#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kt0 s ASP 46 N 0.00 6.33 0.28 4.38 -1.08 -1.26 -4.94 116.67 120.38 3kt0 s ASP 46 Ca 0.00 -0.37 0.16 0.00 -0.52 0.00 0.00 52.55 51.82 3kt0 s ASP 46 Cb 0.00 -2.34 0.08 0.00 -1.46 0.00 0.00 42.92 39.20 3kt0 s ASP 46 CO 0.00 -0.86 1.44 1.88 0.52 0.00 0.00 175.17 178.14 3kt0 h TYR 47 N 8.95 0.00 -0.64 -5.34 0.05 -2.05 -2.77 116.97 115.17 3kt0 h TYR 47 Ca -0.26 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.49 3kt0 h TYR 47 Cb 1.09 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.80 3kt0 h TYR 47 CO 0.76 0.47 0.27 -0.44 -1.05 0.00 0.00 178.16 178.16 3kt0 h ASP 48 N 0.00 0.88 -0.60 3.88 3.32 -2.00 -1.66 116.42 120.23 3kt0 h ASP 48 Ca -0.01 -0.16 0.03 0.00 0.02 0.00 0.00 57.03 56.91 3kt0 h ASP 48 Cb 1.36 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.64 3kt0 h ASP 48 CO 0.06 0.80 0.36 0.50 -1.72 0.00 0.00 179.24 179.24 3kt0 h LYS 49 N 0.90 0.68 -0.25 3.56 1.63 -1.96 -2.68 116.57 118.46 3kt0 h LYS 49 Ca 0.22 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.94 3kt0 h LYS 49 Cb 0.19 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 3kt0 h LYS 49 CO -0.02 0.45 0.01 -0.07 -3.45 0.00 0.00 179.45 176.37 3kt0 h LEU 50 N 0.70 0.42 -0.62 5.20 3.38 -1.20 0.13 115.31 123.31 3kt0 h LEU 50 Ca 0.25 -0.29 0.13 0.00 0.09 0.00 0.00 57.88 58.05 3kt0 h LEU 50 Cb 0.06 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 40.58 3kt0 h LEU 50 CO -0.12 0.61 -0.09 0.40 0.09 0.00 0.00 178.44 179.33 3kt0 h ILE 51 N 0.21 0.42 -0.29 1.22 2.04 -1.24 0.25 117.51 120.13 3kt0 h ILE 51 Ca 0.07 -0.02 -0.12 0.00 1.00 0.00 0.00 64.86 65.79 3kt0 h ILE 51 Cb 0.39 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3kt0 h ILE 51 CO 0.01 0.01 -0.29 0.11 0.00 0.00 0.00 178.15 177.99 3kt0 h LYS 52 N 0.05 0.71 -0.65 2.37 1.57 -1.16 0.13 116.57 119.58 3kt0 h LYS 52 Ca 0.31 -0.38 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 3kt0 h LYS 52 Cb 0.50 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 3kt0 h LYS 52 CO -0.59 0.99 0.13 1.96 -0.57 0.00 0.00 179.45 181.36 3kt0 h GLN 53 N 0.46 1.07 0.00 3.15 4.20 -0.28 -3.08 115.11 120.62 3kt0 h GLN 53 Ca 0.05 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.48 3kt0 h GLN 53 Cb 0.86 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.51 3kt0 h GLN 53 CO 0.07 0.97 -0.59 0.74 -0.67 0.00 0.00 178.83 179.36 3kt0 h PHE 54 N 0.99 0.00 -1.71 2.96 0.04 -0.53 -3.48 116.94 115.21 3kt0 h PHE 54 Ca 0.20 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.87 3kt0 h PHE 54 Cb 0.41 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.58 3kt0 h PHE 54 CO 0.03 0.00 -0.16 0.41 -0.60 0.00 0.00 178.31 177.99 3kt0 n GLY 55 N 1.24 0.44 4.00 -1.45 0.00 0.35 -5.00 105.19 104.78 3kt0 n GLY 55 Ca 0.02 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.30 3kt0 n GLY 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kt0 s THR 56 N -2.80 2.17 -0.27 2.61 -4.23 -0.67 -5.03 115.64 107.40 3kt0 s THR 56 Ca 0.10 -0.71 -0.08 0.00 -1.18 0.00 0.00 61.69 59.81 3kt0 s THR 56 Cb -0.04 -2.46 -0.02 0.00 1.34 0.00 0.00 72.50 71.32 3kt0 s THR 56 CO 0.12 0.00 0.10 -0.75 -0.54 0.00 0.00 174.62 173.55 3kt0 s LYS 57 N -4.99 3.51 0.49 3.99 2.20 -0.51 -4.83 119.74 119.59 3kt0 s LYS 57 Ca 0.65 -0.58 -0.24 0.00 -0.36 0.00 0.00 55.97 55.44 3kt0 s LYS 57 Cb -0.06 -3.42 -0.07 0.00 -1.51 0.00 0.00 37.83 32.78 3kt0 s LYS 57 CO 0.43 -0.28 1.39 -1.25 -0.36 0.00 0.00 175.35 175.27 3kt0 s PRO 58 N 1.61 3.48 -0.14 4.03 0.04 -1.26 -0.25 135.00 142.52 3kt0 s PRO 58 Ca 0.05 2.32 -0.27 0.00 0.04 0.00 0.00 61.00 63.15 3kt0 s PRO 58 Cb -0.16 -2.50 -0.01 0.00 0.04 0.00 0.00 34.50 31.87 3kt0 s PRO 58 CO 0.05 -0.95 0.89 0.08 0.04 0.00 0.00 177.00 177.11 3kt0 s VAL 59 N -1.25 4.85 0.03 -0.36 1.01 0.79 -4.80 120.40 120.67 3kt0 s VAL 59 Ca 0.65 1.78 0.01 0.00 0.00 0.00 0.00 61.98 64.42 3kt0 s VAL 59 Cb -0.42 -4.20 -0.00 0.00 0.00 0.00 0.00 36.38 31.76 3kt0 s VAL 59 CO 0.52 0.03 0.02 -0.46 0.00 0.00 0.00 175.10 175.21 3kt0 n ASN 60 N 5.04 0.46 -0.12 3.32 0.23 -1.26 -4.87 115.26 118.06 3kt0 n ASN 60 Ca 0.06 -1.20 0.04 0.00 -0.53 0.00 0.00 54.58 52.95 3kt0 n ASN 60 Cb 0.49 0.12 0.35 0.00 -2.08 0.00 0.00 39.78 38.66 3kt0 n ASN 60 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3kt0 h GLU 61 N 0.00 0.73 -0.33 -3.83 4.39 -1.99 -2.14 114.58 111.41 3kt0 h GLU 61 Ca -0.03 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 3kt0 h GLU 61 Cb 0.11 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 3kt0 h GLU 61 CO 0.04 0.48 0.15 1.49 -1.16 0.00 0.00 179.01 180.01 3kt0 h GLU 62 N 0.75 0.47 -0.43 2.33 4.57 -1.98 0.03 114.58 120.33 3kt0 h GLU 62 Ca 0.24 -0.07 0.08 0.00 -1.18 0.00 0.00 59.36 58.42 3kt0 h GLU 62 Cb 0.03 -0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 28.47 3kt0 h GLU 62 CO -0.06 0.44 0.03 1.15 -1.18 0.00 0.00 179.01 179.39 3kt0 h THR 63 N 0.39 0.71 -0.40 0.32 2.02 -1.78 0.11 112.91 114.27 3kt0 h THR 63 Ca 0.11 -0.05 -0.14 0.00 0.77 0.00 0.00 66.41 67.10 3kt0 h THR 63 Cb 0.13 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 3kt0 h THR 63 CO -0.01 0.03 -0.31 -0.07 0.37 0.00 0.00 175.52 175.52 3kt0 h LEU 64 N 0.14 0.92 0.31 2.58 3.38 -1.27 -0.16 115.31 121.21 3kt0 h LEU 64 Ca 0.21 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 3kt0 h LEU 64 Cb 0.29 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3kt0 h LEU 64 CO -0.33 1.15 -0.16 0.50 0.09 0.00 0.00 178.44 179.70 3kt0 h LYS 65 N 0.74 -0.41 -0.82 1.13 3.64 -0.68 -1.75 116.57 118.42 3kt0 h LYS 65 Ca 0.08 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3kt0 h LYS 65 Cb 0.88 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.75 3kt0 h LYS 65 CO 0.08 -0.27 0.42 -0.09 -2.27 0.00 0.00 179.45 177.31 3kt0 h ARG 66 N -0.43 1.16 -0.63 1.90 2.43 -0.88 -1.81 114.38 116.12 3kt0 h ARG 66 Ca -0.04 -0.15 0.08 0.00 -0.81 0.00 0.00 59.98 59.06 3kt0 h ARG 66 Cb 0.33 -0.22 -0.07 0.00 -0.42 0.00 0.00 29.97 29.60 3kt0 h ARG 66 CO 0.06 0.87 0.28 0.35 -1.51 0.00 0.00 179.97 180.02 3kt0 h PHE 67 N 1.15 0.50 -0.26 2.20 3.57 -0.87 -0.32 116.94 122.92 3kt0 h PHE 67 Ca 0.28 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 3kt0 h PHE 67 Cb 0.07 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 3kt0 h PHE 67 CO 0.01 0.18 0.12 -0.22 -2.23 0.00 0.00 178.31 176.17 3kt0 h LYS 68 N 0.50 0.37 -0.52 1.11 3.11 -0.53 -1.83 116.57 118.79 3kt0 h LYS 68 Ca 0.31 -0.05 -0.07 0.00 -2.81 0.00 0.00 60.65 58.02 3kt0 h LYS 68 Cb 0.32 -0.07 -0.02 0.00 -1.00 0.00 0.00 32.23 31.46 3kt0 h LYS 68 CO -0.26 0.37 0.05 1.96 -2.81 0.00 0.00 179.45 178.76 3kt0 h GLN 69 N 0.28 0.83 -0.02 1.90 4.20 -1.05 0.23 115.11 121.49 3kt0 h GLN 69 Ca 0.09 -0.21 -0.24 0.00 0.06 0.00 0.00 58.65 58.35 3kt0 h GLN 69 Cb 0.12 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 27.80 3kt0 h GLN 69 CO -0.01 0.80 -0.96 0.28 -0.67 0.00 0.00 178.83 178.27 3kt0 h VAL 70 N 0.79 1.33 0.00 -0.54 2.07 -0.96 -3.38 116.25 115.56 3kt0 h VAL 70 Ca 0.16 -2.30 -0.15 0.00 0.82 0.00 0.00 66.70 65.23 3kt0 h VAL 70 Cb 0.40 2.34 -0.03 0.00 -1.52 0.00 0.00 31.29 32.49 3kt0 h VAL 70 CO 0.01 0.70 -2.00 0.35 0.02 0.00 0.00 177.57 176.65 3kt0 n THR 71 N -3.81 0.57 -0.93 2.57 -2.24 -0.70 -4.73 114.28 105.01 3kt0 n THR 71 Ca -0.08 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 3kt0 n THR 71 Cb 0.84 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 3kt0 n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kt0 n GLY 72 N 1.70 0.75 3.55 3.38 0.00 0.81 -4.34 105.19 111.04 3kt0 n GLY 72 Ca -0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 3kt0 n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kt0 s ARG 73 N -0.07 2.09 0.33 1.61 1.81 -1.25 -5.03 118.95 118.45 3kt0 s ARG 73 Ca 0.00 -1.02 -0.29 0.00 -1.72 0.00 0.00 55.73 52.70 3kt0 s ARG 73 Cb 0.00 -2.27 -0.10 0.00 -0.45 0.00 0.00 34.95 32.12 3kt0 s ARG 73 CO 0.00 0.52 1.32 -1.21 -0.68 0.00 0.00 175.30 175.25 3kt0 s GLU 74 N -2.03 4.34 0.38 3.54 0.41 -1.26 -4.09 118.70 119.99 3kt0 s GLU 74 Ca 0.19 2.24 -0.27 0.00 -0.41 0.00 0.00 54.97 56.73 3kt0 s GLU 74 Cb -0.11 -3.06 -0.11 0.00 -1.78 0.00 0.00 34.13 29.07 3kt0 s GLU 74 CO 0.11 -0.22 1.23 -0.35 -0.49 0.00 0.00 175.26 175.55 3kt0 n PRO 75 N 0.80 1.92 -1.67 0.39 -0.04 -1.26 -4.94 135.00 130.19 3kt0 n PRO 75 Ca 0.00 0.68 -0.38 0.00 -0.04 0.00 0.00 63.50 63.75 3kt0 n PRO 75 Cb 0.42 -2.29 0.05 0.00 -0.04 0.00 0.00 33.50 31.63 3kt0 n PRO 75 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3kt0 n HIS 76 N 0.02 1.53 0.26 0.54 -0.00 -1.26 -4.75 115.22 111.57 3kt0 n HIS 76 Ca 0.06 0.45 0.15 0.00 0.46 0.00 0.00 57.72 58.84 3kt0 n HIS 76 Cb 0.38 -2.25 0.86 0.00 -0.12 0.00 0.00 29.99 28.85 3kt0 n HIS 76 CO 0.00 0.00 0.00 1.12 0.46 0.00 0.00 176.34 177.92 3kt0 h HIS 77 N 0.98 0.00 -0.62 1.57 2.07 -1.99 -0.29 115.15 116.87 3kt0 h HIS 77 Ca -0.49 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.01 3kt0 h HIS 77 Cb 1.34 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.29 3kt0 h HIS 77 CO 0.41 0.00 0.30 0.74 -3.07 0.00 0.00 177.93 176.31 3kt0 h PHE 78 N 0.00 0.86 -0.10 6.12 0.04 -1.94 -0.38 116.94 121.54 3kt0 h PHE 78 Ca 0.03 -0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.62 3kt0 h PHE 78 Cb 0.15 -0.27 0.01 0.00 2.20 0.00 0.00 35.95 38.03 3kt0 h PHE 78 CO 0.00 0.63 -0.52 -0.07 -0.60 0.00 0.00 178.31 177.75 3kt0 h LEU 79 N 0.87 0.62 -1.46 1.54 3.38 -1.32 0.13 115.31 119.07 3kt0 h LEU 79 Ca 0.22 -0.65 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 3kt0 h LEU 79 Cb 0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3kt0 h LEU 79 CO -0.03 1.17 0.23 0.03 0.09 0.00 0.00 178.44 179.93 3kt0 h ARG 80 N 0.12 0.59 -0.01 1.13 3.08 -1.08 -2.62 114.38 115.59 3kt0 h ARG 80 Ca -0.04 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.96 3kt0 h ARG 80 Cb 1.17 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.09 3kt0 h ARG 80 CO 0.11 0.45 -0.12 1.63 -1.07 0.00 0.00 179.97 180.97 3kt0 n LYS 81 N -4.42 1.41 -1.00 0.04 5.02 -0.18 -4.94 118.16 114.10 3kt0 n LYS 81 Ca 0.03 -0.89 -0.00 0.00 -2.02 0.00 0.00 58.31 55.43 3kt0 n LYS 81 Cb 0.10 -1.48 -0.00 0.00 -0.02 0.00 0.00 35.03 33.63 3kt0 n LYS 81 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kt0 n GLY 82 N 1.26 0.47 0.13 0.72 0.00 -0.99 -4.94 105.19 101.85 3kt0 n GLY 82 Ca 0.16 -0.24 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 3kt0 n GLY 82 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3kt0 h LEU 83 N 0.00 0.17 -8.60 0.99 -0.00 -1.01 -3.32 115.31 103.54 3kt0 h LEU 83 Ca -0.00 0.02 -0.68 0.00 -0.00 0.00 0.00 57.88 57.21 3kt0 h LEU 83 Cb 0.03 -0.01 -0.21 0.00 -0.00 0.00 0.00 40.66 40.46 3kt0 h LEU 83 CO 0.00 0.13 -0.52 -0.36 -0.00 0.00 0.00 178.44 177.70 3kt0 s PHE 84 N -6.17 3.21 0.00 1.13 0.40 -1.08 -1.18 117.98 114.29 3kt0 s PHE 84 Ca -0.13 -0.47 0.00 0.00 -0.60 0.00 0.00 56.93 55.73 3kt0 s PHE 84 Cb 0.10 -2.42 0.00 0.00 0.51 0.00 0.00 43.02 41.21 3kt0 s PHE 84 CO 0.70 -0.44 0.00 1.97 0.70 0.00 0.00 175.22 178.15 3kt0 n PHE 85 N 5.04 0.00 -4.15 0.36 -1.74 -0.37 -4.55 117.46 112.05 3kt0 n PHE 85 Ca -0.13 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.62 3kt0 n PHE 85 Cb 0.49 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.42 3kt0 n PHE 85 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 3kt0 s SER 86 N -1.05 0.65 0.22 5.98 1.04 -1.21 -0.15 113.70 119.17 3kt0 s SER 86 Ca 0.00 -1.41 -0.22 0.00 0.48 0.00 0.00 55.95 54.80 3kt0 s SER 86 Cb 0.00 0.54 0.04 0.00 0.10 0.00 0.00 66.02 66.70 3kt0 s SER 86 CO 0.00 -1.08 0.73 -1.83 0.98 0.00 0.00 173.24 172.04 3kt0 s GLU 87 N -3.66 1.53 -0.06 4.02 4.04 0.66 -0.53 118.70 124.71 3kt0 s GLU 87 Ca 0.34 -0.78 0.01 0.00 0.04 0.00 0.00 54.97 54.58 3kt0 s GLU 87 Cb 0.02 0.56 0.02 0.00 0.02 0.00 0.00 34.13 34.76 3kt0 s GLU 87 CO 0.17 -0.69 -0.05 1.03 -1.84 0.00 0.00 175.26 173.88 3kt0 s ARG 88 N -3.75 1.02 -1.79 -4.83 0.52 -0.67 -1.43 118.95 108.02 3kt0 s ARG 88 Ca 0.08 -0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 3kt0 s ARG 88 Cb -0.04 -1.05 0.00 0.00 0.52 0.00 0.00 34.95 34.38 3kt0 s ARG 88 CO 0.01 -0.13 0.00 -0.25 0.02 0.00 0.00 175.30 174.95 3kt0 n ASP 89 N 4.32 -5.12 0.23 0.23 8.00 -1.26 -0.82 116.55 122.13 3kt0 n ASP 89 Ca -0.20 0.35 0.07 0.00 0.71 0.00 0.00 54.79 55.72 3kt0 n ASP 89 Cb 0.51 -4.18 0.55 0.00 -0.02 0.00 0.00 41.12 37.98 3kt0 n ASP 89 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 3kt0 h PHE 90 N 0.00 0.00 -0.17 1.24 3.57 -1.91 -2.65 116.94 117.02 3kt0 h PHE 90 Ca -0.37 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.15 3kt0 h PHE 90 Cb 1.18 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.89 3kt0 h PHE 90 CO 0.49 0.17 0.02 1.15 -2.23 0.00 0.00 178.31 177.91 3kt0 h THR 91 N 0.00 0.91 -0.10 4.41 2.02 -1.99 -1.03 112.91 117.13 3kt0 h THR 91 Ca -0.00 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 3kt0 h THR 91 Cb 0.32 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 3kt0 h THR 91 CO 0.02 0.02 -0.10 0.07 0.37 0.00 0.00 175.52 175.90 3kt0 h LYS 92 N 0.09 0.16 -0.19 6.66 2.10 -1.88 0.16 116.57 123.66 3kt0 h LYS 92 Ca 0.08 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.68 3kt0 h LYS 92 Cb 0.08 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.38 3kt0 h LYS 92 CO -0.11 0.27 0.04 0.82 -2.00 0.00 0.00 179.45 178.46 3kt0 h ILE 93 N 0.15 1.21 -0.89 0.07 1.08 -1.29 -1.33 117.51 116.52 3kt0 h ILE 93 Ca 0.03 -0.68 0.00 0.00 -0.39 0.00 0.00 64.86 63.83 3kt0 h ILE 93 Cb 0.27 1.29 -0.04 0.00 -3.07 0.00 0.00 36.82 35.27 3kt0 h ILE 93 CO 0.02 0.21 0.56 -0.07 -0.69 0.00 0.00 178.15 178.18 3kt0 h LEU 94 N 0.12 1.04 -0.65 1.44 3.38 -0.49 -1.12 115.31 119.04 3kt0 h LEU 94 Ca 0.06 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.05 3kt0 h LEU 94 Cb 0.28 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 3kt0 h LEU 94 CO 0.00 0.77 0.35 0.44 0.09 0.00 0.00 178.44 180.10 3kt0 h ASP 95 N 1.21 0.51 -0.26 -0.43 3.32 -0.54 -0.65 116.42 119.58 3kt0 h ASP 95 Ca 0.32 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.33 3kt0 h ASP 95 Cb -0.10 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3kt0 h ASP 95 CO -0.07 0.33 -0.14 -0.07 -1.72 0.00 0.00 179.24 177.57 3kt0 h LEU 96 N 0.65 0.58 -0.76 1.55 3.38 -0.62 -1.92 115.31 118.17 3kt0 h LEU 96 Ca 0.29 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3kt0 h LEU 96 Cb 0.20 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3kt0 h LEU 96 CO -0.19 0.87 0.48 0.22 0.09 0.00 0.00 178.44 179.92 3kt0 h TYR 97 N 0.29 0.98 -0.85 1.13 3.20 -1.06 0.17 116.97 120.83 3kt0 h TYR 97 Ca 0.06 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 3kt0 h TYR 97 Cb 0.66 -0.33 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 3kt0 h TYR 97 CO 0.06 0.64 0.50 1.49 -1.64 0.00 0.00 178.16 179.21 3kt0 h GLU 98 N 1.04 1.16 -0.01 1.82 4.81 -0.95 -2.31 114.58 120.14 3kt0 h GLU 98 Ca 0.28 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3kt0 h GLU 98 Cb -0.08 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.06 3kt0 h GLU 98 CO -0.06 0.82 -0.14 1.04 -0.73 0.00 0.00 179.01 179.95 3kt0 n GLN 99 N -4.36 0.85 -1.11 1.92 6.02 -0.73 -0.09 117.38 119.88 3kt0 n GLN 99 Ca 0.09 -0.38 -0.03 0.00 -0.01 0.00 0.00 57.00 56.67 3kt0 n GLN 99 Cb 0.07 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 29.83 3kt0 n GLN 99 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kt0 n GLY 100 N 1.27 0.64 3.89 1.08 0.00 -0.54 -4.01 105.19 107.53 3kt0 n GLY 100 Ca 0.15 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 3kt0 n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kt0 s LYS 101 N -2.31 3.69 0.52 1.61 1.02 0.48 -5.01 119.74 119.74 3kt0 s LYS 101 Ca 0.00 0.13 -0.19 0.00 0.02 0.00 0.00 55.97 55.93 3kt0 s LYS 101 Cb 0.00 -2.61 -0.07 0.00 -0.52 0.00 0.00 37.83 34.63 3kt0 s LYS 101 CO 0.00 0.20 1.04 -2.14 -0.92 0.00 0.00 175.35 173.53 3kt0 s PRO 102 N -3.42 3.67 0.28 -1.68 0.02 -1.26 -4.32 135.00 128.28 3kt0 s PRO 102 Ca 0.46 1.29 -0.18 0.00 0.02 0.00 0.00 61.00 62.59 3kt0 s PRO 102 Cb -0.11 -2.08 0.02 0.00 0.02 0.00 0.00 34.50 32.35 3kt0 s PRO 102 CO 0.28 -0.53 0.65 -0.59 -0.33 0.00 0.00 177.00 176.48 3kt0 s PHE 103 N -2.15 0.01 0.23 6.54 -0.12 -1.26 -4.66 117.98 116.57 3kt0 s PHE 103 Ca 0.66 -0.46 0.00 0.00 -0.05 0.00 0.00 56.93 57.08 3kt0 s PHE 103 Cb -0.16 0.56 -0.05 0.00 -0.63 0.00 0.00 43.02 42.74 3kt0 s PHE 103 CO 0.25 -1.19 0.11 -0.59 -0.05 0.00 0.00 175.22 173.75 3kt0 s PHE 104 N -3.82 1.36 0.08 3.49 -0.12 -0.98 -4.35 117.98 113.64 3kt0 s PHE 104 Ca 0.15 -1.27 0.04 0.00 -0.05 0.00 0.00 56.93 55.80 3kt0 s PHE 104 Cb -0.04 -0.74 -0.04 0.00 -0.63 0.00 0.00 43.02 41.56 3kt0 s PHE 104 CO 0.08 -0.47 -0.01 -0.51 -0.05 0.00 0.00 175.22 174.26 3kt0 s LEU 105 N -3.24 3.45 -0.04 -1.99 1.43 -0.08 -0.91 118.68 117.29 3kt0 s LEU 105 Ca 0.38 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.36 3kt0 s LEU 105 Cb 0.07 -2.15 -0.00 0.00 0.03 0.00 0.00 46.19 44.14 3kt0 s LEU 105 CO 0.13 0.19 -0.16 -0.47 0.23 0.00 0.00 176.35 176.27 3kt0 s TYR 106 N -1.27 1.59 0.25 0.29 5.04 -0.83 -1.37 117.35 121.05 3kt0 s TYR 106 Ca 0.25 -0.42 -0.03 0.00 -2.44 0.00 0.00 57.07 54.43 3kt0 s TYR 106 Cb -0.12 -1.07 -0.02 0.00 0.35 0.00 0.00 41.96 41.10 3kt0 s TYR 106 CO 0.17 -0.13 0.29 -0.08 -1.34 0.00 0.00 175.55 174.46 3kt0 s THR 107 N -0.03 0.00 0.31 4.34 -1.32 -0.91 -4.19 115.64 113.85 3kt0 s THR 107 Ca -0.02 -1.79 -0.19 0.00 -1.21 0.00 0.00 61.69 58.48 3kt0 s THR 107 Cb -0.10 -2.45 0.03 0.00 -1.51 0.00 0.00 72.50 68.47 3kt0 s THR 107 CO 0.01 0.00 0.73 -0.83 -2.21 0.00 0.00 174.62 172.32 3kt0 s GLY 108 N -3.17 0.11 -0.18 6.08 0.00 -1.26 -0.92 107.32 107.98 3kt0 s GLY 108 Ca 0.34 -0.49 -0.15 0.00 0.00 0.00 0.00 44.72 44.41 3kt0 s GLY 108 CO 0.15 -0.20 0.47 -1.60 0.00 0.00 0.00 173.10 171.92 3kt0 s ARG 109 N -3.40 0.53 -0.34 2.90 3.52 -0.32 -4.91 118.95 116.92 3kt0 s ARG 109 Ca 0.13 0.69 -0.29 0.00 -0.13 0.00 0.00 55.73 56.14 3kt0 s ARG 109 Cb -0.05 0.21 0.01 0.00 -1.56 0.00 0.00 34.95 33.56 3kt0 s ARG 109 CO 0.09 -0.08 1.26 0.20 -0.81 0.00 0.00 175.30 175.95 3kt0 s GLY 110 N 0.49 1.36 -0.11 8.12 0.00 -1.26 -2.07 107.32 113.85 3kt0 s GLY 110 Ca -0.02 -0.04 -0.29 0.00 0.00 0.00 0.00 44.72 44.37 3kt0 s GLY 110 CO -0.02 2.54 1.43 -4.14 0.00 0.00 0.00 173.10 172.90 3kt0 s PRO 111 N 4.22 4.22 0.34 2.90 0.02 -1.26 -4.98 135.00 140.46 3kt0 s PRO 111 Ca 0.54 1.89 0.08 0.00 0.02 0.00 0.00 61.00 63.54 3kt0 s PRO 111 Cb -0.14 -3.84 -0.04 0.00 0.02 0.00 0.00 34.50 30.49 3kt0 s PRO 111 CO 0.24 -0.75 0.12 -1.54 -0.33 0.00 0.00 177.00 174.74 3kt0 s SER 112 N 2.52 4.61 0.34 2.53 1.04 -1.26 -4.85 113.70 118.63 3kt0 s SER 112 Ca 0.63 -0.80 0.18 0.00 0.48 0.00 0.00 55.95 56.43 3kt0 s SER 112 Cb -0.27 -0.70 0.43 0.00 0.10 0.00 0.00 66.02 65.58 3kt0 s SER 112 CO 0.21 -0.29 1.61 0.77 0.98 0.00 0.00 173.24 176.53 3kt0 h SER 113 N 1.59 0.00 -4.16 7.02 4.64 -1.94 -3.46 113.55 117.23 3kt0 h SER 113 Ca -0.44 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.40 3kt0 h SER 113 Cb 1.25 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.38 3kt0 h SER 113 CO 0.64 0.41 0.38 -1.81 -0.87 0.00 0.00 176.83 175.57 3kt0 s ASP 114 N -6.40 6.18 0.65 4.97 -0.00 -1.26 -5.03 116.67 115.77 3kt0 s ASP 114 Ca 0.02 1.77 -0.18 0.00 -0.00 0.00 0.00 52.55 54.16 3kt0 s ASP 114 Cb 0.09 -2.53 -0.01 0.00 -0.00 0.00 0.00 42.92 40.47 3kt0 s ASP 114 CO 0.71 -0.90 1.24 -0.94 -0.00 0.00 0.00 175.17 175.28 3kt0 s SER 115 N -2.67 4.70 0.38 0.27 1.04 -1.26 -4.96 113.70 111.20 3kt0 s SER 115 Ca 0.63 2.48 -0.27 0.00 0.48 0.00 0.00 55.95 59.27 3kt0 s SER 115 Cb -0.14 -2.60 -0.11 0.00 0.10 0.00 0.00 66.02 63.27 3kt0 s SER 115 CO 0.31 -1.93 1.37 0.80 0.98 0.00 0.00 173.24 174.77 3kt0 n MET 116 N -2.00 2.28 -2.34 4.02 1.56 -1.26 -4.80 117.12 114.58 3kt0 n MET 116 Ca 0.14 0.80 -0.32 0.00 -0.27 0.00 0.00 57.70 58.06 3kt0 n MET 116 Cb 0.49 -2.49 -0.02 0.00 2.15 0.00 0.00 33.22 33.35 3kt0 n MET 116 CO 0.00 0.00 0.00 -1.01 -0.73 0.00 0.00 175.97 174.23 3kt0 s HIS 117 N -1.14 3.49 0.23 1.12 3.76 -1.26 -0.98 115.29 120.51 3kt0 s HIS 117 Ca 0.57 1.38 -0.07 0.00 -0.15 0.00 0.00 55.06 56.79 3kt0 s HIS 117 Cb -0.51 -2.74 0.35 0.00 1.11 0.00 0.00 32.58 30.80 3kt0 s HIS 117 CO 0.61 -0.41 1.77 1.25 -0.85 0.00 0.00 174.74 177.11 3kt0 h LEU 118 N 0.69 0.41 -1.56 0.89 5.85 -1.16 -2.06 115.31 118.37 3kt0 h LEU 118 Ca -0.46 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.36 3kt0 h LEU 118 Cb 1.19 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 3kt0 h LEU 118 CO 0.62 0.22 0.34 1.23 -0.34 0.00 0.00 178.44 180.51 3kt0 h GLY 119 N 0.56 0.65 2.00 3.75 0.00 -1.94 -2.32 103.07 105.77 3kt0 h GLY 119 Ca 0.36 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3kt0 h GLY 119 CO -0.30 0.20 0.00 0.45 0.00 0.00 0.00 176.54 176.90 3kt0 h HIS 120 N 0.58 0.00 -0.15 5.60 3.86 -1.75 -2.21 115.15 121.07 3kt0 h HIS 120 Ca 0.20 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.35 3kt0 h HIS 120 Cb 0.10 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 3kt0 h HIS 120 CO -0.00 0.00 -0.18 0.52 0.86 0.00 0.00 177.93 179.13 3kt0 h MET 121 N 0.00 0.25 0.30 2.45 2.07 -1.45 -3.36 114.93 115.19 3kt0 h MET 121 Ca 0.00 -0.07 0.00 0.00 -2.07 0.00 0.00 59.70 57.56 3kt0 h MET 121 Cb 0.25 -0.03 -0.04 0.00 -1.87 0.00 0.00 31.60 29.92 3kt0 h MET 121 CO 0.00 0.44 -0.51 0.82 1.07 0.00 0.00 176.91 178.72 3kt0 h ILE 122 N 0.24 0.02 -0.32 -1.22 1.08 -1.56 0.02 117.51 115.76 3kt0 h ILE 122 Ca 0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.52 3kt0 h ILE 122 Cb 0.46 0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.21 3kt0 h ILE 122 CO 0.03 0.00 0.21 1.55 -0.69 0.00 0.00 178.15 179.25 3kt0 h PRO 123 N -0.87 0.42 -0.17 2.37 0.13 -1.80 -1.97 132.00 130.12 3kt0 h PRO 123 Ca -0.03 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 3kt0 h PRO 123 Cb 0.81 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.84 3kt0 h PRO 123 CO -0.18 0.28 -0.12 0.74 -0.23 0.00 0.00 178.00 178.49 3kt0 h PHE 124 N 0.43 0.44 -0.48 1.56 0.04 -1.59 0.36 116.94 117.70 3kt0 h PHE 124 Ca 0.12 -0.12 0.06 0.00 2.80 0.00 0.00 57.97 60.83 3kt0 h PHE 124 Cb -0.05 -0.10 -0.05 0.00 2.20 0.00 0.00 35.95 37.95 3kt0 h PHE 124 CO 0.00 0.72 0.17 0.28 -0.60 0.00 0.00 178.31 178.89 3kt0 h VAL 125 N 0.03 0.84 -0.42 -0.55 2.07 -0.80 0.05 116.25 117.47 3kt0 h VAL 125 Ca 0.03 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 3kt0 h VAL 125 Cb 0.63 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3kt0 h VAL 125 CO 0.03 0.06 -0.04 0.15 0.02 0.00 0.00 177.57 177.80 3kt0 h PHE 126 N 0.35 0.85 -0.82 1.57 3.57 -1.28 -2.38 116.94 118.81 3kt0 h PHE 126 Ca 0.23 -0.16 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 3kt0 h PHE 126 Cb 0.24 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 3kt0 h PHE 126 CO -0.16 0.86 0.43 1.15 -2.23 0.00 0.00 178.31 178.36 3kt0 h THR 127 N 0.60 1.24 -0.65 4.41 2.02 -0.59 -0.36 112.91 119.58 3kt0 h THR 127 Ca 0.11 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.66 3kt0 h THR 127 Cb 0.54 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 3kt0 h THR 127 CO 0.03 0.28 0.40 0.50 0.37 0.00 0.00 175.52 177.10 3kt0 h LYS 128 N 1.15 0.88 -0.19 6.66 3.64 -0.73 -0.48 116.57 127.51 3kt0 h LYS 128 Ca 0.29 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.58 3kt0 h LYS 128 Cb 0.06 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 3kt0 h LYS 128 CO -0.04 0.62 0.05 2.35 -2.27 0.00 0.00 179.45 180.16 3kt0 h TRP 129 N 0.88 0.30 -0.92 1.91 7.01 -0.91 -2.11 115.95 122.11 3kt0 h TRP 129 Ca 0.23 -0.03 0.09 0.00 2.11 0.00 0.00 58.89 61.29 3kt0 h TRP 129 Cb -0.04 -0.09 -0.07 0.00 -2.10 0.00 0.00 29.16 26.86 3kt0 h TRP 129 CO -0.02 0.40 0.57 -0.07 -2.79 0.00 0.00 178.44 176.54 3kt0 h LEU 130 N 0.12 0.87 -0.45 0.65 3.38 -0.74 0.14 115.31 119.27 3kt0 h LEU 130 Ca 0.06 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3kt0 h LEU 130 Cb 0.25 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3kt0 h LEU 130 CO -0.00 0.52 0.17 -0.61 0.09 0.00 0.00 178.44 178.60 3kt0 h GLN 131 N 0.98 0.69 -0.22 1.13 4.15 -0.95 -0.83 115.11 120.06 3kt0 h GLN 131 Ca 0.43 -0.13 -0.04 0.00 0.77 0.00 0.00 58.65 59.67 3kt0 h GLN 131 Cb 0.30 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 3kt0 h GLN 131 CO -0.22 0.64 -0.02 1.49 -1.93 0.00 0.00 178.83 178.80 3kt0 h GLU 132 N 0.59 0.41 -0.44 1.69 4.81 -0.67 0.17 114.58 121.13 3kt0 h GLU 132 Ca 0.15 -0.14 -0.11 0.00 -0.13 0.00 0.00 59.36 59.13 3kt0 h GLU 132 Cb 0.22 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 3kt0 h GLU 132 CO -0.01 0.61 -0.14 0.28 -0.73 0.00 0.00 179.01 179.03 3kt0 h VAL 133 N 0.16 1.27 0.00 0.32 2.07 -0.70 -3.13 116.25 116.24 3kt0 h VAL 133 Ca 0.06 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.31 3kt0 h VAL 133 Cb 0.44 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 3kt0 h VAL 133 CO 0.02 0.43 -0.98 0.49 0.02 0.00 0.00 177.57 177.55 3kt0 n PHE 134 N -4.24 0.20 -3.59 1.57 3.72 -0.32 -5.00 117.46 109.80 3kt0 n PHE 134 Ca -0.01 0.06 -0.22 0.00 -0.05 0.00 0.00 57.45 57.24 3kt0 n PHE 134 Cb 0.40 -0.36 0.05 0.00 -0.94 0.00 0.00 39.48 38.62 3kt0 n PHE 134 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3kt0 n ASP 135 N -1.86 -2.96 -4.47 4.37 2.03 0.57 -4.91 116.55 109.33 3kt0 n ASP 135 Ca 0.02 -0.82 -0.23 0.00 0.52 0.00 0.00 54.79 54.29 3kt0 n ASP 135 Cb 0.41 -4.25 -0.10 0.00 -0.72 0.00 0.00 41.12 36.46 3kt0 n ASP 135 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3kt0 s VAL 136 N -3.55 1.82 0.58 5.18 -7.23 -1.14 -2.51 120.40 113.55 3kt0 s VAL 136 Ca 0.17 -2.15 -0.15 0.00 -1.81 0.00 0.00 61.98 58.04 3kt0 s VAL 136 Cb -0.04 -2.52 -0.05 0.00 0.56 0.00 0.00 36.38 34.33 3kt0 s VAL 136 CO 0.80 -0.26 1.02 -2.16 -0.31 0.00 0.00 175.10 174.20 3kt0 s PRO 137 N -3.69 3.56 -0.04 4.82 0.04 -1.26 -4.85 135.00 133.57 3kt0 s PRO 137 Ca 0.31 1.00 0.02 0.00 0.04 0.00 0.00 61.00 62.37 3kt0 s PRO 137 Cb 0.03 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.51 3kt0 s PRO 137 CO 0.13 -0.60 -0.09 -1.17 0.04 0.00 0.00 177.00 175.31 3kt0 s LEU 138 N -4.58 1.67 -0.08 -3.56 2.96 -0.18 -0.90 118.68 114.01 3kt0 s LEU 138 Ca 0.60 -0.21 0.02 0.00 -0.22 0.00 0.00 54.13 54.31 3kt0 s LEU 138 Cb -0.13 -0.63 -0.02 0.00 0.50 0.00 0.00 46.19 45.92 3kt0 s LEU 138 CO 0.40 0.04 -0.14 0.68 -1.32 0.00 0.00 176.35 176.01 3kt0 s VAL 139 N 0.44 3.05 -0.18 1.68 -7.23 -0.47 -0.97 120.40 116.73 3kt0 s VAL 139 Ca -0.08 -0.70 0.01 0.00 -1.81 0.00 0.00 61.98 59.39 3kt0 s VAL 139 Cb -0.12 -2.22 0.03 0.00 0.56 0.00 0.00 36.38 34.63 3kt0 s VAL 139 CO 0.01 0.57 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.62 3kt0 s ILE 140 N -0.35 1.67 -0.21 -0.62 1.01 0.13 -2.13 121.20 120.70 3kt0 s ILE 140 Ca 0.03 -0.88 -0.17 0.00 0.00 0.00 0.00 60.65 59.64 3kt0 s ILE 140 Cb -0.13 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 3kt0 s ILE 140 CO 0.02 0.31 0.44 -0.70 0.00 0.00 0.00 174.94 175.01 3kt0 s GLU 141 N 1.41 4.16 -0.39 2.79 2.12 -0.10 -0.99 118.70 127.70 3kt0 s GLU 141 Ca 0.01 0.26 -0.13 0.00 0.36 0.00 0.00 54.97 55.47 3kt0 s GLU 141 Cb -0.15 -3.56 0.02 0.00 0.26 0.00 0.00 34.13 30.70 3kt0 s GLU 141 CO -0.09 -0.12 0.25 -0.51 -0.54 0.00 0.00 175.26 174.25 3kt0 s LEU 142 N 1.55 4.87 -1.34 2.70 1.43 0.13 -1.17 118.68 126.84 3kt0 s LEU 142 Ca 0.20 -0.88 -0.07 0.00 -1.03 0.00 0.00 54.13 52.36 3kt0 s LEU 142 Cb -0.15 -2.10 0.11 0.00 0.03 0.00 0.00 46.19 44.08 3kt0 s LEU 142 CO 0.09 -0.40 2.35 0.35 0.23 0.00 0.00 176.35 178.97 3kt0 n THR 143 N 5.09 5.01 -0.31 5.49 -2.24 -0.88 -1.46 114.28 124.97 3kt0 n THR 143 Ca -0.12 -4.18 -0.05 0.00 -2.27 0.00 0.00 64.05 57.43 3kt0 n THR 143 Cb 0.47 -2.17 0.07 0.00 -2.10 0.00 0.00 70.33 66.60 3kt0 n THR 143 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3kt0 h ASP 144 N 4.84 1.05 -0.45 3.42 3.04 -1.86 -2.22 116.42 124.23 3kt0 h ASP 144 Ca 0.67 -0.11 0.06 0.00 -3.24 0.00 0.00 57.03 54.40 3kt0 h ASP 144 Cb 0.36 -0.27 -0.05 0.00 -1.04 0.00 0.00 39.33 38.33 3kt0 h ASP 144 CO 1.53 0.86 0.17 -2.24 -2.04 0.00 0.00 179.24 177.52 3kt0 h ASP 145 N 1.17 0.18 -0.40 4.15 3.04 -1.93 -1.60 116.42 121.03 3kt0 h ASP 145 Ca 0.29 0.05 0.02 0.00 -3.24 0.00 0.00 57.03 54.15 3kt0 h ASP 145 Cb 0.05 0.03 -0.03 0.00 -1.04 0.00 0.00 39.33 38.34 3kt0 h ASP 145 CO -0.04 0.14 0.22 -0.08 -2.04 0.00 0.00 179.24 177.44 3kt0 h GLU 146 N 0.34 0.44 -0.40 4.15 4.81 -1.87 -1.89 114.58 120.17 3kt0 h GLU 146 Ca 0.21 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.45 3kt0 h GLU 146 Cb 0.20 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 3kt0 h GLU 146 CO -0.21 0.29 0.17 -0.22 -0.73 0.00 0.00 179.01 178.32 3kt0 h LYS 147 N 0.45 0.35 -0.62 1.92 1.63 -1.19 -1.41 116.57 117.70 3kt0 h LYS 147 Ca 0.16 -0.02 0.12 0.00 -0.85 0.00 0.00 60.65 60.07 3kt0 h LYS 147 Cb 0.03 -0.08 -0.09 0.00 -0.60 0.00 0.00 32.23 31.49 3kt0 h LYS 147 CO -0.09 0.23 0.10 0.35 -3.45 0.00 0.00 179.45 176.59 3kt0 h PHE 148 N 0.36 0.15 -0.16 1.91 3.57 -1.10 0.11 116.94 121.76 3kt0 h PHE 148 Ca 0.18 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 3kt0 h PHE 148 Cb 0.12 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3kt0 h PHE 148 CO -0.12 -0.08 -0.00 -0.07 -2.23 0.00 0.00 178.31 175.81 3kt0 h LEU 149 N 0.22 0.21 0.08 0.59 4.07 -0.56 -3.12 115.31 116.80 3kt0 h LEU 149 Ca 0.33 -0.02 -0.31 0.00 0.08 0.00 0.00 57.88 57.96 3kt0 h LEU 149 Cb 0.52 -0.05 -0.02 0.00 1.08 0.00 0.00 40.66 42.18 3kt0 h LEU 149 CO -0.45 0.26 -1.66 -0.26 -1.08 0.00 0.00 178.44 175.25 3kt0 h PHE 150 N 0.23 0.32 -3.43 1.13 -1.00 -0.42 -3.44 116.94 110.33 3kt0 h PHE 150 Ca 0.06 -0.23 -0.70 0.00 2.81 0.00 0.00 57.97 59.90 3kt0 h PHE 150 Cb 0.17 -0.01 -0.33 0.00 3.61 0.00 0.00 35.95 39.39 3kt0 h PHE 150 CO 0.00 1.35 -0.48 0.15 -1.61 0.00 0.00 178.31 177.72 3kt0 s LYS 151 N -2.60 2.20 0.28 1.51 -0.14 0.29 -4.97 119.74 116.32 3kt0 s LYS 151 Ca -0.10 -1.87 0.26 0.00 -1.36 0.00 0.00 55.97 52.90 3kt0 s LYS 151 Cb 0.07 -3.71 0.87 0.00 -1.68 0.00 0.00 37.83 33.38 3kt0 s LYS 151 CO 0.83 -1.12 1.76 0.45 -0.76 0.00 0.00 175.35 176.50 3kt0 h HIS 152 N 8.09 0.00 0.00 3.18 3.86 -1.86 -2.11 115.15 126.31 3kt0 h HIS 152 Ca -0.14 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 3kt0 h HIS 152 Cb 1.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.52 3kt0 h HIS 152 CO 0.59 0.00 0.00 0.87 0.86 0.00 0.00 177.93 180.25 3kt0 h LYS 153 N 0.00 0.00 -6.68 2.45 1.57 -1.93 -3.46 116.57 108.52 3kt0 h LYS 153 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 3kt0 h LYS 153 Cb 0.62 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 3kt0 h LYS 153 CO 0.00 0.00 0.20 -0.51 -0.57 0.00 0.00 179.45 178.57 3kt0 s LEU 154 N -5.21 4.35 0.51 2.94 1.43 -0.80 -5.09 118.68 116.83 3kt0 s LEU 154 Ca 0.06 1.58 0.03 0.00 -1.03 0.00 0.00 54.13 54.77 3kt0 s LEU 154 Cb 0.09 -3.73 0.03 0.00 0.03 0.00 0.00 46.19 42.61 3kt0 s LEU 154 CO 0.54 0.00 0.72 0.42 0.23 0.00 0.00 176.35 178.26 3kt0 s THR 155 N -1.54 2.82 0.21 5.49 -4.23 -1.26 -4.99 115.64 112.14 3kt0 s THR 155 Ca 0.45 -0.73 -0.10 0.00 -1.18 0.00 0.00 61.69 60.13 3kt0 s THR 155 Cb -0.18 -3.03 0.15 0.00 1.34 0.00 0.00 72.50 70.79 3kt0 s THR 155 CO 0.22 -0.02 1.85 0.40 -0.54 0.00 0.00 174.62 176.54 3kt0 h ILE 156 N 0.22 1.11 -0.88 2.99 1.08 -1.99 -2.69 117.51 117.35 3kt0 h ILE 156 Ca -0.42 -0.31 -0.02 0.00 -0.39 0.00 0.00 64.86 63.72 3kt0 h ILE 156 Cb 1.29 0.13 -0.04 0.00 -3.07 0.00 0.00 36.82 35.13 3kt0 h ILE 156 CO 0.51 0.16 0.46 0.78 -0.69 0.00 0.00 178.15 179.37 3kt0 h ASN 157 N 0.90 1.11 0.19 1.72 4.21 -1.99 -2.19 115.58 119.54 3kt0 h ASN 157 Ca 0.29 -0.11 0.01 0.00 1.21 0.00 0.00 56.30 57.70 3kt0 h ASN 157 Cb 0.01 -0.28 -0.04 0.00 -1.12 0.00 0.00 38.32 36.88 3kt0 h ASN 157 CO -0.10 0.91 -0.39 0.44 -1.29 0.00 0.00 177.43 177.00 3kt0 h ASP 158 N 1.24 -1.11 0.33 5.81 3.32 -1.88 -1.87 116.42 122.26 3kt0 h ASP 158 Ca 0.31 0.12 -0.07 0.00 0.02 0.00 0.00 57.03 57.40 3kt0 h ASP 158 Cb 0.06 0.41 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 3kt0 h ASP 158 CO -0.05 -0.48 -0.34 -0.37 -1.72 0.00 0.00 179.24 176.28 3kt0 h VAL 159 N -0.67 1.25 -0.17 -1.35 -1.51 -1.34 0.56 116.25 113.02 3kt0 h VAL 159 Ca 0.01 -1.18 -0.15 0.00 -1.23 0.00 0.00 66.70 64.15 3kt0 h VAL 159 Cb 0.67 1.63 -0.01 0.00 -2.13 0.00 0.00 31.29 31.45 3kt0 h VAL 159 CO -0.18 0.34 -0.51 0.11 -1.23 0.00 0.00 177.57 176.10 3kt0 h LYS 160 N 0.01 0.46 -0.27 5.19 1.57 -1.32 -0.05 116.57 122.17 3kt0 h LYS 160 Ca -0.00 -0.27 -0.12 0.00 -1.87 0.00 0.00 60.65 58.39 3kt0 h LYS 160 Cb 0.61 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 3kt0 h LYS 160 CO 0.04 0.86 -0.30 -0.91 -0.57 0.00 0.00 179.45 178.58 3kt0 h ASN 161 N 0.36 0.72 -0.89 0.86 -0.26 -0.53 -2.83 115.58 113.02 3kt0 h ASN 161 Ca 0.01 -0.48 0.06 0.00 -0.56 0.00 0.00 56.30 55.33 3kt0 h ASN 161 Cb 1.02 -0.20 -0.06 0.00 -1.06 0.00 0.00 38.32 38.01 3kt0 h ASN 161 CO 0.09 1.06 0.56 -0.26 -1.06 0.00 0.00 177.43 177.82 3kt0 h PHE 162 N 0.40 1.03 -0.49 1.19 0.04 -0.78 -2.13 116.94 116.20 3kt0 h PHE 162 Ca 0.04 0.03 0.03 0.00 2.80 0.00 0.00 57.97 60.87 3kt0 h PHE 162 Cb 0.87 -0.33 -0.04 0.00 2.20 0.00 0.00 35.95 38.65 3kt0 h PHE 162 CO 0.08 0.52 0.27 0.00 -0.60 0.00 0.00 178.31 178.57 3kt0 h ALA 163 N 1.42 0.62 -0.54 2.45 0.00 -0.92 0.17 119.26 122.46 3kt0 h ALA 163 Ca 0.39 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.19 3kt0 h ALA 163 Cb 0.18 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3kt0 h ALA 163 CO -0.18 -0.06 -0.09 0.00 0.00 0.00 0.00 179.25 178.92 3kt0 h ARG 164 N 0.53 1.00 -0.35 0.00 3.08 -1.24 0.38 114.38 117.78 3kt0 h ARG 164 Ca 0.20 -0.36 -0.06 0.00 0.07 0.00 0.00 59.98 59.83 3kt0 h ARG 164 Cb 0.07 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3kt0 h ARG 164 CO -0.12 1.04 -0.02 0.93 -1.07 0.00 0.00 179.97 180.73 3kt0 h GLU 165 N 0.89 0.64 -0.43 0.04 4.39 -1.08 -2.37 114.58 116.66 3kt0 h GLU 165 Ca 0.14 -0.22 -0.05 0.00 0.34 0.00 0.00 59.36 59.57 3kt0 h GLU 165 Cb 0.65 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 3kt0 h GLU 165 CO 0.04 0.77 0.05 -0.91 -1.16 0.00 0.00 179.01 177.81 3kt0 h ASN 166 N 0.45 0.63 -0.44 1.42 -0.26 -0.58 -2.52 115.58 114.29 3kt0 h ASN 166 Ca 0.10 -0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 55.70 3kt0 h ASN 166 Cb 0.50 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.57 3kt0 h ASN 166 CO 0.02 0.67 0.21 0.00 -1.06 0.00 0.00 177.43 177.27 3kt0 h ALA 167 N 1.41 1.46 -0.50 -0.83 0.00 -0.73 -2.19 119.26 117.87 3kt0 h ALA 167 Ca 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3kt0 h ALA 167 Cb 0.33 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3kt0 h ALA 167 CO 0.01 0.42 0.22 0.87 0.00 0.00 0.00 179.25 180.77 3kt0 h LYS 168 N 0.68 0.74 -0.59 0.00 1.57 -0.99 -0.70 116.57 117.29 3kt0 h LYS 168 Ca 0.17 -0.12 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 3kt0 h LYS 168 Cb 0.12 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 3kt0 h LYS 168 CO -0.02 0.64 0.28 -0.44 -0.57 0.00 0.00 179.45 179.34 3kt0 h ASP 169 N 0.67 0.37 -0.21 0.86 3.32 -1.27 -1.00 116.42 119.16 3kt0 h ASP 169 Ca 0.17 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 3kt0 h ASP 169 Cb 0.16 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3kt0 h ASP 169 CO -0.02 0.24 0.02 0.40 -1.72 0.00 0.00 179.24 178.17 3kt0 h ILE 170 N 0.52 1.24 -0.77 0.35 2.04 -1.11 -2.76 117.51 117.01 3kt0 h ILE 170 Ca 0.27 -0.79 0.01 0.00 1.00 0.00 0.00 64.86 65.36 3kt0 h ILE 170 Cb 0.23 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 3kt0 h ILE 170 CO -0.21 0.24 0.51 0.40 0.00 0.00 0.00 178.15 179.09 3kt0 h ILE 171 N 0.15 1.18 0.00 -0.67 2.04 -1.02 -1.95 117.51 117.24 3kt0 h ILE 171 Ca 0.06 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3kt0 h ILE 171 Cb 0.34 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 3kt0 h ILE 171 CO 0.01 0.19 0.00 0.00 0.00 0.00 0.00 178.15 178.34 3kt0 n ALA 172 N -2.42 1.31 0.15 1.87 0.00 -0.39 -0.71 120.51 120.32 3kt0 n ALA 172 Ca 0.09 0.14 0.01 0.00 0.00 0.00 0.00 53.44 53.67 3kt0 n ALA 172 Cb 0.05 -1.32 0.32 0.00 0.00 0.00 0.00 19.45 18.49 3kt0 n ALA 172 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3kt0 h VAL 173 N 0.00 1.27 0.00 0.00 2.07 -1.27 -3.43 116.25 114.89 3kt0 h VAL 173 Ca 0.00 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.21 3kt0 h VAL 173 Cb 0.15 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 3kt0 h VAL 173 CO 0.00 0.38 0.00 0.61 0.02 0.00 0.00 177.57 178.58 3kt0 n GLY 174 N -0.42 -0.38 3.73 2.17 0.00 0.11 -5.00 105.19 105.40 3kt0 n GLY 174 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3kt0 n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kt0 s PHE 175 N -0.53 2.15 -0.09 1.61 0.40 -1.20 -5.05 117.98 115.28 3kt0 s PHE 175 Ca 0.00 1.59 -0.00 0.00 -0.60 0.00 0.00 56.93 57.92 3kt0 s PHE 175 Cb 0.00 -3.43 -0.03 0.00 0.51 0.00 0.00 43.02 40.07 3kt0 s PHE 175 CO 0.00 -2.45 -0.06 0.34 0.70 0.00 0.00 175.22 173.76 3kt0 s ASP 176 N -2.09 4.73 0.57 1.36 -1.08 -1.26 -4.99 116.67 113.91 3kt0 s ASP 176 Ca 0.73 -0.03 0.33 0.00 -0.52 0.00 0.00 52.55 53.07 3kt0 s ASP 176 Cb -0.28 -1.33 1.68 0.00 -1.46 0.00 0.00 42.92 41.53 3kt0 s ASP 176 CO 0.44 0.33 2.13 1.55 0.52 0.00 0.00 175.17 180.13 3kt0 h PRO 177 N 5.52 0.00 -0.96 4.34 0.13 -1.89 -2.80 132.00 136.35 3kt0 h PRO 177 Ca -0.45 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.78 3kt0 h PRO 177 Cb 1.18 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.24 3kt0 h PRO 177 CO 0.54 0.06 0.61 -0.22 -0.23 0.00 0.00 178.00 178.77 3kt0 h LYS 178 N 0.00 0.95 0.00 0.86 3.64 -1.93 -3.10 116.57 116.99 3kt0 h LYS 178 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3kt0 h LYS 178 Cb 0.30 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3kt0 h LYS 178 CO 0.01 0.63 -0.07 0.27 -2.27 0.00 0.00 179.45 178.01 3kt0 n ASN 179 N -4.56 1.78 -3.85 4.20 6.94 -1.15 -1.19 115.26 117.43 3kt0 n ASN 179 Ca 0.17 -2.54 -0.19 0.00 -0.02 0.00 0.00 54.58 52.00 3kt0 n ASN 179 Cb 0.31 -0.27 -0.16 0.00 -2.36 0.00 0.00 39.78 37.30 3kt0 n ASN 179 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 3kt0 s THR 180 N -1.83 0.39 -0.19 5.53 2.01 -1.07 -1.01 115.64 119.48 3kt0 s THR 180 Ca 0.18 -0.02 -0.00 0.00 0.31 0.00 0.00 61.69 62.15 3kt0 s THR 180 Cb 0.15 -0.46 0.01 0.00 0.01 0.00 0.00 72.50 72.22 3kt0 s THR 180 CO 0.02 0.20 -0.16 0.12 -0.69 0.00 0.00 174.62 174.11 3kt0 s PHE 181 N 1.07 2.82 -0.18 4.92 5.36 -0.14 -4.60 117.98 127.22 3kt0 s PHE 181 Ca -0.09 -1.44 -0.02 0.00 -0.96 0.00 0.00 56.93 54.42 3kt0 s PHE 181 Cb -0.14 -1.96 -0.00 0.00 -0.34 0.00 0.00 43.02 40.58 3kt0 s PHE 181 CO -0.01 -0.73 -0.10 0.42 -1.46 0.00 0.00 175.22 173.34 3kt0 s ILE 182 N 1.30 3.01 0.00 3.12 1.01 -0.85 0.18 121.20 128.97 3kt0 s ILE 182 Ca 0.04 -0.63 0.04 0.00 0.00 0.00 0.00 60.65 60.10 3kt0 s ILE 182 Cb -0.13 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 40.00 3kt0 s ILE 182 CO -0.10 0.48 -0.12 0.72 0.00 0.00 0.00 174.94 175.92 3kt0 s PHE 183 N 1.10 1.03 0.13 3.97 -0.71 -0.16 -3.69 117.98 119.64 3kt0 s PHE 183 Ca 0.00 -0.24 -0.30 0.00 -1.04 0.00 0.00 56.93 55.36 3kt0 s PHE 183 Cb -0.15 -0.65 -0.06 0.00 -1.21 0.00 0.00 43.02 40.95 3kt0 s PHE 183 CO -0.02 -0.01 1.01 0.45 -1.34 0.00 0.00 175.22 175.31 3kt0 s SER 184 N -0.50 7.41 0.11 1.98 0.15 -1.26 0.17 113.70 121.76 3kt0 s SER 184 Ca 0.03 1.89 -0.23 0.00 0.70 0.00 0.00 55.95 58.34 3kt0 s SER 184 Cb -0.05 -2.59 -0.07 0.00 -1.71 0.00 0.00 66.02 61.59 3kt0 s SER 184 CO -0.00 -0.13 1.68 0.44 1.20 0.00 0.00 173.24 176.43 3kt0 h ASP 185 N 5.48 -0.39 -0.98 5.45 3.32 -1.65 -0.48 116.42 127.18 3kt0 h ASP 185 Ca -0.43 0.06 0.17 0.00 0.02 0.00 0.00 57.03 56.85 3kt0 h ASP 185 Cb 1.21 0.17 -0.10 0.00 0.22 0.00 0.00 39.33 40.83 3kt0 h ASP 185 CO 0.72 -0.18 0.59 -0.07 -1.72 0.00 0.00 179.24 178.58 3kt0 h LEU 186 N -0.21 0.77 0.09 1.55 3.38 -1.94 0.36 115.31 119.31 3kt0 h LEU 186 Ca 0.05 0.09 -0.28 0.00 0.09 0.00 0.00 57.88 57.83 3kt0 h LEU 186 Cb 0.28 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3kt0 h LEU 186 CO -0.14 0.30 -1.35 -0.61 0.09 0.00 0.00 178.44 176.73 3kt0 h GLN 187 N 0.78 0.19 0.00 1.13 4.15 -1.91 -3.35 115.11 116.10 3kt0 h GLN 187 Ca 0.55 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 59.64 3kt0 h GLN 187 Cb 0.80 0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.62 3kt0 h GLN 187 CO -0.36 1.08 -1.28 0.98 -1.93 0.00 0.00 178.83 177.32 3kt0 n TYR 188 N -3.43 0.40 -1.65 3.99 9.36 -0.21 -4.96 117.16 120.67 3kt0 n TYR 188 Ca -0.11 0.12 -0.47 0.00 3.32 0.00 0.00 57.90 60.76 3kt0 n TYR 188 Cb 1.02 -0.60 -0.04 0.00 -0.63 0.00 0.00 39.34 39.09 3kt0 n TYR 188 CO 0.00 0.00 0.00 -0.12 0.22 0.00 0.00 176.86 176.96 3kt0 n MET 189 N -2.25 1.85 0.00 2.98 1.56 0.08 -4.84 117.12 116.50 3kt0 n MET 189 Ca -0.00 0.66 0.00 0.00 -0.27 0.00 0.00 57.70 58.09 3kt0 n MET 189 Cb 0.50 -2.34 0.00 0.00 2.15 0.00 0.00 33.22 33.53 3kt0 n MET 189 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3kt0 n GLY 190 N 2.69 2.07 7.00 -5.12 0.00 -1.26 -4.95 105.19 105.62 3kt0 n GLY 190 Ca 0.15 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.28 3kt0 n GLY 190 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kt0 n GLY 191 N -1.86 2.08 0.27 -0.02 0.00 -1.26 -2.28 105.19 102.12 3kt0 n GLY 191 Ca 0.00 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.68 3kt0 n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kt0 h ALA 192 N -0.75 1.99 0.39 4.61 0.00 -1.89 -1.66 119.26 121.95 3kt0 h ALA 192 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3kt0 h ALA 192 Cb 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3kt0 h ALA 192 CO 0.00 0.00 -0.24 0.35 0.00 0.00 0.00 179.25 179.37 3kt0 h PHE 193 N 0.06 -0.62 -0.88 0.00 3.57 -1.60 -1.53 116.94 115.94 3kt0 h PHE 193 Ca 0.02 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.56 3kt0 h PHE 193 Cb 0.03 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.93 3kt0 h PHE 193 CO -0.00 -0.37 0.56 -0.92 -2.23 0.00 0.00 178.31 175.35 3kt0 h TYR 194 N -0.60 1.04 -0.77 0.41 3.20 -0.94 -0.42 116.97 118.89 3kt0 h TYR 194 Ca -0.04 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.89 3kt0 h TYR 194 Cb 0.49 -0.34 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 3kt0 h TYR 194 CO -0.09 0.57 0.49 0.93 -1.64 0.00 0.00 178.16 178.42 3kt0 h GLU 195 N 1.06 0.93 -0.49 1.82 5.08 -1.16 0.38 114.58 122.19 3kt0 h GLU 195 Ca 0.37 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.58 3kt0 h GLU 195 Cb 0.08 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3kt0 h GLU 195 CO -0.14 0.61 -0.05 1.15 -1.00 0.00 0.00 179.01 179.58 3kt0 h THR 196 N 0.95 1.27 -0.48 1.13 2.02 -0.73 -0.66 112.91 116.41 3kt0 h THR 196 Ca 0.31 -1.16 0.09 0.00 0.77 0.00 0.00 66.41 66.42 3kt0 h THR 196 Cb 0.02 1.03 -0.08 0.00 -1.74 0.00 0.00 68.15 67.37 3kt0 h THR 196 CO -0.11 0.41 -0.00 0.58 0.37 0.00 0.00 175.52 176.76 3kt0 h VAL 197 N 0.76 0.62 -0.05 3.16 2.07 -0.47 0.10 116.25 122.44 3kt0 h VAL 197 Ca 0.13 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 3kt0 h VAL 197 Cb 0.59 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3kt0 h VAL 197 CO 0.04 0.02 0.03 0.58 0.02 0.00 0.00 177.57 178.26 3kt0 h VAL 198 N 0.11 1.06 -0.49 2.57 2.07 -0.61 0.85 116.25 121.81 3kt0 h VAL 198 Ca 0.24 -0.18 0.10 0.00 0.82 0.00 0.00 66.70 67.68 3kt0 h VAL 198 Cb 0.36 1.09 -0.09 0.00 -1.52 0.00 0.00 31.29 31.13 3kt0 h VAL 198 CO -0.40 0.05 -0.04 0.03 0.02 0.00 0.00 177.57 177.23 3kt0 h ARG 199 N 0.02 0.07 -0.58 1.57 3.08 -0.74 -2.49 114.38 115.30 3kt0 h ARG 199 Ca 0.02 -0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 3kt0 h ARG 199 Cb 0.06 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3kt0 h ARG 199 CO -0.00 0.05 0.14 0.28 -1.07 0.00 0.00 179.97 179.37 3kt0 h VAL 200 N 0.08 1.25 0.00 2.04 2.07 -0.52 -2.98 116.25 118.18 3kt0 h VAL 200 Ca 0.25 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 3kt0 h VAL 200 Cb 0.38 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3kt0 h VAL 200 CO -0.45 0.33 -0.05 0.77 0.02 0.00 0.00 177.57 178.19 3kt0 h SER 201 N 0.83 0.00 1.44 0.57 4.64 -0.40 -1.05 113.55 119.58 3kt0 h SER 201 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3kt0 h SER 201 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3kt0 h SER 201 CO 0.00 0.05 0.00 -0.09 -0.87 0.00 0.00 176.83 175.92 3kt0 h ARG 202 N 0.00 0.00 -0.02 4.77 2.43 -1.32 -3.32 114.38 116.93 3kt0 h ARG 202 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3kt0 h ARG 202 Cb 0.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3kt0 h ARG 202 CO 0.01 0.00 -0.47 1.04 -1.51 0.00 0.00 179.97 179.03 3kt0 n GLN 203 N -2.68 1.24 -4.91 0.20 1.13 -0.40 -4.89 117.38 107.07 3kt0 n GLN 203 Ca 0.04 -0.97 -0.32 0.00 -1.94 0.00 0.00 57.00 53.80 3kt0 n GLN 203 Cb 0.41 -1.46 -0.17 0.00 0.11 0.00 0.00 30.24 29.13 3kt0 n GLN 203 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3kt0 s ILE 204 N -2.43 2.04 0.43 5.09 1.01 -1.22 -4.95 121.20 121.16 3kt0 s ILE 204 Ca 0.18 -0.98 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 3kt0 s ILE 204 Cb 0.18 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 3kt0 s ILE 204 CO 0.56 0.55 0.68 0.42 0.00 0.00 0.00 174.94 177.16 3kt0 s THR 205 N 0.60 4.95 0.23 2.92 -4.23 -1.26 -4.94 115.64 113.91 3kt0 s THR 205 Ca -0.12 -0.10 -0.06 0.00 -1.18 0.00 0.00 61.69 60.23 3kt0 s THR 205 Cb -0.17 -3.85 0.20 0.00 1.34 0.00 0.00 72.50 70.02 3kt0 s THR 205 CO 0.03 -0.71 1.75 1.23 -0.54 0.00 0.00 174.62 176.38 3kt0 h GLY 206 N 0.44 1.09 0.02 3.99 0.00 -1.98 -0.81 103.07 105.82 3kt0 h GLY 206 Ca -0.48 -0.17 0.07 0.00 0.00 0.00 0.00 47.33 46.75 3kt0 h GLY 206 CO 0.61 -0.03 -0.26 1.76 0.00 0.00 0.00 176.54 178.62 3kt0 h SER 207 N 0.50 -0.87 -0.46 0.19 0.02 -1.99 0.11 113.55 111.06 3kt0 h SER 207 Ca 0.38 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 3kt0 h SER 207 Cb 0.51 0.41 -0.02 0.00 0.14 0.00 0.00 62.40 63.44 3kt0 h SER 207 CO -0.34 -0.29 0.29 0.74 -1.14 0.00 0.00 176.83 176.09 3kt0 h THR 208 N -0.24 1.13 -0.74 -2.27 2.02 -1.83 0.36 112.91 111.33 3kt0 h THR 208 Ca 0.16 -0.27 0.08 0.00 0.77 0.00 0.00 66.41 67.15 3kt0 h THR 208 Cb 0.49 0.49 -0.06 0.00 -1.74 0.00 0.00 68.15 67.32 3kt0 h THR 208 CO -0.45 0.13 0.42 0.00 0.37 0.00 0.00 175.52 175.99 3kt0 h ALA 209 N 1.15 1.03 0.12 6.16 0.00 -0.58 0.27 119.26 127.40 3kt0 h ALA 209 Ca 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3kt0 h ALA 209 Cb -0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3kt0 h ALA 209 CO -0.03 0.08 -0.06 0.87 0.00 0.00 0.00 179.25 180.10 3kt0 h LYS 210 N 0.74 -0.16 -0.57 0.00 1.57 -0.48 -1.72 116.57 115.95 3kt0 h LYS 210 Ca 0.35 0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 59.06 3kt0 h LYS 210 Cb 0.27 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 3kt0 h LYS 210 CO -0.21 0.28 0.05 0.00 -0.57 0.00 0.00 179.45 178.99 3kt0 h ALA 211 N 0.08 0.76 0.08 3.86 0.00 -0.10 -0.71 119.26 123.23 3kt0 h ALA 211 Ca -0.02 -0.28 -0.35 0.00 0.00 0.00 0.00 54.91 54.27 3kt0 h ALA 211 Cb 0.51 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3kt0 h ALA 211 CO 0.03 0.55 -1.93 0.28 0.00 0.00 0.00 179.25 178.18 3kt0 n VAL 212 N -4.28 1.69 1.13 0.00 0.31 0.92 -4.39 118.33 113.70 3kt0 n VAL 212 Ca 0.02 -0.51 0.12 0.00 -0.01 0.00 0.00 64.34 63.97 3kt0 n VAL 212 Cb 0.30 -1.77 0.20 0.00 -0.91 0.00 0.00 33.84 31.66 3kt0 n VAL 212 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3kt0 n PHE 213 N -3.69 0.00 -1.75 3.52 3.72 -0.66 -4.89 117.46 113.72 3kt0 n PHE 213 Ca -0.35 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 56.96 3kt0 n PHE 213 Cb 0.96 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 39.47 3kt0 n PHE 213 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kt0 n GLY 214 N 1.32 0.53 3.88 1.37 0.00 -0.27 -4.96 105.19 107.05 3kt0 n GLY 214 Ca 0.14 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 3kt0 n GLY 214 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kt0 s PHE 215 N -2.42 3.51 0.39 1.61 0.08 -1.21 -5.01 117.98 114.93 3kt0 s PHE 215 Ca 0.00 1.07 0.04 0.00 0.12 0.00 0.00 56.93 58.16 3kt0 s PHE 215 Cb 0.00 -2.49 -0.03 0.00 -0.57 0.00 0.00 43.02 39.93 3kt0 s PHE 215 CO 0.00 -0.26 0.11 0.54 -0.10 0.00 0.00 175.22 175.51 3kt0 s ASN 216 N -3.52 2.72 0.34 1.36 2.20 -1.26 -4.42 114.94 112.35 3kt0 s ASN 216 Ca 0.52 -1.62 0.25 0.00 -0.94 0.00 0.00 52.86 51.07 3kt0 s ASN 216 Cb -0.10 0.41 1.18 0.00 -2.00 0.00 0.00 41.25 40.74 3kt0 s ASN 216 CO 0.38 -0.87 1.76 0.44 -2.94 0.00 0.00 177.10 175.87 3kt0 h ASP 217 N 1.84 0.00 1.20 3.54 3.32 -2.00 -1.12 116.42 123.19 3kt0 h ASP 217 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 3kt0 h ASP 217 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 3kt0 h ASP 217 CO 0.59 0.00 -0.11 -1.54 -1.72 0.00 0.00 179.24 176.46 3kt0 n SER 218 N -2.38 0.54 -4.80 6.45 3.41 -1.26 -4.84 113.62 110.74 3kt0 n SER 218 Ca 0.00 0.44 -0.34 0.00 -0.26 0.00 0.00 58.87 58.71 3kt0 n SER 218 Cb 0.16 -0.52 -0.04 0.00 -0.26 0.00 0.00 64.21 63.55 3kt0 n SER 218 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3kt0 s ASP 219 N -3.95 6.45 0.74 4.04 1.01 -0.43 -5.03 116.67 119.51 3kt0 s ASP 219 Ca 0.11 1.91 -0.12 0.00 0.71 0.00 0.00 52.55 55.16 3kt0 s ASP 219 Cb 0.15 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.56 3kt0 s ASP 219 CO 0.60 -0.70 1.11 0.00 0.21 0.00 0.00 175.17 176.38 3kt0 h ILE 221 N -0.77 0.75 -0.69 0.00 3.07 -1.96 -2.32 117.51 115.59 3kt0 h ILE 221 Ca -0.45 -1.02 0.09 0.00 1.55 0.00 0.00 64.86 65.04 3kt0 h ILE 221 Cb 1.24 1.64 -0.07 0.00 -0.27 0.00 0.00 36.82 39.35 3kt0 h ILE 221 CO 0.51 0.24 0.32 1.23 -1.05 0.00 0.00 178.15 179.41 3kt0 h GLY 222 N 1.47 1.02 0.89 0.16 0.00 -1.99 -1.45 103.07 103.17 3kt0 h GLY 222 Ca -0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 3kt0 h GLY 222 CO 0.03 0.04 -0.01 0.50 0.00 0.00 0.00 176.54 177.10 3kt0 h LYS 223 N 0.55 0.55 -0.94 4.80 1.57 -1.79 -1.50 116.57 119.81 3kt0 h LYS 223 Ca 0.34 -0.18 0.15 0.00 -1.87 0.00 0.00 60.65 59.09 3kt0 h LYS 223 Cb 0.38 -0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.56 3kt0 h LYS 223 CO -0.28 0.70 0.60 0.74 -0.57 0.00 0.00 179.45 180.63 3kt0 h PHE 224 N 0.35 0.91 0.00 -1.35 -1.00 -1.27 -2.76 116.94 111.81 3kt0 h PHE 224 Ca 0.09 0.03 -0.15 0.00 2.81 0.00 0.00 57.97 60.74 3kt0 h PHE 224 Cb 0.45 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.70 3kt0 h PHE 224 CO 0.04 0.31 -1.14 1.25 -1.61 0.00 0.00 178.31 177.15 3kt0 h HIS 225 N 0.74 0.00 -0.74 -0.55 2.76 -1.05 -3.41 115.15 112.91 3kt0 h HIS 225 Ca 0.48 0.00 0.10 0.00 -2.20 0.00 0.00 60.37 58.75 3kt0 h HIS 225 Cb 0.75 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.66 3kt0 h HIS 225 CO -0.00 0.58 0.48 0.35 -1.30 0.00 0.00 177.93 178.04 3kt0 h PHE 226 N 0.00 0.67 -0.99 5.26 3.57 -0.97 0.08 116.94 124.56 3kt0 h PHE 226 Ca -0.11 0.02 0.28 0.00 3.53 0.00 0.00 57.97 61.68 3kt0 h PHE 226 Cb 1.54 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 40.01 3kt0 h PHE 226 CO 0.00 0.32 0.70 0.00 -2.23 0.00 0.00 178.31 177.09 3kt0 h ALA 227 N 1.63 2.78 -0.66 2.41 0.00 -1.80 0.33 119.26 123.95 3kt0 h ALA 227 Ca 0.34 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.30 3kt0 h ALA 227 Cb 0.48 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 3kt0 h ALA 227 CO -0.12 -1.08 0.35 0.77 0.00 0.00 0.00 179.25 179.18 3kt0 h SER 228 N 0.09 0.51 0.01 0.00 0.02 -1.30 0.04 113.55 112.91 3kt0 h SER 228 Ca 0.49 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.47 3kt0 h SER 228 Cb 1.77 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 64.25 3kt0 h SER 228 CO -0.06 0.32 -0.00 0.40 -1.14 0.00 0.00 176.83 176.35 3kt0 h ILE 229 N 0.64 1.42 -0.39 3.27 2.04 -1.10 -2.38 117.51 121.01 3kt0 h ILE 229 Ca 0.30 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 64.88 3kt0 h ILE 229 Cb 0.22 2.29 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 3kt0 h ILE 229 CO -0.20 0.33 0.26 -0.61 0.00 0.00 0.00 178.15 177.93 3kt0 h GLN 230 N -0.56 0.52 -0.26 2.37 -0.00 -1.40 -2.72 115.11 113.06 3kt0 h GLN 230 Ca -0.00 -0.03 -0.07 0.00 -0.00 0.00 0.00 58.65 58.54 3kt0 h GLN 230 Cb 0.55 -0.12 -0.01 0.00 0.00 0.00 0.00 27.48 27.90 3kt0 h GLN 230 CO 0.00 0.35 -0.15 0.82 0.00 0.00 0.00 178.83 179.85 3kt0 h ILE 231 N 0.53 1.23 0.00 2.39 2.04 -1.06 -2.54 117.51 120.10 3kt0 h ILE 231 Ca 0.14 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.96 3kt0 h ILE 231 Cb -0.05 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3kt0 h ILE 231 CO -0.03 0.33 -0.02 0.00 0.00 0.00 0.00 178.15 178.43 3kt0 h ALA 232 N 1.43 1.68 0.00 1.87 0.00 -1.10 -1.82 119.26 121.32 3kt0 h ALA 232 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3kt0 h ALA 232 Cb 0.51 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3kt0 h ALA 232 CO 0.03 0.03 0.00 0.25 0.00 0.00 0.00 179.25 179.56 3kt0 n THR 233 N -4.10 0.55 1.44 0.00 -2.24 -0.95 -2.53 114.28 106.45 3kt0 n THR 233 Ca -0.03 0.14 0.14 0.00 -2.27 0.00 0.00 64.05 62.03 3kt0 n THR 233 Cb 0.11 -0.80 0.63 0.00 -2.10 0.00 0.00 70.33 68.16 3kt0 n THR 233 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kt0 n ALA 234 N -1.42 2.74 -2.71 6.98 0.00 -0.69 -4.86 120.51 120.55 3kt0 n ALA 234 Ca 0.06 -0.27 -0.32 0.00 0.00 0.00 0.00 53.44 52.92 3kt0 n ALA 234 Cb 0.21 -1.34 -0.15 0.00 0.00 0.00 0.00 19.45 18.16 3kt0 n ALA 234 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3kt0 s PHE 235 N -2.44 2.54 0.43 0.00 0.08 -1.05 -4.34 117.98 113.20 3kt0 s PHE 235 Ca 0.30 -0.58 0.31 0.00 0.12 0.00 0.00 56.93 57.08 3kt0 s PHE 235 Cb 0.20 -1.64 1.62 0.00 -0.57 0.00 0.00 43.02 42.64 3kt0 s PHE 235 CO 0.46 -0.12 2.12 -1.00 -0.10 0.00 0.00 175.22 176.58 3kt0 h PRO 236 N 5.97 0.00 -0.37 0.24 0.13 -1.81 -2.41 132.00 133.75 3kt0 h PRO 236 Ca -0.35 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.89 3kt0 h PRO 236 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 3kt0 h PRO 236 CO 0.49 0.08 0.32 0.66 -0.23 0.00 0.00 178.00 179.32 3kt0 h SER 237 N 0.00 0.00 0.68 1.44 4.64 -1.85 0.64 113.55 119.11 3kt0 h SER 237 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kt0 h SER 237 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3kt0 h SER 237 CO 0.01 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.77 3kt0 n SER 238 N -4.07 0.00 -2.65 4.97 7.64 -0.91 -4.14 113.62 114.46 3kt0 n SER 238 Ca 0.06 0.42 -0.18 0.00 1.01 0.00 0.00 58.87 60.18 3kt0 n SER 238 Cb 0.50 -0.47 0.01 0.00 -1.01 0.00 0.00 64.21 63.24 3kt0 n SER 238 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3kt0 n PHE 239 N -1.47 2.22 0.08 1.43 3.72 0.22 -3.95 117.46 119.71 3kt0 n PHE 239 Ca 0.06 -3.10 0.04 0.00 -0.05 0.00 0.00 57.45 54.40 3kt0 n PHE 239 Cb 0.24 -0.27 0.44 0.00 -0.94 0.00 0.00 39.48 38.94 3kt0 n PHE 239 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3kt0 h PRO 240 N 2.83 0.36 -0.05 -1.08 0.13 -1.72 0.74 132.00 133.21 3kt0 h PRO 240 Ca 0.10 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 3kt0 h PRO 240 Cb 1.01 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.06 3kt0 h PRO 240 CO 0.67 0.33 0.00 0.09 -0.23 0.00 0.00 178.00 178.85 3kt0 n ASN 241 N -4.41 2.72 -0.09 1.44 3.02 -1.26 -2.89 115.26 113.79 3kt0 n ASN 241 Ca 0.01 -1.85 -0.18 0.00 -0.03 0.00 0.00 54.58 52.53 3kt0 n ASN 241 Cb 0.14 -0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.24 3kt0 n ASN 241 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3kt0 n VAL 242 N 1.14 1.19 -0.11 2.41 0.31 -0.91 -2.86 118.33 119.50 3kt0 n VAL 242 Ca 0.12 -0.15 -0.22 0.00 -0.01 0.00 0.00 64.34 64.08 3kt0 n VAL 242 Cb 0.51 -1.87 -0.10 0.00 -0.91 0.00 0.00 33.84 31.47 3kt0 n VAL 242 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3kt0 n LEU 243 N -3.98 1.88 -3.61 7.52 4.77 0.20 -0.54 117.00 123.25 3kt0 n LEU 243 Ca -0.32 0.42 -0.24 0.00 -0.03 0.00 0.00 56.01 55.84 3kt0 n LEU 243 Cb 0.68 -0.91 0.08 0.00 -2.33 0.00 0.00 43.42 40.93 3kt0 n LEU 243 CO 0.06 0.26 0.23 0.61 -1.33 0.00 0.00 177.39 177.21 3kt0 n GLY 244 N 1.40 -0.53 3.85 -0.72 0.00 -0.99 -4.85 105.19 103.35 3kt0 n GLY 244 Ca -0.35 0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 3kt0 n GLY 244 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kt0 s LEU 245 N -7.25 4.01 0.61 0.99 1.43 -1.26 -5.09 118.68 112.12 3kt0 s LEU 245 Ca 0.55 0.02 -0.18 0.00 -1.03 0.00 0.00 54.13 53.49 3kt0 s LEU 245 Cb -0.25 -2.62 -0.04 0.00 0.03 0.00 0.00 46.19 43.31 3kt0 s LEU 245 CO 0.74 0.10 0.95 -2.65 0.23 0.00 0.00 176.35 175.71 3kt0 n PRO 246 N -0.17 0.84 -0.11 1.29 -0.02 -1.26 -4.73 135.00 130.85 3kt0 n PRO 246 Ca -0.08 0.33 0.26 0.00 -2.02 0.00 0.00 63.50 61.99 3kt0 n PRO 246 Cb 0.53 -2.16 0.71 0.00 -0.02 0.00 0.00 33.50 32.57 3kt0 n PRO 246 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3kt0 h ASP 247 N 0.40 0.00 -0.48 2.55 3.45 -1.97 -1.31 116.42 119.06 3kt0 h ASP 247 Ca -0.49 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.97 3kt0 h ASP 247 Cb 1.37 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.14 3kt0 h ASP 247 CO 0.50 0.00 0.00 0.29 -1.57 0.00 0.00 179.24 178.46 3kt0 n LYS 248 N -4.28 4.06 -2.52 3.56 5.02 -1.26 -4.32 118.16 118.41 3kt0 n LYS 248 Ca 0.15 -2.55 -0.42 0.00 -2.02 0.00 0.00 58.31 53.47 3kt0 n LYS 248 Cb 0.83 -2.08 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 3kt0 n LYS 248 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3kt0 s THR 249 N -2.34 4.42 0.60 -0.18 2.01 -0.50 -4.37 115.64 115.28 3kt0 s THR 249 Ca 0.44 1.72 -0.08 0.00 0.31 0.00 0.00 61.69 64.08 3kt0 s THR 249 Cb 0.33 -4.11 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 3kt0 s THR 249 CO 0.14 -0.03 0.95 -2.16 -0.69 0.00 0.00 174.62 172.84 3kt0 s PRO 250 N 2.39 3.21 0.34 4.92 0.04 -1.26 -4.43 135.00 140.22 3kt0 s PRO 250 Ca 0.53 0.34 0.08 0.00 0.04 0.00 0.00 61.00 61.99 3kt0 s PRO 250 Cb -0.22 -2.19 -0.05 0.00 0.04 0.00 0.00 34.50 32.08 3kt0 s PRO 250 CO 0.19 -0.63 0.10 0.00 0.04 0.00 0.00 177.00 176.70 3kt0 s LEU 252 N -3.81 3.16 -0.28 0.00 2.96 -0.09 -0.32 118.68 120.30 3kt0 s LEU 252 Ca 0.37 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.15 3kt0 s LEU 252 Cb -0.02 -1.75 0.07 0.00 0.50 0.00 0.00 46.19 45.00 3kt0 s LEU 252 CO 0.22 0.19 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.77 3kt0 s ILE 253 N 0.26 1.88 0.14 6.68 1.01 0.99 -1.97 121.20 130.19 3kt0 s ILE 253 Ca -0.04 -1.66 -0.31 0.00 0.00 0.00 0.00 60.65 58.64 3kt0 s ILE 253 Cb -0.14 -2.17 -0.08 0.00 0.01 0.00 0.00 42.46 40.07 3kt0 s ILE 253 CO 0.03 -0.25 1.39 -2.84 0.00 0.00 0.00 174.94 173.28 3kt0 s PRO 254 N 1.19 4.32 0.29 2.79 0.02 -1.26 -1.74 135.00 140.60 3kt0 s PRO 254 Ca -0.01 2.11 -0.08 0.00 0.02 0.00 0.00 61.00 63.03 3kt0 s PRO 254 Cb -0.19 -3.22 -0.00 0.00 0.02 0.00 0.00 34.50 31.10 3kt0 s PRO 254 CO -0.08 -0.42 0.46 0.00 -0.33 0.00 0.00 177.00 176.63 3kt0 s ALA 256 N -3.57 3.27 0.32 0.00 0.00 -1.26 -0.04 121.76 120.47 3kt0 s ALA 256 Ca 0.27 0.04 0.03 0.00 0.00 0.00 0.00 51.96 52.30 3kt0 s ALA 256 Cb -0.00 -2.83 0.61 0.00 0.00 0.00 0.00 23.12 20.89 3kt0 s ALA 256 CO 0.14 0.17 1.90 0.97 0.00 0.00 0.00 175.76 178.94 3kt0 h ILE 257 N 1.66 1.00 0.00 0.00 6.09 -1.66 -1.19 117.51 123.41 3kt0 h ILE 257 Ca -0.48 -0.32 0.00 0.00 -1.37 0.00 0.00 64.86 62.69 3kt0 h ILE 257 Cb 1.18 -0.01 0.00 0.00 0.47 0.00 0.00 36.82 38.45 3kt0 h ILE 257 CO 0.64 0.17 0.00 -0.90 -3.07 0.00 0.00 178.15 174.99 3kt0 n ASP 258 N -4.52 0.00 -0.31 2.19 5.75 -1.26 -1.92 116.55 116.48 3kt0 n ASP 258 Ca 0.15 0.14 0.14 0.00 -0.01 0.00 0.00 54.79 55.21 3kt0 n ASP 258 Cb 0.27 -0.35 0.56 0.00 -1.03 0.00 0.00 41.12 40.57 3kt0 n ASP 258 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3kt0 n GLN 259 N -1.35 1.25 -0.16 0.11 6.02 -0.45 -4.40 117.38 118.40 3kt0 n GLN 259 Ca 0.08 -0.63 -0.06 0.00 -0.01 0.00 0.00 57.00 56.39 3kt0 n GLN 259 Cb 0.19 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 30.00 3kt0 n GLN 259 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 3kt0 h ASP 260 N 1.54 0.45 -0.69 1.08 3.58 -1.48 -1.94 116.42 118.96 3kt0 h ASP 260 Ca 0.00 0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.49 3kt0 h ASP 260 Cb 0.42 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.34 3kt0 h ASP 260 CO 0.00 0.32 0.46 -0.65 -2.88 0.00 0.00 179.24 176.49 3kt0 h PRO 261 N 0.57 0.80 -0.24 0.28 0.11 -1.83 -0.06 132.00 131.63 3kt0 h PRO 261 Ca 0.20 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 3kt0 h PRO 261 Cb 0.04 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 30.96 3kt0 h PRO 261 CO -0.10 0.53 0.13 -0.92 -0.21 0.00 0.00 178.00 177.42 3kt0 h TYR 262 N 0.83 0.34 0.00 0.65 5.03 -1.73 -2.85 116.97 119.24 3kt0 h TYR 262 Ca 0.28 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.58 3kt0 h TYR 262 Cb 0.07 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 38.25 3kt0 h TYR 262 CO -0.00 0.31 0.00 0.74 -1.32 0.00 0.00 178.16 177.89 3kt0 h PHE 263 N 0.27 0.00 -0.20 -3.82 0.04 -0.72 -1.85 116.94 110.67 3kt0 h PHE 263 Ca 0.08 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.74 3kt0 h PHE 263 Cb 0.09 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.22 3kt0 h PHE 263 CO -0.03 0.00 -0.38 0.00 -0.60 0.00 0.00 178.31 177.30 3kt0 h ARG 264 N 0.00 0.45 -0.34 1.51 3.08 -0.90 0.46 114.38 118.64 3kt0 h ARG 264 Ca 0.00 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 59.81 3kt0 h ARG 264 Cb 0.68 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 3kt0 h ARG 264 CO 0.00 0.77 0.10 0.28 -1.07 0.00 0.00 179.97 180.05 3kt0 h VAL 265 N 0.38 1.21 -0.59 2.04 2.07 -1.12 -0.05 116.25 120.18 3kt0 h VAL 265 Ca 0.04 -0.68 0.07 0.00 0.82 0.00 0.00 66.70 66.95 3kt0 h VAL 265 Cb 0.84 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 3kt0 h VAL 265 CO 0.07 0.23 0.27 0.00 0.02 0.00 0.00 177.57 178.16 3kt0 h ARG 267 N 0.49 0.53 -0.45 0.00 3.08 -0.68 -1.22 114.38 116.14 3kt0 h ARG 267 Ca 0.28 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 3kt0 h ARG 267 Cb 0.27 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 3kt0 h ARG 267 CO -0.23 0.81 -0.03 0.22 -1.07 0.00 0.00 179.97 179.66 3kt0 h ASP 268 N 0.45 0.80 -0.63 7.04 3.58 -0.57 -2.79 116.42 124.30 3kt0 h ASP 268 Ca 0.05 -0.33 0.02 0.00 0.42 0.00 0.00 57.03 57.19 3kt0 h ASP 268 Cb 0.82 -0.22 -0.04 0.00 1.72 0.00 0.00 39.33 41.62 3kt0 h ASP 268 CO 0.07 0.93 0.40 0.58 -2.88 0.00 0.00 179.24 178.34 3kt0 h VAL 269 N 0.65 1.11 -0.22 2.25 2.07 -0.61 -2.57 116.25 118.93 3kt0 h VAL 269 Ca 0.12 -0.27 0.06 0.00 0.82 0.00 0.00 66.70 67.43 3kt0 h VAL 269 Cb 0.54 0.24 -0.07 0.00 -1.52 0.00 0.00 31.29 30.49 3kt0 h VAL 269 CO 0.03 0.14 -0.29 0.00 0.02 0.00 0.00 177.57 177.47 3kt0 h ALA 270 N 1.26 -0.24 -0.41 1.67 0.00 -1.11 -0.55 119.26 119.86 3kt0 h ALA 270 Ca 0.25 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.30 3kt0 h ALA 270 Cb -0.02 0.58 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 3kt0 h ALA 270 CO -0.08 -0.73 -0.13 -0.44 0.00 0.00 0.00 179.25 177.86 3kt0 h ASP 271 N -0.31 -0.47 -0.06 0.00 3.45 -1.34 0.15 116.42 117.83 3kt0 h ASP 271 Ca 0.12 0.13 -0.03 0.00 0.43 0.00 0.00 57.03 57.69 3kt0 h ASP 271 Cb 0.51 0.29 -0.01 0.00 -0.56 0.00 0.00 39.33 39.56 3kt0 h ASP 271 CO -0.40 -0.17 -0.03 0.11 -1.57 0.00 0.00 179.24 177.19 3kt0 h LYS 272 N -0.04 0.25 -0.01 3.56 1.57 -0.97 -1.78 116.57 119.16 3kt0 h LYS 272 Ca 0.20 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3kt0 h LYS 272 Cb 0.35 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3kt0 h LYS 272 CO -0.45 0.31 -0.08 1.28 -0.57 0.00 0.00 179.45 179.94 3kt0 n LEU 273 N -4.36 1.24 -3.05 2.94 4.77 -0.28 -4.94 117.00 113.31 3kt0 n LEU 273 Ca -0.00 -0.38 -0.22 0.00 -0.03 0.00 0.00 56.01 55.38 3kt0 n LEU 273 Cb 0.20 -0.05 0.05 0.00 -2.33 0.00 0.00 43.42 41.29 3kt0 n LEU 273 CO 0.37 0.21 0.07 0.29 -1.33 0.00 0.00 177.39 177.00 3kt0 n LYS 274 N -0.18 -5.61 -3.25 3.23 4.76 -0.51 -5.03 118.16 111.56 3kt0 n LYS 274 Ca 0.17 0.85 -0.21 0.00 -2.87 0.00 0.00 58.31 56.24 3kt0 n LYS 274 Cb 0.34 -5.67 0.04 0.00 -1.84 0.00 0.00 35.03 27.90 3kt0 n LYS 274 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 3kt0 s TYR 275 N -3.20 1.51 -0.04 2.13 2.02 -0.08 -4.76 117.35 114.93 3kt0 s TYR 275 Ca 0.37 -0.74 -0.20 0.00 -0.37 0.00 0.00 57.07 56.13 3kt0 s TYR 275 Cb -0.17 -2.14 -0.05 0.00 -0.40 0.00 0.00 41.96 39.21 3kt0 s TYR 275 CO 0.46 -0.96 0.56 -1.12 -1.57 0.00 0.00 175.55 172.93 3kt0 s SER 276 N -4.56 6.89 0.20 2.29 0.01 -1.26 -4.26 113.70 113.01 3kt0 s SER 276 Ca 0.55 1.06 -0.32 0.00 1.31 0.00 0.00 55.95 58.55 3kt0 s SER 276 Cb -0.05 -2.34 -0.12 0.00 0.21 0.00 0.00 66.02 63.72 3kt0 s SER 276 CO 0.34 0.06 1.75 0.29 0.41 0.00 0.00 173.24 176.09 3kt0 n LYS 277 N 3.04 2.80 -2.24 12.44 5.02 -1.26 -4.72 118.16 133.24 3kt0 n LYS 277 Ca -0.07 1.01 -0.37 0.00 -2.02 0.00 0.00 58.31 56.87 3kt0 n LYS 277 Cb 0.51 -2.87 -0.00 0.00 -0.02 0.00 0.00 35.03 32.65 3kt0 n LYS 277 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3kt0 s PRO 278 N 1.40 3.63 0.39 1.97 0.04 -1.26 -4.70 135.00 136.47 3kt0 s PRO 278 Ca 0.76 1.74 -0.14 0.00 0.04 0.00 0.00 61.00 63.40 3kt0 s PRO 278 Cb -0.50 -2.29 -0.08 0.00 0.04 0.00 0.00 34.50 31.67 3kt0 s PRO 278 CO 0.33 -0.65 0.81 0.00 0.04 0.00 0.00 177.00 177.52 3kt0 s ALA 279 N -1.60 3.26 0.01 8.56 0.00 0.56 -4.90 121.76 127.66 3kt0 s ALA 279 Ca 0.66 0.02 0.06 0.00 0.00 0.00 0.00 51.96 52.70 3kt0 s ALA 279 Cb -0.28 -2.84 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 3kt0 s ALA 279 CO 0.33 0.11 -0.18 -0.51 0.00 0.00 0.00 175.76 175.51 3kt0 s LEU 280 N -3.47 2.10 -0.20 0.00 1.43 -0.00 -0.01 118.68 118.54 3kt0 s LEU 280 Ca 0.55 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 53.26 3kt0 s LEU 280 Cb -0.10 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.29 3kt0 s LEU 280 CO 0.24 0.16 -0.16 -0.76 0.23 0.00 0.00 176.35 176.06 3kt0 s LEU 281 N -0.78 2.40 -0.09 1.79 1.43 -0.71 -1.67 118.68 121.04 3kt0 s LEU 281 Ca 0.06 -0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 52.16 3kt0 s LEU 281 Cb -0.08 -1.44 -0.05 0.00 0.03 0.00 0.00 46.19 44.66 3kt0 s LEU 281 CO 0.00 -0.06 0.45 -1.00 0.23 0.00 0.00 176.35 175.97 3kt0 s HIS 282 N 1.28 3.56 0.19 0.29 3.76 0.31 -0.70 115.29 123.98 3kt0 s HIS 282 Ca 0.01 0.89 0.04 0.00 -0.15 0.00 0.00 55.06 55.85 3kt0 s HIS 282 Cb -0.15 -2.48 -0.03 0.00 1.11 0.00 0.00 32.58 31.03 3kt0 s HIS 282 CO -0.10 0.28 0.31 -1.54 -0.85 0.00 0.00 174.74 172.83 3kt0 s SER 283 N 0.23 6.27 1.10 1.40 1.04 0.95 -1.23 113.70 123.45 3kt0 s SER 283 Ca 0.24 0.10 -0.13 0.00 0.48 0.00 0.00 55.95 56.65 3kt0 s SER 283 Cb -0.15 -1.85 0.24 0.00 0.10 0.00 0.00 66.02 64.36 3kt0 s SER 283 CO 0.10 -0.00 1.06 -0.13 0.98 0.00 0.00 173.24 175.25 3kt0 s ARG 284 N -3.58 -0.36 0.25 4.02 0.52 -0.32 -1.74 118.95 117.74 3kt0 s ARG 284 Ca 0.34 0.65 -0.30 0.00 -0.52 0.00 0.00 55.73 55.90 3kt0 s ARG 284 Cb -0.10 -1.63 -0.09 0.00 0.52 0.00 0.00 34.95 33.64 3kt0 s ARG 284 CO 0.28 -3.30 0.98 -0.06 0.02 0.00 0.00 175.30 173.23 3kt0 s PHE 285 N -2.71 3.87 0.05 -0.53 0.08 -1.26 -4.82 117.98 112.65 3kt0 s PHE 285 Ca 0.67 1.86 -0.31 0.00 0.12 0.00 0.00 56.93 59.27 3kt0 s PHE 285 Cb -0.22 -3.06 -0.06 0.00 -0.57 0.00 0.00 43.02 39.11 3kt0 s PHE 285 CO 0.61 0.18 1.39 0.12 -0.10 0.00 0.00 175.22 177.42 3kt0 s PHE 286 N -1.18 3.02 0.24 0.36 5.36 -1.26 -4.96 117.98 119.55 3kt0 s PHE 286 Ca 0.42 0.89 -0.31 0.00 -0.96 0.00 0.00 56.93 56.97 3kt0 s PHE 286 Cb -0.27 -3.66 -0.11 0.00 -0.34 0.00 0.00 43.02 38.64 3kt0 s PHE 286 CO 0.34 -2.38 1.55 -2.14 -1.46 0.00 0.00 175.22 171.14 3kt0 s PRO 287 N 1.86 4.19 0.52 10.12 0.02 -1.26 -4.97 135.00 145.49 3kt0 s PRO 287 Ca 0.64 2.44 -0.21 0.00 0.02 0.00 0.00 61.00 63.89 3kt0 s PRO 287 Cb -0.33 -3.08 -0.06 0.00 0.02 0.00 0.00 34.50 31.05 3kt0 s PRO 287 CO 0.28 -0.57 1.23 0.00 -0.33 0.00 0.00 177.00 177.61 3kt0 s ALA 288 N 0.37 2.80 0.20 -1.55 0.00 -1.26 -4.93 121.76 117.39 3kt0 s ALA 288 Ca 0.65 1.07 -0.12 0.00 0.00 0.00 0.00 51.96 53.56 3kt0 s ALA 288 Cb -0.45 -3.46 0.25 0.00 0.00 0.00 0.00 23.12 19.46 3kt0 s ALA 288 CO 0.41 -1.01 1.69 1.25 0.00 0.00 0.00 175.76 178.09 3kt0 h LEU 289 N 1.52 -0.15 -1.04 0.00 5.85 -1.91 -1.79 115.31 117.80 3kt0 h LEU 289 Ca -0.50 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.34 3kt0 h LEU 289 Cb 1.28 0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.51 3kt0 h LEU 289 CO 0.58 -0.06 0.00 0.00 -0.34 0.00 0.00 178.44 178.62 3kt0 n GLN 290 N -5.21 1.66 -1.06 1.25 6.02 -1.25 -1.75 117.38 117.05 3kt0 n GLN 290 Ca 0.07 -1.01 -0.02 0.00 -0.01 0.00 0.00 57.00 56.03 3kt0 n GLN 290 Cb 0.31 -1.26 -0.01 0.00 1.02 0.00 0.00 30.24 30.29 3kt0 n GLN 290 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kt0 n GLY 291 N 0.99 0.48 0.42 1.08 0.00 -0.67 -4.57 105.19 102.93 3kt0 n GLY 291 Ca 0.11 -0.18 0.02 0.00 0.00 0.00 0.00 46.02 45.98 3kt0 n GLY 291 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3kt0 n ASP 300 N -0.07 -2.28 -1.00 1.61 -0.08 -1.26 -4.56 116.55 108.91 3kt0 n ASP 300 Ca -0.02 0.47 0.11 0.00 -1.51 0.00 0.00 54.79 53.84 3kt0 n ASP 300 Cb 0.20 -1.05 0.26 0.00 2.34 0.00 0.00 41.12 42.87 3kt0 n ASP 300 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 3kt0 n ASP 301 N -2.24 2.96 -0.75 1.67 5.68 -1.26 -3.64 116.55 118.97 3kt0 n ASP 301 Ca -0.01 -1.93 0.13 0.00 -0.50 0.00 0.00 54.79 52.47 3kt0 n ASP 301 Cb 0.16 -0.24 0.23 0.00 -1.14 0.00 0.00 41.12 40.13 3kt0 n ASP 301 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3kt0 n THR 302 N 1.16 0.00 0.77 2.12 -2.24 -1.26 -4.19 114.28 110.63 3kt0 n THR 302 Ca 0.19 -0.39 0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3kt0 n THR 302 Cb 0.52 1.14 -0.08 0.00 -2.10 0.00 0.00 70.33 69.80 3kt0 n THR 302 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3kt0 n THR 303 N 0.81 0.02 -3.57 4.28 -2.24 -1.24 -4.74 114.28 107.61 3kt0 n THR 303 Ca 0.15 -0.12 -0.15 0.00 -2.27 0.00 0.00 64.05 61.66 3kt0 n THR 303 Cb 0.51 0.67 -0.06 0.00 -2.10 0.00 0.00 70.33 69.35 3kt0 n THR 303 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kt0 s ALA 304 N -3.11 -1.42 -0.07 6.98 0.00 -1.26 -3.39 121.76 119.49 3kt0 s ALA 304 Ca 0.05 0.76 -0.22 0.00 0.00 0.00 0.00 51.96 52.55 3kt0 s ALA 304 Cb 0.16 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 23.53 3kt0 s ALA 304 CO 0.85 -0.47 0.63 0.42 0.00 0.00 0.00 175.76 177.19 3kt0 s ILE 305 N -2.12 5.06 0.15 0.00 1.01 -1.26 -4.90 121.20 119.14 3kt0 s ILE 305 Ca -0.07 1.29 0.05 0.00 0.00 0.00 0.00 60.65 61.92 3kt0 s ILE 305 Cb -0.01 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 3kt0 s ILE 305 CO 0.01 0.30 0.11 -0.36 0.00 0.00 0.00 174.94 174.99 3kt0 s PHE 306 N 0.60 3.11 -1.12 3.97 0.08 -1.26 -0.58 117.98 122.77 3kt0 s PHE 306 Ca 0.33 -0.02 0.16 0.00 0.12 0.00 0.00 56.93 57.53 3kt0 s PHE 306 Cb -0.17 -1.51 0.72 0.00 -0.57 0.00 0.00 43.02 41.48 3kt0 s PHE 306 CO 0.16 0.52 1.50 -1.33 -0.10 0.00 0.00 175.22 175.96 3kt0 n MET 307 N -0.16 0.07 0.00 0.44 2.81 -0.16 -1.45 117.12 118.68 3kt0 n MET 307 Ca -0.09 0.20 0.12 0.00 -1.81 0.00 0.00 57.70 56.12 3kt0 n MET 307 Cb 0.54 -1.50 0.15 0.00 -0.71 0.00 0.00 33.22 31.70 3kt0 n MET 307 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3kt0 n THR 308 N -1.44 0.00 -1.96 2.03 -2.24 -1.26 -4.69 114.28 104.71 3kt0 n THR 308 Ca 0.05 -0.33 -0.41 0.00 -2.27 0.00 0.00 64.05 61.09 3kt0 n THR 308 Cb 0.17 1.15 -0.01 0.00 -2.10 0.00 0.00 70.33 69.54 3kt0 n THR 308 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3kt0 s ASP 309 N -2.24 6.49 0.82 3.42 1.01 -0.53 -5.02 116.67 120.63 3kt0 s ASP 309 Ca 0.25 2.85 -0.11 0.00 0.71 0.00 0.00 52.55 56.24 3kt0 s ASP 309 Cb 0.19 -2.66 0.09 0.00 1.01 0.00 0.00 42.92 41.55 3kt0 s ASP 309 CO 0.44 -0.75 1.10 0.42 0.21 0.00 0.00 175.17 176.59 3kt0 s THR 310 N -1.15 2.93 0.24 -1.27 -4.23 -1.26 -4.85 115.64 106.05 3kt0 s THR 310 Ca 0.52 0.30 -0.05 0.00 -1.18 0.00 0.00 61.69 61.29 3kt0 s THR 310 Cb -0.43 -2.98 0.20 0.00 1.34 0.00 0.00 72.50 70.63 3kt0 s THR 310 CO 0.57 -0.40 1.79 -0.65 -0.54 0.00 0.00 174.62 175.39 3kt0 h PRO 311 N -1.21 0.65 -0.36 3.99 0.11 -1.95 -1.66 132.00 131.57 3kt0 h PRO 311 Ca -0.48 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 3kt0 h PRO 311 Cb 1.27 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3kt0 h PRO 311 CO 0.58 0.43 -0.22 -0.22 -0.21 0.00 0.00 178.00 178.36 3kt0 h LYS 312 N 0.67 0.70 -0.35 1.05 3.64 -1.99 -2.24 116.57 118.05 3kt0 h LYS 312 Ca 0.39 -0.28 -0.12 0.00 -1.27 0.00 0.00 60.65 59.38 3kt0 h LYS 312 Cb 0.43 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 3kt0 h LYS 312 CO -0.28 0.87 -0.25 1.96 -2.27 0.00 0.00 179.45 179.47 3kt0 h GLN 313 N 0.62 0.71 -0.12 1.90 4.20 -1.79 -1.14 115.11 119.48 3kt0 h GLN 313 Ca 0.09 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 3kt0 h GLN 313 Cb 0.71 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 3kt0 h GLN 313 CO 0.05 0.89 0.06 0.82 -0.67 0.00 0.00 178.83 179.98 3kt0 h ILE 314 N 0.62 1.13 -0.04 2.54 2.04 -1.18 -0.93 117.51 121.68 3kt0 h ILE 314 Ca 0.08 -0.38 0.03 0.00 1.00 0.00 0.00 64.86 65.59 3kt0 h ILE 314 Cb 0.75 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 3kt0 h ILE 314 CO 0.06 0.12 -0.12 -0.61 0.00 0.00 0.00 178.15 177.60 3kt0 h GLN 315 N 0.07 -0.18 -0.77 2.37 4.15 -1.29 -1.44 115.11 118.02 3kt0 h GLN 315 Ca 0.04 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.45 3kt0 h GLN 315 Cb 0.13 0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.83 3kt0 h GLN 315 CO -0.00 -0.12 0.38 0.87 -1.93 0.00 0.00 178.83 178.02 3kt0 h LYS 316 N -0.18 1.11 -0.22 1.69 1.57 -1.15 -0.44 116.57 118.94 3kt0 h LYS 316 Ca 0.06 -0.16 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 3kt0 h LYS 316 Cb 0.26 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3kt0 h LYS 316 CO -0.15 0.86 -0.14 0.87 -0.57 0.00 0.00 179.45 180.31 3kt0 h LYS 317 N 1.09 0.49 0.25 3.15 1.57 -0.98 0.13 116.57 122.27 3kt0 h LYS 317 Ca 0.27 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3kt0 h LYS 317 Cb 0.11 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3kt0 h LYS 317 CO -0.03 0.79 -0.12 0.82 -0.57 0.00 0.00 179.45 180.34 3kt0 h ILE 318 N 0.20 0.76 -0.60 1.86 1.08 -1.18 0.18 117.51 119.80 3kt0 h ILE 318 Ca 0.05 -0.03 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 3kt0 h ILE 318 Cb 0.66 0.78 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 3kt0 h ILE 318 CO 0.04 0.01 0.39 0.78 -0.69 0.00 0.00 178.15 178.68 3kt0 h ASN 319 N -0.35 0.70 0.34 1.72 2.35 -1.01 -2.51 115.58 116.82 3kt0 h ASN 319 Ca -0.03 -0.03 -0.33 0.00 -0.55 0.00 0.00 56.30 55.36 3kt0 h ASN 319 Cb 0.27 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 3kt0 h ASN 319 CO 0.06 0.51 -1.69 0.50 -1.65 0.00 0.00 177.43 175.16 3kt0 h LYS 320 N 0.82 0.26 0.00 0.81 3.64 -0.77 -3.42 116.57 117.91 3kt0 h LYS 320 Ca 0.22 -0.45 -0.03 0.00 -1.27 0.00 0.00 60.65 59.13 3kt0 h LYS 320 Cb -0.08 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3kt0 h LYS 320 CO -0.05 1.12 -1.39 0.66 -2.27 0.00 0.00 179.45 177.52 3kt0 n TYR 321 N -3.45 0.00 -2.00 1.91 4.02 0.62 -4.99 117.16 113.27 3kt0 n TYR 321 Ca -0.21 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.26 3kt0 n TYR 321 Cb 1.05 -0.22 -0.03 0.00 -0.02 0.00 0.00 39.34 40.13 3kt0 n TYR 321 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3kt0 s ALA 322 N -2.46 3.64 0.15 -0.72 0.00 -0.94 -3.76 121.76 117.66 3kt0 s ALA 322 Ca -0.03 1.08 -0.31 0.00 0.00 0.00 0.00 51.96 52.69 3kt0 s ALA 322 Cb 0.04 -3.69 -0.10 0.00 0.00 0.00 0.00 23.12 19.37 3kt0 s ALA 322 CO 0.32 -1.16 1.69 0.12 0.00 0.00 0.00 175.76 176.73 3kt0 s PHE 323 N 3.02 2.65 -0.13 0.00 5.36 -0.72 -4.90 117.98 123.27 3kt0 s PHE 323 Ca 0.72 0.32 -0.10 0.00 -0.96 0.00 0.00 56.93 56.91 3kt0 s PHE 323 Cb -0.36 -4.06 -0.05 0.00 -0.34 0.00 0.00 43.02 38.21 3kt0 s PHE 323 CO 0.31 -4.12 0.22 0.45 -1.46 0.00 0.00 175.22 170.61 3kt0 s SER 324 N 1.82 6.43 0.00 6.13 0.15 -1.26 -1.29 113.70 125.68 3kt0 s SER 324 Ca 0.75 0.51 0.14 0.00 0.70 0.00 0.00 55.95 58.05 3kt0 s SER 324 Cb -0.45 -2.13 0.40 0.00 -1.71 0.00 0.00 66.02 62.13 3kt0 s SER 324 CO 0.33 0.28 1.33 0.61 1.20 0.00 0.00 173.24 176.99 3kt0 n GLY 325 N 2.59 0.98 3.99 9.45 0.00 -1.26 -4.87 105.19 116.07 3kt0 n GLY 325 Ca -0.16 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 3kt0 n GLY 325 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kt0 s GLY 326 N -1.04 1.77 0.55 -0.02 0.00 -1.26 0.38 107.32 107.69 3kt0 s GLY 326 Ca 0.29 -1.64 -0.06 0.00 0.00 0.00 0.00 44.72 43.31 3kt0 s GLY 326 CO 0.20 -1.11 0.86 1.20 0.00 0.00 0.00 173.10 174.25 3kt0 s GLN 327 N -5.10 3.25 0.00 2.90 -1.52 -1.26 -4.95 119.66 112.97 3kt0 s GLN 327 Ca 0.65 0.15 0.22 0.00 -1.95 0.00 0.00 55.36 54.43 3kt0 s GLN 327 Cb -0.06 -2.30 0.99 0.00 -0.22 0.00 0.00 33.01 31.42 3kt0 s GLN 327 CO 0.44 -0.47 1.70 1.33 -0.25 0.00 0.00 175.29 178.03 3kt0 n VAL 328 N -2.46 0.44 -4.11 1.09 0.24 -1.26 -4.73 118.33 107.54 3kt0 n VAL 328 Ca 0.03 0.11 -0.09 0.00 -2.04 0.00 0.00 64.34 62.34 3kt0 n VAL 328 Cb 0.56 -0.74 -0.10 0.00 -1.47 0.00 0.00 33.84 32.09 3kt0 n VAL 328 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3kt0 s SER 329 N -2.84 0.81 0.20 -1.34 1.04 -1.26 -5.05 113.70 105.26 3kt0 s SER 329 Ca 0.14 -0.91 -0.10 0.00 0.48 0.00 0.00 55.95 55.56 3kt0 s SER 329 Cb 0.14 0.12 0.14 0.00 0.10 0.00 0.00 66.02 66.52 3kt0 s SER 329 CO 0.37 -0.47 1.83 0.00 0.98 0.00 0.00 173.24 175.95 3kt0 h ALA 330 N 3.35 0.92 -0.21 5.32 0.00 -1.99 -0.64 119.26 126.02 3kt0 h ALA 330 Ca -0.35 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.48 3kt0 h ALA 330 Cb 1.16 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 3kt0 h ALA 330 CO 0.60 0.42 0.07 -0.44 0.00 0.00 0.00 179.25 179.90 3kt0 h ASP 331 N 0.99 0.07 -0.67 0.00 3.32 -1.98 -0.16 116.42 118.00 3kt0 h ASP 331 Ca 0.26 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.33 3kt0 h ASP 331 Cb 0.01 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 3kt0 h ASP 331 CO -0.04 0.07 0.42 -0.07 -1.72 0.00 0.00 179.24 177.89 3kt0 h LEU 332 N 0.16 0.80 -0.34 1.55 4.07 -1.92 -2.50 115.31 117.12 3kt0 h LEU 332 Ca 0.09 -0.04 -0.09 0.00 0.08 0.00 0.00 57.88 57.92 3kt0 h LEU 332 Cb 0.06 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.59 3kt0 h LEU 332 CO -0.10 0.61 -0.15 -0.74 -1.08 0.00 0.00 178.44 176.98 3kt0 h HIS 333 N 0.93 0.81 -0.72 1.13 2.76 -0.29 0.22 115.15 119.98 3kt0 h HIS 333 Ca 0.25 -0.20 -0.01 0.00 -2.20 0.00 0.00 60.37 58.21 3kt0 h HIS 333 Cb -0.05 -0.19 -0.04 0.00 1.55 0.00 0.00 27.41 28.68 3kt0 h HIS 333 CO 0.00 0.90 0.42 0.00 -1.30 0.00 0.00 177.93 177.96 3kt0 h ARG 334 N 0.48 0.98 0.07 5.26 2.47 -0.94 0.22 114.38 122.92 3kt0 h ARG 334 Ca 0.08 -0.09 -0.14 0.00 -1.26 0.00 0.00 59.98 58.56 3kt0 h ARG 334 Cb 0.68 -0.21 0.01 0.00 -1.65 0.00 0.00 29.97 28.81 3kt0 h ARG 334 CO 0.05 0.70 -0.60 1.49 0.56 0.00 0.00 179.97 182.17 3kt0 h GLU 335 N 1.00 0.29 0.00 0.04 4.57 -1.20 -3.40 114.58 115.87 3kt0 h GLU 335 Ca 0.26 -0.40 -0.13 0.00 -1.18 0.00 0.00 59.36 57.91 3kt0 h GLU 335 Cb -0.02 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 3kt0 h GLU 335 CO -0.05 1.14 -1.98 1.28 -1.18 0.00 0.00 179.01 178.22 3kt0 n LEU 336 N -4.25 0.00 -0.06 1.64 4.77 0.75 -5.07 117.00 114.79 3kt0 n LEU 336 Ca -0.12 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.87 3kt0 n LEU 336 Cb 0.70 0.17 -0.00 0.00 -2.33 0.00 0.00 43.42 41.96 3kt0 n LEU 336 CO 0.45 0.17 -0.02 0.61 -1.33 0.00 0.00 177.39 177.28 3kt0 n GLY 337 N 1.65 -2.00 3.80 -0.72 0.00 0.76 -4.94 105.19 103.74 3kt0 n GLY 337 Ca -0.13 -1.48 -0.22 0.00 0.00 0.00 0.00 46.02 44.18 3kt0 n GLY 337 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kt0 s GLY 338 N -5.04 1.82 -0.37 -0.02 0.00 0.29 -4.49 107.32 99.51 3kt0 s GLY 338 Ca 0.00 -1.71 -0.04 0.00 0.00 0.00 0.00 44.72 42.97 3kt0 s GLY 338 CO 0.00 -1.65 0.15 0.21 0.00 0.00 0.00 173.10 171.81 3kt0 s ASN 339 N -3.92 5.21 0.36 1.64 3.04 0.16 -3.57 114.94 117.87 3kt0 s ASN 339 Ca 0.39 -1.68 0.27 0.00 0.04 0.00 0.00 52.86 51.88 3kt0 s ASN 339 Cb -0.05 -1.82 1.06 0.00 -1.54 0.00 0.00 41.25 38.91 3kt0 s ASN 339 CO 0.25 -0.45 1.80 1.55 -3.04 0.00 0.00 177.10 177.21 3kt0 h PRO 340 N 8.10 0.00 -0.30 0.43 0.13 -1.88 -2.73 132.00 135.75 3kt0 h PRO 340 Ca -0.17 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.91 3kt0 h PRO 340 Cb 1.06 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 3kt0 h PRO 340 CO 0.65 0.00 -0.02 -0.44 -0.23 0.00 0.00 178.00 177.96 3kt0 h ASP 341 N 0.00 0.43 -0.01 1.44 3.32 -1.97 -3.04 116.42 116.59 3kt0 h ASP 341 Ca 0.00 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.97 3kt0 h ASP 341 Cb 0.48 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3kt0 h ASP 341 CO 0.00 0.51 -0.41 1.33 -1.72 0.00 0.00 179.24 178.96 3kt0 n VAL 342 N -4.29 0.00 -2.36 -1.35 0.24 -1.17 -4.97 118.33 104.43 3kt0 n VAL 342 Ca 0.01 -0.30 -0.43 0.00 -2.04 0.00 0.00 64.34 61.58 3kt0 n VAL 342 Cb 0.24 1.13 -0.02 0.00 -1.47 0.00 0.00 33.84 33.72 3kt0 n VAL 342 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3kt0 s ASP 343 N -1.95 6.61 0.19 -1.34 -1.08 -1.04 -4.49 116.67 113.58 3kt0 s ASP 343 Ca 0.11 1.29 -0.11 0.00 -0.52 0.00 0.00 52.55 53.32 3kt0 s ASP 343 Cb 0.12 -2.54 0.12 0.00 -1.46 0.00 0.00 42.92 39.16 3kt0 s ASP 343 CO 0.43 -1.12 1.79 0.58 0.52 0.00 0.00 175.17 177.38 3kt0 h VAL 344 N 6.00 1.22 -0.25 1.11 2.07 -1.51 -1.04 116.25 123.86 3kt0 h VAL 344 Ca -0.28 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 66.66 3kt0 h VAL 344 Cb 1.11 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 3kt0 h VAL 344 CO 1.03 0.26 0.09 0.00 0.02 0.00 0.00 177.57 178.97 3kt0 h ALA 345 N 1.17 0.28 -0.49 1.67 0.00 -1.91 -0.19 119.26 119.79 3kt0 h ALA 345 Ca 0.24 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 3kt0 h ALA 345 Cb 0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3kt0 h ALA 345 CO -0.03 -0.32 0.22 -0.92 0.00 0.00 0.00 179.25 178.20 3kt0 h TYR 346 N 0.21 0.72 -0.12 0.00 5.03 -1.79 -1.57 116.97 119.46 3kt0 h TYR 346 Ca 0.11 -0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.37 3kt0 h TYR 346 Cb 0.06 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.11 3kt0 h TYR 346 CO -0.12 0.58 0.08 1.96 -1.32 0.00 0.00 178.16 179.35 3kt0 h GLN 347 N 0.65 0.16 -0.40 1.82 1.08 -0.91 0.00 115.11 117.52 3kt0 h GLN 347 Ca 0.17 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.34 3kt0 h GLN 347 Cb 0.14 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 3kt0 h GLN 347 CO -0.02 0.12 0.19 1.88 -0.95 0.00 0.00 178.83 180.06 3kt0 h TYR 348 N 0.15 0.58 -0.50 2.96 -1.99 -1.01 -0.77 116.97 116.40 3kt0 h TYR 348 Ca 0.04 -0.03 0.09 0.00 2.00 0.00 0.00 58.73 60.84 3kt0 h TYR 348 Cb -0.00 -0.18 -0.07 0.00 2.00 0.00 0.00 36.73 38.47 3kt0 h TYR 348 CO -0.07 0.48 0.07 1.25 -0.00 0.00 0.00 178.16 179.90 3kt0 h LEU 349 N 0.51 -0.07 -1.25 3.88 6.46 -1.08 -1.59 115.31 122.18 3kt0 h LEU 349 Ca 0.14 0.10 -0.07 0.00 -0.12 0.00 0.00 57.88 57.93 3kt0 h LEU 349 Cb 0.12 0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 3kt0 h LEU 349 CO -0.02 -0.01 -0.31 0.77 -0.62 0.00 0.00 178.44 178.26 3kt0 h SER 350 N 0.20 0.00 0.56 1.25 4.64 -0.25 -0.52 113.55 119.42 3kt0 h SER 350 Ca 0.25 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.36 3kt0 h SER 350 Cb 0.35 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 3kt0 h SER 350 CO -0.36 0.31 -0.95 -0.26 -0.87 0.00 0.00 176.83 174.70 3kt0 h PHE 351 N 0.00 0.38 -0.19 4.77 0.04 -0.48 -3.37 116.94 118.08 3kt0 h PHE 351 Ca -0.00 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 60.55 3kt0 h PHE 351 Cb 0.71 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.82 3kt0 h PHE 351 CO 0.00 1.06 0.00 1.19 -0.60 0.00 0.00 178.31 179.96 3kt0 n PHE 352 N -3.64 0.25 -4.75 -0.55 3.72 -0.66 -4.88 117.46 106.94 3kt0 n PHE 352 Ca -0.05 -0.25 -0.28 0.00 -0.05 0.00 0.00 57.45 56.82 3kt0 n PHE 352 Cb 0.85 -0.01 -0.17 0.00 -0.94 0.00 0.00 39.48 39.21 3kt0 n PHE 352 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3kt0 s LYS 353 N -1.00 2.34 -0.62 -1.08 2.20 -0.23 -4.96 119.74 116.39 3kt0 s LYS 353 Ca 0.19 -0.62 -0.13 0.00 -0.36 0.00 0.00 55.97 55.05 3kt0 s LYS 353 Cb 0.11 -1.88 0.16 0.00 -1.51 0.00 0.00 37.83 34.72 3kt0 s LYS 353 CO 0.16 0.05 0.55 0.34 -0.36 0.00 0.00 175.35 176.09 3kt0 s ASP 354 N 0.67 6.23 -0.38 1.43 2.15 -1.26 -4.72 116.67 120.78 3kt0 s ASP 354 Ca -0.13 -2.16 0.01 0.00 0.43 0.00 0.00 52.55 50.70 3kt0 s ASP 354 Cb -0.16 -2.15 0.18 0.00 -0.30 0.00 0.00 42.92 40.49 3kt0 s ASP 354 CO 0.04 -0.71 0.79 -0.62 -0.17 0.00 0.00 175.17 174.49 3kt0 s ASP 355 N 2.81 -1.08 0.35 -0.34 -1.08 -1.26 -5.06 116.67 111.02 3kt0 s ASP 355 Ca 0.09 -0.54 0.04 0.00 -0.52 0.00 0.00 52.55 51.62 3kt0 s ASP 355 Cb -0.23 1.38 0.67 0.00 -1.46 0.00 0.00 42.92 43.29 3kt0 s ASP 355 CO -0.02 -0.12 1.97 0.44 0.52 0.00 0.00 175.17 177.96 3kt0 h ASP 356 N 6.41 0.72 0.04 -0.34 3.32 -1.99 -0.32 116.42 124.26 3kt0 h ASP 356 Ca 0.02 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 3kt0 h ASP 356 Cb 1.20 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.59 3kt0 h ASP 356 CO 0.03 0.49 -0.02 0.58 -1.72 0.00 0.00 179.24 178.60 3kt0 h VAL 357 N 0.83 1.30 -0.30 -1.35 2.07 -1.99 -0.86 116.25 115.96 3kt0 h VAL 357 Ca 0.29 -1.16 0.02 0.00 0.82 0.00 0.00 66.70 66.68 3kt0 h VAL 357 Cb 0.12 2.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 3kt0 h VAL 357 CO -0.09 0.29 0.13 0.15 0.02 0.00 0.00 177.57 178.07 3kt0 h PHE 358 N -0.57 0.24 -0.65 1.57 3.04 -1.95 -1.76 116.94 116.86 3kt0 h PHE 358 Ca -0.01 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.92 3kt0 h PHE 358 Cb 0.51 -0.06 -0.03 0.00 2.56 0.00 0.00 35.95 38.93 3kt0 h PHE 358 CO 0.10 0.12 0.26 -0.07 -2.02 0.00 0.00 178.31 176.70 3kt0 h LEU 359 N 0.28 0.90 -0.68 0.59 4.07 -1.07 -1.34 115.31 118.07 3kt0 h LEU 359 Ca 0.13 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.92 3kt0 h LEU 359 Cb 0.06 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.54 3kt0 h LEU 359 CO -0.10 0.83 0.43 0.50 -1.08 0.00 0.00 178.44 179.02 3kt0 h LYS 360 N 0.92 0.91 -0.28 1.13 3.64 -0.98 -0.25 116.57 121.65 3kt0 h LYS 360 Ca 0.22 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.56 3kt0 h LYS 360 Cb 0.21 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.80 3kt0 h LYS 360 CO -0.02 0.62 0.11 1.49 -2.27 0.00 0.00 179.45 179.38 3kt0 h GLU 361 N 0.92 0.23 -0.55 1.90 4.81 -0.99 -0.96 114.58 119.95 3kt0 h GLU 361 Ca 0.25 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 3kt0 h GLU 361 Cb -0.07 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 3kt0 h GLU 361 CO -0.05 0.15 0.36 0.00 -0.73 0.00 0.00 179.01 178.74 3kt0 h TYR 363 N 0.74 -0.61 -0.43 0.00 3.20 -0.78 -1.78 116.97 117.31 3kt0 h TYR 363 Ca 0.20 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.94 3kt0 h TYR 363 Cb -0.08 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 3kt0 h TYR 363 CO -0.04 -0.36 -0.20 -0.44 -1.64 0.00 0.00 178.16 175.48 3kt0 h ASP 364 N -0.59 0.92 1.03 -2.11 3.32 -1.12 -2.45 116.42 115.43 3kt0 h ASP 364 Ca -0.04 -0.40 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 3kt0 h ASP 364 Cb 0.48 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 3kt0 h ASP 364 CO 0.05 1.12 -0.12 0.11 -1.72 0.00 0.00 179.24 178.68 3kt0 h LYS 365 N 0.72 0.00 -0.08 3.56 1.57 -1.24 -0.98 116.57 120.13 3kt0 h LYS 365 Ca 0.10 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 3kt0 h LYS 365 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 3kt0 h LYS 365 CO 0.06 0.12 -0.29 -0.92 -0.57 0.00 0.00 179.45 177.84 3kt0 h TYR 366 N 0.00 0.44 -0.50 -1.35 3.20 -1.08 0.16 116.97 117.85 3kt0 h TYR 366 Ca -0.00 -0.19 -0.05 0.00 3.14 0.00 0.00 58.73 61.63 3kt0 h TYR 366 Cb 0.66 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 3kt0 h TYR 366 CO 0.00 0.91 0.10 0.87 -1.64 0.00 0.00 178.16 178.40 3kt0 h LYS 367 N -0.15 0.76 0.00 1.82 1.57 -1.22 0.10 116.57 119.46 3kt0 h LYS 367 Ca -0.01 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3kt0 h LYS 367 Cb 0.93 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.12 3kt0 h LYS 367 CO 0.06 0.70 0.00 -1.13 -0.57 0.00 0.00 179.45 178.51 3kt0 n SER 368 N -4.28 0.07 0.00 0.86 3.41 -0.39 -4.16 113.62 109.13 3kt0 n SER 368 Ca 0.03 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 3kt0 n SER 368 Cb 0.23 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 3kt0 n SER 368 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kt0 n GLY 369 N 1.40 0.90 0.22 5.00 0.00 -0.79 -4.74 105.19 107.18 3kt0 n GLY 369 Ca 0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.19 3kt0 n GLY 369 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kt0 h GLU 370 N 3.32 0.00 -5.15 1.61 5.08 -1.04 -3.38 114.58 115.03 3kt0 h GLU 370 Ca 0.00 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.71 3kt0 h GLU 370 Cb 0.00 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.01 3kt0 h GLU 370 CO 0.00 0.22 -0.69 -1.17 -1.00 0.00 0.00 179.01 176.37 3kt0 s LEU 371 N -6.83 3.08 0.48 1.33 0.20 -0.01 -4.98 118.68 111.96 3kt0 s LEU 371 Ca 0.00 -0.26 -0.08 0.00 0.69 0.00 0.00 54.13 54.49 3kt0 s LEU 371 Cb 0.10 -1.76 -0.05 0.00 -0.43 0.00 0.00 46.19 44.05 3kt0 s LEU 371 CO 0.63 0.08 0.82 -0.76 -0.29 0.00 0.00 176.35 176.83 3kt0 s LEU 372 N 0.92 3.63 0.21 -0.68 1.43 -1.26 -4.53 118.68 118.39 3kt0 s LEU 372 Ca -0.00 1.07 -0.10 0.00 -1.03 0.00 0.00 54.13 54.07 3kt0 s LEU 372 Cb -0.15 -4.02 0.27 0.00 0.03 0.00 0.00 46.19 42.33 3kt0 s LEU 372 CO 0.01 -0.57 1.70 -1.28 0.23 0.00 0.00 176.35 176.45 3kt0 h SER 373 N 0.45 -0.02 -0.15 2.29 0.87 -1.97 -1.34 113.55 113.68 3kt0 h SER 373 Ca -0.47 0.11 -0.05 0.00 -1.23 0.00 0.00 61.79 60.16 3kt0 h SER 373 Cb 1.20 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 63.30 3kt0 h SER 373 CO 0.62 0.00 -0.03 1.23 -0.53 0.00 0.00 176.83 178.13 3kt0 h GLY 374 N 0.24 0.45 1.12 5.77 0.00 -1.99 -0.22 103.07 108.45 3kt0 h GLY 374 Ca 0.30 -0.26 -0.21 0.00 0.00 0.00 0.00 47.33 47.17 3kt0 h GLY 374 CO -0.40 0.24 -0.70 0.83 0.00 0.00 0.00 176.54 176.52 3kt0 h GLU 375 N 0.41 0.77 -0.55 4.80 5.08 -1.81 -2.16 114.58 121.12 3kt0 h GLU 375 Ca 0.09 -0.60 0.04 0.00 -1.00 0.00 0.00 59.36 57.88 3kt0 h GLU 375 Cb 0.31 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 3kt0 h GLU 375 CO 0.01 1.22 0.31 1.98 -1.00 0.00 0.00 179.01 181.52 3kt0 h MET 376 N 0.50 0.58 -0.81 2.33 4.05 -0.81 -2.35 114.93 118.42 3kt0 h MET 376 Ca -0.04 -0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.39 3kt0 h MET 376 Cb 1.33 -0.13 -0.05 0.00 -0.80 0.00 0.00 31.60 31.94 3kt0 h MET 376 CO 0.15 0.38 0.51 0.87 0.23 0.00 0.00 176.91 179.05 3kt0 h LYS 377 N 0.59 0.94 -0.65 0.39 1.57 -0.97 -1.45 116.57 116.99 3kt0 h LYS 377 Ca 0.23 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.91 3kt0 h LYS 377 Cb 0.09 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 3kt0 h LYS 377 CO -0.13 0.62 0.24 0.87 -0.57 0.00 0.00 179.45 180.48 3kt0 h LYS 378 N 0.97 0.98 -0.17 3.15 1.57 -1.13 0.15 116.57 122.09 3kt0 h LYS 378 Ca 0.33 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3kt0 h LYS 378 Cb 0.07 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 3kt0 h LYS 378 CO -0.14 0.83 0.09 -0.07 -0.57 0.00 0.00 179.45 179.60 3kt0 h LEU 379 N 0.92 0.21 0.04 2.94 3.38 -1.19 -1.58 115.31 120.03 3kt0 h LEU 379 Ca 0.21 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.12 3kt0 h LEU 379 Cb 0.23 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3kt0 h LEU 379 CO -0.01 0.22 -0.13 0.00 0.09 0.00 0.00 178.44 178.61 3kt0 h ILE 381 N -0.24 0.66 -0.44 0.00 2.04 -0.63 0.83 117.51 119.74 3kt0 h ILE 381 Ca 0.03 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 65.87 3kt0 h ILE 381 Cb 0.27 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 3kt0 h ILE 381 CO -0.09 0.02 0.26 -0.08 0.00 0.00 0.00 178.15 178.26 3kt0 h GLU 382 N 0.11 0.51 -0.35 2.37 4.81 -1.11 0.12 114.58 121.05 3kt0 h GLU 382 Ca 0.22 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 3kt0 h GLU 382 Cb 0.32 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3kt0 h GLU 382 CO -0.36 0.34 0.14 1.15 -0.73 0.00 0.00 179.01 179.54 3kt0 h THR 383 N 0.53 1.19 -0.53 0.32 2.02 -0.92 -2.62 112.91 112.90 3kt0 h THR 383 Ca 0.17 -0.58 -0.11 0.00 0.77 0.00 0.00 66.41 66.65 3kt0 h THR 383 Cb 0.00 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 3kt0 h THR 383 CO -0.08 0.21 -0.12 -0.07 0.37 0.00 0.00 175.52 175.83 3kt0 h LEU 384 N 0.41 1.01 -0.38 2.58 3.38 -0.62 -1.83 115.31 119.85 3kt0 h LEU 384 Ca 0.12 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3kt0 h LEU 384 Cb 0.19 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3kt0 h LEU 384 CO -0.01 1.12 0.24 1.56 0.09 0.00 0.00 178.44 181.44 3kt0 h GLN 385 N 0.89 0.51 -0.13 1.13 4.20 -0.73 -0.07 115.11 120.91 3kt0 h GLN 385 Ca 0.14 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.81 3kt0 h GLN 385 Cb 0.68 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 3kt0 h GLN 385 CO 0.05 0.36 0.08 1.49 -0.67 0.00 0.00 178.83 180.14 3kt0 h GLU 386 N 0.51 0.18 0.12 1.46 4.81 -1.40 -1.00 114.58 119.26 3kt0 h GLU 386 Ca 0.14 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3kt0 h GLU 386 Cb -0.02 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 3kt0 h GLU 386 CO -0.03 0.17 -0.07 0.35 -0.73 0.00 0.00 179.01 178.70 3kt0 h PHE 387 N 0.14 -0.19 -0.35 0.92 3.57 -1.15 -1.88 116.94 117.99 3kt0 h PHE 387 Ca 0.05 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 3kt0 h PHE 387 Cb 0.04 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3kt0 h PHE 387 CO -0.05 -0.12 0.03 0.28 -2.23 0.00 0.00 178.31 176.22 3kt0 h VAL 388 N -0.19 1.25 -0.32 1.41 2.07 -0.99 -1.90 116.25 117.57 3kt0 h VAL 388 Ca -0.01 -0.90 0.03 0.00 0.82 0.00 0.00 66.70 66.64 3kt0 h VAL 388 Cb 0.16 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 3kt0 h VAL 388 CO 0.01 0.30 0.14 0.50 0.02 0.00 0.00 177.57 178.54 3kt0 h LYS 389 N 0.42 0.28 -0.39 1.57 3.64 -1.16 0.29 116.57 121.23 3kt0 h LYS 389 Ca 0.10 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 3kt0 h LYS 389 Cb 0.40 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.12 3kt0 h LYS 389 CO 0.01 0.19 0.17 0.00 -2.27 0.00 0.00 179.45 177.54 3kt0 h ALA 390 N 1.19 0.47 -0.10 5.00 0.00 -1.22 -1.54 119.26 123.06 3kt0 h ALA 390 Ca 0.14 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.11 3kt0 h ALA 390 Cb 0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3kt0 h ALA 390 CO -0.12 -0.21 -0.14 0.35 0.00 0.00 0.00 179.25 179.13 3kt0 h PHE 391 N 0.34 -0.34 -0.89 0.00 3.57 -0.99 -1.68 116.94 116.96 3kt0 h PHE 391 Ca 0.17 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.77 3kt0 h PHE 391 Cb 0.12 0.17 -0.06 0.00 2.79 0.00 0.00 35.95 38.96 3kt0 h PHE 391 CO -0.12 -0.20 0.57 1.96 -2.23 0.00 0.00 178.31 178.29 3kt0 h GLN 392 N -0.18 0.91 -0.31 1.11 4.20 -0.61 0.18 115.11 120.42 3kt0 h GLN 392 Ca 0.08 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.60 3kt0 h GLN 392 Cb 0.29 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 3kt0 h GLN 392 CO -0.20 0.61 -0.35 0.93 -0.67 0.00 0.00 178.83 179.14 3kt0 h GLU 393 N 0.94 0.71 -0.13 1.46 5.08 -1.06 -1.96 114.58 119.61 3kt0 h GLU 393 Ca 0.40 -0.34 -0.15 0.00 -1.00 0.00 0.00 59.36 58.26 3kt0 h GLU 393 Cb 0.30 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3kt0 h GLU 393 CO -0.16 0.95 -0.56 0.00 -1.00 0.00 0.00 179.01 178.25 3kt0 h ARG 394 N 0.59 0.40 -0.46 2.33 3.08 -0.35 -3.17 114.38 116.80 3kt0 h ARG 394 Ca 0.06 -0.26 -0.11 0.00 0.07 0.00 0.00 59.98 59.74 3kt0 h ARG 394 Cb 0.88 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.94 3kt0 h ARG 394 CO 0.08 0.85 -0.17 -0.09 -1.07 0.00 0.00 179.97 179.57 3kt0 h ARG 395 N 0.31 0.89 -0.07 0.04 2.43 -0.56 -2.30 114.38 115.12 3kt0 h ARG 395 Ca 0.00 -0.34 0.02 0.00 -0.81 0.00 0.00 59.98 58.85 3kt0 h ARG 395 Cb 1.07 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.57 3kt0 h ARG 395 CO 0.10 0.99 0.10 0.00 -1.51 0.00 0.00 179.97 179.65 3kt0 h ALA 396 N 1.02 1.49 -0.22 2.80 0.00 -1.33 -1.43 119.26 121.57 3kt0 h ALA 396 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3kt0 h ALA 396 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3kt0 h ALA 396 CO 0.05 -0.14 0.00 1.04 0.00 0.00 0.00 179.25 180.20 3kt0 n GLN 397 N -3.56 1.62 -3.65 0.00 1.13 -0.86 -4.70 117.38 107.36 3kt0 n GLN 397 Ca -0.01 -0.95 -0.39 0.00 -1.94 0.00 0.00 57.00 53.70 3kt0 n GLN 397 Cb 0.20 -1.28 -0.10 0.00 0.11 0.00 0.00 30.24 29.16 3kt0 n GLN 397 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3kt0 s VAL 398 N -1.71 4.04 0.31 5.09 1.01 -0.54 -4.95 120.40 123.65 3kt0 s VAL 398 Ca 0.23 -1.44 0.04 0.00 0.00 0.00 0.00 61.98 60.81 3kt0 s VAL 398 Cb 0.12 -3.48 0.04 0.00 0.00 0.00 0.00 36.38 33.06 3kt0 s VAL 398 CO 0.17 -0.48 0.31 -0.90 0.00 0.00 0.00 175.10 174.21 3kt0 n ASP 399 N 4.86 1.63 -0.24 3.32 5.75 -1.26 -4.95 116.55 125.67 3kt0 n ASP 399 Ca -0.10 -1.95 -0.06 0.00 -0.01 0.00 0.00 54.79 52.67 3kt0 n ASP 399 Cb 0.43 -0.11 0.05 0.00 -1.03 0.00 0.00 41.12 40.46 3kt0 n ASP 399 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3kt0 h GLU 400 N 0.00 0.89 -0.65 0.11 4.39 -1.99 -1.03 114.58 116.31 3kt0 h GLU 400 Ca -0.17 -0.07 0.05 0.00 0.34 0.00 0.00 59.36 59.51 3kt0 h GLU 400 Cb 0.69 -0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 29.09 3kt0 h GLU 400 CO 0.26 0.62 0.36 1.49 -1.16 0.00 0.00 179.01 180.59 3kt0 h GLU 401 N 0.90 0.66 -0.21 2.33 4.81 -1.99 -0.59 114.58 120.49 3kt0 h GLU 401 Ca 0.24 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 3kt0 h GLU 401 Cb -0.05 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 3kt0 h GLU 401 CO -0.05 0.44 0.09 1.15 -0.73 0.00 0.00 179.01 179.91 3kt0 h THR 402 N 0.68 1.15 -0.48 0.32 2.02 -1.82 -2.85 112.91 111.93 3kt0 h THR 402 Ca 0.29 -0.46 0.10 0.00 0.77 0.00 0.00 66.41 67.10 3kt0 h THR 402 Cb 0.16 1.08 -0.08 0.00 -1.74 0.00 0.00 68.15 67.56 3kt0 h THR 402 CO -0.17 0.15 -0.05 -0.07 0.37 0.00 0.00 175.52 175.75 3kt0 h LEU 403 N 0.19 -0.31 -1.65 2.58 3.38 -0.81 -1.41 115.31 117.27 3kt0 h LEU 403 Ca 0.07 0.13 0.11 0.00 0.09 0.00 0.00 57.88 58.28 3kt0 h LEU 403 Cb 0.16 0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 3kt0 h LEU 403 CO -0.01 -0.11 0.41 0.44 0.09 0.00 0.00 178.44 179.27 3kt0 h ASP 404 N 0.06 0.35 0.20 -0.43 3.32 -0.96 0.13 116.42 119.08 3kt0 h ASP 404 Ca 0.24 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 3kt0 h ASP 404 Cb 0.36 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 3kt0 h ASP 404 CO -0.44 0.20 -0.21 0.11 -1.72 0.00 0.00 179.24 177.18 3kt0 h LYS 405 N 0.38 0.03 0.11 3.56 1.57 -1.03 -2.07 116.57 119.12 3kt0 h LYS 405 Ca 0.29 -0.01 -0.35 0.00 -1.87 0.00 0.00 60.65 58.71 3kt0 h LYS 405 Cb 0.62 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 3kt0 h LYS 405 CO -0.08 0.24 -1.91 0.74 -0.57 0.00 0.00 179.45 177.87 3kt0 h PHE 406 N 0.03 0.43 0.00 -1.35 0.04 -1.14 -3.43 116.94 111.51 3kt0 h PHE 406 Ca 0.00 -0.31 -0.29 0.00 2.80 0.00 0.00 57.97 60.17 3kt0 h PHE 406 Cb 0.39 -0.02 -0.05 0.00 2.20 0.00 0.00 35.95 38.47 3kt0 h PHE 406 CO 0.00 1.64 -1.87 -1.33 -0.60 0.00 0.00 178.31 176.15 3kt0 n MET 407 N -3.42 0.65 -2.13 1.51 2.81 -0.10 -2.02 117.12 114.42 3kt0 n MET 407 Ca -0.28 0.19 -0.42 0.00 -1.81 0.00 0.00 57.70 55.38 3kt0 n MET 407 Cb 1.05 -1.71 -0.03 0.00 -0.71 0.00 0.00 33.22 31.82 3kt0 n MET 407 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3kt0 s VAL 408 N -2.64 3.42 0.14 2.03 1.01 -0.79 -4.82 120.40 118.77 3kt0 s VAL 408 Ca -0.06 0.89 -0.35 0.00 0.00 0.00 0.00 61.98 62.47 3kt0 s VAL 408 Cb 0.08 -3.57 -0.15 0.00 0.00 0.00 0.00 36.38 32.74 3kt0 s VAL 408 CO 0.83 0.02 1.51 -2.65 0.00 0.00 0.00 175.10 174.80 3kt0 n PRO 409 N 5.05 1.88 -3.79 2.72 -0.02 -1.26 -4.92 135.00 134.66 3kt0 n PRO 409 Ca 0.13 0.68 -0.13 0.00 -2.02 0.00 0.00 63.50 62.17 3kt0 n PRO 409 Cb 0.42 -2.41 -0.09 0.00 -0.02 0.00 0.00 33.50 31.40 3kt0 n PRO 409 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3kt0 s HIS 410 N 0.77 -0.13 -0.15 6.00 -3.43 -1.26 -5.04 115.29 112.04 3kt0 s HIS 410 Ca 0.80 0.22 -0.29 0.00 -0.80 0.00 0.00 55.06 54.98 3kt0 s HIS 410 Cb -0.75 0.06 -0.03 0.00 -1.43 0.00 0.00 32.58 30.43 3kt0 s HIS 410 CO 0.40 -0.33 1.50 0.21 -2.00 0.00 0.00 174.74 174.52 3kt0 s LYS 411 N -1.16 4.07 0.36 -0.38 2.47 -1.14 -4.33 119.74 119.64 3kt0 s LYS 411 Ca -0.12 1.81 -0.26 0.00 -1.56 0.00 0.00 55.97 55.84 3kt0 s LYS 411 Cb -0.05 -3.92 -0.09 0.00 -1.46 0.00 0.00 37.83 32.30 3kt0 s LYS 411 CO 0.03 -0.95 1.09 -0.51 0.16 0.00 0.00 175.35 175.17 3kt0 s LEU 412 N 4.23 4.27 -0.12 5.43 1.43 0.30 -4.99 118.68 129.23 3kt0 s LEU 412 Ca 0.66 2.17 0.01 0.00 -1.03 0.00 0.00 54.13 55.94 3kt0 s LEU 412 Cb -0.26 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 41.96 3kt0 s LEU 412 CO 0.24 -0.43 -0.16 -0.69 0.23 0.00 0.00 176.35 175.54 3kt0 s VAL 413 N -1.46 2.78 0.30 -1.59 1.01 -0.33 -4.93 120.40 116.18 3kt0 s VAL 413 Ca 0.54 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.61 3kt0 s VAL 413 Cb -0.27 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 33.99 3kt0 s VAL 413 CO 0.34 0.54 0.62 -1.66 0.00 0.00 0.00 175.10 174.94 3kt0 s TRP 414 N 0.28 0.24 -0.11 5.22 -2.14 -1.26 -4.16 118.94 117.01 3kt0 s TRP 414 Ca -0.12 -0.69 0.00 0.00 2.66 0.00 0.00 56.10 57.96 3kt0 s TRP 414 Cb -0.16 0.46 0.00 0.00 -3.10 0.00 0.00 33.47 30.67 3kt0 s TRP 414 CO 0.06 -1.22 0.00 0.41 -2.66 0.00 0.00 176.95 173.54 3kt0 n GLY 415 N -0.47 0.46 0.08 3.67 0.00 -1.04 -4.89 105.19 102.99 3kt0 n GLY 415 Ca -0.04 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 3kt0 n GLY 415 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kt0 h GLU 416 N 0.61 0.00 -7.03 1.61 5.08 -1.92 -3.47 114.58 109.46 3kt0 h GLU 416 Ca -0.02 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.79 3kt0 h GLU 416 Cb 0.25 0.00 0.13 0.00 0.50 0.00 0.00 28.75 29.63 3kt0 h GLU 416 CO 0.03 0.59 0.64 0.15 -1.00 0.00 0.00 179.01 179.42 3kt0 s LYS 417 N -2.65 3.34 0.05 2.33 1.02 -1.26 -4.95 119.74 117.63 3kt0 s LYS 417 Ca -0.03 2.28 -0.31 0.00 0.02 0.00 0.00 55.97 57.93 3kt0 s LYS 417 Cb 0.08 -2.40 -0.07 0.00 -0.52 0.00 0.00 37.83 34.93 3kt0 s LYS 417 CO 0.82 -1.04 1.44 -2.00 -0.92 0.00 0.00 175.35 173.65 3kt0 s GLU 418 N -2.74 4.28 0.30 1.68 2.12 -1.26 -5.00 118.70 118.08 3kt0 s GLU 418 Ca 0.68 2.06 -0.28 0.00 0.36 0.00 0.00 54.97 57.78 3kt0 s GLU 418 Cb -0.41 -3.47 -0.09 0.00 0.26 0.00 0.00 34.13 30.41 3kt0 s GLU 418 CO 0.50 -0.56 1.08 1.03 -0.54 0.00 0.00 175.26 176.78 3kt0 s ARG 419 N 2.03 4.56 0.23 4.30 0.52 -1.26 -4.96 118.95 124.36 3kt0 s ARG 419 Ca 0.66 1.74 0.05 0.00 -0.52 0.00 0.00 55.73 57.65 3kt0 s ARG 419 Cb -0.35 -3.07 0.21 0.00 0.52 0.00 0.00 34.95 32.26 3kt0 s ARG 419 CO 0.29 0.16 1.53 -0.07 0.02 0.00 0.00 175.30 177.22 3kt0 h LEU 420 N 3.58 0.24 -7.92 2.53 4.07 -1.95 -3.43 115.31 112.43 3kt0 h LEU 420 Ca -0.47 -0.15 -0.51 0.00 0.08 0.00 0.00 57.88 56.83 3kt0 h LEU 420 Cb 1.21 -0.07 -0.34 0.00 1.08 0.00 0.00 40.66 42.54 3kt0 h LEU 420 CO 0.66 0.83 -0.81 0.54 -1.08 0.00 0.00 178.44 178.58 3kt0 s VAL 421 N -3.63 1.10 0.46 1.22 0.11 -1.26 -4.94 120.40 113.46 3kt0 s VAL 421 Ca -0.03 -0.44 -0.24 0.00 -2.93 0.00 0.00 61.98 58.34 3kt0 s VAL 421 Cb 0.12 -1.03 -0.07 0.00 -1.53 0.00 0.00 36.38 33.86 3kt0 s VAL 421 CO 0.80 0.35 1.28 0.00 -3.33 0.00 0.00 175.10 174.20 3kt0 s ALA 422 N 0.87 3.06 0.55 1.54 0.00 -1.26 -4.97 121.76 121.54 3kt0 s ALA 422 Ca -0.11 1.17 -0.21 0.00 0.00 0.00 0.00 51.96 52.81 3kt0 s ALA 422 Cb -0.15 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.44 3kt0 s ALA 422 CO 0.01 -0.92 1.31 -1.25 0.00 0.00 0.00 175.76 174.91 3kt0 s PRO 423 N -2.56 3.16 -0.64 0.00 0.04 -1.26 -5.00 135.00 128.74 3kt0 s PRO 423 Ca 0.63 2.11 0.05 0.00 0.04 0.00 0.00 61.00 63.83 3kt0 s PRO 423 Cb -0.36 -2.21 0.19 0.00 0.04 0.00 0.00 34.50 32.16 3kt0 s PRO 423 CO 0.44 -1.14 0.53 1.63 0.04 0.00 0.00 177.00 178.50 3kt0 n LYS 424 N -1.09 1.70 0.00 4.56 5.02 0.88 -4.96 118.16 124.27 3kt0 n LYS 424 Ca 0.11 -4.29 0.08 0.00 -2.02 0.00 0.00 58.31 52.19 3kt0 n LYS 424 Cb 0.46 -2.15 0.49 0.00 -0.02 0.00 0.00 35.03 33.81 3kt0 n LYS 424 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53