#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ffq s ALA 25 N 0.00 -0.48 0.94 0.00 0.00 -1.26 -4.70 121.76 116.27 1ffq s ALA 25 Ca 0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 51.96 51.53 1ffq s ALA 25 Cb 0.00 -3.18 0.16 0.00 0.00 0.00 0.00 23.12 20.10 1ffq s ALA 25 CO 0.00 -3.92 1.15 -2.14 0.00 0.00 0.00 175.76 170.84 1ffq s PRO 26 N -4.60 0.89 0.94 0.00 0.02 -1.26 -4.78 135.00 126.22 1ffq s PRO 26 Ca 0.68 0.22 -0.11 0.00 0.02 0.00 0.00 61.00 61.82 1ffq s PRO 26 Cb -0.23 -1.82 0.16 0.00 0.02 0.00 0.00 34.50 32.64 1ffq s PRO 26 CO 0.63 -2.35 1.11 0.20 -0.33 0.00 0.00 177.00 176.26 1ffq s GLY 27 N -4.06 1.65 -0.32 0.52 0.00 0.07 -4.71 107.32 100.48 1ffq s GLY 27 Ca 0.65 0.36 -0.26 0.00 0.00 0.00 0.00 44.72 45.47 1ffq s GLY 27 CO 0.54 0.84 0.94 1.25 0.00 0.00 0.00 173.10 176.66 1ffq s LYS 28 N -4.67 3.99 0.62 2.90 2.20 -1.26 -4.76 119.74 118.76 1ffq s LYS 28 Ca 0.66 0.81 -0.16 0.00 -0.36 0.00 0.00 55.97 56.92 1ffq s LYS 28 Cb -0.22 -3.74 -0.02 0.00 -1.51 0.00 0.00 37.83 32.34 1ffq s LYS 28 CO 0.59 -0.81 1.11 -1.25 -0.36 0.00 0.00 175.35 174.63 1ffq s PRO 29 N 3.33 3.01 -0.23 4.03 0.04 -1.26 -4.68 135.00 139.25 1ffq s PRO 29 Ca 0.39 1.45 -0.05 0.00 0.04 0.00 0.00 61.00 62.83 1ffq s PRO 29 Cb -0.13 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 1ffq s PRO 29 CO 0.14 -1.09 -0.02 0.99 0.04 0.00 0.00 177.00 177.07 1ffq s THR 30 N -2.16 3.59 0.26 1.26 2.01 -0.15 -4.27 115.64 116.18 1ffq s THR 30 Ca 0.69 -0.42 -0.30 0.00 0.31 0.00 0.00 61.69 61.96 1ffq s THR 30 Cb -0.21 -2.65 -0.11 0.00 0.01 0.00 0.00 72.50 69.54 1ffq s THR 30 CO 0.36 0.41 1.59 -0.63 -0.69 0.00 0.00 174.62 175.66 1ffq s ILE 31 N 1.49 2.19 0.40 1.82 1.01 -1.26 -1.31 121.20 125.53 1ffq s ILE 31 Ca 0.06 0.15 -0.25 0.00 0.00 0.00 0.00 60.65 60.61 1ffq s ILE 31 Cb -0.14 -3.10 -0.08 0.00 0.01 0.00 0.00 42.46 39.14 1ffq s ILE 31 CO -0.02 0.02 1.14 0.00 0.00 0.00 0.00 174.94 176.09 1ffq s ALA 32 N 0.29 3.14 0.36 9.38 0.00 0.20 -4.88 121.76 130.25 1ffq s ALA 32 Ca 0.65 0.91 -0.28 0.00 0.00 0.00 0.00 51.96 53.24 1ffq s ALA 32 Cb -0.47 -3.36 -0.11 0.00 0.00 0.00 0.00 23.12 19.18 1ffq s ALA 32 CO 0.43 -0.47 1.45 0.91 0.00 0.00 0.00 175.76 178.08 1ffq n TRP 33 N 0.04 2.81 0.00 0.00 7.02 -1.26 -4.72 117.44 121.33 1ffq n TRP 33 Ca 0.04 0.45 0.00 0.00 -1.02 0.00 0.00 57.50 56.98 1ffq n TRP 33 Cb 0.47 -2.51 0.00 0.00 -2.42 0.00 0.00 31.31 26.85 1ffq n TRP 33 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1ffq n GLY 34 N 0.70 0.83 3.63 6.99 0.00 -1.26 -4.98 105.19 111.10 1ffq n GLY 34 Ca 0.03 -0.88 -0.49 0.00 0.00 0.00 0.00 46.02 44.68 1ffq n GLY 34 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ffq n ASN 35 N 0.00 2.43 -0.06 1.61 5.15 -1.26 -4.90 115.26 118.23 1ffq n ASN 35 Ca 0.00 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.09 1ffq n ASN 35 Cb 0.00 -1.32 0.01 0.00 -0.53 0.00 0.00 39.78 37.94 1ffq n ASN 35 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1ffq n THR 36 N 2.94 0.97 -4.33 -0.44 -2.24 -1.26 -4.91 114.28 105.01 1ffq n THR 36 Ca 0.17 -0.98 -0.34 0.00 -2.27 0.00 0.00 64.05 60.63 1ffq n THR 36 Cb 0.25 0.52 -0.15 0.00 -2.10 0.00 0.00 70.33 68.85 1ffq n THR 36 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ffq s LYS 37 N -0.97 3.25 0.15 -0.78 1.02 -1.26 -0.30 119.74 120.85 1ffq s LYS 37 Ca 0.02 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.30 1ffq s LYS 37 Cb 0.01 -2.72 -0.04 0.00 -0.52 0.00 0.00 37.83 34.55 1ffq s LYS 37 CO 0.01 -0.05 0.03 -0.06 -0.92 0.00 0.00 175.35 174.36 1ffq s PHE 38 N 1.00 1.03 -0.05 3.18 0.08 0.32 -4.98 117.98 118.57 1ffq s PHE 38 Ca -0.01 -1.13 -0.04 0.00 0.12 0.00 0.00 56.93 55.87 1ffq s PHE 38 Cb -0.15 -0.59 0.02 0.00 -0.57 0.00 0.00 43.02 41.73 1ffq s PHE 38 CO -0.02 -0.36 0.13 0.00 -0.10 0.00 0.00 175.22 174.86 1ffq s ALA 39 N -3.85 -0.30 -0.00 5.36 0.00 -1.26 -0.23 121.76 121.47 1ffq s ALA 39 Ca 0.24 0.40 -0.15 0.00 0.00 0.00 0.00 51.96 52.45 1ffq s ALA 39 Cb 0.07 -0.24 -0.34 0.00 0.00 0.00 0.00 23.12 22.61 1ffq s ALA 39 CO 0.03 -0.07 0.87 0.82 0.00 0.00 0.00 175.76 177.41 1ffq h ILE 40 N 5.12 1.16 -3.50 0.00 2.04 -1.43 -3.40 117.51 117.51 1ffq h ILE 40 Ca -0.28 -2.62 -0.71 0.00 1.00 0.00 0.00 64.86 62.25 1ffq h ILE 40 Cb 1.19 2.95 -0.27 0.00 -0.74 0.00 0.00 36.82 39.95 1ffq h ILE 40 CO 0.43 0.82 -0.49 -0.69 0.00 0.00 0.00 178.15 178.23 1ffq s VAL 41 N -2.58 4.30 0.29 1.67 1.01 -1.26 -1.01 120.40 122.82 1ffq s VAL 41 Ca -0.12 -1.24 -0.14 0.00 0.00 0.00 0.00 61.98 60.48 1ffq s VAL 41 Cb 0.04 -3.56 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 1ffq s VAL 41 CO 0.91 -0.42 0.70 -1.61 0.00 0.00 0.00 175.10 174.68 1ffq s GLU 42 N 1.46 3.99 -0.16 2.72 2.02 0.73 -4.88 118.70 124.58 1ffq s GLU 42 Ca 0.02 0.62 0.01 0.00 0.02 0.00 0.00 54.97 55.64 1ffq s GLU 42 Cb -0.22 -2.53 0.01 0.00 0.10 0.00 0.00 34.13 31.50 1ffq s GLU 42 CO 0.03 0.22 -0.19 0.08 0.02 0.00 0.00 175.26 175.42 1ffq s VAL 43 N -1.90 2.26 -0.21 2.63 1.01 -1.26 -0.57 120.40 122.36 1ffq s VAL 43 Ca 0.51 -0.90 -0.27 0.00 0.00 0.00 0.00 61.98 61.33 1ffq s VAL 43 Cb -0.11 -1.93 -0.00 0.00 0.00 0.00 0.00 36.38 34.34 1ffq s VAL 43 CO 0.18 0.53 0.91 -0.62 0.00 0.00 0.00 175.10 176.11 1ffq s ASP 44 N 0.96 6.98 0.00 3.32 -1.08 0.67 -4.93 116.67 122.60 1ffq s ASP 44 Ca -0.03 1.22 0.24 0.00 -0.52 0.00 0.00 52.55 53.46 1ffq s ASP 44 Cb -0.15 -2.48 1.12 0.00 -1.46 0.00 0.00 42.92 39.95 1ffq s ASP 44 CO -0.04 -0.53 1.80 0.00 0.52 0.00 0.00 175.17 176.91 1ffq n GLN 45 N 5.85 0.14 -2.96 4.34 1.13 -1.26 -3.56 117.38 121.06 1ffq n GLN 45 Ca 0.08 0.07 -0.23 0.00 -1.94 0.00 0.00 57.00 54.98 1ffq n GLN 45 Cb 0.47 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.30 1ffq n GLN 45 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ffq n ALA 46 N -1.42 3.76 -2.73 -1.58 0.00 -1.26 -5.03 120.51 112.25 1ffq n ALA 46 Ca 0.08 -4.14 -0.14 0.00 0.00 0.00 0.00 53.44 49.24 1ffq n ALA 46 Cb 0.25 -0.79 -0.11 0.00 0.00 0.00 0.00 19.45 18.80 1ffq n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ffq s ALA 47 N -3.12 0.80 0.00 0.00 0.00 -1.23 -5.03 121.76 113.18 1ffq s ALA 47 Ca 0.44 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1ffq s ALA 47 Cb 0.33 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.46 1ffq s ALA 47 CO -0.11 0.01 0.00 0.25 0.00 0.00 0.00 175.76 175.90 1ffq n THR 48 N 1.21 0.00 -3.30 0.00 -2.24 -1.26 -4.92 114.28 103.77 1ffq n THR 48 Ca -0.21 -0.32 -0.38 0.00 -2.27 0.00 0.00 64.05 60.87 1ffq n THR 48 Cb 0.55 0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 69.59 1ffq n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ffq s ALA 49 N -0.99 3.54 0.27 6.98 0.00 -1.26 -4.10 121.76 126.20 1ffq s ALA 49 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 51.96 51.89 1ffq s ALA 49 Cb 0.00 -2.64 0.54 0.00 0.00 0.00 0.00 23.12 21.03 1ffq s ALA 49 CO 0.00 0.23 1.77 -0.92 0.00 0.00 0.00 175.76 176.84 1ffq h TYR 50 N 5.50 0.83 -0.12 0.00 3.20 -0.73 -0.23 116.97 125.43 1ffq h TYR 50 Ca -0.46 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.46 1ffq h TYR 50 Cb 1.20 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 1ffq h TYR 50 CO 0.66 0.22 0.08 -0.91 -1.64 0.00 0.00 178.16 176.58 1ffq h ASN 51 N 0.68 0.05 0.74 -2.11 2.35 -1.84 -2.27 115.58 113.19 1ffq h ASN 51 Ca 0.47 -0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 56.15 1ffq h ASN 51 Cb 0.64 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 1ffq h ASN 51 CO -0.35 0.04 -1.32 0.59 -1.65 0.00 0.00 177.43 174.74 1ffq n ASN 52 N -4.51 0.73 -0.09 5.81 5.03 -0.22 -4.39 115.26 117.62 1ffq n ASN 52 Ca -0.01 0.30 -0.12 0.00 0.87 0.00 0.00 54.58 55.63 1ffq n ASN 52 Cb 0.16 0.53 0.01 0.00 -1.02 0.00 0.00 39.78 39.46 1ffq n ASN 52 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 1ffq h LEU 53 N 0.00 0.90 -8.63 3.41 5.85 -0.60 -3.39 115.31 112.85 1ffq h LEU 53 Ca -0.08 -0.41 -0.68 0.00 0.84 0.00 0.00 57.88 57.55 1ffq h LEU 53 Cb 1.26 -0.25 -0.28 0.00 0.37 0.00 0.00 40.66 41.76 1ffq h LEU 53 CO 0.02 1.18 -0.81 -0.69 -0.34 0.00 0.00 178.44 177.80 1ffq s VAL 54 N -4.34 2.69 -0.22 1.05 1.01 -1.20 -0.24 120.40 119.14 1ffq s VAL 54 Ca -0.10 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 1ffq s VAL 54 Cb 0.11 -2.06 0.06 0.00 0.00 0.00 0.00 36.38 34.50 1ffq s VAL 54 CO 0.87 0.56 -0.00 -0.75 0.00 0.00 0.00 175.10 175.77 1ffq s LYS 55 N -0.07 1.13 -0.17 2.72 2.20 0.26 -4.91 119.74 120.90 1ffq s LYS 55 Ca -0.04 -0.77 -0.29 0.00 -0.36 0.00 0.00 55.97 54.51 1ffq s LYS 55 Cb -0.14 -2.35 -0.01 0.00 -1.51 0.00 0.00 37.83 33.82 1ffq s LYS 55 CO 0.04 -0.65 1.21 0.08 -0.36 0.00 0.00 175.35 175.66 1ffq s VAL 56 N 1.60 4.38 0.40 4.02 1.01 -1.26 -0.20 120.40 130.36 1ffq s VAL 56 Ca -0.02 1.67 0.08 0.00 0.00 0.00 0.00 61.98 63.70 1ffq s VAL 56 Cb -0.18 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 1ffq s VAL 56 CO -0.08 -0.14 0.33 -0.54 0.00 0.00 0.00 175.10 174.66 1ffq s LYS 57 N 3.35 2.51 0.32 2.72 1.02 -0.18 -4.99 119.74 124.50 1ffq s LYS 57 Ca 0.52 -1.54 0.25 0.00 0.02 0.00 0.00 55.97 55.22 1ffq s LYS 57 Cb -0.20 -2.33 0.60 0.00 -0.52 0.00 0.00 37.83 35.37 1ffq s LYS 57 CO 0.13 -0.12 1.70 -0.91 -0.92 0.00 0.00 175.35 175.23 1ffq h ASN 58 N 1.14 0.00 -5.01 2.83 4.21 -1.97 -3.44 115.58 113.34 1ffq h ASN 58 Ca -0.42 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.02 1ffq h ASN 58 Cb 1.26 0.00 -0.18 0.00 -1.12 0.00 0.00 38.32 38.29 1ffq h ASN 58 CO 0.59 0.00 0.08 0.00 -1.29 0.00 0.00 177.43 176.81 1ffq s ALA 59 N -3.16 -1.47 0.14 -0.83 0.00 -1.26 -4.70 121.76 110.48 1ffq s ALA 59 Ca 0.09 0.86 -0.30 0.00 0.00 0.00 0.00 51.96 52.61 1ffq s ALA 59 Cb 0.09 0.22 -0.06 0.00 0.00 0.00 0.00 23.12 23.36 1ffq s ALA 59 CO 0.63 -0.44 0.97 0.00 0.00 0.00 0.00 175.76 176.93 1ffq s ALA 60 N -1.86 3.27 -0.50 0.00 0.00 -0.10 -4.79 121.76 117.78 1ffq s ALA 60 Ca -0.08 0.61 -0.29 0.00 0.00 0.00 0.00 51.96 52.20 1ffq s ALA 60 Cb -0.01 -3.28 0.03 0.00 0.00 0.00 0.00 23.12 19.86 1ffq s ALA 60 CO 0.03 -0.01 1.16 -0.51 0.00 0.00 0.00 175.76 176.43 1ffq s ASP 61 N -0.19 6.59 0.04 0.00 1.01 -1.26 -1.00 116.67 121.86 1ffq s ASP 61 Ca 0.46 0.40 0.03 0.00 0.71 0.00 0.00 52.55 54.15 1ffq s ASP 61 Cb -0.24 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.10 1ffq s ASP 61 CO 0.31 -1.31 0.02 -0.69 0.21 0.00 0.00 175.17 173.70 1ffq s VAL 62 N 4.59 4.19 0.03 -1.27 1.01 0.82 -4.84 120.40 124.92 1ffq s VAL 62 Ca 0.47 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.74 1ffq s VAL 62 Cb -0.07 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 1ffq s VAL 62 CO 0.31 0.25 -0.10 -0.94 0.00 0.00 0.00 175.10 174.62 1ffq s SER 63 N -1.94 1.18 -0.04 3.32 1.04 -1.26 -1.68 113.70 114.32 1ffq s SER 63 Ca 0.23 -0.39 -0.04 0.00 0.48 0.00 0.00 55.95 56.23 1ffq s SER 63 Cb -0.12 -0.06 0.01 0.00 0.10 0.00 0.00 66.02 65.95 1ffq s SER 63 CO 0.15 -0.02 0.11 -0.69 0.98 0.00 0.00 173.24 173.77 1ffq s VAL 64 N -0.81 0.02 0.20 5.02 1.01 -0.53 -4.95 120.40 120.36 1ffq s VAL 64 Ca -0.02 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 61.90 1ffq s VAL 64 Cb -0.07 -0.21 -0.05 0.00 0.00 0.00 0.00 36.38 36.05 1ffq s VAL 64 CO 0.01 -0.07 -0.12 -0.44 0.00 0.00 0.00 175.10 174.47 1ffq s SER 65 N -0.20 2.40 0.06 3.32 0.01 -1.26 -0.58 113.70 117.44 1ffq s SER 65 Ca -0.03 -1.04 -0.10 0.00 1.31 0.00 0.00 55.95 56.10 1ffq s SER 65 Cb -0.02 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.11 1ffq s SER 65 CO 0.00 -0.23 0.21 -1.66 0.41 0.00 0.00 173.24 171.97 1ffq s TRP 66 N -3.07 0.07 0.10 2.43 -2.14 -0.72 -0.63 118.94 114.98 1ffq s TRP 66 Ca 0.22 -0.35 0.08 0.00 2.66 0.00 0.00 56.10 58.71 1ffq s TRP 66 Cb 0.01 -0.02 -0.03 0.00 -3.10 0.00 0.00 33.47 30.32 1ffq s TRP 66 CO 0.06 -0.48 -0.21 -0.80 -2.66 0.00 0.00 176.95 172.85 1ffq s ASN 67 N -2.37 2.55 -0.27 -2.66 0.01 -0.43 -1.81 114.94 109.96 1ffq s ASN 67 Ca -0.01 -0.67 -0.03 0.00 -0.71 0.00 0.00 52.86 51.44 1ffq s ASN 67 Cb 0.01 -0.15 0.03 0.00 0.41 0.00 0.00 41.25 41.55 1ffq s ASN 67 CO -0.07 0.07 -0.02 -0.22 -1.51 0.00 0.00 177.10 175.35 1ffq s LEU 68 N -1.82 3.42 0.18 0.60 2.96 0.14 -0.98 118.68 123.18 1ffq s LEU 68 Ca 0.07 -0.90 0.16 0.00 -0.22 0.00 0.00 54.13 53.24 1ffq s LEU 68 Cb -0.10 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 1ffq s LEU 68 CO 0.04 -0.16 1.14 -0.50 -1.32 0.00 0.00 176.35 175.55 1ffq h TRP 69 N 8.05 0.00 -3.29 5.38 4.06 -1.87 -3.45 115.95 124.83 1ffq h TRP 69 Ca -0.31 0.00 -0.31 0.00 2.06 0.00 0.00 58.89 60.33 1ffq h TRP 69 Cb 1.10 0.00 -0.36 0.00 -1.00 0.00 0.00 29.16 28.91 1ffq h TRP 69 CO 0.59 0.50 -0.68 -0.80 -3.56 0.00 0.00 178.44 174.49 1ffq s ASN 70 N -6.08 0.58 0.00 -3.49 -0.87 -1.26 -5.15 114.94 98.66 1ffq s ASN 70 Ca 0.01 0.18 0.00 0.00 -1.57 0.00 0.00 52.86 51.48 1ffq s ASN 70 Cb 0.08 0.05 0.00 0.00 -0.02 0.00 0.00 41.25 41.36 1ffq s ASN 70 CO 0.78 -0.20 0.00 0.61 -2.57 0.00 0.00 177.10 175.71 1ffq n GLY 71 N 4.87 0.10 3.76 0.66 0.00 -1.26 -4.35 105.19 108.97 1ffq n GLY 71 Ca -0.13 -2.27 -0.40 0.00 0.00 0.00 0.00 46.02 43.22 1ffq n GLY 71 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ffq s ASP 72 N -4.00 7.38 0.00 1.61 -1.08 -1.26 -4.74 116.67 114.58 1ffq s ASP 72 Ca 0.00 1.64 0.23 0.00 -0.52 0.00 0.00 52.55 53.90 1ffq s ASP 72 Cb 0.00 -2.51 1.08 0.00 -1.46 0.00 0.00 42.92 40.03 1ffq s ASP 72 CO 0.00 0.12 1.73 0.35 0.52 0.00 0.00 175.17 177.89 1ffq n THR 73 N 2.04 0.08 -0.13 1.71 -2.24 -1.26 -0.75 114.28 113.73 1ffq n THR 73 Ca -0.04 -0.17 0.02 0.00 -2.27 0.00 0.00 64.05 61.59 1ffq n THR 73 Cb 0.49 0.06 -0.01 0.00 -2.10 0.00 0.00 70.33 68.77 1ffq n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffq n GLY 74 N 1.01 -1.71 0.00 3.38 0.00 -1.26 -4.75 105.19 101.86 1ffq n GLY 74 Ca 0.17 -1.48 0.03 0.00 0.00 0.00 0.00 46.02 44.74 1ffq n GLY 74 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ffq n THR 75 N -2.06 0.00 -4.45 2.61 -2.24 0.09 -4.64 114.28 103.59 1ffq n THR 75 Ca -0.00 -0.27 -0.20 0.00 -2.27 0.00 0.00 64.05 61.30 1ffq n THR 75 Cb 0.06 0.76 -0.15 0.00 -2.10 0.00 0.00 70.33 68.90 1ffq n THR 75 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1ffq s THR 76 N -1.92 0.83 0.03 4.28 2.01 -0.71 -1.06 115.64 119.10 1ffq s THR 76 Ca 0.01 -0.44 0.06 0.00 0.31 0.00 0.00 61.69 61.63 1ffq s THR 76 Cb 0.05 -0.71 -0.03 0.00 0.01 0.00 0.00 72.50 71.82 1ffq s THR 76 CO 0.27 0.24 -0.15 0.00 -0.69 0.00 0.00 174.62 174.29 1ffq s ALA 77 N -0.15 2.69 0.03 7.40 0.00 0.14 -0.66 121.76 131.22 1ffq s ALA 77 Ca 0.02 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 50.86 1ffq s ALA 77 Cb -0.05 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 1ffq s ALA 77 CO -0.00 0.58 -0.08 0.15 0.00 0.00 0.00 175.76 176.41 1ffq s LYS 78 N -1.42 0.52 -0.18 0.00 1.02 -0.09 -1.02 119.74 118.58 1ffq s LYS 78 Ca 0.15 -0.63 -0.05 0.00 0.02 0.00 0.00 55.97 55.46 1ffq s LYS 78 Cb -0.11 -0.35 -0.03 0.00 -0.52 0.00 0.00 37.83 36.82 1ffq s LYS 78 CO 0.06 0.07 0.01 0.08 -0.92 0.00 0.00 175.35 174.65 1ffq s VAL 79 N -1.06 4.16 -0.03 3.17 1.01 -0.27 -0.55 120.40 126.83 1ffq s VAL 79 Ca -0.07 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1ffq s VAL 79 Cb -0.08 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 1ffq s VAL 79 CO 0.00 0.45 -0.04 -0.76 0.00 0.00 0.00 175.10 174.75 1ffq s LEU 80 N 0.67 3.31 -0.22 3.92 1.43 0.14 -0.23 118.68 127.70 1ffq s LEU 80 Ca 0.00 -0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.06 1ffq s LEU 80 Cb -0.14 -1.83 0.02 0.00 0.03 0.00 0.00 46.19 44.27 1ffq s LEU 80 CO 0.02 0.32 -0.11 -0.76 0.23 0.00 0.00 176.35 176.05 1ffq s LEU 81 N -1.20 2.78 -1.49 1.79 1.43 0.37 -1.36 118.68 120.99 1ffq s LEU 81 Ca 0.16 -0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 52.42 1ffq s LEU 81 Cb -0.11 -1.61 0.07 0.00 0.03 0.00 0.00 46.19 44.56 1ffq s LEU 81 CO 0.06 -0.06 0.97 0.59 0.23 0.00 0.00 176.35 178.13 1ffq n ASN 82 N 4.67 -4.47 0.00 2.29 3.02 -0.45 -1.42 115.26 118.89 1ffq n ASN 82 Ca -0.18 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 53.60 1ffq n ASN 82 Cb 0.49 -4.01 0.00 0.00 -0.61 0.00 0.00 39.78 35.65 1ffq n ASN 82 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ffq n GLY 83 N -1.71 2.21 3.51 7.41 0.00 -1.26 -5.02 105.19 110.33 1ffq n GLY 83 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1ffq n GLY 83 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ffq s LYS 84 N -0.16 3.71 0.15 1.61 2.20 -0.51 -4.97 119.74 121.77 1ffq s LYS 84 Ca 0.00 -0.50 -0.32 0.00 -0.36 0.00 0.00 55.97 54.79 1ffq s LYS 84 Cb 0.00 -2.96 -0.12 0.00 -1.51 0.00 0.00 37.83 33.24 1ffq s LYS 84 CO 0.00 0.23 1.76 -1.91 -0.36 0.00 0.00 175.35 175.07 1ffq n GLU 85 N 3.58 2.65 -0.00 4.03 2.13 -1.26 -0.48 120.64 131.29 1ffq n GLU 85 Ca -0.17 0.96 0.04 0.00 0.66 0.00 0.00 57.16 58.65 1ffq n GLU 85 Cb 0.52 -2.82 -0.06 0.00 0.27 0.00 0.00 31.44 29.36 1ffq n GLU 85 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ffq n ALA 86 N 4.70 2.66 -3.54 4.31 0.00 0.68 -4.89 120.51 124.42 1ffq n ALA 86 Ca 0.17 -0.22 -0.16 0.00 0.00 0.00 0.00 53.44 53.24 1ffq n ALA 86 Cb 0.35 -0.30 -0.06 0.00 0.00 0.00 0.00 19.45 19.44 1ffq n ALA 86 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1ffq s TRP 87 N -2.23 -0.60 -0.01 0.00 -0.00 -1.16 -4.76 118.94 110.17 1ffq s TRP 87 Ca -0.00 1.06 -0.18 0.00 -0.00 0.00 0.00 56.10 56.98 1ffq s TRP 87 Cb 0.06 0.41 0.03 0.00 -0.00 0.00 0.00 33.47 33.97 1ffq s TRP 87 CO 0.35 -0.53 0.40 -1.54 -0.00 0.00 0.00 176.95 175.63 1ffq s SER 88 N -1.04 -0.29 0.19 5.86 1.04 -1.26 -1.11 113.70 117.08 1ffq s SER 88 Ca -0.08 0.19 -0.23 0.00 0.48 0.00 0.00 55.95 56.30 1ffq s SER 88 Cb -0.01 0.37 0.06 0.00 0.10 0.00 0.00 66.02 66.55 1ffq s SER 88 CO 0.07 -0.52 0.93 -0.83 0.98 0.00 0.00 173.24 173.87 1ffq s GLY 89 N -1.43 -0.11 0.27 7.32 0.00 -0.19 -4.99 107.32 108.19 1ffq s GLY 89 Ca -0.12 -0.08 -0.30 0.00 0.00 0.00 0.00 44.72 44.23 1ffq s GLY 89 CO 0.04 0.35 1.51 -4.14 0.00 0.00 0.00 173.10 170.87 1ffq s PRO 90 N -3.11 4.20 -0.42 2.90 0.02 -1.26 0.26 135.00 137.59 1ffq s PRO 90 Ca 0.14 2.43 -0.21 0.00 0.02 0.00 0.00 61.00 63.38 1ffq s PRO 90 Cb -0.02 -3.07 0.02 0.00 0.02 0.00 0.00 34.50 31.44 1ffq s PRO 90 CO 0.04 -0.52 0.65 0.45 -0.33 0.00 0.00 177.00 177.29 1ffq s SER 91 N 0.43 6.34 0.00 2.53 0.15 -0.23 -4.47 113.70 118.46 1ffq s SER 91 Ca 0.61 -0.25 0.11 0.00 0.70 0.00 0.00 55.95 57.12 1ffq s SER 91 Cb -0.45 -2.32 0.20 0.00 -1.71 0.00 0.00 66.02 61.74 1ffq s SER 91 CO 0.45 -0.75 1.06 0.35 1.20 0.00 0.00 173.24 175.55 1ffq n THR 92 N 5.82 0.52 -3.32 6.45 -2.24 -1.26 -4.59 114.28 115.66 1ffq n THR 92 Ca -0.01 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 1ffq n THR 92 Cb 0.48 0.85 0.00 0.00 -2.10 0.00 0.00 70.33 69.56 1ffq n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffq n GLY 93 N 0.55 -0.66 0.03 3.38 0.00 -1.26 -5.01 105.19 102.22 1ffq n GLY 93 Ca 0.09 -0.79 0.13 0.00 0.00 0.00 0.00 46.02 45.45 1ffq n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ffq n SER 94 N 0.16 0.32 -4.33 1.61 3.41 -1.26 -4.77 113.62 108.75 1ffq n SER 94 Ca 0.00 0.33 -0.17 0.00 -0.26 0.00 0.00 58.87 58.77 1ffq n SER 94 Cb 0.00 -0.35 -0.10 0.00 -0.26 0.00 0.00 64.21 63.50 1ffq n SER 94 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1ffq s SER 95 N -3.40 2.03 0.20 4.04 0.01 -1.26 0.28 113.70 115.60 1ffq s SER 95 Ca 0.12 -1.16 -0.23 0.00 1.31 0.00 0.00 55.95 56.00 1ffq s SER 95 Cb 0.17 -0.03 0.05 0.00 0.21 0.00 0.00 66.02 66.41 1ffq s SER 95 CO 0.59 -0.42 0.74 -0.83 0.41 0.00 0.00 173.24 173.73 1ffq s GLY 96 N -3.30 -0.29 0.01 3.44 0.00 -0.75 -4.87 107.32 101.56 1ffq s GLY 96 Ca 0.26 0.09 0.01 0.00 0.00 0.00 0.00 44.72 45.08 1ffq s GLY 96 CO 0.07 0.03 -0.05 -1.59 0.00 0.00 0.00 173.10 171.56 1ffq s THR 97 N -3.70 0.35 -0.00 0.90 2.01 -1.26 -1.76 115.64 112.18 1ffq s THR 97 Ca 0.08 -0.46 0.04 0.00 0.31 0.00 0.00 61.69 61.66 1ffq s THR 97 Cb -0.03 -0.35 -0.01 0.00 0.01 0.00 0.00 72.50 72.11 1ffq s THR 97 CO -0.00 -0.08 -0.14 0.00 -0.69 0.00 0.00 174.62 173.71 1ffq s ALA 98 N -0.53 1.16 -0.10 7.40 0.00 0.25 -5.01 121.76 124.93 1ffq s ALA 98 Ca -0.03 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.30 1ffq s ALA 98 Cb -0.04 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.82 1ffq s ALA 98 CO -0.00 0.27 -0.11 -0.80 0.00 0.00 0.00 175.76 175.12 1ffq s ASN 99 N -0.48 2.10 0.29 0.00 0.01 -1.26 -1.45 114.94 114.15 1ffq s ASN 99 Ca 0.05 -0.33 -0.12 0.00 -0.71 0.00 0.00 52.86 51.74 1ffq s ASN 99 Cb -0.06 -0.90 0.01 0.00 0.41 0.00 0.00 41.25 40.71 1ffq s ASN 99 CO -0.00 -0.04 0.56 0.72 -1.51 0.00 0.00 177.10 176.83 1ffq s PHE 100 N 1.19 0.38 -0.02 2.20 -0.71 -0.67 -5.00 117.98 115.35 1ffq s PHE 100 Ca -0.04 -0.78 0.03 0.00 -1.04 0.00 0.00 56.93 55.10 1ffq s PHE 100 Cb -0.14 0.31 -0.03 0.00 -1.21 0.00 0.00 43.02 41.94 1ffq s PHE 100 CO -0.03 -1.14 -0.09 0.15 -1.34 0.00 0.00 175.22 172.77 1ffq s LYS 101 N -3.58 2.54 -0.15 1.99 1.02 -1.26 -0.13 119.74 120.17 1ffq s LYS 101 Ca 0.21 -0.70 0.01 0.00 0.02 0.00 0.00 55.97 55.51 1ffq s LYS 101 Cb -0.02 -2.48 0.02 0.00 -0.52 0.00 0.00 37.83 34.83 1ffq s LYS 101 CO 0.11 0.61 -0.17 0.08 -0.92 0.00 0.00 175.35 175.07 1ffq s VAL 102 N -0.91 1.75 -1.01 3.17 1.01 -0.17 -4.93 120.40 119.30 1ffq s VAL 102 Ca 0.15 -0.75 0.17 0.00 0.00 0.00 0.00 61.98 61.55 1ffq s VAL 102 Cb -0.11 -1.60 0.61 0.00 0.00 0.00 0.00 36.38 35.27 1ffq s VAL 102 CO 0.05 0.49 1.52 -0.46 0.00 0.00 0.00 175.10 176.70 1ffq n ASN 103 N 4.60 4.23 -3.94 3.32 6.94 -1.26 -0.92 115.26 128.22 1ffq n ASN 103 Ca -0.19 -2.41 -0.23 0.00 -0.02 0.00 0.00 54.58 51.73 1ffq n ASN 103 Cb 0.50 -0.50 -0.17 0.00 -2.36 0.00 0.00 39.78 37.26 1ffq n ASN 103 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1ffq s LYS 104 N -1.76 1.29 0.64 -3.83 2.20 -1.26 -4.88 119.74 112.13 1ffq s LYS 104 Ca 0.44 -0.24 -0.17 0.00 -0.36 0.00 0.00 55.97 55.64 1ffq s LYS 104 Cb 0.29 -1.20 -0.01 0.00 -1.51 0.00 0.00 37.83 35.39 1ffq s LYS 104 CO 0.21 -0.08 1.20 0.20 -0.36 0.00 0.00 175.35 176.52 1ffq s GLY 105 N 1.00 2.56 0.00 5.54 0.00 -1.26 -4.90 107.32 110.26 1ffq s GLY 105 Ca -0.09 0.92 0.00 0.00 0.00 0.00 0.00 44.72 45.55 1ffq s GLY 105 CO -0.00 1.31 0.00 0.61 0.00 0.00 0.00 173.10 175.02 1ffq n GLY 106 N 0.36 0.02 3.52 0.20 0.00 0.17 -4.78 105.19 104.68 1ffq n GLY 106 Ca 0.13 -1.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.12 1ffq n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ffq s ARG 107 N -1.80 2.94 0.02 1.61 0.52 -1.26 -1.49 118.95 119.49 1ffq s ARG 107 Ca 0.00 -0.59 0.05 0.00 -0.52 0.00 0.00 55.73 54.67 1ffq s ARG 107 Cb 0.00 -2.61 -0.02 0.00 0.52 0.00 0.00 34.95 32.85 1ffq s ARG 107 CO 0.00 0.53 -0.14 0.71 0.02 0.00 0.00 175.30 176.42 1ffq s TYR 108 N -0.45 1.23 -0.58 -0.53 1.51 -0.68 -4.97 117.35 112.88 1ffq s TYR 108 Ca 0.06 -0.30 -0.25 0.00 -1.01 0.00 0.00 57.07 55.58 1ffq s TYR 108 Cb -0.12 -0.76 0.04 0.00 -0.11 0.00 0.00 41.96 41.01 1ffq s TYR 108 CO 0.02 0.01 1.02 -0.65 -1.11 0.00 0.00 175.55 174.85 1ffq s GLN 109 N -0.77 3.35 -0.13 -0.62 -1.52 -1.26 -0.73 119.66 117.99 1ffq s GLN 109 Ca 0.03 -0.18 -0.10 0.00 -1.95 0.00 0.00 55.36 53.17 1ffq s GLN 109 Cb -0.07 -4.06 -0.05 0.00 -0.22 0.00 0.00 33.01 28.61 1ffq s GLN 109 CO 0.00 -1.59 0.21 1.41 -0.25 0.00 0.00 175.29 175.07 1ffq s MET 110 N 4.30 3.84 0.04 2.91 -2.45 0.59 -1.34 119.30 127.20 1ffq s MET 110 Ca 0.33 -0.03 0.04 0.00 -1.25 0.00 0.00 55.69 54.78 1ffq s MET 110 Cb -0.11 -3.29 -0.02 0.00 1.25 0.00 0.00 34.83 32.65 1ffq s MET 110 CO 0.20 0.55 -0.11 -0.65 1.05 0.00 0.00 175.02 176.06 1ffq s GLN 111 N -0.42 0.70 -0.22 4.11 -0.21 -0.47 -0.61 119.66 122.55 1ffq s GLN 111 Ca 0.15 -0.74 -0.07 0.00 0.02 0.00 0.00 55.36 54.72 1ffq s GLN 111 Cb -0.13 -0.62 -0.03 0.00 1.00 0.00 0.00 33.01 33.23 1ffq s GLN 111 CO 0.04 0.14 0.05 0.08 -2.12 0.00 0.00 175.29 173.48 1ffq s VAL 112 N -1.06 4.38 0.01 1.09 1.01 -1.26 -0.68 120.40 123.89 1ffq s VAL 112 Ca -0.03 -0.16 0.05 0.00 0.00 0.00 0.00 61.98 61.83 1ffq s VAL 112 Cb -0.08 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 1ffq s VAL 112 CO 0.01 0.39 -0.13 0.00 0.00 0.00 0.00 175.10 175.37 1ffq s ALA 113 N 1.09 2.75 -0.09 5.51 0.00 0.29 -1.04 121.76 130.27 1ffq s ALA 113 Ca 0.04 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.92 1ffq s ALA 113 Cb -0.14 -0.93 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 1ffq s ALA 113 CO 0.03 0.58 -0.09 -0.51 0.00 0.00 0.00 175.76 175.77 1ffq s LEU 114 N -1.25 2.98 0.07 0.00 1.43 -0.43 -0.91 118.68 120.57 1ffq s LEU 114 Ca 0.15 -0.15 0.07 0.00 -1.03 0.00 0.00 54.13 53.17 1ffq s LEU 114 Cb -0.11 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 1ffq s LEU 114 CO 0.05 0.28 -0.18 0.00 0.23 0.00 0.00 176.35 176.73 1ffq n ASN 116 N 1.45 0.00 0.26 0.00 0.23 -0.06 -0.73 115.26 116.42 1ffq n ASN 116 Ca -0.19 -0.92 0.11 0.00 -0.53 0.00 0.00 54.58 53.05 1ffq n ASN 116 Cb 0.54 0.00 0.72 0.00 -2.08 0.00 0.00 39.78 38.95 1ffq n ASN 116 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ffq h ALA 117 N 1.16 1.65 -0.01 -2.53 0.00 -2.01 -1.66 119.26 115.86 1ffq h ALA 117 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ffq h ALA 117 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ffq h ALA 117 CO 0.00 0.08 -0.06 -0.25 0.00 0.00 0.00 179.25 179.01 1ffq n ASP 118 N -4.10 0.89 0.00 0.00 8.00 -1.26 -5.02 116.55 115.05 1ffq n ASP 118 Ca -0.03 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.39 1ffq n ASP 118 Cb 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 1ffq n ASP 118 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ffq n GLY 119 N 1.19 1.99 3.39 0.44 0.00 -0.63 -4.21 105.19 107.36 1ffq n GLY 119 Ca 0.18 -1.54 -0.30 0.00 0.00 0.00 0.00 46.02 44.35 1ffq n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffq s THR 121 N -0.89 0.79 -0.11 0.00 2.01 -0.09 -4.93 115.64 112.42 1ffq s THR 121 Ca 0.13 -0.18 -0.06 0.00 0.31 0.00 0.00 61.69 61.89 1ffq s THR 121 Cb -0.10 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.48 1ffq s THR 121 CO 0.04 0.29 0.13 0.00 -0.69 0.00 0.00 174.62 174.39 1ffq s ALA 122 N 1.80 3.83 1.17 7.40 0.00 -1.26 -1.32 121.76 133.38 1ffq s ALA 122 Ca 0.04 -0.67 -0.13 0.00 0.00 0.00 0.00 51.96 51.21 1ffq s ALA 122 Cb -0.13 -1.92 0.29 0.00 0.00 0.00 0.00 23.12 21.36 1ffq s ALA 122 CO -0.07 0.63 1.03 -1.54 0.00 0.00 0.00 175.76 175.80 1ffq s SER 123 N -1.08 0.93 1.00 0.00 1.04 -0.20 -4.74 113.70 110.64 1ffq s SER 123 Ca 0.16 1.41 -0.11 0.00 0.48 0.00 0.00 55.95 57.89 1ffq s SER 123 Cb -0.12 -2.19 0.19 0.00 0.10 0.00 0.00 66.02 64.00 1ffq s SER 123 CO 0.05 -4.22 1.10 -1.81 0.98 0.00 0.00 173.24 169.35 1ffq s ASP 124 N -2.64 2.30 0.19 7.02 1.01 -1.26 -4.76 116.67 118.53 1ffq s ASP 124 Ca 0.68 1.94 -0.27 0.00 0.71 0.00 0.00 52.55 55.61 1ffq s ASP 124 Cb -0.24 -2.47 -0.08 0.00 1.01 0.00 0.00 42.92 41.14 1ffq s ASP 124 CO 0.64 -3.45 0.85 0.00 0.21 0.00 0.00 175.17 173.42 1ffq s ALA 125 N -2.60 3.40 -0.11 5.23 0.00 -1.26 -4.71 121.76 121.71 1ffq s ALA 125 Ca 0.67 0.47 0.03 0.00 0.00 0.00 0.00 51.96 53.13 1ffq s ALA 125 Cb -0.23 -3.07 0.01 0.00 0.00 0.00 0.00 23.12 19.82 1ffq s ALA 125 CO 0.60 0.24 -0.21 0.99 0.00 0.00 0.00 175.76 177.38 1ffq s THR 126 N -1.07 1.92 0.22 0.00 2.01 0.22 -4.91 115.64 114.03 1ffq s THR 126 Ca 0.38 -0.92 -0.30 0.00 0.31 0.00 0.00 61.69 61.16 1ffq s THR 126 Cb -0.24 -1.68 -0.09 0.00 0.01 0.00 0.00 72.50 70.49 1ffq s THR 126 CO 0.28 0.53 1.32 -0.70 -0.69 0.00 0.00 174.62 175.36 1ffq s GLU 127 N 0.58 4.38 -0.02 4.92 2.12 -1.26 -0.30 118.70 129.12 1ffq s GLU 127 Ca -0.14 2.09 0.07 0.00 0.36 0.00 0.00 54.97 57.35 1ffq s GLU 127 Cb -0.17 -3.18 -0.02 0.00 0.26 0.00 0.00 34.13 31.03 1ffq s GLU 127 CO 0.04 -0.26 -0.23 0.96 -0.54 0.00 0.00 175.26 175.24 1ffq s ILE 128 N -0.02 1.78 -0.29 -3.70 -4.36 0.09 -4.89 121.20 109.81 1ffq s ILE 128 Ca 0.56 -0.96 -0.10 0.00 -0.26 0.00 0.00 60.65 59.89 1ffq s ILE 128 Cb -0.37 -1.48 -0.02 0.00 1.25 0.00 0.00 42.46 41.84 1ffq s ILE 128 CO 0.40 0.50 0.15 -0.69 0.24 0.00 0.00 174.94 175.54 1ffq s VAL 129 N -0.53 4.79 -0.42 8.37 1.01 0.59 -1.69 120.40 132.53 1ffq s VAL 129 Ca 0.09 -0.19 -0.06 0.00 0.00 0.00 0.00 61.98 61.82 1ffq s VAL 129 Cb -0.09 -3.36 0.10 0.00 0.00 0.00 0.00 36.38 33.03 1ffq s VAL 129 CO -0.01 0.17 0.24 -0.69 0.00 0.00 0.00 175.10 174.80 1ffq s VAL 130 N 1.66 3.73 0.44 2.92 1.01 -0.55 0.12 120.40 129.73 1ffq s VAL 130 Ca 0.06 -1.77 -0.22 0.00 0.00 0.00 0.00 61.98 60.06 1ffq s VAL 130 Cb -0.16 -3.42 -0.09 0.00 0.00 0.00 0.00 36.38 32.70 1ffq s VAL 130 CO 0.07 -0.62 1.01 0.00 0.00 0.00 0.00 175.10 175.57 1ffq s ALA 131 N 1.28 2.98 0.16 5.51 0.00 0.68 -0.65 121.76 131.71 1ffq s ALA 131 Ca 0.05 0.56 -0.17 0.00 0.00 0.00 0.00 51.96 52.40 1ffq s ALA 131 Cb -0.23 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.70 1ffq s ALA 131 CO -0.01 -0.14 0.46 0.34 0.00 0.00 0.00 175.76 176.41 1ffq s ASP 132 N -1.94 -0.27 -0.00 0.00 -1.08 -1.26 -1.12 116.67 111.01 1ffq s ASP 132 Ca 0.63 -0.37 0.09 0.00 -0.52 0.00 0.00 52.55 52.39 1ffq s ASP 132 Cb -0.15 0.52 0.27 0.00 -1.46 0.00 0.00 42.92 42.10 1ffq s ASP 132 CO 0.20 -0.94 1.23 0.35 0.52 0.00 0.00 175.17 176.52 1ffq n THR 133 N -0.28 0.41 1.30 1.71 -2.24 -1.26 -1.45 114.28 112.46 1ffq n THR 133 Ca -0.14 -0.41 0.14 0.00 -2.27 0.00 0.00 64.05 61.38 1ffq n THR 133 Cb 0.63 0.20 0.66 0.00 -2.10 0.00 0.00 70.33 69.72 1ffq n THR 133 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ffq n ASP 134 N 0.40 0.16 0.00 3.42 5.75 -1.26 -1.68 116.55 123.33 1ffq n ASP 134 Ca 0.10 -0.12 0.00 0.00 -0.01 0.00 0.00 54.79 54.76 1ffq n ASP 134 Cb 0.26 -0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 1ffq n ASP 134 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ffq n GLY 135 N 1.35 0.47 0.30 6.12 0.00 -0.53 -4.73 105.19 108.17 1ffq n GLY 135 Ca 0.12 -0.82 0.19 0.00 0.00 0.00 0.00 46.02 45.52 1ffq n GLY 135 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ffq h SER 136 N 0.00 0.00 0.53 1.61 4.64 -1.90 -0.60 113.55 117.83 1ffq h SER 136 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ffq h SER 136 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ffq h SER 136 CO 0.00 0.02 -0.30 0.00 -0.87 0.00 0.00 176.83 175.68 1ffq n HIS 137 N -3.18 0.00 -3.72 4.77 1.44 -1.26 -4.20 115.22 109.06 1ffq n HIS 137 Ca -0.01 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.41 1ffq n HIS 137 Cb 0.19 -0.26 -0.04 0.00 0.12 0.00 0.00 29.99 30.00 1ffq n HIS 137 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1ffq s LEU 138 N -2.83 4.26 0.42 2.39 1.43 -0.23 -4.90 118.68 119.21 1ffq s LEU 138 Ca 0.17 0.44 -0.24 0.00 -1.03 0.00 0.00 54.13 53.46 1ffq s LEU 138 Cb 0.18 -3.18 -0.08 0.00 0.03 0.00 0.00 46.19 43.14 1ffq s LEU 138 CO 0.60 0.01 1.14 0.00 0.23 0.00 0.00 176.35 178.34 1ffq s ALA 139 N -1.76 3.07 0.20 4.21 0.00 -1.26 -4.93 121.76 121.29 1ffq s ALA 139 Ca 0.39 0.89 -0.33 0.00 0.00 0.00 0.00 51.96 52.91 1ffq s ALA 139 Cb -0.12 -3.36 -0.13 0.00 0.00 0.00 0.00 23.12 19.52 1ffq s ALA 139 CO 0.28 -0.50 1.58 -0.35 0.00 0.00 0.00 175.76 176.76 1ffq n PRO 140 N -0.15 2.31 -2.85 0.00 -0.04 -1.26 -4.76 135.00 128.24 1ffq n PRO 140 Ca 0.05 0.83 -0.43 0.00 -0.04 0.00 0.00 63.50 63.92 1ffq n PRO 140 Cb 0.48 -2.59 -0.04 0.00 -0.04 0.00 0.00 33.50 31.30 1ffq n PRO 140 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ffq s LEU 141 N 0.66 4.26 -0.60 1.53 2.96 -0.02 -4.86 118.68 122.60 1ffq s LEU 141 Ca 0.74 -0.76 0.05 0.00 -0.22 0.00 0.00 54.13 53.95 1ffq s LEU 141 Cb -0.62 -2.56 0.18 0.00 0.50 0.00 0.00 46.19 43.70 1ffq s LEU 141 CO 0.40 -1.37 0.48 1.17 -1.32 0.00 0.00 176.35 175.72 1ffq n LYS 142 N 7.64 1.40 -3.48 1.98 4.81 -1.26 -4.55 118.16 124.70 1ffq n LYS 142 Ca -0.02 -4.08 -0.26 0.00 -0.87 0.00 0.00 58.31 53.08 1ffq n LYS 142 Cb 0.46 -2.06 -0.02 0.00 0.02 0.00 0.00 35.03 33.43 1ffq n LYS 142 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1ffq s GLU 143 N -1.15 3.52 0.46 1.64 0.41 -1.26 -5.06 118.70 117.26 1ffq s GLU 143 Ca 0.29 -0.29 -0.25 0.00 -0.41 0.00 0.00 54.97 54.31 1ffq s GLU 143 Cb 0.01 -2.71 -0.08 0.00 -1.78 0.00 0.00 34.13 29.57 1ffq s GLU 143 CO -0.16 0.24 1.44 -2.30 -0.49 0.00 0.00 175.26 173.99 1ffq n PRO 144 N -1.31 2.25 -2.11 0.39 -0.02 -1.26 -4.96 135.00 127.98 1ffq n PRO 144 Ca -0.04 0.80 -0.40 0.00 -2.02 0.00 0.00 63.50 61.84 1ffq n PRO 144 Cb 0.55 -2.64 -0.01 0.00 -0.02 0.00 0.00 33.50 31.37 1ffq n PRO 144 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ffq s LEU 145 N -2.75 4.28 0.47 2.45 1.43 -1.26 -5.00 118.68 118.31 1ffq s LEU 145 Ca 0.62 2.61 0.06 0.00 -1.03 0.00 0.00 54.13 56.39 1ffq s LEU 145 Cb -0.45 -3.84 -0.01 0.00 0.03 0.00 0.00 46.19 41.93 1ffq s LEU 145 CO 0.57 -0.72 0.27 -0.76 0.23 0.00 0.00 176.35 175.95 1ffq s LEU 146 N -2.22 2.92 0.00 1.79 1.43 -1.26 -4.93 118.68 116.41 1ffq s LEU 146 Ca 0.54 -1.15 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 1ffq s LEU 146 Cb -0.37 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.48 1ffq s LEU 146 CO 0.49 -0.80 0.00 -0.62 0.23 0.00 0.00 176.35 175.65 1ffq n GLU 147 N -1.48 0.00 -0.22 1.70 1.02 -1.26 -2.00 120.64 118.40 1ffq n GLU 147 Ca -0.02 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.22 1ffq n GLU 147 Cb 0.64 0.00 0.27 0.00 -0.02 0.00 0.00 31.44 32.33 1ffq n GLU 147 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ffq n LYS 148 N 14.00 2.31 -1.95 3.49 5.02 0.14 -4.97 118.16 136.21 1ffq n LYS 148 Ca 0.00 -2.01 -0.42 0.00 -2.02 0.00 0.00 58.31 53.86 1ffq n LYS 148 Cb 0.00 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.51 1ffq n LYS 148 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1ffq s ASN 149 N -1.28 6.60 0.13 4.39 0.01 -0.85 -4.67 114.94 119.27 1ffq s ASN 149 Ca 0.38 2.62 0.10 0.00 -0.71 0.00 0.00 52.86 55.25 1ffq s ASN 149 Cb 0.21 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.23 1ffq s ASN 149 CO 0.29 -0.81 -0.22 -0.54 -1.51 0.00 0.00 177.10 174.31 1ffq s LYS 150 N 0.90 1.61 0.11 -0.60 1.02 -1.26 -4.68 119.74 116.83 1ffq s LYS 150 Ca 0.68 -1.29 -0.30 0.00 0.02 0.00 0.00 55.97 55.08 1ffq s LYS 150 Cb -0.43 -2.00 -0.06 0.00 -0.52 0.00 0.00 37.83 34.81 1ffq s LYS 150 CO 0.33 0.46 1.16 -1.25 -0.92 0.00 0.00 175.35 175.13 1ffq s PRO 151 N -2.20 4.49 0.12 -1.68 0.04 -1.26 -4.93 135.00 129.58 1ffq s PRO 151 Ca 0.17 1.75 0.08 0.00 0.04 0.00 0.00 61.00 63.04 1ffq s PRO 151 Cb -0.10 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 1ffq s PRO 151 CO 0.09 -0.13 -0.19 0.71 0.04 0.00 0.00 177.00 177.52 1ffq s TYR 152 N 0.54 1.70 0.09 0.56 1.51 -1.12 -1.18 117.35 119.46 1ffq s TYR 152 Ca 0.55 -0.45 -0.16 0.00 -1.01 0.00 0.00 57.07 55.99 1ffq s TYR 152 Cb -0.29 -0.90 -0.07 0.00 -0.11 0.00 0.00 41.96 40.59 1ffq s TYR 152 CO 0.32 0.22 0.53 0.15 -1.11 0.00 0.00 175.55 175.66 1ffq s LYS 153 N -2.27 4.04 -1.21 -0.62 1.02 0.19 -4.58 119.74 116.32 1ffq s LYS 153 Ca 0.09 0.55 -0.17 0.00 0.02 0.00 0.00 55.97 56.47 1ffq s LYS 153 Cb -0.08 -3.09 0.12 0.00 -0.52 0.00 0.00 37.83 34.26 1ffq s LYS 153 CO 0.05 0.57 1.53 -0.65 -0.92 0.00 0.00 175.35 175.93 1ffq s GLN 154 N -1.51 3.97 0.00 1.68 -1.52 -1.26 -3.60 119.66 117.42 1ffq s GLN 154 Ca 0.32 -2.17 0.00 0.00 -1.95 0.00 0.00 55.36 51.56 1ffq s GLN 154 Cb -0.17 -5.26 0.00 0.00 -0.22 0.00 0.00 33.01 27.36 1ffq s GLN 154 CO 0.18 -2.00 0.73 0.27 -0.25 0.00 0.00 175.29 174.23 1ffq n ASN 155 N 7.06 1.02 0.23 5.90 6.94 -1.26 -4.62 115.26 130.53 1ffq n ASN 155 Ca 0.40 -1.49 0.12 0.00 -0.02 0.00 0.00 54.58 53.59 1ffq n ASN 155 Cb 0.45 0.00 0.40 0.00 -2.36 0.00 0.00 39.78 38.27 1ffq n ASN 155 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1ffq h SER 156 N 0.00 0.00 0.00 0.53 4.64 -1.82 -3.47 113.55 113.43 1ffq h SER 156 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ffq h SER 156 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1ffq h SER 156 CO 0.00 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.70 1ffq n GLY 157 N 0.51 0.47 3.84 -0.77 0.00 -1.26 -5.03 105.19 102.95 1ffq n GLY 157 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 1ffq n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ffq s LYS 158 N -0.23 3.04 0.21 1.61 -0.14 -1.26 -5.03 119.74 117.94 1ffq s LYS 158 Ca 0.00 -0.87 -0.30 0.00 -1.36 0.00 0.00 55.97 53.44 1ffq s LYS 158 Cb 0.00 -2.69 -0.09 0.00 -1.68 0.00 0.00 37.83 33.37 1ffq s LYS 158 CO 0.00 0.46 1.28 0.08 -0.76 0.00 0.00 175.35 176.41 1ffq s VAL 159 N -1.88 3.24 -0.29 3.17 1.01 -0.07 -4.87 120.40 120.70 1ffq s VAL 159 Ca 0.32 1.05 -0.01 0.00 0.00 0.00 0.00 61.98 63.34 1ffq s VAL 159 Cb -0.09 -3.67 0.09 0.00 0.00 0.00 0.00 36.38 32.71 1ffq s VAL 159 CO 0.25 0.17 0.07 -0.69 0.00 0.00 0.00 175.10 174.90 1ffq s VAL 160 N -0.04 0.97 0.26 2.92 1.01 -1.24 -0.58 120.40 123.69 1ffq s VAL 160 Ca 0.55 -1.32 0.11 0.00 0.00 0.00 0.00 61.98 61.33 1ffq s VAL 160 Cb -0.36 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 1ffq s VAL 160 CO 0.39 -0.55 -0.19 -0.83 0.00 0.00 0.00 175.10 173.91 1ffq s GLY 161 N 1.59 1.81 0.14 4.51 0.00 -0.32 0.11 107.32 115.16 1ffq s GLY 161 Ca 0.07 -1.83 -0.15 0.00 0.00 0.00 0.00 44.72 42.80 1ffq s GLY 161 CO -0.20 -1.92 0.40 -0.45 0.00 0.00 0.00 173.10 170.94 1ffq s SER 162 N -3.43 -0.20 -0.09 1.64 0.15 -0.82 -0.51 113.70 110.43 1ffq s SER 162 Ca 0.28 -0.41 -0.02 0.00 0.70 0.00 0.00 55.95 56.50 1ffq s SER 162 Cb -0.05 0.48 -0.03 0.00 -1.71 0.00 0.00 66.02 64.72 1ffq s SER 162 CO 0.13 -0.89 -0.01 -0.31 1.20 0.00 0.00 173.24 173.37 1ffq s TYR 163 N -3.83 3.13 -0.07 3.44 1.51 -0.98 -1.23 117.35 119.31 1ffq s TYR 163 Ca 0.05 0.12 -0.01 0.00 -1.01 0.00 0.00 57.07 56.23 1ffq s TYR 163 Cb 0.02 -1.81 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 1ffq s TYR 163 CO -0.09 0.39 -0.01 0.12 -1.11 0.00 0.00 175.55 174.86 1ffq s PHE 164 N -0.70 3.12 -0.12 2.71 2.19 0.76 -1.09 117.98 124.86 1ffq s PHE 164 Ca 0.11 0.16 -0.01 0.00 0.33 0.00 0.00 56.93 57.52 1ffq s PHE 164 Cb -0.12 -1.76 -0.02 0.00 -1.31 0.00 0.00 43.02 39.81 1ffq s PHE 164 CO 0.02 0.45 -0.08 0.14 1.83 0.00 0.00 175.22 177.58 1ffq s VAL 165 N -0.90 3.53 0.30 3.12 -7.23 -1.26 -0.97 120.40 116.98 1ffq s VAL 165 Ca 0.14 -0.51 0.02 0.00 -1.81 0.00 0.00 61.98 59.82 1ffq s VAL 165 Cb -0.11 -2.49 0.29 0.00 0.56 0.00 0.00 36.38 34.62 1ffq s VAL 165 CO 0.03 0.53 1.87 -0.08 -0.31 0.00 0.00 175.10 177.15 1ffq h GLU 166 N 6.27 0.95 -0.02 4.82 4.81 -1.31 -1.90 114.58 128.19 1ffq h GLU 166 Ca -0.34 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 1ffq h GLU 166 Cb 1.19 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.36 1ffq h GLU 166 CO 0.57 0.63 0.00 -2.67 -0.73 0.00 0.00 179.01 176.81 1ffq n TRP 167 N -4.55 0.03 1.65 0.92 2.14 -1.26 -4.01 117.44 112.35 1ffq n TRP 167 Ca 0.17 -0.01 0.09 0.00 2.07 0.00 0.00 57.50 59.82 1ffq n TRP 167 Cb 0.31 0.00 0.45 0.00 -0.81 0.00 0.00 31.31 31.25 1ffq n TRP 167 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1ffq n GLY 168 N 0.84 -0.42 0.40 -1.67 0.00 -0.71 -4.07 105.19 99.55 1ffq n GLY 168 Ca 0.15 -0.24 0.13 0.00 0.00 0.00 0.00 46.02 46.05 1ffq n GLY 168 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ffq n VAL 169 N -0.28 0.00 0.00 1.61 0.24 -1.26 -0.54 118.33 118.10 1ffq n VAL 169 Ca 0.14 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1ffq n VAL 169 Cb 0.18 0.72 0.00 0.00 -1.47 0.00 0.00 33.84 33.27 1ffq n VAL 169 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1ffq n TYR 170 N -0.23 0.00 0.12 6.34 4.01 -1.26 -4.40 117.16 121.75 1ffq n TYR 170 Ca 0.12 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.97 1ffq n TYR 170 Cb 0.40 0.00 0.60 0.00 -0.31 0.00 0.00 39.34 40.02 1ffq n TYR 170 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1ffq h GLY 171 N 0.00 0.17 2.00 2.72 0.00 -1.86 -0.77 103.07 105.33 1ffq h GLY 171 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 47.33 47.19 1ffq h GLY 171 CO 0.00 0.05 -0.40 3.21 0.00 0.00 0.00 176.54 179.40 1ffq h ARG 172 N 0.15 0.00 -3.36 4.80 3.08 -1.87 -3.47 114.38 113.71 1ffq h ARG 172 Ca 0.11 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.79 1ffq h ARG 172 Cb 0.25 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.32 1ffq h ARG 172 CO -0.02 0.40 -0.51 -1.71 -1.07 0.00 0.00 179.97 177.06 1ffq n ASN 173 N -3.37 -5.56 -4.20 7.04 5.15 -0.30 -4.94 115.26 109.09 1ffq n ASN 173 Ca 0.01 -0.14 -0.37 0.00 -0.60 0.00 0.00 54.58 53.48 1ffq n ASN 173 Cb 0.59 -4.50 -0.12 0.00 -0.53 0.00 0.00 39.78 35.22 1ffq n ASN 173 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1ffq s PHE 174 N -3.03 3.39 0.39 1.20 2.19 0.30 -4.97 117.98 117.45 1ffq s PHE 174 Ca 0.14 -1.89 0.08 0.00 0.33 0.00 0.00 56.93 55.58 1ffq s PHE 174 Cb -0.06 -2.73 -0.02 0.00 -1.31 0.00 0.00 43.02 38.90 1ffq s PHE 174 CO 0.17 -0.86 0.35 0.95 1.83 0.00 0.00 175.22 177.65 1ffq s THR 175 N 1.29 2.95 0.53 0.12 -4.23 -1.26 -4.07 115.64 110.96 1ffq s THR 175 Ca 0.02 -1.36 0.21 0.00 -1.18 0.00 0.00 61.69 59.38 1ffq s THR 175 Cb -0.22 -3.06 0.29 0.00 1.34 0.00 0.00 72.50 70.86 1ffq s THR 175 CO -0.01 -0.06 2.16 0.58 -0.54 0.00 0.00 174.62 176.76 1ffq h VAL 176 N 1.11 0.84 0.00 2.29 2.07 -1.94 -0.95 116.25 119.67 1ffq h VAL 176 Ca -0.42 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1ffq h VAL 176 Cb 1.26 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1ffq h VAL 176 CO 0.58 0.03 0.00 -0.90 0.02 0.00 0.00 177.57 177.29 1ffq n ASP 177 N -4.25 0.67 -0.06 0.57 5.75 -1.26 -1.97 116.55 116.00 1ffq n ASP 177 Ca -0.03 0.68 0.12 0.00 -0.01 0.00 0.00 54.79 55.55 1ffq n ASP 177 Cb 0.11 -0.82 0.29 0.00 -1.03 0.00 0.00 41.12 39.68 1ffq n ASP 177 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ffq n LYS 178 N -2.26 0.22 -2.00 0.11 5.02 -0.36 -4.79 118.16 114.10 1ffq n LYS 178 Ca 0.02 -0.13 -0.42 0.00 -2.02 0.00 0.00 58.31 55.76 1ffq n LYS 178 Cb 0.21 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 1ffq n LYS 178 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ffq s ILE 179 N -2.87 2.73 -1.45 -0.18 1.01 -0.83 -4.84 121.20 114.76 1ffq s ILE 179 Ca 0.15 0.56 -0.12 0.00 0.00 0.00 0.00 60.65 61.23 1ffq s ILE 179 Cb 0.18 -3.36 0.04 0.00 0.01 0.00 0.00 42.46 39.34 1ffq s ILE 179 CO 0.65 0.06 2.31 -0.81 0.00 0.00 0.00 174.94 177.15 1ffq n PRO 180 N 3.28 3.23 0.19 2.79 -0.04 -1.26 -4.75 135.00 138.43 1ffq n PRO 180 Ca 0.11 -2.73 0.05 0.00 -0.04 0.00 0.00 63.50 60.88 1ffq n PRO 180 Cb 0.40 -3.10 0.33 0.00 -0.04 0.00 0.00 33.50 31.08 1ffq n PRO 180 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ffq h ALA 181 N 5.70 1.00 0.00 0.55 0.00 -1.93 -1.45 119.26 123.13 1ffq h ALA 181 Ca 0.60 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ffq h ALA 181 Cb 0.56 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ffq h ALA 181 CO 1.81 0.48 0.00 -0.56 0.00 0.00 0.00 179.25 180.98 1ffq h GLN 182 N 0.00 0.00 -0.66 0.00 3.07 -1.94 -2.69 115.11 112.89 1ffq h GLN 182 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1ffq h GLN 182 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.46 1ffq h GLN 182 CO 0.05 0.00 0.00 0.09 0.09 0.00 0.00 178.83 179.06 1ffq n ASN 183 N -2.91 4.60 -4.20 0.06 3.02 -0.54 -4.62 115.26 110.66 1ffq n ASN 183 Ca -0.01 -2.66 -0.19 0.00 -0.03 0.00 0.00 54.58 51.69 1ffq n ASN 183 Cb 0.14 -0.62 -0.12 0.00 -0.61 0.00 0.00 39.78 38.57 1ffq n ASN 183 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ffq s LEU 184 N -2.06 2.30 -0.07 3.41 1.43 -1.02 -4.92 118.68 117.76 1ffq s LEU 184 Ca 0.43 -0.66 0.14 0.00 -1.03 0.00 0.00 54.13 53.00 1ffq s LEU 184 Cb 0.32 -0.58 -0.23 0.00 0.03 0.00 0.00 46.19 45.72 1ffq s LEU 184 CO 0.14 -0.07 0.54 0.35 0.23 0.00 0.00 176.35 177.54 1ffq n THR 185 N 1.11 1.55 -4.04 5.49 -2.24 0.12 -4.90 114.28 111.37 1ffq n THR 185 Ca -0.20 -0.81 -0.20 0.00 -2.27 0.00 0.00 64.05 60.58 1ffq n THR 185 Cb 0.55 -0.91 -0.17 0.00 -2.10 0.00 0.00 70.33 67.70 1ffq n THR 185 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1ffq s HIS 186 N -2.58 0.63 -0.16 4.78 3.76 -0.97 -1.30 115.29 119.44 1ffq s HIS 186 Ca -0.06 -0.15 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 1ffq s HIS 186 Cb 0.08 -0.63 0.02 0.00 1.11 0.00 0.00 32.58 33.16 1ffq s HIS 186 CO 0.83 -0.20 -0.16 -1.17 -0.85 0.00 0.00 174.74 173.19 1ffq s LEU 187 N 1.13 1.87 0.04 0.89 2.96 0.44 -1.95 118.68 124.06 1ffq s LEU 187 Ca -0.08 -0.57 0.04 0.00 -0.22 0.00 0.00 54.13 53.30 1ffq s LEU 187 Cb -0.14 -1.27 -0.04 0.00 0.50 0.00 0.00 46.19 45.24 1ffq s LEU 187 CO -0.01 -0.05 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.18 1ffq s LEU 188 N 1.42 3.33 -0.30 -0.68 1.02 -0.37 -1.05 118.68 122.05 1ffq s LEU 188 Ca 0.04 -0.15 -0.06 0.00 0.02 0.00 0.00 54.13 53.98 1ffq s LEU 188 Cb -0.13 -1.98 0.02 0.00 0.02 0.00 0.00 46.19 44.11 1ffq s LEU 188 CO -0.11 0.24 0.07 -0.47 0.02 0.00 0.00 176.35 176.10 1ffq s TYR 189 N -1.14 3.16 -0.14 0.29 5.04 0.14 -0.17 117.35 124.54 1ffq s TYR 189 Ca 0.21 -1.14 -0.02 0.00 -2.44 0.00 0.00 57.07 53.68 1ffq s TYR 189 Cb -0.11 -2.24 -0.03 0.00 0.35 0.00 0.00 41.96 39.93 1ffq s TYR 189 CO 0.12 -0.63 -0.05 0.20 -1.34 0.00 0.00 175.55 173.85 1ffq s GLY 190 N 1.46 1.70 0.04 8.97 0.00 -0.15 -0.83 107.32 118.51 1ffq s GLY 190 Ca 0.01 -0.84 0.01 0.00 0.00 0.00 0.00 44.72 43.91 1ffq s GLY 190 CO 0.02 -0.19 -0.06 -1.36 0.00 0.00 0.00 173.10 171.50 1ffq s PHE 191 N 0.14 0.58 -0.23 1.90 0.08 -1.26 -0.73 117.98 118.46 1ffq s PHE 191 Ca -0.02 -0.56 -0.22 0.00 0.12 0.00 0.00 56.93 56.25 1ffq s PHE 191 Cb -0.14 -0.36 -0.02 0.00 -0.57 0.00 0.00 43.02 41.94 1ffq s PHE 191 CO 0.03 -0.13 0.71 0.42 -0.10 0.00 0.00 175.22 176.15 1ffq s ILE 192 N -1.67 4.94 0.45 0.64 -1.09 0.10 -4.60 121.20 119.98 1ffq s ILE 192 Ca -0.09 1.33 -0.12 0.00 -2.23 0.00 0.00 60.65 59.53 1ffq s ILE 192 Cb -0.08 -4.01 -0.07 0.00 -1.58 0.00 0.00 42.46 36.72 1ffq s ILE 192 CO -0.01 0.02 0.85 -2.16 -1.23 0.00 0.00 174.94 172.41 1ffq s PRO 193 N 2.42 3.82 -0.19 2.79 0.04 -1.25 -3.24 135.00 139.40 1ffq s PRO 193 Ca 0.31 0.63 -0.08 0.00 0.04 0.00 0.00 61.00 61.90 1ffq s PRO 193 Cb -0.16 -2.30 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1ffq s PRO 193 CO 0.09 -0.14 0.07 0.42 0.04 0.00 0.00 177.00 177.48 1ffq s ILE 194 N -2.50 4.88 0.56 0.56 1.01 -1.26 -1.46 121.20 122.99 1ffq s ILE 194 Ca 0.54 -0.00 -0.21 0.00 0.00 0.00 0.00 60.65 60.98 1ffq s ILE 194 Cb -0.10 -3.20 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 1ffq s ILE 194 CO 0.33 0.46 1.32 0.00 0.00 0.00 0.00 174.94 177.04 1ffq n GLY 196 N 0.71 3.95 0.00 0.00 0.00 -1.26 -1.77 105.19 106.82 1ffq n GLY 196 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1ffq n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffq n GLY 197 N -0.94 1.10 3.67 -0.02 0.00 -1.26 -3.97 105.19 103.77 1ffq n GLY 197 Ca 0.00 -0.74 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 1ffq n GLY 197 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ffq n ASN 198 N 0.00 2.65 0.00 1.61 3.02 -1.26 -0.57 115.26 120.71 1ffq n ASN 198 Ca 0.00 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.71 1ffq n ASN 198 Cb 0.00 -1.43 0.00 0.00 -0.61 0.00 0.00 39.78 37.74 1ffq n ASN 198 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ffq n GLY 199 N 1.80 2.85 0.06 7.41 0.00 -1.26 -4.77 105.19 111.28 1ffq n GLY 199 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 1ffq n GLY 199 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ffq n ILE 200 N -2.00 0.65 -2.11 -0.61 5.41 0.27 -4.73 119.36 116.23 1ffq n ILE 200 Ca 0.00 -0.25 -0.15 0.00 1.00 0.00 0.00 62.75 63.35 1ffq n ILE 200 Cb 0.00 -0.90 0.05 0.00 -0.71 0.00 0.00 39.64 38.09 1ffq n ILE 200 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1ffq n ASN 201 N -2.81 3.82 0.25 4.38 3.02 -0.82 -2.98 115.26 120.12 1ffq n ASN 201 Ca -0.20 -3.44 0.09 0.00 -0.03 0.00 0.00 54.58 51.00 1ffq n ASN 201 Cb 0.71 -0.39 0.65 0.00 -0.61 0.00 0.00 39.78 40.15 1ffq n ASN 201 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1ffq h ASP 202 N 2.05 0.00 -0.11 6.41 3.32 -1.85 -1.42 116.42 124.82 1ffq h ASP 202 Ca 0.22 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.30 1ffq h ASP 202 Cb 1.43 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.98 1ffq h ASP 202 CO 0.54 0.07 0.15 0.28 -1.72 0.00 0.00 179.24 178.57 1ffq h SER 203 N 0.00 0.00 0.86 6.45 0.02 -1.90 -1.61 113.55 117.37 1ffq h SER 203 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1ffq h SER 203 Cb 0.14 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 1ffq h SER 203 CO 0.01 0.00 -0.06 -0.07 -1.14 0.00 0.00 176.83 175.57 1ffq h LEU 204 N 0.00 0.00 -2.08 5.07 3.38 -1.29 -3.22 115.31 117.18 1ffq h LEU 204 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ffq h LEU 204 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1ffq h LEU 204 CO -0.00 0.06 0.00 0.11 0.09 0.00 0.00 178.44 178.70 1ffq h LYS 205 N 0.00 0.00 0.00 1.13 1.57 -1.42 -1.90 116.57 115.95 1ffq h LYS 205 Ca -0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1ffq h LYS 205 Cb 0.50 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1ffq h LYS 205 CO 0.01 0.00 -0.29 0.93 -0.57 0.00 0.00 179.45 179.53 1ffq h GLU 206 N 0.00 0.00 -5.58 3.15 4.39 -1.75 -3.40 114.58 111.38 1ffq h GLU 206 Ca 0.00 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 59.08 1ffq h GLU 206 Cb 0.25 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.77 1ffq h GLU 206 CO 0.00 0.29 0.22 0.42 -1.16 0.00 0.00 179.01 178.78 1ffq s ILE 207 N -4.20 4.85 0.19 3.13 -1.09 -0.71 -5.02 121.20 118.35 1ffq s ILE 207 Ca -0.03 0.74 -0.33 0.00 -2.23 0.00 0.00 60.65 58.81 1ffq s ILE 207 Cb 0.14 -4.11 -0.13 0.00 -1.58 0.00 0.00 42.46 36.78 1ffq s ILE 207 CO 0.69 -0.32 1.54 1.21 -1.23 0.00 0.00 174.94 176.83 1ffq n GLU 208 N 6.13 2.20 0.00 2.79 2.13 -1.26 -1.51 120.64 131.12 1ffq n GLU 208 Ca 0.00 0.79 0.00 0.00 0.66 0.00 0.00 57.16 58.61 1ffq n GLU 208 Cb 0.48 -2.54 0.00 0.00 0.27 0.00 0.00 31.44 29.66 1ffq n GLU 208 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ffq n GLY 209 N 3.04 2.62 0.07 8.31 0.00 -1.26 -4.89 105.19 113.08 1ffq n GLY 209 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1ffq n GLY 209 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1ffq h SER 210 N 0.00 0.05 -0.58 1.61 0.87 -1.51 -0.34 113.55 113.65 1ffq h SER 210 Ca 0.00 -0.47 0.05 0.00 -1.23 0.00 0.00 61.79 60.14 1ffq h SER 210 Cb 0.00 -0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 61.90 1ffq h SER 210 CO 0.00 0.51 0.31 0.15 -0.53 0.00 0.00 176.83 177.27 1ffq h PHE 211 N -0.41 0.56 0.19 2.24 3.57 -1.73 -1.81 116.94 119.55 1ffq h PHE 211 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1ffq h PHE 211 Cb 0.49 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.07 1ffq h PHE 211 CO 0.09 0.27 -0.09 1.96 -2.23 0.00 0.00 178.31 178.31 1ffq h GLN 212 N 0.58 -0.24 -0.73 1.11 7.50 -1.91 -1.61 115.11 119.80 1ffq h GLN 212 Ca 0.26 0.02 0.16 0.00 0.50 0.00 0.00 58.65 59.58 1ffq h GLN 212 Cb 0.16 0.05 -0.13 0.00 0.05 0.00 0.00 27.48 27.61 1ffq h GLN 212 CO -0.17 -0.12 -0.09 0.00 -1.50 0.00 0.00 178.83 176.95 1ffq h ALA 213 N 0.51 0.62 -0.62 3.87 0.00 -0.90 0.51 119.26 123.26 1ffq h ALA 213 Ca -0.03 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1ffq h ALA 213 Cb 0.23 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1ffq h ALA 213 CO 0.04 -0.42 0.34 1.25 0.00 0.00 0.00 179.25 180.46 1ffq h LEU 214 N 0.05 0.76 -0.82 0.00 5.85 -0.94 -1.67 115.31 118.53 1ffq h LEU 214 Ca 0.38 -0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.94 1ffq h LEU 214 Cb 0.62 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1ffq h LEU 214 CO -0.70 0.61 -0.22 1.56 -0.34 0.00 0.00 178.44 179.35 1ffq h GLN 215 N 0.86 0.63 -0.47 1.25 1.08 0.95 0.47 115.11 119.88 1ffq h GLN 215 Ca 0.22 -0.24 -0.11 0.00 -1.45 0.00 0.00 58.65 57.07 1ffq h GLN 215 Cb 0.02 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 1ffq h GLN 215 CO -0.04 0.81 -0.13 -0.09 -0.95 0.00 0.00 178.83 178.44 1ffq h ARG 216 N 0.56 0.92 -0.58 1.46 2.43 -1.00 -1.31 114.38 116.85 1ffq h ARG 216 Ca 0.08 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 58.89 1ffq h ARG 216 Cb 0.68 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 1ffq h ARG 216 CO 0.05 1.01 0.33 1.03 -1.51 0.00 0.00 179.97 180.88 1ffq h SER 217 N 0.76 0.71 -0.22 -3.80 0.87 -0.72 -2.80 113.55 108.35 1ffq h SER 217 Ca 0.12 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1ffq h SER 217 Cb 0.68 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1ffq h SER 217 CO 0.05 0.58 0.00 0.00 -0.53 0.00 0.00 176.83 176.93 1ffq s GLN 219 N -1.62 4.25 0.00 0.00 0.74 -0.51 -1.34 119.66 121.17 1ffq s GLN 219 Ca 0.18 2.30 0.00 0.00 0.05 0.00 0.00 55.36 57.89 1ffq s GLN 219 Cb 0.13 -3.15 0.00 0.00 1.10 0.00 0.00 33.01 31.09 1ffq s GLN 219 CO 0.07 -0.50 0.00 0.41 -0.55 0.00 0.00 175.29 174.73 1ffq n GLY 220 N 3.00 0.48 3.54 2.59 0.00 -1.26 -4.71 105.19 108.83 1ffq n GLY 220 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1ffq n GLY 220 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ffq s ARG 221 N -0.49 2.70 0.52 1.61 3.52 -0.45 -5.03 118.95 121.32 1ffq s ARG 221 Ca 0.00 -0.60 -0.21 0.00 -0.13 0.00 0.00 55.73 54.79 1ffq s ARG 221 Cb 0.00 -2.52 -0.06 0.00 -1.56 0.00 0.00 34.95 30.81 1ffq s ARG 221 CO 0.00 0.63 1.17 -1.21 -0.81 0.00 0.00 175.30 175.08 1ffq s GLU 222 N -0.73 3.41 0.62 5.12 2.02 -1.26 -4.96 118.70 122.91 1ffq s GLU 222 Ca 0.11 1.75 -0.16 0.00 0.02 0.00 0.00 54.97 56.69 1ffq s GLU 222 Cb -0.11 -2.15 -0.02 0.00 0.10 0.00 0.00 34.13 31.95 1ffq s GLU 222 CO 0.01 -0.83 1.10 -0.51 0.02 0.00 0.00 175.26 175.05 1ffq s ASP 223 N -1.54 5.40 0.00 -0.19 1.01 -1.26 -3.29 116.67 116.80 1ffq s ASP 223 Ca 0.70 2.01 0.00 0.00 0.71 0.00 0.00 52.55 55.97 1ffq s ASP 223 Cb -0.28 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.10 1ffq s ASP 223 CO 0.32 -1.43 0.00 0.49 0.21 0.00 0.00 175.17 174.76 1ffq n PHE 224 N -2.05 0.00 -3.93 4.23 3.72 -0.73 -4.96 117.46 113.74 1ffq n PHE 224 Ca 0.10 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.17 1ffq n PHE 224 Cb 0.52 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.01 1ffq n PHE 224 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1ffq s LYS 225 N -0.19 3.38 0.68 -1.08 1.02 -1.21 -2.94 119.74 119.41 1ffq s LYS 225 Ca 0.00 -0.37 -0.11 0.00 0.02 0.00 0.00 55.97 55.51 1ffq s LYS 225 Cb 0.00 -3.05 -0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1ffq s LYS 225 CO 0.00 0.66 1.06 0.14 -0.92 0.00 0.00 175.35 176.29 1ffq s VAL 226 N -1.34 4.08 0.00 3.17 -7.23 -1.26 -0.87 120.40 116.95 1ffq s VAL 226 Ca 0.28 0.71 0.00 0.00 -1.81 0.00 0.00 61.98 61.16 1ffq s VAL 226 Cb -0.13 -3.44 0.00 0.00 0.56 0.00 0.00 36.38 33.37 1ffq s VAL 226 CO 0.20 -0.85 0.00 -0.24 -0.31 0.00 0.00 175.10 173.90 1ffq n SER 227 N -2.97 0.00 -4.17 4.85 2.88 -0.54 -4.78 113.62 108.89 1ffq n SER 227 Ca 0.07 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.31 1ffq n SER 227 Cb 0.53 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.83 1ffq n SER 227 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1ffq s ILE 228 N -1.23 1.85 0.03 2.46 1.01 -1.26 -3.94 121.20 120.12 1ffq s ILE 228 Ca 0.00 -0.90 -0.18 0.00 0.00 0.00 0.00 60.65 59.57 1ffq s ILE 228 Cb 0.00 -1.62 -0.21 0.00 0.01 0.00 0.00 42.46 40.65 1ffq s ILE 228 CO 0.00 0.51 1.17 -0.74 0.00 0.00 0.00 174.94 175.88 1ffq h HIS 229 N 6.78 0.69 -3.20 3.97 2.76 -1.93 -3.39 115.15 120.84 1ffq h HIS 229 Ca -0.22 -0.34 -0.63 0.00 -2.20 0.00 0.00 60.37 56.98 1ffq h HIS 229 Cb 1.23 -0.09 -0.41 0.00 1.55 0.00 0.00 27.41 29.69 1ffq h HIS 229 CO 0.47 1.15 -0.68 0.34 -1.30 0.00 0.00 177.93 177.91 1ffq s ASP 230 N -6.77 4.00 0.52 3.26 -1.08 -1.26 -4.57 116.67 110.78 1ffq s ASP 230 Ca -0.13 -2.80 0.17 0.00 -0.52 0.00 0.00 52.55 49.27 1ffq s ASP 230 Cb 0.05 -1.34 1.28 0.00 -1.46 0.00 0.00 42.92 41.44 1ffq s ASP 230 CO 0.83 -0.25 2.13 -0.65 0.52 0.00 0.00 175.17 177.75 1ffq h PRO 231 N 6.64 0.01 0.71 4.34 0.11 -1.94 -0.57 132.00 141.30 1ffq h PRO 231 Ca -0.05 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 1ffq h PRO 231 Cb 0.91 -0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.03 1ffq h PRO 231 CO 0.59 0.01 -0.34 0.35 -0.21 0.00 0.00 178.00 178.39 1ffq h PHE 232 N 0.01 -0.88 -0.69 0.65 3.57 -1.96 -0.79 116.94 116.85 1ffq h PHE 232 Ca 0.04 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1ffq h PHE 232 Cb 0.15 0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1ffq h PHE 232 CO -0.00 -0.52 0.26 0.00 -2.23 0.00 0.00 178.31 175.82 1ffq h ALA 233 N -0.90 1.17 -0.04 2.41 0.00 -1.85 0.13 119.26 120.18 1ffq h ALA 233 Ca -0.10 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.47 1ffq h ALA 233 Cb 0.76 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1ffq h ALA 233 CO 0.16 0.60 -0.70 0.00 0.00 0.00 0.00 179.25 179.31 1ffq h ALA 234 N 1.29 0.73 0.00 0.00 0.00 -1.03 -1.02 119.26 119.23 1ffq h ALA 234 Ca 0.23 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1ffq h ALA 234 Cb 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ffq h ALA 234 CO -0.02 0.80 -0.16 1.28 0.00 0.00 0.00 179.25 181.15 1ffq n LEU 235 N -3.79 0.00 0.00 0.00 4.77 -0.31 -0.40 117.00 117.26 1ffq n LEU 235 Ca -0.03 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1ffq n LEU 235 Cb 0.69 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 1ffq n LEU 235 CO 0.46 0.00 -0.40 0.00 -1.33 0.00 0.00 177.39 176.12 1ffq n GLN 236 N -0.31 1.26 -2.18 3.23 1.13 0.23 -0.94 117.38 119.81 1ffq n GLN 236 Ca 0.00 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.65 1ffq n GLN 236 Cb 0.00 -0.89 -0.03 0.00 0.11 0.00 0.00 30.24 29.43 1ffq n GLN 236 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1ffq s LYS 237 N -1.70 4.38 0.23 -1.09 2.20 0.16 -4.63 119.74 119.29 1ffq s LYS 237 Ca 0.00 2.11 -0.31 0.00 -0.36 0.00 0.00 55.97 57.41 1ffq s LYS 237 Cb 0.00 -3.15 -0.11 0.00 -1.51 0.00 0.00 37.83 33.05 1ffq s LYS 237 CO 0.00 -0.24 1.63 0.00 -0.36 0.00 0.00 175.35 176.39 1ffq s ALA 238 N -0.26 3.83 0.08 3.13 0.00 -1.26 -0.55 121.76 126.73 1ffq s ALA 238 Ca 0.55 1.53 -0.04 0.00 0.00 0.00 0.00 51.96 54.00 1ffq s ALA 238 Cb -0.38 -3.66 -0.03 0.00 0.00 0.00 0.00 23.12 19.06 1ffq s ALA 238 CO 0.42 -0.91 0.06 -0.65 0.00 0.00 0.00 175.76 174.69 1ffq s GLN 239 N 0.49 0.74 -0.05 0.00 -1.52 -1.16 -4.85 119.66 113.32 1ffq s GLN 239 Ca 0.69 -1.17 -0.37 0.00 -1.95 0.00 0.00 55.36 52.57 1ffq s GLN 239 Cb -0.48 0.26 -0.15 0.00 -0.22 0.00 0.00 33.01 32.43 1ffq s GLN 239 CO 0.38 -0.19 1.63 1.17 -0.25 0.00 0.00 175.29 178.03 1ffq n LYS 240 N 0.02 1.58 0.00 2.91 4.81 -1.26 -0.53 118.16 125.69 1ffq n LYS 240 Ca -0.13 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 1ffq n LYS 240 Cb 0.62 -2.30 0.00 0.00 0.02 0.00 0.00 35.03 33.37 1ffq n LYS 240 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ffq n GLY 241 N 3.62 2.37 2.46 3.14 0.00 -1.26 -4.88 105.19 110.64 1ffq n GLY 241 Ca 0.21 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.03 1ffq n GLY 241 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ffq n VAL 242 N -2.00 0.98 0.53 1.61 0.24 0.31 -4.87 118.33 115.13 1ffq n VAL 242 Ca 0.00 -4.80 0.05 0.00 -2.04 0.00 0.00 64.34 57.56 1ffq n VAL 242 Cb 0.00 -0.57 -0.06 0.00 -1.47 0.00 0.00 33.84 31.74 1ffq n VAL 242 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1ffq n THR 243 N 0.07 0.00 -2.07 3.34 -2.24 -1.22 -2.96 114.28 109.20 1ffq n THR 243 Ca 0.26 -0.25 -0.39 0.00 -2.27 0.00 0.00 64.05 61.41 1ffq n THR 243 Cb 0.59 1.01 -0.00 0.00 -2.10 0.00 0.00 70.33 69.83 1ffq n THR 243 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ffq s ALA 244 N -2.02 3.17 0.30 6.98 0.00 -1.26 -4.90 121.76 124.03 1ffq s ALA 244 Ca 0.05 1.19 0.01 0.00 0.00 0.00 0.00 51.96 53.21 1ffq s ALA 244 Cb 0.08 -3.47 0.55 0.00 0.00 0.00 0.00 23.12 20.28 1ffq s ALA 244 CO 0.45 -0.84 1.88 0.11 0.00 0.00 0.00 175.76 177.36 1ffq h TRP 245 N 2.47 1.07 -0.56 0.00 5.08 -2.03 0.26 115.95 122.24 1ffq h TRP 245 Ca -0.50 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.50 1ffq h TRP 245 Cb 1.25 -0.35 0.00 0.00 -3.00 0.00 0.00 29.16 27.06 1ffq h TRP 245 CO 0.53 0.50 0.00 -0.40 -1.28 0.00 0.00 178.44 177.79 1ffq n ASP 246 N -4.54 4.11 -4.63 0.11 5.68 -1.26 -4.83 116.55 111.20 1ffq n ASP 246 Ca 0.16 -2.36 -0.43 0.00 -0.50 0.00 0.00 54.79 51.66 1ffq n ASP 246 Cb 0.28 -0.53 -0.03 0.00 -1.14 0.00 0.00 41.12 39.70 1ffq n ASP 246 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1ffq s ASP 247 N -0.84 6.37 0.19 -1.12 1.01 0.08 -4.91 116.67 117.44 1ffq s ASP 247 Ca 0.44 1.76 -0.11 0.00 0.71 0.00 0.00 52.55 55.35 1ffq s ASP 247 Cb 0.28 -2.53 0.11 0.00 1.01 0.00 0.00 42.92 41.79 1ffq s ASP 247 CO 0.22 -1.24 1.80 1.55 0.21 0.00 0.00 175.17 177.71 1ffq h PRO 248 N 10.80 0.92 -4.75 8.23 0.13 -1.88 -3.39 132.00 142.07 1ffq h PRO 248 Ca -0.35 -0.11 -0.69 0.00 -0.87 0.00 0.00 66.00 63.98 1ffq h PRO 248 Cb 1.16 -0.18 -0.31 0.00 0.13 0.00 0.00 31.00 31.80 1ffq h PRO 248 CO 0.99 0.69 -0.67 0.71 -0.23 0.00 0.00 178.00 179.49 1ffq s TYR 249 N -5.85 3.25 0.00 1.56 2.02 -1.26 -4.77 117.35 112.30 1ffq s TYR 249 Ca -0.13 -1.72 0.00 0.00 -0.37 0.00 0.00 57.07 54.85 1ffq s TYR 249 Cb 0.14 -2.16 0.00 0.00 -0.40 0.00 0.00 41.96 39.54 1ffq s TYR 249 CO 0.78 -0.78 0.00 1.63 -1.57 0.00 0.00 175.55 175.62 1ffq n LYS 250 N 4.68 3.97 0.00 -0.62 5.02 -0.12 -4.16 118.16 126.94 1ffq n LYS 250 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1ffq n LYS 250 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.45 1ffq n LYS 250 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ffq n GLY 251 N 5.00 1.00 0.20 0.72 0.00 0.29 -0.63 105.19 111.77 1ffq n GLY 251 Ca 0.00 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 1ffq n GLY 251 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ffq h ASN 252 N 5.96 0.79 -0.33 1.61 2.35 -0.67 -2.64 115.58 122.65 1ffq h ASN 252 Ca 0.00 -0.54 -0.09 0.00 -0.55 0.00 0.00 56.30 55.12 1ffq h ASN 252 Cb 0.00 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 1ffq h ASN 252 CO 0.00 1.32 -0.16 -0.26 -1.65 0.00 0.00 177.43 176.68 1ffq h PHE 253 N 0.43 0.80 -0.88 1.19 -1.00 -0.80 0.99 116.94 117.67 1ffq h PHE 253 Ca -0.06 -0.20 -0.02 0.00 2.81 0.00 0.00 57.97 60.50 1ffq h PHE 253 Cb 1.42 -0.18 -0.04 0.00 3.61 0.00 0.00 35.95 40.76 1ffq h PHE 253 CO 0.07 0.90 0.46 0.78 -1.61 0.00 0.00 178.31 178.92 1ffq h GLY 254 N 0.47 1.34 1.03 -1.45 0.00 -0.86 -1.71 103.07 101.88 1ffq h GLY 254 Ca 0.07 -0.63 -0.07 0.00 0.00 0.00 0.00 47.33 46.71 1ffq h GLY 254 CO 0.05 0.60 0.12 1.46 0.00 0.00 0.00 176.54 178.77 1ffq h GLN 255 N 1.24 0.98 -0.90 4.80 4.20 -1.29 -2.61 115.11 121.53 1ffq h GLN 255 Ca 0.31 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 1ffq h GLN 255 Cb 0.06 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.68 1ffq h GLN 255 CO -0.05 0.91 0.55 -0.07 -0.67 0.00 0.00 178.83 179.51 1ffq h LEU 256 N 0.89 1.07 -0.59 1.46 3.38 -0.54 0.93 115.31 121.90 1ffq h LEU 256 Ca 0.18 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1ffq h LEU 256 Cb 0.40 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1ffq h LEU 256 CO 0.01 0.81 0.35 0.24 0.09 0.00 0.00 178.44 179.94 1ffq h MET 257 N 1.23 0.67 0.00 1.13 2.86 -1.14 -0.43 114.93 119.25 1ffq h MET 257 Ca 0.32 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.80 1ffq h MET 257 Cb -0.07 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.42 1ffq h MET 257 CO -0.06 0.44 -0.57 0.00 1.06 0.00 0.00 176.91 177.78 1ffq h ALA 258 N 1.27 0.87 -0.31 6.32 0.00 -1.11 -2.38 119.26 123.93 1ffq h ALA 258 Ca 0.24 -0.52 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 1ffq h ALA 258 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1ffq h ALA 258 CO -0.11 0.72 -0.30 1.25 0.00 0.00 0.00 179.25 180.81 1ffq h LEU 259 N 0.00 0.65 -0.94 0.00 5.85 -0.31 0.15 115.31 120.72 1ffq h LEU 259 Ca -0.01 -0.25 -0.08 0.00 0.84 0.00 0.00 57.88 58.39 1ffq h LEU 259 Cb 1.14 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 1ffq h LEU 259 CO 0.07 0.91 -0.05 0.11 -0.34 0.00 0.00 178.44 179.15 1ffq h LYS 260 N 0.55 0.72 -0.80 1.25 1.79 -0.84 0.28 116.57 119.52 1ffq h LYS 260 Ca 0.07 -0.20 -0.01 0.00 -2.18 0.00 0.00 60.65 58.32 1ffq h LYS 260 Cb 0.78 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 31.32 1ffq h LYS 260 CO 0.06 0.77 0.44 1.96 -1.08 0.00 0.00 179.45 181.60 1ffq h GLN 261 N 0.67 1.11 -0.11 3.15 1.08 -1.14 -2.39 115.11 117.48 1ffq h GLN 261 Ca 0.13 -0.13 -0.15 0.00 -1.45 0.00 0.00 58.65 57.05 1ffq h GLN 261 Cb 0.48 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 1ffq h GLN 261 CO 0.02 0.82 -0.56 0.00 -0.95 0.00 0.00 178.83 178.16 1ffq h ALA 262 N 1.23 0.83 -2.49 3.87 0.00 -0.69 -3.41 119.26 118.60 1ffq h ALA 262 Ca 0.28 -0.52 -0.59 0.00 0.00 0.00 0.00 54.91 54.08 1ffq h ALA 262 Cb 0.02 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 17.33 1ffq h ALA 262 CO -0.05 0.70 -0.85 0.72 0.00 0.00 0.00 179.25 179.77 1ffq n HIS 263 N -3.92 0.70 0.30 0.00 8.25 0.93 -4.97 115.22 116.50 1ffq n HIS 263 Ca -0.03 -3.69 0.16 0.00 -0.26 0.00 0.00 57.72 53.90 1ffq n HIS 263 Cb 0.60 -0.14 0.95 0.00 1.12 0.00 0.00 29.99 32.51 1ffq n HIS 263 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1ffq h PRO 264 N 5.19 0.00 -0.03 -0.41 0.11 -1.66 0.10 132.00 135.30 1ffq h PRO 264 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1ffq h PRO 264 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1ffq h PRO 264 CO 0.52 0.01 -0.06 -0.25 -0.21 0.00 0.00 178.00 178.01 1ffq n ASP 265 N -3.72 2.81 -4.73 -2.05 8.00 -1.26 -4.89 116.55 110.70 1ffq n ASP 265 Ca -0.03 -1.90 -0.42 0.00 0.71 0.00 0.00 54.79 53.15 1ffq n ASP 265 Cb 0.09 0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 1ffq n ASP 265 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1ffq s LEU 266 N -1.99 4.37 -0.19 0.64 2.96 0.02 -4.97 118.68 119.52 1ffq s LEU 266 Ca 0.26 2.75 -0.23 0.00 -0.22 0.00 0.00 54.13 56.69 1ffq s LEU 266 Cb 0.19 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.25 1ffq s LEU 266 CO 0.32 -0.86 0.73 -0.54 -1.32 0.00 0.00 176.35 174.69 1ffq s LYS 267 N 0.61 4.24 -0.30 1.98 -0.14 -0.42 -4.97 119.74 120.74 1ffq s LYS 267 Ca 0.68 0.81 -0.05 0.00 -1.36 0.00 0.00 55.97 56.05 1ffq s LYS 267 Cb -0.46 -3.58 0.02 0.00 -1.68 0.00 0.00 37.83 32.13 1ffq s LYS 267 CO 0.36 -0.30 0.05 0.42 -0.76 0.00 0.00 175.35 175.13 1ffq s ILE 268 N 2.09 3.64 -0.06 2.17 1.01 -1.26 -0.42 121.20 128.37 1ffq s ILE 268 Ca 0.33 -0.92 0.04 0.00 0.00 0.00 0.00 60.65 60.11 1ffq s ILE 268 Cb -0.16 -2.94 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 1ffq s ILE 268 CO 0.11 0.02 -0.19 -0.76 0.00 0.00 0.00 174.94 174.12 1ffq s LEU 269 N 1.42 2.41 0.10 2.97 1.43 -0.21 -0.04 118.68 126.76 1ffq s LEU 269 Ca 0.00 -0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 52.44 1ffq s LEU 269 Cb -0.18 -1.47 -0.06 0.00 0.03 0.00 0.00 46.19 44.51 1ffq s LEU 269 CO 0.01 0.27 1.05 -2.16 0.23 0.00 0.00 176.35 175.75 1ffq s PRO 270 N -0.32 4.60 -0.20 1.29 0.04 -1.26 -0.68 135.00 138.47 1ffq s PRO 270 Ca 0.02 1.58 -0.06 0.00 0.04 0.00 0.00 61.00 62.58 1ffq s PRO 270 Cb -0.13 -3.36 -0.03 0.00 0.04 0.00 0.00 34.50 31.03 1ffq s PRO 270 CO 0.02 0.04 0.02 0.45 0.04 0.00 0.00 177.00 177.58 1ffq s SER 271 N 0.32 5.06 -0.27 6.66 0.15 -0.01 -1.50 113.70 124.11 1ffq s SER 271 Ca 0.51 -0.12 -0.09 0.00 0.70 0.00 0.00 55.95 56.94 1ffq s SER 271 Cb -0.26 -1.87 -0.04 0.00 -1.71 0.00 0.00 66.02 62.15 1ffq s SER 271 CO 0.31 0.09 0.13 -0.63 1.20 0.00 0.00 173.24 174.35 1ffq s ILE 272 N 0.84 4.81 0.00 6.45 1.01 -0.30 0.02 121.20 134.03 1ffq s ILE 272 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.63 1ffq s ILE 272 Cb -0.14 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.04 1ffq s ILE 272 CO 0.02 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.85 1ffq n GLY 273 N 4.99 0.24 0.19 6.18 0.00 -1.20 -0.95 105.19 114.64 1ffq n GLY 273 Ca -0.15 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1ffq n GLY 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffq n GLY 274 N 0.00 -3.19 0.29 -0.02 0.00 0.18 -4.08 105.19 98.37 1ffq n GLY 274 Ca 0.00 -1.80 -0.03 0.00 0.00 0.00 0.00 46.02 44.19 1ffq n GLY 274 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1ffq h TRP 275 N 0.00 0.90 -0.02 1.61 2.91 -1.92 -2.91 115.95 116.53 1ffq h TRP 275 Ca 0.00 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.04 1ffq h TRP 275 Cb 0.00 -0.30 0.00 0.00 -0.51 0.00 0.00 29.16 28.35 1ffq h TRP 275 CO 0.00 0.53 -0.43 0.25 -1.03 0.00 0.00 178.44 177.75 1ffq n THR 276 N -4.61 0.00 -2.18 2.65 -2.24 -1.26 -4.24 114.28 102.39 1ffq n THR 276 Ca 0.08 -0.28 -0.06 0.00 -2.27 0.00 0.00 64.05 61.52 1ffq n THR 276 Cb 0.07 1.26 0.08 0.00 -2.10 0.00 0.00 70.33 69.64 1ffq n THR 276 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ffq n LEU 277 N 0.02 2.87 -0.00 3.22 4.77 -1.11 -3.49 117.00 123.28 1ffq n LEU 277 Ca 0.09 -3.64 0.08 0.00 -0.03 0.00 0.00 56.01 52.51 1ffq n LEU 277 Cb 0.45 -0.15 -0.10 0.00 -2.33 0.00 0.00 43.42 41.30 1ffq n LEU 277 CO 0.26 1.39 -0.10 -1.20 -1.33 0.00 0.00 177.39 176.42 1ffq n SER 278 N -0.57 0.81 -0.34 -1.43 7.64 -1.12 -3.97 113.62 114.63 1ffq n SER 278 Ca 0.22 -0.82 0.08 0.00 1.01 0.00 0.00 58.87 59.36 1ffq n SER 278 Cb 0.89 1.07 0.26 0.00 -1.01 0.00 0.00 64.21 65.42 1ffq n SER 278 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1ffq h ASP 279 N 0.00 0.88 -0.02 6.43 5.19 -1.85 -2.19 116.42 124.87 1ffq h ASP 279 Ca 0.00 0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.42 1ffq h ASP 279 Cb 0.43 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.79 1ffq h ASP 279 CO 0.00 0.48 -0.05 -0.65 -3.12 0.00 0.00 179.24 175.89 1ffq h PRO 280 N 0.95 0.19 -0.48 3.56 0.11 -1.81 -1.68 132.00 132.84 1ffq h PRO 280 Ca 0.48 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 66.65 1ffq h PRO 280 Cb 0.49 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.54 1ffq h PRO 280 CO -0.24 0.26 0.33 0.74 -0.21 0.00 0.00 178.00 178.87 1ffq h PHE 281 N 0.18 0.27 0.00 0.65 0.04 -1.73 -1.76 116.94 114.59 1ffq h PHE 281 Ca 0.04 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1ffq h PHE 281 Cb 0.22 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.28 1ffq h PHE 281 CO 0.00 0.13 0.00 1.19 -0.60 0.00 0.00 178.31 179.03 1ffq n PHE 282 N -4.46 0.49 1.16 -0.55 3.72 -0.63 -1.30 117.46 115.89 1ffq n PHE 282 Ca 0.07 0.22 0.12 0.00 -0.05 0.00 0.00 57.45 57.82 1ffq n PHE 282 Cb 0.37 -0.86 0.22 0.00 -0.94 0.00 0.00 39.48 38.27 1ffq n PHE 282 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1ffq n PHE 283 N -1.97 0.00 1.75 1.38 3.01 -0.66 -4.53 117.46 116.44 1ffq n PHE 283 Ca 0.01 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.52 1ffq n PHE 283 Cb 0.11 -0.02 0.28 0.00 -0.01 0.00 0.00 39.48 39.84 1ffq n PHE 283 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 1ffq n MET 284 N 0.43 1.20 0.27 -1.08 2.81 -0.42 -1.95 117.12 118.39 1ffq n MET 284 Ca 0.14 -0.31 0.16 0.00 -1.81 0.00 0.00 57.70 55.87 1ffq n MET 284 Cb 0.47 -1.20 0.71 0.00 -0.71 0.00 0.00 33.22 32.49 1ffq n MET 284 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1ffq h GLY 285 N 5.55 0.00 -7.09 3.03 0.00 -1.80 -3.38 103.07 99.37 1ffq h GLY 285 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1ffq h GLY 285 CO 0.00 0.00 1.20 -0.35 0.00 0.00 0.00 176.54 177.39 1ffq s ASP 286 N -5.80 5.90 0.54 0.19 2.15 -0.82 -4.90 116.67 113.93 1ffq s ASP 286 Ca -0.00 0.60 0.20 0.00 0.43 0.00 0.00 52.55 53.78 1ffq s ASP 286 Cb 0.10 -2.54 1.41 0.00 -0.30 0.00 0.00 42.92 41.60 1ffq s ASP 286 CO 0.55 -1.83 2.17 0.50 -0.17 0.00 0.00 175.17 176.39 1ffq h LYS 287 N 12.36 0.00 -0.41 4.34 3.64 -1.89 0.36 116.57 134.97 1ffq h LYS 287 Ca -0.28 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.18 1ffq h LYS 287 Cb 1.13 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.88 1ffq h LYS 287 CO 1.14 0.00 -0.03 0.28 -2.27 0.00 0.00 179.45 178.57 1ffq h VAL 288 N 0.00 0.66 -0.22 2.00 2.07 -1.93 -0.27 116.25 118.56 1ffq h VAL 288 Ca 0.01 -0.03 -0.13 0.00 0.82 0.00 0.00 66.70 67.37 1ffq h VAL 288 Cb 0.03 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1ffq h VAL 288 CO -0.00 0.01 -0.36 0.11 0.02 0.00 0.00 177.57 177.36 1ffq h LYS 289 N 0.08 0.63 -0.29 1.57 1.57 -1.33 -2.82 116.57 115.98 1ffq h LYS 289 Ca 0.20 -0.38 0.04 0.00 -1.87 0.00 0.00 60.65 58.64 1ffq h LYS 289 Cb 0.30 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.60 1ffq h LYS 289 CO -0.36 1.00 0.03 -0.09 -0.57 0.00 0.00 179.45 179.46 1ffq h ARG 290 N 0.32 0.12 -0.82 3.15 2.43 -0.99 -0.22 114.38 118.37 1ffq h ARG 290 Ca 0.02 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1ffq h ARG 290 Cb 0.95 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.43 1ffq h ARG 290 CO 0.08 0.08 0.42 -0.44 -1.51 0.00 0.00 179.97 178.61 1ffq h ASP 291 N 0.13 1.06 -0.45 -3.80 3.32 -1.09 -0.64 116.42 114.95 1ffq h ASP 291 Ca 0.13 -0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.08 1ffq h ASP 291 Cb 0.16 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1ffq h ASP 291 CO -0.20 0.87 0.28 -0.09 -1.72 0.00 0.00 179.24 178.39 1ffq h ARG 292 N 1.16 0.55 0.32 3.56 2.43 -1.22 -0.24 114.38 120.94 1ffq h ARG 292 Ca 0.29 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1ffq h ARG 292 Cb 0.08 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 1ffq h ARG 292 CO -0.04 0.37 -0.40 0.35 -1.51 0.00 0.00 179.97 178.73 1ffq h PHE 293 N 0.57 -1.11 -0.73 2.20 3.57 -0.72 -0.63 116.94 120.08 1ffq h PHE 293 Ca 0.17 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.73 1ffq h PHE 293 Cb -0.03 0.44 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 1ffq h PHE 293 CO -0.06 -0.54 0.45 0.28 -2.23 0.00 0.00 178.31 176.21 1ffq h VAL 294 N -0.77 1.06 -0.67 1.41 2.07 -1.04 -1.16 116.25 117.15 1ffq h VAL 294 Ca -0.02 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 1ffq h VAL 294 Cb 0.71 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1ffq h VAL 294 CO -0.11 0.16 0.36 1.23 0.02 0.00 0.00 177.57 179.23 1ffq h GLY 295 N 0.86 0.98 1.78 2.17 0.00 -0.95 -1.56 103.07 106.36 1ffq h GLY 295 Ca 0.31 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 1ffq h GLY 295 CO -0.14 0.41 -0.21 1.48 0.00 0.00 0.00 176.54 178.09 1ffq h SER 296 N 0.93 0.25 -0.49 0.19 4.64 0.04 -1.07 113.55 118.04 1ffq h SER 296 Ca 0.24 -0.07 -0.08 0.00 -0.47 0.00 0.00 61.79 61.41 1ffq h SER 296 Cb 0.03 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 1ffq h SER 296 CO -0.04 0.47 -0.01 0.58 -0.87 0.00 0.00 176.83 176.97 1ffq h VAL 297 N 0.24 1.26 -0.28 0.95 2.07 -0.82 -0.06 116.25 119.61 1ffq h VAL 297 Ca 0.04 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.50 1ffq h VAL 297 Cb 0.51 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1ffq h VAL 297 CO 0.03 0.38 0.15 0.50 0.02 0.00 0.00 177.57 178.66 1ffq h LYS 298 N 0.72 0.31 -0.58 1.57 3.64 -0.92 -0.11 116.57 121.19 1ffq h LYS 298 Ca 0.14 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.43 1ffq h LYS 298 Cb 0.52 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1ffq h LYS 298 CO 0.03 0.21 0.08 1.49 -2.27 0.00 0.00 179.45 178.99 1ffq h GLU 299 N 0.32 0.95 -0.70 1.90 4.81 -1.06 0.25 114.58 121.05 1ffq h GLU 299 Ca 0.11 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1ffq h GLU 299 Cb 0.02 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 1ffq h GLU 299 CO -0.07 0.88 0.45 0.35 -0.73 0.00 0.00 179.01 179.89 1ffq h PHE 300 N 0.89 0.89 -0.00 0.92 3.57 -0.44 0.97 116.94 123.74 1ffq h PHE 300 Ca 0.18 0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.55 1ffq h PHE 300 Cb 0.41 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 1ffq h PHE 300 CO 0.03 0.58 -0.68 -0.07 -2.23 0.00 0.00 178.31 175.93 1ffq h LEU 301 N 0.95 0.03 -1.00 0.59 3.38 -0.56 0.68 115.31 119.38 1ffq h LEU 301 Ca 0.25 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 1ffq h LEU 301 Cb -0.08 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1ffq h LEU 301 CO -0.05 0.70 -0.39 1.56 0.09 0.00 0.00 178.44 180.35 1ffq h GLN 302 N 0.02 0.22 -0.05 1.13 4.20 -0.58 -3.22 115.11 116.82 1ffq h GLN 302 Ca -0.01 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.55 1ffq h GLN 302 Cb 1.21 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1ffq h GLN 302 CO 0.09 0.58 -0.16 1.15 -0.67 0.00 0.00 178.83 179.82 1ffq h THR 303 N 0.19 1.44 -3.37 -0.54 2.02 -0.42 -3.41 112.91 108.82 1ffq h THR 303 Ca 0.02 -1.54 -0.68 0.00 0.77 0.00 0.00 66.41 64.97 1ffq h THR 303 Cb 0.77 2.31 -0.37 0.00 -1.74 0.00 0.00 68.15 69.13 1ffq h THR 303 CO 0.06 0.43 -0.30 0.26 0.37 0.00 0.00 175.52 176.34 1ffq s TRP 304 N -3.79 3.62 -1.07 3.16 0.52 0.20 -4.73 118.94 116.85 1ffq s TRP 304 Ca -0.15 -2.98 0.21 0.00 0.02 0.00 0.00 56.10 53.19 1ffq s TRP 304 Cb 0.03 -3.11 0.90 0.00 -1.15 0.00 0.00 33.47 30.14 1ffq s TRP 304 CO 0.73 -0.74 1.66 1.63 0.02 0.00 0.00 176.95 180.25 1ffq n LYS 305 N 2.71 0.05 0.28 4.98 5.02 -1.21 -2.55 118.16 127.44 1ffq n LYS 305 Ca 0.15 0.14 0.18 0.00 -2.02 0.00 0.00 58.31 56.76 1ffq n LYS 305 Cb 0.37 -1.50 0.73 0.00 -0.02 0.00 0.00 35.03 34.61 1ffq n LYS 305 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1ffq h PHE 306 N 0.00 0.00 -3.93 2.13 -0.00 -1.62 -3.44 116.94 110.08 1ffq h PHE 306 Ca 0.00 0.00 -0.47 0.00 -0.00 0.00 0.00 57.97 57.50 1ffq h PHE 306 Cb 0.33 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.27 1ffq h PHE 306 CO 0.00 0.00 0.38 -0.06 -0.00 0.00 0.00 178.31 178.63 1ffq s PHE 307 N -3.70 3.47 -0.23 6.09 0.08 -1.06 -4.60 117.98 118.04 1ffq s PHE 307 Ca 0.01 1.70 0.13 0.00 0.12 0.00 0.00 56.93 58.89 1ffq s PHE 307 Cb 0.09 -3.01 0.50 0.00 -0.57 0.00 0.00 43.02 40.03 1ffq s PHE 307 CO 0.52 -0.19 1.42 -0.25 -0.10 0.00 0.00 175.22 176.62 1ffq n ASP 308 N 0.19 3.05 0.00 1.36 8.00 0.95 -4.98 116.55 125.12 1ffq n ASP 308 Ca 0.04 -3.40 0.00 0.00 0.71 0.00 0.00 54.79 52.13 1ffq n ASP 308 Cb 0.50 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 1ffq n ASP 308 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ffq n GLY 309 N -0.90 0.14 3.46 0.44 0.00 -1.26 -0.67 105.19 106.40 1ffq n GLY 309 Ca 0.27 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 45.01 1ffq n GLY 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ffq s VAL 310 N -4.00 0.01 -0.16 1.61 0.11 -0.32 -4.25 120.40 113.40 1ffq s VAL 310 Ca 0.00 -0.07 0.01 0.00 -2.93 0.00 0.00 61.98 58.99 1ffq s VAL 310 Cb 0.00 -0.83 0.00 0.00 -1.53 0.00 0.00 36.38 34.02 1ffq s VAL 310 CO 0.00 -0.04 -0.17 -0.62 -3.33 0.00 0.00 175.10 170.95 1ffq s ASP 311 N -0.28 3.49 -0.27 3.54 2.15 -0.57 -1.31 116.67 123.43 1ffq s ASP 311 Ca -0.05 -0.53 -0.09 0.00 0.43 0.00 0.00 52.55 52.32 1ffq s ASP 311 Cb -0.03 -1.54 -0.04 0.00 -0.30 0.00 0.00 42.92 41.02 1ffq s ASP 311 CO 0.03 0.06 0.13 -0.63 -0.17 0.00 0.00 175.17 174.59 1ffq s ILE 312 N 0.96 4.77 -0.65 4.11 -1.09 0.26 -1.15 121.20 128.41 1ffq s ILE 312 Ca -0.03 -0.03 0.06 0.00 -2.23 0.00 0.00 60.65 58.42 1ffq s ILE 312 Cb -0.15 -3.26 0.24 0.00 -1.58 0.00 0.00 42.46 37.71 1ffq s ILE 312 CO -0.03 0.28 0.72 -0.67 -1.23 0.00 0.00 174.94 174.01 1ffq n ASP 313 N 4.99 3.71 -4.58 3.58 2.03 -0.13 -1.40 116.55 124.75 1ffq n ASP 313 Ca -0.15 -3.42 -0.43 0.00 0.52 0.00 0.00 54.79 51.32 1ffq n ASP 313 Cb 0.52 -0.69 -0.05 0.00 -0.72 0.00 0.00 41.12 40.18 1ffq n ASP 313 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1ffq s TRP 314 N -2.36 3.06 -0.44 -0.67 -0.00 -1.26 -0.65 118.94 116.62 1ffq s TRP 314 Ca 0.38 0.53 -0.01 0.00 -0.00 0.00 0.00 56.10 56.99 1ffq s TRP 314 Cb 0.12 -3.58 0.12 0.00 -0.00 0.00 0.00 33.47 30.13 1ffq s TRP 314 CO -0.03 -0.85 0.22 -1.21 -0.00 0.00 0.00 176.95 175.09 1ffq s GLU 315 N 3.32 2.00 0.00 5.86 2.02 -1.26 -4.21 118.70 126.43 1ffq s GLU 315 Ca 0.34 -2.02 -0.10 0.00 0.02 0.00 0.00 54.97 53.21 1ffq s GLU 315 Cb -0.12 -3.52 0.01 0.00 0.10 0.00 0.00 34.13 30.59 1ffq s GLU 315 CO 0.20 -1.07 0.19 -0.06 0.02 0.00 0.00 175.26 174.54 1ffq s PHE 316 N 0.77 -0.02 0.02 1.61 0.08 -1.26 -4.18 117.98 114.99 1ffq s PHE 316 Ca 0.11 -0.03 -0.38 0.00 0.12 0.00 0.00 56.93 56.75 1ffq s PHE 316 Cb -0.22 -0.00 -0.17 0.00 -0.57 0.00 0.00 43.02 42.06 1ffq s PHE 316 CO -0.04 -0.33 1.39 -2.30 -0.10 0.00 0.00 175.22 173.83 1ffq n PRO 317 N 1.34 1.05 0.00 0.24 -0.02 -1.26 -0.34 135.00 136.01 1ffq n PRO 317 Ca -0.22 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1ffq n PRO 317 Cb 0.56 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1ffq n PRO 317 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ffq n GLY 318 N 2.72 1.57 1.23 -1.23 0.00 -1.26 -4.93 105.19 103.29 1ffq n GLY 318 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1ffq n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ffq n GLY 319 N -2.00 -1.83 2.32 -0.02 0.00 0.54 -4.29 105.19 99.91 1ffq n GLY 319 Ca 0.00 -1.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.00 1ffq n GLY 319 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ffq n LYS 320 N 0.00 -0.91 0.00 1.61 5.02 -1.26 -4.21 118.16 118.41 1ffq n LYS 320 Ca 0.00 0.82 0.00 0.00 -2.02 0.00 0.00 58.31 57.11 1ffq n LYS 320 Cb 0.00 -4.91 0.00 0.00 -0.02 0.00 0.00 35.03 30.10 1ffq n LYS 320 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ffq n GLY 321 N -1.29 1.38 0.17 0.72 0.00 -1.26 -4.86 105.19 100.05 1ffq n GLY 321 Ca -0.13 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.42 1ffq n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffq h ALA 322 N -1.41 0.62 -3.06 4.61 0.00 -1.77 -3.43 119.26 114.82 1ffq h ALA 322 Ca 0.00 -0.62 -0.63 0.00 0.00 0.00 0.00 54.91 53.67 1ffq h ALA 322 Cb 0.00 -0.06 -0.16 0.00 0.00 0.00 0.00 17.79 17.57 1ffq h ALA 322 CO 0.00 0.78 -0.52 1.21 0.00 0.00 0.00 179.25 180.71 1ffq s ASN 323 N -6.96 5.96 0.00 0.00 3.84 -1.26 -4.96 114.94 111.56 1ffq s ASN 323 Ca -0.05 0.06 0.28 0.00 0.21 0.00 0.00 52.86 53.36 1ffq s ASN 323 Cb 0.11 -2.08 1.12 0.00 -0.55 0.00 0.00 41.25 39.84 1ffq s ASN 323 CO 0.83 0.05 1.82 -0.81 -2.79 0.00 0.00 177.10 176.20 1ffq n PRO 324 N 4.41 0.22 0.00 0.43 -0.04 -1.26 -3.38 135.00 135.37 1ffq n PRO 324 Ca -0.15 -0.06 0.11 0.00 -0.04 0.00 0.00 63.50 63.37 1ffq n PRO 324 Cb 0.52 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.56 1ffq n PRO 324 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ffq n ASN 325 N -1.34 1.31 -4.61 3.54 3.02 -1.26 -4.91 115.26 111.00 1ffq n ASN 325 Ca 0.09 -1.06 -0.28 0.00 -0.03 0.00 0.00 54.58 53.31 1ffq n ASN 325 Cb 0.31 0.53 -0.09 0.00 -0.61 0.00 0.00 39.78 39.92 1ffq n ASN 325 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ffq s LEU 326 N -2.71 3.15 0.00 3.41 1.43 -1.22 -5.06 118.68 117.68 1ffq s LEU 326 Ca 0.15 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1ffq s LEU 326 Cb 0.18 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.53 1ffq s LEU 326 CO 0.67 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.99 1ffq n GLY 327 N 0.26 4.08 3.09 -3.19 0.00 -1.26 -4.31 105.19 103.85 1ffq n GLY 327 Ca -0.11 -1.08 -0.09 0.00 0.00 0.00 0.00 46.02 44.74 1ffq n GLY 327 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ffq s SER 328 N 0.00 0.63 0.59 1.61 0.15 -1.26 -4.80 113.70 110.63 1ffq s SER 328 Ca 0.00 -0.87 0.32 0.00 0.70 0.00 0.00 55.95 56.10 1ffq s SER 328 Cb 0.00 0.14 1.87 0.00 -1.71 0.00 0.00 66.02 66.33 1ffq s SER 328 CO 0.00 -0.48 2.25 -0.65 1.20 0.00 0.00 173.24 175.57 1ffq h PRO 329 N 3.51 0.00 0.00 5.44 0.11 -2.00 -0.82 132.00 138.24 1ffq h PRO 329 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1ffq h PRO 329 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ffq h PRO 329 CO 0.59 0.01 0.00 0.37 -0.21 0.00 0.00 178.00 178.76 1ffq h GLN 330 N 0.00 0.00 -0.98 1.05 4.15 -1.98 -3.38 115.11 113.97 1ffq h GLN 330 Ca -0.00 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.50 1ffq h GLN 330 Cb 0.04 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.66 1ffq h GLN 330 CO 0.00 0.00 0.63 -0.44 -1.93 0.00 0.00 178.83 177.09 1ffq h ASP 331 N 0.00 0.98 -0.29 -0.69 3.32 -1.50 -2.71 116.42 115.53 1ffq h ASP 331 Ca 0.00 0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.14 1ffq h ASP 331 Cb 0.55 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.84 1ffq h ASP 331 CO 0.00 0.61 -0.18 1.23 -1.72 0.00 0.00 179.24 179.18 1ffq h GLY 332 N 1.11 0.02 0.80 2.75 0.00 -1.75 -0.41 103.07 105.59 1ffq h GLY 332 Ca 0.44 0.23 0.05 0.00 0.00 0.00 0.00 47.33 48.04 1ffq h GLY 332 CO -0.19 -0.18 0.54 -2.09 0.00 0.00 0.00 176.54 174.62 1ffq h GLU 333 N -0.15 0.99 -0.44 4.80 4.81 -1.77 -1.47 114.58 121.35 1ffq h GLU 333 Ca 0.15 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.25 1ffq h GLU 333 Cb 0.39 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1ffq h GLU 333 CO -0.38 0.66 -0.01 1.15 -0.73 0.00 0.00 179.01 179.69 1ffq h THR 334 N 1.02 1.26 -0.38 0.32 2.02 -1.32 -0.15 112.91 115.69 1ffq h THR 334 Ca 0.36 -1.06 0.02 0.00 0.77 0.00 0.00 66.41 66.49 1ffq h THR 334 Cb 0.09 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 1ffq h THR 334 CO -0.15 0.36 0.22 0.22 0.37 0.00 0.00 175.52 176.55 1ffq h TYR 335 N 0.63 0.42 -0.52 3.16 5.03 -0.91 0.24 116.97 125.02 1ffq h TYR 335 Ca 0.12 0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.34 1ffq h TYR 335 Cb 0.51 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.64 1ffq h TYR 335 CO 0.04 0.24 -0.10 0.28 -1.32 0.00 0.00 178.16 177.30 1ffq h VAL 336 N 0.45 1.27 -0.47 1.81 2.07 -0.96 -1.99 116.25 118.43 1ffq h VAL 336 Ca 0.15 -1.25 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 1ffq h VAL 336 Cb 0.01 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1ffq h VAL 336 CO -0.07 0.44 0.28 -0.07 0.02 0.00 0.00 177.57 178.17 1ffq h LEU 337 N 0.85 0.57 -0.40 2.57 3.38 -0.76 -1.72 115.31 119.80 1ffq h LEU 337 Ca 0.13 -0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.10 1ffq h LEU 337 Cb 0.66 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.22 1ffq h LEU 337 CO 0.05 0.46 0.10 0.25 0.09 0.00 0.00 178.44 179.39 1ffq h LEU 338 N 0.63 0.07 -0.37 1.67 5.85 -0.17 -1.21 115.31 121.78 1ffq h LEU 338 Ca 0.17 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1ffq h LEU 338 Cb -0.00 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1ffq h LEU 338 CO -0.03 0.07 0.19 0.24 -0.34 0.00 0.00 178.44 178.57 1ffq h MET 339 N 0.25 0.52 -0.76 1.25 2.86 -1.25 -0.08 114.93 117.71 1ffq h MET 339 Ca 0.19 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 1ffq h MET 339 Cb 0.21 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 1ffq h MET 339 CO -0.23 0.45 0.43 0.87 1.06 0.00 0.00 176.91 179.49 1ffq h LYS 340 N 0.47 1.05 -0.02 1.72 1.57 -0.96 -0.95 116.57 119.45 1ffq h LYS 340 Ca 0.13 -0.11 -0.17 0.00 -1.87 0.00 0.00 60.65 58.63 1ffq h LYS 340 Cb 0.08 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1ffq h LYS 340 CO -0.02 0.76 -0.74 0.93 -0.57 0.00 0.00 179.45 179.81 1ffq h GLU 341 N 1.05 0.16 -0.20 3.15 5.08 -1.18 -1.02 114.58 121.61 1ffq h GLU 341 Ca 0.27 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1ffq h GLU 341 Cb 0.00 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1ffq h GLU 341 CO -0.05 0.83 0.04 -0.07 -1.00 0.00 0.00 179.01 178.76 1ffq h LEU 342 N 0.10 0.31 -0.54 1.33 3.38 -0.90 -1.54 115.31 117.45 1ffq h LEU 342 Ca -0.02 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.78 1ffq h LEU 342 Cb 1.31 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.92 1ffq h LEU 342 CO 0.11 0.47 0.22 -0.09 0.09 0.00 0.00 178.44 179.24 1ffq h ARG 343 N 0.13 0.40 -0.62 1.13 9.65 -1.03 0.86 114.38 124.90 1ffq h ARG 343 Ca 0.06 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.90 1ffq h ARG 343 Cb 0.29 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.75 1ffq h ARG 343 CO 0.00 0.27 0.32 0.00 2.80 0.00 0.00 179.97 183.35 1ffq h ALA 344 N 1.35 0.80 -0.72 2.80 0.00 -1.05 0.48 119.26 122.90 1ffq h ALA 344 Ca 0.26 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ffq h ALA 344 Cb 0.26 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1ffq h ALA 344 CO -0.24 0.34 0.43 1.98 0.00 0.00 0.00 179.25 181.76 1ffq h MET 345 N 0.85 0.99 -0.20 0.00 1.85 -0.99 -1.06 114.93 116.36 1ffq h MET 345 Ca 0.22 -0.09 -0.15 0.00 -0.61 0.00 0.00 59.70 59.06 1ffq h MET 345 Cb 0.08 -0.20 -0.01 0.00 0.43 0.00 0.00 31.60 31.90 1ffq h MET 345 CO -0.03 0.70 -0.51 -0.07 -0.40 0.00 0.00 176.91 176.60 1ffq h LEU 346 N 0.99 0.61 -0.86 3.39 3.38 -0.38 -0.70 115.31 121.75 1ffq h LEU 346 Ca 0.26 -0.31 0.03 0.00 0.09 0.00 0.00 57.88 57.94 1ffq h LEU 346 Cb -0.03 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 1ffq h LEU 346 CO -0.05 1.01 0.56 0.44 0.09 0.00 0.00 178.44 180.49 1ffq h ASP 347 N 0.44 0.93 -0.37 -0.43 3.32 0.18 0.26 116.42 120.76 1ffq h ASP 347 Ca 0.02 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 1ffq h ASP 347 Cb 1.04 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 1ffq h ASP 347 CO 0.10 0.65 -0.04 -0.61 -1.72 0.00 0.00 179.24 177.61 1ffq h GLN 348 N 1.09 0.68 -0.74 3.56 5.75 -1.09 -2.36 115.11 122.00 1ffq h GLN 348 Ca 0.34 -0.24 -0.04 0.00 -0.15 0.00 0.00 58.65 58.55 1ffq h GLN 348 Cb -0.02 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.44 1ffq h GLN 348 CO -0.11 0.81 0.29 1.25 -2.65 0.00 0.00 178.83 178.42 1ffq h LEU 349 N 0.48 1.01 -0.40 -2.39 5.85 -0.66 -2.19 115.31 117.02 1ffq h LEU 349 Ca 0.10 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.69 1ffq h LEU 349 Cb 0.53 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1ffq h LEU 349 CO 0.03 0.90 0.22 0.28 -0.34 0.00 0.00 178.44 179.54 1ffq h SER 350 N 1.07 0.35 1.24 1.25 0.02 -0.32 -1.62 113.55 115.55 1ffq h SER 350 Ca 0.25 0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.11 1ffq h SER 350 Cb 0.21 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1ffq h SER 350 CO -0.02 0.25 -0.44 -0.37 -1.14 0.00 0.00 176.83 175.11 1ffq h VAL 351 N 0.45 0.84 -0.62 2.27 -1.51 -1.31 0.31 116.25 116.69 1ffq h VAL 351 Ca 0.16 -1.91 -0.07 0.00 -1.23 0.00 0.00 66.70 63.65 1ffq h VAL 351 Cb 0.03 2.21 -0.03 0.00 -2.13 0.00 0.00 31.29 31.38 1ffq h VAL 351 CO -0.09 0.43 0.10 -0.33 -1.23 0.00 0.00 177.57 176.45 1ffq h GLU 352 N 0.00 1.00 0.00 5.19 5.08 -1.03 -3.31 114.58 121.51 1ffq h GLU 352 Ca -0.00 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1ffq h GLU 352 Cb 1.18 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1ffq h GLU 352 CO 0.06 0.92 -1.00 0.25 -1.00 0.00 0.00 179.01 178.24 1ffq n THR 353 N -4.22 0.00 -0.93 1.13 -2.24 -0.64 -4.98 114.28 102.39 1ffq n THR 353 Ca 0.04 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1ffq n THR 353 Cb 0.28 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1ffq n THR 353 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffq n GLY 354 N 1.42 0.43 3.91 3.38 0.00 0.11 -5.02 105.19 109.42 1ffq n GLY 354 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1ffq n GLY 354 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ffq s ARG 355 N -0.61 3.34 -0.09 1.61 0.52 -1.03 -5.00 118.95 117.69 1ffq s ARG 355 Ca 0.00 -0.62 -0.19 0.00 -0.52 0.00 0.00 55.73 54.40 1ffq s ARG 355 Cb 0.00 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.51 1ffq s ARG 355 CO 0.00 0.53 0.52 0.15 0.02 0.00 0.00 175.30 176.52 1ffq s LYS 356 N -3.09 4.33 0.05 3.54 1.02 -1.26 -4.41 119.74 119.92 1ffq s LYS 356 Ca 0.34 0.54 0.05 0.00 0.02 0.00 0.00 55.97 56.91 1ffq s LYS 356 Cb -0.11 -3.42 -0.04 0.00 -0.52 0.00 0.00 37.83 33.75 1ffq s LYS 356 CO 0.27 0.19 -0.08 0.71 -0.92 0.00 0.00 175.35 175.53 1ffq s TYR 357 N 0.47 2.83 0.09 3.18 2.02 -1.26 -4.91 117.35 119.78 1ffq s TYR 357 Ca 0.28 -0.09 0.06 0.00 -0.37 0.00 0.00 57.07 56.95 1ffq s TYR 357 Cb -0.16 -1.54 -0.04 0.00 -0.40 0.00 0.00 41.96 39.83 1ffq s TYR 357 CO 0.12 0.39 -0.04 -1.21 -1.57 0.00 0.00 175.55 173.24 1ffq s GLU 358 N -1.77 2.39 -0.19 -0.62 2.02 0.15 -4.95 118.70 115.73 1ffq s GLU 358 Ca 0.19 -0.91 0.01 0.00 0.02 0.00 0.00 54.97 54.29 1ffq s GLU 358 Cb -0.11 -2.45 0.04 0.00 0.10 0.00 0.00 34.13 31.71 1ffq s GLU 358 CO 0.11 0.53 -0.11 -1.17 0.02 0.00 0.00 175.26 174.63 1ffq s LEU 359 N -2.24 2.15 0.41 1.80 2.96 -1.26 -1.17 118.68 121.33 1ffq s LEU 359 Ca 0.24 -0.80 0.05 0.00 -0.22 0.00 0.00 54.13 53.40 1ffq s LEU 359 Cb -0.11 -1.23 -0.06 0.00 0.50 0.00 0.00 46.19 45.29 1ffq s LEU 359 CO 0.16 -0.12 0.03 0.42 -1.32 0.00 0.00 176.35 175.52 1ffq s THR 360 N 1.41 1.49 -0.10 3.68 -4.23 -0.43 -0.80 115.64 116.67 1ffq s THR 360 Ca 0.00 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.37 1ffq s THR 360 Cb -0.15 -2.70 0.03 0.00 1.34 0.00 0.00 72.50 71.02 1ffq s THR 360 CO -0.09 0.00 0.37 -0.55 -0.54 0.00 0.00 174.62 173.81 1ffq s SER 361 N -3.69 -0.35 -0.19 3.99 0.15 -1.08 -0.57 113.70 111.96 1ffq s SER 361 Ca 0.28 0.57 -0.12 0.00 0.70 0.00 0.00 55.95 57.38 1ffq s SER 361 Cb 0.07 0.64 -0.05 0.00 -1.71 0.00 0.00 66.02 64.97 1ffq s SER 361 CO 0.14 -0.24 0.22 0.00 1.20 0.00 0.00 173.24 174.56 1ffq s ALA 362 N -0.29 3.63 0.14 5.45 0.00 -0.49 -0.21 121.76 129.99 1ffq s ALA 362 Ca -0.04 -0.61 0.05 0.00 0.00 0.00 0.00 51.96 51.36 1ffq s ALA 362 Cb -0.03 -2.32 -0.04 0.00 0.00 0.00 0.00 23.12 20.72 1ffq s ALA 362 CO 0.02 0.04 -0.12 0.96 0.00 0.00 0.00 175.76 176.65 1ffq s ILE 363 N 0.60 1.29 0.51 0.00 -4.36 -0.60 -4.29 121.20 114.35 1ffq s ILE 363 Ca 0.12 -1.88 -0.23 0.00 -0.26 0.00 0.00 60.65 58.40 1ffq s ILE 363 Cb -0.12 -1.68 -0.06 0.00 1.25 0.00 0.00 42.46 41.84 1ffq s ILE 363 CO 0.02 -0.56 1.37 -0.24 0.24 0.00 0.00 174.94 175.77 1ffq n SER 364 N 0.19 2.83 -1.03 4.36 2.88 -1.26 -1.65 113.62 119.94 1ffq n SER 364 Ca -0.13 1.03 0.12 0.00 -1.33 0.00 0.00 58.87 58.56 1ffq n SER 364 Cb 0.59 -1.58 0.22 0.00 -0.75 0.00 0.00 64.21 62.69 1ffq n SER 364 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ffq n ALA 365 N -0.74 2.45 -2.07 -1.46 0.00 -1.25 -4.63 120.51 112.81 1ffq n ALA 365 Ca 0.09 -0.86 -0.40 0.00 0.00 0.00 0.00 53.44 52.27 1ffq n ALA 365 Cb 0.43 -0.90 -0.06 0.00 0.00 0.00 0.00 19.45 18.93 1ffq n ALA 365 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ffq s GLY 366 N -1.63 2.94 0.46 0.00 0.00 -1.26 -3.78 107.32 104.05 1ffq s GLY 366 Ca 0.36 0.42 0.23 0.00 0.00 0.00 0.00 44.72 45.72 1ffq s GLY 366 CO 0.31 1.05 1.94 1.70 0.00 0.00 0.00 173.10 178.10 1ffq h LYS 367 N 4.75 0.00 -0.46 2.90 3.64 -1.89 -1.06 116.57 124.44 1ffq h LYS 367 Ca -0.45 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 58.94 1ffq h LYS 367 Cb 1.21 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.00 1ffq h LYS 367 CO 0.68 0.22 0.30 0.38 -2.27 0.00 0.00 179.45 178.76 1ffq h ASP 368 N 0.00 0.51 0.24 4.20 2.03 -1.99 -2.97 116.42 118.43 1ffq h ASP 368 Ca -0.00 -0.01 -0.24 0.00 -0.73 0.00 0.00 57.03 56.05 1ffq h ASP 368 Cb 0.53 -0.12 0.01 0.00 -0.83 0.00 0.00 39.33 38.92 1ffq h ASP 368 CO 0.03 0.36 -1.00 0.11 -1.03 0.00 0.00 179.24 177.71 1ffq h LYS 369 N 0.61 0.50 -0.48 4.15 1.57 -1.61 -3.36 116.57 117.95 1ffq h LYS 369 Ca 0.18 -0.56 0.08 0.00 -1.87 0.00 0.00 60.65 58.47 1ffq h LYS 369 Cb -0.04 0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.37 1ffq h LYS 369 CO -0.05 1.19 0.12 0.82 -0.57 0.00 0.00 179.45 180.96 1ffq h ILE 370 N 0.28 0.77 0.00 1.86 2.04 -1.34 -1.53 117.51 119.58 1ffq h ILE 370 Ca -0.10 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1ffq h ILE 370 Cb 1.65 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1ffq h ILE 370 CO 0.18 0.05 0.00 0.47 0.00 0.00 0.00 178.15 178.85 1ffq n ASP 371 N -5.08 0.00 -0.09 1.72 8.00 -1.13 -2.26 116.55 117.71 1ffq n ASP 371 Ca 0.05 -0.86 0.13 0.00 0.71 0.00 0.00 54.79 54.82 1ffq n ASP 371 Cb 0.22 0.00 0.44 0.00 -0.02 0.00 0.00 41.12 41.76 1ffq n ASP 371 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ffq n LYS 372 N -0.89 0.41 -5.01 -1.24 5.02 -0.58 -4.82 118.16 111.05 1ffq n LYS 372 Ca 0.13 -0.19 -0.29 0.00 -2.02 0.00 0.00 58.31 55.94 1ffq n LYS 372 Cb 0.06 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.42 1ffq n LYS 372 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ffq s VAL 373 N -2.72 1.93 -1.20 -0.18 1.01 -0.96 -3.72 120.40 114.56 1ffq s VAL 373 Ca 0.20 -1.17 -0.13 0.00 0.00 0.00 0.00 61.98 60.88 1ffq s VAL 373 Cb 0.19 -1.63 0.18 0.00 0.00 0.00 0.00 36.38 35.12 1ffq s VAL 373 CO 0.57 0.43 1.40 0.00 0.00 0.00 0.00 175.10 177.50 1ffq s ALA 374 N -0.68 4.07 0.44 5.51 0.00 -1.26 -4.82 121.76 125.03 1ffq s ALA 374 Ca 0.10 -3.41 0.32 0.00 0.00 0.00 0.00 51.96 48.97 1ffq s ALA 374 Cb -0.09 -4.08 1.67 0.00 0.00 0.00 0.00 23.12 20.62 1ffq s ALA 374 CO 0.00 -2.72 2.14 1.88 0.00 0.00 0.00 175.76 177.06 1ffq h TYR 375 N 7.11 0.00 0.00 0.00 0.05 -1.95 -1.09 116.97 121.09 1ffq h TYR 375 Ca 0.30 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 59.05 1ffq h TYR 375 Cb 0.87 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.61 1ffq h TYR 375 CO 1.07 0.07 -0.15 -2.95 -1.05 0.00 0.00 178.16 175.15 1ffq h ASN 376 N 0.00 0.00 0.00 3.88 -1.07 -1.88 0.03 115.58 116.55 1ffq h ASN 376 Ca -0.00 0.00 -0.14 0.00 0.07 0.00 0.00 56.30 56.23 1ffq h ASN 376 Cb 0.25 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.48 1ffq h ASN 376 CO 0.01 0.15 -0.78 0.58 0.07 0.00 0.00 177.43 177.46 1ffq h VAL 377 N 0.00 1.19 0.00 6.14 2.07 -1.62 -3.40 116.25 120.63 1ffq h VAL 377 Ca -0.00 -2.19 -0.01 0.00 0.82 0.00 0.00 66.70 65.32 1ffq h VAL 377 Cb 0.36 2.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1ffq h VAL 377 CO 0.02 0.40 -0.02 0.00 0.02 0.00 0.00 177.57 177.99 1ffq h ALA 378 N -0.34 1.63 -0.15 1.67 0.00 -1.14 -2.37 119.26 118.56 1ffq h ALA 378 Ca -0.21 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.72 1ffq h ALA 378 Cb 1.16 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1ffq h ALA 378 CO -0.13 0.03 0.13 -0.56 0.00 0.00 0.00 179.25 178.72 1ffq h GLN 379 N 0.00 0.00 0.00 0.00 3.07 -1.19 -1.51 115.11 115.48 1ffq h GLN 379 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 1ffq h GLN 379 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.61 1ffq h GLN 379 CO 0.00 0.00 -0.09 -0.91 0.09 0.00 0.00 178.83 177.92 1ffq h ASN 380 N 0.00 0.00 0.20 0.06 2.35 -1.68 -1.82 115.58 114.70 1ffq h ASN 380 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1ffq h ASN 380 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.70 1ffq h ASN 380 CO -0.00 0.09 -0.41 -1.20 -1.65 0.00 0.00 177.43 174.26 1ffq n SER 381 N -3.34 1.16 -4.47 5.81 7.64 -0.57 -4.97 113.62 114.88 1ffq n SER 381 Ca -0.01 -0.93 -0.31 0.00 1.01 0.00 0.00 58.87 58.63 1ffq n SER 381 Cb 0.29 0.30 -0.13 0.00 -1.01 0.00 0.00 64.21 63.66 1ffq n SER 381 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1ffq s MET 382 N -2.62 2.24 -0.04 1.43 -1.94 -0.68 -4.75 119.30 112.94 1ffq s MET 382 Ca 0.19 -0.87 -0.17 0.00 -1.71 0.00 0.00 55.69 53.13 1ffq s MET 382 Cb 0.18 -2.27 -0.31 0.00 2.01 0.00 0.00 34.83 34.44 1ffq s MET 382 CO 0.59 0.57 0.79 -0.44 -0.01 0.00 0.00 175.02 176.52 1ffq h ASP 383 N 4.77 0.57 -4.24 3.03 3.32 -1.24 -3.48 116.42 119.15 1ffq h ASP 383 Ca -0.47 -0.92 -0.16 0.00 0.02 0.00 0.00 57.03 55.51 1ffq h ASP 383 Cb 1.15 -0.19 -0.24 0.00 0.22 0.00 0.00 39.33 40.28 1ffq h ASP 383 CO 0.49 1.61 -0.43 -1.00 -1.72 0.00 0.00 179.24 178.20 1ffq s HIS 384 N -2.51 -0.18 -0.34 4.55 3.76 -1.23 -4.83 115.29 114.50 1ffq s HIS 384 Ca -0.15 0.41 -0.08 0.00 -0.15 0.00 0.00 55.06 55.10 1ffq s HIS 384 Cb 0.03 0.06 0.03 0.00 1.11 0.00 0.00 32.58 33.82 1ffq s HIS 384 CO 0.85 -0.20 0.13 0.42 -0.85 0.00 0.00 174.74 175.09 1ffq s ILE 385 N -0.42 4.00 -0.73 0.60 1.01 0.05 -2.64 121.20 123.08 1ffq s ILE 385 Ca -0.05 -1.01 -0.22 0.00 0.00 0.00 0.00 60.65 59.37 1ffq s ILE 385 Cb -0.03 -3.23 0.08 0.00 0.01 0.00 0.00 42.46 39.28 1ffq s ILE 385 CO 0.01 -0.16 1.04 -0.36 0.00 0.00 0.00 174.94 175.47 1ffq s PHE 386 N 1.45 2.73 -0.27 3.97 0.08 0.71 -0.31 117.98 126.34 1ffq s PHE 386 Ca -0.00 -0.69 -0.29 0.00 0.12 0.00 0.00 56.93 56.06 1ffq s PHE 386 Cb -0.19 -4.33 -0.00 0.00 -0.57 0.00 0.00 43.02 37.93 1ffq s PHE 386 CO 0.04 -1.66 1.31 -1.17 -0.10 0.00 0.00 175.22 173.64 1ffq s LEU 387 N 3.95 3.93 -1.40 -0.37 2.96 -0.22 -1.56 118.68 125.97 1ffq s LEU 387 Ca 0.26 1.32 -0.15 0.00 -0.22 0.00 0.00 54.13 55.34 1ffq s LEU 387 Cb -0.13 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 43.08 1ffq s LEU 387 CO 0.06 -1.03 2.07 0.23 -1.32 0.00 0.00 176.35 176.36 1ffq n MET 388 N 7.21 2.99 -1.45 1.98 2.81 -0.66 -2.51 117.12 127.50 1ffq n MET 388 Ca 0.15 -2.85 -0.40 0.00 -1.81 0.00 0.00 57.70 52.79 1ffq n MET 388 Cb 0.46 -3.31 -0.02 0.00 -0.71 0.00 0.00 33.22 29.64 1ffq n MET 388 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1ffq n SER 389 N 6.52 6.91 -2.71 7.83 3.41 -1.26 -3.84 113.62 130.48 1ffq n SER 389 Ca 0.50 -2.66 -0.10 0.00 -0.26 0.00 0.00 58.87 56.35 1ffq n SER 389 Cb 0.41 -1.58 0.01 0.00 -0.26 0.00 0.00 64.21 62.79 1ffq n SER 389 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ffq n TYR 390 N 4.52 -2.04 -2.71 7.33 0.18 -1.26 -4.62 117.16 118.56 1ffq n TYR 390 Ca 0.68 -1.85 -0.19 0.00 1.88 0.00 0.00 57.90 58.43 1ffq n TYR 390 Cb 0.29 0.77 0.02 0.00 -0.38 0.00 0.00 39.34 40.04 1ffq n TYR 390 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 1ffq n ASP 391 N -1.53 -5.42 0.12 9.48 8.00 -0.76 -4.90 116.55 121.55 1ffq n ASP 391 Ca -0.06 -0.17 -0.02 0.00 0.71 0.00 0.00 54.79 55.25 1ffq n ASP 391 Cb 0.55 -4.33 0.17 0.00 -0.02 0.00 0.00 41.12 37.49 1ffq n ASP 391 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1ffq h PHE 392 N -0.79 0.09 -3.93 1.24 0.04 -1.29 -3.45 116.94 108.85 1ffq h PHE 392 Ca -0.45 -0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.18 1ffq h PHE 392 Cb 1.32 -0.02 -0.15 0.00 2.20 0.00 0.00 35.95 39.30 1ffq h PHE 392 CO 0.46 0.65 -0.50 0.71 -0.60 0.00 0.00 178.31 179.03 1ffq s TYR 393 N -3.69 0.27 -1.80 -0.55 2.02 -1.26 -4.96 117.35 107.38 1ffq s TYR 393 Ca -0.02 -0.70 0.00 0.00 -0.37 0.00 0.00 57.07 55.98 1ffq s TYR 393 Cb 0.13 -0.18 0.00 0.00 -0.40 0.00 0.00 41.96 41.51 1ffq s TYR 393 CO 0.77 -0.45 0.00 0.41 -1.57 0.00 0.00 175.55 174.71 1ffq n GLY 394 N 0.20 -1.71 0.00 0.71 0.00 -1.26 -4.58 105.19 98.55 1ffq n GLY 394 Ca -0.16 -1.11 0.08 0.00 0.00 0.00 0.00 46.02 44.83 1ffq n GLY 394 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ffq n ALA 395 N 0.00 1.84 0.43 4.61 0.00 -1.26 -1.67 120.51 124.46 1ffq n ALA 395 Ca 0.00 -0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.50 1ffq n ALA 395 Cb 0.00 -1.25 0.48 0.00 0.00 0.00 0.00 19.45 18.68 1ffq n ALA 395 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ffq h PHE 396 N 0.00 0.00 -3.42 0.00 -5.15 -1.94 -3.39 116.94 103.04 1ffq h PHE 396 Ca 0.00 0.00 -0.60 0.00 -0.20 0.00 0.00 57.97 57.17 1ffq h PHE 396 Cb 0.16 0.00 -0.37 0.00 0.22 0.00 0.00 35.95 35.96 1ffq h PHE 396 CO 0.00 0.00 -0.80 0.34 -2.00 0.00 0.00 178.31 175.85 1ffq s ASP 397 N -4.61 3.28 0.00 -0.68 -1.08 -0.67 -5.01 116.67 107.90 1ffq s ASP 397 Ca 0.05 -0.86 0.26 0.00 -0.52 0.00 0.00 52.55 51.48 1ffq s ASP 397 Cb 0.10 -1.12 0.60 0.00 -1.46 0.00 0.00 42.92 41.03 1ffq s ASP 397 CO 0.47 -0.17 1.47 0.18 0.52 0.00 0.00 175.17 177.64 1ffq n LEU 398 N 4.74 1.32 -0.08 -1.34 4.77 -1.26 -4.33 117.00 120.83 1ffq n LEU 398 Ca -0.13 -0.41 -0.09 0.00 -0.03 0.00 0.00 56.01 55.35 1ffq n LEU 398 Cb 0.47 -0.08 -0.10 0.00 -2.33 0.00 0.00 43.42 41.37 1ffq n LEU 398 CO 0.19 0.24 -1.00 0.29 -1.33 0.00 0.00 177.39 175.78 1ffq n LYS 399 N -0.41 1.30 -3.79 3.23 4.01 -1.26 -0.29 118.16 120.96 1ffq n LYS 399 Ca 0.12 0.03 -0.34 0.00 -0.51 0.00 0.00 58.31 57.61 1ffq n LYS 399 Cb 0.38 -1.36 -0.11 0.00 -0.51 0.00 0.00 35.03 33.44 1ffq n LYS 399 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 1ffq s ASN 400 N -5.05 5.02 0.38 4.39 0.01 -1.26 -4.60 114.94 113.83 1ffq s ASN 400 Ca -0.13 -3.06 -0.12 0.00 -0.71 0.00 0.00 52.86 48.84 1ffq s ASN 400 Cb 0.05 -1.79 -0.07 0.00 0.41 0.00 0.00 41.25 39.85 1ffq s ASN 400 CO 0.51 -0.29 0.77 -0.76 -1.51 0.00 0.00 177.10 175.82 1ffq s LEU 401 N -0.36 3.90 0.00 0.60 1.43 -1.26 -4.84 118.68 118.15 1ffq s LEU 401 Ca 0.19 1.21 -0.24 0.00 -1.03 0.00 0.00 54.13 54.26 1ffq s LEU 401 Cb -0.20 -4.07 0.08 0.00 0.03 0.00 0.00 46.19 42.04 1ffq s LEU 401 CO -0.04 -0.34 1.08 0.61 0.23 0.00 0.00 176.35 177.89 1ffq n GLY 402 N -0.97 0.26 3.71 -3.19 0.00 -1.26 -4.82 105.19 98.91 1ffq n GLY 402 Ca 0.03 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 1ffq n GLY 402 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ffq s HIS 403 N -2.17 3.40 -0.37 1.61 3.76 -1.26 -4.74 115.29 115.52 1ffq s HIS 403 Ca 0.25 1.32 0.25 0.00 -0.15 0.00 0.00 55.06 56.74 1ffq s HIS 403 Cb -0.01 -3.39 0.57 0.00 1.11 0.00 0.00 32.58 30.86 1ffq s HIS 403 CO -0.01 -1.15 1.69 -0.56 -0.85 0.00 0.00 174.74 173.86 1ffq h GLN 404 N 6.96 0.00 0.00 1.40 3.07 -1.84 -3.36 115.11 121.34 1ffq h GLN 404 Ca -0.40 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.29 1ffq h GLN 404 Cb 1.20 0.00 -0.11 0.00 0.08 0.00 0.00 27.48 28.66 1ffq h GLN 404 CO 0.82 0.00 -0.56 -2.37 0.09 0.00 0.00 178.83 176.81 1ffq n THR 405 N -3.01 0.00 -1.90 1.86 5.66 -1.26 -0.93 114.28 114.70 1ffq n THR 405 Ca 0.04 -0.25 -0.37 0.00 -3.05 0.00 0.00 64.05 60.41 1ffq n THR 405 Cb 0.48 0.56 0.05 0.00 -1.55 0.00 0.00 70.33 69.87 1ffq n THR 405 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ffq s ALA 406 N 0.00 2.52 0.06 1.79 0.00 -1.26 -4.82 121.76 120.05 1ffq s ALA 406 Ca 0.09 1.12 -0.21 0.00 0.00 0.00 0.00 51.96 52.95 1ffq s ALA 406 Cb 0.10 -3.50 -0.12 0.00 0.00 0.00 0.00 23.12 19.60 1ffq s ALA 406 CO -0.04 -1.33 1.50 1.25 0.00 0.00 0.00 175.76 177.13 1ffq h LEU 407 N 0.84 0.24 -9.54 0.00 5.85 -1.41 -1.40 115.31 109.89 1ffq h LEU 407 Ca -0.51 -0.30 -0.57 0.00 0.84 0.00 0.00 57.88 57.35 1ffq h LEU 407 Cb 1.31 -0.06 -0.13 0.00 0.37 0.00 0.00 40.66 42.14 1ffq h LEU 407 CO 0.55 0.48 -0.57 0.20 -0.34 0.00 0.00 178.44 178.75 1ffq s ASN 408 N -5.73 3.20 0.48 1.25 0.01 -0.03 -1.66 114.94 112.45 1ffq s ASN 408 Ca -0.14 -1.49 -0.22 0.00 -0.71 0.00 0.00 52.86 50.30 1ffq s ASN 408 Cb 0.06 0.07 -0.07 0.00 0.41 0.00 0.00 41.25 41.71 1ffq s ASN 408 CO 0.71 -0.68 1.13 0.00 -1.51 0.00 0.00 177.10 176.76 1ffq s ALA 409 N -3.04 2.89 0.82 0.60 0.00 -1.26 -4.43 121.76 117.34 1ffq s ALA 409 Ca 0.28 0.85 -0.11 0.00 0.00 0.00 0.00 51.96 52.97 1ffq s ALA 409 Cb 0.06 -3.35 0.08 0.00 0.00 0.00 0.00 23.12 19.91 1ffq s ALA 409 CO 0.13 -0.62 1.09 -1.25 0.00 0.00 0.00 175.76 175.12 1ffq s PRO 410 N -2.90 1.89 0.29 0.00 0.04 -1.26 -3.66 135.00 129.40 1ffq s PRO 410 Ca 0.66 0.78 0.01 0.00 0.04 0.00 0.00 61.00 62.49 1ffq s PRO 410 Cb -0.25 -1.88 0.45 0.00 0.04 0.00 0.00 34.50 32.85 1ffq s PRO 410 CO 0.30 -1.79 1.82 0.00 0.04 0.00 0.00 177.00 177.37 1ffq h ALA 411 N -1.22 1.23 0.00 8.56 0.00 -1.96 -2.71 119.26 123.17 1ffq h ALA 411 Ca -0.47 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1ffq h ALA 411 Cb 1.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ffq h ALA 411 CO 0.57 0.52 0.00 -2.67 0.00 0.00 0.00 179.25 177.66 1ffq n TRP 412 N -4.25 0.00 -2.87 0.00 2.14 -1.26 -4.33 117.44 106.87 1ffq n TRP 412 Ca 0.02 0.00 -0.11 0.00 2.07 0.00 0.00 57.50 59.49 1ffq n TRP 412 Cb 0.27 -0.38 0.01 0.00 -0.81 0.00 0.00 31.31 30.40 1ffq n TRP 412 CO 0.00 0.00 0.00 1.17 2.07 0.00 0.00 177.69 180.93 1ffq n LYS 413 N -1.38 0.63 0.19 -2.67 4.81 -1.03 -5.00 118.16 113.73 1ffq n LYS 413 Ca 0.08 -2.17 0.14 0.00 -0.87 0.00 0.00 58.31 55.50 1ffq n LYS 413 Cb 0.20 -1.46 0.62 0.00 0.02 0.00 0.00 35.03 34.42 1ffq n LYS 413 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1ffq h PRO 414 N 4.48 0.00 -0.00 1.64 0.13 -1.74 -1.23 132.00 135.28 1ffq h PRO 414 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1ffq h PRO 414 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1ffq h PRO 414 CO 0.25 0.00 -0.11 -0.40 -0.23 0.00 0.00 178.00 177.50 1ffq n ASP 415 N -2.55 0.44 -3.21 1.44 5.68 -1.26 -4.83 116.55 112.26 1ffq n ASP 415 Ca 0.01 -0.52 -0.46 0.00 -0.50 0.00 0.00 54.79 53.32 1ffq n ASP 415 Cb 0.21 -0.08 -0.07 0.00 -1.14 0.00 0.00 41.12 40.04 1ffq n ASP 415 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1ffq n THR 416 N -0.99 0.00 -0.04 2.12 -1.04 -0.47 -4.86 114.28 109.00 1ffq n THR 416 Ca 0.14 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 62.02 1ffq n THR 416 Cb 0.28 -0.34 -0.08 0.00 -1.82 0.00 0.00 70.33 68.37 1ffq n THR 416 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ffq h ALA 417 N 3.52 0.13 -2.17 2.41 0.00 -1.92 -3.42 119.26 117.82 1ffq h ALA 417 Ca -0.29 -0.31 -0.75 0.00 0.00 0.00 0.00 54.91 53.56 1ffq h ALA 417 Cb 0.93 -0.03 -0.23 0.00 0.00 0.00 0.00 17.79 18.46 1ffq h ALA 417 CO 0.67 -0.01 -0.04 0.71 0.00 0.00 0.00 179.25 180.58 1ffq s TYR 418 N -4.18 3.27 0.14 0.00 2.02 -1.26 -4.81 117.35 112.53 1ffq s TYR 418 Ca -0.15 -1.34 0.03 0.00 -0.37 0.00 0.00 57.07 55.24 1ffq s TYR 418 Cb 0.04 -3.88 -0.04 0.00 -0.40 0.00 0.00 41.96 37.68 1ffq s TYR 418 CO 0.73 -1.10 -0.06 0.95 -1.57 0.00 0.00 175.55 174.49 1ffq s THR 419 N 1.66 0.89 0.10 -0.71 -4.23 -1.26 -4.90 115.64 107.19 1ffq s THR 419 Ca 0.09 -2.00 -0.32 0.00 -1.18 0.00 0.00 61.69 58.28 1ffq s THR 419 Cb -0.24 -1.86 -0.12 0.00 1.34 0.00 0.00 72.50 71.61 1ffq s THR 419 CO 0.01 -0.72 1.59 0.74 -0.54 0.00 0.00 174.62 175.70 1ffq h THR 420 N 2.82 0.18 -0.90 3.99 2.02 -1.11 -2.90 112.91 117.01 1ffq h THR 420 Ca -0.36 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.00 1ffq h THR 420 Cb 1.19 0.18 -0.11 0.00 -1.74 0.00 0.00 68.15 67.67 1ffq h THR 420 CO 0.64 0.00 0.47 0.58 0.37 0.00 0.00 175.52 177.58 1ffq h VAL 421 N -0.74 0.65 -0.66 3.16 2.07 -1.58 -0.42 116.25 118.74 1ffq h VAL 421 Ca -0.01 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1ffq h VAL 421 Cb 0.70 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 1ffq h VAL 421 CO -0.14 0.11 0.40 0.78 0.02 0.00 0.00 177.57 178.73 1ffq h ASN 422 N 0.59 0.78 -0.17 0.57 2.35 -1.81 0.24 115.58 118.12 1ffq h ASN 422 Ca 0.52 -0.04 -0.15 0.00 -0.55 0.00 0.00 56.30 56.08 1ffq h ASN 422 Cb 0.84 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1ffq h ASN 422 CO -0.42 0.59 -0.47 1.23 -1.65 0.00 0.00 177.43 176.71 1ffq h GLY 423 N 0.93 0.69 0.85 2.83 0.00 -0.90 -0.58 103.07 106.88 1ffq h GLY 423 Ca 0.24 -0.87 0.02 0.00 0.00 0.00 0.00 47.33 46.72 1ffq h GLY 423 CO -0.05 0.78 0.18 -2.08 0.00 0.00 0.00 176.54 175.38 1ffq h VAL 424 N 0.30 1.00 -0.68 4.60 2.07 -1.14 -2.39 116.25 120.00 1ffq h VAL 424 Ca -0.01 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.32 1ffq h VAL 424 Cb 1.09 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1ffq h VAL 424 CO 0.10 0.07 0.20 0.78 0.02 0.00 0.00 177.57 178.74 1ffq h ASN 425 N 0.38 1.00 -0.75 0.57 2.35 -0.36 0.16 115.58 118.92 1ffq h ASN 425 Ca 0.15 -0.21 0.03 0.00 -0.55 0.00 0.00 56.30 55.71 1ffq h ASN 425 Cb 0.04 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.11 1ffq h ASN 425 CO -0.09 0.95 0.48 0.00 -1.65 0.00 0.00 177.43 177.12 1ffq h ALA 426 N 1.09 0.98 -0.19 -0.83 0.00 -0.94 0.12 119.26 119.49 1ffq h ALA 426 Ca 0.22 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ffq h ALA 426 Cb 0.32 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ffq h ALA 426 CO -0.00 0.29 0.10 -0.07 0.00 0.00 0.00 179.25 179.56 1ffq h LEU 427 N 0.94 0.24 -1.18 0.00 3.38 -0.84 -2.69 115.31 115.16 1ffq h LEU 427 Ca 0.30 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1ffq h LEU 427 Cb -0.00 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1ffq h LEU 427 CO -0.11 0.25 0.22 -0.07 0.09 0.00 0.00 178.44 178.83 1ffq h LEU 428 N 0.20 0.72 -1.18 1.67 3.38 -0.26 -2.20 115.31 117.64 1ffq h LEU 428 Ca 0.07 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1ffq h LEU 428 Cb 0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1ffq h LEU 428 CO -0.01 0.65 -0.38 0.00 0.09 0.00 0.00 178.44 178.79 1ffq h ALA 429 N 1.46 1.21 0.00 1.53 0.00 -0.69 -1.27 119.26 121.50 1ffq h ALA 429 Ca 0.19 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1ffq h ALA 429 Cb 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ffq h ALA 429 CO -0.02 0.48 -0.19 1.96 0.00 0.00 0.00 179.25 181.48 1ffq h GLN 430 N 0.00 0.00 0.00 0.00 4.20 -1.08 -3.47 115.11 114.76 1ffq h GLN 430 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ffq h GLN 430 Cb 0.75 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.53 1ffq h GLN 430 CO 0.05 0.19 0.00 0.41 -0.67 0.00 0.00 178.83 178.81 1ffq n GLY 431 N -0.16 1.25 3.75 3.46 0.00 -0.48 -4.59 105.19 108.43 1ffq n GLY 431 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1ffq n GLY 431 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ffq n VAL 432 N -0.81 1.09 -2.20 1.61 0.31 -0.88 -4.84 118.33 112.60 1ffq n VAL 432 Ca 0.00 -0.27 -0.41 0.00 -0.01 0.00 0.00 64.34 63.65 1ffq n VAL 432 Cb 0.00 -1.99 -0.03 0.00 -0.91 0.00 0.00 33.84 30.91 1ffq n VAL 432 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1ffq s LYS 433 N -0.62 4.39 0.30 5.55 1.02 -1.26 -4.52 119.74 124.60 1ffq s LYS 433 Ca 0.63 2.08 0.02 0.00 0.02 0.00 0.00 55.97 58.72 1ffq s LYS 433 Cb -0.49 -3.17 0.57 0.00 -0.52 0.00 0.00 37.83 34.23 1ffq s LYS 433 CO 0.49 -0.23 1.87 -1.00 -0.92 0.00 0.00 175.35 175.56 1ffq h PRO 434 N 4.96 0.95 0.00 -1.68 0.13 -1.91 -2.13 132.00 132.33 1ffq h PRO 434 Ca -0.46 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1ffq h PRO 434 Cb 1.22 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1ffq h PRO 434 CO 0.75 0.63 0.00 0.78 -0.23 0.00 0.00 178.00 179.93 1ffq h GLY 435 N 0.98 0.00 2.00 1.56 0.00 -1.83 -1.22 103.07 104.57 1ffq h GLY 435 Ca 0.45 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.70 1ffq h GLY 435 CO -0.21 0.00 -0.38 0.50 0.00 0.00 0.00 176.54 176.45 1ffq h LYS 436 N 0.00 0.00 -5.22 4.80 1.79 -1.70 -3.31 116.57 112.92 1ffq h LYS 436 Ca 0.00 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 57.83 1ffq h LYS 436 Cb 0.10 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 30.61 1ffq h LYS 436 CO 0.00 0.38 -0.09 0.42 -1.08 0.00 0.00 179.45 179.08 1ffq s ILE 437 N -3.16 5.06 -0.23 1.86 1.01 -0.46 -0.77 121.20 124.51 1ffq s ILE 437 Ca 0.03 0.45 -0.07 0.00 0.00 0.00 0.00 60.65 61.07 1ffq s ILE 437 Cb 0.08 -3.89 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 1ffq s ILE 437 CO 0.71 -0.09 0.05 -0.69 0.00 0.00 0.00 174.94 174.92 1ffq s VAL 438 N 2.30 4.29 0.25 2.92 1.01 0.58 0.20 120.40 131.94 1ffq s VAL 438 Ca 0.18 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.69 1ffq s VAL 438 Cb -0.16 -2.98 -0.09 0.00 0.00 0.00 0.00 36.38 33.15 1ffq s VAL 438 CO 0.12 0.37 0.93 -0.69 0.00 0.00 0.00 175.10 175.83 1ffq s VAL 439 N 1.35 4.12 -0.00 2.92 1.01 -0.18 -1.05 120.40 128.57 1ffq s VAL 439 Ca 0.05 2.00 -0.16 0.00 0.00 0.00 0.00 61.98 63.87 1ffq s VAL 439 Cb -0.15 -4.25 -0.06 0.00 0.00 0.00 0.00 36.38 31.93 1ffq s VAL 439 CO 0.03 0.43 0.46 -0.83 0.00 0.00 0.00 175.10 175.19 1ffq s GLY 440 N -1.27 2.51 -0.00 4.51 0.00 -1.04 -0.97 107.32 111.06 1ffq s GLY 440 Ca 0.42 -0.15 0.07 0.00 0.00 0.00 0.00 44.72 45.06 1ffq s GLY 440 CO 0.30 0.34 -0.22 -0.51 0.00 0.00 0.00 173.10 173.00 1ffq s THR 441 N -0.78 1.76 -0.20 0.90 -4.23 -0.53 -4.50 115.64 108.06 1ffq s THR 441 Ca 0.25 -1.01 -0.11 0.00 -1.18 0.00 0.00 61.69 59.65 1ffq s THR 441 Cb -0.17 -1.47 -0.05 0.00 1.34 0.00 0.00 72.50 72.15 1ffq s THR 441 CO 0.14 0.44 0.16 0.00 -0.54 0.00 0.00 174.62 174.83 1ffq s ALA 442 N -0.58 3.66 -0.37 3.99 0.00 -1.26 -2.84 121.76 124.36 1ffq s ALA 442 Ca 0.09 -0.69 0.06 0.00 0.00 0.00 0.00 51.96 51.42 1ffq s ALA 442 Cb -0.09 -2.23 0.61 0.00 0.00 0.00 0.00 23.12 21.41 1ffq s ALA 442 CO -0.00 0.09 1.69 -1.33 0.00 0.00 0.00 175.76 176.21 1ffq n MET 443 N 3.67 2.86 -3.80 0.00 2.81 0.26 -4.00 117.12 118.92 1ffq n MET 443 Ca -0.15 -2.57 -0.12 0.00 -1.81 0.00 0.00 57.70 53.05 1ffq n MET 443 Cb 0.52 -2.05 -0.08 0.00 -0.71 0.00 0.00 33.22 30.90 1ffq n MET 443 CO 0.00 0.00 0.00 1.52 1.51 0.00 0.00 175.97 179.00 1ffq s TYR 444 N -2.67 -0.05 0.33 2.03 1.13 -1.26 -1.03 117.35 115.83 1ffq s TYR 444 Ca 0.47 -0.06 0.07 0.00 -1.41 0.00 0.00 57.07 56.14 1ffq s TYR 444 Cb 0.38 0.03 -0.02 0.00 -1.10 0.00 0.00 41.96 41.26 1ffq s TYR 444 CO 0.11 -0.43 0.32 0.20 -2.51 0.00 0.00 175.55 173.25 1ffq s GLY 445 N -1.82 1.70 0.18 5.49 0.00 0.11 -4.49 107.32 108.49 1ffq s GLY 445 Ca -0.08 -1.58 0.09 0.00 0.00 0.00 0.00 44.72 43.15 1ffq s GLY 445 CO -0.01 -1.52 -0.12 0.50 0.00 0.00 0.00 173.10 171.95 1ffq s ARG 446 N -4.02 1.97 0.24 2.90 0.52 -0.67 -0.82 118.95 119.07 1ffq s ARG 446 Ca 0.41 -1.32 -0.21 0.00 -0.52 0.00 0.00 55.73 54.10 1ffq s ARG 446 Cb -0.07 -2.10 0.07 0.00 0.52 0.00 0.00 34.95 33.37 1ffq s ARG 446 CO 0.27 0.43 0.95 0.20 0.02 0.00 0.00 175.30 177.17 1ffq s GLY 447 N -2.82 0.14 0.22 -3.53 0.00 -0.67 -0.42 107.32 100.24 1ffq s GLY 447 Ca 0.24 -0.41 0.07 0.00 0.00 0.00 0.00 44.72 44.62 1ffq s GLY 447 CO 0.14 1.28 -0.10 -0.98 0.00 0.00 0.00 173.10 173.44 1ffq s TRP 448 N -2.39 1.70 0.18 1.90 0.51 -0.34 -0.66 118.94 119.85 1ffq s TRP 448 Ca 0.19 -0.67 0.11 0.00 -2.12 0.00 0.00 56.10 53.61 1ffq s TRP 448 Cb -0.03 -0.86 -0.04 0.00 -0.81 0.00 0.00 33.47 31.72 1ffq s TRP 448 CO 0.07 0.26 -0.24 -0.08 -0.51 0.00 0.00 176.95 176.44 1ffq s THR 449 N -3.08 2.34 -0.30 2.01 -1.32 0.91 -1.47 115.64 114.74 1ffq s THR 449 Ca 0.24 -1.98 0.00 0.00 -1.21 0.00 0.00 61.69 58.74 1ffq s THR 449 Cb 0.01 -2.11 0.00 0.00 -1.51 0.00 0.00 72.50 68.90 1ffq s THR 449 CO 0.07 -0.08 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 1ffq n GLY 450 N 0.39 0.48 3.77 6.08 0.00 -0.70 -1.44 105.19 113.76 1ffq n GLY 450 Ca -0.14 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 1ffq n GLY 450 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ffq s VAL 451 N -2.13 2.38 0.16 1.61 1.01 0.14 -3.82 120.40 119.76 1ffq s VAL 451 Ca 0.00 0.36 -0.20 0.00 0.00 0.00 0.00 61.98 62.14 1ffq s VAL 451 Cb 0.00 -3.23 0.05 0.00 0.00 0.00 0.00 36.38 33.20 1ffq s VAL 451 CO 0.00 0.08 0.54 0.54 0.00 0.00 0.00 175.10 176.26 1ffq s ASN 452 N -0.10 -0.41 -0.73 3.32 2.20 -0.36 -4.59 114.94 114.27 1ffq s ASN 452 Ca 0.54 -0.20 -0.05 0.00 -0.94 0.00 0.00 52.86 52.21 1ffq s ASN 452 Cb -0.44 0.57 0.01 0.00 -2.00 0.00 0.00 41.25 39.39 1ffq s ASN 452 CO 0.55 -0.98 0.63 0.61 -2.94 0.00 0.00 177.10 174.97 1ffq n GLY 453 N -0.34 0.14 3.60 0.45 0.00 -1.26 -2.02 105.19 105.77 1ffq n GLY 453 Ca -0.15 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 1ffq n GLY 453 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ffq s TYR 454 N -3.17 2.70 0.11 1.61 -0.85 -1.26 -4.11 117.35 112.38 1ffq s TYR 454 Ca 0.30 -0.20 0.04 0.00 -0.52 0.00 0.00 57.07 56.69 1ffq s TYR 454 Cb -0.13 -1.31 -0.04 0.00 0.38 0.00 0.00 41.96 40.86 1ffq s TYR 454 CO 0.39 0.52 0.10 -0.65 -1.52 0.00 0.00 175.55 174.39 1ffq s GLN 455 N -2.90 2.88 -1.57 -3.49 1.11 -1.26 -4.73 119.66 109.70 1ffq s GLN 455 Ca 0.26 -0.76 -0.03 0.00 0.01 0.00 0.00 55.36 54.84 1ffq s GLN 455 Cb -0.09 -2.70 0.00 0.00 -1.01 0.00 0.00 33.01 29.22 1ffq s GLN 455 CO 0.16 0.54 0.41 0.09 0.01 0.00 0.00 175.29 176.50 1ffq n ASN 456 N 0.17 -5.93 -2.80 5.90 3.02 -1.26 -0.79 115.26 113.58 1ffq n ASN 456 Ca -0.09 -0.20 -0.14 0.00 -0.03 0.00 0.00 54.58 54.12 1ffq n ASN 456 Cb 0.53 -4.80 -0.01 0.00 -0.61 0.00 0.00 39.78 34.89 1ffq n ASN 456 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ffq n ASN 457 N -2.21 -3.24 -4.23 6.41 3.02 -1.26 -4.98 115.26 108.77 1ffq n ASN 457 Ca -0.15 0.03 -0.39 0.00 -0.03 0.00 0.00 54.58 54.05 1ffq n ASN 457 Cb 0.64 -2.75 -0.11 0.00 -0.61 0.00 0.00 39.78 36.94 1ffq n ASN 457 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ffq s ILE 458 N -2.61 3.86 0.40 2.41 1.01 0.03 -4.97 121.20 121.33 1ffq s ILE 458 Ca 0.15 -1.49 0.30 0.00 0.00 0.00 0.00 60.65 59.61 1ffq s ILE 458 Cb -0.08 -3.38 0.33 0.00 0.01 0.00 0.00 42.46 39.34 1ffq s ILE 458 CO 0.18 -0.46 2.10 -0.65 0.00 0.00 0.00 174.94 176.11 1ffq h PRO 459 N 8.27 0.00 0.00 2.79 0.11 -1.94 -2.76 132.00 138.47 1ffq h PRO 459 Ca -0.21 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.89 1ffq h PRO 459 Cb 1.07 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1ffq h PRO 459 CO 0.70 0.09 -0.08 0.74 -0.21 0.00 0.00 178.00 179.24 1ffq h PHE 460 N 0.00 0.00 0.00 0.65 0.04 -1.93 -1.17 116.94 114.53 1ffq h PHE 460 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1ffq h PHE 460 Cb 0.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.46 1ffq h PHE 460 CO 0.00 0.08 0.00 0.25 -0.60 0.00 0.00 178.31 178.04 1ffq n THR 461 N -3.48 0.55 -0.21 -1.55 -2.24 -1.04 -4.08 114.28 102.22 1ffq n THR 461 Ca -0.02 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1ffq n THR 461 Cb 0.22 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 1ffq n THR 461 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffq n GLY 462 N 0.74 -1.08 3.19 3.38 0.00 -0.44 -4.65 105.19 106.33 1ffq n GLY 462 Ca 0.05 -1.60 -0.11 0.00 0.00 0.00 0.00 46.02 44.36 1ffq n GLY 462 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ffq s THR 463 N -0.23 0.37 0.30 2.61 -4.23 -0.86 -4.57 115.64 109.03 1ffq s THR 463 Ca 0.00 -1.93 0.10 0.00 -1.18 0.00 0.00 61.69 58.68 1ffq s THR 463 Cb 0.00 -2.04 -0.05 0.00 1.34 0.00 0.00 72.50 71.75 1ffq s THR 463 CO 0.00 -0.51 -0.09 0.00 -0.54 0.00 0.00 174.62 173.48 1ffq s ALA 464 N -3.86 2.99 -0.06 3.99 0.00 0.60 -1.23 121.76 124.19 1ffq s ALA 464 Ca 0.23 -1.87 0.21 0.00 0.00 0.00 0.00 51.96 50.53 1ffq s ALA 464 Cb 0.07 -0.39 -0.32 0.00 0.00 0.00 0.00 23.12 22.48 1ffq s ALA 464 CO 0.02 0.20 0.43 0.25 0.00 0.00 0.00 175.76 176.66 1ffq n THR 465 N -0.79 0.22 -3.46 0.00 -2.24 -0.52 -4.79 114.28 102.69 1ffq n THR 465 Ca -0.05 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1ffq n THR 465 Cb 0.61 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1ffq n THR 465 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffq n GLY 466 N 1.33 0.72 3.83 3.38 0.00 -1.13 -5.00 105.19 108.33 1ffq n GLY 466 Ca -0.08 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.88 1ffq n GLY 466 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ffq s PRO 467 N -0.70 4.16 0.67 1.61 0.04 -1.26 -0.07 135.00 139.45 1ffq s PRO 467 Ca 0.00 1.02 -0.15 0.00 0.04 0.00 0.00 61.00 61.91 1ffq s PRO 467 Cb 0.00 -2.22 0.01 0.00 0.04 0.00 0.00 34.50 32.32 1ffq s PRO 467 CO 0.00 -0.02 1.12 0.54 0.04 0.00 0.00 177.00 178.68 1ffq s VAL 468 N -2.19 3.11 -0.02 -0.36 0.11 0.17 -3.66 120.40 117.57 1ffq s VAL 468 Ca 0.60 0.52 -0.30 0.00 -2.93 0.00 0.00 61.98 59.87 1ffq s VAL 468 Cb -0.09 -3.04 -0.06 0.00 -1.53 0.00 0.00 36.38 31.66 1ffq s VAL 468 CO 0.16 -0.32 1.49 -0.75 -3.33 0.00 0.00 175.10 172.34 1ffq s LYS 469 N -4.08 4.24 0.54 1.54 2.20 -1.26 -0.76 119.74 122.17 1ffq s LYS 469 Ca 0.68 2.05 0.03 0.00 -0.36 0.00 0.00 55.97 58.37 1ffq s LYS 469 Cb -0.22 -3.69 0.04 0.00 -1.51 0.00 0.00 37.83 32.46 1ffq s LYS 469 CO 0.42 -0.67 0.75 0.20 -0.36 0.00 0.00 175.35 175.69 1ffq s GLY 470 N 2.30 1.84 0.03 5.54 0.00 -1.25 -4.79 107.32 111.00 1ffq s GLY 470 Ca 0.67 -1.54 -0.20 0.00 0.00 0.00 0.00 44.72 43.65 1ffq s GLY 470 CO 0.27 -1.23 1.28 -0.84 0.00 0.00 0.00 173.10 172.58 1ffq h THR 471 N 0.15 1.38 0.00 0.90 2.02 -1.69 -3.41 112.91 112.26 1ffq h THR 471 Ca -0.40 -1.52 0.00 0.00 0.77 0.00 0.00 66.41 65.26 1ffq h THR 471 Cb 1.29 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 69.75 1ffq h THR 471 CO 0.48 0.45 -0.92 0.79 0.37 0.00 0.00 175.52 176.68 1ffq n TRP 472 N -4.46 0.00 -3.67 3.16 7.02 -1.26 -5.05 117.44 113.18 1ffq n TRP 472 Ca -0.07 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.30 1ffq n TRP 472 Cb 0.44 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.28 1ffq n TRP 472 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1ffq s GLU 473 N -1.92 0.97 0.34 -0.99 -1.05 -1.26 -5.15 118.70 109.64 1ffq s GLU 473 Ca 0.00 -0.55 -0.29 0.00 -0.15 0.00 0.00 54.97 53.99 1ffq s GLU 473 Cb 0.00 0.43 -0.11 0.00 -0.44 0.00 0.00 34.13 34.01 1ffq s GLU 473 CO 0.00 -0.35 1.44 -0.80 0.95 0.00 0.00 175.26 176.50 1ffq s ASN 474 N -2.38 6.51 0.00 0.83 0.01 -1.26 -3.09 114.94 115.55 1ffq s ASN 474 Ca -0.01 2.89 0.00 0.00 -0.71 0.00 0.00 52.86 55.02 1ffq s ASN 474 Cb 0.01 -2.65 0.00 0.00 0.41 0.00 0.00 41.25 39.01 1ffq s ASN 474 CO -0.07 -0.76 0.00 0.61 -1.51 0.00 0.00 177.10 175.37 1ffq n GLY 475 N 0.98 1.07 2.92 0.66 0.00 0.06 -4.85 105.19 106.04 1ffq n GLY 475 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 1ffq n GLY 475 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ffq s ILE 476 N -2.73 0.45 -0.04 -0.61 1.01 -1.18 -1.66 121.20 116.44 1ffq s ILE 476 Ca 0.00 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.51 1ffq s ILE 476 Cb 0.00 -0.44 0.02 0.00 0.01 0.00 0.00 42.46 42.04 1ffq s ILE 476 CO 0.00 0.17 -0.07 -0.69 0.00 0.00 0.00 174.94 174.35 1ffq s VAL 477 N 0.43 0.69 0.47 2.92 1.01 -0.00 -1.68 120.40 124.24 1ffq s VAL 477 Ca -0.05 -0.23 -0.24 0.00 0.00 0.00 0.00 61.98 61.45 1ffq s VAL 477 Cb -0.09 -0.67 -0.08 0.00 0.00 0.00 0.00 36.38 35.55 1ffq s VAL 477 CO -0.00 0.25 1.40 0.47 0.00 0.00 0.00 175.10 177.22 1ffq n ASP 478 N 3.85 3.09 -0.30 3.32 8.00 -1.26 0.06 116.55 133.31 1ffq n ASP 478 Ca -0.24 1.08 0.01 0.00 0.71 0.00 0.00 54.79 56.35 1ffq n ASP 478 Cb 0.52 -1.59 0.14 0.00 -0.02 0.00 0.00 41.12 40.17 1ffq n ASP 478 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1ffq h TYR 479 N 2.05 0.93 -0.86 1.24 3.20 -0.95 -1.27 116.97 121.31 1ffq h TYR 479 Ca -0.51 0.03 0.22 0.00 3.14 0.00 0.00 58.73 61.61 1ffq h TYR 479 Cb 1.28 -0.30 -0.13 0.00 1.54 0.00 0.00 36.73 39.12 1ffq h TYR 479 CO 0.48 0.46 0.30 -0.09 -1.64 0.00 0.00 178.16 177.68 1ffq h ARG 480 N 0.92 0.30 0.01 1.82 2.43 -1.43 -0.71 114.38 117.70 1ffq h ARG 480 Ca 0.37 -0.02 -0.19 0.00 -0.81 0.00 0.00 59.98 59.33 1ffq h ARG 480 Cb 0.19 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1ffq h ARG 480 CO -0.18 0.20 -0.89 1.96 -1.51 0.00 0.00 179.97 179.55 1ffq h GLN 481 N 0.30 0.08 -0.04 0.20 1.08 -1.56 -0.06 115.11 115.12 1ffq h GLN 481 Ca 0.53 -0.10 0.03 0.00 -1.45 0.00 0.00 58.65 57.67 1ffq h GLN 481 Cb 1.03 0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 28.45 1ffq h GLN 481 CO -0.57 0.91 -0.16 0.82 -0.95 0.00 0.00 178.83 178.88 1ffq h ILE 482 N 0.04 0.59 -0.11 2.54 2.04 -0.60 0.18 117.51 122.20 1ffq h ILE 482 Ca -0.03 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.72 1ffq h ILE 482 Cb 1.55 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1ffq h ILE 482 CO 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 178.15 177.85 1ffq h ALA 483 N 0.71 1.09 0.04 1.87 0.00 -1.09 -1.43 119.26 120.46 1ffq h ALA 483 Ca 0.06 -0.42 -0.26 0.00 0.00 0.00 0.00 54.91 54.30 1ffq h ALA 483 Cb 0.34 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1ffq h ALA 483 CO -0.18 0.60 -1.28 0.78 0.00 0.00 0.00 179.25 179.16 1ffq h GLY 484 N 1.23 0.11 0.00 0.00 0.00 -0.78 -3.41 103.07 100.21 1ffq h GLY 484 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1ffq h GLY 484 CO 0.07 0.24 -0.65 -1.06 0.00 0.00 0.00 176.54 175.13 1ffq n GLN 485 N -3.34 2.37 -0.45 4.80 6.02 0.62 -4.83 117.38 122.57 1ffq n GLN 485 Ca -0.08 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 56.97 1ffq n GLN 485 Cb 1.00 -0.83 0.22 0.00 1.02 0.00 0.00 30.24 31.65 1ffq n GLN 485 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1ffq n PHE 486 N -1.25 0.77 -2.38 1.08 3.72 -0.55 -4.45 117.46 114.40 1ffq n PHE 486 Ca 0.00 -1.07 -0.17 0.00 -0.05 0.00 0.00 57.45 56.16 1ffq n PHE 486 Cb 0.18 -0.32 0.03 0.00 -0.94 0.00 0.00 39.48 38.43 1ffq n PHE 486 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1ffq n MET 487 N -0.84 2.85 -3.84 -1.08 2.81 -1.18 -4.82 117.12 111.02 1ffq n MET 487 Ca 0.23 -3.96 -0.09 0.00 -1.81 0.00 0.00 57.70 52.06 1ffq n MET 487 Cb 0.87 -2.00 0.01 0.00 -0.71 0.00 0.00 33.22 31.40 1ffq n MET 487 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1ffq s SER 488 N -3.60 0.05 1.73 7.83 1.04 -1.26 -5.04 113.70 114.45 1ffq s SER 488 Ca 0.42 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.74 1ffq s SER 488 Cb 0.39 0.82 0.00 0.00 0.10 0.00 0.00 66.02 67.33 1ffq s SER 488 CO -0.02 -1.61 0.00 0.61 0.98 0.00 0.00 173.24 173.20 1ffq n GLY 489 N -0.52 3.05 0.03 7.32 0.00 -1.26 -2.46 105.19 111.34 1ffq n GLY 489 Ca -0.07 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 45.89 1ffq n GLY 489 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ffq n GLU 490 N 13.47 0.10 -1.96 1.61 2.13 -1.26 -4.88 120.64 129.84 1ffq n GLU 490 Ca 0.00 -0.06 -0.42 0.00 0.66 0.00 0.00 57.16 57.34 1ffq n GLU 490 Cb 0.00 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.18 1ffq n GLU 490 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1ffq s TRP 491 N -2.94 2.39 0.40 4.31 0.52 -1.03 -4.62 118.94 117.98 1ffq s TRP 491 Ca 0.13 0.34 -0.23 0.00 0.02 0.00 0.00 56.10 56.36 1ffq s TRP 491 Cb 0.18 -3.93 -0.09 0.00 -1.15 0.00 0.00 33.47 28.47 1ffq s TRP 491 CO 0.66 -3.75 1.01 -0.65 0.02 0.00 0.00 176.95 174.24 1ffq s GLN 492 N 2.83 4.21 -0.10 4.98 -0.21 0.87 -4.64 119.66 127.59 1ffq s GLN 492 Ca 0.73 1.37 0.03 0.00 0.02 0.00 0.00 55.36 57.51 1ffq s GLN 492 Cb -0.38 -2.45 0.01 0.00 1.00 0.00 0.00 33.01 31.19 1ffq s GLN 492 CO 0.31 -0.08 -0.20 -0.47 -2.12 0.00 0.00 175.29 172.74 1ffq s TYR 493 N -1.81 2.26 -0.01 0.91 6.14 -1.26 -1.75 117.35 121.83 1ffq s TYR 493 Ca 0.59 -0.99 0.03 0.00 0.64 0.00 0.00 57.07 57.34 1ffq s TYR 493 Cb -0.18 -1.56 -0.01 0.00 0.42 0.00 0.00 41.96 40.64 1ffq s TYR 493 CO 0.22 -0.44 -0.11 0.99 0.64 0.00 0.00 175.55 176.85 1ffq s THR 494 N 0.62 0.86 -0.29 4.34 2.01 -0.75 -5.01 115.64 117.41 1ffq s THR 494 Ca -0.13 -0.45 -0.09 0.00 0.31 0.00 0.00 61.69 61.32 1ffq s THR 494 Cb -0.17 -0.73 -0.02 0.00 0.01 0.00 0.00 72.50 71.60 1ffq s THR 494 CO 0.04 0.25 0.13 -0.47 -0.69 0.00 0.00 174.62 173.88 1ffq s TYR 495 N -0.17 3.16 -0.51 4.92 5.04 -1.26 -0.82 117.35 127.70 1ffq s TYR 495 Ca 0.03 -0.44 -0.26 0.00 -2.44 0.00 0.00 57.07 53.96 1ffq s TYR 495 Cb -0.05 -2.32 0.03 0.00 0.35 0.00 0.00 41.96 39.97 1ffq s TYR 495 CO -0.00 -0.39 0.98 0.34 -1.34 0.00 0.00 175.55 175.14 1ffq s ASP 496 N 1.63 6.45 0.42 4.32 -1.08 0.37 -4.91 116.67 123.87 1ffq s ASP 496 Ca 0.05 -0.01 0.25 0.00 -0.52 0.00 0.00 52.55 52.32 1ffq s ASP 496 Cb -0.16 -2.47 0.57 0.00 -1.46 0.00 0.00 42.92 39.40 1ffq s ASP 496 CO 0.06 -1.19 1.69 0.00 0.52 0.00 0.00 175.17 176.25 1ffq h ALA 497 N 9.24 1.00 0.05 3.66 0.00 -1.96 0.27 119.26 131.51 1ffq h ALA 497 Ca -0.25 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ffq h ALA 497 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ffq h ALA 497 CO 1.08 0.00 -0.02 1.15 0.00 0.00 0.00 179.25 181.46 1ffq h THR 498 N 0.00 1.27 -0.02 0.00 2.02 -1.90 -3.33 112.91 110.94 1ffq h THR 498 Ca 0.00 -1.64 -0.13 0.00 0.77 0.00 0.00 66.41 65.41 1ffq h THR 498 Cb 0.88 2.26 -0.02 0.00 -1.74 0.00 0.00 68.15 69.53 1ffq h THR 498 CO 0.00 0.38 -0.58 0.00 0.37 0.00 0.00 175.52 175.69 1ffq h ALA 499 N -0.10 1.00 -4.26 6.16 0.00 -1.63 -3.42 119.26 117.02 1ffq h ALA 499 Ca -0.01 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 1ffq h ALA 499 Cb 0.67 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.39 1ffq h ALA 499 CO 0.01 0.72 -0.10 0.39 0.00 0.00 0.00 179.25 180.27 1ffq n GLU 500 N -3.86 -0.80 -3.64 0.00 -0.58 0.86 -0.85 120.64 111.76 1ffq n GLU 500 Ca -0.02 0.90 -0.06 0.00 -0.42 0.00 0.00 57.16 57.57 1ffq n GLU 500 Cb 0.59 -3.76 -0.07 0.00 -0.57 0.00 0.00 31.44 27.63 1ffq n GLU 500 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ffq s ALA 501 N -3.05 -1.97 0.37 0.62 0.00 -0.59 -3.71 121.76 113.44 1ffq s ALA 501 Ca 0.05 2.38 -0.09 0.00 0.00 0.00 0.00 51.96 54.31 1ffq s ALA 501 Cb -0.01 -1.51 -0.06 0.00 0.00 0.00 0.00 23.12 21.54 1ffq s ALA 501 CO 0.39 -0.43 0.71 -1.25 0.00 0.00 0.00 175.76 175.18 1ffq s PRO 502 N 1.72 3.74 -0.04 0.00 0.04 -1.26 -0.48 135.00 138.72 1ffq s PRO 502 Ca -0.09 0.34 -0.24 0.00 0.04 0.00 0.00 61.00 61.05 1ffq s PRO 502 Cb -0.05 -2.46 0.05 0.00 0.04 0.00 0.00 34.50 32.07 1ffq s PRO 502 CO -0.19 0.04 0.52 1.52 0.04 0.00 0.00 177.00 178.93 1ffq s TYR 503 N -2.28 -0.46 0.04 0.56 1.13 -0.00 -3.31 117.35 113.03 1ffq s TYR 503 Ca 0.49 0.78 0.09 0.00 -1.41 0.00 0.00 57.07 57.02 1ffq s TYR 503 Cb -0.10 0.27 -0.03 0.00 -1.10 0.00 0.00 41.96 41.00 1ffq s TYR 503 CO 0.31 -0.51 -0.25 0.14 -2.51 0.00 0.00 175.55 172.73 1ffq s VAL 504 N -1.20 2.23 -0.03 -3.49 -7.23 -0.77 -1.82 120.40 108.10 1ffq s VAL 504 Ca -0.12 -1.36 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 1ffq s VAL 504 Cb -0.02 -1.88 0.03 0.00 0.56 0.00 0.00 36.38 35.07 1ffq s VAL 504 CO 0.07 0.36 0.01 0.12 -0.31 0.00 0.00 175.10 175.36 1ffq s PHE 505 N -0.82 0.24 -0.45 2.82 5.36 -0.72 -1.49 117.98 122.92 1ffq s PHE 505 Ca 0.12 0.04 -0.08 0.00 -0.96 0.00 0.00 56.93 56.05 1ffq s PHE 505 Cb -0.10 -0.37 0.12 0.00 -0.34 0.00 0.00 43.02 42.32 1ffq s PHE 505 CO 0.02 -0.12 0.31 0.21 -1.46 0.00 0.00 175.22 174.18 1ffq s LYS 506 N 1.08 2.36 0.37 10.12 2.20 0.13 -0.09 119.74 135.90 1ffq s LYS 506 Ca -0.09 -1.77 0.10 0.00 -0.36 0.00 0.00 55.97 53.85 1ffq s LYS 506 Cb -0.13 -3.83 0.86 0.00 -1.51 0.00 0.00 37.83 33.22 1ffq s LYS 506 CO -0.02 -1.16 1.88 -1.35 -0.36 0.00 0.00 175.35 174.34 1ffq h PRO 507 N 8.35 0.62 0.00 4.03 0.11 -1.84 0.22 132.00 143.48 1ffq h PRO 507 Ca -0.19 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.82 1ffq h PRO 507 Cb 1.07 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 1ffq h PRO 507 CO 0.82 0.41 -0.29 0.66 -0.21 0.00 0.00 178.00 179.39 1ffq h SER 508 N 0.64 0.00 0.00 -2.05 4.64 -1.94 -3.14 113.55 111.70 1ffq h SER 508 Ca 0.44 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.74 1ffq h SER 508 Cb 0.75 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1ffq h SER 508 CO -0.19 0.29 -1.65 0.35 -0.87 0.00 0.00 176.83 174.76 1ffq n THR 509 N -3.19 0.06 -1.65 2.95 -2.24 -1.07 -5.00 114.28 104.13 1ffq n THR 509 Ca 0.02 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1ffq n THR 509 Cb 0.63 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 1ffq n THR 509 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ffq n GLY 510 N 1.75 0.54 3.69 3.38 0.00 0.73 -1.72 105.19 113.55 1ffq n GLY 510 Ca -0.04 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 1ffq n GLY 510 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ffq s ASP 511 N -2.89 6.93 -0.10 1.61 1.01 -1.03 -0.69 116.67 121.52 1ffq s ASP 511 Ca 0.00 1.99 0.01 0.00 0.71 0.00 0.00 52.55 55.26 1ffq s ASP 511 Cb 0.00 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.39 1ffq s ASP 511 CO 0.00 -0.67 -0.12 -0.22 0.21 0.00 0.00 175.17 174.37 1ffq s LEU 512 N 2.34 1.56 -0.07 1.23 2.96 -0.54 0.20 118.68 126.36 1ffq s LEU 512 Ca 0.61 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 54.18 1ffq s LEU 512 Cb -0.29 -0.94 0.02 0.00 0.50 0.00 0.00 46.19 45.48 1ffq s LEU 512 CO 0.25 -0.01 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.54 1ffq s ILE 513 N 1.07 0.98 -0.16 6.68 1.01 -0.55 -1.19 121.20 129.04 1ffq s ILE 513 Ca -0.06 -0.36 -0.03 0.00 0.00 0.00 0.00 60.65 60.20 1ffq s ILE 513 Cb -0.15 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.37 1ffq s ILE 513 CO -0.02 0.33 -0.06 0.28 0.00 0.00 0.00 174.94 175.47 1ffq s THR 514 N 0.97 3.55 0.26 2.92 -1.32 0.44 -1.85 115.64 120.60 1ffq s THR 514 Ca -0.09 -0.47 -0.03 0.00 -1.21 0.00 0.00 61.69 59.89 1ffq s THR 514 Cb -0.15 -2.55 -0.02 0.00 -1.51 0.00 0.00 72.50 68.27 1ffq s THR 514 CO 0.00 0.49 0.30 0.72 -2.21 0.00 0.00 174.62 173.92 1ffq s PHE 515 N 0.60 1.06 0.07 9.09 -0.71 -1.21 -1.66 117.98 125.21 1ffq s PHE 515 Ca -0.04 -1.26 -0.10 0.00 -1.04 0.00 0.00 56.93 54.49 1ffq s PHE 515 Cb -0.15 -0.33 -0.06 0.00 -1.21 0.00 0.00 43.02 41.28 1ffq s PHE 515 CO 0.03 -0.85 0.39 -0.51 -1.34 0.00 0.00 175.22 172.93 1ffq s ASP 516 N -3.18 6.63 0.00 1.98 1.01 -1.26 -4.05 116.67 117.81 1ffq s ASP 516 Ca 0.34 0.77 0.00 0.00 0.71 0.00 0.00 52.55 54.37 1ffq s ASP 516 Cb 0.03 -2.17 0.00 0.00 1.01 0.00 0.00 42.92 41.79 1ffq s ASP 516 CO 0.15 0.18 0.00 -0.90 0.21 0.00 0.00 175.17 174.82 1ffq n ASP 517 N 0.93 1.22 -0.28 0.27 5.68 -1.26 -4.93 116.55 118.18 1ffq n ASP 517 Ca -0.08 -0.91 -0.00 0.00 -0.50 0.00 0.00 54.79 53.30 1ffq n ASP 517 Cb 0.52 0.00 0.19 0.00 -1.14 0.00 0.00 41.12 40.70 1ffq n ASP 517 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ffq h ALA 518 N 1.00 1.40 -0.07 2.12 0.00 -1.95 -1.18 119.26 120.58 1ffq h ALA 518 Ca 0.00 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 1ffq h ALA 518 Cb 0.00 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 17.46 1ffq h ALA 518 CO 0.00 0.55 -0.63 -0.09 0.00 0.00 0.00 179.25 179.08 1ffq h ARG 519 N 1.15 0.56 -0.23 0.00 2.43 -1.96 -0.88 114.38 115.44 1ffq h ARG 519 Ca 0.32 -0.50 -0.07 0.00 -0.81 0.00 0.00 59.98 58.91 1ffq h ARG 519 Cb -0.11 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1ffq h ARG 519 CO -0.07 1.13 -0.17 0.66 -1.51 0.00 0.00 179.97 180.00 1ffq h SER 520 N 0.16 0.39 -0.29 -3.80 4.64 -1.80 -0.45 113.55 112.40 1ffq h SER 520 Ca -0.06 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.13 1ffq h SER 520 Cb 1.29 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1ffq h SER 520 CO 0.13 0.59 0.07 0.58 -0.87 0.00 0.00 176.83 177.32 1ffq h VAL 521 N 0.37 1.22 -0.82 0.95 2.07 -1.19 -0.98 116.25 117.87 1ffq h VAL 521 Ca 0.07 -0.73 0.08 0.00 0.82 0.00 0.00 66.70 66.93 1ffq h VAL 521 Cb 0.52 1.14 -0.07 0.00 -1.52 0.00 0.00 31.29 31.37 1ffq h VAL 521 CO 0.03 0.24 0.49 -0.61 0.02 0.00 0.00 177.57 177.74 1ffq h GLN 522 N 0.31 0.83 -0.93 1.57 4.15 -0.80 -0.05 115.11 120.20 1ffq h GLN 522 Ca 0.09 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.52 1ffq h GLN 522 Cb 0.30 -0.19 -0.06 0.00 0.21 0.00 0.00 27.48 27.74 1ffq h GLN 522 CO 0.00 0.55 0.59 0.00 -1.93 0.00 0.00 178.83 178.04 1ffq h ALA 523 N 1.42 1.27 -0.50 3.38 0.00 -0.73 -1.15 119.26 122.95 1ffq h ALA 523 Ca 0.37 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.19 1ffq h ALA 523 Cb 0.26 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1ffq h ALA 523 CO -0.21 0.37 -0.01 0.87 0.00 0.00 0.00 179.25 180.27 1ffq h LYS 524 N 1.08 0.85 -0.10 0.00 1.57 -0.26 -2.73 116.57 116.98 1ffq h LYS 524 Ca 0.40 -0.25 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 1ffq h LYS 524 Cb 0.15 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1ffq h LYS 524 CO -0.17 0.86 -0.04 0.78 -0.57 0.00 0.00 179.45 180.31 1ffq h GLY 525 N 0.98 0.23 0.33 3.86 0.00 -0.65 0.11 103.07 107.93 1ffq h GLY 525 Ca 0.15 -0.20 0.10 0.00 0.00 0.00 0.00 47.33 47.38 1ffq h GLY 525 CO 0.02 0.18 0.23 1.70 0.00 0.00 0.00 176.54 178.68 1ffq h LYS 526 N -0.14 0.39 -0.15 4.80 3.64 -1.28 0.09 116.57 123.92 1ffq h LYS 526 Ca 0.02 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1ffq h LYS 526 Cb 0.49 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1ffq h LYS 526 CO 0.01 0.26 0.08 -0.92 -2.27 0.00 0.00 179.45 176.61 1ffq h TYR 527 N 0.41 0.14 -0.40 1.91 3.20 -1.26 0.50 116.97 121.46 1ffq h TYR 527 Ca 0.33 0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.28 1ffq h TYR 527 Cb 0.42 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.58 1ffq h TYR 527 CO -0.17 0.08 -0.07 0.28 -1.64 0.00 0.00 178.16 176.63 1ffq h VAL 528 N 0.16 0.62 -0.45 1.81 2.07 -0.43 0.75 116.25 120.77 1ffq h VAL 528 Ca 0.06 -0.01 -0.05 0.00 0.82 0.00 0.00 66.70 67.52 1ffq h VAL 528 Cb 0.01 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 1ffq h VAL 528 CO -0.04 0.00 0.10 -0.07 0.02 0.00 0.00 177.57 177.58 1ffq h LEU 529 N 0.03 0.70 -0.67 2.57 3.38 -0.41 -0.07 115.31 120.84 1ffq h LEU 529 Ca 0.20 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1ffq h LEU 529 Cb 0.30 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1ffq h LEU 529 CO -0.39 0.76 0.29 0.44 0.09 0.00 0.00 178.44 179.63 1ffq h ASP 530 N 0.61 0.91 -0.43 -0.43 3.32 0.30 -2.91 116.42 117.79 1ffq h ASP 530 Ca 0.14 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1ffq h ASP 530 Cb 0.34 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1ffq h ASP 530 CO 0.00 0.82 0.00 0.29 -1.72 0.00 0.00 179.24 178.63 1ffq n LYS 531 N -4.42 2.12 -3.04 3.56 4.76 0.23 -4.94 118.16 116.43 1ffq n LYS 531 Ca 0.05 -1.73 -0.22 0.00 -2.87 0.00 0.00 58.31 53.55 1ffq n LYS 531 Cb 0.16 -1.40 0.04 0.00 -1.84 0.00 0.00 35.03 31.98 1ffq n LYS 531 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1ffq n GLN 532 N 0.91 -5.00 -1.17 1.97 6.02 -0.54 -4.88 117.38 114.69 1ffq n GLN 532 Ca 0.17 0.87 -0.19 0.00 -0.01 0.00 0.00 57.00 57.84 1ffq n GLN 532 Cb 0.43 -5.66 0.13 0.00 1.02 0.00 0.00 30.24 26.16 1ffq n GLN 532 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1ffq n LEU 533 N -3.96 0.00 0.07 1.08 4.77 -0.15 -3.10 117.00 115.71 1ffq n LEU 533 Ca -0.10 -0.91 0.05 0.00 -0.03 0.00 0.00 56.01 55.02 1ffq n LEU 533 Cb 0.61 -0.64 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1ffq n LEU 533 CO 0.47 -1.14 -0.10 1.23 -1.33 0.00 0.00 177.39 176.52 1ffq h GLY 534 N -1.16 0.00 0.00 -0.72 0.00 -0.25 -3.44 103.07 97.50 1ffq h GLY 534 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1ffq h GLY 534 CO 0.19 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.34 1ffq n GLY 535 N 1.29 -0.01 3.11 4.60 0.00 -1.25 -0.90 105.19 112.04 1ffq n GLY 535 Ca -0.05 -1.18 -0.18 0.00 0.00 0.00 0.00 46.02 44.61 1ffq n GLY 535 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ffq s LEU 536 N 0.00 2.19 0.17 0.99 1.43 0.25 -1.01 118.68 122.70 1ffq s LEU 536 Ca 0.00 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 1ffq s LEU 536 Cb 0.00 -0.44 -0.05 0.00 0.03 0.00 0.00 46.19 45.73 1ffq s LEU 536 CO 0.00 -0.04 0.02 0.72 0.23 0.00 0.00 176.35 177.27 1ffq s PHE 537 N -0.98 1.18 0.10 0.29 -0.71 -0.14 -1.17 117.98 116.55 1ffq s PHE 537 Ca -0.02 -1.06 0.03 0.00 -1.04 0.00 0.00 56.93 54.84 1ffq s PHE 537 Cb -0.08 -0.67 -0.04 0.00 -1.21 0.00 0.00 43.02 41.02 1ffq s PHE 537 CO 0.01 -0.26 -0.08 -1.54 -1.34 0.00 0.00 175.22 172.01 1ffq s SER 538 N -3.16 1.30 -0.07 1.98 1.04 0.33 -1.45 113.70 113.66 1ffq s SER 538 Ca 0.25 -0.93 0.02 0.00 0.48 0.00 0.00 55.95 55.76 1ffq s SER 538 Cb 0.06 0.05 0.02 0.00 0.10 0.00 0.00 66.02 66.25 1ffq s SER 538 CO 0.04 -0.38 -0.11 0.86 0.98 0.00 0.00 173.24 174.63 1ffq s TRP 539 N -3.15 1.43 0.25 5.02 -0.11 -1.13 -2.31 118.94 118.94 1ffq s TRP 539 Ca 0.10 -0.56 0.09 0.00 1.22 0.00 0.00 56.10 56.95 1ffq s TRP 539 Cb 0.02 -1.08 -0.05 0.00 -1.50 0.00 0.00 33.47 30.86 1ffq s TRP 539 CO -0.02 -0.31 -0.15 -1.83 -4.62 0.00 0.00 176.95 170.01 1ffq s GLU 540 N 0.84 1.53 0.38 5.86 -1.05 -1.26 -0.57 118.70 124.41 1ffq s GLU 540 Ca -0.11 -1.71 0.20 0.00 -0.15 0.00 0.00 54.97 53.20 1ffq s GLU 540 Cb -0.15 -1.41 0.58 0.00 -0.44 0.00 0.00 34.13 32.71 1ffq s GLU 540 CO 0.02 0.22 1.68 0.97 0.95 0.00 0.00 175.26 179.09 1ffq h ILE 541 N 2.37 0.70 0.00 1.83 6.09 -1.40 -2.86 117.51 124.25 1ffq h ILE 541 Ca -0.39 -1.54 -0.03 0.00 -1.37 0.00 0.00 64.86 61.52 1ffq h ILE 541 Cb 1.24 2.01 -0.00 0.00 0.47 0.00 0.00 36.82 40.54 1ffq h ILE 541 CO 0.63 0.33 -0.14 -2.24 -3.07 0.00 0.00 178.15 173.66 1ffq h ASP 542 N 0.00 0.00 0.88 2.19 2.03 -1.96 -3.12 116.42 116.44 1ffq h ASP 542 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1ffq h ASP 542 Cb 0.99 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.49 1ffq h ASP 542 CO 0.04 0.14 -0.41 0.00 -1.03 0.00 0.00 179.24 177.98 1ffq n ALA 543 N -2.19 2.91 -1.77 4.15 0.00 -1.08 -4.90 120.51 117.63 1ffq n ALA 543 Ca -0.00 -0.22 -0.33 0.00 0.00 0.00 0.00 53.44 52.89 1ffq n ALA 543 Cb 0.35 -1.25 -0.02 0.00 0.00 0.00 0.00 19.45 18.54 1ffq n ALA 543 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ffq s ASP 544 N -3.77 6.28 0.00 0.00 2.15 -1.18 -1.25 116.67 118.89 1ffq s ASP 544 Ca 0.09 1.71 0.21 0.00 0.43 0.00 0.00 52.55 55.00 1ffq s ASP 544 Cb 0.15 -2.52 0.12 0.00 -0.30 0.00 0.00 42.92 40.36 1ffq s ASP 544 CO 0.67 -0.83 1.14 -0.46 -0.17 0.00 0.00 175.17 175.52 1ffq n ASN 545 N -1.65 2.55 0.00 -0.34 0.23 -1.26 -4.74 115.26 110.04 1ffq n ASN 545 Ca 0.08 -1.77 0.00 0.00 -0.53 0.00 0.00 54.58 52.35 1ffq n ASN 545 Cb 0.53 0.14 0.00 0.00 -2.08 0.00 0.00 39.78 38.38 1ffq n ASN 545 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ffq n GLY 546 N 1.26 1.07 0.28 4.83 0.00 -1.26 -0.68 105.19 110.69 1ffq n GLY 546 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 1ffq n GLY 546 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ffq h ASP 547 N 1.54 0.86 0.29 1.61 3.32 -1.93 0.79 116.42 122.91 1ffq h ASP 547 Ca 0.00 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 1ffq h ASP 547 Cb 0.00 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1ffq h ASP 547 CO 0.00 0.80 -0.14 0.40 -1.72 0.00 0.00 179.24 178.58 1ffq h ILE 548 N 0.87 0.73 -0.03 0.35 1.08 -1.93 -2.26 117.51 116.32 1ffq h ILE 548 Ca 0.21 -0.49 -0.09 0.00 -0.39 0.00 0.00 64.86 64.10 1ffq h ILE 548 Cb 0.21 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.95 1ffq h ILE 548 CO -0.02 0.10 -0.39 0.25 -0.69 0.00 0.00 178.15 177.40 1ffq h LEU 549 N -0.67 0.06 -0.30 1.44 5.85 -1.98 -0.24 115.31 119.48 1ffq h LEU 549 Ca -0.04 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.68 1ffq h LEU 549 Cb 0.47 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1ffq h LEU 549 CO 0.07 0.45 0.12 0.78 -0.34 0.00 0.00 178.44 179.51 1ffq h ASN 550 N 0.05 0.16 0.23 1.25 2.35 -0.86 -2.21 115.58 116.54 1ffq h ASN 550 Ca 0.00 0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.64 1ffq h ASN 550 Cb 0.71 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.07 1ffq h ASN 550 CO 0.05 0.13 -0.51 -1.28 -1.65 0.00 0.00 177.43 174.17 1ffq h SER 551 N 0.26 0.34 -0.38 5.81 0.87 -0.82 -1.37 113.55 118.27 1ffq h SER 551 Ca 0.13 -0.17 0.04 0.00 -1.23 0.00 0.00 61.79 60.56 1ffq h SER 551 Cb 0.08 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 61.90 1ffq h SER 551 CO -0.11 0.79 0.15 0.24 -0.53 0.00 0.00 176.83 177.37 1ffq h MET 552 N 0.25 0.30 0.04 2.24 2.86 -0.89 -0.15 114.93 119.58 1ffq h MET 552 Ca 0.01 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1ffq h MET 552 Cb 0.98 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.57 1ffq h MET 552 CO 0.08 0.20 -0.02 -0.91 1.06 0.00 0.00 176.91 177.32 1ffq h ASN 553 N 0.31 -0.05 -0.52 1.22 2.35 -1.24 -2.71 115.58 114.95 1ffq h ASN 553 Ca 0.17 -0.21 -0.11 0.00 -0.55 0.00 0.00 56.30 55.60 1ffq h ASN 553 Cb 0.13 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 1ffq h ASN 553 CO -0.16 0.18 -0.08 0.00 -1.65 0.00 0.00 177.43 175.72 1ffq h ALA 554 N 0.66 0.72 0.00 -0.83 0.00 -1.12 -2.10 119.26 116.59 1ffq h ALA 554 Ca -0.01 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 1ffq h ALA 554 Cb 0.26 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ffq h ALA 554 CO 0.01 0.61 -0.22 0.66 0.00 0.00 0.00 179.25 180.31 1ffq h SER 555 N 0.85 0.00 -0.01 0.00 4.64 -1.05 0.12 113.55 118.10 1ffq h SER 555 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1ffq h SER 555 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1ffq h SER 555 CO 0.04 0.22 -0.00 0.18 -0.87 0.00 0.00 176.83 176.40 1ffq n LEU 556 N -3.61 1.31 0.00 5.97 4.77 -1.02 -3.91 117.00 120.50 1ffq n LEU 556 Ca -0.01 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 1ffq n LEU 556 Cb 0.35 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1ffq n LEU 556 CO 0.33 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1ffq n GLY 557 N 1.15 0.73 3.76 -0.72 0.00 0.03 -4.78 105.19 105.36 1ffq n GLY 557 Ca 0.20 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 1ffq n GLY 557 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ffq s ASN 558 N -2.42 7.10 0.20 1.61 0.01 -0.80 -4.56 114.94 116.07 1ffq s ASN 558 Ca 0.00 2.37 -0.27 0.00 -0.71 0.00 0.00 52.86 54.25 1ffq s ASN 558 Cb 0.00 -2.63 -0.08 0.00 0.41 0.00 0.00 41.25 38.95 1ffq s ASN 558 CO 0.00 -0.30 0.85 -0.44 -1.51 0.00 0.00 177.10 175.70 1ffq s SER 559 N -0.54 7.51 0.52 -1.22 0.01 -1.24 -4.59 113.70 114.15 1ffq s SER 559 Ca 0.48 1.78 -0.22 0.00 1.31 0.00 0.00 55.95 59.30 1ffq s SER 559 Cb -0.34 -2.55 -0.06 0.00 0.21 0.00 0.00 66.02 63.27 1ffq s SER 559 CO 0.43 0.18 1.23 0.00 0.41 0.00 0.00 173.24 175.49 1ffq n ALA 560 N 1.57 1.11 0.00 1.44 0.00 -1.26 0.54 120.51 123.91 1ffq n ALA 560 Ca -0.04 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1ffq n ALA 560 Cb 0.48 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1ffq n ALA 560 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ffq n GLY 561 N 0.92 -0.17 3.02 0.00 0.00 -0.32 -4.62 105.19 104.02 1ffq n GLY 561 Ca 0.10 -2.23 -0.15 0.00 0.00 0.00 0.00 46.02 43.74 1ffq n GLY 561 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ffq s VAL 562 N 0.00 0.52 -0.77 1.61 -7.23 -1.26 -2.77 120.40 110.49 1ffq s VAL 562 Ca 0.00 -0.71 0.06 0.00 -1.81 0.00 0.00 61.98 59.52 1ffq s VAL 562 Cb 0.00 -0.52 0.05 0.00 0.56 0.00 0.00 36.38 36.47 1ffq s VAL 562 CO 0.00 -0.15 0.69 0.00 -0.31 0.00 0.00 175.10 175.34