 3kt3 s PRO 287 N 4.63 2.44 0.53 10.12 0.02 -1.26 -1.08 135.00 150.41 3kt3 s PRO 287 Ca 0.69 1.64 -0.18 0.00 0.02 0.00 0.00 61.00 63.18 3kt3 s PRO 287 Cb -0.24 -1.88 -0.06 0.00 0.02 0.00 0.00 34.50 32.34 3kt3 s PRO 287 CO 0.28 -1.58 1.03 0.00 -0.33 0.00 0.00 177.00 176.41 3kt3 s ALA 288 N -2.06 2.86 0.31 -1.55 0.00 -0.74 -4.23 121.76 116.34 3kt3 s ALA 288 Ca 0.72 0.43 0.05 0.00 0.00 0.00 0.00 51.96 53.16 3kt3 s ALA 288 Cb -0.26 -3.21 0.82 0.00 0.00 0.00 0.00 23.12 20.46 3kt3 s ALA 288 CO 0.43 -0.48 1.61 -0.07 0.00 0.00 0.00 175.76 177.24 3kt3 h LEU 289 N 0.99 -0.10 -1.35 0.00 4.07 -1.85 -0.39 115.31 116.68 3kt3 h LEU 289 Ca -0.48 0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.71 3kt3 h LEU 289 Cb 1.21 0.34 0.00 0.00 1.08 0.00 0.00 40.66 43.29 3kt3 h LEU 289 CO 0.59 -0.26 0.00 1.56 -1.08 0.00 0.00 178.44 179.25 3kt3 h GLN 290 N 0.12 0.00 0.00 1.13 1.08 -1.85 0.43 115.11 116.01 3kt3 h GLN 290 Ca 0.61 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.81 3kt3 h GLN 290 Cb 1.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.74 3kt3 h GLN 290 CO -0.76 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 177.53 3kt3 n GLY 291 N -0.73 0.99 3.63 3.46 0.00 -0.16 -4.53 105.19 107.85 3kt3 n GLY 291 Ca -0.00 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.72 3kt3 n GLY 291 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kt3 s SER 292 N -0.57 1.08 0.00 1.61 0.01 -1.26 -3.53 113.70 111.04 3kt3 s SER 292 Ca 0.00 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.81 3kt3 s SER 292 Cb 0.00 -0.73 0.00 0.00 0.21 0.00 0.00 66.02 65.50 3kt3 s SER 292 CO 0.00 -4.02 0.00 1.07 0.41 0.00 0.00 173.24 170.70 3kt3 n THR 293 N -4.68 0.00 -4.06 1.44 5.66 -1.26 -4.90 114.28 106.49 3kt3 n THR 293 Ca 0.14 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.98 3kt3 n THR 293 Cb 0.60 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.22 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 -2.82 0.31 0.44 1.09 2.01 -1.26 -3.62 115.64 111.80 3kt3 s THR 294 Ca 0.00 -0.08 -0.18 0.00 0.31 0.00 0.00 61.69 61.74 3kt3 s THR 294 Cb 0.00 -0.32 -0.09 0.00 0.01 0.00 0.00 72.50 72.10 3kt3 s THR 294 CO 0.00 0.13 0.91 -1.59 -0.69 0.00 0.00 174.62 173.38 3kt3 s LYS 295 N 0.43 4.06 -0.03 4.92 -2.85 -1.26 -1.79 119.74 123.22 3kt3 s LYS 295 Ca -0.05 0.94 -0.30 0.00 -1.00 0.00 0.00 55.97 55.56 3kt3 s LYS 295 Cb -0.08 -2.22 -0.06 0.00 -2.06 0.00 0.00 37.83 33.41 3kt3 s LYS 295 CO -0.01 -0.08 1.56 1.41 0.10 0.00 0.00 175.35 178.33 3kt3 s MET 296 N -3.51 4.21 0.04 1.78 -2.45 -0.24 -4.34 119.30 114.80 3kt3 s MET 296 Ca 0.59 2.11 0.07 0.00 -1.25 0.00 0.00 55.69 57.21 3kt3 s MET 296 Cb -0.10 -3.80 -0.02 0.00 1.25 0.00 0.00 34.83 32.16 3kt3 s MET 296 CO 0.21 -0.75 -0.19 -1.12 1.05 0.00 0.00 175.02 174.23 3kt3 s SER 297 N 2.69 2.24 0.29 1.11 0.01 -1.26 -4.89 113.70 113.90 3kt3 s SER 297 Ca 0.69 -0.50 0.03 0.00 1.31 0.00 0.00 55.95 57.49 3kt3 s SER 297 Cb -0.33 -0.18 0.45 0.00 0.21 0.00 0.00 66.02 66.18 3kt3 s SER 297 CO 0.28 0.12 1.74 0.00 0.41 0.00 0.00 173.24 175.80 3kt3 h ALA 298 N 4.88 1.15 0.00 1.44 0.00 -1.97 -2.87 119.26 121.89 3kt3 h ALA 298 Ca -0.41 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.17 3kt3 h ALA 298 Cb 1.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3kt3 h ALA 298 CO 0.44 0.54 0.00 -1.13 0.00 0.00 0.00 179.25 179.10 3kt3 n SER 299 N -4.13 0.27 -3.39 0.00 3.41 -1.26 -3.84 113.62 104.67 3kt3 n SER 299 Ca -0.00 -0.74 -0.27 0.00 -0.26 0.00 0.00 58.87 57.60 3kt3 n SER 299 Cb 0.39 -0.14 -0.10 0.00 -0.26 0.00 0.00 64.21 64.10 3kt3 n SER 299 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3kt3 s ASP 300 N -0.89 1.82 0.63 4.04 3.68 -1.08 -5.13 116.67 119.73 3kt3 s ASP 300 Ca 0.00 -2.67 -0.19 0.00 2.13 0.00 0.00 52.55 51.82 3kt3 s ASP 300 Cb 0.00 -0.31 -0.02 0.00 -1.45 0.00 0.00 42.92 41.14 3kt3 s ASP 300 CO 0.00 -0.22 1.28 -1.81 0.13 0.00 0.00 175.17 174.55 3kt3 s ASP 301 N 0.48 4.79 -1.21 -0.34 1.11 -1.25 -2.63 116.67 117.62 3kt3 s ASP 301 Ca 0.27 2.59 0.00 0.00 0.18 0.00 0.00 52.55 55.59 3kt3 s ASP 301 Cb -0.06 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.31 3kt3 s ASP 301 CO -0.12 -1.88 0.00 0.41 1.18 0.00 0.00 175.17 174.76 3kt3 n THR 302 N -1.76 0.00 -0.75 -1.27 -1.04 -1.26 -4.67 114.28 103.53 3kt3 n THR 302 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.16 3kt3 n THR 302 Cb 0.48 -1.42 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 3kt3 n THR 302 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 3kt3 n THR 303 N -2.41 0.06 -4.16 12.58 -1.04 -1.08 -4.94 114.28 113.29 3kt3 n THR 303 Ca -0.11 -0.15 -0.16 0.00 -2.04 0.00 0.00 64.05 61.58 3kt3 n THR 303 Cb 0.51 1.55 -0.12 0.00 -1.82 0.00 0.00 70.33 70.45 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 -0.06 0.81 -0.28 2.41 0.00 -1.19 -2.84 121.76 120.61 3kt3 s ALA 304 Ca 0.00 -0.76 -0.07 0.00 0.00 0.00 0.00 51.96 51.13 3kt3 s ALA 304 Cb 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 3kt3 s ALA 304 CO 0.00 0.09 0.08 0.42 0.00 0.00 0.00 175.76 176.34 3kt3 s ILE 305 N -1.08 4.11 0.16 0.00 1.01 -1.26 -5.01 121.20 119.13 3kt3 s ILE 305 Ca -0.04 -0.47 -0.09 0.00 0.00 0.00 0.00 60.65 60.04 3kt3 s ILE 305 Cb -0.08 -3.03 -0.06 0.00 0.01 0.00 0.00 42.46 39.29 3kt3 s ILE 305 CO 0.01 0.19 0.47 -0.36 0.00 0.00 0.00 174.94 175.25 3kt3 s PHE 306 N 1.55 3.50 -1.07 3.97 0.08 -1.26 -1.36 117.98 123.38 3kt3 s PHE 306 Ca 0.04 0.79 0.01 0.00 0.12 0.00 0.00 56.93 57.89 3kt3 s PHE 306 Cb -0.16 -2.18 0.03 0.00 -0.57 0.00 0.00 43.02 40.14 3kt3 s PHE 306 CO 0.03 0.39 0.98 -1.33 -0.10 0.00 0.00 175.22 175.19 3kt3 n MET 307 N 0.27 0.00 0.07 0.44 2.81 -0.96 -0.65 117.12 119.11 3kt3 n MET 307 Ca -0.03 0.45 0.11 0.00 -1.81 0.00 0.00 57.70 56.43 3kt3 n MET 307 Cb 0.52 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.55 3kt3 n MET 307 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3kt3 n THR 308 N -1.46 0.44 -1.71 2.03 -1.04 -1.26 -4.73 114.28 106.54 3kt3 n THR 308 Ca 0.00 -0.44 -0.43 0.00 -2.04 0.00 0.00 64.05 61.14 3kt3 n THR 308 Cb 0.01 -0.17 -0.01 0.00 -1.82 0.00 0.00 70.33 68.33 3kt3 n THR 308 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3kt3 n ASP 309 N -2.42 3.19 -4.83 8.00 8.00 0.18 -5.01 116.55 123.66 3kt3 n ASP 309 Ca 0.00 1.17 -0.31 0.00 0.71 0.00 0.00 54.79 56.36 3kt3 n ASP 309 Cb 0.51 -1.51 0.03 0.00 -0.02 0.00 0.00 41.12 40.13 3kt3 n ASP 309 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3kt3 s THR 310 N -0.47 4.25 0.26 -3.53 -4.23 -1.26 -4.84 115.64 105.82 3kt3 s THR 310 Ca 0.61 0.80 -0.04 0.00 -1.18 0.00 0.00 61.69 61.88 3kt3 s THR 310 Cb -0.56 -3.57 0.28 0.00 1.34 0.00 0.00 72.50 69.99 3kt3 s THR 310 CO 0.55 -0.89 1.64 -0.65 -0.54 0.00 0.00 174.62 174.73 3kt3 h PRO 311 N -0.30 0.14 -0.98 3.99 0.11 -1.94 -0.58 132.00 132.43 3kt3 h PRO 311 Ca -0.44 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.67 3kt3 h PRO 311 Cb 1.20 -0.03 -0.05 0.00 0.11 0.00 0.00 31.00 32.23 3kt3 h PRO 311 CO 0.59 0.09 0.65 -0.22 -0.21 0.00 0.00 178.00 178.90 3kt3 h LYS 312 N 0.14 1.29 -0.23 1.05 3.64 -2.00 -2.52 116.57 117.94 3kt3 h LYS 312 Ca 0.45 -0.08 -0.18 0.00 -1.27 0.00 0.00 60.65 59.57 3kt3 h LYS 312 Cb 0.83 -0.29 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 3kt3 h LYS 312 CO -0.65 0.85 -0.58 1.96 -2.27 0.00 0.00 179.45 178.75 3kt3 h GLN 313 N 1.33 0.73 -0.52 1.90 4.20 -1.52 -2.27 115.11 118.96 3kt3 h GLN 313 Ca 0.36 -0.49 0.00 0.00 0.06 0.00 0.00 58.65 58.59 3kt3 h GLN 313 Cb -0.14 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 3kt3 h GLN 313 CO -0.08 1.11 0.34 0.82 -0.67 0.00 0.00 178.83 180.35 3kt3 h ILE 314 N 0.55 1.14 -0.12 2.54 2.04 -1.13 -1.70 117.51 120.84 3kt3 h ILE 314 Ca 0.00 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.60 3kt3 h ILE 314 Cb 1.17 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3kt3 h ILE 314 CO 0.12 0.14 0.06 -0.61 0.00 0.00 0.00 178.15 177.86 3kt3 h GLN 315 N 0.71 0.13 -0.00 2.37 4.15 -1.36 -2.30 115.11 118.81 3kt3 h GLN 315 Ca 0.19 -0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.47 3kt3 h GLN 315 Cb -0.07 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 3kt3 h GLN 315 CO -0.04 0.09 -0.61 0.87 -1.93 0.00 0.00 178.83 177.20 3kt3 h LYS 316 N 0.14 0.00 -0.23 1.69 1.57 -1.32 -1.46 116.57 116.96 3kt3 h LYS 316 Ca 0.05 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 3kt3 h LYS 316 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 3kt3 h LYS 316 CO -0.03 0.61 -0.09 0.87 -0.57 0.00 0.00 179.45 180.24 3kt3 h LYS 317 N 0.00 0.47 -0.25 3.15 1.57 -1.22 -0.53 116.57 119.76 3kt3 h LYS 317 Ca -0.01 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 3kt3 h LYS 317 Cb 1.08 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 3kt3 h LYS 317 CO 0.08 0.73 0.04 0.82 -0.57 0.00 0.00 179.45 180.55 3kt3 h ILE 318 N 0.18 1.23 -0.31 1.86 1.08 -1.35 -0.18 117.51 120.03 3kt3 h ILE 318 Ca 0.05 -0.76 -0.06 0.00 -0.39 0.00 0.00 64.86 63.70 3kt3 h ILE 318 Cb 0.58 1.26 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 3kt3 h ILE 318 CO 0.03 0.24 -0.06 0.78 -0.69 0.00 0.00 178.15 178.45 3kt3 h ASN 319 N 0.22 0.58 0.65 1.72 2.35 -1.30 -2.76 115.58 117.04 3kt3 h ASN 319 Ca 0.07 -0.35 -0.27 0.00 -0.55 0.00 0.00 56.30 55.20 3kt3 h ASN 319 Cb 0.32 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 3kt3 h ASN 319 CO 0.00 0.80 -1.42 0.50 -1.65 0.00 0.00 177.43 175.66 3kt3 h LYS 320 N 0.35 0.07 0.00 0.81 3.64 -1.14 -3.42 116.57 116.88 3kt3 h LYS 320 Ca 0.08 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 3kt3 h LYS 320 Cb 0.54 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3kt3 h LYS 320 CO 0.03 0.85 -1.15 0.66 -2.27 0.00 0.00 179.45 177.57 3kt3 n TYR 321 N -3.27 0.00 -1.84 1.91 4.02 -0.10 -5.00 117.16 112.88 3kt3 n TYR 321 Ca -0.11 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.36 3kt3 n TYR 321 Cb 1.01 -0.10 -0.03 0.00 -0.02 0.00 0.00 39.34 40.20 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 -2.09 3.63 0.12 -0.72 0.00 -1.04 -4.07 121.76 117.59 3kt3 s ALA 322 Ca -0.01 1.19 -0.31 0.00 0.00 0.00 0.00 51.96 52.82 3kt3 s ALA 322 Cb 0.01 -3.77 -0.08 0.00 0.00 0.00 0.00 23.12 19.27 3kt3 s ALA 322 CO 0.10 -1.38 1.45 0.12 0.00 0.00 0.00 175.76 176.05 3kt3 s PHE 323 N 3.78 3.14 -0.15 0.00 5.36 0.14 -4.92 117.98 125.33 3kt3 s PHE 323 Ca 0.80 0.83 -0.10 0.00 -0.96 0.00 0.00 56.93 57.49 3kt3 s PHE 323 Cb -0.39 -3.76 -0.05 0.00 -0.34 0.00 0.00 43.02 38.48 3kt3 s PHE 323 CO 0.35 -2.74 0.19 0.45 -1.46 0.00 0.00 175.22 172.01 3kt3 s SER 324 N 1.21 6.36 0.00 6.13 0.15 -1.26 -1.59 113.70 124.70 3kt3 s SER 324 Ca 0.66 0.42 0.14 0.00 0.70 0.00 0.00 55.95 57.87 3kt3 s SER 324 Cb -0.39 -2.12 0.40 0.00 -1.71 0.00 0.00 66.02 62.21 3kt3 s SER 324 CO 0.30 0.24 1.33 0.61 1.20 0.00 0.00 173.24 176.93 3kt3 n GLY 325 N 2.88 0.92 0.00 9.45 0.00 -1.26 -4.90 105.19 112.29 3kt3 n GLY 325 Ca -0.16 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 1.17 3.90 3.95 -0.02 0.00 -1.26 0.24 105.19 113.16 3kt3 n GLY 326 Ca 0.14 -2.13 -0.25 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.80 3.45 0.10 1.61 -1.52 -1.26 -4.98 119.66 116.25 3kt3 s GLN 327 Ca 0.00 -0.63 -0.13 0.00 -1.95 0.00 0.00 55.36 52.65 3kt3 s GLN 327 Cb 0.00 -2.93 -0.14 0.00 -0.22 0.00 0.00 33.01 29.71 3kt3 s GLN 327 CO 0.00 0.48 1.32 -0.24 -0.25 0.00 0.00 175.29 176.60 3kt3 h VAL 328 N 1.48 1.28 -3.05 1.09 3.04 -2.00 -3.44 116.25 114.66 3kt3 h VAL 328 Ca -0.49 -1.89 -0.60 0.00 -1.01 0.00 0.00 66.70 62.70 3kt3 h VAL 328 Cb 1.20 1.92 -0.04 0.00 -2.01 0.00 0.00 31.29 32.36 3kt3 h VAL 328 CO 0.66 0.60 -0.36 -0.94 -1.01 0.00 0.00 177.57 176.52 3kt3 s SER 329 N -7.02 6.47 0.13 3.17 1.04 -1.26 -5.02 113.70 111.22 3kt3 s SER 329 Ca -0.11 0.53 -0.21 0.00 0.48 0.00 0.00 55.95 56.64 3kt3 s SER 329 Cb 0.09 -2.07 -0.01 0.00 0.10 0.00 0.00 66.02 64.13 3kt3 s SER 329 CO 0.89 0.13 1.68 0.00 0.98 0.00 0.00 173.24 176.92 3kt3 h ALA 330 N 3.19 0.01 -0.04 5.32 0.00 -1.99 -1.64 119.26 124.11 3kt3 h ALA 330 Ca -0.47 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.54 3kt3 h ALA 330 Cb 1.17 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 3kt3 h ALA 330 CO 0.71 -0.56 -0.14 -0.44 0.00 0.00 0.00 179.25 178.83 3kt3 h ASP 331 N -0.12 -0.41 0.50 0.00 5.19 -1.98 -0.00 116.42 119.58 3kt3 h ASP 331 Ca 0.11 0.07 -0.07 0.00 -0.62 0.00 0.00 57.03 56.51 3kt3 h ASP 331 Cb 0.28 0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.96 3kt3 h ASP 331 CO -0.25 -0.19 -0.33 0.25 -3.12 0.00 0.00 179.24 175.59 3kt3 h LEU 332 N -0.21 0.00 -0.27 1.55 5.85 -1.96 -0.84 115.31 119.42 3kt3 h LEU 332 Ca 0.06 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.72 3kt3 h LEU 332 Cb 0.30 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3kt3 h LEU 332 CO -0.16 0.33 -0.07 -0.74 -0.34 0.00 0.00 178.44 177.46 3kt3 h HIS 333 N 0.00 0.59 -0.50 1.25 2.76 -0.75 0.10 115.15 118.60 3kt3 h HIS 333 Ca -0.00 -0.13 -0.01 0.00 -2.20 0.00 0.00 60.37 58.02 3kt3 h HIS 333 Cb 0.67 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.47 3kt3 h HIS 333 CO 0.00 0.73 0.25 0.00 -1.30 0.00 0.00 177.93 177.61 3kt3 h ARG 334 N 0.27 0.70 0.03 5.26 3.08 -0.50 0.40 114.38 123.62 3kt3 h ARG 334 Ca 0.07 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3kt3 h ARG 334 Cb 0.55 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3kt3 h ARG 334 CO 0.03 0.54 -0.02 1.49 -1.07 0.00 0.00 179.97 180.94 3kt3 h GLU 335 N 0.70 -0.04 0.00 0.04 4.81 -1.04 -3.40 114.58 115.65 3kt3 h GLU 335 Ca 0.18 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.21 3kt3 h GLU 335 Cb 0.06 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 3kt3 h GLU 335 CO -0.03 0.58 -1.75 1.28 -0.73 0.00 0.00 179.01 178.37 3kt3 n LEU 336 N -4.79 0.54 0.00 1.64 4.77 0.34 -5.03 117.00 114.46 3kt3 n LEU 336 Ca -0.09 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3kt3 n LEU 336 Cb 0.32 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 3kt3 n LEU 336 CO 0.31 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3kt3 n GLY 337 N 1.47 -1.33 3.49 -0.72 0.00 0.14 -4.93 105.19 103.31 3kt3 n GLY 337 Ca -0.15 -1.55 -0.25 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.41 1.97 -0.57 -0.02 0.00 0.13 -4.50 107.32 101.92 3kt3 s GLY 338 Ca 0.00 -1.94 -0.08 0.00 0.00 0.00 0.00 44.72 42.71 3kt3 s GLY 338 CO 0.00 -1.99 0.44 0.21 0.00 0.00 0.00 173.10 171.76 3kt3 s ASN 339 N -3.54 5.72 0.53 1.64 2.47 0.14 -3.61 114.94 118.30 3kt3 s ASN 339 Ca 0.31 -2.33 0.19 0.00 0.42 0.00 0.00 52.86 51.45 3kt3 s ASN 339 Cb -0.03 -1.99 1.39 0.00 -1.45 0.00 0.00 41.25 39.17 3kt3 s ASN 339 CO 0.15 -0.57 2.16 1.55 -3.72 0.00 0.00 177.10 176.67 3kt3 h PRO 340 N 7.89 0.00 -0.17 0.43 0.13 -1.88 -2.44 132.00 135.96 3kt3 h PRO 340 Ca -0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.01 3kt3 h PRO 340 Cb 1.03 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 3kt3 h PRO 340 CO 0.79 0.00 -0.00 -0.44 -0.23 0.00 0.00 178.00 178.11 3kt3 h ASP 341 N 0.00 0.22 -0.11 1.44 3.32 -1.97 -2.59 116.42 116.73 3kt3 h ASP 341 Ca 0.02 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3kt3 h ASP 341 Cb 0.09 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3kt3 h ASP 341 CO -0.00 0.27 0.00 1.33 -1.72 0.00 0.00 179.24 179.12 3kt3 n VAL 342 N -4.39 0.18 -2.80 -1.35 0.24 -0.98 -4.94 118.33 104.29 3kt3 n VAL 342 Ca -0.00 -0.59 -0.43 0.00 -2.04 0.00 0.00 64.34 61.28 3kt3 n VAL 342 Cb 0.17 1.18 -0.04 0.00 -1.47 0.00 0.00 33.84 33.68 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 -1.25 6.63 0.12 -1.34 -1.08 -0.96 -4.36 116.67 114.43 3kt3 s ASP 343 Ca 0.21 0.45 -0.20 0.00 -0.52 0.00 0.00 52.55 52.49 3kt3 s ASP 343 Cb 0.14 -2.46 -0.05 0.00 -1.46 0.00 0.00 42.92 39.08 3kt3 s ASP 343 CO 0.20 -0.93 1.75 0.58 0.52 0.00 0.00 175.17 177.29 3kt3 h VAL 344 N 5.91 0.95 -0.91 1.11 2.07 -1.60 -0.56 116.25 123.22 3kt3 h VAL 344 Ca -0.23 -0.05 0.13 0.00 0.82 0.00 0.00 66.70 67.37 3kt3 h VAL 344 Cb 1.08 0.79 -0.09 0.00 -1.52 0.00 0.00 31.29 31.55 3kt3 h VAL 344 CO 1.00 0.03 0.52 0.00 0.02 0.00 0.00 177.57 179.14 3kt3 h ALA 345 N 1.12 1.37 -0.37 1.67 0.00 -1.91 0.12 119.26 121.26 3kt3 h ALA 345 Ca 0.08 0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 3kt3 h ALA 345 Cb 0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3kt3 h ALA 345 CO -0.09 0.05 -0.41 -0.92 0.00 0.00 0.00 179.25 177.88 3kt3 h TYR 346 N 0.79 1.12 -0.60 0.00 5.03 -1.71 -2.25 116.97 119.34 3kt3 h TYR 346 Ca 0.47 -0.34 -0.00 0.00 2.58 0.00 0.00 58.73 61.43 3kt3 h TYR 346 Cb 0.57 -0.23 -0.03 0.00 1.55 0.00 0.00 36.73 38.59 3kt3 h TYR 346 CO -0.05 1.17 0.36 1.96 -1.32 0.00 0.00 178.16 180.28 3kt3 h GLN 347 N 0.75 0.81 -0.79 1.82 1.08 -0.04 -1.64 115.11 117.10 3kt3 h GLN 347 Ca 0.05 -0.08 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 3kt3 h GLN 347 Cb 1.01 -0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 28.23 3kt3 h GLN 347 CO 0.10 0.59 0.41 1.88 -0.95 0.00 0.00 178.83 180.86 3kt3 h TYR 348 N 0.81 1.11 -0.84 2.96 -1.99 -0.78 -2.48 116.97 115.75 3kt3 h TYR 348 Ca 0.21 -0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.90 3kt3 h TYR 348 Cb -0.01 -0.35 -0.04 0.00 2.00 0.00 0.00 36.73 38.33 3kt3 h TYR 348 CO -0.02 0.79 0.49 -0.07 -0.00 0.00 0.00 178.16 179.35 3kt3 h LEU 349 N 1.11 1.02 -1.69 3.88 3.38 -1.07 -1.37 115.31 120.56 3kt3 h LEU 349 Ca 0.28 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 3kt3 h LEU 349 Cb 0.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3kt3 h LEU 349 CO -0.04 0.79 -0.19 0.77 0.09 0.00 0.00 178.44 179.87 3kt3 h SER 350 N 1.15 0.00 0.33 -0.43 4.64 -0.86 0.70 113.55 119.07 3kt3 h SER 350 Ca 0.30 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.29 3kt3 h SER 350 Cb -0.03 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.09 3kt3 h SER 350 CO -0.05 0.19 -1.49 -0.26 -0.87 0.00 0.00 176.83 174.34 3kt3 h PHE 351 N 0.00 0.83 -0.26 4.77 -1.00 -1.16 -3.40 116.94 116.73 3kt3 h PHE 351 Ca -0.00 -0.61 0.00 0.00 2.81 0.00 0.00 57.97 60.17 3kt3 h PHE 351 Cb 0.38 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.91 3kt3 h PHE 351 CO 0.00 1.53 0.00 1.19 -1.61 0.00 0.00 178.31 179.42 3kt3 n PHE 352 N -3.65 0.33 -3.96 -0.55 3.72 -0.55 -4.88 117.46 107.92 3kt3 n PHE 352 Ca -0.17 -0.25 -0.29 0.00 -0.05 0.00 0.00 57.45 56.70 3kt3 n PHE 352 Cb 1.09 -0.01 -0.17 0.00 -0.94 0.00 0.00 39.48 39.45 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 -1.16 1.87 -0.85 -1.08 2.20 0.21 -4.93 119.74 115.98 3kt3 s LYS 353 Ca 0.26 -0.48 -0.18 0.00 -0.36 0.00 0.00 55.97 55.21 3kt3 s LYS 353 Cb 0.15 -1.95 0.15 0.00 -1.51 0.00 0.00 37.83 34.67 3kt3 s LYS 353 CO 0.21 -0.30 0.98 0.34 -0.36 0.00 0.00 175.35 176.22 3kt3 s ASP 354 N 1.58 6.59 -0.35 1.43 2.15 -1.26 -4.78 116.67 122.03 3kt3 s ASP 354 Ca 0.04 -2.09 -0.05 0.00 0.43 0.00 0.00 52.55 50.88 3kt3 s ASP 354 Cb -0.13 -2.34 0.19 0.00 -0.30 0.00 0.00 42.92 40.33 3kt3 s ASP 354 CO -0.09 -0.96 0.94 -0.62 -0.17 0.00 0.00 175.17 174.27 3kt3 s ASP 355 N 3.25 -0.65 0.28 -0.34 -1.08 -1.26 -5.05 116.67 111.83 3kt3 s ASP 355 Ca 0.26 -0.35 -0.03 0.00 -0.52 0.00 0.00 52.55 51.91 3kt3 s ASP 355 Cb -0.09 0.83 0.37 0.00 -1.46 0.00 0.00 42.92 42.57 3kt3 s ASP 355 CO -0.07 -0.07 1.92 0.44 0.52 0.00 0.00 175.17 177.91 3kt3 h ASP 356 N 5.76 0.98 0.25 -0.34 3.32 -2.00 -2.17 116.42 122.23 3kt3 h ASP 356 Ca -0.01 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 3kt3 h ASP 356 Cb 1.22 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.52 3kt3 h ASP 356 CO -0.03 0.76 -0.12 0.58 -1.72 0.00 0.00 179.24 178.71 3kt3 h VAL 357 N 1.12 0.77 -0.86 -1.35 2.07 -1.99 -0.63 116.25 115.39 3kt3 h VAL 357 Ca 0.29 -0.12 0.11 0.00 0.82 0.00 0.00 66.70 67.80 3kt3 h VAL 357 Cb -0.03 0.84 -0.08 0.00 -1.52 0.00 0.00 31.29 30.50 3kt3 h VAL 357 CO -0.05 0.03 0.49 0.15 0.02 0.00 0.00 177.57 178.21 3kt3 h PHE 358 N -0.40 0.89 -0.19 1.57 3.04 -1.92 -1.64 116.94 118.29 3kt3 h PHE 358 Ca -0.03 0.03 -0.19 0.00 3.98 0.00 0.00 57.97 61.76 3kt3 h PHE 358 Cb 0.30 -0.27 0.00 0.00 2.56 0.00 0.00 35.95 38.55 3kt3 h PHE 358 CO -0.04 0.34 -0.65 -0.07 -2.02 0.00 0.00 178.31 175.86 3kt3 h LEU 359 N 0.79 0.79 -0.52 0.59 4.07 -1.25 -1.61 115.31 118.17 3kt3 h LEU 359 Ca 0.43 -0.47 -0.01 0.00 0.08 0.00 0.00 57.88 57.91 3kt3 h LEU 359 Cb 0.44 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.92 3kt3 h LEU 359 CO -0.27 1.23 0.29 0.50 -1.08 0.00 0.00 178.44 179.11 3kt3 h LYS 360 N 0.50 0.71 -0.27 1.13 1.63 -0.70 -1.57 116.57 118.01 3kt3 h LYS 360 Ca -0.01 -0.08 -0.15 0.00 -0.85 0.00 0.00 60.65 59.56 3kt3 h LYS 360 Cb 1.24 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 32.73 3kt3 h LYS 360 CO 0.13 0.54 -0.42 0.93 -3.45 0.00 0.00 179.45 177.18 3kt3 h GLU 361 N 0.69 0.77 -0.12 1.90 5.08 -1.27 -2.07 114.58 119.56 3kt3 h GLU 361 Ca 0.18 -0.46 0.01 0.00 -1.00 0.00 0.00 59.36 58.09 3kt3 h GLU 361 Cb 0.03 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3kt3 h GLU 361 CO -0.03 1.09 0.04 0.00 -1.00 0.00 0.00 179.01 179.11 3kt3 h TYR 363 N 0.09 -0.66 -0.25 0.00 3.20 -1.23 -1.12 116.97 117.00 3kt3 h TYR 363 Ca 0.05 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 3kt3 h TYR 363 Cb 0.03 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 3kt3 h TYR 363 CO -0.11 -0.33 -0.10 -0.44 -1.64 0.00 0.00 178.16 175.54 3kt3 h ASP 364 N -0.35 0.52 0.73 -2.11 3.32 -1.27 -2.57 116.42 114.68 3kt3 h ASP 364 Ca 0.08 -0.40 0.00 0.00 0.02 0.00 0.00 57.03 56.73 3kt3 h ASP 364 Cb 0.47 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.87 3kt3 h ASP 364 CO -0.26 0.80 0.00 0.11 -1.72 0.00 0.00 179.24 178.17 3kt3 h LYS 365 N 0.23 0.00 0.17 3.56 6.56 -0.72 -1.90 116.57 124.47 3kt3 h LYS 365 Ca 0.06 0.00 -0.28 0.00 -1.06 0.00 0.00 60.65 59.37 3kt3 h LYS 365 Cb 0.59 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.27 3kt3 h LYS 365 CO 0.03 0.00 -1.32 -0.92 -2.06 0.00 0.00 179.45 175.18 3kt3 h TYR 366 N 0.00 0.63 -0.38 -1.35 3.20 -1.00 0.23 116.97 118.30 3kt3 h TYR 366 Ca 0.00 -0.46 -0.06 0.00 3.14 0.00 0.00 58.73 61.35 3kt3 h TYR 366 Cb 0.37 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 3kt3 h TYR 366 CO 0.00 1.51 -0.02 0.87 -1.64 0.00 0.00 178.16 178.88 3kt3 h LYS 367 N -0.16 0.61 -0.00 1.82 1.57 -1.20 0.39 116.57 119.60 3kt3 h LYS 367 Ca -0.26 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 3kt3 h LYS 367 Cb 1.87 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 34.10 3kt3 h LYS 367 CO 0.15 0.65 -0.02 -1.13 -0.57 0.00 0.00 179.45 178.53 3kt3 n SER 368 N -4.24 0.02 0.00 0.86 3.41 -0.74 -4.08 113.62 108.86 3kt3 n SER 368 Ca 0.02 0.46 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 3kt3 n SER 368 Cb 0.28 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 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 1.50 0.53 0.10 5.00 0.00 -0.86 -4.72 105.19 106.73 3kt3 n GLY 369 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 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 1.11 0.00 -4.94 1.61 5.08 -1.23 -3.33 114.58 112.87 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 0.01 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.09 3kt3 h GLU 370 CO 0.00 0.78 -0.45 -1.17 -1.00 0.00 0.00 179.01 177.17 3kt3 s LEU 371 N -6.83 4.07 0.66 1.33 0.20 0.59 -5.01 118.68 113.70 3kt3 s LEU 371 Ca 0.01 0.02 -0.12 0.00 0.69 0.00 0.00 54.13 54.73 3kt3 s LEU 371 Cb 0.10 -2.19 -0.01 0.00 -0.43 0.00 0.00 46.19 43.66 3kt3 s LEU 371 CO 0.78 -0.10 1.05 -0.76 -0.29 0.00 0.00 176.35 177.04 3kt3 s LEU 372 N 1.83 3.24 0.13 -0.68 1.43 -1.26 -4.62 118.68 118.76 3kt3 s LEU 372 Ca 0.09 1.64 -0.19 0.00 -1.03 0.00 0.00 54.13 54.64 3kt3 s LEU 372 Cb -0.16 -4.50 -0.03 0.00 0.03 0.00 0.00 46.19 41.53 3kt3 s LEU 372 CO 0.11 -1.29 1.77 -1.28 0.23 0.00 0.00 176.35 175.88 3kt3 h SER 373 N -0.36 0.18 0.01 2.29 0.87 -1.97 -0.63 113.55 113.94 3kt3 h SER 373 Ca -0.45 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.12 3kt3 h SER 373 Cb 1.21 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 63.14 3kt3 h SER 373 CO 0.58 0.14 -0.02 1.23 -0.53 0.00 0.00 176.83 178.23 3kt3 h GLY 374 N 0.26 0.04 0.94 5.77 0.00 -1.93 -0.37 103.07 107.79 3kt3 h GLY 374 Ca 0.10 -0.02 -0.20 0.00 0.00 0.00 0.00 47.33 47.21 3kt3 h GLY 374 CO -0.07 0.02 -0.80 0.83 0.00 0.00 0.00 176.54 176.52 3kt3 h GLU 375 N 0.04 0.51 -0.53 4.80 5.08 -1.82 -1.00 114.58 121.67 3kt3 h GLU 375 Ca 0.01 -0.57 0.07 0.00 -1.00 0.00 0.00 59.36 57.87 3kt3 h GLU 375 Cb 0.07 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.42 3kt3 h GLU 375 CO 0.00 1.20 0.19 1.98 -1.00 0.00 0.00 179.01 181.39 3kt3 h MET 376 N 0.07 0.36 -0.75 2.33 4.05 -0.79 -1.98 114.93 118.22 3kt3 h MET 376 Ca -0.10 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.27 3kt3 h MET 376 Cb 1.50 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 32.18 3kt3 h MET 376 CO 0.16 0.24 0.37 0.87 0.23 0.00 0.00 176.91 178.78 3kt3 h LYS 377 N 0.37 1.08 -0.75 0.39 1.57 -1.05 -1.19 116.57 116.99 3kt3 h LYS 377 Ca 0.26 -0.15 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 3kt3 h LYS 377 Cb 0.29 -0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 3kt3 h LYS 377 CO -0.26 0.83 0.46 0.87 -0.57 0.00 0.00 179.45 180.78 3kt3 h LYS 378 N 1.05 0.86 -0.28 3.15 1.57 -0.76 0.18 116.57 122.34 3kt3 h LYS 378 Ca 0.26 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.94 3kt3 h LYS 378 Cb 0.10 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 3kt3 h LYS 378 CO -0.03 0.57 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.33 3kt3 h LEU 379 N 0.89 0.49 -0.36 2.94 3.38 -1.11 -2.13 115.31 119.40 3kt3 h LEU 379 Ca 0.31 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3kt3 h LEU 379 Cb 0.08 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 3kt3 h LEU 379 CO -0.13 0.70 0.12 0.00 0.09 0.00 0.00 178.44 179.21 3kt3 h ILE 381 N 0.26 0.89 -0.56 0.00 2.04 -0.53 -1.68 117.51 117.93 3kt3 h ILE 381 Ca 0.17 -0.03 0.04 0.00 1.00 0.00 0.00 64.86 66.03 3kt3 h ILE 381 Cb 0.15 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 3kt3 h ILE 381 CO -0.18 0.02 0.32 -0.33 0.00 0.00 0.00 178.15 177.97 3kt3 h GLU 382 N 0.09 0.60 0.39 2.37 5.08 -1.19 0.14 114.58 122.06 3kt3 h GLU 382 Ca 0.09 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3kt3 h GLU 382 Cb 0.10 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3kt3 h GLU 382 CO -0.14 0.40 -0.19 1.15 -1.00 0.00 0.00 179.01 179.24 3kt3 h THR 383 N 0.62 0.61 -0.51 1.13 2.02 -1.11 -2.41 112.91 113.25 3kt3 h THR 383 Ca 0.23 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 67.04 3kt3 h THR 383 Cb 0.08 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 3kt3 h THR 383 CO -0.13 0.06 0.11 -0.07 0.37 0.00 0.00 175.52 175.87 3kt3 h LEU 384 N -0.70 0.74 -0.94 2.58 3.38 -1.29 -2.65 115.31 116.42 3kt3 h LEU 384 Ca -0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3kt3 h LEU 384 Cb 0.50 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 3kt3 h LEU 384 CO 0.09 0.74 0.55 -0.61 0.09 0.00 0.00 178.44 179.29 3kt3 h GLN 385 N 0.76 1.29 0.00 1.13 4.15 -0.62 -0.85 115.11 120.96 3kt3 h GLN 385 Ca 0.17 -0.13 -0.20 0.00 0.77 0.00 0.00 58.65 59.26 3kt3 h GLN 385 Cb 0.30 -0.26 -0.03 0.00 0.21 0.00 0.00 27.48 27.70 3kt3 h GLN 385 CO 0.00 0.91 -1.06 1.05 -1.93 0.00 0.00 178.83 177.80 3kt3 h GLU 386 N 1.30 0.00 0.13 1.69 4.11 -1.31 -1.88 114.58 118.62 3kt3 h GLU 386 Ca 0.34 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.76 3kt3 h GLU 386 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3kt3 h GLU 386 CO -0.06 0.74 -0.06 0.35 0.07 0.00 0.00 179.01 180.05 3kt3 h PHE 387 N 0.00 -0.16 -0.87 2.06 3.57 -1.26 -2.21 116.94 118.07 3kt3 h PHE 387 Ca -0.07 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.43 3kt3 h PHE 387 Cb 1.72 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 40.47 3kt3 h PHE 387 CO 0.00 0.13 0.58 0.28 -2.23 0.00 0.00 178.31 177.07 3kt3 h VAL 388 N -0.45 1.22 -0.56 1.41 2.07 -1.23 -0.81 116.25 117.89 3kt3 h VAL 388 Ca -0.02 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 3kt3 h VAL 388 Cb 0.36 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.04 3kt3 h VAL 388 CO 0.03 0.22 0.32 0.50 0.02 0.00 0.00 177.57 178.66 3kt3 h LYS 389 N 1.18 0.77 -0.28 1.57 3.64 -1.34 -0.03 116.57 122.08 3kt3 h LYS 389 Ca 0.32 -0.08 -0.13 0.00 -1.27 0.00 0.00 60.65 59.49 3kt3 h LYS 389 Cb -0.13 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.52 3kt3 h LYS 389 CO -0.07 0.57 -0.38 0.00 -2.27 0.00 0.00 179.45 177.30 3kt3 h ALA 390 N 1.15 0.81 0.11 5.00 0.00 -1.13 -2.71 119.26 122.50 3kt3 h ALA 390 Ca 0.20 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3kt3 h ALA 390 Cb 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3kt3 h ALA 390 CO -0.04 0.65 -0.05 0.35 0.00 0.00 0.00 179.25 180.16 3kt3 h PHE 391 N 0.54 -0.14 -0.37 0.00 3.57 -0.83 -2.17 116.94 117.54 3kt3 h PHE 391 Ca 0.05 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.56 3kt3 h PHE 391 Cb 0.89 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.66 3kt3 h PHE 391 CO 0.04 -0.05 0.25 1.96 -2.23 0.00 0.00 178.31 178.28 3kt3 h GLN 392 N -0.19 0.43 -0.20 1.11 4.20 -0.94 0.13 115.11 119.65 3kt3 h GLN 392 Ca -0.02 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.55 3kt3 h GLN 392 Cb 0.15 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 3kt3 h GLN 392 CO 0.03 0.29 -0.32 0.93 -0.67 0.00 0.00 178.83 179.08 3kt3 h GLU 393 N 0.45 0.57 -0.51 1.46 5.08 -1.33 -2.15 114.58 118.14 3kt3 h GLU 393 Ca 0.14 -0.35 -0.08 0.00 -1.00 0.00 0.00 59.36 58.08 3kt3 h GLU 393 Cb 0.03 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3kt3 h GLU 393 CO -0.03 0.95 -0.01 0.00 -1.00 0.00 0.00 179.01 178.92 3kt3 h ARG 394 N 0.24 0.87 -0.35 2.33 3.08 -0.87 -2.96 114.38 116.73 3kt3 h ARG 394 Ca 0.02 -0.25 -0.07 0.00 0.07 0.00 0.00 59.98 59.75 3kt3 h ARG 394 Cb 0.91 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 3kt3 h ARG 394 CO 0.07 0.87 -0.08 -0.09 -1.07 0.00 0.00 179.97 179.67 3kt3 h ARG 395 N 0.80 0.58 0.00 0.04 2.43 -0.98 -2.36 114.38 114.90 3kt3 h ARG 395 Ca 0.15 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3kt3 h ARG 395 Cb 0.49 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 3kt3 h ARG 395 CO 0.02 0.67 0.00 0.00 -1.51 0.00 0.00 179.97 179.15 3kt3 h ALA 396 N 1.37 1.00 -0.00 2.80 0.00 -1.21 -1.94 119.26 121.28 3kt3 h ALA 396 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3kt3 h ALA 396 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3kt3 h ALA 396 CO 0.03 0.00 -0.14 1.04 0.00 0.00 0.00 179.25 180.18 3kt3 n GLN 397 N -2.57 0.28 -3.38 0.00 1.13 -0.89 -4.81 117.38 107.15 3kt3 n GLN 397 Ca 0.01 -0.08 -0.41 0.00 -1.94 0.00 0.00 57.00 54.58 3kt3 n GLN 397 Cb 0.20 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 28.96 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 -2.78 5.15 0.32 5.09 1.01 -0.73 -4.95 120.40 123.51 3kt3 s VAL 398 Ca 0.20 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.28 3kt3 s VAL 398 Cb 0.19 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.74 3kt3 s VAL 398 CO 0.54 -0.10 0.02 -0.90 0.00 0.00 0.00 175.10 174.66 3kt3 n ASP 399 N 5.43 2.82 -0.36 3.32 5.68 -1.26 -4.99 116.55 127.18 3kt3 n ASP 399 Ca -0.09 -2.38 0.10 0.00 -0.50 0.00 0.00 54.79 51.93 3kt3 n ASP 399 Cb 0.49 0.20 0.28 0.00 -1.14 0.00 0.00 41.12 40.96 3kt3 n ASP 399 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3kt3 h GLU 400 N 0.00 0.84 -0.54 0.11 4.39 -1.99 -1.62 114.58 115.77 3kt3 h GLU 400 Ca -0.26 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.36 3kt3 h GLU 400 Cb 0.80 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 3kt3 h GLU 400 CO 0.43 0.56 0.24 1.49 -1.16 0.00 0.00 179.01 180.57 3kt3 h GLU 401 N 0.87 0.79 -0.46 2.33 4.81 -1.99 -2.17 114.58 118.75 3kt3 h GLU 401 Ca 0.54 -0.13 -0.13 0.00 -0.13 0.00 0.00 59.36 59.51 3kt3 h GLU 401 Cb 0.71 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 3kt3 h GLU 401 CO -0.33 0.66 -0.24 1.15 -0.73 0.00 0.00 179.01 179.52 3kt3 h THR 402 N 0.73 1.27 -0.31 0.32 2.02 -1.75 -3.05 112.91 112.14 3kt3 h THR 402 Ca 0.18 -1.40 0.06 0.00 0.77 0.00 0.00 66.41 66.02 3kt3 h THR 402 Cb 0.15 1.17 -0.06 0.00 -1.74 0.00 0.00 68.15 67.67 3kt3 h THR 402 CO -0.02 0.48 -0.05 -0.07 0.37 0.00 0.00 175.52 176.23 3kt3 h LEU 403 N 0.82 -0.24 -1.62 2.58 3.38 -1.15 -2.49 115.31 116.59 3kt3 h LEU 403 Ca 0.10 0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.25 3kt3 h LEU 403 Cb 0.81 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 3kt3 h LEU 403 CO 0.07 -0.08 0.40 0.44 0.09 0.00 0.00 178.44 179.36 3kt3 h ASP 404 N 0.03 0.39 0.05 -0.43 3.32 -1.29 0.11 116.42 118.59 3kt3 h ASP 404 Ca 0.15 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.15 3kt3 h ASP 404 Cb 0.22 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3kt3 h ASP 404 CO -0.30 0.24 -0.15 0.11 -1.72 0.00 0.00 179.24 177.42 3kt3 h LYS 405 N 0.43 0.22 0.09 3.56 1.57 -1.38 -1.53 116.57 119.53 3kt3 h LYS 405 Ca 0.27 -0.05 -0.35 0.00 -1.87 0.00 0.00 60.65 58.65 3kt3 h LYS 405 Cb 0.51 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 3kt3 h LYS 405 CO -0.08 0.38 -1.93 1.19 -0.57 0.00 0.00 179.45 178.44 3kt3 n PHE 406 N -4.26 1.15 -0.07 -1.35 3.72 -0.45 -4.70 117.46 111.50 3kt3 n PHE 406 Ca -0.01 0.28 -0.14 0.00 -0.05 0.00 0.00 57.45 57.54 3kt3 n PHE 406 Cb 0.28 -1.17 -0.14 0.00 -0.94 0.00 0.00 39.48 37.52 3kt3 n PHE 406 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3kt3 n MET 407 N -3.35 0.68 -2.21 -1.08 2.81 0.26 -1.81 117.12 112.42 3kt3 n MET 407 Ca -0.28 0.15 -0.42 0.00 -1.81 0.00 0.00 57.70 55.34 3kt3 n MET 407 Cb 1.05 -1.62 -0.03 0.00 -0.71 0.00 0.00 33.22 31.91 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 -2.53 3.74 0.26 2.03 1.01 -0.58 -4.80 120.40 119.52 3kt3 s VAL 408 Ca -0.17 1.08 -0.29 0.00 0.00 0.00 0.00 61.98 62.59 3kt3 s VAL 408 Cb 0.07 -3.69 -0.14 0.00 0.00 0.00 0.00 36.38 32.62 3kt3 s VAL 408 CO 0.76 -0.02 1.09 -2.65 0.00 0.00 0.00 175.10 174.28 3kt3 n PRO 409 N 5.69 1.40 -3.50 2.72 -0.02 -1.26 -4.87 135.00 135.15 3kt3 n PRO 409 Ca 0.14 0.49 -0.14 0.00 -2.02 0.00 0.00 63.50 61.97 3kt3 n PRO 409 Cb 0.44 -1.93 -0.04 0.00 -0.02 0.00 0.00 33.50 31.95 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 -0.76 -0.53 -0.06 6.00 -3.43 -1.26 -5.07 115.29 110.17 3kt3 s HIS 410 Ca 0.63 0.59 -0.30 0.00 -0.80 0.00 0.00 55.06 55.18 3kt3 s HIS 410 Cb -0.73 0.44 -0.04 0.00 -1.43 0.00 0.00 32.58 30.83 3kt3 s HIS 410 CO 0.57 -0.71 1.30 0.21 -2.00 0.00 0.00 174.74 174.10 3kt3 s LYS 411 N -2.62 4.30 0.16 -0.38 2.47 -1.22 -4.34 119.74 118.10 3kt3 s LYS 411 Ca -0.04 1.78 -0.22 0.00 -1.56 0.00 0.00 55.97 55.93 3kt3 s LYS 411 Cb -0.01 -3.63 -0.08 0.00 -1.46 0.00 0.00 37.83 32.66 3kt3 s LYS 411 CO -0.03 -0.56 0.71 -0.51 0.16 0.00 0.00 175.35 175.12 3kt3 s LEU 412 N 2.63 4.52 -0.11 5.43 1.43 -0.72 -4.96 118.68 126.89 3kt3 s LEU 412 Ca 0.59 1.49 0.01 0.00 -1.03 0.00 0.00 54.13 55.20 3kt3 s LEU 412 Cb -0.26 -3.27 -0.01 0.00 0.03 0.00 0.00 46.19 42.67 3kt3 s LEU 412 CO 0.22 0.18 -0.16 -0.69 0.23 0.00 0.00 176.35 176.13 3kt3 s VAL 413 N -1.23 2.79 0.19 -1.59 1.01 -0.43 -4.95 120.40 116.17 3kt3 s VAL 413 Ca 0.36 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 3kt3 s VAL 413 Cb -0.21 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.05 3kt3 s VAL 413 CO 0.23 0.54 0.28 -2.67 0.00 0.00 0.00 175.10 173.48 3kt3 n TRP 414 N 3.37 -1.07 -0.78 5.22 2.14 -1.26 -4.21 117.44 120.85 3kt3 n TRP 414 Ca -0.18 -1.18 0.00 0.00 2.07 0.00 0.00 57.50 58.20 3kt3 n TRP 414 Cb 0.53 0.32 0.00 0.00 -0.81 0.00 0.00 31.31 31.34 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 -0.30 0.86 0.22 -1.67 0.00 -1.11 -4.85 105.19 98.33 3kt3 n GLY 415 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 3kt3 n GLY 415 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kt3 h GLU 416 N 2.08 0.00 -6.97 1.61 5.08 -1.92 -3.47 114.58 110.99 3kt3 h GLU 416 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 3kt3 h GLU 416 Cb 0.00 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.28 3kt3 h GLU 416 CO 0.00 0.07 0.44 0.15 -1.00 0.00 0.00 179.01 178.67 3kt3 s LYS 417 N -3.26 4.04 -0.20 2.33 1.02 -1.26 -4.95 119.74 117.47 3kt3 s LYS 417 Ca 0.06 1.60 -0.29 0.00 0.02 0.00 0.00 55.97 57.36 3kt3 s LYS 417 Cb 0.06 -2.51 -0.04 0.00 -0.52 0.00 0.00 37.83 34.82 3kt3 s LYS 417 CO 0.66 -0.27 1.81 -1.21 -0.92 0.00 0.00 175.35 175.42 3kt3 s GLU 418 N -2.55 3.66 0.33 1.68 8.01 -1.26 -4.97 118.70 123.60 3kt3 s GLU 418 Ca 0.59 1.84 -0.28 0.00 0.01 0.00 0.00 54.97 57.13 3kt3 s GLU 418 Cb -0.24 -4.14 -0.10 0.00 -4.31 0.00 0.00 34.13 25.34 3kt3 s GLU 418 CO 0.30 -1.48 1.24 1.03 0.01 0.00 0.00 175.26 176.36 3kt3 s ARG 419 N 5.10 4.38 0.10 1.61 0.52 -1.26 -4.95 118.95 124.46 3kt3 s ARG 419 Ca 0.81 2.07 0.08 0.00 -0.52 0.00 0.00 55.73 58.17 3kt3 s ARG 419 Cb -0.29 -3.05 -0.21 0.00 0.52 0.00 0.00 34.95 31.92 3kt3 s ARG 419 CO 0.33 -0.11 1.21 -0.07 0.02 0.00 0.00 175.30 176.67 3kt3 h LEU 420 N 3.39 0.00 -7.80 2.53 4.07 -1.93 -3.43 115.31 112.14 3kt3 h LEU 420 Ca -0.48 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 56.95 3kt3 h LEU 420 Cb 1.22 0.00 -0.36 0.00 1.08 0.00 0.00 40.66 42.61 3kt3 h LEU 420 CO 0.65 0.99 -0.81 0.54 -1.08 0.00 0.00 178.44 178.74 3kt3 s VAL 421 N -2.70 1.08 0.50 1.22 0.11 -1.26 -4.97 120.40 114.37 3kt3 s VAL 421 Ca 0.00 -0.36 -0.21 0.00 -2.93 0.00 0.00 61.98 58.48 3kt3 s VAL 421 Cb 0.10 -1.05 -0.07 0.00 -1.53 0.00 0.00 36.38 33.83 3kt3 s VAL 421 CO 0.82 0.36 1.15 0.00 -3.33 0.00 0.00 175.10 174.10 3kt3 s ALA 422 N 1.34 2.85 0.78 1.54 0.00 -1.26 -5.00 121.76 122.01 3kt3 s ALA 422 Ca -0.02 0.89 -0.14 0.00 0.00 0.00 0.00 51.96 52.69 3kt3 s ALA 422 Cb -0.14 -3.37 0.07 0.00 0.00 0.00 0.00 23.12 19.68 3kt3 s ALA 422 CO -0.04 -0.71 1.20 -1.25 0.00 0.00 0.00 175.76 174.95 3kt3 s PRO 423 N -2.96 1.82 -0.48 0.00 0.04 -1.26 -5.01 135.00 127.15 3kt3 s PRO 423 Ca 0.68 1.73 0.06 0.00 0.04 0.00 0.00 61.00 63.51 3kt3 s PRO 423 Cb -0.27 -1.80 0.21 0.00 0.04 0.00 0.00 34.50 32.69 3kt3 s PRO 423 CO 0.31 -2.07 0.50 1.63 0.04 0.00 0.00 177.00 177.41 3kt3 n LYS 424 N -3.12 1.00 0.00 4.56 5.02 0.24 -4.94 118.16 120.91 3kt3 n LYS 424 Ca 0.13 -3.62 0.15 0.00 -2.02 0.00 0.00 58.31 52.96 3kt3 n LYS 424 Cb 0.51 -1.67 0.92 0.00 -0.02 0.00 0.00 35.03 34.76 3kt3 n LYS 424 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53