#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kt7 h LYS 25 N 0.00 0.00 0.06 -0.67 2.10 -2.06 -2.03 116.57 113.97 3kt7 h LYS 25 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3kt7 h LYS 25 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 3kt7 h LYS 25 CO 0.00 0.24 -0.03 0.82 -2.00 0.00 0.00 179.45 178.48 3kt7 h ILE 26 N 0.00 0.94 -0.97 0.07 2.04 -2.00 -3.29 117.51 114.30 3kt7 h ILE 26 Ca -0.00 -1.50 0.10 0.00 1.00 0.00 0.00 64.86 64.45 3kt7 h ILE 26 Cb 0.59 1.71 -0.07 0.00 -0.74 0.00 0.00 36.82 38.31 3kt7 h ILE 26 CO 0.03 0.29 0.62 0.11 0.00 0.00 0.00 178.15 179.21 3kt7 h LYS 27 N -0.94 0.99 0.00 2.37 1.57 -1.95 -1.82 116.57 116.78 3kt7 h LYS 27 Ca -0.01 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3kt7 h LYS 27 Cb 0.55 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3kt7 h LYS 27 CO 0.01 0.65 0.00 0.41 -0.57 0.00 0.00 179.45 179.96 3kt7 n GLY 28 N -1.37 -1.14 0.57 3.86 0.00 -0.77 -2.15 105.19 104.19 3kt7 n GLY 28 Ca 0.17 0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.34 3kt7 n GLY 28 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3kt7 n MET 29 N -1.90 1.77 -4.28 1.61 2.81 -0.68 -4.85 117.12 111.59 3kt7 n MET 29 Ca 0.03 -1.13 -0.23 0.00 -1.81 0.00 0.00 57.70 54.55 3kt7 n MET 29 Cb 0.20 -1.46 -0.07 0.00 -0.71 0.00 0.00 33.22 31.18 3kt7 n MET 29 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 3kt7 s PHE 30 N -1.93 2.67 -0.01 2.03 0.40 -0.91 -0.46 117.98 119.77 3kt7 s PHE 30 Ca 0.36 -0.26 -0.36 0.00 -0.60 0.00 0.00 56.93 56.07 3kt7 s PHE 30 Cb 0.20 -1.26 -0.14 0.00 0.51 0.00 0.00 43.02 42.33 3kt7 s PHE 30 CO 0.31 0.58 1.64 -1.71 0.70 0.00 0.00 175.22 176.75 3kt7 n ASN 31 N -0.92 2.72 0.32 1.36 4.05 0.15 -4.68 115.26 118.27 3kt7 n ASN 31 Ca -0.06 1.06 0.20 0.00 0.45 0.00 0.00 54.58 56.23 3kt7 n ASN 31 Cb 0.60 -1.30 1.11 0.00 1.23 0.00 0.00 39.78 41.42 3kt7 n ASN 31 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 3kt7 h PRO 32 N 6.80 0.00 -0.18 1.20 0.13 -1.91 -2.23 132.00 135.80 3kt7 h PRO 32 Ca -0.47 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.70 3kt7 h PRO 32 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 3kt7 h PRO 32 CO 0.89 0.00 0.13 1.57 -0.23 0.00 0.00 178.00 180.36 3kt7 h LYS 33 N 0.00 0.09 0.00 0.86 2.10 -1.98 -2.67 116.57 114.96 3kt7 h LYS 33 Ca -0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3kt7 h LYS 33 Cb 0.00 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.31 3kt7 h LYS 33 CO 0.00 0.06 0.00 -0.84 -2.00 0.00 0.00 179.45 176.67 3kt7 h ILE 34 N 0.09 0.00 -0.01 0.07 3.07 -1.78 -2.27 117.51 116.68 3kt7 h ILE 34 Ca 0.08 -0.35 0.00 0.00 1.55 0.00 0.00 64.86 66.14 3kt7 h ILE 34 Cb 0.22 1.20 0.00 0.00 -0.27 0.00 0.00 36.82 37.97 3kt7 h ILE 34 CO -0.01 0.00 -0.19 0.79 -1.05 0.00 0.00 178.15 177.70 3kt7 n TRP 35 N -2.56 0.00 -2.89 0.16 5.03 -1.01 -4.74 117.44 111.44 3kt7 n TRP 35 Ca 0.02 0.00 -0.41 0.00 3.03 0.00 0.00 57.50 60.14 3kt7 n TRP 35 Cb 0.27 -0.06 -0.04 0.00 -1.03 0.00 0.00 31.31 30.45 3kt7 n TRP 35 CO 0.00 0.00 0.00 0.34 -0.03 0.00 0.00 177.69 178.00 3kt7 s ASP 36 N -2.31 7.04 0.21 -0.99 2.15 -0.85 -4.97 116.67 116.95 3kt7 s ASP 36 Ca 0.28 1.27 -0.10 0.00 0.43 0.00 0.00 52.55 54.44 3kt7 s ASP 36 Cb 0.20 -2.47 0.17 0.00 -0.30 0.00 0.00 42.92 40.52 3kt7 s ASP 36 CO 0.45 -0.32 1.88 0.50 -0.17 0.00 0.00 175.17 177.52 3kt7 h LYS 37 N 7.10 1.00 -0.63 4.34 1.63 -1.90 -0.95 116.57 127.16 3kt7 h LYS 37 Ca -0.34 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.40 3kt7 h LYS 37 Cb 1.16 -0.23 -0.03 0.00 -0.60 0.00 0.00 32.23 32.53 3kt7 h LYS 37 CO 0.81 0.66 0.39 1.15 -3.45 0.00 0.00 179.45 179.01 3kt7 h THR 38 N 1.03 1.18 -0.24 1.00 2.02 -1.95 -0.45 112.91 115.50 3kt7 h THR 38 Ca 0.29 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 67.09 3kt7 h THR 38 Cb -0.10 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.60 3kt7 h THR 38 CO -0.07 0.18 0.16 0.15 0.37 0.00 0.00 175.52 176.31 3kt7 h PHE 39 N 0.85 0.31 -0.47 3.16 3.57 -1.72 -1.75 116.94 120.90 3kt7 h PHE 39 Ca 0.23 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.75 3kt7 h PHE 39 Cb -0.04 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 3kt7 h PHE 39 CO -0.02 0.21 0.28 1.96 -2.23 0.00 0.00 178.31 178.51 3kt7 h GLN 40 N 0.32 0.56 -0.42 1.11 4.20 -0.77 -0.05 115.11 120.05 3kt7 h GLN 40 Ca 0.09 -0.03 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 3kt7 h GLN 40 Cb -0.02 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.61 3kt7 h GLN 40 CO -0.02 0.37 -0.12 -0.44 -0.67 0.00 0.00 178.83 177.95 3kt7 h ASP 41 N 0.57 0.73 -0.56 1.46 3.32 -1.01 -0.41 116.42 120.53 3kt7 h ASP 41 Ca 0.18 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 3kt7 h ASP 41 Cb -0.00 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3kt7 h ASP 41 CO -0.08 0.87 0.17 1.23 -1.72 0.00 0.00 179.24 179.72 3kt7 h GLY 42 N 0.97 0.94 0.96 2.75 0.00 -0.82 -1.85 103.07 106.03 3kt7 h GLY 42 Ca 0.11 -0.56 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 3kt7 h GLY 42 CO 0.04 0.52 -0.08 -2.00 0.00 0.00 0.00 176.54 175.02 3kt7 h LEU 43 N 0.79 0.73 -0.87 3.11 5.85 -0.74 -1.45 115.31 122.72 3kt7 h LEU 43 Ca 0.18 -0.36 0.09 0.00 0.84 0.00 0.00 57.88 58.63 3kt7 h LEU 43 Cb 0.29 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 3kt7 h LEU 43 CO -0.01 0.92 0.52 0.50 -0.34 0.00 0.00 178.44 180.04 3kt7 h LYS 44 N 0.54 0.86 -0.43 1.25 3.64 -0.93 -1.04 116.57 120.46 3kt7 h LYS 44 Ca 0.10 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 3kt7 h LYS 44 Cb 0.59 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 3kt7 h LYS 44 CO 0.04 0.57 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.53 3kt7 h LYS 45 N 0.89 0.79 -0.50 1.90 3.64 -1.14 -1.06 116.57 121.08 3kt7 h LYS 45 Ca 0.41 -0.27 0.07 0.00 -1.27 0.00 0.00 60.65 59.59 3kt7 h LYS 45 Cb 0.33 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.03 3kt7 h LYS 45 CO -0.23 0.88 0.18 0.93 -2.27 0.00 0.00 179.45 178.95 3kt7 h GLU 46 N 0.63 0.36 -0.40 1.90 5.08 -0.59 -0.79 114.58 120.76 3kt7 h GLU 46 Ca 0.12 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 3kt7 h GLU 46 Cb 0.55 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3kt7 h GLU 46 CO 0.03 0.24 0.04 0.82 -1.00 0.00 0.00 179.01 179.14 3kt7 h ILE 47 N 0.37 1.25 -0.79 3.13 2.04 -1.04 -1.92 117.51 120.56 3kt7 h ILE 47 Ca 0.24 -0.92 0.05 0.00 1.00 0.00 0.00 64.86 65.23 3kt7 h ILE 47 Cb 0.25 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.34 3kt7 h ILE 47 CO -0.24 0.31 0.52 -0.33 0.00 0.00 0.00 178.15 178.41 3kt7 h GLU 48 N 0.52 0.89 -0.01 2.37 5.08 -0.79 -2.89 114.58 119.75 3kt7 h GLU 48 Ca 0.12 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3kt7 h GLU 48 Cb 0.40 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3kt7 h GLU 48 CO 0.01 0.59 -0.08 -0.25 -1.00 0.00 0.00 179.01 178.28 3kt7 n ASP 49 N -4.46 1.52 -4.83 1.42 10.43 -0.34 -4.96 116.55 115.32 3kt7 n ASP 49 Ca 0.11 -1.39 -0.30 0.00 2.57 0.00 0.00 54.79 55.78 3kt7 n ASP 49 Cb 0.16 0.05 0.07 0.00 1.84 0.00 0.00 41.12 43.24 3kt7 n ASP 49 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 3kt7 s SER 50 N -2.14 4.86 0.06 -2.24 1.04 -0.75 -5.06 113.70 109.47 3kt7 s SER 50 Ca 0.33 1.29 0.00 0.00 0.48 0.00 0.00 55.95 58.05 3kt7 s SER 50 Cb 0.20 -2.06 -0.04 0.00 0.10 0.00 0.00 66.02 64.23 3kt7 s SER 50 CO 0.39 -1.73 -0.04 0.00 0.98 0.00 0.00 173.24 172.83 3kt7 s GLN 51 N -5.20 0.62 0.09 4.02 1.03 -1.26 -4.53 119.66 114.43 3kt7 s GLN 51 Ca 0.60 -1.13 0.26 0.00 0.04 0.00 0.00 55.36 55.12 3kt7 s GLN 51 Cb -0.13 0.05 0.74 0.00 0.03 0.00 0.00 33.01 33.69 3kt7 s GLN 51 CO 0.54 -0.07 1.62 -0.35 -2.54 0.00 0.00 175.29 174.49 3kt7 n PRO 52 N 0.37 0.15 -4.08 9.60 -0.04 -1.26 -4.81 135.00 134.92 3kt7 n PRO 52 Ca -0.16 0.08 -0.09 0.00 -0.04 0.00 0.00 63.50 63.29 3kt7 n PRO 52 Cb 0.60 -1.63 -0.09 0.00 -0.04 0.00 0.00 33.50 32.34 3kt7 n PRO 52 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3kt7 s TYR 53 N -3.07 0.67 0.05 0.54 1.13 -1.26 -4.88 117.35 110.52 3kt7 s TYR 53 Ca 0.10 -1.07 -0.30 0.00 -1.41 0.00 0.00 57.07 54.39 3kt7 s TYR 53 Cb 0.15 -0.35 -0.08 0.00 -1.10 0.00 0.00 41.96 40.58 3kt7 s TYR 53 CO 0.63 -0.54 1.80 -0.80 -2.51 0.00 0.00 175.55 174.13 3kt7 s ASN 54 N -3.00 6.52 0.12 -0.18 0.01 -1.26 -4.88 114.94 112.27 3kt7 s ASN 54 Ca 0.19 2.56 -0.09 0.00 -0.71 0.00 0.00 52.86 54.80 3kt7 s ASN 54 Cb 0.07 -2.55 -0.00 0.00 0.41 0.00 0.00 41.25 39.18 3kt7 s ASN 54 CO -0.01 -0.98 0.23 -1.66 -1.51 0.00 0.00 177.10 173.17 3kt7 s TRP 55 N 3.57 0.21 0.12 2.20 1.48 -1.26 -4.24 118.94 121.02 3kt7 s TRP 55 Ca 0.80 -0.61 -0.02 0.00 -1.06 0.00 0.00 56.10 55.22 3kt7 s TRP 55 Cb -0.41 -0.04 -0.04 0.00 -1.16 0.00 0.00 33.47 31.83 3kt7 s TRP 55 CO 0.36 -0.61 0.06 0.20 -4.06 0.00 0.00 176.95 172.90 3kt7 s GLY 56 N -2.89 0.83 -0.03 3.67 0.00 -0.26 -4.33 107.32 104.30 3kt7 s GLY 56 Ca 0.09 -1.36 -0.06 0.00 0.00 0.00 0.00 44.72 43.39 3kt7 s GLY 56 CO -0.08 -1.30 0.15 -1.08 0.00 0.00 0.00 173.10 170.79 3kt7 s THR 57 N -4.01 0.04 -0.08 0.90 -1.32 -1.26 -1.34 115.64 108.57 3kt7 s THR 57 Ca 0.20 -0.31 0.03 0.00 -1.21 0.00 0.00 61.69 60.40 3kt7 s THR 57 Cb 0.07 -0.32 0.01 0.00 -1.51 0.00 0.00 72.50 70.76 3kt7 s THR 57 CO -0.01 -0.17 -0.16 -0.63 -2.21 0.00 0.00 174.62 171.44 3kt7 s ILE 58 N -0.56 1.43 0.12 5.08 1.01 -0.73 -5.00 121.20 122.56 3kt7 s ILE 58 Ca -0.06 -0.65 -0.05 0.00 0.00 0.00 0.00 60.65 59.89 3kt7 s ILE 58 Cb -0.04 -1.28 -0.05 0.00 0.01 0.00 0.00 42.46 41.10 3kt7 s ILE 58 CO 0.01 0.42 0.36 -1.38 0.00 0.00 0.00 174.94 174.35 3kt7 s HIS 59 N 0.60 3.49 -1.29 3.97 -3.43 -1.26 -1.37 115.29 116.00 3kt7 s HIS 59 Ca -0.15 0.55 -0.00 0.00 -0.80 0.00 0.00 55.06 54.66 3kt7 s HIS 59 Cb -0.16 -2.00 -0.00 0.00 -1.43 0.00 0.00 32.58 28.99 3kt7 s HIS 59 CO 0.05 0.46 0.74 0.39 -2.00 0.00 0.00 174.74 174.38 3kt7 n GLU 60 N 0.23 -5.05 -0.02 -0.38 1.02 -0.55 -4.94 120.64 110.96 3kt7 n GLU 60 Ca -0.04 0.65 -0.12 0.00 -0.02 0.00 0.00 57.16 57.63 3kt7 n GLU 60 Cb 0.52 -5.26 -0.07 0.00 -0.02 0.00 0.00 31.44 26.61 3kt7 n GLU 60 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3kt7 h LEU 61 N -1.86 0.13 -9.90 -4.62 5.85 -1.39 -3.39 115.31 100.13 3kt7 h LEU 61 Ca -0.61 -0.30 -0.52 0.00 0.84 0.00 0.00 57.88 57.29 3kt7 h LEU 61 Cb 1.36 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.30 3kt7 h LEU 61 CO 0.55 0.39 -0.53 -0.69 -0.34 0.00 0.00 178.44 177.83 3kt7 s VAL 62 N -5.02 4.59 -0.10 1.05 1.01 -1.26 -0.67 120.40 119.99 3kt7 s VAL 62 Ca -0.14 -1.23 -0.39 0.00 0.00 0.00 0.00 61.98 60.22 3kt7 s VAL 62 Cb 0.05 -3.43 -0.17 0.00 0.00 0.00 0.00 36.38 32.83 3kt7 s VAL 62 CO 0.69 -0.26 1.50 -3.20 0.00 0.00 0.00 175.10 173.83 3kt7 n ASN 63 N -0.91 1.78 -0.24 3.32 5.15 0.39 -4.62 115.26 120.13 3kt7 n ASN 63 Ca -0.08 1.11 -0.06 0.00 -0.60 0.00 0.00 54.58 54.95 3kt7 n ASN 63 Cb 0.57 -1.13 0.04 0.00 -0.53 0.00 0.00 39.78 38.73 3kt7 n ASN 63 CO 0.00 0.00 0.00 -0.78 1.40 0.00 0.00 177.26 177.88 3kt7 h ASP 64 N 5.52 0.83 -0.72 1.20 1.82 -1.95 -1.85 116.42 121.28 3kt7 h ASP 64 Ca -0.47 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.07 3kt7 h ASP 64 Cb 1.34 -0.21 -0.04 0.00 0.68 0.00 0.00 39.33 41.10 3kt7 h ASP 64 CO 0.85 0.69 0.45 0.44 -1.61 0.00 0.00 179.24 180.06 3kt7 h ASP 65 N 0.91 0.85 0.03 2.28 3.32 -1.99 -0.93 116.42 120.88 3kt7 h ASP 65 Ca 0.23 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 3kt7 h ASP 65 Cb 0.04 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.38 3kt7 h ASP 65 CO -0.04 0.64 -0.01 0.25 -1.72 0.00 0.00 179.24 178.36 3kt7 h LEU 66 N 0.98 -0.03 -0.90 1.55 5.85 -1.84 -1.53 115.31 119.39 3kt7 h LEU 66 Ca 0.26 -0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.80 3kt7 h LEU 66 Cb -0.07 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3kt7 h LEU 66 CO -0.05 0.06 -0.24 0.25 -0.34 0.00 0.00 178.44 178.12 3kt7 h LEU 67 N -0.12 0.54 -0.95 2.25 5.85 -1.17 -0.35 115.31 121.35 3kt7 h LEU 67 Ca -0.00 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 3kt7 h LEU 67 Cb 0.11 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 3kt7 h LEU 67 CO 0.01 0.78 0.50 0.03 -0.34 0.00 0.00 178.44 179.41 3kt7 h ARG 68 N 0.47 1.23 -0.32 1.25 3.08 -1.08 -1.47 114.38 117.54 3kt7 h ARG 68 Ca 0.07 -0.14 -0.12 0.00 0.07 0.00 0.00 59.98 59.86 3kt7 h ARG 68 Cb 0.67 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 3kt7 h ARG 68 CO 0.05 0.89 -0.30 0.00 -1.07 0.00 0.00 179.97 179.54 3kt7 h ALA 69 N 1.31 0.87 -0.32 0.04 0.00 -0.50 -1.99 119.26 118.68 3kt7 h ALA 69 Ca 0.31 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3kt7 h ALA 69 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3kt7 h ALA 69 CO -0.05 0.63 0.13 0.28 0.00 0.00 0.00 179.25 180.23 3kt7 h VAL 70 N 0.58 1.18 -0.62 0.00 2.07 -0.81 -1.12 116.25 117.53 3kt7 h VAL 70 Ca 0.07 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.07 3kt7 h VAL 70 Cb 0.80 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 3kt7 h VAL 70 CO 0.07 0.19 0.36 -0.09 0.02 0.00 0.00 177.57 178.12 3kt7 h ARG 71 N 0.36 0.67 -0.71 1.57 2.43 -1.09 -0.68 114.38 116.94 3kt7 h ARG 71 Ca 0.11 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 3kt7 h ARG 71 Cb 0.18 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 3kt7 h ARG 71 CO -0.01 0.44 0.23 0.87 -1.51 0.00 0.00 179.97 180.00 3kt7 h LYS 72 N 0.69 1.10 -0.57 0.20 1.79 -1.17 -1.39 116.57 117.22 3kt7 h LYS 72 Ca 0.26 -0.23 -0.00 0.00 -2.18 0.00 0.00 60.65 58.50 3kt7 h LYS 72 Cb 0.10 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 30.56 3kt7 h LYS 72 CO -0.14 0.94 0.35 0.93 -1.08 0.00 0.00 179.45 180.45 3kt7 h GLU 73 N 1.04 0.77 -0.42 3.15 5.08 -0.69 -1.74 114.58 121.77 3kt7 h GLU 73 Ca 0.23 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3kt7 h GLU 73 Cb 0.29 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3kt7 h GLU 73 CO -0.01 0.55 0.26 0.82 -1.00 0.00 0.00 179.01 179.63 3kt7 h ILE 74 N 0.76 1.13 -0.65 3.13 2.04 -0.81 0.11 117.51 123.22 3kt7 h ILE 74 Ca 0.20 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 3kt7 h ILE 74 Cb -0.03 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 3kt7 h ILE 74 CO -0.04 0.13 0.30 -0.33 0.00 0.00 0.00 178.15 178.21 3kt7 h GLU 75 N 0.55 0.92 0.06 2.37 5.08 -1.01 -2.00 114.58 120.56 3kt7 h GLU 75 Ca 0.15 -0.12 -0.28 0.00 -1.00 0.00 0.00 59.36 58.10 3kt7 h GLU 75 Cb -0.02 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 3kt7 h GLU 75 CO -0.03 0.72 -1.46 1.15 -1.00 0.00 0.00 179.01 178.39 3kt7 h THR 76 N 0.92 1.19 0.00 1.13 2.02 -1.03 -3.41 112.91 113.73 3kt7 h THR 76 Ca 0.22 -2.91 0.00 0.00 0.77 0.00 0.00 66.41 64.50 3kt7 h THR 76 Cb 0.11 2.69 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 3kt7 h THR 76 CO -0.03 0.77 -1.08 -0.62 0.37 0.00 0.00 175.52 174.93 3kt7 n GLU 77 N -3.33 1.63 -4.84 6.66 -0.58 0.35 -4.97 120.64 115.57 3kt7 n GLU 77 Ca -0.13 -0.06 -0.33 0.00 -0.42 0.00 0.00 57.16 56.22 3kt7 n GLU 77 Cb 1.02 -1.14 -0.15 0.00 -0.57 0.00 0.00 31.44 30.61 3kt7 n GLU 77 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3kt7 s ILE 78 N -2.41 2.94 -0.21 -3.67 1.01 -0.76 -4.43 121.20 113.67 3kt7 s ILE 78 Ca -0.01 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 59.87 3kt7 s ILE 78 Cb 0.07 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 3kt7 s ILE 78 CO 0.42 0.53 0.05 -2.28 0.00 0.00 0.00 174.94 173.66 3kt7 s HIS 79 N 0.28 3.14 0.12 3.97 5.65 0.40 -4.77 115.29 124.08 3kt7 s HIS 79 Ca -0.11 -0.20 -0.07 0.00 0.25 0.00 0.00 55.06 54.94 3kt7 s HIS 79 Cb -0.16 -2.13 -0.06 0.00 -1.18 0.00 0.00 32.58 29.05 3kt7 s HIS 79 CO 0.06 -0.11 0.38 -0.06 -0.65 0.00 0.00 174.74 174.36 3kt7 s PHE 80 N 0.94 3.51 -0.10 3.88 0.08 -1.26 -4.54 117.98 120.49 3kt7 s PHE 80 Ca 0.03 0.64 0.02 0.00 0.12 0.00 0.00 56.93 57.74 3kt7 s PHE 80 Cb -0.14 -2.06 0.01 0.00 -0.57 0.00 0.00 43.02 40.26 3kt7 s PHE 80 CO 0.03 0.46 -0.15 0.99 -0.10 0.00 0.00 175.22 176.45 3kt7 s THR 81 N -1.56 1.44 0.20 0.64 2.01 -0.24 -4.86 115.64 113.27 3kt7 s THR 81 Ca 0.38 -0.61 -0.32 0.00 0.31 0.00 0.00 61.69 61.45 3kt7 s THR 81 Cb -0.13 -1.32 -0.12 0.00 0.01 0.00 0.00 72.50 70.95 3kt7 s THR 81 CO 0.22 0.43 1.73 -0.75 -0.69 0.00 0.00 174.62 175.56 3kt7 s LYS 82 N 0.94 4.12 -0.07 4.92 2.20 -1.26 -0.73 119.74 129.86 3kt7 s LYS 82 Ca -0.08 2.61 0.02 0.00 -0.36 0.00 0.00 55.97 58.16 3kt7 s LYS 82 Cb -0.15 -3.12 0.02 0.00 -1.51 0.00 0.00 37.83 33.06 3kt7 s LYS 82 CO -0.01 -0.76 -0.11 0.21 -0.36 0.00 0.00 175.35 174.32 3kt7 s LYS 83 N 1.33 1.64 -0.06 4.03 2.20 0.50 -4.92 119.74 124.47 3kt7 s LYS 83 Ca 0.75 -0.38 0.06 0.00 -0.36 0.00 0.00 55.97 56.04 3kt7 s LYS 83 Cb -0.49 -1.41 -0.01 0.00 -1.51 0.00 0.00 37.83 34.41 3kt7 s LYS 83 CO 0.32 -0.02 -0.23 -2.00 -0.36 0.00 0.00 175.35 173.06 3kt7 s GLU 84 N 0.83 2.42 0.21 4.03 2.12 -1.26 -1.72 118.70 125.33 3kt7 s GLU 84 Ca -0.12 -0.84 0.02 0.00 0.36 0.00 0.00 54.97 54.40 3kt7 s GLU 84 Cb -0.15 -2.04 -0.01 0.00 0.26 0.00 0.00 34.13 32.19 3kt7 s GLU 84 CO 0.02 0.33 0.08 0.25 -0.54 0.00 0.00 175.26 175.41 3kt7 n THR 85 N 3.04 0.00 -0.18 -1.70 -2.24 0.05 -5.01 114.28 108.24 3kt7 n THR 85 Ca -0.18 -1.27 0.01 0.00 -2.27 0.00 0.00 64.05 60.34 3kt7 n THR 85 Cb 0.52 0.47 0.27 0.00 -2.10 0.00 0.00 70.33 69.50 3kt7 n THR 85 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3kt7 h ASP 86 N 0.89 0.80 0.30 3.42 -0.00 -2.00 -3.22 116.42 116.61 3kt7 h ASP 86 Ca -0.16 -0.02 0.00 0.00 -0.00 0.00 0.00 57.03 56.84 3kt7 h ASP 86 Cb 0.65 -0.20 0.00 0.00 -0.00 0.00 0.00 39.33 39.78 3kt7 h ASP 86 CO 0.26 0.58 -0.96 0.00 -0.00 0.00 0.00 179.24 179.12 3kt7 n ILE 87 N -4.43 0.08 -3.81 4.15 3.06 -1.26 -4.64 119.36 112.51 3kt7 n ILE 87 Ca 0.07 -0.14 -0.09 0.00 -2.50 0.00 0.00 62.75 60.09 3kt7 n ILE 87 Cb 0.04 0.43 -0.04 0.00 0.54 0.00 0.00 39.64 40.61 3kt7 n ILE 87 CO 0.00 0.00 0.00 -0.72 -2.50 0.00 0.00 176.55 173.33 3kt7 s TYR 88 N -3.12 0.00 -0.06 9.51 1.13 -1.22 -0.94 117.35 122.65 3kt7 s TYR 88 Ca 0.06 -0.36 -0.02 0.00 -1.41 0.00 0.00 57.07 55.34 3kt7 s TYR 88 Cb 0.15 0.34 0.03 0.00 -1.10 0.00 0.00 41.96 41.39 3kt7 s TYR 88 CO 0.81 -0.94 0.03 0.50 -2.51 0.00 0.00 175.55 173.44 3kt7 s ARG 89 N -3.91 0.25 0.03 -3.49 3.52 -0.66 -0.77 118.95 113.91 3kt7 s ARG 89 Ca 0.12 0.24 -0.07 0.00 -0.13 0.00 0.00 55.73 55.89 3kt7 s ARG 89 Cb -0.01 -0.77 -0.01 0.00 -1.56 0.00 0.00 34.95 32.60 3kt7 s ARG 89 CO 0.00 -0.33 0.12 0.14 -0.81 0.00 0.00 175.30 174.42 3kt7 s VAL 90 N 2.07 0.12 -0.42 7.11 -7.23 -0.70 -1.26 120.40 120.10 3kt7 s VAL 90 Ca 0.05 -0.99 -0.19 0.00 -1.81 0.00 0.00 61.98 59.05 3kt7 s VAL 90 Cb -0.12 -0.82 0.02 0.00 0.56 0.00 0.00 36.38 36.01 3kt7 s VAL 90 CO -0.04 -0.54 0.52 0.20 -0.31 0.00 0.00 175.10 174.92 3kt7 s ASN 91 N -2.00 6.26 0.33 4.85 0.01 -0.43 -0.37 114.94 123.59 3kt7 s ASN 91 Ca -0.07 -0.47 0.08 0.00 -0.71 0.00 0.00 52.86 51.69 3kt7 s ASN 91 Cb -0.02 -2.26 -0.03 0.00 0.41 0.00 0.00 41.25 39.35 3kt7 s ASN 91 CO -0.03 -0.64 0.27 -1.10 -1.51 0.00 0.00 177.10 174.09 3kt7 s GLN 92 N 2.42 2.70 -0.01 -0.60 -0.21 0.09 -1.31 119.66 122.73 3kt7 s GLN 92 Ca 0.17 -1.31 0.01 0.00 0.02 0.00 0.00 55.36 54.26 3kt7 s GLN 92 Cb -0.16 -2.45 0.02 0.00 1.00 0.00 0.00 33.01 31.42 3kt7 s GLN 92 CO 0.16 0.11 0.75 -1.13 -2.12 0.00 0.00 175.29 173.06 3kt7 n SER 93 N -1.34 0.59 -2.02 5.90 3.41 -1.23 -1.07 113.62 117.86 3kt7 n SER 93 Ca -0.02 -1.56 -0.18 0.00 -0.26 0.00 0.00 58.87 56.85 3kt7 n SER 93 Cb 0.60 -0.07 0.17 0.00 -0.26 0.00 0.00 64.21 64.65 3kt7 n SER 93 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kt7 n GLY 94 N -0.21 4.01 3.77 5.00 0.00 -1.26 -4.61 105.19 111.89 3kt7 n GLY 94 Ca 0.01 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 3kt7 n GLY 94 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3kt7 s ASP 95 N -0.94 6.51 0.28 1.61 -4.77 -1.26 -4.90 116.67 113.19 3kt7 s ASP 95 Ca 0.49 2.91 0.02 0.00 -3.30 0.00 0.00 52.55 52.67 3kt7 s ASP 95 Cb 0.41 -2.66 0.62 0.00 -1.09 0.00 0.00 42.92 40.20 3kt7 s ASP 95 CO 0.10 -0.75 1.79 0.25 0.70 0.00 0.00 175.17 177.26 3kt7 h LEU 96 N 3.21 0.75 0.00 2.11 5.85 -1.98 -0.58 115.31 124.67 3kt7 h LEU 96 Ca -0.50 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3kt7 h LEU 96 Cb 1.23 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.21 3kt7 h LEU 96 CO 0.65 0.32 0.00 0.00 -0.34 0.00 0.00 178.44 179.07 3kt7 n ALA 97 N -2.36 2.58 -2.54 1.25 0.00 -1.26 -4.91 120.51 113.27 3kt7 n ALA 97 Ca 0.20 -0.18 -0.21 0.00 0.00 0.00 0.00 53.44 53.26 3kt7 n ALA 97 Cb 0.47 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.43 3kt7 n ALA 97 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3kt7 n ASN 98 N -1.09 -5.88 0.21 0.00 3.02 -0.22 -4.88 115.26 106.40 3kt7 n ASN 98 Ca 0.20 -0.07 0.15 0.00 -0.03 0.00 0.00 54.58 54.83 3kt7 n ASN 98 Cb 0.15 -4.87 0.65 0.00 -0.61 0.00 0.00 39.78 35.10 3kt7 n ASN 98 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3kt7 h LEU 99 N -0.30 0.00 -1.68 3.41 3.38 -1.89 -2.15 115.31 116.08 3kt7 h LEU 99 Ca -0.50 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 3kt7 h LEU 99 Cb 1.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.11 3kt7 h LEU 99 CO 0.57 0.00 -0.03 0.77 0.09 0.00 0.00 178.44 179.84 3kt7 h SER 100 N 0.00 0.00 0.00 -0.43 4.64 -1.84 -3.46 113.55 112.46 3kt7 h SER 100 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kt7 h SER 100 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3kt7 h SER 100 CO 0.00 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 3kt7 n GLY 101 N -0.16 0.01 3.54 -0.77 0.00 -0.81 -0.46 105.19 106.55 3kt7 n GLY 101 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3kt7 n GLY 101 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kt7 s LEU 102 N 0.00 4.46 -0.21 0.99 2.96 -1.26 -4.86 118.68 120.76 3kt7 s LEU 102 Ca 0.00 -0.22 -0.02 0.00 -0.22 0.00 0.00 54.13 53.67 3kt7 s LEU 102 Cb 0.00 -2.42 0.06 0.00 0.50 0.00 0.00 46.19 44.33 3kt7 s LEU 102 CO 0.00 -0.41 0.01 -0.62 -1.32 0.00 0.00 176.35 174.01 3kt7 s ASP 103 N 1.75 3.28 0.34 3.68 3.68 -1.26 -4.68 116.67 123.46 3kt7 s ASP 103 Ca 0.14 -0.99 0.26 0.00 2.13 0.00 0.00 52.55 54.09 3kt7 s ASP 103 Cb -0.16 -0.79 1.17 0.00 -1.45 0.00 0.00 42.92 41.68 3kt7 s ASP 103 CO 0.12 -0.29 1.79 -0.50 0.13 0.00 0.00 175.17 176.42 3kt7 h TRP 104 N 8.14 0.00 0.00 -5.34 4.06 -1.99 -0.81 115.95 120.00 3kt7 h TRP 104 Ca -0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.79 3kt7 h TRP 104 Cb 1.10 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.26 3kt7 h TRP 104 CO 0.36 0.00 -0.41 -0.25 -3.56 0.00 0.00 178.44 174.58 3kt7 n ASP 105 N -2.44 0.44 -3.28 -3.49 8.00 -1.26 -4.66 116.55 109.87 3kt7 n ASP 105 Ca 0.01 -0.02 -0.13 0.00 0.71 0.00 0.00 54.79 55.36 3kt7 n ASP 105 Cb 0.19 0.06 -0.06 0.00 -0.02 0.00 0.00 41.12 41.30 3kt7 n ASP 105 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3kt7 s ASP 106 N -3.23 0.41 -0.40 -2.24 3.68 -0.31 -5.01 116.67 109.57 3kt7 s ASP 106 Ca 0.11 -1.59 0.01 0.00 2.13 0.00 0.00 52.55 53.21 3kt7 s ASP 106 Cb 0.17 0.87 0.43 0.00 -1.45 0.00 0.00 42.92 42.94 3kt7 s ASP 106 CO 0.67 -0.21 1.83 0.18 0.13 0.00 0.00 175.17 177.77 3kt7 n LEU 107 N 4.00 6.35 -0.30 -1.34 4.77 -1.23 -4.40 117.00 124.86 3kt7 n LEU 107 Ca 0.14 -3.38 0.12 0.00 -0.03 0.00 0.00 56.01 52.85 3kt7 n LEU 107 Cb 0.49 -0.86 0.29 0.00 -2.33 0.00 0.00 43.42 41.00 3kt7 n LEU 107 CO 0.06 1.10 1.05 0.28 -1.33 0.00 0.00 177.39 178.55 3kt7 h SER 108 N 1.16 0.34 0.09 -1.43 0.02 -1.95 0.65 113.55 112.43 3kt7 h SER 108 Ca 0.47 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.56 3kt7 h SER 108 Cb 1.76 0.12 0.00 0.00 0.14 0.00 0.00 62.40 64.42 3kt7 h SER 108 CO 0.98 0.03 -0.10 0.54 -1.14 0.00 0.00 176.83 177.14 3kt7 n ARG 109 N -5.02 1.34 -3.07 3.45 1.74 -1.26 -4.29 116.66 109.54 3kt7 n ARG 109 Ca 0.21 -0.77 -0.22 0.00 -0.77 0.00 0.00 57.85 56.29 3kt7 n ARG 109 Cb 0.61 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.53 3kt7 n ARG 109 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3kt7 n LEU 110 N -0.15 2.63 0.19 0.55 4.32 0.21 -4.94 117.00 119.81 3kt7 n LEU 110 Ca 0.16 -5.34 0.05 0.00 -0.02 0.00 0.00 56.01 50.87 3kt7 n LEU 110 Cb 0.35 0.09 0.52 0.00 -1.62 0.00 0.00 43.42 42.76 3kt7 n LEU 110 CO 0.20 2.32 0.98 1.55 -1.22 0.00 0.00 177.39 181.23 3kt7 h PRO 111 N 3.00 0.10 -0.21 3.23 0.13 -1.73 -1.36 132.00 135.16 3kt7 h PRO 111 Ca 0.11 -0.01 -0.17 0.00 -0.87 0.00 0.00 66.00 65.06 3kt7 h PRO 111 Cb 0.74 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 3kt7 h PRO 111 CO 0.66 0.18 -0.55 -0.91 -0.23 0.00 0.00 178.00 177.15 3kt7 h ASN 112 N 0.10 0.71 -0.81 1.44 4.21 -1.92 -1.90 115.58 117.40 3kt7 h ASN 112 Ca 0.02 -0.38 -0.03 0.00 1.21 0.00 0.00 56.30 57.12 3kt7 h ASN 112 Cb 0.18 -0.20 -0.04 0.00 -1.12 0.00 0.00 38.32 37.14 3kt7 h ASN 112 CO 0.01 1.11 0.37 0.25 -1.29 0.00 0.00 177.43 177.88 3kt7 h LEU 113 N 0.49 1.08 -0.40 1.61 5.85 -1.75 -0.19 115.31 122.00 3kt7 h LEU 113 Ca 0.01 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.65 3kt7 h LEU 113 Cb 1.10 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 3kt7 h LEU 113 CO 0.11 0.92 0.05 0.15 -0.34 0.00 0.00 178.44 179.32 3kt7 h PHE 114 N 1.16 0.07 -0.75 1.25 3.57 -1.08 -0.81 116.94 120.34 3kt7 h PHE 114 Ca 0.28 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.78 3kt7 h PHE 114 Cb 0.14 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 3kt7 h PHE 114 CO 0.01 -0.03 0.38 -0.22 -2.23 0.00 0.00 178.31 176.23 3kt7 h LYS 115 N 0.16 1.07 -0.23 1.11 1.63 -0.87 -1.31 116.57 118.13 3kt7 h LYS 115 Ca 0.19 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 3kt7 h LYS 115 Cb 0.25 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.67 3kt7 h LYS 115 CO -0.28 0.82 0.15 1.25 -3.45 0.00 0.00 179.45 177.93 3kt7 h LEU 116 N 1.05 0.26 -0.69 5.20 5.85 -0.53 -0.98 115.31 125.46 3kt7 h LEU 116 Ca 0.26 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 3kt7 h LEU 116 Cb 0.08 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 3kt7 h LEU 116 CO -0.04 0.19 0.42 -0.09 -0.34 0.00 0.00 178.44 178.58 3kt7 h ARG 117 N 0.31 0.93 -0.36 1.25 2.43 -0.93 -1.72 114.38 116.30 3kt7 h ARG 117 Ca 0.09 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 3kt7 h ARG 117 Cb -0.03 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.29 3kt7 h ARG 117 CO -0.02 0.66 0.18 0.37 -1.51 0.00 0.00 179.97 179.64 3kt7 h GLN 118 N 0.94 0.36 -0.17 0.20 4.15 -0.91 -1.66 115.11 118.02 3kt7 h GLN 118 Ca 0.25 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.49 3kt7 h GLN 118 Cb -0.04 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 3kt7 h GLN 118 CO -0.05 0.24 -0.54 -0.84 -1.93 0.00 0.00 178.83 175.71 3kt7 h ILE 119 N 0.37 1.33 -0.05 2.39 3.07 -0.98 -1.84 117.51 121.80 3kt7 h ILE 119 Ca 0.15 -1.80 -0.08 0.00 1.55 0.00 0.00 64.86 64.68 3kt7 h ILE 119 Cb 0.05 1.79 -0.01 0.00 -0.27 0.00 0.00 36.82 38.38 3kt7 h ILE 119 CO -0.10 0.56 -0.34 -0.07 -1.05 0.00 0.00 178.15 177.14 3kt7 h LEU 120 N 0.38 0.09 -2.84 0.16 3.38 -1.06 -2.83 115.31 112.59 3kt7 h LEU 120 Ca 0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3kt7 h LEU 120 Cb 1.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3kt7 h LEU 120 CO 0.10 0.43 0.00 -1.22 0.09 0.00 0.00 178.44 177.84 3kt7 n TYR 121 N -4.11 0.99 -1.51 1.13 4.02 -0.65 -4.49 117.16 112.54 3kt7 n TYR 121 Ca -0.02 -0.52 -0.34 0.00 -0.01 0.00 0.00 57.90 57.01 3kt7 n TYR 121 Cb 0.40 -0.05 0.08 0.00 -0.02 0.00 0.00 39.34 39.75 3kt7 n TYR 121 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3kt7 s SER 122 N -1.00 4.40 0.23 7.72 1.04 -0.71 -4.57 113.70 120.82 3kt7 s SER 122 Ca 0.45 2.28 -0.06 0.00 0.48 0.00 0.00 55.95 59.10 3kt7 s SER 122 Cb 0.25 -2.58 0.31 0.00 0.10 0.00 0.00 66.02 64.09 3kt7 s SER 122 CO 0.29 -2.12 1.84 0.50 0.98 0.00 0.00 173.24 174.73 3kt7 h LYS 123 N -0.21 0.86 -0.19 4.02 3.64 -1.90 -0.26 116.57 122.53 3kt7 h LYS 123 Ca -0.47 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 58.89 3kt7 h LYS 123 Cb 1.29 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.88 3kt7 h LYS 123 CO 0.51 0.57 -0.04 1.96 -2.27 0.00 0.00 179.45 180.17 3kt7 h GLN 124 N 0.88 0.01 -0.24 1.90 7.50 -1.92 0.28 115.11 123.52 3kt7 h GLN 124 Ca 0.35 -0.00 -0.15 0.00 0.50 0.00 0.00 58.65 59.35 3kt7 h GLN 124 Cb 0.18 -0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.71 3kt7 h GLN 124 CO -0.18 0.00 -0.42 -0.92 -1.50 0.00 0.00 178.83 175.81 3kt7 h TYR 125 N 0.01 0.90 -0.88 2.96 5.03 -1.75 -2.81 116.97 120.43 3kt7 h TYR 125 Ca 0.09 -0.31 0.00 0.00 2.58 0.00 0.00 58.73 61.09 3kt7 h TYR 125 Cb 0.13 -0.17 -0.04 0.00 1.55 0.00 0.00 36.73 38.20 3kt7 h TYR 125 CO -0.21 1.09 0.56 0.00 -1.32 0.00 0.00 178.16 178.28 3kt7 h ARG 126 N 0.44 1.17 -0.51 1.82 3.08 -0.84 0.11 114.38 119.65 3kt7 h ARG 126 Ca 0.02 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 3kt7 h ARG 126 Cb 1.02 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 3kt7 h ARG 126 CO 0.10 0.80 0.10 -0.44 -1.07 0.00 0.00 179.97 179.45 3kt7 h ASP 127 N 1.20 0.80 0.16 7.04 3.45 -0.92 0.32 116.42 128.47 3kt7 h ASP 127 Ca 0.32 -0.25 -0.01 0.00 0.43 0.00 0.00 57.03 57.52 3kt7 h ASP 127 Cb -0.10 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 38.46 3kt7 h ASP 127 CO -0.06 0.85 -0.08 0.15 -1.57 0.00 0.00 179.24 178.53 3kt7 h PHE 128 N 0.73 -0.20 -0.41 4.55 3.57 -1.19 -2.51 116.94 121.48 3kt7 h PHE 128 Ca 0.16 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.55 3kt7 h PHE 128 Cb 0.38 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 3kt7 h PHE 128 CO 0.03 -0.10 -0.14 0.35 -2.23 0.00 0.00 178.31 176.21 3kt7 h PHE 129 N -0.25 0.93 -0.37 0.41 3.57 -0.64 -2.07 116.94 118.52 3kt7 h PHE 129 Ca -0.02 -0.21 -0.06 0.00 3.53 0.00 0.00 57.97 61.21 3kt7 h PHE 129 Cb 0.19 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 3kt7 h PHE 129 CO -0.06 0.96 -0.01 0.78 -2.23 0.00 0.00 178.31 177.75 3kt7 h GLY 130 N 0.63 0.63 0.78 2.40 0.00 -1.01 -2.57 103.07 103.93 3kt7 h GLY 130 Ca 0.10 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 3kt7 h GLY 130 CO 0.05 0.36 -0.16 -1.82 0.00 0.00 0.00 176.54 174.97 3kt7 h TYR 131 N 0.56 -0.41 0.00 5.60 3.20 -1.03 -1.70 116.97 123.19 3kt7 h TYR 131 Ca 0.12 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 3kt7 h TYR 131 Cb 0.37 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 3kt7 h TYR 131 CO 0.01 -0.12 -0.27 -0.39 -1.64 0.00 0.00 178.16 175.75 3kt7 h VAL 132 N -0.67 1.00 -0.01 1.81 -1.51 -1.35 -2.64 116.25 112.86 3kt7 h VAL 132 Ca -0.05 -0.99 0.00 0.00 -1.23 0.00 0.00 66.70 64.44 3kt7 h VAL 132 Cb 0.47 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 31.20 3kt7 h VAL 132 CO 0.07 0.26 -0.28 0.35 -1.23 0.00 0.00 177.57 176.75 3kt7 n THR 133 N -3.93 0.00 -3.56 7.19 -2.24 -0.97 -4.41 114.28 106.35 3kt7 n THR 133 Ca -0.02 -0.20 -0.26 0.00 -2.27 0.00 0.00 64.05 61.30 3kt7 n THR 133 Cb 0.34 0.73 0.02 0.00 -2.10 0.00 0.00 70.33 69.33 3kt7 n THR 133 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3kt7 n LYS 134 N -0.25 -5.05 0.00 -0.78 5.02 -0.76 -4.87 118.16 111.47 3kt7 n LYS 134 Ca 0.12 0.65 0.11 0.00 -2.02 0.00 0.00 58.31 57.17 3kt7 n LYS 134 Cb 0.40 -5.51 0.04 0.00 -0.02 0.00 0.00 35.03 29.94 3kt7 n LYS 134 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kt7 n ALA 135 N -4.18 4.01 -0.18 7.82 0.00 -0.71 -5.05 120.51 122.21 3kt7 n ALA 135 Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.89 3kt7 n ALA 135 Cb 0.55 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 19.12 3kt7 n ALA 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kt7 n GLY 136 N 1.46 0.01 3.83 0.00 0.00 -1.23 -4.88 105.19 104.37 3kt7 n GLY 136 Ca 0.07 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 3kt7 n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kt7 s LYS 137 N 0.00 4.16 0.04 1.61 -0.14 -1.26 -4.53 119.74 119.62 3kt7 s LYS 137 Ca 0.00 1.08 0.04 0.00 -1.36 0.00 0.00 55.97 55.73 3kt7 s LYS 137 Cb 0.00 -2.17 -0.02 0.00 -1.68 0.00 0.00 37.83 33.96 3kt7 s LYS 137 CO 0.00 -0.09 -0.12 -0.51 -0.76 0.00 0.00 175.35 173.88 3kt7 s LEU 138 N -3.39 2.17 0.07 3.17 1.43 -1.26 -4.44 118.68 116.43 3kt7 s LEU 138 Ca 0.61 -0.44 -0.31 0.00 -1.03 0.00 0.00 54.13 52.97 3kt7 s LEU 138 Cb -0.09 -0.47 -0.07 0.00 0.03 0.00 0.00 46.19 45.59 3kt7 s LEU 138 CO 0.17 -0.02 1.43 -0.55 0.23 0.00 0.00 176.35 177.61 3kt7 s SER 139 N -1.13 6.81 0.09 2.29 0.15 0.00 -4.73 113.70 117.17 3kt7 s SER 139 Ca -0.01 2.27 0.09 0.00 0.70 0.00 0.00 55.95 59.00 3kt7 s SER 139 Cb -0.08 -2.57 -0.20 0.00 -1.71 0.00 0.00 66.02 61.46 3kt7 s SER 139 CO 0.01 -0.70 1.13 1.23 1.20 0.00 0.00 173.24 176.10 3kt7 h GLY 140 N 7.56 0.00 0.88 9.45 0.00 -1.91 -3.40 103.07 115.66 3kt7 h GLY 140 Ca -0.41 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 46.64 3kt7 h GLY 140 CO 0.89 0.00 -1.74 -1.14 0.00 0.00 0.00 176.54 174.55 3kt7 n SER 141 N -3.26 0.78 -3.98 0.19 3.41 -1.26 -4.50 113.62 105.01 3kt7 n SER 141 Ca -0.04 0.37 -0.43 0.00 -0.26 0.00 0.00 58.87 58.51 3kt7 n SER 141 Cb 0.95 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.98 3kt7 n SER 141 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3kt7 n LYS 142 N -2.99 3.24 -2.62 4.33 4.81 -1.26 -4.95 118.16 118.71 3kt7 n LYS 142 Ca -0.17 -3.17 -0.39 0.00 -0.87 0.00 0.00 58.31 53.70 3kt7 n LYS 142 Cb 1.03 -3.16 -0.05 0.00 0.02 0.00 0.00 35.03 32.87 3kt7 n LYS 142 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3kt7 s THR 143 N 2.12 3.83 -0.41 3.15 -4.23 -1.26 -4.53 115.64 114.31 3kt7 s THR 143 Ca 0.45 1.70 0.06 0.00 -1.18 0.00 0.00 61.69 62.72 3kt7 s THR 143 Cb 0.09 -4.03 0.17 0.00 1.34 0.00 0.00 72.50 70.08 3kt7 s THR 143 CO -0.02 0.30 0.53 -0.62 -0.54 0.00 0.00 174.62 174.27 3kt7 s ASP 144 N -1.23 -0.36 0.14 3.99 2.15 -1.26 -5.07 116.67 115.03 3kt7 s ASP 144 Ca 0.47 -1.33 0.07 0.00 0.43 0.00 0.00 52.55 52.19 3kt7 s ASP 144 Cb -0.26 1.31 -0.04 0.00 -0.30 0.00 0.00 42.92 43.63 3kt7 s ASP 144 CO 0.33 -0.19 -0.17 -0.04 -0.17 0.00 0.00 175.17 174.93 3kt7 s MET 145 N 1.47 1.14 0.02 4.34 -1.94 -1.26 -1.06 119.30 122.01 3kt7 s MET 145 Ca 0.19 -1.29 0.00 0.00 -1.71 0.00 0.00 55.69 52.89 3kt7 s MET 145 Cb -0.07 -1.16 -0.02 0.00 2.01 0.00 0.00 34.83 35.58 3kt7 s MET 145 CO -0.06 0.24 -0.04 -1.54 -0.01 0.00 0.00 175.02 173.62 3kt7 s SER 146 N -2.43 0.34 -0.16 3.03 1.04 0.15 -4.97 113.70 110.70 3kt7 s SER 146 Ca 0.11 -0.52 0.02 0.00 0.48 0.00 0.00 55.95 56.03 3kt7 s SER 146 Cb -0.06 0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.16 3kt7 s SER 146 CO 0.05 -0.29 -0.21 -0.63 0.98 0.00 0.00 173.24 173.14 3kt7 s ILE 147 N -1.52 2.09 0.05 -1.02 1.01 -1.26 -1.07 121.20 119.48 3kt7 s ILE 147 Ca -0.14 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.57 3kt7 s ILE 147 Cb -0.09 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 3kt7 s ILE 147 CO -0.01 0.54 -0.06 0.20 0.00 0.00 0.00 174.94 175.61 3kt7 s ASN 148 N 1.05 0.71 0.02 3.58 -0.87 -0.73 -3.56 114.94 115.15 3kt7 s ASN 148 Ca -0.01 -0.68 0.08 0.00 -1.57 0.00 0.00 52.86 50.68 3kt7 s ASN 148 Cb -0.14 0.08 -0.02 0.00 -0.02 0.00 0.00 41.25 41.15 3kt7 s ASN 148 CO -0.07 -0.32 -0.24 0.42 -2.57 0.00 0.00 177.10 174.31 3kt7 s THR 149 N -2.13 1.92 -0.24 1.60 -4.23 -0.43 -1.30 115.64 110.83 3kt7 s THR 149 Ca -0.05 -1.21 -0.03 0.00 -1.18 0.00 0.00 61.69 59.22 3kt7 s THR 149 Cb -0.05 -1.63 0.01 0.00 1.34 0.00 0.00 72.50 72.17 3kt7 s THR 149 CO -0.02 0.38 -0.05 -0.31 -0.54 0.00 0.00 174.62 174.08 3kt7 s TYR 150 N -0.72 3.01 0.31 3.99 1.51 -0.07 -1.31 117.35 124.08 3kt7 s TYR 150 Ca 0.10 -1.23 0.04 0.00 -1.01 0.00 0.00 57.07 54.96 3kt7 s TYR 150 Cb -0.09 -2.09 0.04 0.00 -0.11 0.00 0.00 41.96 39.70 3kt7 s TYR 150 CO 0.01 -0.64 0.30 0.25 -1.11 0.00 0.00 175.55 174.36 3kt7 n THR 151 N 4.74 0.00 -1.67 -0.71 -2.24 -1.26 -1.23 114.28 111.92 3kt7 n THR 151 Ca -0.17 -1.18 -0.49 0.00 -2.27 0.00 0.00 64.05 59.94 3kt7 n THR 151 Cb 0.49 -0.39 -0.05 0.00 -2.10 0.00 0.00 70.33 68.28 3kt7 n THR 151 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3kt7 n LYS 152 N -1.38 1.89 0.00 -0.78 4.81 -1.24 -1.10 118.16 120.37 3kt7 n LYS 152 Ca 0.02 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 3kt7 n LYS 152 Cb 0.35 -2.46 0.00 0.00 0.02 0.00 0.00 35.03 32.94 3kt7 n LYS 152 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3kt7 n GLY 153 N 3.74 1.92 3.77 3.14 0.00 -0.06 -4.99 105.19 112.71 3kt7 n GLY 153 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 3kt7 n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kt7 s HIS 155 N -1.58 -0.30 -0.09 0.00 -3.43 -0.39 -1.80 115.29 107.70 3kt7 s HIS 155 Ca 0.65 0.02 -0.04 0.00 -0.80 0.00 0.00 55.06 54.90 3kt7 s HIS 155 Cb -0.28 0.61 0.05 0.00 -1.43 0.00 0.00 32.58 31.53 3kt7 s HIS 155 CO 0.34 -0.87 0.17 -1.17 -2.00 0.00 0.00 174.74 171.21 3kt7 s LEU 156 N -2.78 -0.09 0.97 5.38 2.96 -1.26 -1.66 118.68 122.20 3kt7 s LEU 156 Ca 0.07 0.32 -0.16 0.00 -0.22 0.00 0.00 54.13 54.14 3kt7 s LEU 156 Cb -0.02 0.31 0.21 0.00 0.50 0.00 0.00 46.19 47.18 3kt7 s LEU 156 CO -0.03 -0.25 1.33 -0.76 -1.32 0.00 0.00 176.35 175.32 3kt7 s LEU 157 N 2.30 2.73 0.19 -0.68 1.43 -0.12 -4.60 118.68 119.94 3kt7 s LEU 157 Ca 0.03 0.24 -0.32 0.00 -1.03 0.00 0.00 54.13 53.05 3kt7 s LEU 157 Cb -0.12 -2.26 -0.11 0.00 0.03 0.00 0.00 46.19 43.73 3kt7 s LEU 157 CO -0.06 -2.78 1.63 -0.89 0.23 0.00 0.00 176.35 174.48 3kt7 s THR 158 N -3.91 2.33 0.28 5.49 2.01 -1.26 -4.64 115.64 115.95 3kt7 s THR 158 Ca 0.75 0.24 -0.20 0.00 0.31 0.00 0.00 61.69 62.79 3kt7 s THR 158 Cb -0.03 -3.15 0.02 0.00 0.01 0.00 0.00 72.50 69.34 3kt7 s THR 158 CO 0.53 0.02 0.70 -1.38 -0.69 0.00 0.00 174.62 173.80 3kt7 s HIS 159 N 1.05 -0.10 -0.50 4.92 -3.43 -0.67 -4.55 115.29 112.00 3kt7 s HIS 159 Ca 0.71 -0.36 0.05 0.00 -0.80 0.00 0.00 55.06 54.67 3kt7 s HIS 159 Cb -0.47 0.65 0.01 0.00 -1.43 0.00 0.00 32.58 31.35 3kt7 s HIS 159 CO 0.33 -1.23 0.49 -0.40 -2.00 0.00 0.00 174.74 171.93 3kt7 n ASP 160 N -0.51 0.97 0.00 7.38 5.68 -1.26 -1.26 116.55 127.55 3kt7 n ASP 160 Ca -0.04 -0.99 0.00 0.00 -0.50 0.00 0.00 54.79 53.26 3kt7 n ASP 160 Cb 0.59 0.39 0.00 0.00 -1.14 0.00 0.00 41.12 40.97 3kt7 n ASP 160 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3kt7 n ASP 161 N -0.25 -1.47 -4.56 -1.12 10.43 -1.26 -4.63 116.55 113.69 3kt7 n ASP 161 Ca 0.02 0.00 -0.40 0.00 2.57 0.00 0.00 54.79 56.98 3kt7 n ASP 161 Cb 0.11 -1.35 -0.03 0.00 1.84 0.00 0.00 41.12 41.69 3kt7 n ASP 161 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3kt7 s VAL 162 N -2.29 3.81 -0.02 2.53 1.01 -1.26 -4.91 120.40 119.27 3kt7 s VAL 162 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 3kt7 s VAL 162 Cb 0.00 -4.93 0.01 0.00 0.00 0.00 0.00 36.38 31.47 3kt7 s VAL 162 CO 0.00 -1.83 0.03 -0.63 0.00 0.00 0.00 175.10 172.67 3kt7 s ILE 163 N 5.62 -0.02 0.00 2.22 -1.09 -1.26 -5.10 121.20 121.57 3kt7 s ILE 163 Ca 0.44 0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.94 3kt7 s ILE 163 Cb -0.03 -0.07 0.00 0.00 -1.58 0.00 0.00 42.46 40.78 3kt7 s ILE 163 CO -0.00 0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.35 3kt7 n GLY 164 N 3.46 2.48 1.39 6.18 0.00 -1.26 -2.33 105.19 115.12 3kt7 n GLY 164 Ca -0.18 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 45.79 3kt7 n GLY 164 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kt7 n SER 165 N 1.04 4.08 -4.74 1.61 3.41 -1.26 -4.67 113.62 113.09 3kt7 n SER 165 Ca 0.00 -2.50 -0.42 0.00 -0.26 0.00 0.00 58.87 55.69 3kt7 n SER 165 Cb 0.00 -0.56 -0.02 0.00 -0.26 0.00 0.00 64.21 63.37 3kt7 n SER 165 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3kt7 s ARG 166 N -2.02 4.13 -0.06 4.33 0.52 -0.98 -1.70 118.95 123.17 3kt7 s ARG 166 Ca 0.39 2.56 -0.01 0.00 -0.52 0.00 0.00 55.73 58.16 3kt7 s ARG 166 Cb 0.28 -3.05 -0.03 0.00 0.52 0.00 0.00 34.95 32.66 3kt7 s ARG 166 CO 0.15 -0.66 -0.06 -2.13 0.02 0.00 0.00 175.30 172.63 3kt7 n ARG 167 N 2.78 0.14 -4.31 3.54 0.63 0.13 -4.83 116.66 114.73 3kt7 n ARG 167 Ca 0.11 0.04 -0.19 0.00 -0.92 0.00 0.00 57.85 56.88 3kt7 n ARG 167 Cb 0.37 -0.96 -0.15 0.00 0.45 0.00 0.00 32.46 32.17 3kt7 n ARG 167 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3kt7 s ILE 168 N -2.11 0.68 -0.07 5.15 1.01 -0.81 -0.98 121.20 124.06 3kt7 s ILE 168 Ca -0.08 -0.30 -0.13 0.00 0.00 0.00 0.00 60.65 60.14 3kt7 s ILE 168 Cb 0.03 -0.62 -0.05 0.00 0.01 0.00 0.00 42.46 41.83 3kt7 s ILE 168 CO 0.12 0.22 0.33 -0.55 0.00 0.00 0.00 174.94 175.06 3kt7 s SER 169 N 0.26 6.63 0.03 3.58 0.15 0.19 -1.02 113.70 123.52 3kt7 s SER 169 Ca -0.04 0.75 0.01 0.00 0.70 0.00 0.00 55.95 57.37 3kt7 s SER 169 Cb -0.08 -2.20 -0.02 0.00 -1.71 0.00 0.00 66.02 62.00 3kt7 s SER 169 CO 0.00 0.27 -0.06 0.72 1.20 0.00 0.00 173.24 175.38 3kt7 s PHE 170 N -0.62 0.50 -0.07 3.44 -0.71 -0.42 -1.42 117.98 118.69 3kt7 s PHE 170 Ca 0.20 -0.51 -0.01 0.00 -1.04 0.00 0.00 56.93 55.57 3kt7 s PHE 170 Cb -0.15 -0.32 0.03 0.00 -1.21 0.00 0.00 43.02 41.37 3kt7 s PHE 170 CO 0.09 -0.13 0.00 0.42 -1.34 0.00 0.00 175.22 174.26 3kt7 s ILE 171 N -1.41 0.36 -0.23 -4.49 1.09 0.35 -0.62 121.20 116.24 3kt7 s ILE 171 Ca -0.12 0.12 -0.10 0.00 -1.10 0.00 0.00 60.65 59.44 3kt7 s ILE 171 Cb -0.10 -0.51 -0.05 0.00 -1.06 0.00 0.00 42.46 40.74 3kt7 s ILE 171 CO -0.00 0.25 0.15 -0.22 -0.10 0.00 0.00 174.94 175.02 3kt7 s LEU 172 N 1.88 4.06 -0.12 2.97 2.96 0.23 -1.03 118.68 129.63 3kt7 s LEU 172 Ca 0.04 0.09 -0.10 0.00 -0.22 0.00 0.00 54.13 53.94 3kt7 s LEU 172 Cb -0.12 -2.08 -0.05 0.00 0.50 0.00 0.00 46.19 44.44 3kt7 s LEU 172 CO -0.05 0.07 0.21 -0.31 -1.32 0.00 0.00 176.35 174.95 3kt7 s TYR 173 N 1.02 3.57 -0.32 5.38 1.51 -0.39 -0.66 117.35 127.45 3kt7 s TYR 173 Ca 0.07 0.59 0.15 0.00 -1.01 0.00 0.00 57.07 56.87 3kt7 s TYR 173 Cb -0.13 -2.10 0.46 0.00 -0.11 0.00 0.00 41.96 40.08 3kt7 s TYR 173 CO 0.04 0.57 1.07 1.28 -1.11 0.00 0.00 175.55 177.40 3kt7 n LEU 174 N 2.46 2.77 -4.59 -1.29 4.32 0.34 -1.03 117.00 119.99 3kt7 n LEU 174 Ca -0.17 -4.03 -0.30 0.00 -0.02 0.00 0.00 56.01 51.50 3kt7 n LEU 174 Cb 0.54 0.12 0.23 0.00 -1.62 0.00 0.00 43.42 42.68 3kt7 n LEU 174 CO 0.35 1.66 0.61 -2.16 -1.22 0.00 0.00 177.39 176.62 3kt7 s PRO 175 N -3.48 -0.90 -0.46 3.23 0.04 -1.24 -4.43 135.00 127.76 3kt7 s PRO 175 Ca 0.36 0.13 -0.45 0.00 0.04 0.00 0.00 61.00 61.08 3kt7 s PRO 175 Cb 0.40 -1.62 -0.19 0.00 0.04 0.00 0.00 34.50 33.14 3kt7 s PRO 175 CO -0.03 -3.53 1.75 -3.47 0.04 0.00 0.00 177.00 171.76 3kt7 n ASP 176 N -4.67 1.34 0.26 6.66 -0.08 -1.26 -4.50 116.55 114.30 3kt7 n ASP 176 Ca 0.10 1.04 0.17 0.00 -1.51 0.00 0.00 54.79 54.60 3kt7 n ASP 176 Cb 0.59 -0.94 0.81 0.00 2.34 0.00 0.00 41.12 43.92 3kt7 n ASP 176 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3kt7 h PRO 177 N 6.40 0.00 -0.42 -0.67 0.13 -1.98 -3.03 132.00 132.44 3kt7 h PRO 177 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3kt7 h PRO 177 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 3kt7 h PRO 177 CO 1.00 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.52 3kt7 n ASP 178 N -2.86 3.85 -4.01 1.44 8.00 -1.26 -4.93 116.55 116.77 3kt7 n ASP 178 Ca -0.00 -2.48 -0.12 0.00 0.71 0.00 0.00 54.79 52.89 3kt7 n ASP 178 Cb 0.19 -0.45 -0.12 0.00 -0.02 0.00 0.00 41.12 40.73 3kt7 n ASP 178 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3kt7 s ARG 179 N -1.88 0.42 -0.03 -1.24 1.81 -1.15 -5.14 118.95 111.75 3kt7 s ARG 179 Ca 0.38 -0.59 -0.28 0.00 -1.72 0.00 0.00 55.73 53.53 3kt7 s ARG 179 Cb 0.26 -0.19 -0.03 0.00 -0.45 0.00 0.00 34.95 34.54 3kt7 s ARG 179 CO 0.16 0.03 0.88 0.21 -0.68 0.00 0.00 175.30 175.90 3kt7 s LYS 180 N -1.25 4.51 0.00 3.54 2.20 -1.26 -4.79 119.74 122.69 3kt7 s LYS 180 Ca -0.09 1.22 -0.30 0.00 -0.36 0.00 0.00 55.97 56.43 3kt7 s LYS 180 Cb -0.08 -3.46 -0.04 0.00 -1.51 0.00 0.00 37.83 32.74 3kt7 s LYS 180 CO -0.00 -0.01 1.15 -0.46 -0.36 0.00 0.00 175.35 175.66 3kt7 s TRP 181 N 0.95 3.40 0.13 4.03 -0.11 -1.26 -5.03 118.94 121.05 3kt7 s TRP 181 Ca 0.47 1.36 0.04 0.00 1.22 0.00 0.00 56.10 59.18 3kt7 s TRP 181 Cb -0.20 -3.35 -0.04 0.00 -1.50 0.00 0.00 33.47 28.38 3kt7 s TRP 181 CO 0.24 -1.00 0.13 0.15 -4.62 0.00 0.00 176.95 171.85 3kt7 s LYS 182 N 1.49 2.97 0.23 5.86 1.02 -1.26 -4.91 119.74 125.13 3kt7 s LYS 182 Ca 0.56 -0.76 -0.07 0.00 0.02 0.00 0.00 55.97 55.71 3kt7 s LYS 182 Cb -0.26 -2.72 0.37 0.00 -0.52 0.00 0.00 37.83 34.70 3kt7 s LYS 182 CO 0.26 0.52 1.71 0.77 -0.92 0.00 0.00 175.35 177.69 3kt7 h SER 183 N 2.73 0.11 0.46 2.83 0.02 -1.96 -1.27 113.55 116.47 3kt7 h SER 183 Ca -0.47 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 3kt7 h SER 183 Cb 1.18 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.86 3kt7 h SER 183 CO 0.65 0.04 0.00 0.00 -1.14 0.00 0.00 176.83 176.38 3kt7 n HIS 184 N -5.08 0.00 0.30 3.45 1.44 -1.26 -2.01 115.22 112.05 3kt7 n HIS 184 Ca 0.11 0.00 0.16 0.00 -2.01 0.00 0.00 57.72 55.98 3kt7 n HIS 184 Cb 0.37 -0.42 0.58 0.00 0.12 0.00 0.00 29.99 30.64 3kt7 n HIS 184 CO 0.00 0.00 0.00 1.88 -2.81 0.00 0.00 176.34 175.41 3kt7 h TYR 185 N 0.00 0.00 -0.16 -1.40 0.05 -1.62 -3.43 116.97 110.41 3kt7 h TYR 185 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3kt7 h TYR 185 Cb 0.23 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.97 3kt7 h TYR 185 CO 0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 3kt7 n GLY 186 N 0.21 -0.65 2.35 3.88 0.00 -0.85 -0.17 105.19 109.96 3kt7 n GLY 186 Ca 0.01 -1.13 -0.05 0.00 0.00 0.00 0.00 46.02 44.85 3kt7 n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kt7 n GLY 187 N 0.00 0.75 3.77 -0.02 0.00 -0.60 -4.83 105.19 104.26 3kt7 n GLY 187 Ca 0.00 -0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 3kt7 n GLY 187 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kt7 s GLY 188 N -2.51 2.89 -0.22 -0.02 0.00 -1.25 -4.65 107.32 101.55 3kt7 s GLY 188 Ca 0.00 1.07 -0.28 0.00 0.00 0.00 0.00 44.72 45.51 3kt7 s GLY 188 CO 0.00 1.61 0.98 -2.27 0.00 0.00 0.00 173.10 173.42 3kt7 s LEU 189 N -2.47 4.11 -0.06 0.66 2.96 -0.21 -0.85 118.68 122.82 3kt7 s LEU 189 Ca 0.57 1.31 0.03 0.00 -0.22 0.00 0.00 54.13 55.82 3kt7 s LEU 189 Cb -0.34 -3.45 -0.02 0.00 0.50 0.00 0.00 46.19 42.88 3kt7 s LEU 189 CO 0.42 -0.61 -0.15 -0.13 -1.32 0.00 0.00 176.35 174.56 3kt7 s ARG 190 N 3.00 2.59 -0.01 1.98 0.52 -0.08 -0.21 118.95 126.74 3kt7 s ARG 190 Ca 0.42 -0.71 0.07 0.00 -0.52 0.00 0.00 55.73 54.99 3kt7 s ARG 190 Cb -0.15 -2.39 -0.02 0.00 0.52 0.00 0.00 34.95 32.90 3kt7 s ARG 190 CO 0.07 0.56 -0.22 -0.51 0.02 0.00 0.00 175.30 175.23 3kt7 s LEU 191 N -0.58 2.31 -0.11 2.53 1.43 -0.35 -0.82 118.68 123.10 3kt7 s LEU 191 Ca 0.08 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 3kt7 s LEU 191 Cb -0.11 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 3kt7 s LEU 191 CO 0.01 0.31 -0.11 -0.36 0.23 0.00 0.00 176.35 176.43 3kt7 s PHE 192 N -0.72 2.84 0.90 0.29 0.08 -0.00 -1.02 117.98 120.35 3kt7 s PHE 192 Ca 0.11 -0.38 -0.12 0.00 0.12 0.00 0.00 56.93 56.67 3kt7 s PHE 192 Cb -0.10 -1.80 0.13 0.00 -0.57 0.00 0.00 43.02 40.68 3kt7 s PHE 192 CO 0.01 -0.01 1.12 -1.25 -0.10 0.00 0.00 175.22 174.99 3kt7 s PRO 193 N -0.06 1.19 0.02 0.24 0.04 -1.26 -4.51 135.00 130.66 3kt7 s PRO 193 Ca -0.01 0.39 0.09 0.00 0.04 0.00 0.00 61.00 61.51 3kt7 s PRO 193 Cb -0.14 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 3kt7 s PRO 193 CO 0.03 -2.18 -0.26 -1.12 0.04 0.00 0.00 177.00 173.51 3kt7 s SER 194 N -3.91 3.09 -0.02 6.66 0.01 -1.26 -0.72 113.70 117.56 3kt7 s SER 194 Ca 0.63 -0.54 -0.20 0.00 1.31 0.00 0.00 55.95 57.16 3kt7 s SER 194 Cb -0.15 -0.31 -0.29 0.00 0.21 0.00 0.00 66.02 65.48 3kt7 s SER 194 CO 0.54 0.28 0.99 0.40 0.41 0.00 0.00 173.24 175.86 3kt7 h ILE 195 N 4.35 1.45 -4.04 1.44 2.04 -1.00 -3.45 117.51 118.30 3kt7 h ILE 195 Ca -0.45 -2.38 -0.13 0.00 1.00 0.00 0.00 64.86 62.90 3kt7 h ILE 195 Cb 1.13 2.94 -0.13 0.00 -0.74 0.00 0.00 36.82 40.03 3kt7 h ILE 195 CO 0.45 0.69 -0.37 -0.76 0.00 0.00 0.00 178.15 178.15 3kt7 s LEU 196 N -8.02 0.94 0.18 1.44 1.02 -1.16 -4.56 118.68 108.53 3kt7 s LEU 196 Ca -0.13 -1.03 -0.33 0.00 0.02 0.00 0.00 54.13 52.66 3kt7 s LEU 196 Cb 0.02 1.05 -0.14 0.00 0.02 0.00 0.00 46.19 47.14 3kt7 s LEU 196 CO 0.84 -0.92 1.40 -2.65 0.02 0.00 0.00 176.35 175.05 3kt7 n PRO 197 N -0.25 1.77 -1.07 1.29 -0.02 -1.26 -0.87 135.00 134.59 3kt7 n PRO 197 Ca -0.04 0.63 -0.02 0.00 -2.02 0.00 0.00 63.50 62.05 3kt7 n PRO 197 Cb 0.63 -2.29 -0.01 0.00 -0.02 0.00 0.00 33.50 31.81 3kt7 n PRO 197 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3kt7 n ASN 198 N 2.56 -5.05 -3.72 2.55 4.13 0.15 -4.94 115.26 110.94 3kt7 n ASN 198 Ca 0.15 0.06 -0.28 0.00 1.68 0.00 0.00 54.58 56.19 3kt7 n ASN 198 Cb 0.27 -2.76 -0.11 0.00 -1.54 0.00 0.00 39.78 35.64 3kt7 n ASN 198 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3kt7 s VAL 199 N -1.49 1.93 0.56 2.41 1.01 -0.05 -5.07 120.40 119.69 3kt7 s VAL 199 Ca 0.00 -3.61 -0.20 0.00 0.00 0.00 0.00 61.98 58.18 3kt7 s VAL 199 Cb 0.00 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 3kt7 s VAL 199 CO 0.00 -1.08 1.19 -2.16 0.00 0.00 0.00 175.10 173.06 3kt7 s PRO 200 N -0.81 3.19 0.56 2.72 0.04 -1.26 -0.40 135.00 139.02 3kt7 s PRO 200 Ca 0.27 1.79 -0.21 0.00 0.04 0.00 0.00 61.00 62.89 3kt7 s PRO 200 Cb -0.03 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 3kt7 s PRO 200 CO -0.16 -1.03 1.30 -1.01 0.04 0.00 0.00 177.00 176.14 3kt7 s HIS 201 N -1.62 2.34 0.43 0.56 3.76 0.11 -4.38 115.29 116.50 3kt7 s HIS 201 Ca 0.74 1.43 0.10 0.00 -0.15 0.00 0.00 55.06 57.18 3kt7 s HIS 201 Cb -0.29 -3.69 0.93 0.00 1.11 0.00 0.00 32.58 30.64 3kt7 s HIS 201 CO 0.32 -2.63 2.03 1.03 -0.85 0.00 0.00 174.74 174.65 3kt7 h SER 202 N 1.32 0.29 -3.62 1.40 0.87 -1.92 -3.44 113.55 108.45 3kt7 h SER 202 Ca -0.51 -0.02 -0.68 0.00 -1.23 0.00 0.00 61.79 59.35 3kt7 h SER 202 Cb 1.30 -0.07 -0.19 0.00 -0.44 0.00 0.00 62.40 63.00 3kt7 h SER 202 CO 0.57 0.28 -0.68 -1.81 -0.53 0.00 0.00 176.83 174.65 3kt7 s ASP 203 N -6.84 4.72 0.70 6.23 1.01 -1.26 -4.86 116.67 116.37 3kt7 s ASP 203 Ca -0.07 -0.00 -0.11 0.00 0.71 0.00 0.00 52.55 53.08 3kt7 s ASP 203 Cb 0.17 -1.21 0.01 0.00 1.01 0.00 0.00 42.92 42.90 3kt7 s ASP 203 CO 0.72 0.36 1.06 -2.16 0.21 0.00 0.00 175.17 175.36 3kt7 s PRO 204 N -0.81 2.89 0.00 8.23 0.04 -1.26 -4.54 135.00 139.55 3kt7 s PRO 204 Ca 0.12 0.99 0.02 0.00 0.04 0.00 0.00 61.00 62.17 3kt7 s PRO 204 Cb -0.11 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.44 3kt7 s PRO 204 CO 0.02 -1.14 0.30 -1.13 0.04 0.00 0.00 177.00 175.09 3kt7 n SER 205 N -3.10 0.58 -3.88 6.66 3.41 -0.19 -4.96 113.62 112.13 3kt7 n SER 205 Ca 0.08 -0.79 -0.11 0.00 -0.26 0.00 0.00 58.87 57.79 3kt7 n SER 205 Cb 0.53 0.54 -0.10 0.00 -0.26 0.00 0.00 64.21 64.92 3kt7 n SER 205 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kt7 s ALA 206 N -0.70 -0.26 -0.09 7.33 0.00 -1.14 -4.89 121.76 122.00 3kt7 s ALA 206 Ca 0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 51.96 51.77 3kt7 s ALA 206 Cb 0.01 0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.27 3kt7 s ALA 206 CO 0.05 -0.19 0.20 0.21 0.00 0.00 0.00 175.76 176.03 3kt7 s LYS 207 N -1.26 0.13 -0.22 0.00 2.20 -1.26 -1.21 119.74 118.12 3kt7 s LYS 207 Ca -0.14 0.53 -0.08 0.00 -0.36 0.00 0.00 55.97 55.93 3kt7 s LYS 207 Cb -0.07 -0.15 -0.04 0.00 -1.51 0.00 0.00 37.83 36.05 3kt7 s LYS 207 CO 0.01 -0.22 0.09 -1.17 -0.36 0.00 0.00 175.35 173.70 3kt7 s LEU 208 N 1.68 3.74 -0.36 5.43 2.96 0.70 -4.94 118.68 127.89 3kt7 s LEU 208 Ca -0.05 -0.02 -0.20 0.00 -0.22 0.00 0.00 54.13 53.64 3kt7 s LEU 208 Cb -0.11 -1.98 0.00 0.00 0.50 0.00 0.00 46.19 44.60 3kt7 s LEU 208 CO -0.07 0.07 0.64 -0.69 -1.32 0.00 0.00 176.35 174.98 3kt7 s VAL 209 N 0.97 4.89 0.41 1.68 1.01 -1.26 -1.05 120.40 127.05 3kt7 s VAL 209 Ca 0.05 0.58 -0.25 0.00 0.00 0.00 0.00 61.98 62.36 3kt7 s VAL 209 Cb -0.14 -4.08 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 3kt7 s VAL 209 CO 0.03 -0.32 1.18 -2.16 0.00 0.00 0.00 175.10 173.83 3kt7 s PRO 210 N 2.72 3.97 0.15 2.72 0.04 -1.26 -5.05 135.00 138.29 3kt7 s PRO 210 Ca 0.24 1.86 0.05 0.00 0.04 0.00 0.00 61.00 63.19 3kt7 s PRO 210 Cb -0.14 -2.62 -0.04 0.00 0.04 0.00 0.00 34.50 31.73 3kt7 s PRO 210 CO 0.15 -0.39 -0.11 -0.65 0.04 0.00 0.00 177.00 176.04 3kt7 s GLN 211 N -2.39 1.07 0.16 4.56 -1.52 -1.26 -4.55 119.66 115.73 3kt7 s GLN 211 Ca 0.59 -1.44 -0.34 0.00 -1.95 0.00 0.00 55.36 52.22 3kt7 s GLN 211 Cb -0.31 -0.67 -0.15 0.00 -0.22 0.00 0.00 33.01 31.66 3kt7 s GLN 211 CO 0.39 0.09 1.45 0.34 -0.25 0.00 0.00 175.29 177.30 3kt7 n PHE 212 N -0.14 1.97 -1.27 0.91 7.35 -1.26 -1.86 117.46 123.17 3kt7 n PHE 212 Ca -0.11 0.43 -0.09 0.00 -0.76 0.00 0.00 57.45 56.92 3kt7 n PHE 212 Cb 0.60 -2.45 -0.04 0.00 0.35 0.00 0.00 39.48 37.94 3kt7 n PHE 212 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3kt7 n ASN 213 N 2.81 -4.21 -4.77 -2.13 4.05 -0.19 -4.67 115.26 106.14 3kt7 n ASN 213 Ca 0.16 0.23 -0.36 0.00 0.45 0.00 0.00 54.58 55.06 3kt7 n ASN 213 Cb 0.27 -2.52 -0.08 0.00 1.23 0.00 0.00 39.78 38.67 3kt7 n ASN 213 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 3kt7 s GLN 214 N -2.70 3.58 -0.07 1.20 0.74 -0.77 -1.23 119.66 120.40 3kt7 s GLN 214 Ca 0.00 -0.24 0.02 0.00 0.05 0.00 0.00 55.36 55.19 3kt7 s GLN 214 Cb 0.00 -3.15 -0.02 0.00 1.10 0.00 0.00 33.01 30.93 3kt7 s GLN 214 CO 0.00 0.59 -0.12 -1.50 -0.55 0.00 0.00 175.29 173.71 3kt7 s ILE 215 N -0.50 3.26 0.05 -2.34 2.07 -0.47 -1.26 121.20 122.01 3kt7 s ILE 215 Ca 0.11 -0.63 0.09 0.00 -1.41 0.00 0.00 60.65 58.81 3kt7 s ILE 215 Cb -0.12 -2.32 -0.03 0.00 0.13 0.00 0.00 42.46 40.12 3kt7 s ILE 215 CO 0.02 0.58 -0.24 0.00 -1.91 0.00 0.00 174.94 173.39 3kt7 s ALA 216 N -0.49 2.37 0.14 1.50 0.00 -0.20 -1.76 121.76 123.32 3kt7 s ALA 216 Ca 0.07 -1.26 -0.22 0.00 0.00 0.00 0.00 51.96 50.54 3kt7 s ALA 216 Cb -0.12 -0.55 0.06 0.00 0.00 0.00 0.00 23.12 22.51 3kt7 s ALA 216 CO 0.02 0.55 0.57 -0.59 0.00 0.00 0.00 175.76 176.30 3kt7 s PHE 217 N -0.86 -0.48 -0.17 0.00 -0.71 -0.45 -0.50 117.98 114.81 3kt7 s PHE 217 Ca 0.13 0.31 -0.28 0.00 -1.04 0.00 0.00 56.93 56.05 3kt7 s PHE 217 Cb -0.10 0.49 0.08 0.00 -1.21 0.00 0.00 43.02 42.28 3kt7 s PHE 217 CO 0.03 -0.80 0.75 -0.59 -1.34 0.00 0.00 175.22 173.27 3kt7 s PHE 218 N -3.54 -0.68 0.22 3.49 -0.71 -0.51 -1.10 117.98 115.15 3kt7 s PHE 218 Ca 0.00 1.43 -0.31 0.00 -1.04 0.00 0.00 56.93 57.02 3kt7 s PHE 218 Cb -0.00 0.35 -0.11 0.00 -1.21 0.00 0.00 43.02 42.05 3kt7 s PHE 218 CO -0.11 -0.46 1.56 0.21 -1.34 0.00 0.00 175.22 175.08 3kt7 s LYS 219 N -0.40 4.20 0.03 1.99 2.20 -1.26 -0.64 119.74 125.86 3kt7 s LYS 219 Ca -0.04 2.42 -0.30 0.00 -0.36 0.00 0.00 55.97 57.68 3kt7 s LYS 219 Cb -0.03 -3.10 -0.07 0.00 -1.51 0.00 0.00 37.83 33.12 3kt7 s LYS 219 CO 0.04 -0.58 1.62 0.08 -0.36 0.00 0.00 175.35 176.16 3kt7 s VAL 220 N 0.56 3.28 -0.34 4.02 1.01 -0.16 -4.87 120.40 123.90 3kt7 s VAL 220 Ca 0.66 0.62 0.03 0.00 0.00 0.00 0.00 61.98 63.29 3kt7 s VAL 220 Cb -0.45 -3.40 0.10 0.00 0.00 0.00 0.00 36.38 32.63 3kt7 s VAL 220 CO 0.38 -0.02 0.08 -0.76 0.00 0.00 0.00 175.10 174.79 3kt7 s LEU 221 N 3.00 3.94 0.09 3.92 1.43 -1.26 -4.96 118.68 124.83 3kt7 s LEU 221 Ca 0.73 -2.07 -0.36 0.00 -1.03 0.00 0.00 54.13 51.40 3kt7 s LEU 221 Cb -0.37 -1.39 -0.15 0.00 0.03 0.00 0.00 46.19 44.31 3kt7 s LEU 221 CO 0.31 -0.38 1.50 -2.65 0.23 0.00 0.00 176.35 175.36 3kt7 n PRO 222 N 4.34 1.65 0.00 1.29 -0.02 -1.26 -0.84 135.00 140.16 3kt7 n PRO 222 Ca 0.02 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 3kt7 n PRO 222 Cb 0.41 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3kt7 n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kt7 n GLY 223 N 3.12 2.12 0.00 -1.23 0.00 -1.26 -4.81 105.19 103.14 3kt7 n GLY 223 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3kt7 n GLY 223 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3kt7 n PHE 224 N -2.00 0.00 -1.24 1.61 3.72 -0.02 -0.67 117.46 118.85 3kt7 n PHE 224 Ca 0.00 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.15 3kt7 n PHE 224 Cb 0.00 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.44 3kt7 n PHE 224 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3kt7 n SER 225 N -1.21 6.83 -4.70 4.37 3.41 -0.65 -4.88 113.62 116.79 3kt7 n SER 225 Ca 0.00 -2.64 -0.42 0.00 -0.26 0.00 0.00 58.87 55.55 3kt7 n SER 225 Cb 0.14 -1.44 -0.03 0.00 -0.26 0.00 0.00 64.21 62.61 3kt7 n SER 225 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3kt7 s PHE 226 N 0.95 3.57 0.17 7.33 0.40 -1.26 -4.23 117.98 124.91 3kt7 s PHE 226 Ca 0.66 1.58 -0.11 0.00 -0.60 0.00 0.00 56.93 58.46 3kt7 s PHE 226 Cb 0.27 -3.12 0.00 0.00 0.51 0.00 0.00 43.02 40.68 3kt7 s PHE 226 CO -0.05 -0.12 0.34 -3.38 0.70 0.00 0.00 175.22 172.71 3kt7 s HIS 227 N 1.54 0.27 0.00 0.36 -3.43 -0.39 -0.82 115.29 112.81 3kt7 s HIS 227 Ca 0.48 -0.63 0.00 0.00 -0.80 0.00 0.00 55.06 54.11 3kt7 s HIS 227 Cb -0.19 0.05 0.00 0.00 -1.43 0.00 0.00 32.58 31.01 3kt7 s HIS 227 CO 0.21 -0.76 0.00 -0.40 -2.00 0.00 0.00 174.74 171.79 3kt7 n ASP 228 N -0.24 0.00 -3.94 7.38 3.85 -0.00 -1.67 116.55 121.93 3kt7 n ASP 228 Ca -0.08 0.00 -0.19 0.00 -0.71 0.00 0.00 54.79 53.81 3kt7 n ASP 228 Cb 0.63 0.00 -0.16 0.00 -1.35 0.00 0.00 41.12 40.24 3kt7 n ASP 228 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 3kt7 s GLU 230 N 3.69 0.79 0.36 0.11 2.12 -0.03 -0.90 118.70 124.84 3kt7 s GLU 230 Ca 0.00 -0.19 -0.26 0.00 0.36 0.00 0.00 54.97 54.88 3kt7 s GLU 230 Cb 0.00 -0.77 -0.12 0.00 0.26 0.00 0.00 34.13 33.50 3kt7 s GLU 230 CO 0.00 0.02 1.08 -1.91 -0.54 0.00 0.00 175.26 173.91 3kt7 n GLU 231 N 3.57 1.54 -2.52 4.30 2.13 -1.26 -1.56 120.64 126.83 3kt7 n GLU 231 Ca -0.21 0.54 -0.43 0.00 0.66 0.00 0.00 57.16 57.73 3kt7 n GLU 231 Cb 0.53 -2.05 -0.02 0.00 0.27 0.00 0.00 31.44 30.17 3kt7 n GLU 231 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3kt7 s VAL 232 N -1.16 4.43 -1.67 6.31 1.01 -0.75 -2.02 120.40 126.56 3kt7 s VAL 232 Ca 0.60 1.73 0.21 0.00 0.00 0.00 0.00 61.98 64.52 3kt7 s VAL 232 Cb -0.61 -4.12 -0.07 0.00 0.00 0.00 0.00 36.38 31.59 3kt7 s VAL 232 CO 0.59 -0.09 0.99 0.29 0.00 0.00 0.00 175.10 176.89 3kt7 n LYS 233 N 5.89 1.04 -4.36 2.72 5.02 0.76 -0.88 118.16 128.36 3kt7 n LYS 233 Ca 0.12 -0.71 -0.18 0.00 -2.02 0.00 0.00 58.31 55.52 3kt7 n LYS 233 Cb 0.46 -1.44 -0.10 0.00 -0.02 0.00 0.00 35.03 33.92 3kt7 n LYS 233 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3kt7 s VAL 234 N -2.52 0.83 -1.36 -0.18 -7.23 -1.24 -4.95 120.40 103.74 3kt7 s VAL 234 Ca 0.15 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.15 3kt7 s VAL 234 Cb 0.17 -2.64 0.04 0.00 0.56 0.00 0.00 36.38 34.50 3kt7 s VAL 234 CO 0.62 -0.05 2.01 -0.67 -0.31 0.00 0.00 175.10 176.70 3kt7 n ASP 235 N -0.53 4.23 -4.24 4.85 2.03 -1.26 -3.61 116.55 118.02 3kt7 n ASP 235 Ca -0.01 -2.86 -0.13 0.00 0.52 0.00 0.00 54.79 52.30 3kt7 n ASP 235 Cb 0.66 -1.68 -0.10 0.00 -0.72 0.00 0.00 41.12 39.28 3kt7 n ASP 235 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3kt7 s LYS 236 N 3.77 1.09 -0.32 -0.67 -0.14 -1.26 -5.00 119.74 117.21 3kt7 s LYS 236 Ca 0.51 -1.51 -0.04 0.00 -1.36 0.00 0.00 55.97 53.57 3kt7 s LYS 236 Cb 0.10 -0.32 0.05 0.00 -1.68 0.00 0.00 37.83 35.97 3kt7 s LYS 236 CO -0.01 -0.09 0.05 -1.01 -0.76 0.00 0.00 175.35 173.53 3kt7 s HIS 237 N -3.60 3.26 -0.64 3.18 3.76 -1.26 -4.04 115.29 115.96 3kt7 s HIS 237 Ca 0.22 -1.68 -0.18 0.00 -0.15 0.00 0.00 55.06 53.27 3kt7 s HIS 237 Cb 0.06 -2.19 0.12 0.00 1.11 0.00 0.00 32.58 31.67 3kt7 s HIS 237 CO 0.03 -0.77 0.72 0.50 -0.85 0.00 0.00 174.74 174.37 3kt7 s ARG 238 N 1.32 3.13 -0.06 1.40 3.52 -0.36 -4.61 118.95 123.29 3kt7 s ARG 238 Ca -0.04 -1.51 -0.16 0.00 -0.13 0.00 0.00 55.73 53.89 3kt7 s ARG 238 Cb -0.20 -4.34 -0.05 0.00 -1.56 0.00 0.00 34.95 28.81 3kt7 s ARG 238 CO 0.01 -1.52 0.43 -1.17 -0.81 0.00 0.00 175.30 172.24 3kt7 s LEU 239 N 2.33 4.37 0.04 -0.88 2.96 -1.26 -0.89 118.68 125.36 3kt7 s LEU 239 Ca 0.13 0.87 -0.07 0.00 -0.22 0.00 0.00 54.13 54.85 3kt7 s LEU 239 Cb -0.22 -2.63 -0.01 0.00 0.50 0.00 0.00 46.19 43.84 3kt7 s LEU 239 CO 0.03 0.17 0.12 -0.94 -1.32 0.00 0.00 176.35 174.41 3kt7 s SER 240 N -0.23 0.15 -0.28 3.68 1.04 -0.42 -0.50 113.70 117.14 3kt7 s SER 240 Ca 0.24 -0.53 -0.02 0.00 0.48 0.00 0.00 55.95 56.12 3kt7 s SER 240 Cb -0.16 0.25 0.04 0.00 0.10 0.00 0.00 66.02 66.25 3kt7 s SER 240 CO 0.11 -0.55 -0.01 -0.63 0.98 0.00 0.00 173.24 173.15 3kt7 s ILE 241 N -2.79 3.09 -0.11 -1.02 1.01 0.16 -1.77 121.20 119.76 3kt7 s ILE 241 Ca -0.03 -1.16 -0.09 0.00 0.00 0.00 0.00 60.65 59.37 3kt7 s ILE 241 Cb -0.00 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 3kt7 s ILE 241 CO -0.05 0.03 0.20 -1.58 0.00 0.00 0.00 174.94 173.54 3kt7 s GLN 242 N 1.31 3.67 0.26 2.79 2.00 -0.23 -0.60 119.66 128.86 3kt7 s GLN 242 Ca -0.02 -0.02 -0.08 0.00 -2.00 0.00 0.00 55.36 53.24 3kt7 s GLN 242 Cb -0.18 -3.24 -0.01 0.00 0.80 0.00 0.00 33.01 30.38 3kt7 s GLN 242 CO -0.02 0.68 0.40 0.20 -0.50 0.00 0.00 175.29 176.05 3kt7 s GLY 243 N -0.79 0.96 0.01 2.59 0.00 0.21 0.34 107.32 110.63 3kt7 s GLY 243 Ca 0.16 -1.21 0.03 0.00 0.00 0.00 0.00 44.72 43.70 3kt7 s GLY 243 CO 0.05 -0.89 -0.08 -0.98 0.00 0.00 0.00 173.10 171.20 3kt7 s TRP 244 N -3.83 0.74 -0.02 1.90 0.51 -0.22 -1.30 118.94 116.71 3kt7 s TRP 244 Ca 0.28 -0.22 -0.15 0.00 -2.12 0.00 0.00 56.10 53.89 3kt7 s TRP 244 Cb 0.01 -0.46 -0.05 0.00 -0.81 0.00 0.00 33.47 32.15 3kt7 s TRP 244 CO 0.12 -0.02 0.41 0.71 -0.51 0.00 0.00 176.95 177.66 3kt7 s TYR 245 N -0.48 3.69 0.32 -1.98 1.51 -0.19 -4.17 117.35 116.05 3kt7 s TYR 245 Ca 0.00 0.95 0.08 0.00 -1.01 0.00 0.00 57.07 57.10 3kt7 s TYR 245 Cb -0.05 -2.32 -0.04 0.00 -0.11 0.00 0.00 41.96 39.45 3kt7 s TYR 245 CO 0.00 0.57 0.18 -1.01 -1.11 0.00 0.00 175.55 174.18 3kt7 s HIS 246 N -0.78 2.82 0.24 2.71 3.76 -1.26 0.17 115.29 122.95 3kt7 s HIS 246 Ca 0.23 -0.30 -0.31 0.00 -0.15 0.00 0.00 55.06 54.53 3kt7 s HIS 246 Cb -0.16 -1.61 -0.14 0.00 1.11 0.00 0.00 32.58 31.77 3kt7 s HIS 246 CO 0.12 0.34 1.24 -0.89 -0.85 0.00 0.00 174.74 174.71 3kt7 n ILE 247 N -1.20 1.25 -1.65 0.60 5.41 -0.69 -0.82 119.36 122.27 3kt7 n ILE 247 Ca -0.04 -0.31 -0.42 0.00 1.00 0.00 0.00 62.75 62.99 3kt7 n ILE 247 Cb 0.60 -1.20 0.01 0.00 -0.71 0.00 0.00 39.64 38.34 3kt7 n ILE 247 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3kt7 n PRO 248 N 1.53 1.63 -2.97 0.38 -0.02 -1.26 -4.38 135.00 129.91 3kt7 n PRO 248 Ca 0.11 0.58 -0.18 0.00 -2.02 0.00 0.00 63.50 62.00 3kt7 n PRO 248 Cb 0.30 -2.18 0.01 0.00 -0.02 0.00 0.00 33.50 31.62 3kt7 n PRO 248 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3kt7 s GLN 249 N -2.04 2.78 0.20 -0.52 -1.52 -1.26 -4.69 119.66 112.61 3kt7 s GLN 249 Ca 0.61 -1.20 -0.31 0.00 -1.95 0.00 0.00 55.36 52.51 3kt7 s GLN 249 Cb -0.55 -2.73 -0.15 0.00 -0.22 0.00 0.00 33.01 29.36 3kt7 s GLN 249 CO 0.58 -0.34 1.04 1.55 -0.25 0.00 0.00 175.29 177.87 3kt7 n VAL 250 N -1.92 1.30 -0.55 1.09 3.14 -1.26 -1.65 118.33 118.48 3kt7 n VAL 250 Ca 0.08 -0.33 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 3kt7 n VAL 250 Cb 0.59 -0.77 0.00 0.00 -1.06 0.00 0.00 33.84 32.61 3kt7 n VAL 250 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3kt7 n GLY 251 N 1.77 1.47 3.94 7.55 0.00 -1.26 -5.02 105.19 113.63 3kt7 n GLY 251 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 3kt7 n GLY 251 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kt7 s GLU 252 N -0.16 3.40 0.18 1.61 2.02 -0.66 -5.05 118.70 120.04 3kt7 s GLU 252 Ca 0.00 -0.65 -0.33 0.00 0.02 0.00 0.00 54.97 54.01 3kt7 s GLU 252 Cb 0.00 -2.93 -0.13 0.00 0.10 0.00 0.00 34.13 31.17 3kt7 s GLU 252 CO 0.00 0.50 1.60 -1.91 0.02 0.00 0.00 175.26 175.47 3kt7 n GLU 253 N -0.69 2.30 -0.81 1.61 2.13 -1.26 -1.89 120.64 122.02 3kt7 n GLU 253 Ca -0.07 0.83 0.00 0.00 0.66 0.00 0.00 57.16 58.57 3kt7 n GLU 253 Cb 0.55 -2.61 0.00 0.00 0.27 0.00 0.00 31.44 29.65 3kt7 n GLU 253 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3kt7 n GLY 254 N 3.41 0.82 3.72 8.31 0.00 -1.26 -4.64 105.19 115.54 3kt7 n GLY 254 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3kt7 n GLY 254 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3kt7 s TYR 255 N -3.16 3.04 -0.20 1.61 6.14 -0.79 -4.77 117.35 119.21 3kt7 s TYR 255 Ca 0.00 0.58 0.00 0.00 0.64 0.00 0.00 57.07 58.29 3kt7 s TYR 255 Cb 0.00 -3.97 0.05 0.00 0.42 0.00 0.00 41.96 38.46 3kt7 s TYR 255 CO 0.00 -3.58 -0.07 0.42 0.64 0.00 0.00 175.55 172.96 3kt7 s ILE 256 N 1.15 1.40 0.14 3.14 1.01 -1.26 -5.03 121.20 121.75 3kt7 s ILE 256 Ca 0.71 -0.95 -0.34 0.00 0.00 0.00 0.00 60.65 60.07 3kt7 s ILE 256 Cb -0.45 -1.59 -0.14 0.00 0.01 0.00 0.00 42.46 40.29 3kt7 s ILE 256 CO 0.31 0.05 1.55 -2.65 0.00 0.00 0.00 174.94 174.21 3kt7 n PRO 257 N 4.75 2.01 0.00 2.79 -0.02 -1.26 -1.65 135.00 141.62 3kt7 n PRO 257 Ca -0.13 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 3kt7 n PRO 257 Cb 0.46 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3kt7 n PRO 257 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kt7 n GLY 258 N 3.32 2.19 0.09 -1.23 0.00 -1.26 -4.93 105.19 103.37 3kt7 n GLY 258 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 3kt7 n GLY 258 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3kt7 h GLU 259 N 2.62 -0.11 -0.43 1.61 4.81 -1.74 -1.70 114.58 119.64 3kt7 h GLU 259 Ca 0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3kt7 h GLU 259 Cb 0.00 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 3kt7 h GLU 259 CO 0.00 -0.07 0.17 1.49 -0.73 0.00 0.00 179.01 179.87 3kt7 h GLU 260 N -0.11 0.65 -0.64 1.92 4.81 -1.92 -1.50 114.58 117.79 3kt7 h GLU 260 Ca 0.01 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.15 3kt7 h GLU 260 Cb 0.11 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 3kt7 h GLU 260 CO -0.02 0.60 0.39 0.93 -0.73 0.00 0.00 179.01 180.18 3kt7 h GLU 261 N 0.55 0.74 -0.67 1.92 3.07 -1.93 -1.29 114.58 116.98 3kt7 h GLU 261 Ca 0.14 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 58.89 3kt7 h GLU 261 Cb 0.20 -0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 3kt7 h GLU 261 CO -0.01 0.49 0.15 0.00 -1.40 0.00 0.00 179.01 178.24 3kt7 h ALA 262 N 1.28 0.89 -0.07 3.43 0.00 -1.09 -1.43 119.26 122.27 3kt7 h ALA 262 Ca 0.26 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3kt7 h ALA 262 Cb 0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3kt7 h ALA 262 CO -0.11 0.62 0.04 2.35 0.00 0.00 0.00 179.25 182.15 3kt7 h TRP 263 N 1.01 0.09 -0.53 0.00 2.91 -0.91 -1.21 115.95 117.32 3kt7 h TRP 263 Ca 0.21 -0.00 -0.04 0.00 1.13 0.00 0.00 58.89 60.19 3kt7 h TRP 263 Cb 0.39 -0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 28.99 3kt7 h TRP 263 CO 0.03 0.11 0.19 0.28 -1.03 0.00 0.00 178.44 178.01 3kt7 h VAL 264 N 0.05 1.23 -0.38 2.65 2.07 -1.14 -2.44 116.25 118.29 3kt7 h VAL 264 Ca 0.03 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 3kt7 h VAL 264 Cb 0.04 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 3kt7 h VAL 264 CO -0.00 0.28 0.21 -0.09 0.02 0.00 0.00 177.57 177.98 3kt7 h ARG 265 N 0.72 0.53 0.00 1.57 2.43 -1.17 -0.84 114.38 117.61 3kt7 h ARG 265 Ca 0.17 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 3kt7 h ARG 265 Cb 0.24 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3kt7 h ARG 265 CO -0.01 0.43 -0.17 -0.97 -1.51 0.00 0.00 179.97 177.74 3kt7 h ASN 266 N 0.49 0.00 0.84 -3.80 -1.24 -1.13 -1.42 115.58 109.32 3kt7 h ASN 266 Ca 0.13 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.12 3kt7 h ASN 266 Cb 0.05 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.10 3kt7 h ASN 266 CO -0.02 0.17 -1.17 0.59 -1.29 0.00 0.00 177.43 175.70 3kt7 n ASN 267 N -3.92 0.75 -0.04 1.15 3.02 -0.93 -4.33 115.26 110.97 3kt7 n ASN 267 Ca -0.02 0.29 -0.22 0.00 -0.03 0.00 0.00 54.58 54.61 3kt7 n ASN 267 Cb 0.26 0.60 -0.13 0.00 -0.61 0.00 0.00 39.78 39.89 3kt7 n ASN 267 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3kt7 n THR 268 N -2.65 1.69 -2.65 3.41 -1.04 -0.35 -5.09 114.28 107.59 3kt7 n THR 268 Ca -0.02 -0.43 -0.42 0.00 -2.04 0.00 0.00 64.05 61.14 3kt7 n THR 268 Cb 0.59 -1.84 -0.03 0.00 -1.82 0.00 0.00 70.33 67.22 3kt7 n THR 268 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3kt7 s SER 269 N -6.98 7.32 -0.59 8.00 1.04 -0.55 -5.10 113.70 116.84 3kt7 s SER 269 Ca -0.25 1.77 0.04 0.00 0.48 0.00 0.00 55.95 57.98 3kt7 s SER 269 Cb 0.07 -2.58 0.38 0.00 0.10 0.00 0.00 66.02 63.99 3kt7 s SER 269 CO 0.70 -0.27 1.23 0.59 0.98 0.00 0.00 173.24 176.47 3kt7 n ASN 277 N 3.69 5.22 0.11 7.02 3.02 -1.26 -4.87 115.26 128.19 3kt7 n ASN 277 Ca 0.06 -3.72 0.02 0.00 -0.03 0.00 0.00 54.58 50.90 3kt7 n ASN 277 Cb 0.50 -0.63 0.36 0.00 -0.61 0.00 0.00 39.78 39.40 3kt7 n ASN 277 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3kt7 h VAL 278 N 2.61 1.20 0.00 2.41 2.07 -2.06 -3.11 116.25 119.36 3kt7 h VAL 278 Ca 0.30 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.91 3kt7 h VAL 278 Cb 0.62 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 3kt7 h VAL 278 CO 0.94 0.28 -0.02 -0.07 0.02 0.00 0.00 177.57 178.72 3kt7 h LEU 279 N 0.22 0.00 -2.02 2.57 3.38 -2.00 -2.56 115.31 114.90 3kt7 h LEU 279 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3kt7 h LEU 279 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3kt7 h LEU 279 CO 0.03 0.02 0.00 1.05 0.09 0.00 0.00 178.44 179.63 3kt7 h GLU 280 N 0.00 0.00 0.00 1.13 4.11 -1.96 -1.78 114.58 116.08 3kt7 h GLU 280 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.41 3kt7 h GLU 280 Cb 0.46 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 3kt7 h GLU 280 CO 0.00 0.00 -0.09 -0.44 0.07 0.00 0.00 179.01 178.55 3kt7 h ASP 281 N 0.00 0.00 -0.02 3.06 5.19 -1.68 -2.87 116.42 120.10 3kt7 h ASP 281 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3kt7 h ASP 281 Cb 0.21 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.72 3kt7 h ASP 281 CO 0.00 0.09 -0.00 0.49 -3.12 0.00 0.00 179.24 176.70 3kt7 n PHE 282 N -3.92 0.00 -3.13 4.55 3.72 -0.67 -4.87 117.46 113.14 3kt7 n PHE 282 Ca -0.02 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.98 3kt7 n PHE 282 Cb 0.18 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.67 3kt7 n PHE 282 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3kt7 s GLU 283 N -2.00 4.40 0.01 -1.08 2.02 -1.09 -4.26 118.70 116.69 3kt7 s GLU 283 Ca 0.34 0.74 0.02 0.00 0.02 0.00 0.00 54.97 56.09 3kt7 s GLU 283 Cb 0.21 -3.45 -0.01 0.00 0.10 0.00 0.00 34.13 30.98 3kt7 s GLU 283 CO 0.32 0.08 -0.07 -0.06 0.02 0.00 0.00 175.26 175.55 3kt7 s PHE 284 N 0.79 0.62 0.65 1.61 0.40 -0.38 -4.17 117.98 117.50 3kt7 s PHE 284 Ca 0.34 -0.20 -0.14 0.00 -0.60 0.00 0.00 56.93 56.32 3kt7 s PHE 284 Cb -0.17 -0.39 -0.01 0.00 0.51 0.00 0.00 43.02 42.97 3kt7 s PHE 284 CO 0.15 -0.02 1.08 -1.25 0.70 0.00 0.00 175.22 175.88 3kt7 s PRO 285 N -0.50 2.94 0.38 0.24 0.04 -1.26 -1.25 135.00 135.58 3kt7 s PRO 285 Ca -0.00 1.24 -0.26 0.00 0.04 0.00 0.00 61.00 62.02 3kt7 s PRO 285 Cb -0.04 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.43 3kt7 s PRO 285 CO -0.00 -1.12 1.17 0.15 0.04 0.00 0.00 177.00 177.24 3kt7 s LYS 286 N -4.30 4.16 -1.34 4.56 -0.14 -1.26 -4.93 119.74 116.48 3kt7 s LYS 286 Ca 0.64 1.86 -0.11 0.00 -1.36 0.00 0.00 55.97 57.00 3kt7 s LYS 286 Cb -0.18 -2.77 0.12 0.00 -1.68 0.00 0.00 37.83 33.32 3kt7 s LYS 286 CO 0.43 -0.23 1.99 -3.47 -0.76 0.00 0.00 175.35 173.31 3kt7 n ASP 287 N 0.28 4.65 -4.01 2.83 4.64 -1.26 -4.91 116.55 118.78 3kt7 n ASP 287 Ca 0.03 -3.01 -0.20 0.00 -1.38 0.00 0.00 54.79 50.23 3kt7 n ASP 287 Cb 0.46 -1.55 -0.15 0.00 -1.04 0.00 0.00 41.12 38.84 3kt7 n ASP 287 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 3kt7 s GLU 288 N 1.48 0.98 0.07 -0.67 2.02 -1.26 -4.86 118.70 116.46 3kt7 s GLU 288 Ca 0.42 -0.32 0.08 0.00 0.02 0.00 0.00 54.97 55.18 3kt7 s GLU 288 Cb 0.11 -0.92 -0.04 0.00 0.10 0.00 0.00 34.13 33.39 3kt7 s GLU 288 CO -0.03 0.12 -0.18 1.03 0.02 0.00 0.00 175.26 176.22 3kt7 s ARG 289 N 0.17 1.95 -0.07 1.61 0.52 -1.26 -4.68 118.95 117.19 3kt7 s ARG 289 Ca -0.03 -1.06 -0.10 0.00 -0.52 0.00 0.00 55.73 54.02 3kt7 s ARG 289 Cb -0.08 -2.15 -0.05 0.00 0.52 0.00 0.00 34.95 33.19 3kt7 s ARG 289 CO 0.00 0.52 0.25 -0.80 0.02 0.00 0.00 175.30 175.29 3kt7 s ASN 290 N -1.70 6.56 0.47 0.23 -0.87 -0.23 -4.79 114.94 114.61 3kt7 s ASN 290 Ca 0.16 0.67 -0.22 0.00 -1.57 0.00 0.00 52.86 51.89 3kt7 s ASN 290 Cb -0.10 -2.14 -0.07 0.00 -0.02 0.00 0.00 41.25 38.91 3kt7 s ASN 290 CO 0.07 0.37 1.16 0.27 -2.57 0.00 0.00 177.10 176.41 3kt7 s ILE 291 N -1.04 3.11 0.63 0.60 -4.36 -1.26 -0.83 121.20 118.04 3kt7 s ILE 291 Ca 0.19 0.81 -0.09 0.00 -0.26 0.00 0.00 60.65 61.30 3kt7 s ILE 291 Cb -0.14 -3.40 -0.00 0.00 1.25 0.00 0.00 42.46 40.17 3kt7 s ILE 291 CO 0.08 -0.03 0.98 -0.76 0.24 0.00 0.00 174.94 175.45 3kt7 s LEU 292 N -3.12 3.15 0.70 0.37 1.43 -0.56 -4.87 118.68 115.78 3kt7 s LEU 292 Ca 0.65 1.02 -0.14 0.00 -1.03 0.00 0.00 54.13 54.62 3kt7 s LEU 292 Cb -0.28 -3.88 0.02 0.00 0.03 0.00 0.00 46.19 42.08 3kt7 s LEU 292 CO 0.34 -1.08 1.12 -0.94 0.23 0.00 0.00 176.35 176.02 3kt7 s SER 293 N -4.28 4.76 0.25 2.29 1.04 -1.26 -4.89 113.70 111.60 3kt7 s SER 293 Ca 0.55 2.04 -0.04 0.00 0.48 0.00 0.00 55.95 58.98 3kt7 s SER 293 Cb -0.11 -2.55 0.43 0.00 0.10 0.00 0.00 66.02 63.88 3kt7 s SER 293 CO 0.49 -1.87 1.80 -0.26 0.98 0.00 0.00 173.24 174.38 3kt7 h PHE 294 N -0.29 0.83 -0.34 5.02 0.05 -2.00 -2.57 116.94 117.63 3kt7 h PHE 294 Ca -0.46 0.03 0.05 0.00 3.82 0.00 0.00 57.97 61.41 3kt7 h PHE 294 Cb 1.25 -0.25 -0.04 0.00 2.00 0.00 0.00 35.95 38.91 3kt7 h PHE 294 CO 0.54 0.31 0.09 1.25 -0.18 0.00 0.00 178.31 180.31 3kt7 h HIS 295 N 0.74 0.15 0.32 -0.55 2.76 -2.00 -2.18 115.15 114.39 3kt7 h HIS 295 Ca 0.41 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.59 3kt7 h HIS 295 Cb 0.43 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.38 3kt7 h HIS 295 CO -0.07 0.04 -0.17 0.93 -1.30 0.00 0.00 177.93 177.37 3kt7 h GLU 296 N 0.21 -0.43 -0.92 5.26 5.08 -1.84 -2.59 114.58 119.34 3kt7 h GLU 296 Ca 0.16 0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3kt7 h GLU 296 Cb 0.17 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 3kt7 h GLU 296 CO -0.20 -0.29 0.57 0.28 -1.00 0.00 0.00 179.01 178.38 3kt7 h VAL 297 N -0.45 1.25 -0.64 3.13 2.07 -1.39 -1.62 116.25 118.60 3kt7 h VAL 297 Ca -0.04 -0.52 0.06 0.00 0.82 0.00 0.00 66.70 67.02 3kt7 h VAL 297 Cb 0.35 -0.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.00 3kt7 h VAL 297 CO 0.06 0.26 0.34 0.11 0.02 0.00 0.00 177.57 178.36 3kt7 h LYS 298 N 1.27 0.60 -0.52 1.57 1.57 -1.32 -0.51 116.57 119.23 3kt7 h LYS 298 Ca 0.33 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.09 3kt7 h LYS 298 Cb -0.08 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.06 3kt7 h LYS 298 CO -0.06 0.40 0.32 0.45 -0.57 0.00 0.00 179.45 179.99 3kt7 h HIS 299 N 0.62 0.61 -0.19 -1.35 3.86 -0.91 0.43 115.15 118.22 3kt7 h HIS 299 Ca 0.29 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.47 3kt7 h HIS 299 Cb 0.22 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.48 3kt7 h HIS 299 CO -0.09 0.36 -0.07 0.74 0.86 0.00 0.00 177.93 179.72 3kt7 h PHE 300 N 0.65 0.44 -0.18 2.45 0.05 -1.03 -2.27 116.94 117.05 3kt7 h PHE 300 Ca 0.20 -0.10 0.03 0.00 3.82 0.00 0.00 57.97 61.92 3kt7 h PHE 300 Cb -0.01 -0.10 -0.03 0.00 2.00 0.00 0.00 35.95 37.81 3kt7 h PHE 300 CO -0.06 0.67 -0.01 0.93 -0.18 0.00 0.00 178.31 179.66 3kt7 h GLU 301 N 0.08 0.04 -0.49 1.51 5.08 -0.99 -1.34 114.58 118.47 3kt7 h GLU 301 Ca 0.04 -0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.45 3kt7 h GLU 301 Cb 0.54 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 3kt7 h GLU 301 CO 0.02 0.03 0.22 -0.22 -1.00 0.00 0.00 179.01 178.06 3kt7 h LYS 302 N 0.04 0.41 -0.43 2.33 3.64 -0.90 -1.38 116.57 120.28 3kt7 h LYS 302 Ca 0.09 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.37 3kt7 h LYS 302 Cb 0.11 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3kt7 h LYS 302 CO -0.16 0.27 -0.01 1.98 -2.27 0.00 0.00 179.45 179.27 3kt7 h MET 303 N 0.42 0.77 -0.01 1.90 4.05 -1.19 -3.19 114.93 117.70 3kt7 h MET 303 Ca 0.22 -0.25 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 3kt7 h MET 303 Cb 0.18 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 30.91 3kt7 h MET 303 CO -0.19 0.85 -0.15 1.28 0.23 0.00 0.00 176.91 178.93 3kt7 n LEU 304 N -4.39 0.80 -1.36 3.39 4.77 -0.52 0.15 117.00 119.83 3kt7 n LEU 304 Ca -0.00 -0.16 0.08 0.00 -0.03 0.00 0.00 56.01 55.90 3kt7 n LEU 304 Cb 0.30 -0.13 0.32 0.00 -2.33 0.00 0.00 43.42 41.58 3kt7 n LEU 304 CO 0.41 0.15 0.78 0.29 -1.33 0.00 0.00 177.39 177.69 3kt7 n LYS 305 N -0.69 3.60 0.00 3.23 5.02 -0.54 -4.97 118.16 123.82 3kt7 n LYS 305 Ca 0.15 -2.80 0.00 0.00 -2.02 0.00 0.00 58.31 53.63 3kt7 n LYS 305 Cb 0.31 -1.84 0.00 0.00 -0.02 0.00 0.00 35.03 33.48 3kt7 n LYS 305 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3kt7 n VAL 328 N 0.67 0.00 -3.84 -0.18 0.24 0.38 -5.09 118.33 110.51 3kt7 n VAL 328 Ca 0.23 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.41 3kt7 n VAL 328 Cb 0.86 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 33.09 3kt7 n VAL 328 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3kt7 s LYS 329 N 0.00 0.04 -0.06 7.34 2.20 -1.26 -5.14 119.74 122.86 3kt7 s LYS 329 Ca 0.00 0.08 0.02 0.00 -0.36 0.00 0.00 55.97 55.71 3kt7 s LYS 329 Cb 0.00 -0.02 -0.03 0.00 -1.51 0.00 0.00 37.83 36.27 3kt7 s LYS 329 CO 0.00 -0.03 -0.08 -0.51 -0.36 0.00 0.00 175.35 174.37 3kt7 s LEU 330 N 0.20 3.09 0.83 5.43 1.02 -1.26 -4.97 118.68 123.00 3kt7 s LEU 330 Ca -0.01 -0.07 -0.11 0.00 0.02 0.00 0.00 54.13 53.95 3kt7 s LEU 330 Cb -0.02 -1.68 0.09 0.00 0.02 0.00 0.00 46.19 44.60 3kt7 s LEU 330 CO -0.01 0.35 1.09 -0.94 0.02 0.00 0.00 176.35 176.87 3kt7 s SER 331 N -0.87 4.15 0.31 2.29 1.04 -1.26 -4.83 113.70 114.53 3kt7 s SER 331 Ca 0.13 1.44 -0.00 0.00 0.48 0.00 0.00 55.95 57.99 3kt7 s SER 331 Cb -0.11 -2.16 0.50 0.00 0.10 0.00 0.00 66.02 64.35 3kt7 s SER 331 CO 0.02 -2.20 1.93 -0.33 0.98 0.00 0.00 173.24 173.64 3kt7 h GLU 332 N -1.25 0.90 -0.78 4.02 5.08 -2.00 -0.87 114.58 119.68 3kt7 h GLU 332 Ca -0.47 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 57.74 3kt7 h GLU 332 Cb 1.27 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 3kt7 h GLU 332 CO 0.57 0.67 0.30 0.00 -1.00 0.00 0.00 179.01 179.54 3kt7 h ALA 333 N 1.48 1.06 -0.51 3.43 0.00 -1.99 -0.90 119.26 121.81 3kt7 h ALA 333 Ca 0.23 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 3kt7 h ALA 333 Cb 0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3kt7 h ALA 333 CO -0.04 0.66 -0.08 0.93 0.00 0.00 0.00 179.25 180.73 3kt7 h GLU 334 N 1.14 0.96 -0.48 0.00 5.08 -1.73 -1.32 114.58 118.22 3kt7 h GLU 334 Ca 0.26 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 3kt7 h GLU 334 Cb 0.23 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3kt7 h GLU 334 CO -0.02 1.01 0.07 0.74 -1.00 0.00 0.00 179.01 179.82 3kt7 h PHE 335 N 0.83 0.77 -0.66 4.33 0.04 -1.03 -1.24 116.94 119.98 3kt7 h PHE 335 Ca 0.14 -0.08 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 3kt7 h PHE 335 Cb 0.63 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.53 3kt7 h PHE 335 CO 0.05 0.68 0.32 1.15 -0.60 0.00 0.00 178.31 179.91 3kt7 h THR 336 N 0.71 1.22 -0.07 -1.55 2.02 -0.85 -0.84 112.91 113.56 3kt7 h THR 336 Ca 0.15 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 3kt7 h THR 336 Cb 0.33 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.16 3kt7 h THR 336 CO 0.01 0.26 0.03 0.22 0.37 0.00 0.00 175.52 176.41 3kt7 h TYR 337 N 0.91 0.11 -0.31 3.16 3.20 -0.90 -2.70 116.97 120.45 3kt7 h TYR 337 Ca 0.23 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.11 3kt7 h TYR 337 Cb 0.12 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 3kt7 h TYR 337 CO 0.00 0.22 0.21 -0.07 -1.64 0.00 0.00 178.16 176.88 3kt7 h LEU 338 N -0.03 0.31 -0.98 2.82 3.38 -1.08 -1.82 115.31 117.91 3kt7 h LEU 338 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3kt7 h LEU 338 Cb 0.16 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3kt7 h LEU 338 CO -0.00 0.22 0.00 0.28 0.09 0.00 0.00 178.44 179.03 3kt7 h SER 339 N 0.36 0.00 0.37 -0.43 0.02 -0.81 -0.46 113.55 112.60 3kt7 h SER 339 Ca 0.12 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 3kt7 h SER 339 Cb 0.04 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 3kt7 h SER 339 CO -0.03 0.00 -0.13 1.56 -1.14 0.00 0.00 176.83 177.10 3kt7 h GLN 340 N 0.00 0.00 0.00 3.45 4.20 -1.26 -3.37 115.11 118.13 3kt7 h GLN 340 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3kt7 h GLN 340 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3kt7 h GLN 340 CO 0.00 0.13 -0.82 0.66 -0.67 0.00 0.00 178.83 178.13 3kt7 n TYR 341 N -3.68 0.00 -3.50 2.96 4.01 -0.89 -4.81 117.16 111.26 3kt7 n TYR 341 Ca -0.02 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.34 3kt7 n TYR 341 Cb 0.24 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.21 3kt7 n TYR 341 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3kt7 s ILE 342 N -1.82 5.02 0.37 -0.72 1.01 -0.23 0.05 121.20 124.88 3kt7 s ILE 342 Ca 0.00 0.85 -0.28 0.00 0.00 0.00 0.00 60.65 61.22 3kt7 s ILE 342 Cb 0.00 -3.72 -0.11 0.00 0.01 0.00 0.00 42.46 38.64 3kt7 s ILE 342 CO 0.00 0.58 1.48 -0.24 0.00 0.00 0.00 174.94 176.75 3kt7 n SER 343 N 1.81 3.69 -0.12 3.58 2.88 -0.33 -4.31 113.62 120.83 3kt7 n SER 343 Ca -0.14 1.22 0.21 0.00 -1.33 0.00 0.00 58.87 58.83 3kt7 n SER 343 Cb 0.52 -1.61 0.63 0.00 -0.75 0.00 0.00 64.21 63.01 3kt7 n SER 343 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3kt7 h PRO 344 N 3.04 0.15 -0.91 -1.46 0.11 -1.94 -1.56 132.00 129.44 3kt7 h PRO 344 Ca -0.50 -0.01 0.16 0.00 0.11 0.00 0.00 66.00 65.76 3kt7 h PRO 344 Cb 1.25 -0.03 -0.10 0.00 0.11 0.00 0.00 31.00 32.22 3kt7 h PRO 344 CO 0.65 0.10 0.50 1.49 -0.21 0.00 0.00 178.00 180.53 3kt7 h GLU 345 N 0.16 0.67 -0.13 1.05 4.81 -1.95 -1.72 114.58 117.47 3kt7 h GLU 345 Ca 0.35 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 3kt7 h GLU 345 Cb 1.17 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.40 3kt7 h GLU 345 CO -0.06 0.44 0.00 0.72 -0.73 0.00 0.00 179.01 179.39 3kt7 n HIS 346 N -4.82 0.16 0.14 0.92 -0.00 -0.59 -3.73 115.22 107.30 3kt7 n HIS 346 Ca 0.19 -0.08 0.02 0.00 -0.00 0.00 0.00 57.72 57.85 3kt7 n HIS 346 Cb 0.47 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.45 3kt7 n HIS 346 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3kt7 n LEU 347 N 0.37 0.58 -4.81 2.41 4.77 -0.69 -4.47 117.00 115.15 3kt7 n LEU 347 Ca 0.17 -0.69 -0.32 0.00 -0.03 0.00 0.00 56.01 55.14 3kt7 n LEU 347 Cb 0.36 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.48 3kt7 n LEU 347 CO 0.14 0.13 0.71 -0.94 -1.33 0.00 0.00 177.39 176.10 3kt7 s SER 348 N -0.90 5.56 0.20 -1.43 1.04 -0.93 -4.84 113.70 112.40 3kt7 s SER 348 Ca 0.02 1.69 -0.11 0.00 0.48 0.00 0.00 55.95 58.03 3kt7 s SER 348 Cb 0.02 -2.51 0.23 0.00 0.10 0.00 0.00 66.02 63.86 3kt7 s SER 348 CO 0.09 -1.32 1.76 0.77 0.98 0.00 0.00 173.24 175.52 3kt7 h SER 349 N -0.25 0.26 1.07 7.02 4.64 -1.93 -0.06 113.55 124.31 3kt7 h SER 349 Ca -0.45 0.06 -0.18 0.00 -0.47 0.00 0.00 61.79 60.75 3kt7 h SER 349 Cb 1.21 0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 63.30 3kt7 h SER 349 CO 0.57 0.17 -0.96 0.11 -0.87 0.00 0.00 176.83 175.85 3kt7 h LYS 350 N 0.43 0.00 -0.31 4.77 1.79 -1.93 -1.98 116.57 119.35 3kt7 h LYS 350 Ca 0.28 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.74 3kt7 h LYS 350 Cb 0.30 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 3kt7 h LYS 350 CO -0.26 0.74 0.14 0.78 -1.08 0.00 0.00 179.45 179.78 3kt7 h GLY 351 N 3.26 0.48 0.94 3.86 0.00 -1.68 -1.88 103.07 108.05 3kt7 h GLY 351 Ca -0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 3kt7 h GLY 351 CO 0.10 0.23 0.15 -2.22 0.00 0.00 0.00 176.54 174.79 3kt7 h ILE 352 N 0.36 1.21 -0.92 2.60 2.04 -1.01 -2.43 117.51 119.36 3kt7 h ILE 352 Ca 0.10 -0.67 0.06 0.00 1.00 0.00 0.00 64.86 65.35 3kt7 h ILE 352 Cb 0.13 0.87 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 3kt7 h ILE 352 CO -0.01 0.24 0.59 -0.33 0.00 0.00 0.00 178.15 178.63 3kt7 h GLU 353 N 0.52 1.05 -0.29 2.37 5.08 -1.26 -0.06 114.58 122.00 3kt7 h GLU 353 Ca 0.14 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 3kt7 h GLU 353 Cb 0.23 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3kt7 h GLU 353 CO -0.01 0.70 0.09 -0.22 -1.00 0.00 0.00 179.01 178.57 3kt7 h LYS 354 N 1.09 0.45 -0.64 2.33 3.64 -1.20 -1.91 116.57 120.34 3kt7 h LYS 354 Ca 0.39 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.65 3kt7 h LYS 354 Cb 0.12 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 3kt7 h LYS 354 CO -0.16 0.51 0.34 -0.07 -2.27 0.00 0.00 179.45 177.80 3kt7 h LEU 355 N 0.31 0.81 -0.62 5.20 3.38 -0.94 -0.52 115.31 122.92 3kt7 h LEU 355 Ca 0.09 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 57.99 3kt7 h LEU 355 Cb 0.25 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3kt7 h LEU 355 CO -0.00 0.69 0.37 1.56 0.09 0.00 0.00 178.44 181.14 3kt7 h GLN 356 N 0.87 0.69 -0.48 1.13 4.20 -0.92 -0.82 115.11 119.79 3kt7 h GLN 356 Ca 0.22 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.84 3kt7 h GLN 356 Cb 0.07 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 3kt7 h GLN 356 CO -0.03 0.46 0.11 -0.22 -0.67 0.00 0.00 178.83 178.48 3kt7 h LYS 357 N 0.71 0.78 -0.64 1.46 3.64 -0.97 -1.76 116.57 119.79 3kt7 h LYS 357 Ca 0.26 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 3kt7 h LYS 357 Cb 0.08 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3kt7 h LYS 357 CO -0.13 0.76 0.35 1.96 -2.27 0.00 0.00 179.45 180.12 3kt7 h GLN 358 N 0.66 0.89 -0.60 1.90 4.20 -0.80 -1.65 115.11 119.70 3kt7 h GLN 358 Ca 0.15 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 3kt7 h GLN 358 Cb 0.34 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 3kt7 h GLN 358 CO 0.00 0.67 0.02 0.35 -0.67 0.00 0.00 178.83 179.20 3kt7 h PHE 359 N 0.87 1.13 -0.56 2.96 3.57 -1.01 -0.12 116.94 123.78 3kt7 h PHE 359 Ca 0.22 -0.19 0.03 0.00 3.53 0.00 0.00 57.97 61.56 3kt7 h PHE 359 Cb 0.04 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.44 3kt7 h PHE 359 CO -0.01 1.00 0.33 0.28 -2.23 0.00 0.00 178.31 177.68 3kt7 h VAL 360 N 0.94 1.04 0.00 1.41 2.07 -1.12 0.19 116.25 120.79 3kt7 h VAL 360 Ca 0.17 -0.22 -0.23 0.00 0.82 0.00 0.00 66.70 67.24 3kt7 h VAL 360 Cb 0.53 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3kt7 h VAL 360 CO 0.03 0.12 -0.95 -0.33 0.02 0.00 0.00 177.57 176.45 3kt7 h GLU 361 N 0.65 0.41 0.00 1.57 5.08 -1.02 -3.38 114.58 117.89 3kt7 h GLU 361 Ca 0.23 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 3kt7 h GLU 361 Cb 0.05 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3kt7 h GLU 361 CO -0.11 1.11 -1.13 0.09 -1.00 0.00 0.00 179.01 177.97 3kt7 n ASN 362 N -3.74 2.36 -2.31 1.42 3.02 -0.08 -4.99 115.26 110.93 3kt7 n ASN 362 Ca -0.07 -0.18 -0.19 0.00 -0.03 0.00 0.00 54.58 54.11 3kt7 n ASN 362 Cb 0.84 1.29 -0.02 0.00 -0.61 0.00 0.00 39.78 41.28 3kt7 n ASN 362 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3kt7 n SER 363 N -1.64 -5.37 -3.45 6.41 7.64 0.68 -4.96 113.62 112.92 3kt7 n SER 363 Ca -0.01 0.08 -0.13 0.00 1.01 0.00 0.00 58.87 59.83 3kt7 n SER 363 Cb 0.20 -4.52 -0.03 0.00 -1.01 0.00 0.00 64.21 58.85 3kt7 n SER 363 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3kt7 s SER 364 N -2.11 -0.55 0.02 6.43 1.04 -1.26 -1.41 113.70 115.87 3kt7 s SER 364 Ca 0.00 0.07 0.04 0.00 0.48 0.00 0.00 55.95 56.54 3kt7 s SER 364 Cb 0.00 0.58 -0.02 0.00 0.10 0.00 0.00 66.02 66.68 3kt7 s SER 364 CO 0.00 -0.91 -0.12 -0.76 0.98 0.00 0.00 173.24 172.44 3kt7 s LEU 365 N -2.53 2.13 -0.34 2.42 1.43 0.71 -4.01 118.68 118.48 3kt7 s LEU 365 Ca -0.01 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 3kt7 s LEU 365 Cb -0.01 -0.51 0.11 0.00 0.03 0.00 0.00 46.19 45.82 3kt7 s LEU 365 CO -0.10 0.03 0.13 -1.10 0.23 0.00 0.00 176.35 175.54 3kt7 s GLN 366 N -0.86 0.91 -0.19 1.70 -0.21 -1.26 -0.75 119.66 119.01 3kt7 s GLN 366 Ca 0.01 -1.37 -0.10 0.00 0.02 0.00 0.00 55.36 53.91 3kt7 s GLN 366 Cb -0.07 -2.17 -0.05 0.00 1.00 0.00 0.00 33.01 31.72 3kt7 s GLN 366 CO 0.01 -1.03 0.15 0.42 -2.12 0.00 0.00 175.29 172.72 3kt7 s ILE 367 N 1.25 5.40 0.16 1.08 1.01 0.76 -4.96 121.20 125.90 3kt7 s ILE 367 Ca 0.12 0.23 0.01 0.00 0.00 0.00 0.00 60.65 61.01 3kt7 s ILE 367 Cb -0.19 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 3kt7 s ILE 367 CO -0.17 0.44 0.32 -1.61 0.00 0.00 0.00 174.94 173.91 3kt7 s GLU 368 N 0.36 3.48 -1.27 2.79 2.02 -1.26 -0.39 118.70 124.42 3kt7 s GLU 368 Ca 0.09 -0.46 -0.21 0.00 0.02 0.00 0.00 54.97 54.41 3kt7 s GLU 368 Cb -0.11 -2.92 0.02 0.00 0.10 0.00 0.00 34.13 31.21 3kt7 s GLU 368 CO -0.01 0.49 0.58 0.43 0.02 0.00 0.00 175.26 176.76 3kt7 n SER 369 N -0.46 -3.19 0.18 -0.19 7.64 -0.55 -4.90 113.62 112.14 3kt7 n SER 369 Ca -0.06 -1.17 -0.13 0.00 1.01 0.00 0.00 58.87 58.52 3kt7 n SER 369 Cb 0.53 -2.38 -0.08 0.00 -1.01 0.00 0.00 64.21 61.27 3kt7 n SER 369 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 3kt7 h PHE 370 N -2.18 -0.44 -4.07 1.43 3.57 -1.50 -3.43 116.94 110.32 3kt7 h PHE 370 Ca -0.68 -0.01 -0.46 0.00 3.53 0.00 0.00 57.97 60.35 3kt7 h PHE 370 Cb 1.39 0.15 0.01 0.00 2.79 0.00 0.00 35.95 40.29 3kt7 h PHE 370 CO 0.40 -0.12 0.38 -0.51 -2.23 0.00 0.00 178.31 176.23 3kt7 s LEU 371 N -9.54 3.87 1.10 0.59 1.43 -1.26 -1.19 118.68 113.69 3kt7 s LEU 371 Ca -0.14 1.88 -0.13 0.00 -1.03 0.00 0.00 54.13 54.70 3kt7 s LEU 371 Cb 0.02 -4.55 0.24 0.00 0.03 0.00 0.00 46.19 41.94 3kt7 s LEU 371 CO 0.53 -0.68 1.06 0.54 0.23 0.00 0.00 176.35 178.04 3kt7 s ASN 372 N -2.02 1.67 0.21 2.29 6.03 0.11 -4.28 114.94 118.94 3kt7 s ASN 372 Ca 0.66 1.24 -0.10 0.00 -1.03 0.00 0.00 52.86 53.63 3kt7 s ASN 372 Cb -0.15 -1.94 0.18 0.00 -3.03 0.00 0.00 41.25 36.32 3kt7 s ASN 372 CO 0.18 -3.73 1.86 0.44 -2.03 0.00 0.00 177.10 173.82 3kt7 h ASP 373 N -2.31 0.78 -0.05 3.54 3.32 -1.94 -0.42 116.42 119.35 3kt7 h ASP 373 Ca -0.57 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 56.48 3kt7 h ASP 373 Cb 1.34 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 3kt7 h ASP 373 CO 0.53 0.55 -0.01 -0.78 -1.72 0.00 0.00 179.24 177.82 3kt7 h ASP 374 N 0.93 -0.04 0.14 6.45 3.58 -1.95 -0.79 116.42 124.74 3kt7 h ASP 374 Ca 0.28 0.01 -0.24 0.00 0.42 0.00 0.00 57.03 57.51 3kt7 h ASP 374 Cb -0.03 0.03 0.01 0.00 1.72 0.00 0.00 39.33 41.06 3kt7 h ASP 374 CO -0.09 -0.01 -0.95 0.11 -2.88 0.00 0.00 179.24 175.41 3kt7 h LYS 375 N 0.00 0.58 -0.43 0.28 1.79 -1.85 -2.01 116.57 114.93 3kt7 h LYS 375 Ca 0.02 -0.59 0.04 0.00 -2.18 0.00 0.00 60.65 57.94 3kt7 h LYS 375 Cb 0.04 0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 30.81 3kt7 h LYS 375 CO -0.05 1.21 0.20 1.03 -1.08 0.00 0.00 179.45 180.76 3kt7 h SER 376 N 0.34 0.28 -0.51 0.86 0.87 -1.03 -0.62 113.55 113.75 3kt7 h SER 376 Ca -0.09 0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.43 3kt7 h SER 376 Cb 1.59 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.51 3kt7 h SER 376 CO 0.18 0.20 0.08 -0.33 -0.53 0.00 0.00 176.83 176.43 3kt7 h GLU 377 N 0.41 0.85 0.13 2.24 5.08 -1.10 -0.94 114.58 121.25 3kt7 h GLU 377 Ca 0.19 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3kt7 h GLU 377 Cb 0.12 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3kt7 h GLU 377 CO -0.15 0.84 -0.06 1.25 -1.00 0.00 0.00 179.01 179.89 3kt7 h LEU 378 N 0.73 -0.15 -0.79 1.33 5.85 -1.16 -1.79 115.31 119.32 3kt7 h LEU 378 Ca 0.15 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 3kt7 h LEU 378 Cb 0.41 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 3kt7 h LEU 378 CO 0.01 -0.07 0.15 -0.07 -0.34 0.00 0.00 178.44 178.12 3kt7 h LEU 379 N -0.22 1.00 -0.46 2.25 3.38 -1.08 -2.24 115.31 117.95 3kt7 h LEU 379 Ca -0.02 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 3kt7 h LEU 379 Cb 0.17 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3kt7 h LEU 379 CO 0.03 0.97 0.14 0.50 0.09 0.00 0.00 178.44 180.17 3kt7 h LYS 380 N 1.00 0.72 -0.14 1.13 3.64 -1.08 -1.25 116.57 120.60 3kt7 h LYS 380 Ca 0.21 -0.16 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3kt7 h LYS 380 Cb 0.37 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3kt7 h LYS 380 CO 0.00 0.69 0.03 -0.22 -2.27 0.00 0.00 179.45 177.68 3kt7 h LYS 381 N 0.61 0.08 -0.10 1.90 3.64 -1.11 -0.98 116.57 120.61 3kt7 h LYS 381 Ca 0.15 -0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.32 3kt7 h LYS 381 Cb 0.28 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 3kt7 h LYS 381 CO -0.00 0.05 -0.76 -0.39 -2.27 0.00 0.00 179.45 176.08 3kt7 h VAL 382 N 0.08 1.34 -0.23 2.00 -1.51 -1.30 -1.52 116.25 115.11 3kt7 h VAL 382 Ca 0.06 -2.08 -0.06 0.00 -1.23 0.00 0.00 66.70 63.39 3kt7 h VAL 382 Cb 0.05 2.07 -0.01 0.00 -2.13 0.00 0.00 31.29 31.28 3kt7 h VAL 382 CO -0.08 0.64 -0.08 0.40 -1.23 0.00 0.00 177.57 177.22 3kt7 h ILE 383 N 0.38 1.29 -0.77 7.19 2.04 -1.21 -1.91 117.51 124.51 3kt7 h ILE 383 Ca -0.04 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.70 3kt7 h ILE 383 Cb 1.35 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 38.93 3kt7 h ILE 383 CO 0.14 0.34 0.45 0.11 0.00 0.00 0.00 178.15 179.19 3kt7 h LYS 384 N 0.19 1.06 -0.63 2.37 1.57 -1.17 -0.58 116.57 119.39 3kt7 h LYS 384 Ca 0.06 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3kt7 h LYS 384 Cb 0.55 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 3kt7 h LYS 384 CO 0.03 0.76 0.42 0.37 -0.57 0.00 0.00 179.45 180.45 3kt7 h GLN 385 N 1.06 0.83 -0.54 3.15 -0.00 -1.21 -0.28 115.11 118.12 3kt7 h GLN 385 Ca 0.27 -0.05 -0.08 0.00 -0.00 0.00 0.00 58.65 58.80 3kt7 h GLN 385 Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 27.48 27.26 3kt7 h GLN 385 CO -0.05 0.55 0.04 -0.22 0.00 0.00 0.00 178.83 179.15 3kt7 h LYS 386 N 0.86 0.92 -0.69 1.69 3.64 -0.96 -0.52 116.57 121.50 3kt7 h LYS 386 Ca 0.23 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 3kt7 h LYS 386 Cb -0.10 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 3kt7 h LYS 386 CO -0.05 0.92 0.32 0.93 -2.27 0.00 0.00 179.45 179.31 3kt7 h GLU 387 N 0.80 1.00 0.00 1.90 4.39 -0.73 -2.37 114.58 119.58 3kt7 h GLU 387 Ca 0.16 -0.15 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 3kt7 h GLU 387 Cb 0.48 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 3kt7 h GLU 387 CO 0.02 0.80 -1.46 1.28 -1.16 0.00 0.00 179.01 178.49 3kt7 n LEU 388 N -4.43 0.66 -0.00 1.33 4.77 -0.15 -4.50 117.00 114.68 3kt7 n LEU 388 Ca 0.05 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 3kt7 n LEU 388 Cb 0.14 0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3kt7 n LEU 388 CO 0.39 0.05 0.01 -0.62 -1.33 0.00 0.00 177.39 175.89 3kt7 n GLU 389 N -2.72 6.39 -4.43 3.23 1.02 -0.21 -5.05 120.64 118.86 3kt7 n GLU 389 Ca -0.08 -0.03 -0.25 0.00 -0.02 0.00 0.00 57.16 56.79 3kt7 n GLU 389 Cb 0.74 -0.56 -0.10 0.00 -0.02 0.00 0.00 31.44 31.50 3kt7 n GLU 389 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3kt7 s GLN 390 N -1.03 1.72 -0.14 3.49 -0.21 -0.89 -4.55 119.66 118.04 3kt7 s GLN 390 Ca 0.00 -1.63 -0.15 0.00 0.02 0.00 0.00 55.36 53.60 3kt7 s GLN 390 Cb 0.01 -1.86 -0.05 0.00 1.00 0.00 0.00 33.01 32.11 3kt7 s GLN 390 CO 0.03 0.36 0.34 -1.21 -2.12 0.00 0.00 175.29 172.69 3kt7 s GLU 391 N -3.24 4.25 -0.02 2.91 0.41 -1.26 -4.78 118.70 116.96 3kt7 s GLU 391 Ca 0.27 0.19 -0.17 0.00 -0.41 0.00 0.00 54.97 54.85 3kt7 s GLU 391 Cb -0.06 -3.42 -0.05 0.00 -1.78 0.00 0.00 34.13 28.82 3kt7 s GLU 391 CO 0.14 0.25 0.46 0.00 -0.49 0.00 0.00 175.26 175.62 3kt7 s PRO 393 N -0.52 4.36 -0.13 0.00 0.04 -1.26 -4.92 135.00 132.57 3kt7 s PRO 393 Ca 0.25 2.13 0.15 0.00 0.04 0.00 0.00 61.00 63.58 3kt7 s PRO 393 Cb -0.17 -3.16 0.29 0.00 0.04 0.00 0.00 34.50 31.51 3kt7 s PRO 393 CO 0.13 -0.27 1.15 0.66 0.04 0.00 0.00 177.00 178.71 3kt7 n TYR 394 N 2.25 0.00 -3.73 0.56 4.02 -1.26 -4.96 117.16 114.04 3kt7 n TYR 394 Ca 0.05 -0.97 -0.13 0.00 -0.01 0.00 0.00 57.90 56.84 3kt7 n TYR 394 Cb 0.42 -0.16 -0.10 0.00 -0.02 0.00 0.00 39.34 39.48 3kt7 n TYR 394 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 3kt7 s HIS 395 N -2.52 -0.44 0.53 -0.72 2.46 -1.26 -5.05 115.29 108.28 3kt7 s HIS 395 Ca 0.30 1.06 0.18 0.00 0.47 0.00 0.00 55.06 57.07 3kt7 s HIS 395 Cb 0.27 0.15 1.32 0.00 -0.13 0.00 0.00 32.58 34.19 3kt7 s HIS 395 CO -0.00 -0.23 2.12 0.66 -2.47 0.00 0.00 174.74 174.82 3kt7 h SER 396 N 5.39 0.00 0.52 9.88 4.64 -1.96 -0.63 113.55 131.39 3kt7 h SER 396 Ca -0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3kt7 h SER 396 Cb 1.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3kt7 h SER 396 CO 0.26 0.00 -0.05 0.07 -0.87 0.00 0.00 176.83 176.24 3kt7 h LYS 397 N 0.00 0.00 -0.01 4.77 2.10 -1.97 -2.95 116.57 118.52 3kt7 h LYS 397 Ca 0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 3kt7 h LYS 397 Cb 0.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 3kt7 h LYS 397 CO -0.00 0.05 -0.44 -0.25 -2.00 0.00 0.00 179.45 176.81 3kt7 n ASP 398 N -3.28 1.65 -4.70 7.07 8.00 -0.25 -4.91 116.55 120.14 3kt7 n ASP 398 Ca -0.01 -1.28 -0.42 0.00 0.71 0.00 0.00 54.79 53.78 3kt7 n ASP 398 Cb 0.22 0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 41.69 3kt7 n ASP 398 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3kt7 s VAL 399 N -2.52 4.42 0.34 2.53 1.01 -1.12 -4.81 120.40 120.26 3kt7 s VAL 399 Ca 0.20 1.73 0.09 0.00 0.00 0.00 0.00 61.98 64.00 3kt7 s VAL 399 Cb 0.18 -4.11 -0.06 0.00 0.00 0.00 0.00 36.38 32.39 3kt7 s VAL 399 CO 0.57 0.09 -0.09 -0.54 0.00 0.00 0.00 175.10 175.13 3kt7 s LYS 400 N 1.43 1.84 0.28 2.72 1.02 -1.26 -4.98 119.74 120.79 3kt7 s LYS 400 Ca 0.55 -1.92 -0.28 0.00 0.02 0.00 0.00 55.97 54.33 3kt7 s LYS 400 Cb -0.25 -1.72 -0.14 0.00 -0.52 0.00 0.00 37.83 35.20 3kt7 s LYS 400 CO 0.26 0.14 0.99 0.00 -0.92 0.00 0.00 175.35 175.82 3kt7 n ALA 401 N -0.81 -0.41 0.33 5.17 0.00 -1.26 -0.99 120.51 122.54 3kt7 n ALA 401 Ca -0.05 0.40 0.05 0.00 0.00 0.00 0.00 53.44 53.84 3kt7 n ALA 401 Cb 0.63 -2.00 0.20 0.00 0.00 0.00 0.00 19.45 18.29 3kt7 n ALA 401 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3kt7 n PRO 402 N 0.80 2.55 -3.41 0.00 -0.04 -1.26 -5.05 135.00 128.58 3kt7 n PRO 402 Ca 0.10 -1.61 -0.32 0.00 -0.04 0.00 0.00 63.50 61.63 3kt7 n PRO 402 Cb 0.31 -1.61 -0.05 0.00 -0.04 0.00 0.00 33.50 32.10 3kt7 n PRO 402 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3kt7 s TRP 403 N -1.71 3.43 0.21 0.54 0.52 -0.16 -4.47 118.94 117.30 3kt7 s TRP 403 Ca 0.29 0.86 0.06 0.00 0.02 0.00 0.00 56.10 57.33 3kt7 s TRP 403 Cb 0.19 -2.25 -0.05 0.00 -1.15 0.00 0.00 33.47 30.20 3kt7 s TRP 403 CO 0.14 0.27 -0.09 0.15 0.02 0.00 0.00 176.95 177.44 3kt7 s LYS 404 N -2.84 1.32 -0.21 4.98 1.02 0.15 -4.51 119.74 119.65 3kt7 s LYS 404 Ca 0.47 -1.62 -0.06 0.00 0.02 0.00 0.00 55.97 54.78 3kt7 s LYS 404 Cb -0.11 -0.92 -0.03 0.00 -0.52 0.00 0.00 37.83 36.25 3kt7 s LYS 404 CO 0.22 0.07 0.02 0.99 -0.92 0.00 0.00 175.35 175.73 3kt7 s THR 405 N -3.15 4.15 0.28 2.17 2.01 -1.26 -1.10 115.64 118.75 3kt7 s THR 405 Ca 0.24 -0.24 -0.30 0.00 0.31 0.00 0.00 61.69 61.70 3kt7 s THR 405 Cb 0.02 -2.89 -0.10 0.00 0.01 0.00 0.00 72.50 69.54 3kt7 s THR 405 CO 0.07 0.41 1.43 0.00 -0.69 0.00 0.00 174.62 175.85 3kt7 s ALA 406 N 1.05 3.61 0.06 7.40 0.00 0.21 -4.85 121.76 129.24 3kt7 s ALA 406 Ca 0.03 1.37 -0.05 0.00 0.00 0.00 0.00 51.96 53.30 3kt7 s ALA 406 Cb -0.14 -3.56 -0.02 0.00 0.00 0.00 0.00 23.12 19.40 3kt7 s ALA 406 CO 0.02 -0.78 0.09 0.96 0.00 0.00 0.00 175.76 176.05 3kt7 s ILE 407 N -0.35 0.16 0.49 0.00 -4.36 -0.38 -4.18 121.20 112.58 3kt7 s ILE 407 Ca 0.57 -1.35 -0.04 0.00 -0.26 0.00 0.00 60.65 59.57 3kt7 s ILE 407 Cb -0.43 -1.24 -0.02 0.00 1.25 0.00 0.00 42.46 42.02 3kt7 s ILE 407 CO 0.48 -0.75 0.77 -2.16 0.24 0.00 0.00 174.94 173.52 3kt7 s PRO 408 N -3.45 3.31 0.00 0.37 0.04 -1.26 -1.25 135.00 132.76 3kt7 s PRO 408 Ca 0.02 -0.02 0.20 0.00 0.04 0.00 0.00 61.00 61.25 3kt7 s PRO 408 Cb 0.04 -2.41 0.97 0.00 0.04 0.00 0.00 34.50 33.14 3kt7 s PRO 408 CO -0.08 -0.30 1.65 -0.35 0.04 0.00 0.00 177.00 177.96 3kt7 n PRO 409 N -2.26 0.18 -0.05 0.56 -0.04 -1.24 -1.08 135.00 131.07 3kt7 n PRO 409 Ca 0.01 0.12 0.10 0.00 -0.04 0.00 0.00 63.50 63.68 3kt7 n PRO 409 Cb 0.56 -1.50 0.43 0.00 -0.04 0.00 0.00 33.50 32.95 3kt7 n PRO 409 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 3kt7 n HIS 410 N -1.37 0.13 0.00 0.54 1.44 -1.26 -4.22 115.22 110.49 3kt7 n HIS 410 Ca 0.08 -0.07 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 3kt7 n HIS 410 Cb 0.19 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.30 3kt7 n HIS 410 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3kt7 n LYS 411 N -0.10 0.00 -3.51 -1.40 5.02 -0.25 -4.97 118.16 112.96 3kt7 n LYS 411 Ca 0.15 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.36 3kt7 n LYS 411 Cb 0.23 -0.74 -0.02 0.00 -0.02 0.00 0.00 35.03 34.48 3kt7 n LYS 411 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kt7 s ALA 412 N -1.95 -1.83 -0.20 7.82 0.00 -0.58 -3.03 121.76 121.99 3kt7 s ALA 412 Ca 0.00 1.04 -0.10 0.00 0.00 0.00 0.00 51.96 52.90 3kt7 s ALA 412 Cb 0.00 0.39 0.08 0.00 0.00 0.00 0.00 23.12 23.58 3kt7 s ALA 412 CO 0.00 -0.68 0.47 0.50 0.00 0.00 0.00 175.76 176.05 3kt7 s ARG 413 N -3.07 0.43 -0.01 0.00 3.52 -0.61 -3.65 118.95 115.57 3kt7 s ARG 413 Ca 0.05 0.97 -0.30 0.00 -0.13 0.00 0.00 55.73 56.32 3kt7 s ARG 413 Cb -0.01 0.16 0.11 0.00 -1.56 0.00 0.00 34.95 33.64 3kt7 s ARG 413 CO -0.09 -0.19 1.13 1.52 -0.81 0.00 0.00 175.30 176.86 3kt7 s TYR 414 N 1.87 -0.13 -0.02 5.12 -0.85 -1.26 -0.34 117.35 121.74 3kt7 s TYR 414 Ca -0.07 -0.02 -0.06 0.00 -0.52 0.00 0.00 57.07 56.40 3kt7 s TYR 414 Cb -0.09 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 42.77 3kt7 s TYR 414 CO -0.14 -0.44 0.23 -0.51 -1.52 0.00 0.00 175.55 173.16 3kt7 s LEU 415 N -2.73 4.38 0.00 -3.49 1.43 -0.50 -0.62 118.68 117.14 3kt7 s LEU 415 Ca 0.11 0.51 -0.11 0.00 -1.03 0.00 0.00 54.13 53.61 3kt7 s LEU 415 Cb 0.01 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.70 3kt7 s LEU 415 CO -0.03 0.29 0.23 -0.72 0.23 0.00 0.00 176.35 176.34 3kt7 s TYR 416 N -1.24 -0.06 -0.25 0.29 1.13 -0.25 -0.78 117.35 116.19 3kt7 s TYR 416 Ca 0.25 0.02 -0.06 0.00 -1.41 0.00 0.00 57.07 55.87 3kt7 s TYR 416 Cb -0.13 0.02 -0.01 0.00 -1.10 0.00 0.00 41.96 40.74 3kt7 s TYR 416 CO 0.14 -0.36 0.03 0.42 -2.51 0.00 0.00 175.55 173.27 3kt7 s ILE 417 N -1.57 3.87 -0.86 -3.49 1.01 0.38 -0.68 121.20 119.87 3kt7 s ILE 417 Ca -0.13 -0.41 0.09 0.00 0.00 0.00 0.00 60.65 60.21 3kt7 s ILE 417 Cb -0.05 -2.83 0.01 0.00 0.01 0.00 0.00 42.46 39.60 3kt7 s ILE 417 CO 0.02 0.32 0.62 -0.90 0.00 0.00 0.00 174.94 175.00 3kt7 n ASP 418 N 4.86 1.25 0.00 3.58 3.85 -1.26 -1.51 116.55 127.32 3kt7 n ASP 418 Ca -0.17 -1.12 0.00 0.00 -0.71 0.00 0.00 54.79 52.79 3kt7 n ASP 418 Cb 0.50 0.37 0.00 0.00 -1.35 0.00 0.00 41.12 40.65 3kt7 n ASP 418 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3kt7 n GLY 419 N 0.77 0.62 3.95 6.12 0.00 -1.26 -4.55 105.19 110.85 3kt7 n GLY 419 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 3kt7 n GLY 419 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kt7 s LYS 420 N -0.25 2.40 0.67 1.61 1.02 -1.26 -0.56 119.74 123.37 3kt7 s LYS 420 Ca 0.00 -0.54 -0.17 0.00 0.02 0.00 0.00 55.97 55.28 3kt7 s LYS 420 Cb 0.00 -2.34 0.00 0.00 -0.52 0.00 0.00 37.83 34.97 3kt7 s LYS 420 CO 0.00 -0.94 1.28 -1.83 -0.92 0.00 0.00 175.35 172.93 3kt7 s GLU 421 N -4.98 2.43 0.29 1.68 -1.05 -1.26 -4.88 118.70 110.94 3kt7 s GLU 421 Ca 0.58 2.01 -0.30 0.00 -0.15 0.00 0.00 54.97 57.12 3kt7 s GLU 421 Cb -0.11 -1.84 -0.12 0.00 -0.44 0.00 0.00 34.13 31.62 3kt7 s GLU 421 CO 0.41 -1.67 1.44 0.98 0.95 0.00 0.00 175.26 177.37 3kt7 n TYR 422 N -2.10 2.45 -4.16 4.83 4.19 -1.26 -5.02 117.16 116.09 3kt7 n TYR 422 Ca 0.15 0.41 -0.16 0.00 3.31 0.00 0.00 57.90 61.61 3kt7 n TYR 422 Cb 0.48 -2.50 -0.15 0.00 0.49 0.00 0.00 39.34 37.67 3kt7 n TYR 422 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 3kt7 s ARG 423 N -0.87 0.45 -0.22 2.98 1.81 -1.26 -5.12 118.95 116.72 3kt7 s ARG 423 Ca 0.63 -0.18 -0.04 0.00 -1.72 0.00 0.00 55.73 54.42 3kt7 s ARG 423 Cb -0.57 -0.44 0.08 0.00 -0.45 0.00 0.00 34.95 33.56 3kt7 s ARG 423 CO 0.53 0.10 0.12 1.21 -0.68 0.00 0.00 175.30 176.58 3kt7 s ASN 424 N -0.05 2.75 -0.62 0.23 3.84 -1.26 -4.72 114.94 115.11 3kt7 s ASN 424 Ca 0.01 -0.86 -0.20 0.00 0.21 0.00 0.00 52.86 52.02 3kt7 s ASN 424 Cb -0.03 -0.23 0.09 0.00 -0.55 0.00 0.00 41.25 40.54 3kt7 s ASN 424 CO -0.00 -0.39 0.80 -0.36 -2.79 0.00 0.00 177.10 174.36 3kt7 s PHE 425 N 2.14 2.89 -0.04 0.43 0.08 -1.26 -4.79 117.98 117.43 3kt7 s PHE 425 Ca 0.05 -0.83 0.06 0.00 0.12 0.00 0.00 56.93 56.33 3kt7 s PHE 425 Cb -0.16 -4.11 -0.09 0.00 -0.57 0.00 0.00 43.02 38.09 3kt7 s PHE 425 CO -0.21 -1.42 0.14 1.04 -0.10 0.00 0.00 175.22 174.67 3kt7 n GLN 426 N 6.80 0.85 -4.22 0.44 1.13 -1.26 -4.95 117.38 116.16 3kt7 n GLN 426 Ca -0.07 -0.05 -0.12 0.00 -1.94 0.00 0.00 57.00 54.82 3kt7 n GLN 426 Cb 0.43 -1.09 -0.10 0.00 0.11 0.00 0.00 30.24 29.60 3kt7 n GLN 426 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3kt7 s THR 427 N -2.28 0.57 0.24 5.09 -4.23 -1.26 -4.98 115.64 108.78 3kt7 s THR 427 Ca -0.02 -1.96 -0.05 0.00 -1.18 0.00 0.00 61.69 58.49 3kt7 s THR 427 Cb 0.04 -2.07 0.21 0.00 1.34 0.00 0.00 72.50 72.02 3kt7 s THR 427 CO 0.24 -0.51 1.80 -0.08 -0.54 0.00 0.00 174.62 175.53 3kt7 h GLU 428 N 2.75 0.73 -0.87 3.99 4.81 -1.97 -2.61 114.58 121.41 3kt7 h GLU 428 Ca -0.36 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 58.86 3kt7 h GLU 428 Cb 1.20 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 30.36 3kt7 h GLU 428 CO 0.62 0.48 0.56 0.00 -0.73 0.00 0.00 179.01 179.94 3kt7 h ALA 429 N 1.45 1.16 -0.69 2.92 0.00 -1.97 -0.55 119.26 121.58 3kt7 h ALA 429 Ca 0.39 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.32 3kt7 h ALA 429 Cb 0.37 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 3kt7 h ALA 429 CO -0.25 0.38 0.40 -0.44 0.00 0.00 0.00 179.25 179.33 3kt7 h ASP 430 N 1.07 0.60 -0.22 0.00 3.45 -1.84 -0.39 116.42 119.08 3kt7 h ASP 430 Ca 0.35 0.03 -0.07 0.00 0.43 0.00 0.00 57.03 57.77 3kt7 h ASP 430 Cb 0.04 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.71 3kt7 h ASP 430 CO -0.13 0.39 -0.13 0.40 -1.57 0.00 0.00 179.24 178.20 3kt7 h ILE 431 N 0.73 1.31 -0.78 0.35 2.04 -1.28 -2.89 117.51 117.00 3kt7 h ILE 431 Ca 0.31 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 3kt7 h ILE 431 Cb 0.17 1.64 -0.04 0.00 -0.74 0.00 0.00 36.82 37.85 3kt7 h ILE 431 CO -0.17 0.37 0.45 -0.07 0.00 0.00 0.00 178.15 178.73 3kt7 h LEU 432 N 0.18 0.95 -0.39 1.44 3.38 -0.81 -1.55 115.31 118.51 3kt7 h LEU 432 Ca 0.05 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3kt7 h LEU 432 Cb 0.64 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3kt7 h LEU 432 CO 0.04 0.75 0.26 -0.08 0.09 0.00 0.00 178.44 179.49 3kt7 h GLU 433 N 1.08 0.51 -0.78 1.13 4.81 -1.06 -1.20 114.58 119.08 3kt7 h GLU 433 Ca 0.28 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 3kt7 h GLU 433 Cb -0.00 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 3kt7 h GLU 433 CO -0.05 0.34 0.46 0.00 -0.73 0.00 0.00 179.01 179.04 3kt7 h ALA 434 N 1.14 1.00 -0.16 2.92 0.00 -1.20 -1.98 119.26 120.98 3kt7 h ALA 434 Ca 0.14 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3kt7 h ALA 434 Cb -0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3kt7 h ALA 434 CO -0.03 0.47 -0.32 -0.07 0.00 0.00 0.00 179.25 179.30 3kt7 h LEU 435 N 1.07 0.32 -0.03 0.00 3.38 -0.95 -2.33 115.31 116.77 3kt7 h LEU 435 Ca 0.28 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3kt7 h LEU 435 Cb -0.02 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3kt7 h LEU 435 CO -0.05 0.63 0.00 -3.20 0.09 0.00 0.00 178.44 175.91 3kt7 n ASN 436 N -4.09 0.74 -3.19 -0.43 5.15 -0.48 -4.30 115.26 108.65 3kt7 n ASN 436 Ca -0.01 0.57 -0.23 0.00 -0.60 0.00 0.00 54.58 54.32 3kt7 n ASN 436 Cb 0.42 -0.77 -0.05 0.00 -0.53 0.00 0.00 39.78 38.85 3kt7 n ASN 436 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3kt7 n ASN 437 N -2.20 1.48 -4.77 1.20 4.13 -0.77 -5.09 115.26 109.24 3kt7 n ASN 437 Ca 0.06 -3.04 -0.41 0.00 1.68 0.00 0.00 54.58 52.86 3kt7 n ASN 437 Cb 0.41 -0.63 -0.01 0.00 -1.54 0.00 0.00 39.78 38.02 3kt7 n ASN 437 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 3kt7 s ASN 438 N -2.12 6.49 0.18 6.41 3.04 -1.16 -4.80 114.94 122.99 3kt7 s ASN 438 Ca 0.39 2.93 0.03 0.00 0.04 0.00 0.00 52.86 56.25 3kt7 s ASN 438 Cb 0.25 -2.66 -0.05 0.00 -1.54 0.00 0.00 41.25 37.25 3kt7 s ASN 438 CO -0.09 -0.76 -0.03 1.51 -3.04 0.00 0.00 177.10 174.69 3kt7 s ASP 439 N -0.23 1.61 0.17 -4.21 3.84 -1.26 -5.14 116.67 111.45 3kt7 s ASP 439 Ca 0.52 -1.14 0.06 0.00 -0.00 0.00 0.00 52.55 51.99 3kt7 s ASP 439 Cb -0.44 0.04 -0.04 0.00 -1.38 0.00 0.00 42.92 41.10 3kt7 s ASP 439 CO 0.59 -0.48 0.06 -0.76 -0.00 0.00 0.00 175.17 174.58 3kt7 s LEU 440 N -3.22 3.51 0.36 2.11 1.43 -1.26 -4.97 118.68 116.64 3kt7 s LEU 440 Ca 0.23 -0.30 -0.28 0.00 -1.03 0.00 0.00 54.13 52.75 3kt7 s LEU 440 Cb 0.05 -2.14 -0.11 0.00 0.03 0.00 0.00 46.19 44.02 3kt7 s LEU 440 CO 0.04 0.08 1.45 -2.84 0.23 0.00 0.00 176.35 175.31 3kt7 s PRO 441 N -3.04 4.16 -0.27 1.29 0.02 -1.26 -4.61 135.00 131.29 3kt7 s PRO 441 Ca 0.29 2.50 -0.03 0.00 0.02 0.00 0.00 61.00 63.78 3kt7 s PRO 441 Cb -0.09 -2.99 0.11 0.00 0.02 0.00 0.00 34.50 31.55 3kt7 s PRO 441 CO 0.21 -0.46 0.22 1.21 -0.33 0.00 0.00 177.00 177.84 3kt7 s ASN 442 N -0.20 2.25 0.21 2.53 3.84 0.28 -4.93 114.94 118.92 3kt7 s ASN 442 Ca 0.52 -0.82 -0.01 0.00 0.21 0.00 0.00 52.86 52.76 3kt7 s ASN 442 Cb -0.45 0.17 0.17 0.00 -0.55 0.00 0.00 41.25 40.59 3kt7 s ASN 442 CO 0.61 -0.39 1.54 -0.26 -2.79 0.00 0.00 177.10 175.81 3kt7 h PHE 443 N 8.33 0.62 -0.47 0.43 -1.00 -1.92 -2.25 116.94 120.67 3kt7 h PHE 443 Ca -0.16 -0.21 -0.09 0.00 2.81 0.00 0.00 57.97 60.32 3kt7 h PHE 443 Cb 1.07 -0.12 -0.02 0.00 3.61 0.00 0.00 35.95 40.50 3kt7 h PHE 443 CO 0.25 0.91 -0.06 0.37 -1.61 0.00 0.00 178.31 178.17 3kt7 h GLN 444 N 0.39 0.87 -0.62 1.51 5.75 -1.96 -0.42 115.11 120.63 3kt7 h GLN 444 Ca 0.01 -0.31 -0.02 0.00 -0.15 0.00 0.00 58.65 58.18 3kt7 h GLN 444 Cb 1.04 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.50 3kt7 h GLN 444 CO 0.09 0.94 0.29 0.74 -2.65 0.00 0.00 178.83 178.25 3kt7 h PHE 445 N 0.72 0.88 -0.25 3.99 0.04 -1.94 -0.15 116.94 120.23 3kt7 h PHE 445 Ca 0.13 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 3kt7 h PHE 445 Cb 0.59 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 3kt7 h PHE 445 CO 0.04 0.65 0.11 1.15 -0.60 0.00 0.00 178.31 179.66 3kt7 h THR 446 N 0.88 1.15 -0.51 -1.55 2.02 -1.09 -1.22 112.91 112.60 3kt7 h THR 446 Ca 0.22 -0.46 0.08 0.00 0.77 0.00 0.00 66.41 67.02 3kt7 h THR 446 Cb 0.10 1.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.45 3kt7 h THR 446 CO -0.03 0.16 0.13 0.11 0.37 0.00 0.00 175.52 176.26 3kt7 h LYS 447 N 0.26 0.27 -0.60 6.66 1.57 -0.71 -2.01 116.57 122.01 3kt7 h LYS 447 Ca 0.08 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 3kt7 h LYS 447 Cb 0.14 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 3kt7 h LYS 447 CO -0.01 0.18 0.37 -0.44 -0.57 0.00 0.00 179.45 178.98 3kt7 h ASP 448 N 0.28 0.61 -0.61 0.86 3.32 -0.73 -2.46 116.42 117.69 3kt7 h ASP 448 Ca 0.25 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 3kt7 h ASP 448 Cb 0.33 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 3kt7 h ASP 448 CO -0.31 0.43 0.17 0.00 -1.72 0.00 0.00 179.24 177.81 3kt7 h ALA 449 N 1.25 1.09 -0.38 3.45 0.00 -0.94 -2.88 119.26 120.85 3kt7 h ALA 449 Ca 0.24 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3kt7 h ALA 449 Cb -0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3kt7 h ALA 449 CO -0.09 0.61 0.25 0.82 0.00 0.00 0.00 179.25 180.84 3kt7 h ILE 450 N 0.96 1.09 -0.90 0.00 2.04 -0.95 -2.41 117.51 117.34 3kt7 h ILE 450 Ca 0.21 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.92 3kt7 h ILE 450 Cb 0.32 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.89 3kt7 h ILE 450 CO -0.00 0.09 0.59 0.11 0.00 0.00 0.00 178.15 178.94 3kt7 h LYS 451 N 0.51 1.10 -0.22 2.37 6.56 -1.24 0.13 116.57 125.78 3kt7 h LYS 451 Ca 0.14 -0.07 -0.18 0.00 -1.06 0.00 0.00 60.65 59.49 3kt7 h LYS 451 Cb -0.06 -0.25 -0.00 0.00 -0.57 0.00 0.00 32.23 31.35 3kt7 h LYS 451 CO -0.03 0.73 -0.58 0.82 -2.06 0.00 0.00 179.45 178.33 3kt7 h ILE 452 N 1.14 1.30 -0.45 1.86 2.04 -1.37 0.93 117.51 122.96 3kt7 h ILE 452 Ca 0.35 -1.81 -0.05 0.00 1.00 0.00 0.00 64.86 64.35 3kt7 h ILE 452 Cb -0.01 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 3kt7 h ILE 452 CO -0.10 0.57 0.07 0.40 0.00 0.00 0.00 178.15 179.09 3kt7 h ILE 453 N 0.52 1.25 -0.35 -0.67 2.04 -1.19 -2.79 117.51 116.32 3kt7 h ILE 453 Ca 0.00 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 64.92 3kt7 h ILE 453 Cb 1.16 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 3kt7 h ILE 453 CO 0.12 0.32 0.05 -1.28 0.00 0.00 0.00 178.15 177.36 3kt7 h SER 454 N 0.61 0.56 0.60 1.72 0.87 -0.78 -2.52 113.55 114.61 3kt7 h SER 454 Ca 0.14 -0.26 -0.06 0.00 -1.23 0.00 0.00 61.79 60.37 3kt7 h SER 454 Cb 0.39 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 3kt7 h SER 454 CO 0.01 0.68 -0.29 0.44 -0.53 0.00 0.00 176.83 177.14 3kt7 h ASP 455 N 0.41 0.00 0.72 6.23 3.32 -0.87 0.07 116.42 126.30 3kt7 h ASP 455 Ca 0.11 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.02 3kt7 h ASP 455 Cb 0.36 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 3kt7 h ASP 455 CO 0.01 0.29 -0.63 0.00 -1.72 0.00 0.00 179.24 177.19 3kt7 h ALA 456 N 1.71 0.90 0.04 3.45 0.00 -1.34 -3.32 119.26 120.70 3kt7 h ALA 456 Ca -0.00 -0.57 -0.31 0.00 0.00 0.00 0.00 54.91 54.03 3kt7 h ALA 456 Cb 0.67 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 3kt7 h ALA 456 CO 0.04 0.78 -1.78 0.66 0.00 0.00 0.00 179.25 178.95 3kt7 h SER 457 N 0.00 0.14 0.00 0.00 4.64 -0.98 -3.49 113.55 113.86 3kt7 h SER 457 Ca -0.01 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 3kt7 h SER 457 Cb 1.15 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3kt7 h SER 457 CO 0.08 1.28 0.00 0.61 -0.87 0.00 0.00 176.83 177.93 3kt7 n GLY 458 N 1.69 1.74 3.09 -0.77 0.00 -0.04 -4.84 105.19 106.05 3kt7 n GLY 458 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.67 3kt7 n GLY 458 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3kt7 n ASN 459 N 0.00 -5.32 -4.71 1.61 2.85 -1.02 -4.97 115.26 103.71 3kt7 n ASN 459 Ca 0.00 -0.62 -0.24 0.00 -0.11 0.00 0.00 54.58 53.62 3kt7 n ASN 459 Cb 0.00 -4.70 0.10 0.00 1.24 0.00 0.00 39.78 36.42 3kt7 n ASN 459 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 3kt7 s SER 460 N -3.53 4.44 0.54 1.20 1.04 -1.26 -4.79 113.70 111.34 3kt7 s SER 460 Ca 0.33 -0.25 0.29 0.00 0.48 0.00 0.00 55.95 56.80 3kt7 s SER 460 Cb -0.04 -0.19 1.54 0.00 0.10 0.00 0.00 66.02 67.42 3kt7 s SER 460 CO 0.66 -1.79 2.10 0.03 0.98 0.00 0.00 173.24 175.21 3kt7 h ARG 461 N -0.50 0.00 0.00 4.02 3.08 -1.96 -1.86 114.38 117.16 3kt7 h ARG 461 Ca -0.38 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.44 3kt7 h ARG 461 Cb 1.27 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.29 3kt7 h ARG 461 CO 0.43 0.10 -1.25 0.93 -1.07 0.00 0.00 179.97 179.11 3kt7 h GLU 462 N 0.00 0.00 0.00 0.04 3.07 -1.94 -3.42 114.58 112.33 3kt7 h GLU 462 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3kt7 h GLU 462 Cb 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.21 3kt7 h GLU 462 CO 0.01 0.75 0.00 0.09 -1.40 0.00 0.00 179.01 178.46 3kt7 n ASN 463 N -3.21 0.87 -4.75 1.42 3.02 -1.15 -4.54 115.26 106.93 3kt7 n ASN 463 Ca -0.06 -1.29 -0.33 0.00 -0.03 0.00 0.00 54.58 52.87 3kt7 n ASN 463 Cb 0.96 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 40.22 3kt7 n ASN 463 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3kt7 s ASN 464 N -0.29 4.47 -0.36 6.41 2.20 -0.71 -4.79 114.94 121.86 3kt7 s ASN 464 Ca 0.00 2.07 0.07 0.00 -0.94 0.00 0.00 52.86 54.06 3kt7 s ASN 464 Cb 0.00 -2.56 0.57 0.00 -2.00 0.00 0.00 41.25 37.26 3kt7 s ASN 464 CO 0.00 -2.07 1.65 0.49 -2.94 0.00 0.00 177.10 174.24 3kt7 n PHE 465 N -2.97 1.94 -0.36 1.54 3.01 -1.26 -4.74 117.46 114.61 3kt7 n PHE 465 Ca 0.11 -1.75 0.02 0.00 1.01 0.00 0.00 57.45 56.84 3kt7 n PHE 465 Cb 0.52 -0.69 0.17 0.00 -0.01 0.00 0.00 39.48 39.47 3kt7 n PHE 465 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3kt7 h ASP 466 N 1.03 1.05 -0.07 4.37 3.32 -1.93 0.17 116.42 124.35 3kt7 h ASP 466 Ca 0.40 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 3kt7 h ASP 466 Cb 2.13 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 41.45 3kt7 h ASP 466 CO 0.70 0.69 0.01 0.00 -1.72 0.00 0.00 179.24 178.92 3kt7 h ALA 467 N 1.45 0.09 -0.76 3.45 0.00 -1.85 -2.03 119.26 119.61 3kt7 h ALA 467 Ca 0.42 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 3kt7 h ALA 467 Cb 0.11 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3kt7 h ALA 467 CO -0.15 -0.25 0.40 0.93 0.00 0.00 0.00 179.25 180.18 3kt7 h GLU 468 N -0.14 1.06 -0.45 0.00 3.07 -1.80 -0.44 114.58 115.89 3kt7 h GLU 468 Ca 0.02 -0.13 -0.06 0.00 -0.50 0.00 0.00 59.36 58.69 3kt7 h GLU 468 Cb 0.30 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 27.99 3kt7 h GLU 468 CO 0.00 0.80 0.06 -0.07 -1.40 0.00 0.00 179.01 178.40 3kt7 h LEU 469 N 1.05 0.72 -0.84 1.33 3.38 -0.97 0.18 115.31 120.17 3kt7 h LEU 469 Ca 0.26 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 3kt7 h LEU 469 Cb 0.06 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3kt7 h LEU 469 CO -0.04 0.81 0.05 0.00 0.09 0.00 0.00 178.44 179.35 3kt7 h ALA 470 N 0.94 1.04 -0.32 1.53 0.00 -1.12 -0.91 119.26 120.42 3kt7 h ALA 470 Ca 0.13 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 3kt7 h ALA 470 Cb 0.41 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3kt7 h ALA 470 CO 0.01 0.61 -0.41 -0.07 0.00 0.00 0.00 179.25 179.39 3kt7 h LEU 471 N 0.85 0.83 -0.57 0.00 3.38 -0.87 -1.82 115.31 117.11 3kt7 h LEU 471 Ca 0.17 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 3kt7 h LEU 471 Cb 0.44 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3kt7 h LEU 471 CO 0.02 1.13 -0.01 0.40 0.09 0.00 0.00 178.44 180.07 3kt7 h ILE 472 N 0.63 1.27 -0.93 1.22 2.04 -0.78 -0.17 117.51 120.79 3kt7 h ILE 472 Ca 0.05 -1.14 0.07 0.00 1.00 0.00 0.00 64.86 64.84 3kt7 h ILE 472 Cb 0.97 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.84 3kt7 h ILE 472 CO 0.09 0.41 0.59 0.44 0.00 0.00 0.00 178.15 179.68 3kt7 h ASP 473 N 0.91 0.91 -0.46 1.72 3.45 -1.04 0.89 116.42 122.81 3kt7 h ASP 473 Ca 0.16 0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.61 3kt7 h ASP 473 Cb 0.56 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 39.14 3kt7 h ASP 473 CO 0.03 0.56 0.15 0.25 -1.57 0.00 0.00 179.24 178.67 3kt7 h LEU 474 N 1.04 0.66 -0.81 1.55 5.85 -0.93 -1.81 115.31 120.85 3kt7 h LEU 474 Ca 0.42 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.97 3kt7 h LEU 474 Cb 0.23 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 3kt7 h LEU 474 CO -0.19 0.68 0.52 0.00 -0.34 0.00 0.00 178.44 179.10 3kt7 h ALA 475 N 1.00 1.07 -0.66 1.25 0.00 -0.26 -2.20 119.26 119.46 3kt7 h ALA 475 Ca 0.15 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 3kt7 h ALA 475 Cb 0.25 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3kt7 h ALA 475 CO -0.01 0.33 0.23 0.28 0.00 0.00 0.00 179.25 180.08 3kt7 h VAL 476 N 1.00 1.24 -0.52 0.00 2.07 -0.64 -0.83 116.25 118.57 3kt7 h VAL 476 Ca 0.33 -0.79 0.02 0.00 0.82 0.00 0.00 66.70 67.08 3kt7 h VAL 476 Cb 0.03 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 3kt7 h VAL 476 CO -0.12 0.31 0.31 0.15 0.02 0.00 0.00 177.57 178.24 3kt7 h PHE 477 N 0.96 0.58 0.00 1.57 3.04 -0.77 -2.10 116.94 120.22 3kt7 h PHE 477 Ca 0.22 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.19 3kt7 h PHE 477 Cb 0.24 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 38.56 3kt7 h PHE 477 CO 0.02 0.33 0.00 0.45 -2.02 0.00 0.00 178.31 177.09 3kt7 h HIS 478 N 0.61 0.00 0.00 0.41 3.86 -0.82 -2.14 115.15 117.07 3kt7 h HIS 478 Ca 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 3kt7 h HIS 478 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 3kt7 h HIS 478 CO -0.07 0.00 -0.22 1.17 0.86 0.00 0.00 177.93 179.67 3kt7 n LYS 479 N -2.81 0.03 -2.23 2.45 4.81 -0.37 -4.61 118.16 115.42 3kt7 n LYS 479 Ca 0.02 0.02 -0.36 0.00 -0.87 0.00 0.00 58.31 57.12 3kt7 n LYS 479 Cb 0.34 -1.53 0.00 0.00 0.02 0.00 0.00 35.03 33.87 3kt7 n LYS 479 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 3kt7 s SER 480 N -3.15 5.79 0.23 3.14 1.04 -0.80 -4.93 113.70 115.02 3kt7 s SER 480 Ca 0.12 2.24 -0.07 0.00 0.48 0.00 0.00 55.95 58.71 3kt7 s SER 480 Cb 0.18 -2.59 0.25 0.00 0.10 0.00 0.00 66.02 63.96 3kt7 s SER 480 CO 0.61 -1.17 1.87 0.74 0.98 0.00 0.00 173.24 176.27 3kt7 h THR 481 N 1.36 1.12 -0.46 2.02 2.02 -1.92 -2.65 112.91 114.40 3kt7 h THR 481 Ca -0.50 -0.35 -0.09 0.00 0.77 0.00 0.00 66.41 66.24 3kt7 h THR 481 Cb 1.26 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 3kt7 h THR 481 CO 0.58 0.19 -0.07 0.40 0.37 0.00 0.00 175.52 176.98 3kt7 h ILE 482 N 1.02 1.25 -0.47 3.11 2.04 -1.91 -1.45 117.51 121.10 3kt7 h ILE 482 Ca 0.33 -1.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.05 3kt7 h ILE 482 Cb 0.03 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 3kt7 h ILE 482 CO -0.12 0.39 0.23 0.15 0.00 0.00 0.00 178.15 178.79 3kt7 h PHE 483 N 0.73 0.67 0.00 1.37 3.04 -1.70 -1.87 116.94 119.18 3kt7 h PHE 483 Ca 0.13 -0.03 -0.05 0.00 3.98 0.00 0.00 57.97 62.00 3kt7 h PHE 483 Cb 0.55 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.84 3kt7 h PHE 483 CO 0.03 0.54 -0.22 0.87 -2.02 0.00 0.00 178.31 177.50 3kt7 h LYS 484 N 0.61 0.00 -0.56 1.11 1.57 -1.16 0.25 116.57 118.39 3kt7 h LYS 484 Ca 0.16 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 3kt7 h LYS 484 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3kt7 h LYS 484 CO -0.02 0.22 0.17 0.87 -0.57 0.00 0.00 179.45 180.13 3kt7 h LYS 485 N 0.00 0.88 -0.51 3.15 1.57 -0.94 -0.40 116.57 120.32 3kt7 h LYS 485 Ca -0.00 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.54 3kt7 h LYS 485 Cb 0.44 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 3kt7 h LYS 485 CO 0.03 0.80 0.15 -0.92 -0.57 0.00 0.00 179.45 178.93 3kt7 h TYR 486 N 0.79 0.84 -0.65 -1.35 3.20 -0.49 0.26 116.97 119.57 3kt7 h TYR 486 Ca 0.18 -0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.98 3kt7 h TYR 486 Cb 0.28 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.28 3kt7 h TYR 486 CO 0.02 0.73 0.41 1.25 -1.64 0.00 0.00 178.16 178.93 3kt7 h LEU 487 N 0.71 0.70 -0.79 2.82 5.85 -0.87 -0.64 115.31 123.08 3kt7 h LEU 487 Ca 0.16 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 3kt7 h LEU 487 Cb 0.29 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 3kt7 h LEU 487 CO -0.00 0.50 0.44 0.00 -0.34 0.00 0.00 178.44 179.03 3kt7 h ALA 488 N 1.26 1.01 -0.36 1.25 0.00 -0.81 -2.14 119.26 119.47 3kt7 h ALA 488 Ca 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3kt7 h ALA 488 Cb -0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3kt7 h ALA 488 CO -0.08 0.52 0.23 1.25 0.00 0.00 0.00 179.25 181.18 3kt7 h LEU 489 N 1.10 0.42 -1.02 0.00 5.85 -0.29 0.14 115.31 121.50 3kt7 h LEU 489 Ca 0.28 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 3kt7 h LEU 489 Cb 0.03 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 3kt7 h LEU 489 CO -0.05 0.32 0.14 -0.07 -0.34 0.00 0.00 178.44 178.44 3kt7 h LEU 490 N 0.48 0.79 0.00 2.25 3.38 -0.88 -3.33 115.31 118.00 3kt7 h LEU 490 Ca 0.13 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3kt7 h LEU 490 Cb -0.04 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.50 3kt7 h LEU 490 CO -0.03 0.77 -1.44 0.35 0.09 0.00 0.00 178.44 178.19 3kt7 n THR 491 N -4.28 0.00 -2.05 0.22 -2.24 -0.83 -4.16 114.28 100.94 3kt7 n THR 491 Ca 0.04 -0.30 -0.19 0.00 -2.27 0.00 0.00 64.05 61.33 3kt7 n THR 491 Cb 0.22 0.40 -0.04 0.00 -2.10 0.00 0.00 70.33 68.81 3kt7 n THR 491 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3kt7 n SER 492 N -1.85 -5.33 -4.48 3.42 7.64 0.49 -4.97 113.62 108.54 3kt7 n SER 492 Ca -0.01 0.21 -0.31 0.00 1.01 0.00 0.00 58.87 59.77 3kt7 n SER 492 Cb 0.37 -4.57 -0.13 0.00 -1.01 0.00 0.00 64.21 58.87 3kt7 n SER 492 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3kt7 s LEU 493 N -5.37 2.70 -0.37 -3.43 1.43 -1.23 -4.30 118.68 108.11 3kt7 s LEU 493 Ca 0.00 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 52.66 3kt7 s LEU 493 Cb 0.00 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.67 3kt7 s LEU 493 CO 0.00 0.29 0.21 0.00 0.23 0.00 0.00 176.35 177.08 3kt7 s PRO 495 N 1.59 4.28 0.00 0.00 0.02 -1.26 -0.64 135.00 138.99 3kt7 s PRO 495 Ca 0.03 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.37 3kt7 s PRO 495 Cb -0.19 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.28 3kt7 s PRO 495 CO 0.07 -0.31 0.22 1.33 -0.33 0.00 0.00 177.00 177.98 3kt7 n VAL 496 N 0.96 0.00 -3.77 3.83 0.24 -0.04 -4.81 118.33 114.75 3kt7 n VAL 496 Ca 0.01 -0.34 -0.09 0.00 -2.04 0.00 0.00 64.34 61.87 3kt7 n VAL 496 Cb 0.41 1.20 -0.04 0.00 -1.47 0.00 0.00 33.84 33.94 3kt7 n VAL 496 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3kt7 s SER 497 N -0.25 -0.23 -0.02 -1.34 1.04 -1.23 -1.50 113.70 110.16 3kt7 s SER 497 Ca 0.00 -0.53 -0.18 0.00 0.48 0.00 0.00 55.95 55.73 3kt7 s SER 497 Cb 0.00 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.73 3kt7 s SER 497 CO 0.00 -1.05 0.38 -1.83 0.98 0.00 0.00 173.24 171.71 3kt7 s GLU 498 N -3.89 0.73 -0.03 4.02 -1.05 -0.01 -3.64 118.70 114.83 3kt7 s GLU 498 Ca 0.10 -0.10 0.00 0.00 -0.15 0.00 0.00 54.97 54.83 3kt7 s GLU 498 Cb -0.01 0.33 0.03 0.00 -0.44 0.00 0.00 34.13 34.04 3kt7 s GLU 498 CO -0.02 -0.21 0.00 -1.14 0.95 0.00 0.00 175.26 174.85 3kt7 s GLN 499 N -1.27 0.32 -0.10 -4.83 0.74 0.05 -1.07 119.66 113.49 3kt7 s GLN 499 Ca -0.13 0.08 0.03 0.00 0.05 0.00 0.00 55.36 55.39 3kt7 s GLN 499 Cb -0.04 -0.51 0.01 0.00 1.10 0.00 0.00 33.01 33.57 3kt7 s GLN 499 CO 0.05 -0.14 -0.19 0.42 -0.55 0.00 0.00 175.29 174.88 3kt7 s ILE 500 N 1.08 1.72 -0.02 -2.34 1.01 -1.26 -1.12 121.20 120.27 3kt7 s ILE 500 Ca -0.09 -0.80 0.05 0.00 0.00 0.00 0.00 60.65 59.80 3kt7 s ILE 500 Cb -0.13 -1.52 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 3kt7 s ILE 500 CO -0.02 0.48 -0.16 -0.76 0.00 0.00 0.00 174.94 174.49 3kt7 s LEU 501 N 0.62 2.00 -0.17 2.97 1.43 0.36 -4.76 118.68 121.13 3kt7 s LEU 501 Ca -0.14 -0.29 -0.13 0.00 -1.03 0.00 0.00 54.13 52.55 3kt7 s LEU 501 Cb -0.16 -0.82 -0.05 0.00 0.03 0.00 0.00 46.19 45.19 3kt7 s LEU 501 CO 0.04 0.18 0.25 -0.63 0.23 0.00 0.00 176.35 176.42 3kt7 s ILE 502 N -0.28 5.34 0.03 -0.59 1.01 -0.57 0.02 121.20 126.15 3kt7 s ILE 502 Ca 0.04 0.44 0.08 0.00 0.00 0.00 0.00 60.65 61.21 3kt7 s ILE 502 Cb -0.07 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 3kt7 s ILE 502 CO -0.00 0.40 -0.23 -0.13 0.00 0.00 0.00 174.94 174.98 3kt7 s ARG 503 N 0.47 1.64 -0.11 2.79 0.52 0.07 -0.47 118.95 123.86 3kt7 s ARG 503 Ca 0.14 -0.97 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 3kt7 s ARG 503 Cb -0.12 -1.74 0.02 0.00 0.52 0.00 0.00 34.95 33.63 3kt7 s ARG 503 CO 0.02 0.45 -0.11 0.50 0.02 0.00 0.00 175.30 176.19 3kt7 s ARG 504 N -1.04 1.79 -0.41 3.54 3.52 0.04 -1.57 118.95 124.81 3kt7 s ARG 504 Ca 0.09 -0.37 -0.10 0.00 -0.13 0.00 0.00 55.73 55.22 3kt7 s ARG 504 Cb -0.09 -1.69 0.07 0.00 -1.56 0.00 0.00 34.95 31.67 3kt7 s ARG 504 CO 0.01 -0.19 0.26 -0.06 -0.81 0.00 0.00 175.30 174.51 3kt7 s PHE 505 N 1.41 3.30 0.25 5.12 0.40 0.71 -1.41 117.98 127.76 3kt7 s PHE 505 Ca 0.01 -1.34 -0.30 0.00 -0.60 0.00 0.00 56.93 54.70 3kt7 s PHE 505 Cb -0.13 -2.84 -0.09 0.00 0.51 0.00 0.00 43.02 40.46 3kt7 s PHE 505 CO -0.06 -0.80 1.01 1.03 0.70 0.00 0.00 175.22 177.11 3kt7 s ARG 506 N 1.47 4.75 0.19 0.44 0.52 -1.26 -1.47 118.95 123.60 3kt7 s ARG 506 Ca 0.03 1.63 -0.33 0.00 -0.52 0.00 0.00 55.73 56.53 3kt7 s ARG 506 Cb -0.22 -3.25 -0.14 0.00 0.52 0.00 0.00 34.95 31.86 3kt7 s ARG 506 CO 0.04 0.36 1.44 -2.30 0.02 0.00 0.00 175.30 174.86 3kt7 n PRO 507 N 1.46 1.93 -0.98 3.54 -0.02 -1.26 -2.07 135.00 137.60 3kt7 n PRO 507 Ca -0.01 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3kt7 n PRO 507 Cb 0.46 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 3kt7 n PRO 507 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kt7 n GLY 508 N 2.61 0.73 0.68 -1.23 0.00 0.77 -4.70 105.19 104.06 3kt7 n GLY 508 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3kt7 n GLY 508 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3kt7 n MET 509 N -2.31 0.00 -4.28 1.61 2.81 -0.88 -4.92 117.12 109.15 3kt7 n MET 509 Ca 0.00 0.00 -0.30 0.00 -1.81 0.00 0.00 57.70 55.59 3kt7 n MET 509 Cb 0.01 -0.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.93 3kt7 n MET 509 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3kt7 s ASP 510 N -4.11 4.35 -0.08 7.83 -0.00 -0.98 -4.79 116.67 118.89 3kt7 s ASP 510 Ca 0.00 -0.37 -0.32 0.00 -0.00 0.00 0.00 52.55 51.86 3kt7 s ASP 510 Cb 0.00 -0.83 0.12 0.00 -0.00 0.00 0.00 42.92 42.21 3kt7 s ASP 510 CO 0.00 0.19 1.18 0.72 -0.00 0.00 0.00 175.17 177.27 3kt7 s PHE 511 N -1.17 -0.12 0.29 4.23 -0.71 0.53 -1.75 117.98 119.28 3kt7 s PHE 511 Ca 0.20 0.02 0.03 0.00 -1.04 0.00 0.00 56.93 56.15 3kt7 s PHE 511 Cb -0.11 0.54 -0.06 0.00 -1.21 0.00 0.00 43.02 42.18 3kt7 s PHE 511 CO 0.12 -0.32 0.05 0.95 -1.34 0.00 0.00 175.22 174.68 3kt7 s THR 512 N -2.56 1.07 0.30 -4.49 -4.23 -0.37 -1.57 115.64 103.78 3kt7 s THR 512 Ca 0.11 -2.01 0.10 0.00 -1.18 0.00 0.00 61.69 58.70 3kt7 s THR 512 Cb 0.01 -2.66 -0.05 0.00 1.34 0.00 0.00 72.50 71.14 3kt7 s THR 512 CO -0.04 -0.08 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.16 3kt7 s LEU 513 N -3.42 2.99 -0.10 4.79 1.43 -1.17 -4.15 118.68 119.05 3kt7 s LEU 513 Ca 0.35 -0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 52.31 3kt7 s LEU 513 Cb 0.08 -1.46 -0.07 0.00 0.03 0.00 0.00 46.19 44.77 3kt7 s LEU 513 CO 0.14 -0.08 2.05 0.00 0.23 0.00 0.00 176.35 178.70 3kt7 s ALA 514 N -2.43 3.16 0.08 4.21 0.00 -1.26 -4.57 121.76 120.95 3kt7 s ALA 514 Ca 0.32 1.00 -0.01 0.00 0.00 0.00 0.00 51.96 53.28 3kt7 s ALA 514 Cb -0.04 -3.95 -0.04 0.00 0.00 0.00 0.00 23.12 19.09 3kt7 s ALA 514 CO 0.19 -2.17 -0.02 0.95 0.00 0.00 0.00 175.76 174.71 3kt7 s THR 515 N 6.30 0.26 0.46 0.00 -4.23 -0.79 -4.87 115.64 112.78 3kt7 s THR 515 Ca 0.93 -1.85 -0.00 0.00 -1.18 0.00 0.00 61.69 59.58 3kt7 s THR 515 Cb -0.37 -1.66 -0.00 0.00 1.34 0.00 0.00 72.50 71.81 3kt7 s THR 515 CO 0.38 -0.86 0.69 -0.54 -0.54 0.00 0.00 174.62 173.75 3kt7 s LYS 516 N -3.94 3.08 0.79 3.99 1.02 -1.26 -1.54 119.74 121.88 3kt7 s LYS 516 Ca 0.11 -0.42 -0.11 0.00 0.02 0.00 0.00 55.97 55.58 3kt7 s LYS 516 Cb 0.08 -2.53 0.07 0.00 -0.52 0.00 0.00 37.83 34.93 3kt7 s LYS 516 CO -0.07 -0.30 1.10 0.00 -0.92 0.00 0.00 175.35 175.17 3kt7 s ARG 518 N -4.81 2.87 0.45 0.00 3.52 -1.26 -5.02 118.95 114.70 3kt7 s ARG 518 Ca 0.63 -0.97 -0.23 0.00 -0.13 0.00 0.00 55.73 55.03 3kt7 s ARG 518 Cb -0.18 -3.09 -0.08 0.00 -1.56 0.00 0.00 34.95 30.04 3kt7 s ARG 518 CO 0.56 -0.42 1.15 -0.06 -0.81 0.00 0.00 175.30 175.71 3kt7 s PHE 519 N 1.36 2.93 -0.73 5.12 0.08 -1.26 -4.95 117.98 120.52 3kt7 s PHE 519 Ca 0.00 1.55 -0.26 0.00 0.12 0.00 0.00 56.93 58.34 3kt7 s PHE 519 Cb -0.17 -3.35 0.00 0.00 -0.57 0.00 0.00 43.02 38.93 3kt7 s PHE 519 CO -0.03 -1.39 1.62 1.21 -0.10 0.00 0.00 175.22 176.53 3kt7 s ASN 520 N -1.38 5.70 0.58 1.36 3.84 -1.26 -4.88 114.94 118.90 3kt7 s ASN 520 Ca 0.63 -0.24 0.31 0.00 0.21 0.00 0.00 52.86 53.76 3kt7 s ASN 520 Cb -0.28 -2.55 1.80 0.00 -0.55 0.00 0.00 41.25 39.67 3kt7 s ASN 520 CO 0.34 -2.14 2.23 1.05 -2.79 0.00 0.00 177.10 175.79 3kt7 h GLU 521 N 12.25 0.00 0.00 0.43 4.11 -2.01 0.40 114.58 129.76 3kt7 h GLU 521 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.25 3kt7 h GLU 521 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 3kt7 h GLU 521 CO 1.26 0.02 0.00 1.25 0.07 0.00 0.00 179.01 181.62 3kt7 h LEU 522 N 0.00 0.00 -2.21 3.06 5.85 -2.04 -3.14 115.31 116.83 3kt7 h LEU 522 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3kt7 h LEU 522 Cb 0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.10 3kt7 h LEU 522 CO 0.00 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.28 3kt7 n LEU 523 N -2.67 2.95 0.07 2.25 4.32 0.13 -4.63 117.00 119.42 3kt7 n LEU 523 Ca 0.02 -1.46 0.02 0.00 -0.02 0.00 0.00 56.01 54.57 3kt7 n LEU 523 Cb 0.33 -0.17 0.36 0.00 -1.62 0.00 0.00 43.42 42.32 3kt7 n LEU 523 CO 0.26 0.64 0.92 0.11 -1.22 0.00 0.00 177.39 178.09 3kt7 h LYS 524 N 3.38 0.35 -0.00 3.23 1.57 -1.52 -2.55 116.57 121.02 3kt7 h LYS 524 Ca 0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3kt7 h LYS 524 Cb 0.80 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.06 3kt7 h LYS 524 CO 0.00 0.43 -0.17 0.43 -0.57 0.00 0.00 179.45 179.58 3kt7 n SER 525 N -4.29 0.21 -4.62 0.86 7.64 -1.26 -4.79 113.62 107.37 3kt7 n SER 525 Ca 0.00 0.13 -0.43 0.00 1.01 0.00 0.00 58.87 59.58 3kt7 n SER 525 Cb 0.25 -0.21 -0.02 0.00 -1.01 0.00 0.00 64.21 63.21 3kt7 n SER 525 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3kt7 s ASN 526 N -2.93 6.59 0.46 6.43 3.04 -0.96 -4.91 114.94 122.66 3kt7 s ASN 526 Ca 0.15 1.07 0.26 0.00 0.04 0.00 0.00 52.86 54.38 3kt7 s ASN 526 Cb 0.19 -2.54 0.81 0.00 -1.54 0.00 0.00 41.25 38.17 3kt7 s ASN 526 CO 0.57 -1.17 1.78 1.55 -3.04 0.00 0.00 177.10 176.79 3kt7 h PRO 527 N 9.60 0.00 0.00 0.43 0.13 -1.88 -3.02 132.00 137.27 3kt7 h PRO 527 Ca -0.26 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.66 3kt7 h PRO 527 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 3kt7 h PRO 527 CO 1.05 0.12 -0.89 -0.44 -0.23 0.00 0.00 178.00 177.61 3kt7 h ASP 528 N 0.00 0.34 -2.91 1.44 3.32 -1.93 -3.44 116.42 113.24 3kt7 h ASP 528 Ca -0.00 -0.27 -0.57 0.00 0.02 0.00 0.00 57.03 56.21 3kt7 h ASP 528 Cb 0.81 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.22 3kt7 h ASP 528 CO 0.02 1.07 0.91 -0.63 -1.72 0.00 0.00 179.24 178.88 3kt7 s ILE 529 N -3.24 4.28 0.41 0.35 1.01 -1.14 -2.16 121.20 120.70 3kt7 s ILE 529 Ca -0.04 1.54 -0.26 0.00 0.00 0.00 0.00 60.65 61.90 3kt7 s ILE 529 Cb 0.10 -4.00 -0.08 0.00 0.01 0.00 0.00 42.46 38.48 3kt7 s ILE 529 CO 0.84 -0.14 1.27 -0.63 0.00 0.00 0.00 174.94 176.27 3kt7 s ILE 530 N 3.53 2.75 -1.45 2.92 -1.09 -0.42 -4.91 121.20 122.53 3kt7 s ILE 530 Ca 0.55 0.66 -0.13 0.00 -2.23 0.00 0.00 60.65 59.49 3kt7 s ILE 530 Cb -0.22 -3.38 -0.01 0.00 -1.58 0.00 0.00 42.46 37.28 3kt7 s ILE 530 CO 0.15 0.08 2.40 0.47 -1.23 0.00 0.00 174.94 176.81 3kt7 n ASP 531 N 0.07 5.10 -3.45 3.58 8.00 -1.26 -4.74 116.55 123.85 3kt7 n ASP 531 Ca 0.04 -2.75 -0.11 0.00 0.71 0.00 0.00 54.79 52.69 3kt7 n ASP 531 Cb 0.44 -1.59 -0.02 0.00 -0.02 0.00 0.00 41.12 39.94 3kt7 n ASP 531 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kt7 s ALA 532 N 3.04 -1.69 -0.11 2.24 0.00 -1.26 -4.40 121.76 119.58 3kt7 s ALA 532 Ca 0.53 0.71 0.03 0.00 0.00 0.00 0.00 51.96 53.23 3kt7 s ALA 532 Cb 0.15 0.69 -0.00 0.00 0.00 0.00 0.00 23.12 23.96 3kt7 s ALA 532 CO -0.07 -0.73 -0.21 0.08 0.00 0.00 0.00 175.76 174.83 3kt7 s VAL 533 N -3.46 2.27 -0.09 0.00 1.01 0.40 -4.52 120.40 116.01 3kt7 s VAL 533 Ca 0.02 -0.94 -0.25 0.00 0.00 0.00 0.00 61.98 60.82 3kt7 s VAL 533 Cb -0.01 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 3kt7 s VAL 533 CO -0.11 0.55 0.79 -0.22 0.00 0.00 0.00 175.10 176.11 3kt7 s LEU 534 N 0.44 4.28 -0.07 3.92 2.96 -0.40 -0.41 118.68 129.40 3kt7 s LEU 534 Ca -0.15 1.26 0.01 0.00 -0.22 0.00 0.00 54.13 55.04 3kt7 s LEU 534 Cb -0.17 -3.21 0.02 0.00 0.50 0.00 0.00 46.19 43.32 3kt7 s LEU 534 CO 0.06 -0.23 -0.09 -0.70 -1.32 0.00 0.00 176.35 174.08 3kt7 s GLU 535 N 1.25 1.43 0.06 1.98 2.12 -0.05 -0.79 118.70 124.71 3kt7 s GLU 535 Ca 0.40 -0.29 0.07 0.00 0.36 0.00 0.00 54.97 55.51 3kt7 s GLU 535 Cb -0.18 -1.31 -0.04 0.00 0.26 0.00 0.00 34.13 32.86 3kt7 s GLU 535 CO 0.18 -0.08 -0.15 0.20 -0.54 0.00 0.00 175.26 174.87 3kt7 s GLY 536 N 1.03 1.66 -0.11 -1.50 0.00 0.10 -0.60 107.32 107.90 3kt7 s GLY 536 Ca -0.08 -1.20 -0.02 0.00 0.00 0.00 0.00 44.72 43.41 3kt7 s GLY 536 CO -0.00 -1.12 0.04 -1.59 0.00 0.00 0.00 173.10 170.42 3kt7 s THR 537 N -1.02 0.24 -0.46 0.90 2.01 0.27 -0.83 115.64 116.75 3kt7 s THR 537 Ca 0.17 -0.03 -0.15 0.00 0.31 0.00 0.00 61.69 61.99 3kt7 s THR 537 Cb -0.11 -0.59 0.06 0.00 0.01 0.00 0.00 72.50 71.88 3kt7 s THR 537 CO 0.08 0.04 0.37 -0.22 -0.69 0.00 0.00 174.62 174.20 3kt7 s LEU 538 N 2.01 5.50 -0.02 4.42 0.20 -0.09 -0.90 118.68 129.80 3kt7 s LEU 538 Ca 0.03 -1.27 -0.23 0.00 0.69 0.00 0.00 54.13 53.34 3kt7 s LEU 538 Cb -0.14 -2.16 -0.05 0.00 -0.43 0.00 0.00 46.19 43.41 3kt7 s LEU 538 CO -0.06 -0.61 0.70 0.00 -0.29 0.00 0.00 176.35 176.09 3kt7 n LEU 540 N 3.28 2.08 -4.52 0.00 4.77 0.47 -0.62 117.00 122.46 3kt7 n LEU 540 Ca -0.03 -4.88 -0.39 0.00 -0.03 0.00 0.00 56.01 50.68 3kt7 n LEU 540 Cb 0.51 0.28 -0.11 0.00 -2.33 0.00 0.00 43.42 41.77 3kt7 n LEU 540 CO 0.46 2.14 -0.15 -0.89 -1.33 0.00 0.00 177.39 177.62 3kt7 s THR 541 N -3.29 5.10 -1.68 -5.08 2.01 -0.81 -4.24 115.64 107.64 3kt7 s THR 541 Ca 0.40 -0.20 0.26 0.00 0.31 0.00 0.00 61.69 62.46 3kt7 s THR 541 Cb 0.36 -3.58 0.25 0.00 0.01 0.00 0.00 72.50 69.55 3kt7 s THR 541 CO -0.08 0.06 1.56 -0.81 -0.69 0.00 0.00 174.62 174.67 3kt7 n PRO 542 N 5.06 0.76 -3.35 4.92 -0.04 -1.26 -3.02 135.00 138.08 3kt7 n PRO 542 Ca -0.13 -0.44 -0.22 0.00 -0.04 0.00 0.00 63.50 62.67 3kt7 n PRO 542 Cb 0.50 -1.49 -0.00 0.00 -0.04 0.00 0.00 33.50 32.47 3kt7 n PRO 542 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3kt7 s SER 543 N -2.54 6.04 0.37 3.54 1.04 -1.26 -5.02 113.70 115.86 3kt7 s SER 543 Ca 0.23 0.15 0.02 0.00 0.48 0.00 0.00 55.95 56.83 3kt7 s SER 543 Cb 0.19 -1.59 0.02 0.00 0.10 0.00 0.00 66.02 64.73 3kt7 s SER 543 CO 0.53 -0.45 0.14 0.00 0.98 0.00 0.00 173.24 174.44 3kt7 n ALA 544 N -1.79 0.44 -0.41 5.32 0.00 -1.26 -4.81 120.51 118.00 3kt7 n ALA 544 Ca -0.02 -1.56 0.00 0.00 0.00 0.00 0.00 53.44 51.86 3kt7 n ALA 544 Cb 0.57 0.76 0.00 0.00 0.00 0.00 0.00 19.45 20.78 3kt7 n ALA 544 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kt7 n GLY 545 N 0.60 0.84 0.10 0.00 0.00 -1.26 -4.72 105.19 100.75 3kt7 n GLY 545 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 3kt7 n GLY 545 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3kt7 h TRP 546 N 0.00 0.16 0.01 1.61 4.06 -1.90 0.30 115.95 120.18 3kt7 h TRP 546 Ca 0.00 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.94 3kt7 h TRP 546 Cb 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 28.12 3kt7 h TRP 546 CO 0.00 0.09 -0.08 0.93 -3.56 0.00 0.00 178.44 175.82 3kt7 h GLU 547 N 0.19 0.04 -0.81 0.49 5.08 -1.93 -1.25 114.58 116.39 3kt7 h GLU 547 Ca 0.08 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3kt7 h GLU 547 Cb 0.03 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 3kt7 h GLU 547 CO -0.06 0.90 0.39 0.66 -1.00 0.00 0.00 179.01 179.89 3kt7 h SER 548 N -0.79 1.07 0.26 1.42 4.64 -1.99 -2.68 113.55 115.48 3kt7 h SER 548 Ca -0.01 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3kt7 h SER 548 Cb 0.93 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3kt7 h SER 548 CO 0.01 0.91 -0.11 0.61 -0.87 0.00 0.00 176.83 177.39 3kt7 n GLY 549 N -0.99 -0.77 3.80 -0.77 0.00 0.09 -4.96 105.19 101.59 3kt7 n GLY 549 Ca 0.08 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 3kt7 n GLY 549 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kt7 n GLU 550 N -0.77 -0.96 -0.07 1.61 1.02 -1.01 -4.88 120.64 115.57 3kt7 n GLU 550 Ca 0.15 0.34 0.11 0.00 -0.02 0.00 0.00 57.16 57.74 3kt7 n GLU 550 Cb 0.28 -3.67 0.38 0.00 -0.02 0.00 0.00 31.44 28.42 3kt7 n GLU 550 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3kt7 n LEU 551 N -4.44 1.60 0.00 -4.62 4.77 -0.50 -4.91 117.00 108.89 3kt7 n LEU 551 Ca -0.10 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 3kt7 n LEU 551 Cb 0.58 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 3kt7 n LEU 551 CO 0.69 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 3kt7 n GLY 552 N 1.12 -0.39 3.32 -0.72 0.00 -1.26 -0.81 105.19 106.44 3kt7 n GLY 552 Ca 0.16 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.11 3kt7 n GLY 552 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kt7 n GLY 553 N 0.00 0.86 3.77 -0.02 0.00 0.31 -4.67 105.19 105.45 3kt7 n GLY 553 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3kt7 n GLY 553 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kt7 s TYR 554 N -3.07 3.09 -0.20 1.61 1.13 -1.26 -4.08 117.35 114.57 3kt7 s TYR 554 Ca 0.00 1.59 -0.19 0.00 -1.41 0.00 0.00 57.07 57.06 3kt7 s TYR 554 Cb 0.00 -3.28 -0.03 0.00 -1.10 0.00 0.00 41.96 37.55 3kt7 s TYR 554 CO 0.00 -1.10 0.54 -2.00 -2.51 0.00 0.00 175.55 170.49 3kt7 s GLU 555 N -2.49 4.19 -0.18 -3.49 2.12 0.25 -1.53 118.70 117.56 3kt7 s GLU 555 Ca 0.59 0.45 0.01 0.00 0.36 0.00 0.00 54.97 56.38 3kt7 s GLU 555 Cb -0.27 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.57 3kt7 s GLU 555 CO 0.33 -0.18 -0.19 -1.17 -0.54 0.00 0.00 175.26 173.50 3kt7 s LEU 556 N 1.74 2.09 -0.15 2.70 1.98 -0.09 -1.01 118.68 125.94 3kt7 s LEU 556 Ca 0.25 -0.63 -0.01 0.00 -2.89 0.00 0.00 54.13 50.85 3kt7 s LEU 556 Cb -0.15 -1.45 -0.01 0.00 0.66 0.00 0.00 46.19 45.23 3kt7 s LEU 556 CO 0.10 -0.00 -0.12 -0.31 -1.89 0.00 0.00 176.35 174.12 3kt7 s TYR 557 N 1.29 2.83 0.02 5.38 2.02 0.15 -1.57 117.35 127.47 3kt7 s TYR 557 Ca 0.05 -0.73 -0.00 0.00 -0.37 0.00 0.00 57.07 56.01 3kt7 s TYR 557 Cb -0.13 -1.89 -0.02 0.00 -0.40 0.00 0.00 41.96 39.53 3kt7 s TYR 557 CO -0.12 -0.29 -0.02 0.00 -1.57 0.00 0.00 175.55 173.55 3kt7 s MET 558 N 0.56 0.30 0.29 -0.62 0.23 -0.11 -0.20 119.30 119.74 3kt7 s MET 558 Ca -0.08 -0.55 -0.29 0.00 -1.03 0.00 0.00 55.69 53.74 3kt7 s MET 558 Cb -0.16 0.11 -0.10 0.00 -1.53 0.00 0.00 34.83 33.16 3kt7 s MET 558 CO 0.03 -0.05 1.12 -1.64 -2.03 0.00 0.00 175.02 172.46 3kt7 s MET 559 N -1.34 4.58 0.00 3.16 -1.94 0.92 -0.10 119.30 124.59 3kt7 s MET 559 Ca -0.15 1.85 -0.02 0.00 -1.71 0.00 0.00 55.69 55.66 3kt7 s MET 559 Cb -0.09 -3.15 -0.08 0.00 2.01 0.00 0.00 34.83 33.52 3kt7 s MET 559 CO -0.01 0.15 2.31 -3.47 -0.01 0.00 0.00 175.02 173.98 3kt7 n ASP 560 N 1.09 4.78 -3.92 3.03 2.03 -1.25 -4.86 116.55 117.44 3kt7 n ASP 560 Ca -0.01 -2.31 -0.55 0.00 0.52 0.00 0.00 54.79 52.44 3kt7 n ASP 560 Cb 0.45 -1.10 -0.08 0.00 -0.72 0.00 0.00 41.12 39.66 3kt7 n ASP 560 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3kt7 n ASP 586 N 1.88 0.80 0.11 1.67 4.64 -1.26 -5.13 116.55 119.26 3kt7 n ASP 586 Ca 0.13 0.99 0.13 0.00 -1.38 0.00 0.00 54.79 54.65 3kt7 n ASP 586 Cb 0.58 -0.74 0.31 0.00 -1.04 0.00 0.00 41.12 40.22 3kt7 n ASP 586 CO 0.00 0.00 0.00 0.77 -0.82 0.00 0.00 177.20 177.15 3kt7 h SER 587 N 3.83 0.00 -2.99 1.67 4.64 -1.98 -3.45 113.55 115.27 3kt7 h SER 587 Ca -0.38 -0.05 -0.56 0.00 -0.47 0.00 0.00 61.79 60.33 3kt7 h SER 587 Cb 1.15 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.21 3kt7 h SER 587 CO 0.76 0.03 0.82 -0.69 -0.87 0.00 0.00 176.83 176.87 3kt7 s VAL 588 N -3.14 4.27 -0.14 0.95 1.01 -1.26 -0.05 120.40 122.03 3kt7 s VAL 588 Ca 0.09 1.56 -0.20 0.00 0.00 0.00 0.00 61.98 63.43 3kt7 s VAL 588 Cb 0.12 -4.01 -0.24 0.00 0.00 0.00 0.00 36.38 32.25 3kt7 s VAL 588 CO 0.64 -0.08 0.48 -0.07 0.00 0.00 0.00 175.10 176.07 3kt7 h LEU 589 N 9.06 0.19 -7.52 3.92 3.38 -0.90 -3.48 115.31 119.96 3kt7 h LEU 589 Ca -0.30 -0.77 -0.27 0.00 0.09 0.00 0.00 57.88 56.64 3kt7 h LEU 589 Cb 1.13 -0.06 -0.32 0.00 0.09 0.00 0.00 40.66 41.49 3kt7 h LEU 589 CO 0.93 1.48 -0.68 -0.63 0.09 0.00 0.00 178.44 179.63 3kt7 s ILE 590 N -2.40 -0.05 -0.35 1.22 1.01 -0.91 -4.99 121.20 114.73 3kt7 s ILE 590 Ca -0.23 0.17 -0.00 0.00 0.00 0.00 0.00 60.65 60.59 3kt7 s ILE 590 Cb 0.04 -0.13 0.12 0.00 0.01 0.00 0.00 42.46 42.50 3kt7 s ILE 590 CO 0.70 0.07 0.16 0.21 0.00 0.00 0.00 174.94 176.07 3kt7 s ASN 591 N 0.91 3.74 -0.30 3.58 3.84 -1.25 -0.68 114.94 124.79 3kt7 s ASN 591 Ca -0.07 -1.98 0.03 0.00 0.21 0.00 0.00 52.86 51.04 3kt7 s ASN 591 Cb -0.10 -0.81 0.08 0.00 -0.55 0.00 0.00 41.25 39.86 3kt7 s ASN 591 CO -0.03 -0.36 -0.03 -1.81 -2.79 0.00 0.00 177.10 172.07 3kt7 s ASP 592 N 1.20 4.62 0.66 -4.21 1.11 -0.18 -4.95 116.67 114.93 3kt7 s ASP 592 Ca 0.13 -1.69 -0.17 0.00 0.18 0.00 0.00 52.55 50.99 3kt7 s ASP 592 Cb -0.20 -1.60 -0.01 0.00 1.07 0.00 0.00 42.92 42.18 3kt7 s ASP 592 CO -0.15 -0.28 1.11 -2.65 1.18 0.00 0.00 175.17 174.39 3kt7 n PRO 593 N 4.38 0.86 -1.74 8.23 -0.02 -1.26 -0.59 135.00 144.86 3kt7 n PRO 593 Ca -0.07 0.35 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 3kt7 n PRO 593 Cb 0.42 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.55 3kt7 n PRO 593 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3kt7 n PRO 594 N -1.70 2.49 -4.13 0.52 -0.02 -1.26 -4.85 135.00 126.04 3kt7 n PRO 594 Ca 0.15 0.88 -0.18 0.00 -2.02 0.00 0.00 63.50 62.32 3kt7 n PRO 594 Cb 0.48 -2.58 -0.07 0.00 -0.02 0.00 0.00 33.50 31.32 3kt7 n PRO 594 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kt7 n ALA 595 N 0.98 0.54 -2.66 3.55 0.00 -1.26 -4.90 120.51 116.75 3kt7 n ALA 595 Ca 0.05 -1.85 -0.37 0.00 0.00 0.00 0.00 53.44 51.27 3kt7 n ALA 595 Cb 0.37 1.50 -0.09 0.00 0.00 0.00 0.00 19.45 21.22 3kt7 n ALA 595 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 3kt7 s TRP 596 N -3.26 3.32 -0.79 0.00 -0.11 -1.17 -1.92 118.94 115.01 3kt7 s TRP 596 Ca 0.37 0.34 -0.02 0.00 1.22 0.00 0.00 56.10 58.01 3kt7 s TRP 596 Cb 0.01 -2.36 0.00 0.00 -1.50 0.00 0.00 33.47 29.62 3kt7 s TRP 596 CO 0.26 0.01 0.67 -1.71 -4.62 0.00 0.00 176.95 171.57 3kt7 n ASN 597 N 4.45 -2.89 -4.64 5.86 4.05 0.20 -4.64 115.26 117.64 3kt7 n ASN 597 Ca -0.13 -0.38 -0.30 0.00 0.45 0.00 0.00 54.58 54.22 3kt7 n ASN 597 Cb 0.52 -3.42 -0.09 0.00 1.23 0.00 0.00 39.78 38.02 3kt7 n ASN 597 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 3kt7 s THR 598 N -3.22 3.78 -0.17 -0.44 -4.23 -1.06 -1.48 115.64 108.81 3kt7 s THR 598 Ca 0.12 -1.05 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 3kt7 s THR 598 Cb -0.05 -2.77 0.04 0.00 1.34 0.00 0.00 72.50 71.06 3kt7 s THR 598 CO 0.46 0.15 -0.09 0.12 -0.54 0.00 0.00 174.62 174.73 3kt7 s PHE 599 N -1.24 2.05 -0.14 3.99 5.36 0.47 -0.70 117.98 127.76 3kt7 s PHE 599 Ca 0.23 -1.30 -0.07 0.00 -0.96 0.00 0.00 56.93 54.83 3kt7 s PHE 599 Cb -0.11 -1.48 -0.04 0.00 -0.34 0.00 0.00 43.02 41.04 3kt7 s PHE 599 CO 0.15 -0.67 0.10 -0.80 -1.46 0.00 0.00 175.22 172.54 3kt7 s ASN 600 N 1.52 6.03 -0.08 6.13 0.01 -0.08 -0.17 114.94 128.30 3kt7 s ASN 600 Ca 0.01 0.29 0.01 0.00 -0.71 0.00 0.00 52.86 52.46 3kt7 s ASN 600 Cb -0.15 -1.96 0.02 0.00 0.41 0.00 0.00 41.25 39.56 3kt7 s ASN 600 CO -0.08 0.31 -0.09 -0.22 -1.51 0.00 0.00 177.10 175.51 3kt7 s LEU 601 N -0.44 1.39 -0.07 0.60 2.96 0.07 -0.56 118.68 122.64 3kt7 s LEU 601 Ca 0.11 -0.27 0.01 0.00 -0.22 0.00 0.00 54.13 53.75 3kt7 s LEU 601 Cb -0.12 -0.77 0.02 0.00 0.50 0.00 0.00 46.19 45.82 3kt7 s LEU 601 CO 0.02 -0.05 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.25 3kt7 s VAL 602 N 1.15 0.77 -0.53 1.68 1.01 0.23 -0.21 120.40 124.50 3kt7 s VAL 602 Ca -0.06 -0.21 -0.25 0.00 0.00 0.00 0.00 61.98 61.46 3kt7 s VAL 602 Cb -0.14 -0.78 0.04 0.00 0.00 0.00 0.00 36.38 35.49 3kt7 s VAL 602 CO -0.02 0.29 0.97 -0.22 0.00 0.00 0.00 175.10 176.13 3kt7 s LEU 603 N 1.17 3.99 -0.27 3.92 2.96 -0.50 -0.87 118.68 129.08 3kt7 s LEU 603 Ca -0.06 -0.18 -0.17 0.00 -0.22 0.00 0.00 54.13 53.49 3kt7 s LEU 603 Cb -0.14 -2.96 -0.03 0.00 0.50 0.00 0.00 46.19 43.56 3kt7 s LEU 603 CO -0.01 -1.22 0.49 -0.13 -1.32 0.00 0.00 176.35 174.15 3kt7 s ARG 604 N 4.05 4.00 0.95 1.98 0.52 0.45 -4.92 118.95 125.98 3kt7 s ARG 604 Ca 0.34 0.21 -0.14 0.00 -0.52 0.00 0.00 55.73 55.61 3kt7 s ARG 604 Cb -0.11 -3.67 0.21 0.00 0.52 0.00 0.00 34.95 31.90 3kt7 s ARG 604 CO 0.22 -0.37 1.29 -0.40 0.02 0.00 0.00 175.30 176.05 3kt7 n ASP 605 N 5.53 0.31 -0.20 0.23 5.68 -1.26 -0.46 116.55 126.37 3kt7 n ASP 605 Ca -0.05 -1.59 0.12 0.00 -0.50 0.00 0.00 54.79 52.76 3kt7 n ASP 605 Cb 0.50 -0.97 0.42 0.00 -1.14 0.00 0.00 41.12 39.93 3kt7 n ASP 605 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3kt7 h GLU 606 N 0.00 0.58 0.00 0.11 5.08 -1.96 -3.02 114.58 115.37 3kt7 h GLU 606 Ca -0.42 -0.03 -0.26 0.00 -1.00 0.00 0.00 59.36 57.65 3kt7 h GLU 606 Cb 1.20 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 3kt7 h GLU 606 CO 0.32 0.38 -1.43 0.66 -1.00 0.00 0.00 179.01 177.94 3kt7 h SER 607 N 0.60 0.00 -1.88 1.42 4.64 -1.97 -3.40 113.55 112.96 3kt7 h SER 607 Ca 0.38 -0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 61.05 3kt7 h SER 607 Cb 0.64 -0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.77 3kt7 h SER 607 CO -0.14 1.00 0.81 0.52 -0.87 0.00 0.00 176.83 178.15 3kt7 n VAL 608 N -3.16 0.22 -3.87 0.95 0.31 -1.14 -3.90 118.33 107.74 3kt7 n VAL 608 Ca -0.10 -0.04 -0.33 0.00 -0.01 0.00 0.00 64.34 63.86 3kt7 n VAL 608 Cb 1.01 -1.36 -0.05 0.00 -0.91 0.00 0.00 33.84 32.53 3kt7 n VAL 608 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3kt7 s LEU 609 N 2.23 4.36 0.00 7.52 1.43 0.85 -4.26 118.68 130.82 3kt7 s LEU 609 Ca 0.88 0.39 -0.02 0.00 -1.03 0.00 0.00 54.13 54.35 3kt7 s LEU 609 Cb -0.85 -2.74 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 3kt7 s LEU 609 CO 0.50 0.23 0.02 -0.70 0.23 0.00 0.00 176.35 176.64 3kt7 s GLU 610 N -2.07 0.21 0.21 1.70 -6.30 -0.59 -0.94 118.70 110.93 3kt7 s GLU 610 Ca 0.30 -0.27 -0.19 0.00 -2.50 0.00 0.00 54.97 52.30 3kt7 s GLU 610 Cb -0.13 0.08 0.03 0.00 0.00 0.00 0.00 34.13 34.12 3kt7 s GLU 610 CO 0.20 -0.04 0.57 -0.59 0.02 0.00 0.00 175.26 175.43 3kt7 s PHE 611 N -0.77 -0.20 -0.21 5.30 -0.71 -0.61 -1.89 117.98 118.90 3kt7 s PHE 611 Ca -0.08 -0.14 -0.04 0.00 -1.04 0.00 0.00 56.93 55.63 3kt7 s PHE 611 Cb -0.05 0.48 -0.01 0.00 -1.21 0.00 0.00 43.02 42.23 3kt7 s PHE 611 CO -0.00 -0.97 -0.05 0.08 -1.34 0.00 0.00 175.22 172.94 3kt7 s VAL 612 N -3.86 3.37 0.33 -2.49 1.01 -1.26 -0.92 120.40 116.58 3kt7 s VAL 612 Ca 0.08 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.28 3kt7 s VAL 612 Cb -0.02 -2.53 -0.10 0.00 0.00 0.00 0.00 36.38 33.73 3kt7 s VAL 612 CO -0.03 0.43 1.33 -0.75 0.00 0.00 0.00 175.10 176.09 3kt7 s LYS 613 N 1.36 4.33 -0.04 2.72 2.47 -0.59 -1.24 119.74 128.76 3kt7 s LYS 613 Ca 0.04 2.25 -0.28 0.00 -1.56 0.00 0.00 55.97 56.43 3kt7 s LYS 613 Cb -0.14 -3.07 -0.14 0.00 -1.46 0.00 0.00 37.83 33.02 3kt7 s LYS 613 CO -0.03 -0.24 0.77 0.98 0.16 0.00 0.00 175.35 177.00 3kt7 n TYR 614 N 0.91 0.52 -3.09 4.03 9.36 -1.26 -0.53 117.16 127.11 3kt7 n TYR 614 Ca 0.01 0.73 -0.41 0.00 3.32 0.00 0.00 57.90 61.55 3kt7 n TYR 614 Cb 0.41 -1.44 -0.06 0.00 -0.63 0.00 0.00 39.34 37.63 3kt7 n TYR 614 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 3kt7 s VAL 615 N 0.23 4.97 0.57 2.97 1.01 -0.72 -3.08 120.40 126.35 3kt7 s VAL 615 Ca 0.63 1.18 -0.21 0.00 0.00 0.00 0.00 61.98 63.58 3kt7 s VAL 615 Cb -0.88 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 31.51 3kt7 s VAL 615 CO 0.41 0.02 1.36 -0.55 0.00 0.00 0.00 175.10 176.33 3kt7 s SER 616 N 1.46 5.07 0.60 3.32 0.15 0.01 -0.16 113.70 124.14 3kt7 s SER 616 Ca 0.27 2.76 0.29 0.00 0.70 0.00 0.00 55.95 59.97 3kt7 s SER 616 Cb -0.15 -2.63 1.60 0.00 -1.71 0.00 0.00 66.02 63.12 3kt7 s SER 616 CO 0.08 -1.71 2.01 -0.50 1.20 0.00 0.00 173.24 174.33 3kt7 h TRP 617 N 1.22 0.00 0.00 3.44 4.06 -1.90 -1.78 115.95 120.99 3kt7 h TRP 617 Ca -0.51 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.44 3kt7 h TRP 617 Cb 1.31 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.47 3kt7 h TRP 617 CO 0.44 0.00 0.00 0.43 -3.56 0.00 0.00 178.44 175.75 3kt7 n SER 618 N -3.68 0.27 -4.77 -3.49 7.64 -1.26 -4.80 113.62 103.53 3kt7 n SER 618 Ca 0.04 0.54 -0.40 0.00 1.01 0.00 0.00 58.87 60.05 3kt7 n SER 618 Cb 0.45 -0.60 0.01 0.00 -1.01 0.00 0.00 64.21 63.06 3kt7 n SER 618 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kt7 s ALA 619 N -3.06 3.30 -1.82 -0.43 0.00 -0.67 -4.92 121.76 114.16 3kt7 s ALA 619 Ca 0.11 1.42 0.25 0.00 0.00 0.00 0.00 51.96 53.74 3kt7 s ALA 619 Cb 0.15 -3.56 0.58 0.00 0.00 0.00 0.00 23.12 20.28 3kt7 s ALA 619 CO 0.49 -1.07 1.45 1.63 0.00 0.00 0.00 175.76 178.26 3kt7 n LYS 620 N 0.01 0.92 -3.93 0.00 5.02 -1.26 -4.89 118.16 114.03 3kt7 n LYS 620 Ca 0.04 -0.61 -0.09 0.00 -2.02 0.00 0.00 58.31 55.63 3kt7 n LYS 620 Cb 0.42 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.89 3kt7 n LYS 620 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3kt7 s SER 621 N -2.50 -0.11 0.79 4.39 1.04 -1.26 -4.96 113.70 111.09 3kt7 s SER 621 Ca 0.23 -0.81 -0.12 0.00 0.48 0.00 0.00 55.95 55.73 3kt7 s SER 621 Cb 0.19 0.57 0.07 0.00 0.10 0.00 0.00 66.02 66.95 3kt7 s SER 621 CO 0.53 -1.09 1.13 -0.44 0.98 0.00 0.00 173.24 174.35 3kt7 s SER 622 N -2.98 4.07 -0.17 7.02 0.01 -1.26 -4.64 113.70 115.76 3kt7 s SER 622 Ca 0.18 2.05 -0.29 0.00 1.31 0.00 0.00 55.95 59.20 3kt7 s SER 622 Cb -0.00 -2.55 -0.00 0.00 0.21 0.00 0.00 66.02 63.67 3kt7 s SER 622 CO 0.05 -2.33 1.09 -0.60 0.41 0.00 0.00 173.24 171.86 3kt7 s ARG 623 N -4.54 4.30 -0.11 12.44 3.52 -0.54 -4.72 118.95 129.30 3kt7 s ARG 623 Ca 0.66 1.46 -0.01 0.00 -0.13 0.00 0.00 55.73 57.71 3kt7 s ARG 623 Cb -0.21 -3.63 -0.03 0.00 -1.56 0.00 0.00 34.95 29.52 3kt7 s ARG 623 CO 0.53 -0.56 -0.07 -1.58 -0.81 0.00 0.00 175.30 172.80 3kt7 s TRP 624 N 2.90 2.93 0.27 5.12 0.52 -1.26 -0.21 118.94 129.21 3kt7 s TRP 624 Ca 0.48 -0.22 -0.11 0.00 0.02 0.00 0.00 56.10 56.27 3kt7 s TRP 624 Cb -0.18 -1.81 0.00 0.00 -1.15 0.00 0.00 33.47 30.33 3kt7 s TRP 624 CO 0.12 0.10 0.50 0.16 0.02 0.00 0.00 176.95 177.84 3kt7 s ASP 625 N -0.19 0.10 -0.16 2.95 1.47 -0.61 -0.39 116.67 119.84 3kt7 s ASP 625 Ca 0.02 -1.05 0.01 0.00 1.18 0.00 0.00 52.55 52.71 3kt7 s ASP 625 Cb -0.13 0.62 0.01 0.00 -0.34 0.00 0.00 42.92 43.08 3kt7 s ASP 625 CO 0.03 -1.21 -0.19 -0.69 0.68 0.00 0.00 175.17 173.79 3kt7 s VAL 626 N -3.72 2.24 -0.16 2.11 1.01 -0.09 -0.76 120.40 121.04 3kt7 s VAL 626 Ca 0.24 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.26 3kt7 s VAL 626 Cb -0.01 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 3kt7 s VAL 626 CO 0.11 0.53 0.03 -0.75 0.00 0.00 0.00 175.10 175.02 3kt7 s LYS 627 N 1.04 3.77 -0.02 2.72 2.47 0.10 -0.91 119.74 128.91 3kt7 s LYS 627 Ca -0.01 -0.40 0.03 0.00 -1.56 0.00 0.00 55.97 54.03 3kt7 s LYS 627 Cb -0.14 -3.08 0.00 0.00 -1.46 0.00 0.00 37.83 33.15 3kt7 s LYS 627 CO -0.06 0.33 -0.09 -1.64 0.16 0.00 0.00 175.35 174.05 3kt7 s MET 628 N 0.19 0.91 -0.01 4.03 -1.94 -0.01 -0.49 119.30 121.97 3kt7 s MET 628 Ca 0.02 -0.31 0.01 0.00 -1.71 0.00 0.00 55.69 53.70 3kt7 s MET 628 Cb -0.13 -0.86 0.01 0.00 2.01 0.00 0.00 34.83 35.86 3kt7 s MET 628 CO 0.01 0.13 -0.02 0.15 -0.01 0.00 0.00 175.02 175.28 3kt7 s LYS 629 N 0.10 0.33 -0.02 2.03 1.02 -0.28 0.01 119.74 122.94 3kt7 s LYS 629 Ca -0.02 -0.06 0.02 0.00 0.02 0.00 0.00 55.97 55.93 3kt7 s LYS 629 Cb -0.07 -0.38 0.00 0.00 -0.52 0.00 0.00 37.83 36.86 3kt7 s LYS 629 CO 0.00 -0.00 -0.05 -1.58 -0.92 0.00 0.00 175.35 172.80 3kt7 s TRP 630 N 0.34 0.56 0.42 3.18 0.51 0.03 -0.77 118.94 123.20 3kt7 s TRP 630 Ca -0.03 -0.11 -0.23 0.00 -2.12 0.00 0.00 56.10 53.61 3kt7 s TRP 630 Cb -0.06 -0.42 -0.09 0.00 -0.81 0.00 0.00 33.47 32.08 3kt7 s TRP 630 CO -0.01 -0.06 1.01 -0.51 -0.51 0.00 0.00 176.95 176.87 3kt7 s ASP 631 N 0.21 6.78 0.02 2.95 1.11 -1.24 -1.27 116.67 125.24 3kt7 s ASP 631 Ca -0.02 1.91 0.01 0.00 0.18 0.00 0.00 52.55 54.62 3kt7 s ASP 631 Cb -0.06 -2.57 -0.02 0.00 1.07 0.00 0.00 42.92 41.34 3kt7 s ASP 631 CO -0.00 -0.47 -0.04 0.68 1.18 0.00 0.00 175.17 176.51 3kt7 s VAL 632 N -1.84 0.25 0.20 -1.27 -7.23 -1.26 -0.86 120.40 108.38 3kt7 s VAL 632 Ca 0.60 -0.87 0.11 0.00 -1.81 0.00 0.00 61.98 60.00 3kt7 s VAL 632 Cb -0.17 -0.36 -0.04 0.00 0.56 0.00 0.00 36.38 36.37 3kt7 s VAL 632 CO 0.22 -0.40 -0.18 -1.59 -0.31 0.00 0.00 175.10 172.84 3kt7 s LYS 633 N -1.34 1.73 0.10 4.82 -2.85 0.19 -1.30 119.74 121.10 3kt7 s LYS 633 Ca -0.12 -1.46 -0.31 0.00 -1.00 0.00 0.00 55.97 53.08 3kt7 s LYS 633 Cb -0.09 -1.95 -0.07 0.00 -2.06 0.00 0.00 37.83 33.66 3kt7 s LYS 633 CO -0.00 0.40 1.27 -1.54 0.10 0.00 0.00 175.35 175.58 3kt7 s SER 634 N -2.82 6.98 0.00 0.03 1.04 -0.92 -0.93 113.70 117.08 3kt7 s SER 634 Ca 0.23 2.17 0.00 0.00 0.48 0.00 0.00 55.95 58.83 3kt7 s SER 634 Cb -0.08 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.46 3kt7 s SER 634 CO 0.12 -0.53 0.29 0.00 0.98 0.00 0.00 173.24 174.11