#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fg9 s THR 14 N 0.00 3.59 0.60 3.45 -4.23 -1.26 -4.73 115.64 113.06 1fg9 s THR 14 Ca 0.00 -0.86 -0.19 0.00 -1.18 0.00 0.00 61.69 59.46 1fg9 s THR 14 Cb 0.00 -2.58 -0.03 0.00 1.34 0.00 0.00 72.50 71.23 1fg9 s THR 14 CO 0.00 0.35 1.29 -2.84 -0.54 0.00 0.00 174.62 172.87 1fg9 s PRO 15 N -1.55 2.86 0.13 3.99 0.02 -1.26 -4.85 135.00 134.34 1fg9 s PRO 15 Ca 0.18 2.05 0.07 0.00 0.02 0.00 0.00 61.00 63.31 1fg9 s PRO 15 Cb -0.11 -2.00 -0.04 0.00 0.02 0.00 0.00 34.50 32.37 1fg9 s PRO 15 CO 0.09 -1.35 -0.15 -0.08 -0.33 0.00 0.00 177.00 175.17 1fg9 s THR 16 N -1.42 1.45 -1.26 0.99 -1.32 -0.94 -4.86 115.64 108.28 1fg9 s THR 16 Ca 0.78 -1.76 -0.09 0.00 -1.21 0.00 0.00 61.69 59.40 1fg9 s THR 16 Cb -0.36 -1.61 -0.01 0.00 -1.51 0.00 0.00 72.50 69.01 1fg9 s THR 16 CO 0.40 -0.39 0.66 0.59 -2.21 0.00 0.00 174.62 173.68 1fg9 n ASN 17 N 0.48 -2.84 -4.77 8.08 3.02 -1.26 0.53 115.26 118.50 1fg9 n ASN 17 Ca -0.15 -0.95 -0.39 0.00 -0.03 0.00 0.00 54.58 53.05 1fg9 n ASN 17 Cb 0.57 -3.53 -0.00 0.00 -0.61 0.00 0.00 39.78 36.21 1fg9 n ASN 17 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1fg9 s VAL 18 N -3.66 2.55 -0.26 2.41 1.01 -1.25 -4.33 120.40 116.87 1fg9 s VAL 18 Ca 0.22 0.49 -0.11 0.00 0.00 0.00 0.00 61.98 62.58 1fg9 s VAL 18 Cb -0.07 -3.29 0.10 0.00 0.00 0.00 0.00 36.38 33.12 1fg9 s VAL 18 CO 0.85 0.07 0.59 -0.89 0.00 0.00 0.00 175.10 175.72 1fg9 s THR 19 N -1.26 -0.60 0.14 3.92 2.01 0.23 -4.95 115.64 115.13 1fg9 s THR 19 Ca 0.58 0.04 -0.04 0.00 0.31 0.00 0.00 61.69 62.58 1fg9 s THR 19 Cb -0.39 -0.89 -0.05 0.00 0.01 0.00 0.00 72.50 71.18 1fg9 s THR 19 CO 0.50 0.02 0.37 -0.63 -0.69 0.00 0.00 174.62 174.18 1fg9 s ILE 20 N 2.41 5.18 -0.09 1.82 1.01 -1.26 0.57 121.20 130.84 1fg9 s ILE 20 Ca -0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 60.65 60.44 1fg9 s ILE 20 Cb -0.10 -3.63 0.03 0.00 0.01 0.00 0.00 42.46 38.76 1fg9 s ILE 20 CO -0.17 0.02 0.31 -1.61 0.00 0.00 0.00 174.94 173.49 1fg9 s GLU 21 N -2.71 0.43 0.02 2.79 2.02 -0.94 -4.96 118.70 115.34 1fg9 s GLU 21 Ca 0.40 0.29 0.01 0.00 0.02 0.00 0.00 54.97 55.70 1fg9 s GLU 21 Cb -0.12 0.20 -0.02 0.00 0.10 0.00 0.00 34.13 34.29 1fg9 s GLU 21 CO 0.25 -0.07 -0.06 0.45 0.02 0.00 0.00 175.26 175.86 1fg9 s SER 22 N -0.17 0.60 -0.07 -0.19 0.15 -1.26 -0.78 113.70 111.98 1fg9 s SER 22 Ca -0.03 -0.38 -0.04 0.00 0.70 0.00 0.00 55.95 56.20 1fg9 s SER 22 Cb -0.03 0.02 0.04 0.00 -1.71 0.00 0.00 66.02 64.34 1fg9 s SER 22 CO 0.01 -0.14 0.17 -0.47 1.20 0.00 0.00 173.24 174.01 1fg9 s TYR 23 N -0.96 -0.20 -1.50 3.44 5.04 -1.14 -4.89 117.35 117.15 1fg9 s TYR 23 Ca -0.07 0.54 -0.14 0.00 -2.44 0.00 0.00 57.07 54.95 1fg9 s TYR 23 Cb -0.07 -0.02 0.12 0.00 0.35 0.00 0.00 41.96 42.33 1fg9 s TYR 23 CO -0.00 -0.16 0.68 0.09 -1.34 0.00 0.00 175.55 174.82 1fg9 n ASN 24 N 3.95 -3.58 -2.64 4.32 3.02 -1.26 -3.31 115.26 115.77 1fg9 n ASN 24 Ca -0.23 -0.72 -0.07 0.00 -0.03 0.00 0.00 54.58 53.53 1fg9 n ASN 24 Cb 0.53 -2.93 0.03 0.00 -0.61 0.00 0.00 39.78 36.80 1fg9 n ASN 24 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1fg9 n MET 25 N -4.12 -1.30 -3.15 3.52 2.81 -1.26 -5.03 117.12 108.59 1fg9 n MET 25 Ca 0.04 0.80 0.06 0.00 -1.81 0.00 0.00 57.70 56.79 1fg9 n MET 25 Cb 0.51 -4.42 -0.02 0.00 -0.71 0.00 0.00 33.22 28.59 1fg9 n MET 25 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1fg9 s ASN 26 N -3.05 -0.26 0.07 7.83 2.20 -1.21 -5.06 114.94 115.46 1fg9 s ASN 26 Ca 0.20 0.14 -0.04 0.00 -0.94 0.00 0.00 52.86 52.23 1fg9 s ASN 26 Cb -0.03 1.21 -0.05 0.00 -2.00 0.00 0.00 41.25 40.39 1fg9 s ASN 26 CO 0.50 -0.05 0.28 -2.16 -2.94 0.00 0.00 177.10 172.74 1fg9 s PRO 27 N 2.97 3.54 -0.07 3.55 0.04 -1.25 -2.87 135.00 140.91 1fg9 s PRO 27 Ca -0.01 -0.21 0.02 0.00 0.04 0.00 0.00 61.00 60.85 1fg9 s PRO 27 Cb -0.08 -2.99 0.01 0.00 0.04 0.00 0.00 34.50 31.48 1fg9 s PRO 27 CO -0.11 0.58 -0.13 0.42 0.04 0.00 0.00 177.00 177.80 1fg9 s ILE 28 N -1.49 1.19 0.10 0.56 -1.09 0.04 -1.95 121.20 118.57 1fg9 s ILE 28 Ca 0.34 -0.51 -0.28 0.00 -2.23 0.00 0.00 60.65 57.98 1fg9 s ILE 28 Cb -0.13 -1.08 -0.06 0.00 -1.58 0.00 0.00 42.46 39.61 1fg9 s ILE 28 CO 0.23 0.37 0.87 -0.69 -1.23 0.00 0.00 174.94 174.48 1fg9 s VAL 29 N 0.66 4.53 -0.01 2.92 1.01 0.16 -2.22 120.40 127.45 1fg9 s VAL 29 Ca -0.15 1.88 0.06 0.00 0.00 0.00 0.00 61.98 63.77 1fg9 s VAL 29 Cb -0.16 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 1fg9 s VAL 29 CO 0.04 0.37 -0.18 -0.31 0.00 0.00 0.00 175.10 175.02 1fg9 s TYR 30 N -0.25 1.60 -0.09 5.22 2.02 0.19 -0.02 117.35 126.03 1fg9 s TYR 30 Ca 0.42 -0.31 -0.23 0.00 -0.37 0.00 0.00 57.07 56.58 1fg9 s TYR 30 Cb -0.23 -1.02 0.05 0.00 -0.40 0.00 0.00 41.96 40.36 1fg9 s TYR 30 CO 0.27 -0.02 0.54 1.67 -1.57 0.00 0.00 175.55 176.45 1fg9 s TRP 31 N -0.46 -0.51 0.73 2.71 -2.14 -1.21 0.78 118.94 118.83 1fg9 s TRP 31 Ca 0.07 1.01 -0.04 0.00 2.66 0.00 0.00 56.10 59.80 1fg9 s TRP 31 Cb -0.07 0.26 0.11 0.00 -3.10 0.00 0.00 33.47 30.67 1fg9 s TRP 31 CO -0.00 -0.45 1.02 -1.21 -2.66 0.00 0.00 176.95 173.64 1fg9 s GLU 32 N -0.76 1.75 -0.29 3.25 0.41 0.19 -4.79 118.70 118.45 1fg9 s GLU 32 Ca -0.08 -0.78 -0.23 0.00 -0.41 0.00 0.00 54.97 53.47 1fg9 s GLU 32 Cb -0.03 -2.24 0.18 0.00 -1.78 0.00 0.00 34.13 30.26 1fg9 s GLU 32 CO 0.05 -1.45 1.31 -0.47 -0.49 0.00 0.00 175.26 174.22 1fg9 s TYR 33 N -3.23 -0.16 0.45 1.61 5.04 -1.26 -2.22 117.35 117.58 1fg9 s TYR 33 Ca 0.65 0.38 -0.23 0.00 -2.44 0.00 0.00 57.07 55.42 1fg9 s TYR 33 Cb -0.07 0.38 -0.07 0.00 0.35 0.00 0.00 41.96 42.55 1fg9 s TYR 33 CO 0.45 -0.08 1.19 1.14 -1.34 0.00 0.00 175.55 176.91 1fg9 s GLN 34 N 0.31 3.76 0.53 4.97 1.03 -1.26 -5.02 119.66 123.98 1fg9 s GLN 34 Ca 0.03 1.83 -0.16 0.00 0.04 0.00 0.00 55.36 57.10 1fg9 s GLN 34 Cb -0.04 -2.45 -0.07 0.00 0.03 0.00 0.00 33.01 30.47 1fg9 s GLN 34 CO -0.13 -0.56 0.99 0.96 -2.54 0.00 0.00 175.29 174.01 1fg9 s ILE 35 N -1.50 4.50 -0.10 3.63 -0.00 -1.26 -4.93 121.20 121.55 1fg9 s ILE 35 Ca 0.63 1.17 -0.31 0.00 -0.00 0.00 0.00 60.65 62.14 1fg9 s ILE 35 Cb -0.30 -3.71 0.12 0.00 -0.00 0.00 0.00 42.46 38.57 1fg9 s ILE 35 CO 0.37 -0.72 1.02 0.00 -0.00 0.00 0.00 174.94 175.61 1fg9 s MET 36 N -4.17 0.60 0.50 0.37 0.23 -1.26 -5.03 119.30 110.55 1fg9 s MET 36 Ca 0.59 -0.15 0.15 0.00 -1.03 0.00 0.00 55.69 55.25 1fg9 s MET 36 Cb -0.10 0.28 0.82 0.00 -1.53 0.00 0.00 34.83 34.30 1fg9 s MET 36 CO 0.34 -0.25 1.39 -1.00 -2.03 0.00 0.00 175.02 173.47 1fg9 h PRO 37 N 2.12 0.00 -5.97 3.16 0.13 -2.08 -3.41 132.00 125.96 1fg9 h PRO 37 Ca -0.17 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.28 1fg9 h PRO 37 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 1fg9 h PRO 37 CO 0.28 0.00 -0.61 -1.14 -0.23 0.00 0.00 178.00 176.30 1fg9 s GLN 38 N -3.66 3.00 -0.31 0.86 2.00 -1.26 -5.09 119.66 115.20 1fg9 s GLN 38 Ca -0.02 -0.41 -0.18 0.00 -2.00 0.00 0.00 55.36 52.76 1fg9 s GLN 38 Cb 0.04 -2.81 -0.01 0.00 0.80 0.00 0.00 33.01 31.03 1fg9 s GLN 38 CO 0.14 0.70 0.50 0.54 -0.50 0.00 0.00 175.29 176.67 1fg9 s VAL 39 N -0.92 5.05 0.35 1.34 0.11 -1.26 -5.06 120.40 120.00 1fg9 s VAL 39 Ca 0.14 0.56 0.02 0.00 -2.93 0.00 0.00 61.98 59.78 1fg9 s VAL 39 Cb -0.11 -3.89 -0.02 0.00 -1.53 0.00 0.00 36.38 30.82 1fg9 s VAL 39 CO 0.04 -0.08 0.53 -2.16 -3.33 0.00 0.00 175.10 170.09 1fg9 s PRO 40 N 2.34 3.30 0.44 1.54 0.04 -1.26 -4.75 135.00 136.66 1fg9 s PRO 40 Ca 0.19 -0.59 0.07 0.00 0.04 0.00 0.00 61.00 60.72 1fg9 s PRO 40 Cb -0.15 -2.71 -0.03 0.00 0.04 0.00 0.00 34.50 31.65 1fg9 s PRO 40 CO 0.12 0.08 0.26 0.14 0.04 0.00 0.00 177.00 177.64 1fg9 s VAL 41 N -2.28 2.23 0.03 -0.36 -7.23 -0.89 -4.62 120.40 107.27 1fg9 s VAL 41 Ca 0.42 -1.59 -0.03 0.00 -1.81 0.00 0.00 61.98 58.96 1fg9 s VAL 41 Cb -0.10 -2.82 -0.02 0.00 0.56 0.00 0.00 36.38 34.01 1fg9 s VAL 41 CO 0.34 0.00 0.05 -0.36 -0.31 0.00 0.00 175.10 174.82 1fg9 s PHE 42 N -2.61 0.24 -0.09 2.82 0.08 0.46 -1.68 117.98 117.19 1fg9 s PHE 42 Ca 0.40 -0.53 -0.01 0.00 0.12 0.00 0.00 56.93 56.91 1fg9 s PHE 42 Cb 0.01 -0.17 0.03 0.00 -0.57 0.00 0.00 43.02 42.32 1fg9 s PHE 42 CO 0.23 -0.30 -0.00 0.99 -0.10 0.00 0.00 175.22 176.04 1fg9 s THR 43 N -2.21 0.46 -0.20 0.64 2.01 -0.67 0.26 115.64 115.94 1fg9 s THR 43 Ca -0.09 0.01 -0.09 0.00 0.31 0.00 0.00 61.69 61.84 1fg9 s THR 43 Cb -0.04 -0.64 -0.04 0.00 0.01 0.00 0.00 72.50 71.79 1fg9 s THR 43 CO -0.03 0.23 0.10 -0.69 -0.69 0.00 0.00 174.62 173.53 1fg9 s VAL 44 N 1.93 5.01 -0.09 3.82 1.01 -0.30 -1.32 120.40 130.46 1fg9 s VAL 44 Ca 0.04 0.05 0.04 0.00 0.00 0.00 0.00 61.98 62.11 1fg9 s VAL 44 Cb -0.13 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1fg9 s VAL 44 CO -0.06 0.43 -0.21 -1.61 0.00 0.00 0.00 175.10 173.65 1fg9 s GLU 45 N 0.55 2.67 -0.11 2.72 2.02 0.21 -0.33 118.70 126.43 1fg9 s GLU 45 Ca 0.05 -0.78 -0.02 0.00 0.02 0.00 0.00 54.97 54.25 1fg9 s GLU 45 Cb -0.12 -2.07 -0.03 0.00 0.10 0.00 0.00 34.13 32.01 1fg9 s GLU 45 CO 0.01 0.17 -0.02 0.08 0.02 0.00 0.00 175.26 175.51 1fg9 s VAL 46 N 0.34 4.08 -0.11 2.63 1.01 0.24 -0.03 120.40 128.56 1fg9 s VAL 46 Ca -0.16 -0.32 -0.00 0.00 0.00 0.00 0.00 61.98 61.50 1fg9 s VAL 46 Cb -0.17 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.51 1fg9 s VAL 46 CO 0.07 0.56 -0.08 -0.75 0.00 0.00 0.00 175.10 174.90 1fg9 s LYS 47 N -0.44 1.56 -0.13 2.72 2.20 0.40 -0.69 119.74 125.35 1fg9 s LYS 47 Ca 0.07 -0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.41 1fg9 s LYS 47 Cb -0.12 -1.57 -0.01 0.00 -1.51 0.00 0.00 37.83 34.62 1fg9 s LYS 47 CO 0.02 -0.23 -0.14 0.54 -0.36 0.00 0.00 175.35 175.18 1fg9 s ASN 48 N 1.56 3.89 0.18 1.43 2.20 -1.26 0.28 114.94 123.22 1fg9 s ASN 48 Ca 0.02 -0.37 -0.22 0.00 -0.94 0.00 0.00 52.86 51.35 1fg9 s ASN 48 Cb -0.13 -1.59 -0.14 0.00 -2.00 0.00 0.00 41.25 37.39 1fg9 s ASN 48 CO -0.07 0.15 0.39 0.00 -2.94 0.00 0.00 177.10 174.63 1fg9 n TYR 49 N 3.64 -0.51 -1.60 1.54 9.36 0.11 -3.58 117.16 126.12 1fg9 n TYR 49 Ca -0.18 0.77 0.00 0.00 3.32 0.00 0.00 57.90 61.80 1fg9 n TYR 49 Cb 0.53 -1.58 0.00 0.00 -0.63 0.00 0.00 39.34 37.65 1fg9 n TYR 49 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1fg9 n GLY 50 N 1.65 0.52 3.79 2.98 0.00 -1.26 -4.91 105.19 107.95 1fg9 n GLY 50 Ca 0.14 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 1fg9 n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fg9 s VAL 51 N -2.68 4.95 0.16 1.61 1.01 -1.23 -4.99 120.40 119.23 1fg9 s VAL 51 Ca 0.00 1.05 -0.21 0.00 0.00 0.00 0.00 61.98 62.82 1fg9 s VAL 51 Cb 0.00 -3.83 0.06 0.00 0.00 0.00 0.00 36.38 32.61 1fg9 s VAL 51 CO 0.00 0.49 1.62 0.50 0.00 0.00 0.00 175.10 177.71 1fg9 h LYS 52 N 5.28 -0.21 0.00 2.72 3.64 -1.95 -3.43 116.57 122.62 1fg9 h LYS 52 Ca -0.47 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1fg9 h LYS 52 Cb 1.21 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1fg9 h LYS 52 CO 0.67 -0.14 0.00 0.09 -2.27 0.00 0.00 179.45 177.80 1fg9 n ASN 53 N -5.39 0.00 -1.39 4.20 4.13 -1.26 -5.08 115.26 110.46 1fg9 n ASN 53 Ca 0.01 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.23 1fg9 n ASN 53 Cb 0.31 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.55 1fg9 n ASN 53 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1fg9 n SER 54 N 0.00 -0.85 -4.89 6.41 2.88 -1.26 -5.11 113.62 110.80 1fg9 n SER 54 Ca 0.00 -1.61 -0.33 0.00 -1.33 0.00 0.00 58.87 55.60 1fg9 n SER 54 Cb 0.00 0.32 -0.05 0.00 -0.75 0.00 0.00 64.21 63.73 1fg9 n SER 54 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1fg9 s GLU 55 N 0.03 3.61 0.81 -1.46 0.41 -1.26 -5.10 118.70 115.75 1fg9 s GLU 55 Ca 0.02 -0.07 -0.06 0.00 -0.41 0.00 0.00 54.97 54.46 1fg9 s GLU 55 Cb 0.12 -2.99 0.16 0.00 -1.78 0.00 0.00 34.13 29.64 1fg9 s GLU 55 CO -0.03 0.57 1.11 -1.58 -0.49 0.00 0.00 175.26 174.84 1fg9 s TRP 56 N -1.45 1.52 -0.03 1.61 0.52 -1.26 -4.86 118.94 114.99 1fg9 s TRP 56 Ca 0.33 -0.10 0.01 0.00 0.02 0.00 0.00 56.10 56.37 1fg9 s TRP 56 Cb -0.13 -3.38 0.01 0.00 -1.15 0.00 0.00 33.47 28.82 1fg9 s TRP 56 CO 0.20 -2.07 -0.04 -1.50 0.02 0.00 0.00 176.95 173.56 1fg9 s ILE 57 N -3.41 0.47 -0.36 2.03 -1.16 0.13 -4.92 121.20 113.97 1fg9 s ILE 57 Ca 0.69 -0.14 -0.29 0.00 -0.51 0.00 0.00 60.65 60.40 1fg9 s ILE 57 Cb -0.04 -0.47 0.01 0.00 0.61 0.00 0.00 42.46 42.57 1fg9 s ILE 57 CO 0.47 0.18 1.21 -1.81 -2.81 0.00 0.00 174.94 172.18 1fg9 s ASP 58 N 0.56 6.71 -0.14 4.50 -0.00 -1.26 0.80 116.67 127.84 1fg9 s ASP 58 Ca -0.07 0.95 -0.20 0.00 -0.00 0.00 0.00 52.55 53.23 1fg9 s ASP 58 Cb -0.10 -2.54 -0.25 0.00 -0.00 0.00 0.00 42.92 40.03 1fg9 s ASP 58 CO -0.00 -1.09 0.50 0.00 -0.00 0.00 0.00 175.17 174.57 1fg9 h ALA 59 N 9.05 0.17 -2.88 5.23 0.00 -1.05 -3.46 119.26 126.31 1fg9 h ALA 59 Ca -0.24 -1.02 -0.28 0.00 0.00 0.00 0.00 54.91 53.37 1fg9 h ALA 59 Cb 1.08 0.47 -0.35 0.00 0.00 0.00 0.00 17.79 18.98 1fg9 h ALA 59 CO 1.06 0.64 -0.61 0.00 0.00 0.00 0.00 179.25 180.34 1fg9 s ILE 61 N 2.33 2.97 -1.46 0.00 2.07 -1.26 -1.15 121.20 124.70 1fg9 s ILE 61 Ca 0.04 -0.72 -0.07 0.00 -1.41 0.00 0.00 60.65 58.48 1fg9 s ILE 61 Cb -0.13 -2.20 0.01 0.00 0.13 0.00 0.00 42.46 40.27 1fg9 s ILE 61 CO -0.08 0.55 0.91 0.59 -1.91 0.00 0.00 174.94 175.00 1fg9 n ASN 62 N 3.02 -6.23 -4.80 4.50 3.02 -0.31 -4.95 115.26 109.52 1fg9 n ASN 62 Ca -0.18 -0.43 -0.35 0.00 -0.03 0.00 0.00 54.58 53.59 1fg9 n ASN 62 Cb 0.52 -4.96 -0.07 0.00 -0.61 0.00 0.00 39.78 34.67 1fg9 n ASN 62 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1fg9 s ILE 63 N -3.25 4.34 -0.11 2.41 -1.09 0.14 -4.50 121.20 119.14 1fg9 s ILE 63 Ca 0.46 1.60 0.17 0.00 -2.23 0.00 0.00 60.65 60.64 1fg9 s ILE 63 Cb -0.20 -3.84 -0.19 0.00 -1.58 0.00 0.00 42.46 36.64 1fg9 s ILE 63 CO 0.56 -0.00 0.64 -1.54 -1.23 0.00 0.00 174.94 173.37 1fg9 n SER 64 N 0.17 0.65 -2.73 3.58 3.41 -1.26 0.17 113.62 117.61 1fg9 n SER 64 Ca 0.03 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 1fg9 n SER 64 Cb 0.52 0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.86 1fg9 n SER 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fg9 n HIS 65 N -2.85 -1.98 -2.44 7.33 1.44 -1.26 -4.90 115.22 110.57 1fg9 n HIS 65 Ca -0.15 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.45 1fg9 n HIS 65 Cb 0.92 0.00 0.04 0.00 0.12 0.00 0.00 29.99 31.06 1fg9 n HIS 65 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1fg9 n HIS 66 N -1.34 1.93 -3.62 -1.40 8.25 -1.26 -4.86 115.22 112.91 1fg9 n HIS 66 Ca 0.00 -2.15 -0.10 0.00 -0.26 0.00 0.00 57.72 55.21 1fg9 n HIS 66 Cb 0.00 -0.28 -0.04 0.00 1.12 0.00 0.00 29.99 30.79 1fg9 n HIS 66 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1fg9 s TYR 67 N -3.65 -0.24 -0.26 4.41 1.13 -1.25 -3.30 117.35 114.18 1fg9 s TYR 67 Ca 0.38 -0.06 -0.06 0.00 -1.41 0.00 0.00 57.07 55.92 1fg9 s TYR 67 Cb 0.36 0.37 0.13 0.00 -1.10 0.00 0.00 41.96 41.72 1fg9 s TYR 67 CO -0.00 -0.80 0.53 0.00 -2.51 0.00 0.00 175.55 172.77 1fg9 s ASN 69 N 2.76 6.20 -0.09 0.00 3.84 -1.26 0.37 114.94 126.76 1fg9 s ASN 69 Ca 0.04 -0.41 0.08 0.00 0.21 0.00 0.00 52.86 52.77 1fg9 s ASN 69 Cb -0.13 -2.55 0.39 0.00 -0.55 0.00 0.00 41.25 38.41 1fg9 s ASN 69 CO -0.17 -1.76 1.15 2.30 -2.79 0.00 0.00 177.10 175.83 1fg9 n ILE 70 N 6.38 1.17 -0.49 -5.21 -5.35 -0.82 -4.64 119.36 110.40 1fg9 n ILE 70 Ca 0.03 -0.65 0.41 0.00 -0.27 0.00 0.00 62.75 62.28 1fg9 n ILE 70 Cb 0.49 -0.25 0.68 0.00 -1.74 0.00 0.00 39.64 38.82 1fg9 n ILE 70 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1fg9 n SER 71 N 0.37 0.19 -1.90 7.28 7.64 -1.26 -0.65 113.62 125.29 1fg9 n SER 71 Ca 0.13 1.35 -0.18 0.00 1.01 0.00 0.00 58.87 61.18 1fg9 n SER 71 Cb 0.63 -0.66 0.05 0.00 -1.01 0.00 0.00 64.21 63.22 1fg9 n SER 71 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1fg9 n ASP 72 N -4.64 6.15 0.00 6.43 9.92 -1.26 -2.92 116.55 130.23 1fg9 n ASP 72 Ca 0.40 -3.10 0.00 0.00 -0.53 0.00 0.00 54.79 51.56 1fg9 n ASP 72 Cb 1.59 -1.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.07 1fg9 n ASP 72 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1fg9 n HIS 73 N 0.13 0.00 -2.95 1.24 8.25 0.17 -4.98 115.22 117.08 1fg9 n HIS 73 Ca 0.33 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.35 1fg9 n HIS 73 Cb 0.66 0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.75 1fg9 n HIS 73 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1fg9 s VAL 74 N 0.00 4.77 0.00 1.59 1.01 -1.15 -4.88 120.40 121.74 1fg9 s VAL 74 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 61.98 60.38 1fg9 s VAL 74 Cb 0.00 -4.76 0.00 0.00 0.00 0.00 0.00 36.38 31.62 1fg9 s VAL 74 CO 0.00 -1.48 0.00 0.61 0.00 0.00 0.00 175.10 174.23 1fg9 n GLY 75 N 5.40 -0.18 3.67 4.51 0.00 -1.26 -4.78 105.19 112.56 1fg9 n GLY 75 Ca 0.22 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1fg9 n GLY 75 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fg9 s ASP 76 N -1.25 6.59 0.00 1.61 -1.08 -1.26 -4.80 116.67 116.48 1fg9 s ASP 76 Ca 0.00 2.44 0.00 0.00 -0.52 0.00 0.00 52.55 54.47 1fg9 s ASP 76 Cb 0.00 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.91 1fg9 s ASP 76 CO 0.00 -0.93 0.09 -0.81 0.52 0.00 0.00 175.17 174.03 1fg9 n PRO 77 N 6.47 0.15 0.00 4.34 -0.04 -1.26 -0.87 135.00 143.79 1fg9 n PRO 77 Ca 0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 1fg9 n PRO 77 Cb 0.41 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 1fg9 n PRO 77 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1fg9 n SER 78 N 0.50 1.19 -4.44 3.54 7.64 -1.26 0.16 113.62 120.95 1fg9 n SER 78 Ca 0.00 -0.23 -0.43 0.00 1.01 0.00 0.00 58.87 59.22 1fg9 n SER 78 Cb 0.04 0.69 -0.04 0.00 -1.01 0.00 0.00 64.21 63.89 1fg9 n SER 78 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1fg9 s ASN 79 N -0.93 6.19 0.10 6.43 -0.87 -0.05 -4.54 114.94 121.28 1fg9 s ASN 79 Ca 0.00 -1.01 -0.30 0.00 -1.57 0.00 0.00 52.86 49.98 1fg9 s ASN 79 Cb 0.00 -2.39 -0.16 0.00 -0.02 0.00 0.00 41.25 38.67 1fg9 s ASN 79 CO 0.00 -1.33 0.68 -1.20 -2.57 0.00 0.00 177.10 172.68 1fg9 n SER 80 N 7.34 -0.64 -4.19 -1.22 7.64 -1.26 -4.48 113.62 116.81 1fg9 n SER 80 Ca -0.05 1.03 -0.14 0.00 1.01 0.00 0.00 58.87 60.72 1fg9 n SER 80 Cb 0.45 -0.84 -0.11 0.00 -1.01 0.00 0.00 64.21 62.70 1fg9 n SER 80 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1fg9 s LEU 81 N 1.53 2.43 -0.04 -3.43 0.05 -1.26 0.05 118.68 118.00 1fg9 s LEU 81 Ca 0.68 -0.85 0.02 0.00 0.05 0.00 0.00 54.13 54.03 1fg9 s LEU 81 Cb -0.97 -0.31 0.01 0.00 -2.05 0.00 0.00 46.19 42.87 1fg9 s LEU 81 CO 0.51 -0.28 -0.10 0.26 -0.55 0.00 0.00 176.35 176.19 1fg9 s TRP 82 N -2.63 1.17 0.08 3.48 0.51 0.14 -4.97 118.94 116.72 1fg9 s TRP 82 Ca 0.08 -0.35 0.10 0.00 -2.12 0.00 0.00 56.10 53.80 1fg9 s TRP 82 Cb -0.02 -0.85 -0.03 0.00 -0.81 0.00 0.00 33.47 31.76 1fg9 s TRP 82 CO -0.00 -0.17 -0.26 0.54 -0.51 0.00 0.00 176.95 176.55 1fg9 s VAL 83 N 0.42 2.11 0.11 4.03 0.11 -1.26 -0.45 120.40 125.47 1fg9 s VAL 83 Ca -0.08 -1.51 0.07 0.00 -2.93 0.00 0.00 61.98 57.53 1fg9 s VAL 83 Cb -0.12 -1.84 -0.04 0.00 -1.53 0.00 0.00 36.38 32.86 1fg9 s VAL 83 CO 0.02 0.23 -0.16 0.00 -3.33 0.00 0.00 175.10 171.86 1fg9 s ARG 84 N -1.55 1.04 0.04 1.54 1.70 0.96 -4.95 118.95 117.74 1fg9 s ARG 84 Ca 0.12 -1.19 0.00 0.00 -0.47 0.00 0.00 55.73 54.19 1fg9 s ARG 84 Cb -0.10 -1.06 -0.03 0.00 -0.57 0.00 0.00 34.95 33.19 1fg9 s ARG 84 CO 0.03 0.22 -0.04 0.54 -1.08 0.00 0.00 175.30 174.98 1fg9 s VAL 85 N -1.74 0.28 0.24 4.99 0.11 -1.26 0.67 120.40 123.70 1fg9 s VAL 85 Ca 0.07 -1.37 0.01 0.00 -2.93 0.00 0.00 61.98 57.76 1fg9 s VAL 85 Cb -0.07 -0.92 -0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1fg9 s VAL 85 CO 0.04 -0.70 0.30 2.29 -3.33 0.00 0.00 175.10 173.69 1fg9 n LYS 86 N 0.86 0.43 -3.68 1.54 2.85 -0.44 -4.74 118.16 114.99 1fg9 n LYS 86 Ca -0.19 -2.12 -0.16 0.00 -1.05 0.00 0.00 58.31 54.79 1fg9 n LYS 86 Cb 0.58 1.93 -0.05 0.00 -0.65 0.00 0.00 35.03 36.83 1fg9 n LYS 86 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1fg9 n ALA 87 N -1.37 0.47 -3.66 0.58 0.00 -1.26 -1.66 120.51 113.61 1fg9 n ALA 87 Ca -0.09 -1.45 -0.06 0.00 0.00 0.00 0.00 53.44 51.84 1fg9 n ALA 87 Cb 0.42 1.07 -0.07 0.00 0.00 0.00 0.00 19.45 20.87 1fg9 n ALA 87 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1fg9 s ARG 88 N -3.05 0.48 -0.41 0.00 3.52 -0.68 -2.82 118.95 115.98 1fg9 s ARG 88 Ca 0.22 1.19 -0.05 0.00 -0.13 0.00 0.00 55.73 56.96 1fg9 s ARG 88 Cb 0.01 0.47 0.11 0.00 -1.56 0.00 0.00 34.95 33.98 1fg9 s ARG 88 CO 0.15 -0.21 0.22 0.08 -0.81 0.00 0.00 175.30 174.74 1fg9 s VAL 89 N 2.45 3.52 0.00 7.11 1.01 0.47 -2.10 120.40 132.86 1fg9 s VAL 89 Ca -0.05 -1.91 0.00 0.00 0.00 0.00 0.00 61.98 60.02 1fg9 s VAL 89 Cb -0.11 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.92 1fg9 s VAL 89 CO -0.16 -0.66 0.00 0.61 0.00 0.00 0.00 175.10 174.89 1fg9 n GLY 90 N 4.68 1.37 0.88 4.51 0.00 -1.26 0.03 105.19 115.40 1fg9 n GLY 90 Ca -0.05 0.35 0.01 0.00 0.00 0.00 0.00 46.02 46.34 1fg9 n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fg9 n GLN 91 N 0.00 0.00 -3.82 1.61 0.00 -1.26 -5.00 117.38 108.91 1fg9 n GLN 91 Ca 0.00 -1.25 -0.33 0.00 0.00 0.00 0.00 57.00 55.42 1fg9 n GLN 91 Cb 0.00 -0.21 -0.11 0.00 0.00 0.00 0.00 30.24 29.92 1fg9 n GLN 91 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1fg9 s LYS 92 N 0.00 2.43 0.96 2.61 -0.14 0.10 -5.08 119.74 120.62 1fg9 s LYS 92 Ca 0.12 -2.77 -0.16 0.00 -1.36 0.00 0.00 55.97 51.80 1fg9 s LYS 92 Cb 0.13 -3.57 0.23 0.00 -1.68 0.00 0.00 37.83 32.94 1fg9 s LYS 92 CO -0.06 -1.18 1.08 0.39 -0.76 0.00 0.00 175.35 174.82 1fg9 n GLU 93 N 3.00 -1.91 -4.38 1.68 1.02 -1.26 -0.39 120.64 118.40 1fg9 n GLU 93 Ca 0.10 -1.69 -0.23 0.00 -0.02 0.00 0.00 57.16 55.32 1fg9 n GLU 93 Cb 0.35 -1.31 -0.13 0.00 -0.02 0.00 0.00 31.44 30.33 1fg9 n GLU 93 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1fg9 s SER 94 N -4.76 2.25 0.00 1.62 0.15 -1.13 -4.89 113.70 106.95 1fg9 s SER 94 Ca 0.65 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.70 1fg9 s SER 94 Cb -0.04 -0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.13 1fg9 s SER 94 CO 0.47 0.06 0.00 0.00 1.20 0.00 0.00 173.24 174.98 1fg9 n ALA 95 N 1.46 0.00 -3.15 5.45 0.00 -1.26 -4.75 120.51 118.27 1fg9 n ALA 95 Ca -0.19 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.29 1fg9 n ALA 95 Cb 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.99 1fg9 n ALA 95 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1fg9 s SER 99 N -1.77 -1.36 -0.26 0.00 0.15 -1.26 -5.03 113.70 104.16 1fg9 s SER 99 Ca 0.00 0.24 -0.28 0.00 0.70 0.00 0.00 55.95 56.62 1fg9 s SER 99 Cb 0.00 1.90 -0.05 0.00 -1.71 0.00 0.00 66.02 66.16 1fg9 s SER 99 CO 0.00 -0.25 2.25 -1.61 1.20 0.00 0.00 173.24 174.83 1fg9 s GLU 100 N 2.86 2.96 0.38 5.44 2.02 -1.26 -4.89 118.70 126.22 1fg9 s GLU 100 Ca 0.14 1.93 -0.25 0.00 0.02 0.00 0.00 54.97 56.81 1fg9 s GLU 100 Cb -0.09 -4.41 -0.09 0.00 0.10 0.00 0.00 34.13 29.64 1fg9 s GLU 100 CO -0.24 -2.29 1.06 -2.00 0.02 0.00 0.00 175.26 171.80 1fg9 s GLU 101 N 6.65 4.22 -0.30 1.61 2.12 -1.26 -5.01 118.70 126.73 1fg9 s GLU 101 Ca 1.00 1.56 -0.02 0.00 0.36 0.00 0.00 54.97 57.87 1fg9 s GLU 101 Cb -0.30 -2.62 0.19 0.00 0.26 0.00 0.00 34.13 31.65 1fg9 s GLU 101 CO 0.34 -0.11 0.66 0.12 -0.54 0.00 0.00 175.26 175.73 1fg9 s PHE 102 N -1.59 -1.47 0.14 5.30 5.99 -1.26 -5.08 117.98 120.01 1fg9 s PHE 102 Ca 0.56 1.53 -0.21 0.00 0.00 0.00 0.00 56.93 58.81 1fg9 s PHE 102 Cb -0.24 0.50 -0.07 0.00 0.00 0.00 0.00 43.02 43.21 1fg9 s PHE 102 CO 0.30 -0.81 0.68 0.00 -0.00 0.00 0.00 175.22 175.39 1fg9 s ALA 103 N 2.87 3.50 0.31 11.12 0.00 -1.26 -4.81 121.76 133.49 1fg9 s ALA 103 Ca 0.18 0.18 0.03 0.00 0.00 0.00 0.00 51.96 52.34 1fg9 s ALA 103 Cb -0.14 -2.79 0.60 0.00 0.00 0.00 0.00 23.12 20.79 1fg9 s ALA 103 CO -0.20 0.35 1.88 0.28 0.00 0.00 0.00 175.76 178.07 1fg9 h VAL 104 N 3.26 0.97 0.11 0.00 2.07 0.12 -0.02 116.25 122.75 1fg9 h VAL 104 Ca -0.48 -0.32 -0.37 0.00 0.82 0.00 0.00 66.70 66.35 1fg9 h VAL 104 Cb 1.21 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1fg9 h VAL 104 CO 0.65 0.17 -2.05 0.00 0.02 0.00 0.00 177.57 176.36 1fg9 h ARG 106 N 0.06 -0.20 0.00 0.00 2.43 -1.65 -3.48 114.38 111.54 1fg9 h ARG 106 Ca -0.44 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1fg9 h ARG 106 Cb 2.02 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.61 1fg9 h ARG 106 CO 0.07 0.18 0.00 -0.25 -1.51 0.00 0.00 179.97 178.46 1fg9 n ASP 107 N -4.99 0.00 0.00 -3.80 8.00 -0.04 -4.79 116.55 110.92 1fg9 n ASP 107 Ca -0.09 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.55 1fg9 n ASP 107 Cb 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 1fg9 n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fg9 n GLY 108 N 5.00 2.37 2.81 0.44 0.00 -1.26 -4.73 105.19 109.81 1fg9 n GLY 108 Ca 0.00 -0.30 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 1fg9 n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fg9 s LYS 109 N 0.00 0.13 -0.11 1.61 1.02 -1.26 -4.92 119.74 116.20 1fg9 s LYS 109 Ca 0.00 0.10 -0.04 0.00 0.02 0.00 0.00 55.97 56.05 1fg9 s LYS 109 Cb 0.00 -0.33 -0.04 0.00 -0.52 0.00 0.00 37.83 36.95 1fg9 s LYS 109 CO 0.00 -0.12 0.03 0.96 -0.92 0.00 0.00 175.35 175.30 1fg9 s ILE 110 N 0.87 4.58 1.02 2.17 -4.36 -1.26 -4.17 121.20 120.05 1fg9 s ILE 110 Ca -0.08 -0.13 -0.24 0.00 -0.26 0.00 0.00 60.65 59.94 1fg9 s ILE 110 Cb -0.11 -2.97 -0.09 0.00 1.25 0.00 0.00 42.46 40.54 1fg9 s ILE 110 CO -0.02 0.57 -0.98 0.61 0.24 0.00 0.00 174.94 175.36 1fg9 n GLY 111 N 2.47 -2.76 3.86 6.27 0.00 -1.26 -1.31 105.19 112.46 1fg9 n GLY 111 Ca -0.18 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1fg9 n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fg9 s PRO 112 N -2.48 2.59 0.00 1.61 0.04 -1.18 -3.33 135.00 132.24 1fg9 s PRO 112 Ca 0.41 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1fg9 s PRO 112 Cb 0.03 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1fg9 s PRO 112 CO 0.63 -1.24 0.00 -0.35 0.04 0.00 0.00 177.00 176.08 1fg9 n PRO 113 N -3.15 -0.84 -3.94 0.56 -0.04 -1.26 -4.67 135.00 121.65 1fg9 n PRO 113 Ca 0.07 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.22 1fg9 n PRO 113 Cb 0.57 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.88 1fg9 n PRO 113 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1fg9 s LYS 114 N -2.66 1.39 0.42 0.54 1.02 -0.23 -4.82 119.74 115.40 1fg9 s LYS 114 Ca 0.00 -1.50 -0.22 0.00 0.02 0.00 0.00 55.97 54.28 1fg9 s LYS 114 Cb 0.00 -2.79 -0.10 0.00 -0.52 0.00 0.00 37.83 34.41 1fg9 s LYS 114 CO 0.00 -0.86 0.97 -0.51 -0.92 0.00 0.00 175.35 174.03 1fg9 s LEU 115 N 1.17 3.99 -0.13 3.17 1.43 -1.26 -2.32 118.68 124.72 1fg9 s LEU 115 Ca 0.06 1.77 -0.11 0.00 -1.03 0.00 0.00 54.13 54.82 1fg9 s LEU 115 Cb -0.19 -4.46 0.04 0.00 0.03 0.00 0.00 46.19 41.61 1fg9 s LEU 115 CO -0.12 -0.40 0.34 -0.62 0.23 0.00 0.00 176.35 175.78 1fg9 s ASP 116 N -2.04 -0.36 0.12 2.29 -1.08 -1.03 -5.01 116.67 109.55 1fg9 s ASP 116 Ca 0.61 0.69 0.06 0.00 -0.52 0.00 0.00 52.55 53.38 1fg9 s ASP 116 Cb -0.12 0.67 -0.04 0.00 -1.46 0.00 0.00 42.92 41.98 1fg9 s ASP 116 CO 0.16 -0.13 -0.13 -0.51 0.52 0.00 0.00 175.17 175.08 1fg9 s ILE 117 N 0.37 1.27 0.00 4.11 2.07 -1.26 -1.99 121.20 125.76 1fg9 s ILE 117 Ca -0.02 -1.73 0.00 0.00 -1.41 0.00 0.00 60.65 57.50 1fg9 s ILE 117 Cb -0.03 -1.52 0.00 0.00 0.13 0.00 0.00 42.46 41.03 1fg9 s ILE 117 CO -0.01 -0.45 0.00 -2.11 -1.91 0.00 0.00 174.94 170.45 1fg9 n ARG 118 N 0.49 0.00 -3.66 3.50 1.85 -1.14 -5.02 116.66 112.69 1fg9 n ARG 118 Ca -0.15 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.55 1fg9 n ARG 118 Cb 0.57 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.91 1fg9 n ARG 118 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1fg9 s LYS 119 N 1.73 0.79 -0.10 2.89 1.02 -1.26 -3.78 119.74 121.04 1fg9 s LYS 119 Ca 0.00 0.19 -0.08 0.00 0.02 0.00 0.00 55.97 56.09 1fg9 s LYS 119 Cb 0.00 0.37 0.03 0.00 -0.52 0.00 0.00 37.83 37.71 1fg9 s LYS 119 CO 0.00 -0.21 0.25 -1.21 -0.92 0.00 0.00 175.35 173.26 1fg9 s GLU 120 N -0.90 0.28 0.04 1.68 2.02 -0.90 -4.95 118.70 115.97 1fg9 s GLU 120 Ca -0.09 0.38 -0.18 0.00 0.02 0.00 0.00 54.97 55.10 1fg9 s GLU 120 Cb -0.03 0.10 -0.10 0.00 0.10 0.00 0.00 34.13 34.20 1fg9 s GLU 120 CO 0.05 -0.06 0.44 -0.85 0.02 0.00 0.00 175.26 174.87 1fg9 n GLU 121 N 3.16 0.00 -0.09 1.61 0.28 -1.26 -0.76 120.64 123.58 1fg9 n GLU 121 Ca -0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.85 1fg9 n GLU 121 Cb 0.57 -0.67 0.00 0.00 1.43 0.00 0.00 31.44 32.77 1fg9 n GLU 121 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1fg9 n LYS 122 N 0.67 0.00 -3.79 3.44 4.81 -1.26 -4.88 118.16 117.15 1fg9 n LYS 122 Ca 0.10 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.36 1fg9 n LYS 122 Cb 0.07 -2.93 -0.17 0.00 0.02 0.00 0.00 35.03 32.02 1fg9 n LYS 122 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 1fg9 s GLN 123 N -0.18 0.12 0.09 1.64 -2.07 0.06 -1.90 119.66 117.42 1fg9 s GLN 123 Ca 0.00 0.20 -0.30 0.00 -1.82 0.00 0.00 55.36 53.44 1fg9 s GLN 123 Cb 0.00 -0.47 -0.06 0.00 -1.09 0.00 0.00 33.01 31.39 1fg9 s GLN 123 CO 0.00 -0.22 1.07 0.42 -1.32 0.00 0.00 175.29 175.24 1fg9 s ILE 124 N 1.48 4.28 -0.09 3.63 1.01 -0.63 -2.12 121.20 128.76 1fg9 s ILE 124 Ca -0.04 1.77 -0.00 0.00 0.00 0.00 0.00 60.65 62.38 1fg9 s ILE 124 Cb -0.13 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.18 1fg9 s ILE 124 CO -0.03 0.21 -0.06 -0.04 0.00 0.00 0.00 174.94 175.02 1fg9 s MET 125 N 0.42 2.97 -0.14 2.79 -1.94 -1.25 -1.09 119.30 121.06 1fg9 s MET 125 Ca 0.52 -0.54 0.01 0.00 -1.71 0.00 0.00 55.69 53.98 1fg9 s MET 125 Cb -0.26 -2.67 0.02 0.00 2.01 0.00 0.00 34.83 33.93 1fg9 s MET 125 CO 0.31 0.56 -0.18 0.42 -0.01 0.00 0.00 175.02 176.12 1fg9 s ILE 126 N -0.53 1.80 -0.08 2.53 1.01 -0.97 -2.88 121.20 122.07 1fg9 s ILE 126 Ca 0.08 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.90 1fg9 s ILE 126 Cb -0.12 -1.63 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 1fg9 s ILE 126 CO 0.02 0.50 0.06 -1.81 0.00 0.00 0.00 174.94 173.71 1fg9 s ASP 127 N 1.15 5.70 -0.40 3.58 1.01 -0.84 -2.12 116.67 124.75 1fg9 s ASP 127 Ca -0.01 0.25 0.01 0.00 0.71 0.00 0.00 52.55 53.51 1fg9 s ASP 127 Cb -0.14 -1.70 0.13 0.00 1.01 0.00 0.00 42.92 42.22 1fg9 s ASP 127 CO -0.07 0.36 0.20 -0.63 0.21 0.00 0.00 175.17 175.25 1fg9 s ILE 128 N -1.00 1.15 0.13 0.77 1.01 -0.87 -2.48 121.20 119.91 1fg9 s ILE 128 Ca 0.16 -2.20 -0.31 0.00 0.00 0.00 0.00 60.65 58.30 1fg9 s ILE 128 Cb -0.12 -1.82 -0.08 0.00 0.01 0.00 0.00 42.46 40.46 1fg9 s ILE 128 CO 0.05 -0.86 1.37 -0.36 0.00 0.00 0.00 174.94 175.14 1fg9 s PHE 129 N 0.72 3.26 0.68 3.97 0.40 -0.98 -2.85 117.98 123.18 1fg9 s PHE 129 Ca 0.16 1.02 -0.17 0.00 -0.60 0.00 0.00 56.93 57.34 1fg9 s PHE 129 Cb -0.23 -3.65 0.01 0.00 0.51 0.00 0.00 43.02 39.66 1fg9 s PHE 129 CO -0.05 -2.24 1.27 -1.01 0.70 0.00 0.00 175.22 173.89 1fg9 s HIS 130 N 0.94 2.03 0.25 0.36 3.76 -0.66 -1.07 115.29 120.91 1fg9 s HIS 130 Ca 0.63 1.53 -0.30 0.00 -0.15 0.00 0.00 55.06 56.77 1fg9 s HIS 130 Cb -0.36 -3.63 -0.14 0.00 1.11 0.00 0.00 32.58 29.56 1fg9 s HIS 130 CO 0.31 -2.86 1.27 -2.30 -0.85 0.00 0.00 174.74 170.32 1fg9 n PRO 131 N -2.23 1.78 -1.52 8.40 -0.02 -1.26 -4.65 135.00 135.49 1fg9 n PRO 131 Ca 0.15 0.63 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 1fg9 n PRO 131 Cb 0.49 -2.19 -0.10 0.00 -0.02 0.00 0.00 33.50 31.68 1fg9 n PRO 131 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1fg9 n SER 132 N 1.72 1.08 -4.42 2.55 2.88 -1.26 -5.08 113.62 111.09 1fg9 n SER 132 Ca 0.11 -1.90 -0.23 0.00 -1.33 0.00 0.00 58.87 55.52 1fg9 n SER 132 Cb 0.31 -1.55 -0.10 0.00 -0.75 0.00 0.00 64.21 62.12 1fg9 n SER 132 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 1fg9 s PRO 146 N 8.34 1.72 -1.44 -1.46 0.02 -1.26 -5.25 135.00 135.67 1fg9 s PRO 146 Ca 0.83 -1.98 -0.11 0.00 0.02 0.00 0.00 61.00 59.77 1fg9 s PRO 146 Cb -0.13 -0.89 0.07 0.00 0.02 0.00 0.00 34.50 33.58 1fg9 s PRO 146 CO 0.16 -0.23 0.72 0.39 -0.33 0.00 0.00 177.00 177.70 1fg9 n GLU 147 N -0.75 -4.48 -3.47 5.54 -0.58 -1.26 -4.99 120.64 110.65 1fg9 n GLU 147 Ca -0.03 0.59 -0.22 0.00 -0.42 0.00 0.00 57.16 57.08 1fg9 n GLU 147 Cb 0.66 -5.40 -0.01 0.00 -0.57 0.00 0.00 31.44 26.13 1fg9 n GLU 147 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 1fg9 s THR 148 N -3.13 4.68 -0.52 2.62 -1.32 -1.26 -5.00 115.64 111.72 1fg9 s THR 148 Ca 0.50 -0.73 0.24 0.00 -1.21 0.00 0.00 61.69 60.49 1fg9 s THR 148 Cb -0.25 -3.68 0.09 0.00 -1.51 0.00 0.00 72.50 67.15 1fg9 s THR 148 CO 0.62 -0.36 1.32 0.71 -2.21 0.00 0.00 174.62 174.70 1fg9 h THR 149 N 0.82 0.00 -0.58 5.08 1.35 -2.01 -3.41 112.91 114.15 1fg9 h THR 149 Ca -0.49 -0.69 -0.60 0.00 -0.55 0.00 0.00 66.41 64.08 1fg9 h THR 149 Cb 1.24 1.33 -0.06 0.00 -1.73 0.00 0.00 68.15 68.93 1fg9 h THR 149 CO 0.58 0.00 2.10 0.00 -0.25 0.00 0.00 175.52 177.96 1fg9 s TYR 151 N 5.65 1.45 -0.16 0.00 -0.85 -1.26 -5.01 117.35 117.17 1fg9 s TYR 151 Ca 0.56 -1.50 -0.24 0.00 -0.52 0.00 0.00 57.07 55.37 1fg9 s TYR 151 Cb 0.05 -0.56 -0.02 0.00 0.38 0.00 0.00 41.96 41.82 1fg9 s TYR 151 CO 0.07 -0.85 0.78 0.42 -1.52 0.00 0.00 175.55 174.45 1fg9 s ILE 152 N -3.61 4.93 -0.23 -3.49 -1.09 -1.26 -2.06 121.20 114.38 1fg9 s ILE 152 Ca 0.38 1.52 -0.17 0.00 -2.23 0.00 0.00 60.65 60.15 1fg9 s ILE 152 Cb 0.03 -4.09 -0.13 0.00 -1.58 0.00 0.00 42.46 36.69 1fg9 s ILE 152 CO 0.22 0.07 -0.14 -2.11 -1.23 0.00 0.00 174.94 171.75 1fg9 n ARG 153 N 5.05 0.56 -4.60 2.79 1.85 0.06 -4.59 116.66 117.78 1fg9 n ARG 153 Ca 0.03 0.39 -0.28 0.00 -1.00 0.00 0.00 57.85 56.99 1fg9 n ARG 153 Cb 0.49 -1.59 -0.17 0.00 -1.05 0.00 0.00 32.46 30.14 1fg9 n ARG 153 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 1fg9 s VAL 154 N -2.47 1.44 -0.15 8.89 -7.23 -1.24 -0.84 120.40 118.81 1fg9 s VAL 154 Ca -0.33 -0.63 -0.15 0.00 -1.81 0.00 0.00 61.98 59.06 1fg9 s VAL 154 Cb 0.10 -1.31 -0.05 0.00 0.56 0.00 0.00 36.38 35.68 1fg9 s VAL 154 CO 0.50 0.43 0.34 -0.31 -0.31 0.00 0.00 175.10 175.75 1fg9 s TYR 155 N 0.80 3.48 -0.63 2.82 2.02 -0.04 -1.46 117.35 124.34 1fg9 s TYR 155 Ca -0.11 0.67 -0.17 0.00 -0.37 0.00 0.00 57.07 57.09 1fg9 s TYR 155 Cb -0.16 -2.39 0.13 0.00 -0.40 0.00 0.00 41.96 39.14 1fg9 s TYR 155 CO 0.02 0.23 0.66 -0.80 -1.57 0.00 0.00 175.55 174.08 1fg9 s ASN 156 N 0.49 6.30 -0.25 2.29 0.01 -0.15 -1.58 114.94 122.04 1fg9 s ASN 156 Ca 0.19 -1.79 -0.24 0.00 -0.71 0.00 0.00 52.86 50.31 1fg9 s ASN 156 Cb -0.13 -2.26 -0.01 0.00 0.41 0.00 0.00 41.25 39.26 1fg9 s ASN 156 CO 0.05 -0.94 0.79 -0.69 -1.51 0.00 0.00 177.10 174.81 1fg9 s VAL 157 N 1.90 4.86 -0.09 1.60 1.01 -0.83 -2.31 120.40 126.55 1fg9 s VAL 157 Ca 0.10 1.44 -0.03 0.00 0.00 0.00 0.00 61.98 63.49 1fg9 s VAL 157 Cb -0.23 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 1fg9 s VAL 157 CO 0.02 -0.08 0.05 -0.31 0.00 0.00 0.00 175.10 174.78 1fg9 s TYR 158 N 2.80 3.31 -0.07 5.22 1.51 -0.65 -0.26 117.35 129.21 1fg9 s TYR 158 Ca 0.33 0.30 0.01 0.00 -1.01 0.00 0.00 57.07 56.70 1fg9 s TYR 158 Cb -0.15 -1.83 0.02 0.00 -0.11 0.00 0.00 41.96 39.89 1fg9 s TYR 158 CO 0.08 0.56 -0.09 0.08 -1.11 0.00 0.00 175.55 175.07 1fg9 s VAL 159 N -0.97 0.97 0.10 0.71 1.01 -0.38 -2.66 120.40 119.19 1fg9 s VAL 159 Ca 0.15 -0.35 0.08 0.00 0.00 0.00 0.00 61.98 61.87 1fg9 s VAL 159 Cb -0.12 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 1fg9 s VAL 159 CO 0.04 0.33 -0.17 -0.60 0.00 0.00 0.00 175.10 174.70 1fg9 s ARG 160 N 0.99 1.88 0.11 2.72 3.52 -0.31 -0.70 118.95 127.15 1fg9 s ARG 160 Ca -0.09 -1.12 -0.04 0.00 -0.13 0.00 0.00 55.73 54.35 1fg9 s ARG 160 Cb -0.15 -2.16 0.01 0.00 -1.56 0.00 0.00 34.95 31.10 1fg9 s ARG 160 CO 0.00 0.49 0.20 0.00 -0.81 0.00 0.00 175.30 175.19 1fg9 n MET 161 N 0.89 0.29 0.00 5.12 0.00 -1.16 0.10 117.12 122.35 1fg9 n MET 161 Ca -0.15 -0.62 0.00 0.00 0.00 0.00 0.00 57.70 56.93 1fg9 n MET 161 Cb 0.53 0.75 0.00 0.00 0.00 0.00 0.00 33.22 34.49 1fg9 n MET 161 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1fg9 n ASN 162 N -1.25 0.00 -2.87 3.17 2.85 -1.26 -2.62 115.26 113.27 1fg9 n ASN 162 Ca -0.02 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.33 1fg9 n ASN 162 Cb 0.16 0.00 0.05 0.00 1.24 0.00 0.00 39.78 41.23 1fg9 n ASN 162 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1fg9 n GLY 163 N -0.73 1.57 3.15 8.20 0.00 -1.26 -5.10 105.19 111.03 1fg9 n GLY 163 Ca 0.00 -0.53 0.05 0.00 0.00 0.00 0.00 46.02 45.54 1fg9 n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fg9 s SER 164 N -1.65 -0.35 0.27 1.61 1.04 -1.08 -5.12 113.70 108.42 1fg9 s SER 164 Ca 0.28 0.23 -0.24 0.00 0.48 0.00 0.00 55.95 56.70 1fg9 s SER 164 Cb 0.31 1.30 -0.09 0.00 0.10 0.00 0.00 66.02 67.64 1fg9 s SER 164 CO -0.06 -0.07 0.85 -1.83 0.98 0.00 0.00 173.24 173.11 1fg9 s GLU 165 N 2.94 4.47 -0.24 4.02 -1.05 -1.26 -3.01 118.70 124.57 1fg9 s GLU 165 Ca -0.04 1.15 -0.03 0.00 -0.15 0.00 0.00 54.97 55.90 1fg9 s GLU 165 Cb -0.10 -2.89 0.13 0.00 -0.44 0.00 0.00 34.13 30.83 1fg9 s GLU 165 CO -0.10 0.36 0.36 -1.50 0.95 0.00 0.00 175.26 175.32 1fg9 s ILE 166 N -1.52 -0.57 1.00 1.83 2.07 0.12 -4.95 121.20 119.18 1fg9 s ILE 166 Ca 0.46 -0.06 -0.14 0.00 -1.41 0.00 0.00 60.65 59.50 1fg9 s ILE 166 Cb -0.19 -0.79 0.19 0.00 0.13 0.00 0.00 42.46 41.81 1fg9 s ILE 166 CO 0.23 -0.12 1.13 -1.58 -1.91 0.00 0.00 174.94 172.68 1fg9 s GLN 167 N 2.52 0.37 -0.21 3.50 0.74 -1.26 -1.25 119.66 124.07 1fg9 s GLN 167 Ca 0.11 0.26 -0.18 0.00 0.05 0.00 0.00 55.36 55.61 1fg9 s GLN 167 Cb -0.15 -1.75 0.06 0.00 1.10 0.00 0.00 33.01 32.26 1fg9 s GLN 167 CO -0.15 -2.71 0.55 0.71 -0.55 0.00 0.00 175.29 173.14 1fg9 s TYR 168 N -3.14 -0.64 -0.10 1.67 2.02 0.64 -4.89 117.35 112.91 1fg9 s TYR 168 Ca 0.66 1.51 -0.06 0.00 -0.37 0.00 0.00 57.07 58.81 1fg9 s TYR 168 Cb -0.15 0.24 -0.04 0.00 -0.40 0.00 0.00 41.96 41.61 1fg9 s TYR 168 CO 0.55 -0.31 0.12 0.15 -1.57 0.00 0.00 175.55 174.49 1fg9 s LYS 169 N 0.47 3.35 -0.06 -0.62 -0.14 -1.26 -1.96 119.74 119.52 1fg9 s LYS 169 Ca -0.01 -0.20 0.02 0.00 -1.36 0.00 0.00 55.97 54.42 1fg9 s LYS 169 Cb -0.04 -3.11 0.01 0.00 -1.68 0.00 0.00 37.83 33.01 1fg9 s LYS 169 CO -0.02 0.76 -0.11 0.42 -0.76 0.00 0.00 175.35 175.64 1fg9 s ILE 170 N -1.03 1.03 -0.58 2.17 1.01 -0.61 -4.96 121.20 118.24 1fg9 s ILE 170 Ca 0.16 -0.44 -0.07 0.00 0.00 0.00 0.00 60.65 60.30 1fg9 s ILE 170 Cb -0.12 -0.95 0.15 0.00 0.01 0.00 0.00 42.46 41.55 1fg9 s ILE 170 CO 0.05 0.33 0.43 -0.76 0.00 0.00 0.00 174.94 174.99 1fg9 s LEU 171 N 0.58 5.67 0.57 2.97 1.02 -1.26 -0.86 118.68 127.37 1fg9 s LEU 171 Ca -0.12 -2.38 0.36 0.00 0.02 0.00 0.00 54.13 52.02 1fg9 s LEU 171 Cb -0.14 -1.97 1.47 0.00 0.02 0.00 0.00 46.19 45.57 1fg9 s LEU 171 CO 0.03 -0.55 1.69 0.71 0.02 0.00 0.00 176.35 178.25 1fg9 h THR 172 N 5.64 0.25 0.00 5.49 1.35 -1.24 -3.23 112.91 121.17 1fg9 h THR 172 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1fg9 h THR 172 Cb 1.02 0.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 1fg9 h THR 172 CO 0.78 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.05 1fg9 n GLN 173 N -3.88 0.00 -1.49 4.72 1.13 -1.26 -4.66 117.38 111.93 1fg9 n GLN 173 Ca 0.26 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.96 1fg9 n GLN 173 Cb 1.36 -0.04 -0.07 0.00 0.11 0.00 0.00 30.24 31.59 1fg9 n GLN 173 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1fg9 n LYS 174 N -0.21 1.32 0.00 -1.09 2.85 -1.23 -4.55 118.16 115.25 1fg9 n LYS 174 Ca 0.00 -2.02 0.00 0.00 -1.05 0.00 0.00 58.31 55.24 1fg9 n LYS 174 Cb 0.00 -3.27 0.00 0.00 -0.65 0.00 0.00 35.03 31.11 1fg9 n LYS 174 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1fg9 n GLU 175 N 7.69 0.00 -2.21 -1.58 4.07 -1.22 -4.77 120.64 122.62 1fg9 n GLU 175 Ca 0.47 0.00 -0.32 0.00 -0.06 0.00 0.00 57.16 57.25 1fg9 n GLU 175 Cb 0.43 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 31.83 1fg9 n GLU 175 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1fg9 n ASP 176 N 0.00 5.94 -0.08 4.31 4.64 -1.26 -4.34 116.55 125.77 1fg9 n ASP 176 Ca 0.00 -3.77 -0.10 0.00 -1.38 0.00 0.00 54.79 49.54 1fg9 n ASP 176 Cb 0.00 -0.72 -0.09 0.00 -1.04 0.00 0.00 41.12 39.27 1fg9 n ASP 176 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 1fg9 n ASP 177 N -0.52 2.17 -4.92 1.67 9.92 -1.26 -5.00 116.55 118.61 1fg9 n ASP 177 Ca 0.46 -0.05 -0.26 0.00 -0.53 0.00 0.00 54.79 54.41 1fg9 n ASP 177 Cb 0.49 0.25 0.01 0.00 -0.64 0.00 0.00 41.12 41.23 1fg9 n ASP 177 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1fg9 s ASP 179 N -4.17 -0.01 0.62 0.00 1.47 -1.00 -4.93 116.67 108.65 1fg9 s ASP 179 Ca 0.48 -1.05 0.25 0.00 1.18 0.00 0.00 52.55 53.42 1fg9 s ASP 179 Cb -0.10 0.81 1.22 0.00 -0.34 0.00 0.00 42.92 44.51 1fg9 s ASP 179 CO 0.42 -1.59 1.66 -0.33 0.68 0.00 0.00 175.17 176.01 1fg9 h GLU 180 N 2.01 0.00 0.00 2.11 4.39 -1.98 -3.21 114.58 117.89 1fg9 h GLU 180 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 1fg9 h GLU 180 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 1fg9 h GLU 180 CO 0.37 0.00 -0.77 -0.89 -1.16 0.00 0.00 179.01 176.55 1fg9 n ILE 181 N -3.28 1.28 -2.42 3.13 2.08 -1.26 -4.92 119.36 113.98 1fg9 n ILE 181 Ca 0.08 0.21 0.00 0.00 0.56 0.00 0.00 62.75 63.60 1fg9 n ILE 181 Cb 0.84 -2.16 0.00 0.00 -0.75 0.00 0.00 39.64 37.57 1fg9 n ILE 181 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1fg9 n GLN 182 N -4.11 3.97 -3.52 0.38 10.64 -1.22 -1.66 117.38 121.87 1fg9 n GLN 182 Ca -0.11 0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 54.93 1fg9 n GLN 182 Cb 0.40 0.00 -0.05 0.00 -0.86 0.00 0.00 30.24 29.74 1fg9 n GLN 182 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1fg9 s GLN 184 N -1.85 1.61 -0.32 0.00 -1.52 -1.18 -2.04 119.66 114.37 1fg9 s GLN 184 Ca -0.04 -1.83 -0.07 0.00 -1.95 0.00 0.00 55.36 51.47 1fg9 s GLN 184 Cb -0.00 -1.21 0.19 0.00 -0.22 0.00 0.00 33.01 31.76 1fg9 s GLN 184 CO 0.01 0.02 0.96 -1.17 -0.25 0.00 0.00 175.29 174.87 1fg9 s LEU 185 N -3.48 -0.61 0.71 2.90 0.20 -0.90 -4.88 118.68 112.61 1fg9 s LEU 185 Ca 0.31 -0.08 -0.11 0.00 0.69 0.00 0.00 54.13 54.93 1fg9 s LEU 185 Cb 0.04 1.13 0.01 0.00 -0.43 0.00 0.00 46.19 46.95 1fg9 s LEU 185 CO 0.13 -0.09 1.07 0.00 -0.29 0.00 0.00 176.35 177.16 1fg9 s ALA 186 N 2.52 2.68 -0.07 5.97 0.00 -1.26 -2.29 121.76 129.31 1fg9 s ALA 186 Ca 0.21 -0.07 -0.10 0.00 0.00 0.00 0.00 51.96 52.00 1fg9 s ALA 186 Cb -0.01 -3.12 0.02 0.00 0.00 0.00 0.00 23.12 20.01 1fg9 s ALA 186 CO -0.19 -1.23 0.25 0.42 0.00 0.00 0.00 175.76 175.01 1fg9 s ILE 187 N -3.13 0.02 0.26 0.00 1.01 -0.25 -4.96 121.20 114.15 1fg9 s ILE 187 Ca 0.58 -0.19 -0.28 0.00 0.00 0.00 0.00 60.65 60.76 1fg9 s ILE 187 Cb -0.13 -0.42 -0.09 0.00 0.01 0.00 0.00 42.46 41.83 1fg9 s ILE 187 CO 0.54 -0.10 0.91 -2.16 0.00 0.00 0.00 174.94 174.13 1fg9 s PRO 188 N -0.36 4.70 -0.86 2.79 0.04 -1.26 -1.60 135.00 138.46 1fg9 s PRO 188 Ca -0.05 1.37 -0.26 0.00 0.04 0.00 0.00 61.00 62.10 1fg9 s PRO 188 Cb -0.03 -3.09 -0.14 0.00 0.04 0.00 0.00 34.50 31.27 1fg9 s PRO 188 CO 0.01 0.43 2.31 0.08 0.04 0.00 0.00 177.00 179.88 1fg9 s VAL 189 N -1.35 3.06 0.43 -0.36 1.01 -0.80 -4.87 120.40 117.52 1fg9 s VAL 189 Ca 0.44 -0.06 -0.22 0.00 0.00 0.00 0.00 61.98 62.13 1fg9 s VAL 189 Cb -0.23 -3.30 -0.09 0.00 0.00 0.00 0.00 36.38 32.76 1fg9 s VAL 189 CO 0.28 -0.13 1.02 -0.55 0.00 0.00 0.00 175.10 175.72 1fg9 s SER 190 N 10.16 6.69 -0.68 3.32 0.15 -1.26 -4.71 113.70 127.37 1fg9 s SER 190 Ca 0.88 1.91 -0.15 0.00 0.70 0.00 0.00 55.95 59.29 1fg9 s SER 190 Cb -0.11 -2.57 0.02 0.00 -1.71 0.00 0.00 66.02 61.66 1fg9 s SER 190 CO 0.09 -0.53 0.29 -1.20 1.20 0.00 0.00 173.24 173.08 1fg9 n SER 191 N -0.46 -1.61 -3.17 5.45 7.64 -1.26 -3.06 113.62 117.15 1fg9 n SER 191 Ca 0.07 -0.70 -0.11 0.00 1.01 0.00 0.00 58.87 59.14 1fg9 n SER 191 Cb 0.52 -0.84 -0.03 0.00 -1.01 0.00 0.00 64.21 62.85 1fg9 n SER 191 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1fg9 n LEU 192 N -3.10 -0.31 0.00 -3.43 0.00 -1.26 -4.91 117.00 103.99 1fg9 n LEU 192 Ca -0.08 -0.44 -0.15 0.00 0.00 0.00 0.00 56.01 55.34 1fg9 n LEU 192 Cb 0.31 -0.54 0.06 0.00 0.00 0.00 0.00 43.42 43.25 1fg9 n LEU 192 CO 0.41 0.17 0.31 0.59 0.00 0.00 0.00 177.39 178.87 1fg9 n ASN 193 N -0.74 1.44 0.00 1.96 5.03 -1.17 -5.08 115.26 116.70 1fg9 n ASN 193 Ca -0.11 -2.08 0.00 0.00 0.87 0.00 0.00 54.58 53.27 1fg9 n ASN 193 Cb 0.24 -0.36 0.00 0.00 -1.02 0.00 0.00 39.78 38.64 1fg9 n ASN 193 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1fg9 n SER 194 N -2.60 0.00 -4.64 6.41 7.64 -1.26 -4.98 113.62 114.19 1fg9 n SER 194 Ca 0.12 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.58 1fg9 n SER 194 Cb 0.45 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.61 1fg9 n SER 194 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1fg9 s GLN 195 N -0.93 4.18 0.04 1.43 -0.21 -1.26 -3.31 119.66 119.60 1fg9 s GLN 195 Ca 0.00 1.02 0.03 0.00 0.02 0.00 0.00 55.36 56.43 1fg9 s GLN 195 Cb 0.00 -3.65 -0.04 0.00 1.00 0.00 0.00 33.01 30.32 1fg9 s GLN 195 CO 0.00 -0.56 0.02 0.71 -2.12 0.00 0.00 175.29 173.34 1fg9 s TYR 196 N 2.95 3.09 -0.15 0.91 1.51 -1.25 -4.30 117.35 120.11 1fg9 s TYR 196 Ca 0.37 0.06 -0.03 0.00 -1.01 0.00 0.00 57.07 56.46 1fg9 s TYR 196 Cb -0.15 -1.63 0.05 0.00 -0.11 0.00 0.00 41.96 40.12 1fg9 s TYR 196 CO 0.08 0.48 0.04 0.00 -1.11 0.00 0.00 175.55 175.04 1fg9 s VAL 198 N 1.96 5.41 0.11 0.00 1.01 -1.11 -1.16 120.40 126.62 1fg9 s VAL 198 Ca 0.01 -0.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.84 1fg9 s VAL 198 Cb -0.15 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 32.72 1fg9 s VAL 198 CO -0.07 0.38 0.32 -0.94 0.00 0.00 0.00 175.10 174.79 1fg9 s SER 199 N -1.75 -0.10 -0.17 3.32 1.04 -1.09 -1.48 113.70 113.47 1fg9 s SER 199 Ca 0.26 -0.43 -0.29 0.00 0.48 0.00 0.00 55.95 55.97 1fg9 s SER 199 Cb -0.13 0.42 0.11 0.00 0.10 0.00 0.00 66.02 66.53 1fg9 s SER 199 CO 0.16 -0.80 0.94 0.00 0.98 0.00 0.00 173.24 174.52 1fg9 s ALA 200 N -3.79 -1.91 0.15 5.32 0.00 -1.26 -1.64 121.76 118.64 1fg9 s ALA 200 Ca 0.03 1.63 0.07 0.00 0.00 0.00 0.00 51.96 53.70 1fg9 s ALA 200 Cb 0.03 -0.78 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1fg9 s ALA 200 CO -0.11 -0.30 -0.16 -1.83 0.00 0.00 0.00 175.76 173.35 1fg9 s GLU 201 N -0.75 1.17 0.01 0.00 -1.05 -0.98 -2.21 118.70 114.90 1fg9 s GLU 201 Ca -0.02 -1.36 -0.01 0.00 -0.15 0.00 0.00 54.97 53.44 1fg9 s GLU 201 Cb -0.02 -1.12 -0.04 0.00 -0.44 0.00 0.00 34.13 32.51 1fg9 s GLU 201 CO 0.01 0.22 0.13 0.20 0.95 0.00 0.00 175.26 176.77 1fg9 s GLY 202 N -2.65 2.10 -0.17 -3.83 0.00 -1.26 -0.98 107.32 100.53 1fg9 s GLY 202 Ca 0.14 -0.85 -0.01 0.00 0.00 0.00 0.00 44.72 43.99 1fg9 s GLY 202 CO 0.05 -0.76 -0.11 0.14 0.00 0.00 0.00 173.10 172.42 1fg9 s VAL 203 N -1.31 3.04 0.43 1.40 1.01 -0.53 0.11 120.40 124.55 1fg9 s VAL 203 Ca 0.27 -0.63 -0.18 0.00 0.00 0.00 0.00 61.98 61.44 1fg9 s VAL 203 Cb -0.12 -2.32 -0.09 0.00 0.00 0.00 0.00 36.38 33.84 1fg9 s VAL 203 CO 0.19 0.49 0.90 -0.76 0.00 0.00 0.00 175.10 175.92 1fg9 s LEU 204 N 0.88 3.88 1.10 3.92 1.43 0.13 -0.76 118.68 129.26 1fg9 s LEU 204 Ca -0.03 1.53 -0.13 0.00 -1.03 0.00 0.00 54.13 54.48 1fg9 s LEU 204 Cb -0.15 -4.40 0.25 0.00 0.03 0.00 0.00 46.19 41.92 1fg9 s LEU 204 CO 0.00 -0.39 1.05 -2.28 0.23 0.00 0.00 176.35 174.96 1fg9 s HIS 205 N -2.27 1.61 0.00 0.29 5.65 -0.87 -0.70 115.29 119.00 1fg9 s HIS 205 Ca 0.59 1.14 0.00 0.00 0.25 0.00 0.00 55.06 57.04 1fg9 s HIS 205 Cb -0.10 -3.16 0.00 0.00 -1.18 0.00 0.00 32.58 28.15 1fg9 s HIS 205 CO 0.20 -3.52 0.00 0.28 -0.65 0.00 0.00 174.74 171.05 1fg9 n VAL 206 N -4.65 0.00 0.12 0.89 0.31 -1.26 -2.04 118.33 111.69 1fg9 n VAL 206 Ca 0.04 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.41 1fg9 n VAL 206 Cb 0.55 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.50 1fg9 n VAL 206 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 1fg9 h TRP 207 N 0.00 0.00 -3.97 3.52 6.55 -1.97 -3.49 115.95 116.60 1fg9 h TRP 207 Ca 0.00 0.00 -0.24 0.00 0.95 0.00 0.00 58.89 59.60 1fg9 h TRP 207 Cb 0.00 0.00 0.09 0.00 -0.86 0.00 0.00 29.16 28.39 1fg9 h TRP 207 CO 0.00 0.40 -0.42 0.41 -1.05 0.00 0.00 178.44 177.78 1fg9 n GLY 208 N 1.25 0.04 3.70 1.49 0.00 0.13 -4.99 105.19 106.80 1fg9 n GLY 208 Ca -0.01 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1fg9 n GLY 208 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fg9 s VAL 209 N -3.20 4.91 0.48 1.61 1.01 -1.24 -4.53 120.40 119.45 1fg9 s VAL 209 Ca 0.32 1.80 -0.20 0.00 0.00 0.00 0.00 61.98 63.90 1fg9 s VAL 209 Cb -0.14 -4.20 -0.09 0.00 0.00 0.00 0.00 36.38 31.95 1fg9 s VAL 209 CO 0.44 0.14 1.02 -0.89 0.00 0.00 0.00 175.10 175.81 1fg9 s THR 210 N 1.31 3.95 0.58 3.92 2.01 -1.26 0.17 115.64 126.32 1fg9 s THR 210 Ca 0.45 1.18 -0.05 0.00 0.31 0.00 0.00 61.69 63.58 1fg9 s THR 210 Cb -0.19 -3.49 0.12 0.00 0.01 0.00 0.00 72.50 68.96 1fg9 s THR 210 CO 0.21 -0.29 0.79 0.35 -0.69 0.00 0.00 174.62 174.99 1fg9 n THR 211 N -0.98 0.00 -2.49 -0.82 -2.24 0.31 -4.74 114.28 103.31 1fg9 n THR 211 Ca 0.09 -0.92 -0.40 0.00 -2.27 0.00 0.00 64.05 60.54 1fg9 n THR 211 Cb 0.53 -1.30 -0.04 0.00 -2.10 0.00 0.00 70.33 67.41 1fg9 n THR 211 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1fg9 s GLU 212 N -4.60 4.65 -0.13 -0.78 2.02 -0.42 -4.48 118.70 114.96 1fg9 s GLU 212 Ca 0.49 1.78 -0.29 0.00 0.02 0.00 0.00 54.97 56.97 1fg9 s GLU 212 Cb -0.02 -3.20 -0.01 0.00 0.10 0.00 0.00 34.13 31.00 1fg9 s GLU 212 CO 0.33 0.22 1.14 0.21 0.02 0.00 0.00 175.26 177.18 1fg9 s LYS 213 N -1.37 4.32 0.75 1.61 2.20 -1.26 -3.13 119.74 122.85 1fg9 s LYS 213 Ca 0.44 1.54 -0.15 0.00 -0.36 0.00 0.00 55.97 57.44 1fg9 s LYS 213 Cb -0.31 -3.62 0.05 0.00 -1.51 0.00 0.00 37.83 32.43 1fg9 s LYS 213 CO 0.40 -0.52 1.24 -1.13 -0.36 0.00 0.00 175.35 174.98 1fg9 n SER 214 N 5.74 1.41 -4.78 1.43 3.41 -0.94 -4.86 113.62 115.03 1fg9 n SER 214 Ca 0.11 0.67 -0.35 0.00 -0.26 0.00 0.00 58.87 59.05 1fg9 n SER 214 Cb 0.46 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 62.89 1fg9 n SER 214 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1fg9 s LYS 215 N -3.84 3.32 0.66 4.33 2.36 -1.26 -4.48 119.74 120.83 1fg9 s LYS 215 Ca 0.77 1.55 -0.17 0.00 -2.55 0.00 0.00 55.97 55.57 1fg9 s LYS 215 Cb -0.32 -2.01 -0.00 0.00 -1.05 0.00 0.00 37.83 34.45 1fg9 s LYS 215 CO 0.47 -0.86 1.22 -1.21 1.55 0.00 0.00 175.35 176.51 1fg9 s GLU 216 N -3.40 2.58 -0.31 4.03 2.02 -1.26 -4.84 118.70 117.52 1fg9 s GLU 216 Ca 0.71 1.82 -0.02 0.00 0.02 0.00 0.00 54.97 57.50 1fg9 s GLU 216 Cb -0.23 -1.88 0.10 0.00 0.10 0.00 0.00 34.13 32.23 1fg9 s GLU 216 CO 0.28 -1.51 0.13 0.54 0.02 0.00 0.00 175.26 174.72 1fg9 s VAL 217 N -1.74 0.45 0.84 2.63 0.11 -0.55 -4.98 120.40 117.16 1fg9 s VAL 217 Ca 0.77 -1.21 -0.10 0.00 -2.93 0.00 0.00 61.98 58.51 1fg9 s VAL 217 Cb -0.31 -1.35 0.15 0.00 -1.53 0.00 0.00 36.38 33.34 1fg9 s VAL 217 CO 0.39 -0.73 1.17 0.00 -3.33 0.00 0.00 175.10 172.60 1fg9 n ILE 219 N -3.33 0.00 -1.11 0.00 3.06 -0.60 -4.96 119.36 112.41 1fg9 n ILE 219 Ca 0.14 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.39 1fg9 n ILE 219 Cb 0.60 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.78 1fg9 n ILE 219 CO 0.00 0.00 0.00 1.07 -2.50 0.00 0.00 176.55 175.12 1fg9 n THR 220 N 0.00 0.00 -0.23 9.51 5.66 -1.26 -3.82 114.28 124.14 1fg9 n THR 220 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1fg9 n THR 220 Cb 0.00 1.45 0.00 0.00 -1.55 0.00 0.00 70.33 70.23 1fg9 n THR 220 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32