#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b55 s ALA 3 N 0.00 3.27 -0.20 0.00 0.00 -1.26 -5.05 121.76 118.52 1b55 s ALA 3 Ca 0.00 -0.23 -0.12 0.00 0.00 0.00 0.00 51.96 51.61 1b55 s ALA 3 Cb 0.00 -2.81 -0.05 0.00 0.00 0.00 0.00 23.12 20.26 1b55 s ALA 3 CO 0.00 -0.33 0.24 0.08 0.00 0.00 0.00 175.76 175.75 1b55 s VAL 4 N -2.74 5.32 -0.03 0.00 1.01 -1.26 -4.24 120.40 118.46 1b55 s VAL 4 Ca 0.52 0.38 -0.05 0.00 0.00 0.00 0.00 61.98 62.83 1b55 s VAL 4 Cb -0.10 -3.57 -0.28 0.00 0.00 0.00 0.00 36.38 32.42 1b55 s VAL 4 CO 0.42 0.36 0.72 0.40 0.00 0.00 0.00 175.10 177.00 1b55 h ILE 5 N 4.86 0.99 -2.92 2.22 2.04 -0.29 -3.48 117.51 120.93 1b55 h ILE 5 Ca -0.39 -2.63 -0.06 0.00 1.00 0.00 0.00 64.86 62.77 1b55 h ILE 5 Cb 1.16 2.71 -0.16 0.00 -0.74 0.00 0.00 36.82 39.80 1b55 h ILE 5 CO 0.72 0.82 -0.02 -0.76 0.00 0.00 0.00 178.15 178.91 1b55 s LEU 6 N -7.05 0.13 -0.22 1.44 1.43 -1.18 -4.99 118.68 108.23 1b55 s LEU 6 Ca -0.13 0.06 -0.09 0.00 -1.03 0.00 0.00 54.13 52.95 1b55 s LEU 6 Cb 0.06 1.97 0.09 0.00 0.03 0.00 0.00 46.19 48.34 1b55 s LEU 6 CO 0.84 -0.72 0.49 -0.70 0.23 0.00 0.00 176.35 176.49 1b55 s GLU 7 N -2.60 0.43 0.27 1.70 2.12 -1.26 -1.52 118.70 117.83 1b55 s GLU 7 Ca -0.04 1.07 -0.12 0.00 0.36 0.00 0.00 54.97 56.24 1b55 s GLU 7 Cb -0.01 0.32 -0.00 0.00 0.26 0.00 0.00 34.13 34.71 1b55 s GLU 7 CO -0.03 -0.21 0.50 -1.12 -0.54 0.00 0.00 175.26 173.86 1b55 s SER 8 N 2.27 0.03 -0.16 -1.70 0.01 -1.02 -5.01 113.70 108.11 1b55 s SER 8 Ca -0.05 -1.00 -0.01 0.00 1.31 0.00 0.00 55.95 56.19 1b55 s SER 8 Cb -0.10 0.61 -0.01 0.00 0.21 0.00 0.00 66.02 66.73 1b55 s SER 8 CO -0.15 -1.19 -0.12 -0.63 0.41 0.00 0.00 173.24 171.56 1b55 s ILE 9 N -3.81 2.98 0.36 1.44 1.01 -1.26 -2.20 121.20 119.72 1b55 s ILE 9 Ca 0.23 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.25 1b55 s ILE 9 Cb -0.01 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 1b55 s ILE 9 CO 0.10 0.50 0.11 -0.36 0.00 0.00 0.00 174.94 175.30 1b55 s PHE 10 N 0.76 1.79 -0.27 3.97 0.08 -0.64 -4.75 117.98 118.92 1b55 s PHE 10 Ca -0.05 -1.21 -0.01 0.00 0.12 0.00 0.00 56.93 55.78 1b55 s PHE 10 Cb -0.15 -1.13 0.04 0.00 -0.57 0.00 0.00 43.02 41.21 1b55 s PHE 10 CO 0.01 -0.26 -0.04 -1.17 -0.10 0.00 0.00 175.22 173.66 1b55 s LEU 11 N -3.52 3.46 0.05 -0.37 2.96 -0.98 -0.50 118.68 119.78 1b55 s LEU 11 Ca 0.30 -1.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.15 1b55 s LEU 11 Cb 0.05 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 45.03 1b55 s LEU 11 CO 0.15 -0.18 0.14 -1.59 -1.32 0.00 0.00 176.35 173.55 1b55 s LYS 12 N 1.28 3.16 0.16 1.98 -2.85 -0.99 0.30 119.74 122.78 1b55 s LYS 12 Ca -0.03 -0.54 0.01 0.00 -1.00 0.00 0.00 55.97 54.41 1b55 s LYS 12 Cb -0.18 -2.89 -0.04 0.00 -2.06 0.00 0.00 37.83 32.66 1b55 s LYS 12 CO -0.03 0.60 0.32 0.50 0.10 0.00 0.00 175.35 176.84 1b55 s ARG 13 N -2.30 3.48 0.20 1.78 3.52 -0.76 -1.43 118.95 123.45 1b55 s ARG 13 Ca 0.30 -0.45 -0.31 0.00 -0.13 0.00 0.00 55.73 55.14 1b55 s ARG 13 Cb -0.12 -2.92 -0.10 0.00 -1.56 0.00 0.00 34.95 30.25 1b55 s ARG 13 CO 0.23 0.48 1.55 0.45 -0.81 0.00 0.00 175.30 177.19 1b55 s SER 14 N -3.09 6.57 0.44 -2.12 0.15 0.13 -4.68 113.70 111.11 1b55 s SER 14 Ca 0.36 2.67 0.29 0.00 0.70 0.00 0.00 55.95 59.98 1b55 s SER 14 Cb -0.11 -2.61 1.09 0.00 -1.71 0.00 0.00 66.02 62.68 1b55 s SER 14 CO 0.28 -0.81 1.85 1.56 1.20 0.00 0.00 173.24 177.33 1b55 h GLN 15 N 6.15 0.00 -6.33 5.44 4.20 -1.90 -3.45 115.11 119.23 1b55 h GLN 15 Ca -0.44 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 57.80 1b55 h GLN 15 Cb 1.21 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.95 1b55 h GLN 15 CO 0.87 0.00 -0.79 1.04 -0.67 0.00 0.00 178.83 179.28 1b55 n GLN 16 N -2.84 -4.94 -0.33 1.46 6.02 -1.26 -4.83 117.38 110.66 1b55 n GLN 16 Ca 0.02 0.56 -0.04 0.00 -0.01 0.00 0.00 57.00 57.53 1b55 n GLN 16 Cb 0.33 -5.30 0.09 0.00 1.02 0.00 0.00 30.24 26.38 1b55 n GLN 16 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1b55 h LYS 17 N -1.96 1.25 -5.94 -1.09 6.56 -1.95 -3.41 116.57 110.04 1b55 h LYS 17 Ca -0.59 -0.16 -0.60 0.00 -1.06 0.00 0.00 60.65 58.24 1b55 h LYS 17 Cb 1.37 -0.24 -0.06 0.00 -0.57 0.00 0.00 32.23 32.73 1b55 h LYS 17 CO 0.66 0.93 -0.20 0.15 -2.06 0.00 0.00 179.45 178.92 1b55 s LYS 18 N -5.80 4.00 0.28 3.15 1.02 -1.26 -4.99 119.74 116.14 1b55 s LYS 18 Ca -0.13 0.40 -0.03 0.00 0.02 0.00 0.00 55.97 56.24 1b55 s LYS 18 Cb 0.17 -3.26 0.59 0.00 -0.52 0.00 0.00 37.83 34.81 1b55 s LYS 18 CO 0.83 0.59 1.59 0.87 -0.92 0.00 0.00 175.35 178.32 1b55 h LYS 19 N 5.10 0.04 0.00 1.68 1.57 -2.01 -0.87 116.57 122.08 1b55 h LYS 19 Ca -0.50 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1b55 h LYS 19 Cb 1.21 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1b55 h LYS 19 CO 0.64 0.03 0.00 -2.37 -0.57 0.00 0.00 179.45 177.18 1b55 n THR 20 N -5.45 0.00 -2.93 -0.16 5.66 -1.26 -4.86 114.28 105.28 1b55 n THR 20 Ca 0.19 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.79 1b55 n THR 20 Cb 0.62 -0.54 -0.05 0.00 -1.55 0.00 0.00 70.33 68.80 1b55 n THR 20 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1b55 s SER 21 N -1.96 7.36 0.62 1.09 0.01 -0.33 -5.05 113.70 115.43 1b55 s SER 21 Ca 0.40 1.62 -0.13 0.00 1.31 0.00 0.00 55.95 59.14 1b55 s SER 21 Cb 0.18 -2.51 -0.03 0.00 0.21 0.00 0.00 66.02 63.87 1b55 s SER 21 CO 0.31 0.09 1.04 -2.16 0.41 0.00 0.00 173.24 172.92 1b55 s PRO 22 N -0.58 3.41 -0.52 12.44 0.04 -1.26 -4.87 135.00 143.67 1b55 s PRO 22 Ca 0.39 0.95 -0.20 0.00 0.04 0.00 0.00 61.00 62.18 1b55 s PRO 22 Cb -0.22 -2.05 0.06 0.00 0.04 0.00 0.00 34.50 32.32 1b55 s PRO 22 CO 0.26 -0.72 0.68 -1.17 0.04 0.00 0.00 177.00 176.09 1b55 s LEU 23 N -4.92 4.84 0.23 -3.56 2.96 -1.26 -4.69 118.68 112.28 1b55 s LEU 23 Ca 0.58 -0.84 -0.09 0.00 -0.22 0.00 0.00 54.13 53.57 1b55 s LEU 23 Cb -0.13 -2.50 -0.02 0.00 0.50 0.00 0.00 46.19 44.05 1b55 s LEU 23 CO 0.46 -0.95 0.35 0.54 -1.32 0.00 0.00 176.35 175.43 1b55 s ASN 24 N 2.74 -0.01 0.05 3.68 2.20 -1.26 -4.92 114.94 117.42 1b55 s ASN 24 Ca 0.17 -1.08 0.06 0.00 -0.94 0.00 0.00 52.86 51.08 1b55 s ASN 24 Cb -0.18 0.51 -0.03 0.00 -2.00 0.00 0.00 41.25 39.54 1b55 s ASN 24 CO 0.13 -1.03 -0.13 -0.36 -2.94 0.00 0.00 177.10 172.76 1b55 s PHE 25 N -4.06 2.68 -0.00 1.54 0.40 -1.26 0.21 117.98 117.49 1b55 s PHE 25 Ca 0.28 -0.18 0.03 0.00 -0.60 0.00 0.00 56.93 56.46 1b55 s PHE 25 Cb 0.02 -1.49 -0.01 0.00 0.51 0.00 0.00 43.02 42.05 1b55 s PHE 25 CO 0.10 0.33 -0.10 0.15 0.70 0.00 0.00 175.22 176.39 1b55 s LYS 26 N -1.63 0.82 -0.01 0.44 -0.14 -0.51 -4.96 119.74 113.74 1b55 s LYS 26 Ca 0.17 -0.42 -0.29 0.00 -1.36 0.00 0.00 55.97 54.07 1b55 s LYS 26 Cb -0.11 -0.79 -0.03 0.00 -1.68 0.00 0.00 37.83 35.22 1b55 s LYS 26 CO 0.08 0.21 0.92 0.15 -0.76 0.00 0.00 175.35 175.95 1b55 s LYS 27 N -0.38 4.53 0.02 1.68 1.02 -1.26 -2.35 119.74 123.00 1b55 s LYS 27 Ca 0.03 1.30 0.00 0.00 0.02 0.00 0.00 55.97 57.32 1b55 s LYS 27 Cb -0.05 -3.46 -0.02 0.00 -0.52 0.00 0.00 37.83 33.79 1b55 s LYS 27 CO -0.00 -0.03 -0.03 1.03 -0.92 0.00 0.00 175.35 175.40 1b55 s ARG 28 N 0.97 0.28 -0.33 1.68 1.81 0.35 -4.52 118.95 119.19 1b55 s ARG 28 Ca 0.49 -0.55 -0.22 0.00 -1.72 0.00 0.00 55.73 53.73 1b55 s ARG 28 Cb -0.20 0.09 0.00 0.00 -0.45 0.00 0.00 34.95 34.39 1b55 s ARG 28 CO 0.26 -0.04 0.72 -1.17 -0.68 0.00 0.00 175.30 174.39 1b55 s LEU 29 N -1.30 4.14 -0.09 2.53 2.96 0.62 -1.62 118.68 125.92 1b55 s LEU 29 Ca -0.14 0.44 -0.14 0.00 -0.22 0.00 0.00 54.13 54.07 1b55 s LEU 29 Cb -0.09 -2.95 -0.05 0.00 0.50 0.00 0.00 46.19 43.60 1b55 s LEU 29 CO -0.01 -0.61 0.34 -0.36 -1.32 0.00 0.00 176.35 174.40 1b55 s PHE 30 N 2.86 3.59 0.39 5.38 0.40 -0.93 -0.58 117.98 129.09 1b55 s PHE 30 Ca 0.29 0.78 0.08 0.00 -0.60 0.00 0.00 56.93 57.48 1b55 s PHE 30 Cb -0.14 -2.29 -0.07 0.00 0.51 0.00 0.00 43.02 41.02 1b55 s PHE 30 CO 0.14 0.46 -0.00 -0.51 0.70 0.00 0.00 175.22 176.01 1b55 s LEU 31 N -0.33 2.87 -0.20 -0.37 1.43 0.91 -2.44 118.68 120.56 1b55 s LEU 31 Ca 0.20 -1.26 -0.05 0.00 -1.03 0.00 0.00 54.13 52.00 1b55 s LEU 31 Cb -0.15 -1.02 0.10 0.00 0.03 0.00 0.00 46.19 45.15 1b55 s LEU 31 CO 0.08 -0.37 0.36 -0.22 0.23 0.00 0.00 176.35 176.43 1b55 s LEU 32 N -3.70 -0.53 0.39 1.79 2.96 -0.57 -2.21 118.68 116.81 1b55 s LEU 32 Ca 0.35 0.59 0.08 0.00 -0.22 0.00 0.00 54.13 54.93 1b55 s LEU 32 Cb 0.06 1.07 -0.03 0.00 0.50 0.00 0.00 46.19 47.79 1b55 s LEU 32 CO 0.18 -0.26 0.28 0.42 -1.32 0.00 0.00 176.35 175.66 1b55 s THR 33 N 2.53 2.75 0.65 3.68 -4.23 -0.81 0.54 115.64 120.75 1b55 s THR 33 Ca 0.04 -1.48 0.37 0.00 -1.18 0.00 0.00 61.69 59.43 1b55 s THR 33 Cb -0.13 -3.02 0.37 0.00 1.34 0.00 0.00 72.50 71.05 1b55 s THR 33 CO -0.13 -0.05 2.12 -0.37 -0.54 0.00 0.00 174.62 175.65 1b55 h VAL 34 N 1.23 0.00 0.00 2.29 -1.51 -2.00 -2.90 116.25 113.37 1b55 h VAL 34 Ca -0.43 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.00 1b55 h VAL 34 Cb 1.26 0.81 -0.01 0.00 -2.13 0.00 0.00 31.29 31.23 1b55 h VAL 34 CO 0.61 0.00 -0.38 0.45 -1.23 0.00 0.00 177.57 177.02 1b55 h HIS 35 N 0.00 0.00 -4.59 5.19 3.86 -1.94 -3.42 115.15 114.24 1b55 h HIS 35 Ca 0.00 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.92 1b55 h HIS 35 Cb 0.35 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.69 1b55 h HIS 35 CO 0.00 0.43 -0.53 0.15 0.86 0.00 0.00 177.93 178.84 1b55 s LYS 36 N -2.03 1.41 -0.18 2.45 1.02 -1.10 -0.39 119.74 120.92 1b55 s LYS 36 Ca -0.13 -1.72 0.01 0.00 0.02 0.00 0.00 55.97 54.15 1b55 s LYS 36 Cb 0.01 0.31 0.02 0.00 -0.52 0.00 0.00 37.83 37.65 1b55 s LYS 36 CO 0.29 -0.50 -0.19 -1.17 -0.92 0.00 0.00 175.35 172.86 1b55 s LEU 37 N -3.21 2.15 0.05 3.17 2.96 0.06 -1.92 118.68 121.95 1b55 s LEU 37 Ca 0.38 -0.67 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 1b55 s LEU 37 Cb 0.05 -1.46 -0.03 0.00 0.50 0.00 0.00 46.19 45.26 1b55 s LEU 37 CO 0.17 -0.01 -0.08 -0.94 -1.32 0.00 0.00 176.35 174.16 1b55 s SER 38 N 1.30 0.96 0.00 3.68 1.04 -0.94 0.89 113.70 120.64 1b55 s SER 38 Ca 0.04 -0.62 0.01 0.00 0.48 0.00 0.00 55.95 55.87 1b55 s SER 38 Cb -0.13 0.04 -0.00 0.00 0.10 0.00 0.00 66.02 66.02 1b55 s SER 38 CO -0.12 -0.23 -0.04 -0.72 0.98 0.00 0.00 173.24 173.11 1b55 s TYR 39 N -1.69 0.35 0.15 5.02 1.13 0.06 -0.06 117.35 122.31 1b55 s TYR 39 Ca -0.06 -0.11 0.07 0.00 -1.41 0.00 0.00 57.07 55.56 1b55 s TYR 39 Cb -0.08 -0.22 -0.04 0.00 -1.10 0.00 0.00 41.96 40.52 1b55 s TYR 39 CO -0.00 -0.02 -0.16 0.71 -2.51 0.00 0.00 175.55 173.58 1b55 s TYR 40 N -0.23 1.59 0.56 -3.49 1.51 0.25 0.46 117.35 118.00 1b55 s TYR 40 Ca -0.00 -0.53 -0.20 0.00 -1.01 0.00 0.00 57.07 55.32 1b55 s TYR 40 Cb -0.02 -0.80 -0.05 0.00 -0.11 0.00 0.00 41.96 40.98 1b55 s TYR 40 CO -0.00 0.23 1.25 -2.00 -1.11 0.00 0.00 175.55 173.93 1b55 s GLU 41 N -2.85 3.14 -0.18 -0.62 2.12 0.14 -0.28 118.70 120.18 1b55 s GLU 41 Ca 0.13 1.96 -0.06 0.00 0.36 0.00 0.00 54.97 57.36 1b55 s GLU 41 Cb -0.05 -2.12 -0.04 0.00 0.26 0.00 0.00 34.13 32.19 1b55 s GLU 41 CO 0.05 -1.10 0.03 -0.47 -0.54 0.00 0.00 175.26 173.22 1b55 s TYR 42 N -1.47 3.16 -1.02 5.30 5.04 -1.26 0.65 117.35 127.75 1b55 s TYR 42 Ca 0.73 -0.09 -0.14 0.00 -2.44 0.00 0.00 57.07 55.14 1b55 s TYR 42 Cb -0.34 -2.05 0.21 0.00 0.35 0.00 0.00 41.96 40.13 1b55 s TYR 42 CO 0.38 0.05 1.10 0.34 -1.34 0.00 0.00 175.55 176.08 1b55 s ASP 43 N 0.45 6.96 0.10 4.32 3.68 -0.59 -4.88 116.67 126.72 1b55 s ASP 43 Ca 0.01 -2.87 -0.16 0.00 2.13 0.00 0.00 52.55 51.65 1b55 s ASP 43 Cb -0.13 -2.30 -0.05 0.00 -1.45 0.00 0.00 42.92 38.99 1b55 s ASP 43 CO 0.01 -0.64 1.52 0.15 0.13 0.00 0.00 175.17 176.34 1b55 h PHE 44 N 7.55 0.69 -0.00 -5.34 3.57 -1.94 0.11 116.94 121.57 1b55 h PHE 44 Ca 0.19 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1b55 h PHE 44 Cb 0.95 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 1b55 h PHE 44 CO 1.00 0.77 -0.00 0.93 -2.23 0.00 0.00 178.31 178.79 1b55 h GLU 45 N 0.40 -0.00 0.00 1.11 4.39 -1.97 -0.27 114.58 118.24 1b55 h GLU 45 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1b55 h GLU 45 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1b55 h GLU 45 CO 0.03 -0.00 0.00 0.54 -1.16 0.00 0.00 179.01 178.42 1b55 n ARG 46 N -2.73 0.14 -2.91 2.33 1.74 -1.24 -4.90 116.66 109.09 1b55 n ARG 46 Ca -0.00 0.47 -0.10 0.00 -0.77 0.00 0.00 57.85 57.44 1b55 n ARG 46 Cb 0.00 -1.82 0.04 0.00 -1.02 0.00 0.00 32.46 29.66 1b55 n ARG 46 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1b55 n GLY 47 N -0.48 0.17 3.32 -0.13 0.00 -0.08 -5.05 105.19 102.94 1b55 n GLY 47 Ca 0.01 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 1b55 n GLY 47 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1b55 s ARG 48 N -5.30 1.16 0.48 1.61 1.70 0.17 -4.99 118.95 113.78 1b55 s ARG 48 Ca 0.19 -1.26 -0.22 0.00 -0.47 0.00 0.00 55.73 53.97 1b55 s ARG 48 Cb -0.08 0.36 -0.07 0.00 -0.57 0.00 0.00 34.95 34.58 1b55 s ARG 48 CO 0.35 -0.41 1.15 -0.98 -1.08 0.00 0.00 175.30 174.33 1b55 s ARG 49 N -4.00 3.68 0.00 3.89 1.70 -1.26 -1.54 118.95 121.43 1b55 s ARG 49 Ca 0.20 1.73 0.00 0.00 -0.47 0.00 0.00 55.73 57.20 1b55 s ARG 49 Cb 0.04 -2.32 0.00 0.00 -0.57 0.00 0.00 34.95 32.10 1b55 s ARG 49 CO 0.02 -0.60 0.00 0.41 -1.08 0.00 0.00 175.30 174.05 1b55 n GLY 50 N 0.38 2.81 3.74 3.88 0.00 0.21 -4.75 105.19 111.46 1b55 n GLY 50 Ca 0.08 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 1b55 n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b55 s SER 51 N -0.44 6.77 0.40 1.61 1.04 -1.26 -4.62 113.70 117.21 1b55 s SER 51 Ca 0.00 2.54 -0.25 0.00 0.48 0.00 0.00 55.95 58.71 1b55 s SER 51 Cb 0.00 -2.62 -0.08 0.00 0.10 0.00 0.00 66.02 63.42 1b55 s SER 51 CO 0.00 -0.62 1.20 -0.75 0.98 0.00 0.00 173.24 174.05 1b55 s LYS 52 N -0.24 4.05 0.00 4.02 2.20 -1.26 0.25 119.74 128.76 1b55 s LYS 52 Ca 0.58 1.91 0.00 0.00 -0.36 0.00 0.00 55.97 58.10 1b55 s LYS 52 Cb -0.39 -2.70 0.00 0.00 -1.51 0.00 0.00 37.83 33.22 1b55 s LYS 52 CO 0.41 -0.35 0.47 1.63 -0.36 0.00 0.00 175.35 177.15 1b55 n LYS 53 N 0.11 0.00 0.00 4.03 4.76 0.17 -4.82 118.16 122.41 1b55 n LYS 53 Ca 0.04 -0.56 0.00 0.00 -2.87 0.00 0.00 58.31 54.93 1b55 n LYS 53 Cb 0.46 -0.84 0.00 0.00 -1.84 0.00 0.00 35.03 32.80 1b55 n LYS 53 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1b55 n GLY 54 N -0.09 3.26 3.30 0.72 0.00 -1.12 -4.95 105.19 106.32 1b55 n GLY 54 Ca 0.00 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 1b55 n GLY 54 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b55 s SER 55 N 0.00 0.11 -0.05 1.61 1.04 -1.26 -0.76 113.70 114.39 1b55 s SER 55 Ca 0.00 -1.08 -0.00 0.00 0.48 0.00 0.00 55.95 55.35 1b55 s SER 55 Cb 0.00 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.56 1b55 s SER 55 CO 0.00 -0.88 -0.01 -0.63 0.98 0.00 0.00 173.24 172.70 1b55 s ILE 56 N -4.04 0.35 0.09 -1.02 1.01 0.26 -4.97 121.20 112.88 1b55 s ILE 56 Ca 0.25 0.05 -0.31 0.00 0.00 0.00 0.00 60.65 60.64 1b55 s ILE 56 Cb 0.04 -0.46 -0.07 0.00 0.01 0.00 0.00 42.46 41.99 1b55 s ILE 56 CO 0.05 0.21 1.38 -1.81 0.00 0.00 0.00 174.94 174.77 1b55 s ASP 57 N 1.39 6.85 0.27 3.58 1.01 -1.26 -0.76 116.67 127.75 1b55 s ASP 57 Ca -0.04 2.25 0.13 0.00 0.71 0.00 0.00 52.55 55.60 1b55 s ASP 57 Cb -0.13 -2.58 0.71 0.00 1.01 0.00 0.00 42.92 41.93 1b55 s ASP 57 CO -0.02 -0.65 1.32 0.52 0.21 0.00 0.00 175.17 176.54 1b55 n VAL 58 N 4.10 0.87 -0.06 -1.27 0.31 0.47 -1.77 118.33 120.98 1b55 n VAL 58 Ca 0.12 0.70 -0.00 0.00 -0.01 0.00 0.00 64.34 65.14 1b55 n VAL 58 Cb 0.43 -1.70 -0.16 0.00 -0.91 0.00 0.00 33.84 31.50 1b55 n VAL 58 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1b55 n GLU 59 N -1.99 0.76 0.00 5.55 0.28 -1.26 -3.86 120.64 120.13 1b55 n GLU 59 Ca -0.01 -0.09 0.06 0.00 -0.16 0.00 0.00 57.16 56.96 1b55 n GLU 59 Cb 0.21 -1.49 0.35 0.00 1.43 0.00 0.00 31.44 31.94 1b55 n GLU 59 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1b55 n LYS 60 N -2.49 0.59 -2.74 3.44 5.02 -0.73 -4.69 118.16 116.57 1b55 n LYS 60 Ca -0.19 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.67 1b55 n LYS 60 Cb 0.86 -1.31 -0.03 0.00 -0.02 0.00 0.00 35.03 34.53 1b55 n LYS 60 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1b55 s ILE 61 N -2.00 4.35 -0.17 -0.18 1.01 -1.25 -3.70 121.20 119.26 1b55 s ILE 61 Ca 0.18 0.85 0.16 0.00 0.00 0.00 0.00 60.65 61.84 1b55 s ILE 61 Cb 0.08 -4.52 0.09 0.00 0.01 0.00 0.00 42.46 38.12 1b55 s ILE 61 CO 0.14 -0.95 1.46 0.71 0.00 0.00 0.00 174.94 176.30 1b55 h THR 62 N 6.13 0.80 -1.55 2.92 1.35 -1.55 -3.42 112.91 117.59 1b55 h THR 62 Ca -0.24 -2.11 0.11 0.00 -0.55 0.00 0.00 66.41 63.62 1b55 h THR 62 Cb 1.07 2.38 -0.23 0.00 -1.73 0.00 0.00 68.15 69.64 1b55 h THR 62 CO 1.08 0.45 0.60 0.00 -0.25 0.00 0.00 175.52 177.40 1b55 s VAL 64 N -1.29 -0.13 0.33 0.00 1.01 -1.26 0.57 120.40 119.64 1b55 s VAL 64 Ca 0.00 0.20 -0.18 0.00 0.00 0.00 0.00 61.98 62.01 1b55 s VAL 64 Cb -0.01 -0.36 0.05 0.00 0.00 0.00 0.00 36.38 36.07 1b55 s VAL 64 CO -0.01 0.08 0.81 -1.61 0.00 0.00 0.00 175.10 174.38 1b55 s GLU 65 N 1.56 2.01 0.97 2.72 0.41 -0.04 -4.95 118.70 121.38 1b55 s GLU 65 Ca -0.06 -1.26 -0.12 0.00 -0.41 0.00 0.00 54.97 53.12 1b55 s GLU 65 Cb -0.11 0.59 0.17 0.00 -1.78 0.00 0.00 34.13 33.00 1b55 s GLU 65 CO -0.08 -0.94 1.10 0.95 -0.49 0.00 0.00 175.26 175.81 1b55 s THR 66 N -2.63 2.14 0.07 3.63 -4.23 -1.26 0.67 115.64 114.03 1b55 s THR 66 Ca 0.15 0.04 0.04 0.00 -1.18 0.00 0.00 61.69 60.74 1b55 s THR 66 Cb -0.05 -2.59 -0.03 0.00 1.34 0.00 0.00 72.50 71.17 1b55 s THR 66 CO 0.10 -0.06 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.32 1b55 s VAL 67 N -3.02 0.87 -0.02 2.29 1.01 -1.23 -4.50 120.40 115.80 1b55 s VAL 67 Ca 0.65 -1.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.03 1b55 s VAL 67 Cb -0.18 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1b55 s VAL 67 CO 0.57 -0.35 1.17 -0.69 0.00 0.00 0.00 175.10 175.80 1b55 s VAL 68 N -1.56 4.27 0.49 2.92 1.01 0.39 -4.78 120.40 123.14 1b55 s VAL 68 Ca -0.03 1.61 -0.23 0.00 0.00 0.00 0.00 61.98 63.32 1b55 s VAL 68 Cb -0.08 -4.03 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 1b55 s VAL 68 CO 0.01 0.05 1.30 -2.16 0.00 0.00 0.00 175.10 174.30 1b55 s PRO 69 N 1.75 3.51 0.71 2.72 0.04 -1.26 -4.51 135.00 137.94 1b55 s PRO 69 Ca 0.56 2.11 -0.15 0.00 0.04 0.00 0.00 61.00 63.57 1b55 s PRO 69 Cb -0.26 -2.42 0.03 0.00 0.04 0.00 0.00 34.50 31.89 1b55 s PRO 69 CO 0.25 -0.86 1.15 -1.83 0.04 0.00 0.00 177.00 175.75 1b55 s GLU 70 N -2.69 2.42 0.19 4.56 1.03 -1.26 -4.93 118.70 118.02 1b55 s GLU 70 Ca 0.66 1.54 0.01 0.00 0.03 0.00 0.00 54.97 57.20 1b55 s GLU 70 Cb -0.37 -1.89 0.09 0.00 -0.80 0.00 0.00 34.13 31.16 1b55 s GLU 70 CO 0.45 -1.57 1.46 0.87 -1.33 0.00 0.00 175.26 175.13 1b55 h LYS 71 N -0.25 0.33 -2.05 -4.83 1.57 -2.02 -3.36 116.57 105.96 1b55 h LYS 71 Ca -0.47 -0.27 -0.56 0.00 -1.87 0.00 0.00 60.65 57.48 1b55 h LYS 71 Cb 1.27 0.06 -0.39 0.00 0.08 0.00 0.00 32.23 33.25 1b55 h LYS 71 CO 0.52 0.92 -1.09 0.09 -0.57 0.00 0.00 179.45 179.31 1b55 n ASN 72 N -3.82 0.07 -4.77 0.86 3.02 -1.26 -5.10 115.26 104.26 1b55 n ASN 72 Ca -0.04 -2.64 -0.39 0.00 -0.03 0.00 0.00 54.58 51.48 1b55 n ASN 72 Cb 0.70 -0.62 -0.05 0.00 -0.61 0.00 0.00 39.78 39.20 1b55 n ASN 72 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1b55 s PRO 73 N -1.00 4.50 0.79 3.52 0.04 -1.26 -5.03 135.00 136.56 1b55 s PRO 73 Ca 0.35 1.63 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 1b55 s PRO 73 Cb 0.15 -2.95 0.06 0.00 0.04 0.00 0.00 34.50 31.80 1b55 s PRO 73 CO -0.12 0.13 1.09 -1.25 0.04 0.00 0.00 177.00 176.89 1b55 s PRO 74 N -1.82 2.16 0.57 0.56 0.04 -1.26 -4.70 135.00 130.56 1b55 s PRO 74 Ca 0.49 1.05 0.31 0.00 0.04 0.00 0.00 61.00 62.89 1b55 s PRO 74 Cb -0.27 -1.89 1.42 0.00 0.04 0.00 0.00 34.50 33.80 1b55 s PRO 74 CO 0.34 -1.68 1.79 -1.00 0.04 0.00 0.00 177.00 176.49 1b55 h PRO 75 N -1.15 0.00 0.00 0.56 0.13 -1.95 -0.72 132.00 128.87 1b55 h PRO 75 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1b55 h PRO 75 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1b55 h PRO 75 CO 0.53 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.45 1b55 n GLU 76 N -3.83 0.15 -2.67 0.86 0.28 -1.26 -2.93 120.64 111.23 1b55 n GLU 76 Ca 0.16 0.46 -0.08 0.00 -0.16 0.00 0.00 57.16 57.54 1b55 n GLU 76 Cb 0.98 -1.83 0.03 0.00 1.43 0.00 0.00 31.44 32.06 1b55 n GLU 76 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1b55 n ARG 77 N -2.11 1.68 -4.34 3.44 1.74 -0.28 0.36 116.66 117.15 1b55 n ARG 77 Ca 0.01 -3.50 -0.24 0.00 -0.77 0.00 0.00 57.85 53.36 1b55 n ARG 77 Cb 0.16 -1.51 -0.08 0.00 -1.02 0.00 0.00 32.46 30.00 1b55 n ARG 77 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1b55 s GLN 78 N -3.42 2.12 -0.16 5.56 -0.21 -1.15 -4.59 119.66 117.81 1b55 s GLN 78 Ca 0.30 -1.49 -0.19 0.00 0.02 0.00 0.00 55.36 54.00 1b55 s GLN 78 Cb 0.40 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 32.32 1b55 s GLN 78 CO -0.01 0.36 0.54 0.96 -2.12 0.00 0.00 175.29 175.02 1b55 s ILE 79 N -2.31 5.12 0.00 1.08 -5.25 -1.26 -4.61 121.20 113.96 1b55 s ILE 79 Ca 0.30 1.03 0.00 0.00 -0.99 0.00 0.00 60.65 60.99 1b55 s ILE 79 Cb -0.06 -3.86 0.00 0.00 2.95 0.00 0.00 42.46 41.48 1b55 s ILE 79 CO 0.18 0.23 0.00 -0.81 -1.79 0.00 0.00 174.94 172.75 1b55 n PRO 80 N 4.34 -0.70 -0.11 0.37 -0.04 -1.26 -5.02 135.00 132.57 1b55 n PRO 80 Ca -0.05 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.17 1b55 n PRO 80 Cb 0.51 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.89 1b55 n PRO 80 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1b55 n ARG 81 N -1.20 0.49 0.00 0.54 0.63 -1.26 -5.29 116.66 110.57 1b55 n ARG 81 Ca 0.00 0.22 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 1b55 n ARG 81 Cb 0.00 -1.33 0.00 0.00 0.45 0.00 0.00 32.46 31.58 1b55 n ARG 81 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1b55 n ARG 82 N -4.06 0.00 0.00 -0.14 3.00 -1.26 -5.36 116.66 108.84 1b55 n ARG 82 Ca -0.44 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.40 1b55 n ARG 82 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.26 1b55 n ARG 82 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 1b55 n MET 89 N -0.18 0.00 -0.10 5.56 2.81 -1.26 -5.29 117.12 118.66 1b55 n MET 89 Ca 0.00 0.00 -0.18 0.00 -1.81 0.00 0.00 57.70 55.71 1b55 n MET 89 Cb 0.00 0.00 -0.08 0.00 -0.71 0.00 0.00 33.22 32.43 1b55 n MET 89 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1b55 n GLU 90 N 0.00 0.54 -0.22 0.03 2.13 -1.26 -2.68 120.64 119.18 1b55 n GLU 90 Ca 0.00 0.51 0.20 0.00 0.66 0.00 0.00 57.16 58.53 1b55 n GLU 90 Cb 0.00 -1.69 0.31 0.00 0.27 0.00 0.00 31.44 30.33 1b55 n GLU 90 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1b55 n GLN 91 N -4.46 0.00 -0.11 5.31 7.27 -1.26 0.18 117.38 124.32 1b55 n GLN 91 Ca -0.28 0.54 -0.19 0.00 0.07 0.00 0.00 57.00 57.13 1b55 n GLN 91 Cb 0.60 -1.30 -0.08 0.00 2.41 0.00 0.00 30.24 31.86 1b55 n GLN 91 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 1b55 n ILE 92 N -2.58 1.51 -0.33 1.69 2.08 -1.17 -4.50 119.36 116.05 1b55 n ILE 92 Ca 0.17 -0.06 0.26 0.00 0.56 0.00 0.00 62.75 63.68 1b55 n ILE 92 Cb 0.90 -2.10 0.56 0.00 -0.75 0.00 0.00 39.64 38.25 1b55 n ILE 92 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 1b55 h SER 93 N -1.00 0.36 0.00 4.38 4.64 0.21 0.10 113.55 122.25 1b55 h SER 93 Ca -0.34 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1b55 h SER 93 Cb 1.21 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1b55 h SER 93 CO -0.21 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 175.80 1b55 n ILE 94 N -4.57 0.00 -0.97 0.95 3.06 -0.91 0.56 119.36 117.47 1b55 n ILE 94 Ca 0.26 0.00 0.01 0.00 -2.50 0.00 0.00 62.75 60.52 1b55 n ILE 94 Cb 0.98 -0.62 0.01 0.00 0.54 0.00 0.00 39.64 40.55 1b55 n ILE 94 CO 0.00 0.00 0.00 2.30 -2.50 0.00 0.00 176.55 176.35 1b55 n ILE 95 N -0.99 0.36 0.00 9.51 -5.35 0.32 -4.80 119.36 118.41 1b55 n ILE 95 Ca 0.17 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 1b55 n ILE 95 Cb 0.08 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 38.68 1b55 n ILE 95 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1b55 n GLU 96 N -0.22 3.92 -4.07 6.28 1.02 -0.85 -5.01 120.64 121.70 1b55 n GLU 96 Ca 0.01 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.82 1b55 n GLU 96 Cb 0.49 -0.50 -0.15 0.00 -0.02 0.00 0.00 31.44 31.26 1b55 n GLU 96 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1b55 s ARG 97 N -0.40 2.70 -0.49 3.49 3.52 0.19 -4.74 118.95 123.21 1b55 s ARG 97 Ca 0.00 -1.04 0.03 0.00 -0.13 0.00 0.00 55.73 54.59 1b55 s ARG 97 Cb 0.00 -2.76 0.14 0.00 -1.56 0.00 0.00 34.95 30.77 1b55 s ARG 97 CO 0.00 -0.37 0.28 -0.06 -0.81 0.00 0.00 175.30 174.34 1b55 s PHE 98 N 1.23 2.44 -2.47 5.12 0.40 0.16 -4.24 117.98 120.62 1b55 s PHE 98 Ca -0.01 -2.73 0.23 0.00 -0.60 0.00 0.00 56.93 53.82 1b55 s PHE 98 Cb -0.16 -2.17 0.41 0.00 0.51 0.00 0.00 43.02 41.61 1b55 s PHE 98 CO -0.09 -0.74 1.39 -0.35 0.70 0.00 0.00 175.22 176.13 1b55 n PRO 99 N 3.17 2.50 -3.85 0.24 -0.04 -0.76 -4.39 135.00 131.88 1b55 n PRO 99 Ca 0.11 -2.28 -0.34 0.00 -0.04 0.00 0.00 63.50 60.94 1b55 n PRO 99 Cb 0.35 -1.51 -0.12 0.00 -0.04 0.00 0.00 33.50 32.17 1b55 n PRO 99 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1b55 s TYR 100 N -1.49 3.56 0.49 0.54 2.02 0.77 -4.87 117.35 118.37 1b55 s TYR 100 Ca 0.38 -2.72 -0.01 0.00 -0.37 0.00 0.00 57.07 54.36 1b55 s TYR 100 Cb 0.23 -3.10 0.00 0.00 -0.40 0.00 0.00 41.96 38.69 1b55 s TYR 100 CO 0.31 -0.92 0.73 -1.25 -1.57 0.00 0.00 175.55 172.86 1b55 s PRO 101 N 0.72 3.00 0.23 -1.71 0.04 -1.26 0.26 135.00 136.28 1b55 s PRO 101 Ca 0.11 -0.39 -0.15 0.00 0.04 0.00 0.00 61.00 60.61 1b55 s PRO 101 Cb -0.22 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 31.85 1b55 s PRO 101 CO -0.05 -0.40 0.52 -0.59 0.04 0.00 0.00 177.00 176.52 1b55 s PHE 102 N -2.67 0.12 -0.04 0.56 -0.71 0.10 -3.49 117.98 111.84 1b55 s PHE 102 Ca 0.50 -0.49 0.02 0.00 -1.04 0.00 0.00 56.93 55.92 1b55 s PHE 102 Cb -0.10 0.32 0.01 0.00 -1.21 0.00 0.00 43.02 42.04 1b55 s PHE 102 CO 0.40 -0.99 -0.07 1.14 -1.34 0.00 0.00 175.22 174.36 1b55 s GLN 103 N -3.95 0.93 -0.32 1.99 -2.07 0.21 -1.60 119.66 114.85 1b55 s GLN 103 Ca 0.16 -0.21 0.00 0.00 -1.82 0.00 0.00 55.36 53.50 1b55 s GLN 103 Cb -0.01 -0.88 0.07 0.00 -1.09 0.00 0.00 33.01 31.10 1b55 s GLN 103 CO 0.04 0.01 0.02 0.08 -1.32 0.00 0.00 175.29 174.11 1b55 s VAL 104 N 0.58 2.69 0.05 3.63 1.01 -0.20 -0.86 120.40 127.30 1b55 s VAL 104 Ca -0.09 -1.75 0.02 0.00 0.00 0.00 0.00 61.98 60.17 1b55 s VAL 104 Cb -0.12 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1b55 s VAL 104 CO 0.01 -0.28 0.04 -0.69 0.00 0.00 0.00 175.10 174.18 1b55 s VAL 105 N 1.13 4.36 0.28 2.92 1.01 0.19 0.99 120.40 131.27 1b55 s VAL 105 Ca -0.01 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 1b55 s VAL 105 Cb -0.20 -3.04 0.04 0.00 0.00 0.00 0.00 36.38 33.17 1b55 s VAL 105 CO -0.04 0.22 0.52 0.00 0.00 0.00 0.00 175.10 175.80 1b55 n TYR 106 N 0.83 -1.82 -0.29 5.22 4.11 0.50 -1.67 117.16 124.03 1b55 n TYR 106 Ca -0.11 -1.39 0.11 0.00 -0.00 0.00 0.00 57.90 56.51 1b55 n TYR 106 Cb 0.52 0.61 0.27 0.00 -0.00 0.00 0.00 39.34 40.74 1b55 n TYR 106 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.86 177.24 1b55 h ASP 107 N 1.41 0.22 1.33 9.48 2.03 -1.99 0.25 116.42 129.15 1b55 h ASP 107 Ca -0.23 0.16 0.00 0.00 -0.73 0.00 0.00 57.03 56.22 1b55 h ASP 107 Cb 0.87 0.16 0.00 0.00 -0.83 0.00 0.00 39.33 39.54 1b55 h ASP 107 CO 0.30 -0.02 0.00 -0.33 -1.03 0.00 0.00 179.24 178.16 1b55 h GLU 108 N 0.35 0.00 0.00 4.15 5.08 -1.97 -3.47 114.58 118.72 1b55 h GLU 108 Ca 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 1b55 h GLU 108 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1b55 h GLU 108 CO -0.53 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 177.89 1b55 n GLY 109 N 0.55 0.27 3.45 -3.84 0.00 0.08 -4.64 105.19 101.04 1b55 n GLY 109 Ca 0.03 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.53 1b55 n GLY 109 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b55 s PRO 110 N -2.00 2.68 -0.19 1.61 0.04 -1.26 -0.37 135.00 135.51 1b55 s PRO 110 Ca 0.00 -0.70 -0.13 0.00 0.04 0.00 0.00 61.00 60.21 1b55 s PRO 110 Cb 0.00 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 32.07 1b55 s PRO 110 CO 0.00 0.53 0.26 -1.17 0.04 0.00 0.00 177.00 176.66 1b55 s LEU 111 N -0.50 4.20 -0.21 -3.56 2.96 0.28 -4.94 118.68 116.91 1b55 s LEU 111 Ca 0.06 0.39 -0.10 0.00 -0.22 0.00 0.00 54.13 54.27 1b55 s LEU 111 Cb -0.12 -2.30 -0.05 0.00 0.50 0.00 0.00 46.19 44.22 1b55 s LEU 111 CO 0.02 0.08 0.13 -0.31 -1.32 0.00 0.00 176.35 174.95 1b55 s TYR 112 N 0.68 3.37 -0.04 5.38 2.02 -1.26 -1.03 117.35 126.47 1b55 s TYR 112 Ca 0.14 0.28 -0.01 0.00 -0.37 0.00 0.00 57.07 57.10 1b55 s TYR 112 Cb -0.13 -2.18 0.03 0.00 -0.40 0.00 0.00 41.96 39.28 1b55 s TYR 112 CO 0.03 0.22 0.03 0.08 -1.57 0.00 0.00 175.55 174.35 1b55 s VAL 113 N 0.52 0.06 -0.09 0.71 1.01 -0.63 -1.82 120.40 120.15 1b55 s VAL 113 Ca 0.07 0.28 -0.11 0.00 0.00 0.00 0.00 61.98 62.23 1b55 s VAL 113 Cb -0.12 -0.26 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 1b55 s VAL 113 CO -0.00 0.19 0.26 -0.36 0.00 0.00 0.00 175.10 175.18 1b55 s PHE 114 N 1.85 3.60 0.07 5.22 0.40 0.15 0.02 117.98 129.29 1b55 s PHE 114 Ca 0.02 0.68 0.07 0.00 -0.60 0.00 0.00 56.93 57.09 1b55 s PHE 114 Cb -0.12 -2.15 -0.04 0.00 0.51 0.00 0.00 43.02 41.22 1b55 s PHE 114 CO -0.03 0.58 -0.14 0.45 0.70 0.00 0.00 175.22 176.78 1b55 s SER 115 N -0.65 4.14 0.15 1.36 0.15 0.14 -2.32 113.70 116.67 1b55 s SER 115 Ca 0.18 -0.39 0.03 0.00 0.70 0.00 0.00 55.95 56.47 1b55 s SER 115 Cb -0.14 -0.75 -0.06 0.00 -1.71 0.00 0.00 66.02 63.36 1b55 s SER 115 CO 0.07 0.22 1.34 1.55 1.20 0.00 0.00 173.24 177.62 1b55 h PRO 116 N 4.12 0.16 -5.76 5.44 0.13 -1.85 0.24 132.00 134.47 1b55 h PRO 116 Ca -0.48 -0.19 -0.56 0.00 -0.87 0.00 0.00 66.00 63.89 1b55 h PRO 116 Cb 1.16 0.06 -0.14 0.00 0.13 0.00 0.00 31.00 32.22 1b55 h PRO 116 CO 0.50 0.97 -0.68 0.95 -0.23 0.00 0.00 178.00 179.51 1b55 s THR 117 N -3.07 1.99 0.07 1.56 -4.23 -1.26 -4.36 115.64 106.34 1b55 s THR 117 Ca -0.02 -2.18 -0.16 0.00 -1.18 0.00 0.00 61.69 58.15 1b55 s THR 117 Cb 0.10 -2.53 -0.14 0.00 1.34 0.00 0.00 72.50 71.27 1b55 s THR 117 CO 0.83 -0.26 1.31 -0.08 -0.54 0.00 0.00 174.62 175.88 1b55 h GLU 118 N 2.16 0.64 -0.92 3.99 4.57 -1.95 -2.51 114.58 120.56 1b55 h GLU 118 Ca -0.41 -0.45 -0.01 0.00 -1.18 0.00 0.00 59.36 57.31 1b55 h GLU 118 Cb 1.24 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 29.86 1b55 h GLU 118 CO 0.68 1.07 0.55 1.49 -1.18 0.00 0.00 179.01 181.63 1b55 h GLU 119 N 0.32 1.26 -0.83 1.92 4.81 -1.98 0.53 114.58 120.61 1b55 h GLU 119 Ca -0.01 -0.12 0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1b55 h GLU 119 Cb 1.10 -0.26 -0.04 0.00 0.63 0.00 0.00 28.75 30.17 1b55 h GLU 119 CO 0.10 0.88 0.54 1.25 -0.73 0.00 0.00 179.01 181.06 1b55 h LEU 120 N 1.28 0.93 -0.35 1.64 5.85 -1.96 0.63 115.31 123.33 1b55 h LEU 120 Ca 0.33 -0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.88 1b55 h LEU 120 Cb -0.05 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1b55 h LEU 120 CO -0.06 0.66 -0.37 -0.09 -0.34 0.00 0.00 178.44 178.24 1b55 h ARG 121 N 1.09 0.87 0.39 1.25 2.43 -0.45 -0.37 114.38 119.59 1b55 h ARG 121 Ca 0.32 -0.47 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1b55 h ARG 121 Cb -0.08 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 1b55 h ARG 121 CO -0.09 1.11 -0.32 -0.22 -1.51 0.00 0.00 179.97 178.94 1b55 h LYS 122 N 0.67 -0.69 -0.64 0.20 3.64 0.50 -0.70 116.57 119.55 1b55 h LYS 122 Ca 0.05 0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.61 1b55 h LYS 122 Cb 0.96 0.16 -0.11 0.00 -0.41 0.00 0.00 32.23 32.82 1b55 h LYS 122 CO 0.09 -0.46 -0.05 0.00 -2.27 0.00 0.00 179.45 176.76 1b55 h ARG 123 N -0.71 0.07 -0.22 1.90 3.08 0.12 -1.18 114.38 117.44 1b55 h ARG 123 Ca -0.03 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1b55 h ARG 123 Cb 0.62 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1b55 h ARG 123 CO -0.02 0.05 -0.02 -1.49 -1.07 0.00 0.00 179.97 177.42 1b55 h TRP 124 N 0.07 0.44 -0.92 3.04 4.06 -0.58 -2.60 115.95 119.46 1b55 h TRP 124 Ca 0.33 -0.08 0.02 0.00 2.06 0.00 0.00 58.89 61.21 1b55 h TRP 124 Cb 0.53 -0.11 -0.05 0.00 -1.00 0.00 0.00 29.16 28.53 1b55 h TRP 124 CO -0.42 0.60 0.61 0.82 -3.56 0.00 0.00 178.44 176.48 1b55 h ILE 125 N 0.15 1.21 0.67 1.49 2.04 0.04 0.52 117.51 123.63 1b55 h ILE 125 Ca 0.06 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1b55 h ILE 125 Cb 0.43 -0.11 0.01 0.00 -0.74 0.00 0.00 36.82 36.41 1b55 h ILE 125 CO 0.01 0.22 -0.32 -0.74 0.00 0.00 0.00 178.15 177.32 1b55 h HIS 126 N 1.22 -0.84 -0.95 1.37 2.76 -1.35 0.63 115.15 117.99 1b55 h HIS 126 Ca 0.35 -0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.61 1b55 h HIS 126 Cb -0.09 0.28 -0.08 0.00 1.55 0.00 0.00 27.41 29.06 1b55 h HIS 126 CO -0.00 -0.49 0.58 1.96 -1.30 0.00 0.00 177.93 178.68 1b55 h GLN 127 N -1.09 0.89 -0.46 5.26 1.08 -1.14 0.18 115.11 119.83 1b55 h GLN 127 Ca -0.09 -0.05 0.01 0.00 -1.45 0.00 0.00 58.65 57.06 1b55 h GLN 127 Cb 0.73 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.93 1b55 h GLN 127 CO 0.15 0.59 0.30 -0.07 -0.95 0.00 0.00 178.83 178.85 1b55 h LEU 128 N 0.91 0.51 0.01 1.46 3.38 -0.28 0.96 115.31 122.26 1b55 h LEU 128 Ca 0.47 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.43 1b55 h LEU 128 Cb 0.47 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1b55 h LEU 128 CO -0.27 0.37 -0.13 0.11 0.09 0.00 0.00 178.44 178.61 1b55 h LYS 129 N 0.61 -0.16 -0.99 1.13 1.57 0.31 0.41 116.57 119.45 1b55 h LYS 129 Ca 0.17 0.01 0.18 0.00 -1.87 0.00 0.00 60.65 59.14 1b55 h LYS 129 Cb -0.05 0.04 -0.18 0.00 0.08 0.00 0.00 32.23 32.12 1b55 h LYS 129 CO -0.05 -0.11 -0.30 -0.91 -0.57 0.00 0.00 179.45 177.51 1b55 h ASN 130 N -0.17 -1.12 -0.53 0.86 4.21 -0.55 1.95 115.58 120.24 1b55 h ASN 130 Ca 0.00 0.30 0.07 0.00 1.21 0.00 0.00 56.30 57.89 1b55 h ASN 130 Cb 0.18 0.67 -0.03 0.00 -1.12 0.00 0.00 38.32 38.01 1b55 h ASN 130 CO -0.08 -0.31 0.35 0.58 -1.29 0.00 0.00 177.43 176.68 1b55 h VAL 131 N -0.00 0.94 -0.01 2.81 2.07 0.34 -2.89 116.25 119.50 1b55 h VAL 131 Ca 0.42 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.80 1b55 h VAL 131 Cb 0.67 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1b55 h VAL 131 CO -1.00 0.07 -0.50 2.30 0.02 0.00 0.00 177.57 178.46 1b55 n ILE 132 N -4.47 0.00 -0.18 4.57 -5.35 0.64 -4.69 119.36 109.88 1b55 n ILE 132 Ca 0.08 -0.25 0.18 0.00 -0.27 0.00 0.00 62.75 62.49 1b55 n ILE 132 Cb 0.30 1.23 0.32 0.00 -1.74 0.00 0.00 39.64 39.75 1b55 n ILE 132 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 1b55 n ARG 133 N -0.17 -0.04 -0.59 6.28 0.63 0.13 0.12 116.66 123.02 1b55 n ARG 133 Ca 0.08 0.79 0.02 0.00 -0.92 0.00 0.00 57.85 57.83 1b55 n ARG 133 Cb 0.44 -1.41 0.20 0.00 0.45 0.00 0.00 32.46 32.14 1b55 n ARG 133 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1b55 n TYR 134 N -4.32 0.64 -1.14 -0.14 4.01 -1.26 -5.03 117.16 109.92 1b55 n TYR 134 Ca 0.21 -1.37 -0.30 0.00 -0.16 0.00 0.00 57.90 56.28 1b55 n TYR 134 Cb 0.72 -0.35 0.13 0.00 -0.31 0.00 0.00 39.34 39.52 1b55 n TYR 134 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1b55 s ASN 135 N -2.66 3.60 0.10 7.72 -0.87 0.12 -4.96 114.94 118.00 1b55 s ASN 135 Ca 0.41 1.66 0.24 0.00 -1.57 0.00 0.00 52.86 53.60 1b55 s ASN 135 Cb 0.37 -2.32 0.27 0.00 -0.02 0.00 0.00 41.25 39.54 1b55 s ASN 135 CO 0.00 -2.58 1.24 -1.54 -2.57 0.00 0.00 177.10 171.65 1b55 n SER 136 N -3.86 0.68 -0.75 -1.22 3.41 -1.26 -4.33 113.62 106.29 1b55 n SER 136 Ca 0.08 0.04 0.06 0.00 -0.26 0.00 0.00 58.87 58.79 1b55 n SER 136 Cb 0.54 0.32 0.17 0.00 -0.26 0.00 0.00 64.21 64.99 1b55 n SER 136 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1b55 n ASP 137 N -2.08 1.59 -4.55 4.04 8.00 -1.26 -5.00 116.55 117.28 1b55 n ASP 137 Ca 0.03 -3.53 -0.27 0.00 0.71 0.00 0.00 54.79 51.73 1b55 n ASP 137 Cb 0.44 -0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 41.01 1b55 n ASP 137 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1b55 s LEU 138 N -2.62 3.17 0.79 0.64 1.43 -1.25 -4.52 118.68 116.32 1b55 s LEU 138 Ca 0.37 0.54 -0.16 0.00 -1.03 0.00 0.00 54.13 53.86 1b55 s LEU 138 Cb 0.37 -2.52 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 1b55 s LEU 138 CO -0.09 -3.24 0.26 1.33 0.23 0.00 0.00 176.35 174.84 1b55 n VAL 139 N 8.25 0.96 0.08 -1.59 0.24 -0.29 -4.95 118.33 121.03 1b55 n VAL 139 Ca 0.40 -0.37 0.01 0.00 -2.04 0.00 0.00 64.34 62.33 1b55 n VAL 139 Cb 0.50 -0.54 -0.01 0.00 -1.47 0.00 0.00 33.84 32.31 1b55 n VAL 139 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1b55 n GLN 140 N -0.31 5.31 -5.06 7.34 7.27 -1.26 -4.87 117.38 125.80 1b55 n GLN 140 Ca 0.07 -0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.82 1b55 n GLN 140 Cb 0.51 -0.67 -0.15 0.00 2.41 0.00 0.00 30.24 32.35 1b55 n GLN 140 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1b55 s LYS 141 N -1.34 2.61 0.33 3.69 1.02 -1.26 -3.58 119.74 121.21 1b55 s LYS 141 Ca 0.00 -0.80 0.05 0.00 0.02 0.00 0.00 55.97 55.24 1b55 s LYS 141 Cb 0.01 -2.30 -0.03 0.00 -0.52 0.00 0.00 37.83 34.99 1b55 s LYS 141 CO 0.08 0.47 0.20 1.52 -0.92 0.00 0.00 175.35 176.69 1b55 s TYR 142 N -0.35 1.67 -0.32 3.18 1.13 0.04 -3.77 117.35 118.94 1b55 s TYR 142 Ca 0.02 -1.47 -0.08 0.00 -1.41 0.00 0.00 57.07 54.14 1b55 s TYR 142 Cb -0.12 -0.85 0.02 0.00 -1.10 0.00 0.00 41.96 39.91 1b55 s TYR 142 CO 0.02 -0.62 0.11 -1.01 -2.51 0.00 0.00 175.55 171.55 1b55 s HIS 143 N -3.50 3.19 -1.05 -3.49 3.76 -1.26 -1.07 115.29 111.87 1b55 s HIS 143 Ca 0.35 -1.06 0.27 0.00 -0.15 0.00 0.00 55.06 54.47 1b55 s HIS 143 Cb 0.04 -2.30 1.18 0.00 1.11 0.00 0.00 32.58 32.61 1b55 s HIS 143 CO 0.20 -0.62 1.88 -0.35 -0.85 0.00 0.00 174.74 175.00 1b55 n PRO 144 N 4.88 0.04 -3.73 8.40 -0.04 -1.26 -4.80 135.00 138.49 1b55 n PRO 144 Ca -0.13 0.03 -0.21 0.00 -0.04 0.00 0.00 63.50 63.15 1b55 n PRO 144 Cb 0.47 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.39 1b55 n PRO 144 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1b55 s PHE 146 N -2.38 2.96 -0.17 0.00 0.08 -1.26 -4.76 117.98 112.45 1b55 s PHE 146 Ca 0.44 1.25 -0.19 0.00 0.12 0.00 0.00 56.93 58.55 1b55 s PHE 146 Cb -0.04 -3.02 -0.03 0.00 -0.57 0.00 0.00 43.02 39.35 1b55 s PHE 146 CO 0.27 -1.53 0.53 -0.46 -0.10 0.00 0.00 175.22 173.93 1b55 s TRP 147 N -3.12 3.42 -0.27 0.36 -0.00 -1.26 -2.31 118.94 115.77 1b55 s TRP 147 Ca 0.60 0.85 -0.22 0.00 -0.00 0.00 0.00 56.10 57.33 1b55 s TRP 147 Cb -0.14 -2.66 0.07 0.00 -0.00 0.00 0.00 33.47 30.74 1b55 s TRP 147 CO 0.54 -0.02 0.69 -1.50 -0.00 0.00 0.00 176.95 176.66 1b55 s ILE 148 N 1.34 -0.00 -1.50 5.86 2.07 0.35 -4.91 121.20 124.42 1b55 s ILE 148 Ca 0.26 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 59.47 1b55 s ILE 148 Cb -0.15 -0.97 0.01 0.00 0.13 0.00 0.00 42.46 41.47 1b55 s ILE 148 CO 0.10 0.00 0.29 0.47 -1.91 0.00 0.00 174.94 173.90 1b55 n ASP 149 N 3.07 -5.31 0.00 4.50 8.00 -1.26 -2.66 116.55 122.89 1b55 n ASP 149 Ca -0.15 -0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.22 1b55 n ASP 149 Cb 0.56 -4.38 0.00 0.00 -0.02 0.00 0.00 41.12 37.28 1b55 n ASP 149 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b55 n GLY 150 N -1.19 1.97 3.83 0.44 0.00 -1.26 -5.03 105.19 103.96 1b55 n GLY 150 Ca -0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.84 1b55 n GLY 150 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1b55 s GLN 151 N -0.21 1.36 -0.13 1.61 -2.07 -1.09 -4.32 119.66 114.81 1b55 s GLN 151 Ca 0.00 -0.84 -0.24 0.00 -1.82 0.00 0.00 55.36 52.46 1b55 s GLN 151 Cb 0.00 0.40 -0.03 0.00 -1.09 0.00 0.00 33.01 32.30 1b55 s GLN 151 CO 0.00 -0.63 0.76 0.71 -1.32 0.00 0.00 175.29 174.80 1b55 s TYR 152 N -2.54 3.48 0.24 9.60 2.02 0.76 -0.50 117.35 130.41 1b55 s TYR 152 Ca 0.18 1.22 -0.05 0.00 -0.37 0.00 0.00 57.07 58.04 1b55 s TYR 152 Cb -0.02 -2.90 0.35 0.00 -0.40 0.00 0.00 41.96 38.98 1b55 s TYR 152 CO 0.05 -0.09 1.83 -0.07 -1.57 0.00 0.00 175.55 175.69 1b55 h LEU 153 N 7.64 0.72 -0.91 -1.29 3.38 -1.76 2.58 115.31 125.67 1b55 h LEU 153 Ca -0.35 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 1b55 h LEU 153 Cb 1.16 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 1b55 h LEU 153 CO 0.79 0.44 0.13 0.00 0.09 0.00 0.00 178.44 179.90 1b55 n SER 156 N -0.28 -1.82 -4.76 0.00 7.64 0.86 -4.88 113.62 110.39 1b55 n SER 156 Ca 0.02 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.55 1b55 n SER 156 Cb 0.54 -2.26 0.03 0.00 -1.01 0.00 0.00 64.21 61.51 1b55 n SER 156 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1b55 s GLN 157 N -1.07 3.04 -0.17 1.43 -0.21 -1.25 -4.41 119.66 117.02 1b55 s GLN 157 Ca 0.00 1.67 0.19 0.00 0.02 0.00 0.00 55.36 57.24 1b55 s GLN 157 Cb 0.00 -1.96 -0.27 0.00 1.00 0.00 0.00 33.01 31.79 1b55 s GLN 157 CO 0.00 -1.12 0.15 0.25 -2.12 0.00 0.00 175.29 172.45 1b55 n THR 158 N -1.68 1.13 -1.70 -0.19 -2.24 -1.26 -0.17 114.28 108.17 1b55 n THR 158 Ca 0.12 -0.79 -0.37 0.00 -2.27 0.00 0.00 64.05 60.74 1b55 n THR 158 Cb 0.51 -0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 68.33 1b55 n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b55 s ALA 159 N -2.68 1.82 0.27 6.98 0.00 -1.26 -4.55 121.76 122.33 1b55 s ALA 159 Ca -0.10 -0.14 0.19 0.00 0.00 0.00 0.00 51.96 51.92 1b55 s ALA 159 Cb 0.08 -4.32 0.91 0.00 0.00 0.00 0.00 23.12 19.78 1b55 s ALA 159 CO 0.85 -4.24 0.97 1.17 0.00 0.00 0.00 175.76 174.50 1b55 n LYS 160 N 9.04 -0.02 -1.93 0.00 4.81 -1.26 0.40 118.16 129.20 1b55 n LYS 160 Ca 0.32 0.79 -0.30 0.00 -0.87 0.00 0.00 58.31 58.24 1b55 n LYS 160 Cb 0.54 -1.53 0.03 0.00 0.02 0.00 0.00 35.03 34.09 1b55 n LYS 160 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1b55 n ASN 161 N -3.98 6.04 -4.73 3.14 6.94 -1.26 -4.62 115.26 116.79 1b55 n ASN 161 Ca 0.25 -3.77 -0.31 0.00 -0.02 0.00 0.00 54.58 50.73 1b55 n ASN 161 Cb 0.95 -0.66 0.12 0.00 -2.36 0.00 0.00 39.78 37.83 1b55 n ASN 161 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1b55 s ALA 162 N -3.73 1.86 0.18 -2.53 0.00 1.32 -4.98 121.76 113.88 1b55 s ALA 162 Ca 0.54 0.31 -0.31 0.00 0.00 0.00 0.00 51.96 52.50 1b55 s ALA 162 Cb 0.44 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 20.16 1b55 s ALA 162 CO -0.10 -2.19 1.41 1.41 0.00 0.00 0.00 175.76 176.28 1b55 s MET 163 N -4.82 4.31 0.63 0.00 1.75 -1.26 -4.96 119.30 114.94 1b55 s MET 163 Ca 0.63 2.16 -0.18 0.00 -1.25 0.00 0.00 55.69 57.06 1b55 s MET 163 Cb -0.19 -3.19 -0.05 0.00 2.84 0.00 0.00 34.83 34.25 1b55 s MET 163 CO 0.57 -0.41 0.85 0.41 -0.65 0.00 0.00 175.02 175.79 1b55 n GLY 164 N 2.91 -0.66 1.15 2.11 0.00 -1.25 -4.86 105.19 104.60 1b55 n GLY 164 Ca 0.09 -0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1b55 n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b55 s GLN 166 N -1.44 0.13 -0.20 0.00 0.74 -0.52 -4.96 119.66 113.42 1b55 s GLN 166 Ca 0.39 -0.20 -0.04 0.00 0.05 0.00 0.00 55.36 55.55 1b55 s GLN 166 Cb 0.23 -0.00 -0.02 0.00 1.10 0.00 0.00 33.01 34.32 1b55 s GLN 166 CO 0.31 -0.01 -0.03 0.42 -0.55 0.00 0.00 175.29 175.44 1b55 s ILE 167 N -0.45 3.63 -0.47 -2.34 1.01 -1.26 -0.78 121.20 120.55 1b55 s ILE 167 Ca -0.05 -0.42 -0.16 0.00 0.00 0.00 0.00 60.65 60.02 1b55 s ILE 167 Cb -0.03 -2.63 0.06 0.00 0.01 0.00 0.00 42.46 39.86 1b55 s ILE 167 CO -0.00 0.44 0.42 -0.76 0.00 0.00 0.00 174.94 175.04 1b55 s LEU 168 N 1.09 5.40 -0.16 2.97 1.43 -1.23 -5.00 118.68 123.17 1b55 s LEU 168 Ca 0.02 -1.15 0.00 0.00 -1.03 0.00 0.00 54.13 51.96 1b55 s LEU 168 Cb -0.15 -2.24 0.03 0.00 0.03 0.00 0.00 46.19 43.87 1b55 s LEU 168 CO 0.00 -0.65 -0.09 -1.83 0.23 0.00 0.00 176.35 174.01 1b55 s GLU 169 N 1.84 1.82 0.00 1.70 1.03 -1.26 -5.01 118.70 118.81 1b55 s GLU 169 Ca 0.06 -0.58 0.00 0.00 0.03 0.00 0.00 54.97 54.48 1b55 s GLU 169 Cb -0.22 -2.09 0.00 0.00 -0.80 0.00 0.00 34.13 31.02 1b55 s GLU 169 CO 0.08 -0.36 0.00 0.27 -1.33 0.00 0.00 175.26 173.92