#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cf9 s GLN 9 N 0.00 -0.78 -0.05 1.96 -2.07 -1.26 -5.03 119.66 112.43 3cf9 s GLN 9 Ca 0.00 -0.07 0.09 0.00 -1.82 0.00 0.00 55.36 53.55 3cf9 s GLN 9 Cb 0.00 -1.65 -0.13 0.00 -1.09 0.00 0.00 33.01 30.15 3cf9 s GLN 9 CO 0.00 -3.41 0.11 0.45 -1.32 0.00 0.00 175.29 171.12 3cf9 n SER 10 N -4.55 2.86 -4.58 12.60 2.88 -1.26 -4.85 113.62 116.72 3cf9 n SER 10 Ca 0.13 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.32 3cf9 n SER 10 Cb 0.59 1.05 -0.11 0.00 -0.75 0.00 0.00 64.21 65.00 3cf9 n SER 10 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 3cf9 s GLN 11 N -2.42 3.87 -0.01 -1.46 -1.52 -1.26 -2.95 119.66 113.90 3cf9 s GLN 11 Ca -0.04 -0.40 0.04 0.00 -1.95 0.00 0.00 55.36 53.02 3cf9 s GLN 11 Cb 0.04 -3.20 -0.01 0.00 -0.22 0.00 0.00 33.01 29.63 3cf9 s GLN 11 CO 0.37 0.17 -0.15 -0.06 -0.25 0.00 0.00 175.29 175.38 3cf9 s PHE 12 N 0.63 1.32 0.48 0.91 0.40 -0.51 -5.00 117.98 116.20 3cf9 s PHE 12 Ca 0.02 -0.26 0.07 0.00 -0.60 0.00 0.00 56.93 56.16 3cf9 s PHE 12 Cb -0.13 -0.85 0.01 0.00 0.51 0.00 0.00 43.02 42.55 3cf9 s PHE 12 CO 0.02 -0.03 0.41 -0.06 0.70 0.00 0.00 175.22 176.25 3cf9 s PHE 13 N -0.30 2.16 0.30 0.36 0.40 -1.26 -0.96 117.98 118.67 3cf9 s PHE 13 Ca 0.05 -0.66 0.05 0.00 -0.60 0.00 0.00 56.93 55.77 3cf9 s PHE 13 Cb -0.06 -2.06 0.73 0.00 0.51 0.00 0.00 43.02 42.14 3cf9 s PHE 13 CO -0.00 -0.33 1.75 0.97 0.70 0.00 0.00 175.22 178.31 3cf9 h ILE 14 N 0.87 0.64 0.00 0.64 6.09 -1.92 0.91 117.51 124.74 3cf9 h ILE 14 Ca -0.39 -0.22 -0.03 0.00 -1.37 0.00 0.00 64.86 62.85 3cf9 h ILE 14 Cb 1.28 -0.06 -0.00 0.00 0.47 0.00 0.00 36.82 38.51 3cf9 h ILE 14 CO 0.57 0.12 -0.16 1.05 -3.07 0.00 0.00 178.15 176.66 3cf9 h GLU 15 N 0.64 0.00 0.15 2.19 9.09 -1.95 -1.21 114.58 123.49 3cf9 h GLU 15 Ca 0.57 0.00 -0.31 0.00 0.05 0.00 0.00 59.36 59.67 3cf9 h GLU 15 Cb 0.94 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 28.07 3cf9 h GLU 15 CO -0.42 0.16 -1.29 0.45 0.05 0.00 0.00 179.01 177.95 3cf9 h HIS 16 N 0.00 0.97 -0.54 2.06 3.86 -1.23 -3.28 115.15 116.99 3cf9 h HIS 16 Ca -0.00 -0.63 -0.07 0.00 -1.16 0.00 0.00 60.37 58.51 3cf9 h HIS 16 Cb 0.32 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.70 3cf9 h HIS 16 CO 0.00 1.48 0.08 0.82 0.86 0.00 0.00 177.93 181.17 3cf9 h ILE 17 N 0.24 1.25 -0.90 2.45 2.04 -0.83 -2.68 117.51 119.08 3cf9 h ILE 17 Ca -0.20 -0.98 0.16 0.00 1.00 0.00 0.00 64.86 64.85 3cf9 h ILE 17 Cb 1.97 0.84 -0.10 0.00 -0.74 0.00 0.00 36.82 38.78 3cf9 h ILE 17 CO 0.24 0.35 0.48 -0.07 0.00 0.00 0.00 178.15 179.16 3cf9 h LEU 18 N 0.79 0.59 -0.90 1.44 -0.00 -1.37 0.19 115.31 116.05 3cf9 h LEU 18 Ca 0.16 0.10 -0.04 0.00 -0.00 0.00 0.00 57.88 58.10 3cf9 h LEU 18 Cb 0.42 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.08 3cf9 h LEU 18 CO 0.01 0.23 -0.21 1.56 -0.00 0.00 0.00 178.44 180.03 3cf9 h GLN 19 N 0.65 0.00 0.00 1.13 4.20 -1.54 -3.35 115.11 116.21 3cf9 h GLN 19 Ca 0.50 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 58.78 3cf9 h GLN 19 Cb 0.74 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.46 3cf9 h GLN 19 CO -0.38 0.21 -2.34 -0.89 -0.67 0.00 0.00 178.83 174.75 3cf9 n ILE 20 N -3.30 1.53 -3.21 2.54 2.08 -0.85 -4.44 119.36 113.71 3cf9 n ILE 20 Ca 0.01 -0.33 -0.39 0.00 0.56 0.00 0.00 62.75 62.60 3cf9 n ILE 20 Cb 0.46 -1.90 -0.06 0.00 -0.75 0.00 0.00 39.64 37.39 3cf9 n ILE 20 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 3cf9 s LEU 21 N -7.55 4.50 0.00 1.39 1.43 0.61 -4.85 118.68 114.20 3cf9 s LEU 21 Ca -0.37 1.28 0.30 0.00 -1.03 0.00 0.00 54.13 54.31 3cf9 s LEU 21 Cb 0.13 -2.96 1.37 0.00 0.03 0.00 0.00 46.19 44.77 3cf9 s LEU 21 CO 0.51 0.21 1.99 -0.81 0.23 0.00 0.00 176.35 178.48 3cf9 n PRO 22 N 2.04 0.20 -2.05 1.29 -0.04 -1.26 -4.67 135.00 130.51 3cf9 n PRO 22 Ca -0.09 -0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.96 3cf9 n PRO 22 Cb 0.51 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.44 3cf9 n PRO 22 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3cf9 s HIS 23 N -2.80 3.01 0.39 0.54 3.76 -1.26 -5.04 115.29 113.89 3cf9 s HIS 23 Ca 0.21 1.18 0.04 0.00 -0.15 0.00 0.00 55.06 56.35 3cf9 s HIS 23 Cb 0.20 -3.77 -0.02 0.00 1.11 0.00 0.00 32.58 30.10 3cf9 s HIS 23 CO 0.50 -2.36 0.16 0.54 -0.85 0.00 0.00 174.74 172.73 3cf9 n ARG 24 N 1.70 0.56 -1.85 1.40 5.12 -1.26 -4.66 116.66 117.66 3cf9 n ARG 24 Ca 0.04 -3.35 -0.41 0.00 -1.93 0.00 0.00 57.85 52.20 3cf9 n ARG 24 Cb 0.41 1.96 -0.01 0.00 -1.16 0.00 0.00 32.46 33.66 3cf9 n ARG 24 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 3cf9 s TYR 25 N -3.09 2.76 -0.64 -1.55 5.04 -1.26 0.03 117.35 118.63 3cf9 s TYR 25 Ca 0.23 0.99 -0.02 0.00 -2.44 0.00 0.00 57.07 55.83 3cf9 s TYR 25 Cb 0.01 -3.99 0.40 0.00 0.35 0.00 0.00 41.96 38.74 3cf9 s TYR 25 CO 0.16 -3.12 2.05 -0.35 -1.34 0.00 0.00 175.55 172.95 3cf9 n PRO 26 N 1.53 2.59 -0.02 4.97 -0.04 -1.26 -4.93 135.00 137.84 3cf9 n PRO 26 Ca 0.05 -3.10 0.00 0.00 -0.04 0.00 0.00 63.50 60.42 3cf9 n PRO 26 Cb 0.39 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 3cf9 n PRO 26 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3cf9 n MET 27 N -0.70 1.34 -3.29 0.54 2.81 0.10 -4.95 117.12 112.98 3cf9 n MET 27 Ca 0.58 -1.02 -0.43 0.00 -1.81 0.00 0.00 57.70 55.02 3cf9 n MET 27 Cb 0.60 -0.75 -0.08 0.00 -0.71 0.00 0.00 33.22 32.28 3cf9 n MET 27 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 3cf9 s LEU 28 N -0.53 4.69 -0.18 4.03 2.96 -0.91 -4.65 118.68 124.10 3cf9 s LEU 28 Ca 0.01 -0.49 0.14 0.00 -0.22 0.00 0.00 54.13 53.57 3cf9 s LEU 28 Cb 0.01 -2.46 0.42 0.00 0.50 0.00 0.00 46.19 44.66 3cf9 s LEU 28 CO 0.00 -0.57 1.21 0.18 -1.32 0.00 0.00 176.35 175.85 3cf9 n LEU 29 N 5.70 2.46 -3.89 -0.68 4.77 -1.26 -4.92 117.00 119.19 3cf9 n LEU 29 Ca -0.06 -3.60 -0.21 0.00 -0.03 0.00 0.00 56.01 52.11 3cf9 n LEU 29 Cb 0.48 -0.43 -0.16 0.00 -2.33 0.00 0.00 43.42 40.97 3cf9 n LEU 29 CO 0.46 1.27 -0.41 -0.69 -1.33 0.00 0.00 177.39 176.69 3cf9 s VAL 30 N -2.72 0.58 -0.20 4.08 1.01 -1.26 -4.58 120.40 117.31 3cf9 s VAL 30 Ca 0.38 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.30 3cf9 s VAL 30 Cb 0.37 -0.61 -0.18 0.00 0.00 0.00 0.00 36.38 35.97 3cf9 s VAL 30 CO -0.08 0.24 -0.08 0.47 0.00 0.00 0.00 175.10 175.65 3cf9 n ASP 31 N 4.14 1.59 -3.70 3.32 8.00 -0.25 -4.98 116.55 124.66 3cf9 n ASP 31 Ca -0.23 -0.06 -0.14 0.00 0.71 0.00 0.00 54.79 55.07 3cf9 n ASP 31 Cb 0.51 0.23 -0.09 0.00 -0.02 0.00 0.00 41.12 41.75 3cf9 n ASP 31 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3cf9 s ARG 32 N -2.43 0.62 -0.21 -1.24 3.52 -1.11 -3.08 118.95 115.02 3cf9 s ARG 32 Ca -0.20 0.55 -0.08 0.00 -0.13 0.00 0.00 55.73 55.87 3cf9 s ARG 32 Cb 0.06 0.30 -0.04 0.00 -1.56 0.00 0.00 34.95 33.71 3cf9 s ARG 32 CO 0.60 -0.10 0.07 0.42 -0.81 0.00 0.00 175.30 175.48 3cf9 s ILE 33 N -0.03 4.70 -0.07 4.11 -1.09 -0.14 -1.17 121.20 127.51 3cf9 s ILE 33 Ca -0.02 -0.06 0.14 0.00 -2.23 0.00 0.00 60.65 58.47 3cf9 s ILE 33 Cb -0.03 -3.15 -0.20 0.00 -1.58 0.00 0.00 42.46 37.50 3cf9 s ILE 33 CO 0.02 0.41 0.21 0.35 -1.23 0.00 0.00 174.94 174.70 3cf9 n THR 34 N 4.02 0.38 -3.70 2.92 -2.24 -0.43 -1.43 114.28 113.80 3cf9 n THR 34 Ca -0.16 -0.43 -0.12 0.00 -2.27 0.00 0.00 64.05 61.07 3cf9 n THR 34 Cb 0.52 -0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.49 3cf9 n THR 34 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3cf9 s GLU 35 N -2.73 0.52 -0.24 -0.78 2.12 -0.96 -4.45 118.70 112.18 3cf9 s GLU 35 Ca -0.06 0.74 -0.07 0.00 0.36 0.00 0.00 54.97 55.94 3cf9 s GLU 35 Cb 0.07 0.18 0.12 0.00 0.26 0.00 0.00 34.13 34.75 3cf9 s GLU 35 CO 0.58 -0.10 0.51 -1.17 -0.54 0.00 0.00 175.26 174.54 3cf9 s LEU 36 N 0.69 -0.87 -0.26 2.70 0.20 -1.24 -0.73 118.68 119.16 3cf9 s LEU 36 Ca -0.04 1.11 -0.02 0.00 0.69 0.00 0.00 54.13 55.88 3cf9 s LEU 36 Cb -0.05 1.71 0.03 0.00 -0.43 0.00 0.00 46.19 47.46 3cf9 s LEU 36 CO -0.05 -0.24 -0.05 -1.10 -0.29 0.00 0.00 176.35 174.63 3cf9 s GLN 37 N 2.72 2.73 0.11 1.98 -0.21 0.39 -4.78 119.66 122.61 3cf9 s GLN 37 Ca -0.00 -1.05 -0.36 0.00 0.02 0.00 0.00 55.36 53.97 3cf9 s GLN 37 Cb -0.13 -3.03 -0.16 0.00 1.00 0.00 0.00 33.01 30.69 3cf9 s GLN 37 CO -0.16 -0.45 1.34 0.00 -2.12 0.00 0.00 175.29 173.89 3cf9 n ALA 38 N 4.66 -0.66 -0.84 6.09 0.00 -1.26 -1.34 120.51 127.16 3cf9 n ALA 38 Ca -0.16 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.78 3cf9 n ALA 38 Cb 0.46 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.81 3cf9 n ALA 38 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3cf9 n ASN 39 N 2.52 -2.42 0.05 0.00 4.13 -1.26 -4.72 115.26 113.56 3cf9 n ASN 39 Ca 0.17 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.43 3cf9 n ASN 39 Cb 0.21 -1.98 0.00 0.00 -1.54 0.00 0.00 39.78 36.47 3cf9 n ASN 39 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3cf9 n GLN 40 N -1.25 0.00 -3.60 3.52 6.02 -0.45 -4.63 117.38 117.00 3cf9 n GLN 40 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.85 3cf9 n GLN 40 Cb 0.16 -0.24 -0.06 0.00 1.02 0.00 0.00 30.24 31.11 3cf9 n GLN 40 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 3cf9 s LYS 41 N -1.67 0.99 -0.01 -1.09 -2.85 -0.67 -0.32 119.74 114.12 3cf9 s LYS 41 Ca 0.00 -0.20 0.01 0.00 -1.00 0.00 0.00 55.97 54.78 3cf9 s LYS 41 Cb 0.00 0.45 -0.00 0.00 -2.06 0.00 0.00 37.83 36.22 3cf9 s LYS 41 CO 0.00 -0.35 -0.04 -1.50 0.10 0.00 0.00 175.35 173.56 3cf9 s ILE 42 N -2.25 0.37 -0.16 3.79 2.07 0.21 -0.46 121.20 124.77 3cf9 s ILE 42 Ca -0.06 -0.18 0.01 0.00 -1.41 0.00 0.00 60.65 59.00 3cf9 s ILE 42 Cb -0.01 -0.32 0.00 0.00 0.13 0.00 0.00 42.46 42.26 3cf9 s ILE 42 CO -0.00 0.11 -0.17 -0.69 -1.91 0.00 0.00 174.94 172.28 3cf9 s VAL 43 N -0.01 2.44 0.34 4.00 1.01 0.09 -1.00 120.40 127.27 3cf9 s VAL 43 Ca 0.01 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.19 3cf9 s VAL 43 Cb -0.03 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 3cf9 s VAL 43 CO -0.00 0.52 0.18 0.00 0.00 0.00 0.00 175.10 175.80 3cf9 s ALA 44 N 0.93 2.21 0.12 5.51 0.00 -0.33 -1.31 121.76 128.89 3cf9 s ALA 44 Ca -0.04 -1.69 -0.14 0.00 0.00 0.00 0.00 51.96 50.09 3cf9 s ALA 44 Cb -0.15 1.13 0.03 0.00 0.00 0.00 0.00 23.12 24.13 3cf9 s ALA 44 CO -0.03 -0.50 0.36 1.52 0.00 0.00 0.00 175.76 177.11 3cf9 s TYR 45 N -3.45 -0.10 -0.07 0.00 1.13 -0.32 0.41 117.35 114.94 3cf9 s TYR 45 Ca 0.34 -0.24 0.03 0.00 -1.41 0.00 0.00 57.07 55.78 3cf9 s TYR 45 Cb 0.04 0.19 0.01 0.00 -1.10 0.00 0.00 41.96 41.09 3cf9 s TYR 45 CO 0.19 -0.69 -0.17 0.21 -2.51 0.00 0.00 175.55 172.59 3cf9 s LYS 46 N -3.83 2.20 0.15 -3.49 2.20 0.62 -1.09 119.74 116.50 3cf9 s LYS 46 Ca 0.04 -0.60 -0.30 0.00 -0.36 0.00 0.00 55.97 54.75 3cf9 s LYS 46 Cb 0.02 -1.75 -0.07 0.00 -1.51 0.00 0.00 37.83 34.53 3cf9 s LYS 46 CO -0.11 0.11 1.12 -0.80 -0.36 0.00 0.00 175.35 175.31 3cf9 s ASN 47 N 0.47 7.23 -0.23 1.43 0.01 -1.26 -0.34 114.94 122.25 3cf9 s ASN 47 Ca -0.15 2.07 -0.09 0.00 -0.71 0.00 0.00 52.86 53.99 3cf9 s ASN 47 Cb -0.16 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 38.86 3cf9 s ASN 47 CO 0.05 -0.27 0.11 -0.63 -1.51 0.00 0.00 177.10 174.85 3cf9 s ILE 48 N 0.01 4.89 0.07 0.60 -1.09 0.27 -4.93 121.20 121.03 3cf9 s ILE 48 Ca 0.51 0.02 0.05 0.00 -2.23 0.00 0.00 60.65 59.00 3cf9 s ILE 48 Cb -0.29 -3.27 -0.03 0.00 -1.58 0.00 0.00 42.46 37.29 3cf9 s ILE 48 CO 0.34 0.36 -0.14 0.28 -1.23 0.00 0.00 174.94 174.56 3cf9 s THR 49 N 1.10 1.06 0.53 2.92 -1.32 -1.26 -0.54 115.64 118.13 3cf9 s THR 49 Ca 0.06 -1.29 0.20 0.00 -1.21 0.00 0.00 61.69 59.45 3cf9 s THR 49 Cb -0.14 -1.03 0.31 0.00 -1.51 0.00 0.00 72.50 70.13 3cf9 s THR 49 CO 0.04 -0.24 2.13 0.15 -2.21 0.00 0.00 174.62 174.48 3cf9 h PHE 50 N 4.30 0.00 0.00 9.09 3.57 -1.95 -3.19 116.94 128.76 3cf9 h PHE 50 Ca -0.40 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.10 3cf9 h PHE 50 Cb 1.19 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.93 3cf9 h PHE 50 CO 0.63 0.00 0.00 -1.71 -2.23 0.00 0.00 178.31 175.00 3cf9 n ASN 51 N -4.41 3.73 -4.31 0.41 5.15 -1.26 -4.74 115.26 109.84 3cf9 n ASN 51 Ca -0.00 -1.97 -0.32 0.00 -0.60 0.00 0.00 54.58 51.69 3cf9 n ASN 51 Cb 0.21 -0.77 -0.16 0.00 -0.53 0.00 0.00 39.78 38.53 3cf9 n ASN 51 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3cf9 s GLU 52 N 0.42 2.75 0.32 1.20 2.02 -1.21 -5.03 118.70 119.17 3cf9 s GLU 52 Ca 0.00 -0.84 0.03 0.00 0.02 0.00 0.00 54.97 54.18 3cf9 s GLU 52 Cb 0.00 -2.29 0.62 0.00 0.10 0.00 0.00 34.13 32.56 3cf9 s GLU 52 CO 0.00 0.36 1.90 0.22 0.02 0.00 0.00 175.26 177.76 3cf9 h ASP 53 N 6.16 0.82 -1.06 -0.19 3.58 -1.94 -2.28 116.42 121.52 3cf9 h ASP 53 Ca -0.31 0.02 0.29 0.00 0.42 0.00 0.00 57.03 57.45 3cf9 h ASP 53 Cb 1.19 -0.15 -0.07 0.00 1.72 0.00 0.00 39.33 42.02 3cf9 h ASP 53 CO 0.49 0.50 0.72 1.62 -2.88 0.00 0.00 179.24 179.69 3cf9 h VAL 54 N 0.92 0.50 0.00 2.25 3.04 -1.96 -0.43 116.25 120.57 3cf9 h VAL 54 Ca 0.40 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 66.03 3cf9 h VAL 54 Cb 0.35 0.29 0.00 0.00 -2.01 0.00 0.00 31.29 29.92 3cf9 h VAL 54 CO -0.17 0.03 0.00 -0.26 -1.01 0.00 0.00 177.57 176.17 3cf9 h PHE 55 N 0.19 0.00 -0.36 3.17 0.05 -1.69 -2.59 116.94 115.71 3cf9 h PHE 55 Ca 0.55 0.00 0.03 0.00 3.82 0.00 0.00 57.97 62.37 3cf9 h PHE 55 Cb 1.79 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 39.72 3cf9 h PHE 55 CO -0.00 0.00 0.24 -0.91 -0.18 0.00 0.00 178.31 177.46 3cf9 h ASN 56 N 0.00 0.32 -0.01 2.17 2.35 -1.24 -3.23 115.58 115.93 3cf9 h ASN 56 Ca 0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3cf9 h ASN 56 Cb 0.45 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.75 3cf9 h ASN 56 CO 0.00 0.22 -0.12 0.61 -1.65 0.00 0.00 177.43 176.50 3cf9 n GLY 57 N -1.51 -0.27 2.32 2.83 0.00 -0.99 -4.15 105.19 103.42 3cf9 n GLY 57 Ca 0.03 -0.29 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 3cf9 n GLY 57 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3cf9 n HIS 58 N 0.09 -1.03 -4.33 1.61 -0.00 -1.12 -4.54 115.22 105.90 3cf9 n HIS 58 Ca 0.05 -3.16 -0.18 0.00 -0.00 0.00 0.00 57.72 54.43 3cf9 n HIS 58 Cb 0.23 0.08 -0.10 0.00 -0.00 0.00 0.00 29.99 30.20 3cf9 n HIS 58 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 3cf9 s PHE 59 N -0.78 1.61 0.12 1.57 0.40 0.19 -1.26 117.98 119.82 3cf9 s PHE 59 Ca 0.34 -0.74 -0.35 0.00 -0.60 0.00 0.00 56.93 55.58 3cf9 s PHE 59 Cb 0.19 -0.85 -0.16 0.00 0.51 0.00 0.00 43.02 42.70 3cf9 s PHE 59 CO -0.14 0.16 1.33 -2.30 0.70 0.00 0.00 175.22 174.97 3cf9 n PRO 60 N -0.39 1.28 -0.64 0.24 -0.02 -1.26 -0.99 135.00 133.24 3cf9 n PRO 60 Ca -0.07 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3cf9 n PRO 60 Cb 0.62 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 3cf9 n PRO 60 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3cf9 n ASN 61 N 2.48 -0.80 -3.14 2.55 3.02 -1.26 -4.86 115.26 113.25 3cf9 n ASN 61 Ca 0.17 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.54 3cf9 n ASN 61 Cb 0.22 -2.27 -0.05 0.00 -0.61 0.00 0.00 39.78 37.07 3cf9 n ASN 61 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3cf9 n LYS 62 N -1.65 0.37 -2.14 3.52 3.00 -0.16 -5.12 118.16 115.98 3cf9 n LYS 62 Ca 0.00 -2.74 -0.43 0.00 -0.00 0.00 0.00 58.31 55.15 3cf9 n LYS 62 Cb 0.06 -1.56 -0.02 0.00 0.00 0.00 0.00 35.03 33.51 3cf9 n LYS 62 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 3cf9 s PRO 63 N 0.26 3.83 -0.13 1.64 0.04 -1.24 -0.64 135.00 138.78 3cf9 s PRO 63 Ca 0.32 1.66 -0.00 0.00 0.04 0.00 0.00 61.00 63.02 3cf9 s PRO 63 Cb 0.05 -4.02 0.03 0.00 0.04 0.00 0.00 34.50 30.60 3cf9 s PRO 63 CO -0.15 -1.25 -0.07 0.42 0.04 0.00 0.00 177.00 176.00 3cf9 s ILE 64 N 5.04 1.05 0.03 0.56 -1.09 -0.39 -4.53 121.20 121.88 3cf9 s ILE 64 Ca 0.70 -0.37 -0.30 0.00 -2.23 0.00 0.00 60.65 58.45 3cf9 s ILE 64 Cb -0.25 -1.10 -0.08 0.00 -1.58 0.00 0.00 42.46 39.45 3cf9 s ILE 64 CO 0.28 0.32 1.85 0.12 -1.23 0.00 0.00 174.94 176.28 3cf9 s PHE 65 N 1.69 1.66 0.21 3.97 5.36 0.17 -4.63 117.98 126.42 3cf9 s PHE 65 Ca 0.04 -0.18 -0.32 0.00 -0.96 0.00 0.00 56.93 55.51 3cf9 s PHE 65 Cb -0.13 -4.13 -0.13 0.00 -0.34 0.00 0.00 43.02 38.28 3cf9 s PHE 65 CO -0.08 -4.92 1.48 -2.30 -1.46 0.00 0.00 175.22 167.94 3cf9 n PRO 66 N 7.04 2.12 -0.37 10.12 -0.02 -1.26 -4.52 135.00 148.11 3cf9 n PRO 66 Ca 0.19 0.76 0.03 0.00 -2.02 0.00 0.00 63.50 62.45 3cf9 n PRO 66 Cb 0.41 -2.46 0.18 0.00 -0.02 0.00 0.00 33.50 31.61 3cf9 n PRO 66 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3cf9 h GLY 67 N 4.85 1.55 2.00 -1.23 0.00 -1.99 -1.88 103.07 106.38 3cf9 h GLY 67 Ca -0.45 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.39 3cf9 h GLY 67 CO 0.81 0.31 -0.10 -0.39 0.00 0.00 0.00 176.54 177.17 3cf9 h VAL 68 N 1.16 0.76 0.00 4.60 -1.51 -2.00 -2.13 116.25 117.13 3cf9 h VAL 68 Ca 0.44 -0.39 -0.15 0.00 -1.23 0.00 0.00 66.70 65.37 3cf9 h VAL 68 Cb 0.21 1.23 -0.02 0.00 -2.13 0.00 0.00 31.29 30.58 3cf9 h VAL 68 CO -0.19 0.10 -0.87 -0.07 -1.23 0.00 0.00 177.57 175.31 3cf9 h LEU 69 N 0.00 0.00 -0.69 4.19 3.38 -1.72 -1.99 115.31 118.47 3cf9 h LEU 69 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3cf9 h LEU 69 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3cf9 h LEU 69 CO 0.01 0.66 0.35 0.40 0.09 0.00 0.00 178.44 179.96 3cf9 h ILE 70 N 0.00 1.22 -0.25 1.22 2.04 -1.07 -0.82 117.51 119.85 3cf9 h ILE 70 Ca -0.05 -0.60 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 3cf9 h ILE 70 Cb 1.55 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 3cf9 h ILE 70 CO 0.08 0.25 0.01 0.58 0.00 0.00 0.00 178.15 179.07 3cf9 h VAL 71 N 0.95 1.25 -0.56 1.67 2.07 -1.41 -1.93 116.25 118.29 3cf9 h VAL 71 Ca 0.24 -0.87 0.09 0.00 0.82 0.00 0.00 66.70 66.98 3cf9 h VAL 71 Cb 0.08 1.32 -0.07 0.00 -1.52 0.00 0.00 31.29 31.11 3cf9 h VAL 71 CO -0.03 0.27 0.19 -0.08 0.02 0.00 0.00 177.57 177.94 3cf9 h GLU 72 N 0.22 0.35 -0.89 1.57 4.57 -1.30 -0.31 114.58 118.79 3cf9 h GLU 72 Ca 0.07 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.27 3cf9 h GLU 72 Cb 0.39 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.85 3cf9 h GLU 72 CO 0.01 0.23 0.57 0.78 -1.18 0.00 0.00 179.01 179.43 3cf9 h GLY 73 N 0.37 1.30 1.03 1.92 0.00 -0.90 -0.97 103.07 105.81 3cf9 h GLY 73 Ca 0.28 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 47.14 3cf9 h GLY 73 CO -0.29 0.36 0.35 -0.33 0.00 0.00 0.00 176.54 176.62 3cf9 h MET 74 N 1.10 1.13 -0.31 4.80 2.86 -0.65 -1.80 114.93 122.06 3cf9 h MET 74 Ca 0.36 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.81 3cf9 h MET 74 Cb 0.03 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.48 3cf9 h MET 74 CO -0.13 0.90 0.18 0.00 1.06 0.00 0.00 176.91 178.92 3cf9 h ALA 75 N 1.18 0.40 -0.49 6.32 0.00 -0.52 -1.22 119.26 124.93 3cf9 h ALA 75 Ca 0.26 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 3cf9 h ALA 75 Cb 0.16 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3cf9 h ALA 75 CO -0.03 -0.08 0.07 1.96 0.00 0.00 0.00 179.25 181.17 3cf9 h GLN 76 N 0.39 0.78 -0.44 0.00 4.20 -1.10 0.25 115.11 119.20 3cf9 h GLN 76 Ca 0.11 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 3cf9 h GLN 76 Cb 0.05 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 3cf9 h GLN 76 CO -0.02 0.74 0.21 0.77 -0.67 0.00 0.00 178.83 179.87 3cf9 h SER 77 N 0.74 0.57 -0.37 1.46 0.02 -1.22 -1.42 113.55 113.34 3cf9 h SER 77 Ca 0.16 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 3cf9 h SER 77 Cb 0.36 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 3cf9 h SER 77 CO 0.01 0.53 0.17 1.23 -1.14 0.00 0.00 176.83 177.63 3cf9 h GLY 78 N 0.57 0.57 1.82 -3.77 0.00 -0.66 -1.98 103.07 99.62 3cf9 h GLY 78 Ca 0.15 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 3cf9 h GLY 78 CO -0.02 0.27 0.05 -1.33 0.00 0.00 0.00 176.54 175.51 3cf9 h GLY 79 N 0.45 0.25 1.08 4.60 0.00 -0.45 0.35 103.07 109.35 3cf9 h GLY 79 Ca 0.13 -0.11 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 3cf9 h GLY 79 CO -0.01 0.10 -0.34 -2.75 0.00 0.00 0.00 176.54 173.54 3cf9 h PHE 80 N 0.24 1.04 0.08 5.60 3.57 -1.03 -2.00 116.94 124.44 3cf9 h PHE 80 Ca 0.06 -0.31 -0.00 0.00 3.53 0.00 0.00 57.97 61.25 3cf9 h PHE 80 Cb 0.08 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.60 3cf9 h PHE 80 CO 0.00 1.11 -0.04 1.25 -2.23 0.00 0.00 178.31 178.40 3cf9 h LEU 81 N 0.67 -0.09 -0.33 0.59 5.85 -0.60 -2.29 115.31 119.11 3cf9 h LEU 81 Ca 0.06 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.67 3cf9 h LEU 81 Cb 0.93 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.91 3cf9 h LEU 81 CO 0.09 0.13 -0.20 0.00 -0.34 0.00 0.00 178.44 178.11 3cf9 h ALA 82 N 0.58 0.02 0.08 1.25 0.00 -0.35 -1.37 119.26 119.46 3cf9 h ALA 82 Ca -0.01 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3cf9 h ALA 82 Cb 0.27 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3cf9 h ALA 82 CO 0.02 -0.59 -0.04 0.35 0.00 0.00 0.00 179.25 178.99 3cf9 h PHE 83 N -0.16 -0.10 0.00 0.00 3.57 -1.35 -3.01 116.94 115.89 3cf9 h PHE 83 Ca 0.17 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 3cf9 h PHE 83 Cb 0.42 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 3cf9 h PHE 83 CO -0.40 0.26 -0.13 1.79 -2.23 0.00 0.00 178.31 177.60 3cf9 h THR 84 N -0.47 0.62 -0.75 4.41 1.35 -1.38 0.04 112.91 116.73 3cf9 h THR 84 Ca -0.01 -0.55 -0.06 0.00 -0.55 0.00 0.00 66.41 65.24 3cf9 h THR 84 Cb 0.40 1.35 -0.03 0.00 -1.73 0.00 0.00 68.15 68.14 3cf9 h THR 84 CO 0.02 0.12 0.25 0.28 -0.25 0.00 0.00 175.52 175.94 3cf9 h SER 85 N 0.00 1.08 0.22 5.36 0.02 -1.18 -0.02 113.55 119.02 3cf9 h SER 85 Ca -0.00 -0.19 -0.31 0.00 -0.84 0.00 0.00 61.79 60.45 3cf9 h SER 85 Cb 0.34 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.54 3cf9 h SER 85 CO 0.02 0.99 -2.06 0.18 -1.14 0.00 0.00 176.83 174.81 3cf9 n LEU 86 N -4.26 0.35 0.00 5.07 4.32 -0.80 -4.61 117.00 117.08 3cf9 n LEU 86 Ca 0.06 0.17 0.00 0.00 -0.02 0.00 0.00 56.01 56.22 3cf9 n LEU 86 Cb 0.22 0.33 0.00 0.00 -1.62 0.00 0.00 43.42 42.35 3cf9 n LEU 86 CO 0.41 0.40 0.07 0.79 -1.22 0.00 0.00 177.39 177.85 3cf9 n TRP 87 N -2.83 0.00 -4.62 -1.77 8.01 -0.07 -5.12 117.44 111.05 3cf9 n TRP 87 Ca -0.24 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 55.95 3cf9 n TRP 87 Cb 1.06 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.36 3cf9 n TRP 87 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3cf9 n GLY 88 N 0.44 -0.09 3.57 6.99 0.00 -0.02 -4.22 105.19 111.85 3cf9 n GLY 88 Ca 0.00 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 3cf9 n GLY 88 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3cf9 s PHE 89 N 0.00 2.55 -0.50 1.61 5.36 -1.26 -4.24 117.98 121.50 3cf9 s PHE 89 Ca 0.00 -0.96 0.03 0.00 -0.96 0.00 0.00 56.93 55.04 3cf9 s PHE 89 Cb 0.00 -4.67 0.14 0.00 -0.34 0.00 0.00 43.02 38.16 3cf9 s PHE 89 CO 0.00 -1.88 0.30 0.34 -1.46 0.00 0.00 175.22 172.53 3cf9 s ASP 90 N 4.95 3.78 0.46 6.13 -1.08 -1.26 -4.98 116.67 124.67 3cf9 s ASP 90 Ca 0.50 -2.99 0.13 0.00 -0.52 0.00 0.00 52.55 49.67 3cf9 s ASP 90 Cb 0.01 -1.21 1.03 0.00 -1.46 0.00 0.00 42.92 41.29 3cf9 s ASP 90 CO -0.04 -0.21 2.04 -0.65 0.52 0.00 0.00 175.17 176.83 3cf9 h PRO 91 N 6.30 0.11 0.02 4.34 0.11 -1.91 -0.12 132.00 140.85 3cf9 h PRO 91 Ca 0.04 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.13 3cf9 h PRO 91 Cb 0.88 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 3cf9 h PRO 91 CO 0.56 0.18 -0.01 1.49 -0.21 0.00 0.00 178.00 180.00 3cf9 h GLU 92 N 0.11 -0.03 0.00 1.05 4.81 -1.93 -2.36 114.58 116.23 3cf9 h GLU 92 Ca 0.03 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.14 3cf9 h GLU 92 Cb 0.17 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3cf9 h GLU 92 CO 0.01 -0.02 -0.57 0.82 -0.73 0.00 0.00 179.01 178.52 3cf9 h ILE 93 N -0.03 1.08 -0.11 2.32 2.04 -1.94 -3.21 117.51 117.66 3cf9 h ILE 93 Ca 0.00 -2.24 -0.01 0.00 1.00 0.00 0.00 64.86 63.60 3cf9 h ILE 93 Cb 0.03 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 3cf9 h ILE 93 CO -0.00 0.56 0.01 0.00 0.00 0.00 0.00 178.15 178.72 3cf9 h ALA 94 N 1.43 1.82 0.00 1.87 0.00 -0.76 -1.48 119.26 122.14 3cf9 h ALA 94 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3cf9 h ALA 94 Cb 1.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3cf9 h ALA 94 CO 0.07 0.14 0.00 1.63 0.00 0.00 0.00 179.25 181.10 3cf9 n LYS 95 N -4.46 0.10 -0.29 0.00 5.02 -0.91 -2.63 118.16 115.00 3cf9 n LYS 95 Ca -0.01 0.29 0.11 0.00 -2.02 0.00 0.00 58.31 56.68 3cf9 n LYS 95 Cb 0.13 -1.68 0.28 0.00 -0.02 0.00 0.00 35.03 33.74 3cf9 n LYS 95 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 3cf9 n THR 96 N -1.86 0.76 -4.25 -0.18 5.66 -0.56 -4.95 114.28 108.90 3cf9 n THR 96 Ca 0.03 -0.83 -0.19 0.00 -3.05 0.00 0.00 64.05 60.02 3cf9 n THR 96 Cb 0.23 0.57 -0.11 0.00 -1.55 0.00 0.00 70.33 69.47 3cf9 n THR 96 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 3cf9 s LYS 97 N -1.24 1.05 0.02 1.09 -0.14 -1.08 -0.96 119.74 118.48 3cf9 s LYS 97 Ca 0.42 -1.25 0.01 0.00 -1.36 0.00 0.00 55.97 53.79 3cf9 s LYS 97 Cb 0.23 -0.96 -0.02 0.00 -1.68 0.00 0.00 37.83 35.40 3cf9 s LYS 97 CO 0.30 0.19 -0.05 0.42 -0.76 0.00 0.00 175.35 175.45 3cf9 s ILE 98 N -2.10 0.35 -0.15 2.17 1.01 -0.60 -4.80 121.20 117.09 3cf9 s ILE 98 Ca 0.09 -0.69 -0.17 0.00 0.00 0.00 0.00 60.65 59.88 3cf9 s ILE 98 Cb -0.05 -0.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.98 3cf9 s ILE 98 CO 0.03 -0.23 0.43 -0.69 0.00 0.00 0.00 174.94 174.48 3cf9 s VAL 99 N -0.91 5.21 -0.20 2.92 1.01 -1.26 -1.03 120.40 126.14 3cf9 s VAL 99 Ca -0.07 0.82 -0.01 0.00 0.00 0.00 0.00 61.98 62.72 3cf9 s VAL 99 Cb -0.07 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.56 3cf9 s VAL 99 CO -0.00 0.31 -0.14 -0.31 0.00 0.00 0.00 175.10 174.97 3cf9 s TYR 100 N 0.81 2.87 0.13 5.22 1.51 0.94 -4.97 117.35 123.86 3cf9 s TYR 100 Ca 0.22 -1.41 -0.31 0.00 -1.01 0.00 0.00 57.07 54.56 3cf9 s TYR 100 Cb -0.15 -1.99 -0.10 0.00 -0.11 0.00 0.00 41.96 39.61 3cf9 s TYR 100 CO 0.08 -0.72 1.74 -0.06 -1.11 0.00 0.00 175.55 175.49 3cf9 s PHE 101 N 1.35 2.44 -0.20 2.71 0.08 -1.26 -0.46 117.98 122.65 3cf9 s PHE 101 Ca 0.05 0.19 -0.11 0.00 0.12 0.00 0.00 56.93 57.17 3cf9 s PHE 101 Cb -0.14 -4.10 -0.09 0.00 -0.57 0.00 0.00 43.02 38.13 3cf9 s PHE 101 CO -0.09 -4.40 -0.28 -1.33 -0.10 0.00 0.00 175.22 169.03 3cf9 n MET 102 N 5.16 0.45 -3.98 0.44 2.81 -0.30 -4.93 117.12 116.78 3cf9 n MET 102 Ca 0.17 0.20 -0.09 0.00 -1.81 0.00 0.00 57.70 56.16 3cf9 n MET 102 Cb 0.38 -1.26 -0.10 0.00 -0.71 0.00 0.00 33.22 31.54 3cf9 n MET 102 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 3cf9 s THR 103 N -2.43 0.15 -0.01 2.03 -4.23 -1.10 -5.00 115.64 105.05 3cf9 s THR 103 Ca -0.29 -1.25 0.02 0.00 -1.18 0.00 0.00 61.69 58.99 3cf9 s THR 103 Cb 0.11 -0.93 -0.00 0.00 1.34 0.00 0.00 72.50 73.01 3cf9 s THR 103 CO 0.37 -0.69 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.07 3cf9 s ILE 104 N -2.73 0.53 0.10 2.99 1.01 -1.26 -2.15 121.20 119.69 3cf9 s ILE 104 Ca -0.04 -0.26 -0.12 0.00 0.00 0.00 0.00 60.65 60.23 3cf9 s ILE 104 Cb -0.01 -0.47 0.02 0.00 0.01 0.00 0.00 42.46 42.01 3cf9 s ILE 104 CO -0.05 0.16 0.29 -0.62 0.00 0.00 0.00 174.94 174.71 3cf9 s ASP 105 N 0.03 -0.04 -1.50 3.58 2.15 -0.38 -4.98 116.67 115.52 3cf9 s ASP 105 Ca 0.00 -0.49 -0.04 0.00 0.43 0.00 0.00 52.55 52.45 3cf9 s ASP 105 Cb -0.05 0.40 0.00 0.00 -0.30 0.00 0.00 42.92 42.98 3cf9 s ASP 105 CO -0.00 -0.78 0.51 0.29 -0.17 0.00 0.00 175.17 175.01 3cf9 n LYS 106 N -0.12 -4.28 -3.11 4.34 4.76 -1.26 -1.36 118.16 117.13 3cf9 n LYS 106 Ca -0.16 0.88 -0.39 0.00 -2.87 0.00 0.00 58.31 55.77 3cf9 n LYS 106 Cb 0.63 -5.61 -0.05 0.00 -1.84 0.00 0.00 35.03 28.15 3cf9 n LYS 106 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3cf9 s VAL 107 N -3.13 5.06 -0.03 -0.18 -7.23 -1.26 -4.00 120.40 109.64 3cf9 s VAL 107 Ca 0.25 1.33 0.05 0.00 -1.81 0.00 0.00 61.98 61.81 3cf9 s VAL 107 Cb -0.11 -3.99 -0.01 0.00 0.56 0.00 0.00 36.38 32.83 3cf9 s VAL 107 CO 0.31 0.28 -0.19 -0.54 -0.31 0.00 0.00 175.10 174.65 3cf9 s LYS 108 N 0.66 1.71 -0.38 4.82 1.02 -0.42 -4.96 119.74 122.19 3cf9 s LYS 108 Ca 0.35 -0.68 -0.05 0.00 0.02 0.00 0.00 55.97 55.61 3cf9 s LYS 108 Cb -0.17 -1.58 0.08 0.00 -0.52 0.00 0.00 37.83 35.64 3cf9 s LYS 108 CO 0.17 0.36 0.17 -0.06 -0.92 0.00 0.00 175.35 175.06 3cf9 s PHE 109 N -0.28 3.42 -0.21 3.18 2.99 -1.26 -1.88 117.98 123.94 3cf9 s PHE 109 Ca 0.03 -1.96 -0.09 0.00 0.00 0.00 0.00 56.93 54.92 3cf9 s PHE 109 Cb -0.09 -2.83 -0.20 0.00 0.00 0.00 0.00 43.02 39.90 3cf9 s PHE 109 CO 0.00 -0.88 0.03 0.54 -0.00 0.00 0.00 175.22 174.91 3cf9 n ARG 110 N 4.71 0.66 -4.29 0.44 1.74 -0.61 -4.96 116.66 114.34 3cf9 n ARG 110 Ca -0.08 0.29 -0.20 0.00 -0.77 0.00 0.00 57.85 57.09 3cf9 n ARG 110 Cb 0.42 -1.62 -0.16 0.00 -1.02 0.00 0.00 32.46 30.08 3cf9 n ARG 110 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3cf9 s ILE 111 N -2.50 0.67 0.42 0.55 1.01 -1.09 -5.05 121.20 115.21 3cf9 s ILE 111 Ca -0.30 -0.25 -0.23 0.00 0.00 0.00 0.00 60.65 59.87 3cf9 s ILE 111 Cb 0.09 -0.64 -0.08 0.00 0.01 0.00 0.00 42.46 41.83 3cf9 s ILE 111 CO 0.63 0.24 1.08 -2.16 0.00 0.00 0.00 174.94 174.74 3cf9 s PRO 112 N 0.58 4.03 -0.19 2.79 0.04 -1.26 -4.79 135.00 136.20 3cf9 s PRO 112 Ca -0.09 1.58 -0.08 0.00 0.04 0.00 0.00 61.00 62.46 3cf9 s PRO 112 Cb -0.12 -2.48 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 3cf9 s PRO 112 CO 0.01 -0.28 0.07 0.08 0.04 0.00 0.00 177.00 176.92 3cf9 s VAL 113 N -1.64 4.84 0.14 -0.36 1.01 -1.26 -5.02 120.40 118.10 3cf9 s VAL 113 Ca 0.60 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.62 3cf9 s VAL 113 Cb -0.24 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 3cf9 s VAL 113 CO 0.29 0.45 -0.12 0.42 0.00 0.00 0.00 175.10 176.15 3cf9 s THR 114 N 0.42 1.27 0.05 3.92 -4.23 -1.26 0.46 115.64 116.26 3cf9 s THR 114 Ca 0.04 -1.93 -0.38 0.00 -1.18 0.00 0.00 61.69 58.24 3cf9 s THR 114 Cb -0.12 -1.72 -0.19 0.00 1.34 0.00 0.00 72.50 71.80 3cf9 s THR 114 CO 0.00 -0.61 1.05 -2.65 -0.54 0.00 0.00 174.62 171.88 3cf9 n PRO 115 N 0.08 0.26 0.00 3.99 -0.02 -1.26 -1.74 135.00 136.31 3cf9 n PRO 115 Ca -0.12 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 3cf9 n PRO 115 Cb 0.59 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 3cf9 n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cf9 n GLY 116 N 1.75 0.10 3.80 -1.23 0.00 0.30 -4.92 105.19 104.99 3cf9 n GLY 116 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3cf9 n GLY 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3cf9 s ASP 117 N -2.04 7.20 -0.52 1.61 1.01 -0.71 -4.91 116.67 118.31 3cf9 s ASP 117 Ca 0.00 1.54 -0.15 0.00 0.71 0.00 0.00 52.55 54.64 3cf9 s ASP 117 Cb 0.00 -2.46 0.11 0.00 1.01 0.00 0.00 42.92 41.58 3cf9 s ASP 117 CO 0.00 0.08 0.46 -0.60 0.21 0.00 0.00 175.17 175.32 3cf9 s ARG 118 N -1.71 2.96 -0.70 8.23 3.52 -1.26 -0.56 118.95 129.43 3cf9 s ARG 118 Ca 0.41 -1.62 -0.26 0.00 -0.13 0.00 0.00 55.73 54.14 3cf9 s ARG 118 Cb -0.19 -4.23 0.04 0.00 -1.56 0.00 0.00 34.95 29.01 3cf9 s ARG 118 CO 0.23 -1.24 1.17 -1.17 -0.81 0.00 0.00 175.30 173.48 3cf9 s LEU 119 N 1.60 3.56 -0.19 -0.88 2.96 0.54 -4.44 118.68 121.83 3cf9 s LEU 119 Ca 0.03 -0.58 -0.17 0.00 -0.22 0.00 0.00 54.13 53.19 3cf9 s LEU 119 Cb -0.28 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.82 3cf9 s LEU 119 CO 0.04 -1.69 0.46 -0.70 -1.32 0.00 0.00 176.35 173.14 3cf9 s GLU 120 N 5.16 4.19 -0.26 1.98 2.12 0.09 -0.28 118.70 131.70 3cf9 s GLU 120 Ca 0.31 0.32 -0.10 0.00 0.36 0.00 0.00 54.97 55.86 3cf9 s GLU 120 Cb -0.11 -3.54 -0.05 0.00 0.26 0.00 0.00 34.13 30.69 3cf9 s GLU 120 CO 0.14 -0.07 0.16 0.71 -0.54 0.00 0.00 175.26 175.66 3cf9 s TYR 121 N 1.41 3.25 -0.30 5.30 1.51 0.17 0.20 117.35 128.88 3cf9 s TYR 121 Ca 0.22 0.12 -0.01 0.00 -1.01 0.00 0.00 57.07 56.40 3cf9 s TYR 121 Cb -0.15 -2.31 0.05 0.00 -0.11 0.00 0.00 41.96 39.45 3cf9 s TYR 121 CO 0.09 -0.06 -0.02 -1.01 -1.11 0.00 0.00 175.55 173.44 3cf9 s HIS 122 N 1.38 3.29 -0.00 2.71 3.76 0.06 -1.19 115.29 125.30 3cf9 s HIS 122 Ca 0.07 -2.01 0.06 0.00 -0.15 0.00 0.00 55.06 53.03 3cf9 s HIS 122 Cb -0.15 -2.12 -0.02 0.00 1.11 0.00 0.00 32.58 31.40 3cf9 s HIS 122 CO 0.07 -0.83 -0.18 -0.51 -0.85 0.00 0.00 174.74 172.44 3cf9 s LEU 123 N 1.21 2.06 0.07 0.89 1.02 -0.17 -1.68 118.68 122.08 3cf9 s LEU 123 Ca -0.05 -0.36 0.08 0.00 0.02 0.00 0.00 54.13 53.82 3cf9 s LEU 123 Cb -0.20 -0.91 -0.03 0.00 0.02 0.00 0.00 46.19 45.07 3cf9 s LEU 123 CO -0.02 0.20 -0.22 -1.83 0.02 0.00 0.00 176.35 174.50 3cf9 s GLU 124 N -0.58 1.35 -0.15 1.70 -1.05 -0.59 -0.62 118.70 118.76 3cf9 s GLU 124 Ca 0.07 -1.08 -0.29 0.00 -0.15 0.00 0.00 54.97 53.51 3cf9 s GLU 124 Cb -0.07 -1.57 -0.01 0.00 -0.44 0.00 0.00 34.13 32.04 3cf9 s GLU 124 CO -0.00 0.39 1.22 0.08 0.95 0.00 0.00 175.26 177.89 3cf9 s VAL 125 N -0.95 4.34 -0.12 1.83 1.01 0.56 -1.78 120.40 125.30 3cf9 s VAL 125 Ca 0.08 1.63 -0.07 0.00 0.00 0.00 0.00 61.98 63.61 3cf9 s VAL 125 Cb -0.09 -4.05 -0.26 0.00 0.00 0.00 0.00 36.38 31.97 3cf9 s VAL 125 CO 0.03 -0.11 0.38 0.18 0.00 0.00 0.00 175.10 175.58 3cf9 n LEU 126 N 6.28 2.62 -3.64 3.92 4.77 0.18 -4.92 117.00 126.20 3cf9 n LEU 126 Ca 0.13 0.22 -0.14 0.00 -0.03 0.00 0.00 56.01 56.19 3cf9 n LEU 126 Cb 0.45 -1.12 -0.07 0.00 -2.33 0.00 0.00 43.42 40.34 3cf9 n LEU 126 CO 0.55 0.84 0.37 -0.75 -1.33 0.00 0.00 177.39 177.07 3cf9 s LYS 127 N -2.55 0.81 -0.08 3.23 2.20 -0.88 -5.01 119.74 117.45 3cf9 s LYS 127 Ca -0.22 0.84 -0.06 0.00 -0.36 0.00 0.00 55.97 56.16 3cf9 s LYS 127 Cb 0.06 0.39 0.03 0.00 -1.51 0.00 0.00 37.83 36.81 3cf9 s LYS 127 CO 0.77 -0.12 0.21 -3.38 -0.36 0.00 0.00 175.35 172.47 3cf9 s HIS 128 N 0.16 -0.25 -0.12 4.03 -3.43 -1.26 0.77 115.29 115.20 3cf9 s HIS 128 Ca -0.01 0.61 -0.04 0.00 -0.80 0.00 0.00 55.06 54.81 3cf9 s HIS 128 Cb -0.04 0.05 0.06 0.00 -1.43 0.00 0.00 32.58 31.22 3cf9 s HIS 128 CO 0.02 -0.15 0.21 -1.59 -2.00 0.00 0.00 174.74 171.23 3cf9 s LYS 129 N 0.56 0.10 7.62 -0.38 -2.85 -0.59 -5.03 119.74 119.17 3cf9 s LYS 129 Ca -0.04 0.60 0.00 0.00 -1.00 0.00 0.00 55.97 55.53 3cf9 s LYS 129 Cb -0.05 -0.28 0.00 0.00 -2.06 0.00 0.00 37.83 35.44 3cf9 s LYS 129 CO -0.03 -0.34 0.00 0.41 0.10 0.00 0.00 175.35 175.49 3cf9 n GLY 130 N 5.34 4.09 0.07 0.59 0.00 -1.26 -1.93 105.19 112.09 3cf9 n GLY 130 Ca -0.05 0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.18 3cf9 n GLY 130 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3cf9 n MET 131 N 14.00 0.24 -2.90 1.61 2.81 -1.26 -4.81 117.12 126.81 3cf9 n MET 131 Ca 0.00 0.12 -0.43 0.00 -1.81 0.00 0.00 57.70 55.59 3cf9 n MET 131 Cb 0.00 -1.70 -0.05 0.00 -0.71 0.00 0.00 33.22 30.76 3cf9 n MET 131 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3cf9 s ILE 132 N -3.12 4.65 -0.09 2.02 -1.09 -0.81 -2.20 121.20 120.55 3cf9 s ILE 132 Ca 0.09 0.87 0.04 0.00 -2.23 0.00 0.00 60.65 59.42 3cf9 s ILE 132 Cb 0.14 -4.29 -0.00 0.00 -1.58 0.00 0.00 42.46 36.73 3cf9 s ILE 132 CO 0.66 -0.56 -0.23 0.26 -1.23 0.00 0.00 174.94 173.84 3cf9 s TRP 133 N 3.32 2.47 -0.23 3.97 0.52 -0.13 -1.54 118.94 127.32 3cf9 s TRP 133 Ca 0.34 -0.98 -0.00 0.00 0.02 0.00 0.00 56.10 55.48 3cf9 s TRP 133 Cb -0.12 -1.65 0.03 0.00 -1.15 0.00 0.00 33.47 30.57 3cf9 s TRP 133 CO 0.20 -0.39 -0.11 -1.14 0.02 0.00 0.00 176.95 175.53 3cf9 s GLN 134 N 0.30 2.78 0.20 4.98 0.74 0.23 -0.40 119.66 128.48 3cf9 s GLN 134 Ca -0.17 -1.00 0.10 0.00 0.05 0.00 0.00 55.36 54.34 3cf9 s GLN 134 Cb -0.17 -2.86 -0.04 0.00 1.10 0.00 0.00 33.01 31.04 3cf9 s GLN 134 CO 0.08 -0.38 -0.20 0.14 -0.55 0.00 0.00 175.29 174.38 3cf9 s VAL 135 N 1.28 2.11 -0.01 1.34 -7.23 -0.00 0.49 120.40 118.37 3cf9 s VAL 135 Ca -0.00 -2.06 -0.20 0.00 -1.81 0.00 0.00 61.98 57.91 3cf9 s VAL 135 Cb -0.16 -2.03 0.04 0.00 0.56 0.00 0.00 36.38 34.79 3cf9 s VAL 135 CO -0.07 -0.28 0.43 -0.83 -0.31 0.00 0.00 175.10 174.04 3cf9 s GLY 136 N -2.86 -0.29 0.00 2.32 0.00 -0.73 -0.60 107.32 105.16 3cf9 s GLY 136 Ca 0.20 0.59 0.00 0.00 0.00 0.00 0.00 44.72 45.52 3cf9 s GLY 136 CO 0.09 0.33 0.00 0.61 0.00 0.00 0.00 173.10 174.13 3cf9 n GLY 137 N 1.01 -0.64 3.23 0.20 0.00 -0.32 -1.54 105.19 107.13 3cf9 n GLY 137 Ca -0.20 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 3cf9 n GLY 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cf9 s THR 138 N -3.94 1.14 -0.13 2.61 -4.23 -0.68 -1.75 115.64 108.67 3cf9 s THR 138 Ca 0.00 -1.88 -0.02 0.00 -1.18 0.00 0.00 61.69 58.61 3cf9 s THR 138 Cb 0.00 -1.65 -0.03 0.00 1.34 0.00 0.00 72.50 72.16 3cf9 s THR 138 CO 0.00 -0.63 -0.04 0.00 -0.54 0.00 0.00 174.62 173.41 3cf9 s ALA 139 N -2.84 3.03 0.00 3.99 0.00 0.35 -0.76 121.76 125.54 3cf9 s ALA 139 Ca 0.12 -0.83 0.05 0.00 0.00 0.00 0.00 51.96 51.30 3cf9 s ALA 139 Cb -0.00 -1.47 -0.01 0.00 0.00 0.00 0.00 23.12 21.63 3cf9 s ALA 139 CO 0.01 0.34 -0.16 -0.65 0.00 0.00 0.00 175.76 175.30 3cf9 s GLN 140 N -0.06 1.22 -0.13 0.00 -0.21 0.13 0.13 119.66 120.74 3cf9 s GLN 140 Ca 0.02 -0.63 0.00 0.00 0.02 0.00 0.00 55.36 54.77 3cf9 s GLN 140 Cb -0.13 -1.20 0.02 0.00 1.00 0.00 0.00 33.01 32.70 3cf9 s GLN 140 CO 0.03 0.32 -0.12 0.08 -2.12 0.00 0.00 175.29 173.47 3cf9 s VAL 141 N -0.49 1.39 -1.29 1.09 1.01 -0.36 -0.73 120.40 121.01 3cf9 s VAL 141 Ca 0.05 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 3cf9 s VAL 141 Cb -0.07 -1.32 0.00 0.00 0.00 0.00 0.00 36.38 34.99 3cf9 s VAL 141 CO -0.00 0.43 0.58 -0.67 0.00 0.00 0.00 175.10 175.43 3cf9 n ASP 142 N 4.70 -2.51 0.00 3.32 4.64 -1.26 -1.91 116.55 123.53 3cf9 n ASP 142 Ca -0.16 -1.04 0.00 0.00 -1.38 0.00 0.00 54.79 52.21 3cf9 n ASP 142 Cb 0.50 -3.05 0.00 0.00 -1.04 0.00 0.00 41.12 37.54 3cf9 n ASP 142 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3cf9 n GLY 143 N -1.89 0.22 3.61 0.27 0.00 -1.26 -4.99 105.19 101.15 3cf9 n GLY 143 Ca -0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 3cf9 n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cf9 s LYS 144 N -1.09 2.98 -0.33 1.61 1.02 -0.80 -5.07 119.74 118.06 3cf9 s LYS 144 Ca 0.00 -0.49 -0.29 0.00 0.02 0.00 0.00 55.97 55.22 3cf9 s LYS 144 Cb 0.00 -2.72 -0.01 0.00 -0.52 0.00 0.00 37.83 34.58 3cf9 s LYS 144 CO 0.00 0.62 1.63 0.08 -0.92 0.00 0.00 175.35 176.76 3cf9 s VAL 145 N -0.67 3.67 -0.07 3.17 1.01 -1.26 -1.23 120.40 125.02 3cf9 s VAL 145 Ca 0.10 0.70 0.11 0.00 0.00 0.00 0.00 61.98 62.89 3cf9 s VAL 145 Cb -0.12 -3.84 -0.24 0.00 0.00 0.00 0.00 36.38 32.19 3cf9 s VAL 145 CO 0.02 -0.49 0.55 0.52 0.00 0.00 0.00 175.10 175.70 3cf9 n VAL 146 N 7.08 1.60 -3.48 2.92 0.31 0.12 -4.49 118.33 122.40 3cf9 n VAL 146 Ca 0.20 -0.79 -0.11 0.00 -0.01 0.00 0.00 64.34 63.63 3cf9 n VAL 146 Cb 0.47 -1.05 -0.02 0.00 -0.91 0.00 0.00 33.84 32.32 3cf9 n VAL 146 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3cf9 s ALA 147 N -2.58 -1.57 0.05 3.52 0.00 -0.98 -1.58 121.76 118.62 3cf9 s ALA 147 Ca -0.07 0.42 0.03 0.00 0.00 0.00 0.00 51.96 52.33 3cf9 s ALA 147 Cb 0.08 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 24.03 3cf9 s ALA 147 CO 0.82 -0.80 -0.09 -1.21 0.00 0.00 0.00 175.76 174.47 3cf9 s GLU 148 N -3.73 0.60 -0.03 0.00 2.02 -0.79 -0.49 118.70 116.27 3cf9 s GLU 148 Ca 0.03 -0.79 -0.29 0.00 0.02 0.00 0.00 54.97 53.94 3cf9 s GLU 148 Cb -0.02 -0.43 0.09 0.00 0.10 0.00 0.00 34.13 33.87 3cf9 s GLU 148 CO -0.10 0.09 0.78 0.00 0.02 0.00 0.00 175.26 176.04 3cf9 s ALA 149 N -1.32 -1.79 -0.00 5.21 0.00 -0.72 -1.31 121.76 121.84 3cf9 s ALA 149 Ca -0.08 1.18 0.06 0.00 0.00 0.00 0.00 51.96 53.13 3cf9 s ALA 149 Cb -0.10 0.06 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 3cf9 s ALA 149 CO 0.01 -0.48 -0.19 -1.21 0.00 0.00 0.00 175.76 173.89 3cf9 s GLU 150 N -1.97 1.47 -0.01 0.00 2.02 -0.47 -1.18 118.70 118.58 3cf9 s GLU 150 Ca -0.04 -0.72 -0.15 0.00 0.02 0.00 0.00 54.97 54.07 3cf9 s GLU 150 Cb -0.00 -1.46 0.02 0.00 0.10 0.00 0.00 34.13 32.79 3cf9 s GLU 150 CO 0.00 0.39 0.33 -0.48 0.02 0.00 0.00 175.26 175.52 3cf9 s LEU 151 N -0.60 0.79 -0.08 1.80 0.05 0.24 -1.25 118.68 119.61 3cf9 s LEU 151 Ca 0.07 0.08 0.03 0.00 0.05 0.00 0.00 54.13 54.36 3cf9 s LEU 151 Cb -0.08 1.34 -0.02 0.00 -2.05 0.00 0.00 46.19 45.38 3cf9 s LEU 151 CO -0.00 -0.47 -0.17 -0.75 -0.55 0.00 0.00 176.35 174.40 3cf9 s LYS 152 N -1.45 2.85 0.22 1.48 2.20 -0.91 -0.82 119.74 123.30 3cf9 s LYS 152 Ca -0.13 -0.76 0.04 0.00 -0.36 0.00 0.00 55.97 54.76 3cf9 s LYS 152 Cb -0.05 -2.40 -0.05 0.00 -1.51 0.00 0.00 37.83 33.82 3cf9 s LYS 152 CO 0.04 0.40 -0.02 0.00 -0.36 0.00 0.00 175.35 175.40 3cf9 s ALA 153 N -0.15 1.77 -0.05 3.13 0.00 0.47 -1.15 121.76 125.77 3cf9 s ALA 153 Ca -0.02 -1.72 0.01 0.00 0.00 0.00 0.00 51.96 50.23 3cf9 s ALA 153 Cb -0.14 0.40 0.02 0.00 0.00 0.00 0.00 23.12 23.40 3cf9 s ALA 153 CO 0.04 -0.21 -0.07 1.41 0.00 0.00 0.00 175.76 176.92 3cf9 s MET 154 N -3.84 1.13 -0.32 0.00 1.75 0.40 -0.95 119.30 117.47 3cf9 s MET 154 Ca 0.26 -0.21 -0.25 0.00 -1.25 0.00 0.00 55.69 54.25 3cf9 s MET 154 Cb 0.05 -1.05 0.01 0.00 2.84 0.00 0.00 34.83 36.68 3cf9 s MET 154 CO 0.07 -0.05 0.86 0.42 -0.65 0.00 0.00 175.02 175.67 3cf9 s ILE 155 N 0.87 4.71 0.07 10.11 1.01 -0.93 -0.04 121.20 136.99 3cf9 s ILE 155 Ca -0.12 1.29 0.06 0.00 0.00 0.00 0.00 60.65 61.89 3cf9 s ILE 155 Cb -0.15 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 3cf9 s ILE 155 CO 0.01 -0.33 -0.10 0.00 0.00 0.00 0.00 174.94 174.51 3cf9 s ALA 156 N 3.16 2.92 0.29 9.38 0.00 -0.20 -4.82 121.76 132.50 3cf9 s ALA 156 Ca 0.36 -1.18 -0.30 0.00 0.00 0.00 0.00 51.96 50.84 3cf9 s ALA 156 Cb -0.13 -0.94 -0.12 0.00 0.00 0.00 0.00 23.12 21.93 3cf9 s ALA 156 CO 0.14 0.63 1.50 0.39 0.00 0.00 0.00 175.76 178.41 3cf9 n GLU 157 N 1.05 2.43 0.27 0.00 -0.58 -1.26 -1.55 120.64 121.01 3cf9 n GLU 157 Ca -0.14 0.86 0.16 0.00 -0.42 0.00 0.00 57.16 57.63 3cf9 n GLU 157 Cb 0.52 -2.59 0.67 0.00 -0.57 0.00 0.00 31.44 29.48 3cf9 n GLU 157 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 3cf9 h ARG 158 N 4.29 0.00 0.00 3.49 2.43 -1.36 -3.45 114.38 119.78 3cf9 h ARG 158 Ca -0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3cf9 h ARG 158 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 3cf9 h ARG 158 CO 0.76 0.03 0.00 0.39 -1.51 0.00 0.00 179.97 179.64