#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tc5 s MET 9 N 0.00 4.61 -0.17 -1.40 1.00 -1.24 -4.52 119.30 117.59 1tc5 s MET 9 Ca 0.00 1.25 -0.07 0.00 0.00 0.00 0.00 55.69 56.87 1tc5 s MET 9 Cb 0.00 -3.35 -0.04 0.00 0.00 0.00 0.00 34.83 31.44 1tc5 s MET 9 CO 0.00 0.32 0.08 0.99 0.00 0.00 0.00 175.02 176.41 1tc5 s THR 10 N -0.28 4.99 -0.38 2.05 2.01 -0.73 -4.97 115.64 118.33 1tc5 s THR 10 Ca 0.41 0.03 -0.16 0.00 0.31 0.00 0.00 61.69 62.28 1tc5 s THR 10 Cb -0.22 -3.23 0.01 0.00 0.01 0.00 0.00 72.50 69.07 1tc5 s THR 10 CO 0.27 0.50 0.38 -0.63 -0.69 0.00 0.00 174.62 174.44 1tc5 s ILE 11 N 0.01 5.15 -0.22 1.82 1.01 -0.43 -0.58 121.20 127.96 1tc5 s ILE 11 Ca 0.07 -0.22 -0.13 0.00 0.00 0.00 0.00 60.65 60.37 1tc5 s ILE 11 Cb -0.12 -3.92 -0.05 0.00 0.01 0.00 0.00 42.46 38.38 1tc5 s ILE 11 CO 0.00 -0.26 0.25 -0.60 0.00 0.00 0.00 174.94 174.34 1tc5 s ARG 12 N 2.01 4.13 -0.02 2.79 3.52 -0.18 -0.73 118.95 130.47 1tc5 s ARG 12 Ca 0.11 -0.07 0.06 0.00 -0.13 0.00 0.00 55.73 55.69 1tc5 s ARG 12 Cb -0.17 -3.52 -0.01 0.00 -1.56 0.00 0.00 34.95 29.68 1tc5 s ARG 12 CO 0.12 0.06 -0.19 0.14 -0.81 0.00 0.00 175.30 174.62 1tc5 s VAL 13 N 1.05 1.50 -0.15 7.11 -7.23 -0.34 -1.41 120.40 120.93 1tc5 s VAL 13 Ca 0.12 -0.80 -0.07 0.00 -1.81 0.00 0.00 61.98 59.42 1tc5 s VAL 13 Cb -0.14 -1.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.51 1tc5 s VAL 13 CO 0.05 0.42 0.08 -0.04 -0.31 0.00 0.00 175.10 175.31 1tc5 s MET 14 N -0.39 3.70 -0.09 4.82 1.00 -0.40 -1.48 119.30 126.45 1tc5 s MET 14 Ca 0.06 -0.28 0.02 0.00 0.00 0.00 0.00 55.69 55.49 1tc5 s MET 14 Cb -0.08 -3.16 0.01 0.00 0.00 0.00 0.00 34.83 31.60 1tc5 s MET 14 CO -0.00 0.48 -0.13 -0.51 0.00 0.00 0.00 175.02 174.86 1tc5 s LEU 15 N -0.22 1.64 0.00 -0.03 1.43 0.31 -0.84 118.68 120.98 1tc5 s LEU 15 Ca 0.09 -0.35 0.05 0.00 -1.03 0.00 0.00 54.13 52.89 1tc5 s LEU 15 Cb -0.12 -0.94 -0.02 0.00 0.03 0.00 0.00 46.19 45.15 1tc5 s LEU 15 CO 0.01 0.02 -0.16 -1.10 0.23 0.00 0.00 176.35 175.35 1tc5 s GLN 16 N 0.86 1.25 -0.22 1.70 -0.21 -0.44 -0.81 119.66 121.79 1tc5 s GLN 16 Ca -0.10 -0.65 -0.29 0.00 0.02 0.00 0.00 55.36 54.34 1tc5 s GLN 16 Cb -0.15 -1.24 -0.04 0.00 1.00 0.00 0.00 33.01 32.58 1tc5 s GLN 16 CO 0.01 0.33 1.82 0.00 -2.12 0.00 0.00 175.29 175.34 1tc5 s ALA 17 N -0.50 3.10 -0.14 6.09 0.00 0.46 -1.23 121.76 129.53 1tc5 s ALA 17 Ca 0.06 0.59 -0.09 0.00 0.00 0.00 0.00 51.96 52.51 1tc5 s ALA 17 Cb -0.07 -3.93 -0.05 0.00 0.00 0.00 0.00 23.12 19.07 1tc5 s ALA 17 CO -0.00 -2.24 0.17 1.41 0.00 0.00 0.00 175.76 175.11 1tc5 s MET 18 N 5.22 3.79 -0.27 0.00 1.75 -0.10 -4.40 119.30 125.28 1tc5 s MET 18 Ca 0.81 -0.09 -0.14 0.00 -1.25 0.00 0.00 55.69 55.02 1tc5 s MET 18 Cb -0.28 -3.29 -0.12 0.00 2.84 0.00 0.00 34.83 33.99 1tc5 s MET 18 CO 0.33 0.57 -0.36 -3.47 -0.65 0.00 0.00 175.02 171.44 1tc5 n ASP 19 N 2.61 1.94 -3.95 1.11 2.03 0.00 -1.22 116.55 119.07 1tc5 n ASP 19 Ca -0.17 0.34 -0.12 0.00 0.52 0.00 0.00 54.79 55.35 1tc5 n ASP 19 Cb 0.54 -0.81 -0.13 0.00 -0.72 0.00 0.00 41.12 40.00 1tc5 n ASP 19 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1tc5 s GLN 20 N -2.52 0.26 0.01 -0.67 -1.52 -0.94 -1.40 119.66 112.89 1tc5 s GLN 20 Ca -0.38 -0.35 -0.00 0.00 -1.95 0.00 0.00 55.36 52.67 1tc5 s GLN 20 Cb 0.14 -0.09 -0.01 0.00 -0.22 0.00 0.00 33.01 32.83 1tc5 s GLN 20 CO 0.48 0.01 -0.02 0.20 -0.25 0.00 0.00 175.29 175.72 1tc5 s GLY 21 N -0.73 0.18 -0.10 3.09 0.00 -0.16 -1.08 107.32 108.51 1tc5 s GLY 21 Ca -0.06 -0.43 0.01 0.00 0.00 0.00 0.00 44.72 44.23 1tc5 s GLY 21 CO -0.00 -0.49 -0.11 0.30 0.00 0.00 0.00 173.10 172.80 1tc5 s HIS 22 N -1.11 1.64 -0.12 1.90 3.76 0.21 -1.17 115.29 120.39 1tc5 s HIS 22 Ca -0.12 -0.77 0.02 0.00 -0.15 0.00 0.00 55.06 54.05 1tc5 s HIS 22 Cb -0.08 -1.26 0.01 0.00 1.11 0.00 0.00 32.58 32.37 1tc5 s HIS 22 CO -0.01 -0.46 -0.19 -1.17 -0.85 0.00 0.00 174.74 172.07 1tc5 s LEU 23 N 1.25 1.93 -0.03 0.89 2.96 -0.13 -0.96 118.68 124.58 1tc5 s LEU 23 Ca -0.03 -0.51 -0.30 0.00 -0.22 0.00 0.00 54.13 53.07 1tc5 s LEU 23 Cb -0.14 -1.26 -0.04 0.00 0.50 0.00 0.00 46.19 45.25 1tc5 s LEU 23 CO -0.04 0.07 1.24 -0.22 -1.32 0.00 0.00 176.35 176.08 1tc5 s LEU 24 N 0.79 4.30 -0.00 -0.68 2.96 0.15 -1.07 118.68 125.13 1tc5 s LEU 24 Ca -0.09 1.90 0.07 0.00 -0.22 0.00 0.00 54.13 55.78 1tc5 s LEU 24 Cb -0.16 -3.56 -0.08 0.00 0.50 0.00 0.00 46.19 42.89 1tc5 s LEU 24 CO 0.00 -0.59 0.23 1.33 -1.32 0.00 0.00 176.35 176.00 1tc5 n VAL 25 N 4.52 0.00 -0.47 1.68 0.24 -0.43 -4.41 118.33 119.47 1tc5 n VAL 25 Ca 0.11 -0.28 0.05 0.00 -2.04 0.00 0.00 64.34 62.18 1tc5 n VAL 25 Cb 0.46 0.77 0.08 0.00 -1.47 0.00 0.00 33.84 33.67 1tc5 n VAL 25 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1tc5 n ASN 26 N -1.36 2.31 0.00 -1.34 6.94 -1.26 -4.66 115.26 115.89 1tc5 n ASN 26 Ca 0.00 -2.46 0.00 0.00 -0.02 0.00 0.00 54.58 52.10 1tc5 n ASN 26 Cb 0.13 -0.21 0.00 0.00 -2.36 0.00 0.00 39.78 37.34 1tc5 n ASN 26 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1tc5 n ASN 27 N -0.77 -1.78 0.00 0.53 3.02 -1.26 -4.77 115.26 110.22 1tc5 n ASN 27 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1tc5 n ASN 27 Cb 0.44 -1.75 0.00 0.00 -0.61 0.00 0.00 39.78 37.87 1tc5 n ASN 27 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1tc5 n VAL 28 N -2.16 0.00 -1.47 2.41 0.31 -1.26 -5.03 118.33 111.13 1tc5 n VAL 28 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1tc5 n VAL 28 Cb 0.11 -0.21 0.00 0.00 -0.91 0.00 0.00 33.84 32.83 1tc5 n VAL 28 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1tc5 n ASP 29 N -0.59 0.00 -4.59 4.52 5.75 -1.26 -5.06 116.55 115.32 1tc5 n ASP 29 Ca 0.00 -1.07 -0.40 0.00 -0.01 0.00 0.00 54.79 53.30 1tc5 n ASP 29 Cb 0.00 -0.01 -0.08 0.00 -1.03 0.00 0.00 41.12 40.00 1tc5 n ASP 29 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1tc5 s LYS 30 N 0.00 3.86 -0.07 0.11 2.20 -1.26 -5.05 119.74 119.53 1tc5 s LYS 30 Ca 0.00 0.07 0.01 0.00 -0.36 0.00 0.00 55.97 55.69 1tc5 s LYS 30 Cb 0.00 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.57 1tc5 s LYS 30 CO 0.00 -0.48 -0.09 0.71 -0.36 0.00 0.00 175.35 175.13 1tc5 s TYR 31 N 2.32 2.86 0.07 4.03 1.51 -1.26 -1.32 117.35 125.57 1tc5 s TYR 31 Ca 0.19 -0.08 0.03 0.00 -1.01 0.00 0.00 57.07 56.20 1tc5 s TYR 31 Cb -0.16 -1.70 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 1tc5 s TYR 31 CO 0.11 0.24 0.06 0.14 -1.11 0.00 0.00 175.55 175.00 1tc5 s VAL 32 N -0.68 4.45 0.06 0.71 -7.23 -0.23 -4.88 120.40 112.60 1tc5 s VAL 32 Ca 0.10 -0.76 0.07 0.00 -1.81 0.00 0.00 61.98 59.58 1tc5 s VAL 32 Cb -0.11 -3.12 -0.03 0.00 0.56 0.00 0.00 36.38 33.67 1tc5 s VAL 32 CO 0.01 0.16 -0.16 -0.13 -0.31 0.00 0.00 175.10 174.67 1tc5 s ARG 33 N -2.27 2.07 0.08 4.82 0.52 -1.26 -0.96 118.95 121.94 1tc5 s ARG 33 Ca 0.28 -1.00 0.05 0.00 -0.52 0.00 0.00 55.73 54.54 1tc5 s ARG 33 Cb -0.12 -2.21 -0.03 0.00 0.52 0.00 0.00 34.95 33.11 1tc5 s ARG 33 CO 0.20 0.53 -0.14 0.00 0.02 0.00 0.00 175.30 175.91 1tc5 s ALA 34 N -0.99 1.20 0.11 2.13 0.00 -0.32 -4.96 121.76 118.92 1tc5 s ALA 34 Ca 0.16 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1tc5 s ALA 34 Cb -0.11 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1tc5 s ALA 34 CO 0.07 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.39 1tc5 n GLY 35 N 1.18 1.70 3.76 0.00 0.00 -1.26 -0.99 105.19 109.58 1tc5 n GLY 35 Ca -0.20 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 1tc5 n GLY 35 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1tc5 s ARG 36 N 3.55 4.37 0.00 1.61 3.52 -0.49 -4.31 118.95 127.20 1tc5 s ARG 36 Ca 0.00 2.16 0.00 0.00 -0.13 0.00 0.00 55.73 57.76 1tc5 s ARG 36 Cb 0.00 -3.11 0.00 0.00 -1.56 0.00 0.00 34.95 30.28 1tc5 s ARG 36 CO 0.00 -0.20 0.00 0.41 -0.81 0.00 0.00 175.30 174.70 1tc5 n GLY 37 N 1.36 -0.54 3.04 8.12 0.00 -0.35 -0.83 105.19 115.99 1tc5 n GLY 37 Ca 0.02 -0.17 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 1tc5 n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tc5 s VAL 38 N -1.10 1.11 -0.23 1.61 1.01 -0.55 -0.93 120.40 121.32 1tc5 s VAL 38 Ca 0.00 -0.50 -0.13 0.00 0.00 0.00 0.00 61.98 61.35 1tc5 s VAL 38 Cb 0.00 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 1tc5 s VAL 38 CO 0.00 0.34 0.28 -0.32 0.00 0.00 0.00 175.10 175.40 1tc5 s MET 39 N 0.39 4.11 -0.21 2.72 1.75 -0.37 -1.39 119.30 126.30 1tc5 s MET 39 Ca -0.09 -0.04 -0.03 0.00 -1.25 0.00 0.00 55.69 54.28 1tc5 s MET 39 Cb -0.13 -3.55 -0.00 0.00 2.84 0.00 0.00 34.83 33.98 1tc5 s MET 39 CO 0.02 -0.02 -0.07 0.08 -0.65 0.00 0.00 175.02 174.38 1tc5 s VAL 40 N 1.28 3.17 -0.15 10.11 1.01 0.89 -1.33 120.40 135.39 1tc5 s VAL 40 Ca 0.13 -0.56 -0.13 0.00 0.00 0.00 0.00 61.98 61.42 1tc5 s VAL 40 Cb -0.14 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.76 1tc5 s VAL 40 CO 0.07 0.45 0.27 -0.31 0.00 0.00 0.00 175.10 175.57 1tc5 s TYR 41 N 1.37 3.50 -0.01 5.22 2.02 -0.02 0.12 117.35 129.55 1tc5 s TYR 41 Ca 0.05 0.59 0.03 0.00 -0.37 0.00 0.00 57.07 57.37 1tc5 s TYR 41 Cb -0.14 -2.27 -0.01 0.00 -0.40 0.00 0.00 41.96 39.15 1tc5 s TYR 41 CO -0.04 0.34 -0.09 -1.50 -1.57 0.00 0.00 175.55 172.69 1tc5 s ILE 42 N 0.13 0.73 0.02 2.71 2.07 -0.61 -1.28 121.20 124.96 1tc5 s ILE 42 Ca 0.16 -0.39 0.01 0.00 -1.41 0.00 0.00 60.65 59.02 1tc5 s ILE 42 Cb -0.13 -0.61 -0.01 0.00 0.13 0.00 0.00 42.46 41.83 1tc5 s ILE 42 CO 0.04 0.21 -0.04 0.00 -1.91 0.00 0.00 174.94 173.24 1tc5 s ALA 43 N -0.17 0.23 -0.22 1.50 0.00 -0.50 -0.89 121.76 121.72 1tc5 s ALA 43 Ca 0.03 -0.42 -0.02 0.00 0.00 0.00 0.00 51.96 51.55 1tc5 s ALA 43 Cb -0.04 0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.14 1tc5 s ALA 43 CO -0.00 -0.05 -0.09 -0.06 0.00 0.00 0.00 175.76 175.55 1tc5 s PHE 44 N -0.87 2.94 0.24 0.00 0.08 -1.26 -1.01 117.98 118.08 1tc5 s PHE 44 Ca -0.08 -1.32 0.11 0.00 0.12 0.00 0.00 56.93 55.76 1tc5 s PHE 44 Cb -0.06 -2.04 -0.05 0.00 -0.57 0.00 0.00 43.02 40.30 1tc5 s PHE 44 CO -0.00 -0.68 -0.19 -0.51 -0.10 0.00 0.00 175.22 173.74 1tc5 s LEU 45 N 1.38 2.60 -0.15 -0.37 1.43 0.26 -2.05 118.68 121.79 1tc5 s LEU 45 Ca 0.04 -0.90 -0.24 0.00 -1.03 0.00 0.00 54.13 52.00 1tc5 s LEU 45 Cb -0.15 -1.22 0.06 0.00 0.03 0.00 0.00 46.19 44.92 1tc5 s LEU 45 CO -0.07 0.08 0.61 -0.55 0.23 0.00 0.00 176.35 176.65 1tc5 s SER 46 N -3.13 -0.60 0.66 2.29 0.15 0.71 -1.77 113.70 112.02 1tc5 s SER 46 Ca 0.26 0.94 -0.10 0.00 0.70 0.00 0.00 55.95 57.75 1tc5 s SER 46 Cb -0.07 0.91 0.01 0.00 -1.71 0.00 0.00 66.02 65.16 1tc5 s SER 46 CO 0.13 -0.38 1.03 -1.81 1.20 0.00 0.00 173.24 173.42 1tc5 s ASP 47 N -0.39 5.59 0.32 5.45 1.01 -1.26 -4.51 116.67 122.88 1tc5 s ASP 47 Ca -0.05 1.06 0.02 0.00 0.71 0.00 0.00 52.55 54.28 1tc5 s ASP 47 Cb -0.03 -1.95 0.57 0.00 1.01 0.00 0.00 42.92 42.52 1tc5 s ASP 47 CO 0.04 -1.20 1.94 0.08 0.21 0.00 0.00 175.17 176.24 1tc5 h ARG 48 N -0.48 0.95 -0.57 8.23 -0.00 -1.99 -3.07 114.38 117.45 1tc5 h ARG 48 Ca -0.45 -0.06 -0.32 0.00 -0.00 0.00 0.00 59.98 59.16 1tc5 h ARG 48 Cb 1.25 -0.21 -0.19 0.00 -0.00 0.00 0.00 29.97 30.82 1tc5 h ARG 48 CO 0.63 0.63 0.10 -3.47 -0.00 0.00 0.00 179.97 177.86 1tc5 n ASP 49 N -4.47 3.23 -4.85 0.08 4.64 -1.26 -5.01 116.55 108.91 1tc5 n ASP 49 Ca 0.12 -3.76 -0.37 0.00 -1.38 0.00 0.00 54.79 49.41 1tc5 n ASP 49 Cb 0.17 -0.69 -0.06 0.00 -1.04 0.00 0.00 41.12 39.50 1tc5 n ASP 49 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 1tc5 s SER 50 N -2.28 6.69 0.49 1.67 1.04 -1.16 -4.74 113.70 115.41 1tc5 s SER 50 Ca 0.49 0.83 -0.21 0.00 0.48 0.00 0.00 55.95 57.54 1tc5 s SER 50 Cb 0.43 -2.20 -0.07 0.00 0.10 0.00 0.00 66.02 64.28 1tc5 s SER 50 CO 0.02 0.28 1.11 0.00 0.98 0.00 0.00 173.24 175.63 1tc5 s ALA 51 N -1.19 2.85 0.58 5.32 0.00 -1.26 -4.84 121.76 123.21 1tc5 s ALA 51 Ca 0.26 0.79 -0.16 0.00 0.00 0.00 0.00 51.96 52.85 1tc5 s ALA 51 Cb -0.15 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 1tc5 s ALA 51 CO 0.14 -0.58 1.05 -1.25 0.00 0.00 0.00 175.76 175.12 1tc5 s PRO 52 N -3.02 3.42 -0.30 0.00 0.04 -1.26 -3.58 135.00 130.30 1tc5 s PRO 52 Ca 0.67 1.18 -0.29 0.00 0.04 0.00 0.00 61.00 62.60 1tc5 s PRO 52 Cb -0.23 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.27 1tc5 s PRO 52 CO 0.28 -0.72 1.20 0.42 0.04 0.00 0.00 177.00 178.21 1tc5 s ILE 53 N -2.45 4.31 1.04 0.56 1.01 -1.26 -4.97 121.20 119.44 1tc5 s ILE 53 Ca 0.63 1.50 -0.17 0.00 0.00 0.00 0.00 60.65 62.61 1tc5 s ILE 53 Cb -0.15 -4.26 0.24 0.00 0.01 0.00 0.00 42.46 38.29 1tc5 s ILE 53 CO 0.35 -0.46 1.29 0.42 0.00 0.00 0.00 174.94 176.55 1tc5 s THR 54 N 3.99 1.89 0.18 2.92 -4.23 -1.26 -4.88 115.64 114.26 1tc5 s THR 54 Ca 0.51 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 60.95 1tc5 s THR 54 Cb -0.15 -2.88 0.01 0.00 1.34 0.00 0.00 72.50 70.82 1tc5 s THR 54 CO 0.19 0.00 1.58 0.44 -0.54 0.00 0.00 174.62 176.29 1tc5 h ASP 55 N -1.94 0.91 -0.37 3.99 3.32 -1.99 -2.01 116.42 118.34 1tc5 h ASP 55 Ca -0.44 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 56.21 1tc5 h ASP 55 Cb 1.24 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 1tc5 h ASP 55 CO 0.33 1.11 0.08 -0.33 -1.72 0.00 0.00 179.24 178.71 1tc5 h GLU 56 N 0.77 0.68 -0.18 3.56 3.07 -1.99 -0.40 114.58 120.10 1tc5 h GLU 56 Ca 0.10 -0.14 -0.20 0.00 -0.50 0.00 0.00 59.36 58.62 1tc5 h GLU 56 Cb 0.79 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1tc5 h GLU 56 CO 0.07 0.65 -0.67 0.00 -1.40 0.00 0.00 179.01 177.65 1tc5 h ALA 57 N 1.43 0.48 -0.49 3.43 0.00 -1.92 -1.75 119.26 120.43 1tc5 h ALA 57 Ca 0.15 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1tc5 h ALA 57 Cb 0.29 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1tc5 h ALA 57 CO 0.00 0.70 0.13 -0.07 0.00 0.00 0.00 179.25 180.01 1tc5 h LEU 58 N 0.50 0.74 -1.07 0.00 3.38 -1.00 -2.05 115.31 115.81 1tc5 h LEU 58 Ca -0.02 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 1tc5 h LEU 58 Cb 1.27 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1tc5 h LEU 58 CO 0.13 0.77 -0.23 0.03 0.09 0.00 0.00 178.44 179.24 1tc5 h ARG 59 N 0.67 0.39 -0.63 1.13 3.08 -1.11 -1.66 114.38 116.25 1tc5 h ARG 59 Ca 0.16 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1tc5 h ARG 59 Cb 0.31 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 1tc5 h ARG 59 CO -0.00 0.60 0.32 1.25 -1.07 0.00 0.00 179.97 181.06 1tc5 h HIS 60 N 0.35 0.90 -0.22 3.04 2.76 -1.17 -1.35 115.15 119.45 1tc5 h HIS 60 Ca 0.06 -0.04 -0.10 0.00 -2.20 0.00 0.00 60.37 58.09 1tc5 h HIS 60 Cb 0.59 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.26 1tc5 h HIS 60 CO 0.02 0.67 -0.28 0.00 -1.30 0.00 0.00 177.93 177.04 1tc5 h ALA 61 N 1.14 1.11 -0.45 5.26 0.00 -0.69 -1.85 119.26 123.78 1tc5 h ALA 61 Ca 0.22 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1tc5 h ALA 61 Cb 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1tc5 h ALA 61 CO -0.03 0.56 -0.20 0.28 0.00 0.00 0.00 179.25 179.86 1tc5 h VAL 62 N 0.38 1.27 -0.95 0.00 2.07 -1.14 -2.11 116.25 115.78 1tc5 h VAL 62 Ca 0.05 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.24 1tc5 h VAL 62 Cb 0.69 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 1tc5 h VAL 62 CO 0.05 0.46 0.59 1.23 0.02 0.00 0.00 177.57 179.92 1tc5 h GLY 63 N 0.93 1.36 0.89 2.17 0.00 -0.78 -0.22 103.07 107.42 1tc5 h GLY 63 Ca 0.11 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 1tc5 h GLY 63 CO 0.06 0.53 0.08 -2.08 0.00 0.00 0.00 176.54 175.13 1tc5 h VAL 64 N 1.30 1.19 -0.83 4.60 2.07 -1.13 0.32 116.25 123.78 1tc5 h VAL 64 Ca 0.34 -0.62 0.08 0.00 0.82 0.00 0.00 66.70 67.33 1tc5 h VAL 64 Cb -0.09 1.12 -0.07 0.00 -1.52 0.00 0.00 31.29 30.74 1tc5 h VAL 64 CO -0.07 0.20 0.49 0.25 0.02 0.00 0.00 177.57 178.46 1tc5 h LEU 65 N 0.25 0.72 0.00 2.57 5.85 -0.91 -2.98 115.31 120.82 1tc5 h LEU 65 Ca 0.08 0.04 -0.33 0.00 0.84 0.00 0.00 57.88 58.51 1tc5 h LEU 65 Cb 0.23 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 1tc5 h LEU 65 CO -0.00 0.43 -2.02 0.18 -0.34 0.00 0.00 178.44 176.69 1tc5 n LEU 66 N -4.71 0.54 0.05 2.25 4.77 -0.14 -4.48 117.00 115.29 1tc5 n LEU 66 Ca 0.13 0.22 0.04 0.00 -0.03 0.00 0.00 56.01 56.37 1tc5 n LEU 66 Cb 0.24 0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 41.55 1tc5 n LEU 66 CO 0.28 0.45 -0.22 1.41 -1.33 0.00 0.00 177.39 177.98 1tc5 n HIS 67 N -2.92 0.94 -2.49 -1.77 8.25 0.11 -0.85 115.22 116.49 1tc5 n HIS 67 Ca -0.24 0.30 -0.42 0.00 -0.26 0.00 0.00 57.72 57.10 1tc5 n HIS 67 Cb 1.10 -1.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.14 1tc5 n HIS 67 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1tc5 s THR 68 N -3.07 4.03 -0.54 1.59 2.01 -1.12 -4.76 115.64 113.77 1tc5 s THR 68 Ca -0.02 1.58 -0.28 0.00 0.31 0.00 0.00 61.69 63.28 1tc5 s THR 68 Cb 0.09 -4.01 0.03 0.00 0.01 0.00 0.00 72.50 68.62 1tc5 s THR 68 CO 0.81 0.19 1.13 -0.54 -0.69 0.00 0.00 174.62 175.52 1tc5 s LYS 69 N 0.39 3.55 0.03 4.92 1.02 -1.26 -4.06 119.74 124.33 1tc5 s LYS 69 Ca 0.54 0.27 -0.03 0.00 0.02 0.00 0.00 55.97 56.77 1tc5 s LYS 69 Cb -0.29 -3.99 -0.01 0.00 -0.52 0.00 0.00 37.83 33.03 1tc5 s LYS 69 CO 0.32 -1.55 -0.05 -0.89 -0.92 0.00 0.00 175.35 172.25 1tc5 n ILE 70 N 6.65 1.03 -3.88 2.17 5.41 -0.92 -4.66 119.36 125.16 1tc5 n ILE 70 Ca 0.08 0.27 -0.30 0.00 1.00 0.00 0.00 62.75 63.80 1tc5 n ILE 70 Cb 0.49 -1.67 -0.04 0.00 -0.71 0.00 0.00 39.64 37.71 1tc5 n ILE 70 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1tc5 s PHE 71 N -2.12 3.51 -1.04 1.39 0.08 -1.22 -4.67 117.98 113.91 1tc5 s PHE 71 Ca -0.05 0.27 0.09 0.00 0.12 0.00 0.00 56.93 57.37 1tc5 s PHE 71 Cb 0.01 -1.78 0.15 0.00 -0.57 0.00 0.00 43.02 40.83 1tc5 s PHE 71 CO 0.07 0.54 0.96 0.25 -0.10 0.00 0.00 175.22 176.94 1tc5 n THR 72 N 0.06 0.38 0.82 0.64 -2.24 -1.26 -0.94 114.28 111.72 1tc5 n THR 72 Ca -0.05 -0.69 0.09 0.00 -2.27 0.00 0.00 64.05 61.13 1tc5 n THR 72 Cb 0.52 0.93 0.03 0.00 -2.10 0.00 0.00 70.33 69.71 1tc5 n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tc5 n HIS 73 N 0.47 0.00 0.01 4.78 1.44 -1.26 -4.57 115.22 116.08 1tc5 n HIS 73 Ca 0.07 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.76 1tc5 n HIS 73 Cb 0.30 0.00 0.25 0.00 0.12 0.00 0.00 29.99 30.66 1tc5 n HIS 73 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 1tc5 h PHE 74 N 2.68 0.55 -2.38 -1.40 0.04 -1.95 -3.38 116.94 111.09 1tc5 h PHE 74 Ca 0.00 -0.08 -0.60 0.00 2.80 0.00 0.00 57.97 60.09 1tc5 h PHE 74 Cb 0.69 -0.15 -0.41 0.00 2.20 0.00 0.00 35.95 38.29 1tc5 h PHE 74 CO 0.00 0.62 -0.71 0.43 -0.60 0.00 0.00 178.31 178.04 1tc5 n SER 75 N -4.20 2.58 0.29 2.17 7.64 -1.26 -4.94 113.62 115.90 1tc5 n SER 75 Ca 0.01 -3.16 0.18 0.00 1.01 0.00 0.00 58.87 56.90 1tc5 n SER 75 Cb 0.33 -0.68 0.98 0.00 -1.01 0.00 0.00 64.21 63.83 1tc5 n SER 75 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1tc5 h PRO 76 N 4.56 0.00 0.00 1.43 0.13 -1.90 -0.73 132.00 135.49 1tc5 h PRO 76 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1tc5 h PRO 76 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1tc5 h PRO 76 CO 0.70 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.62 1tc5 n GLU 77 N -3.57 0.26 -2.58 0.86 0.00 -1.26 -4.82 120.64 109.52 1tc5 n GLU 77 Ca -0.02 0.11 -0.42 0.00 0.00 0.00 0.00 57.16 56.84 1tc5 n GLU 77 Cb 0.15 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.05 1tc5 n GLU 77 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1tc5 s LYS 78 N -2.57 4.54 0.10 3.44 3.01 -0.28 -4.95 119.74 123.03 1tc5 s LYS 78 Ca 0.17 1.59 -0.23 0.00 -1.01 0.00 0.00 55.97 56.50 1tc5 s LYS 78 Cb 0.12 -3.38 -0.11 0.00 -1.01 0.00 0.00 37.83 33.46 1tc5 s LYS 78 CO 0.28 -0.06 1.72 1.98 0.51 0.00 0.00 175.35 179.78 1tc5 h MET 79 N 6.32 -0.08 -4.94 1.68 1.85 -1.89 -3.39 114.93 114.47 1tc5 h MET 79 Ca -0.42 0.01 -0.67 0.00 -0.61 0.00 0.00 59.70 58.00 1tc5 h MET 79 Cb 1.22 0.02 -0.33 0.00 0.43 0.00 0.00 31.60 32.93 1tc5 h MET 79 CO 0.76 -0.05 -0.78 0.42 -0.40 0.00 0.00 176.91 176.86 1tc5 s ILE 80 N -6.18 2.64 -0.18 1.77 1.01 -1.26 -5.10 121.20 113.90 1tc5 s ILE 80 Ca -0.14 -1.04 -0.27 0.00 0.00 0.00 0.00 60.65 59.20 1tc5 s ILE 80 Cb 0.07 -2.31 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 1tc5 s ILE 80 CO 0.67 0.27 0.94 0.20 0.00 0.00 0.00 174.94 177.01 1tc5 s ASN 81 N 1.30 7.06 0.22 3.58 -0.87 -1.26 -5.04 114.94 119.92 1tc5 s ASN 81 Ca 0.01 1.31 0.11 0.00 -1.57 0.00 0.00 52.86 52.72 1tc5 s ASN 81 Cb -0.16 -2.50 -0.05 0.00 -0.02 0.00 0.00 41.25 38.52 1tc5 s ASN 81 CO -0.06 -0.51 -0.22 -1.10 -2.57 0.00 0.00 177.10 172.64 1tc5 s GLN 82 N 2.51 1.54 0.36 -0.60 -0.21 -1.26 -5.08 119.66 116.92 1tc5 s GLN 82 Ca 0.42 -1.59 -0.27 0.00 0.02 0.00 0.00 55.36 53.94 1tc5 s GLN 82 Cb -0.16 -1.75 -0.12 0.00 1.00 0.00 0.00 33.01 31.98 1tc5 s GLN 82 CO 0.11 0.36 1.20 -2.30 -2.12 0.00 0.00 175.29 172.55 1tc5 n PRO 83 N -0.02 1.86 -4.16 2.91 -0.02 -1.26 -4.55 135.00 129.76 1tc5 n PRO 83 Ca -0.10 0.66 -0.15 0.00 -2.02 0.00 0.00 63.50 61.88 1tc5 n PRO 83 Cb 0.57 -2.23 -0.11 0.00 -0.02 0.00 0.00 33.50 31.71 1tc5 n PRO 83 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1tc5 s GLN 84 N -1.93 0.79 0.38 -0.52 -0.21 -0.12 -4.76 119.66 113.29 1tc5 s GLN 84 Ca 0.58 -1.04 -0.13 0.00 0.02 0.00 0.00 55.36 54.78 1tc5 s GLN 84 Cb -0.57 -0.57 -0.08 0.00 1.00 0.00 0.00 33.01 32.79 1tc5 s GLN 84 CO 0.60 0.10 0.78 -1.54 -2.12 0.00 0.00 175.29 173.11 1tc5 s SER 85 N -2.13 6.65 0.35 5.90 1.04 -1.26 -2.17 113.70 122.08 1tc5 s SER 85 Ca 0.01 1.25 0.04 0.00 0.48 0.00 0.00 55.95 57.73 1tc5 s SER 85 Cb -0.06 -2.37 0.68 0.00 0.10 0.00 0.00 66.02 64.38 1tc5 s SER 85 CO 0.01 -0.33 1.96 -0.07 0.98 0.00 0.00 173.24 175.79 1tc5 h LEU 86 N 1.70 0.72 -0.65 2.42 3.38 -1.71 -2.85 115.31 118.32 1tc5 h LEU 86 Ca -0.47 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.55 1tc5 h LEU 86 Cb 1.18 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 1tc5 h LEU 86 CO 0.64 0.48 0.36 -0.08 0.09 0.00 0.00 178.44 179.93 1tc5 h GLU 87 N 0.82 0.65 -0.00 1.13 4.81 -1.34 -0.93 114.58 119.72 1tc5 h GLU 87 Ca 0.31 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1tc5 h GLU 87 Cb 0.17 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1tc5 h GLU 87 CO -0.10 0.43 -0.00 -0.85 -0.73 0.00 0.00 179.01 177.76 1tc5 n GLU 88 N -4.80 0.47 -3.56 1.92 0.28 -1.09 -3.84 120.64 110.03 1tc5 n GLU 88 Ca 0.08 -0.01 -0.27 0.00 -0.16 0.00 0.00 57.16 56.80 1tc5 n GLU 88 Cb 0.17 -1.50 -0.10 0.00 1.43 0.00 0.00 31.44 31.44 1tc5 n GLU 88 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1tc5 h PRO 90 N 4.72 0.00 0.00 0.00 0.13 -1.66 -2.67 132.00 132.52 1tc5 h PRO 90 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1tc5 h PRO 90 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1tc5 h PRO 90 CO 0.71 0.00 -0.51 0.39 -0.23 0.00 0.00 178.00 178.36 1tc5 n GLU 91 N -3.12 0.05 -1.88 0.86 1.02 -1.26 -4.54 120.64 111.77 1tc5 n GLU 91 Ca -0.02 0.01 -0.39 0.00 -0.02 0.00 0.00 57.16 56.74 1tc5 n GLU 91 Cb 0.16 -1.53 0.02 0.00 -0.02 0.00 0.00 31.44 30.08 1tc5 n GLU 91 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1tc5 s MET 92 N -3.03 3.42 0.33 3.49 -1.94 -1.01 -1.26 119.30 119.30 1tc5 s MET 92 Ca 0.10 2.20 -0.11 0.00 -1.71 0.00 0.00 55.69 56.17 1tc5 s MET 92 Cb 0.17 -2.41 -0.07 0.00 2.01 0.00 0.00 34.83 34.53 1tc5 s MET 92 CO 0.70 -0.96 0.69 -0.51 -0.01 0.00 0.00 175.02 174.93 1tc5 s ASP 93 N -0.90 6.61 -0.07 3.03 1.11 -0.01 -4.19 116.67 122.26 1tc5 s ASP 93 Ca 0.67 1.08 0.03 0.00 0.18 0.00 0.00 52.55 54.51 1tc5 s ASP 93 Cb -0.39 -2.30 0.01 0.00 1.07 0.00 0.00 42.92 41.31 1tc5 s ASP 93 CO 0.48 -0.24 -0.14 -0.63 1.18 0.00 0.00 175.17 175.81 1tc5 s ILE 94 N -2.10 1.27 -0.20 0.77 1.01 -0.27 -1.48 121.20 120.21 1tc5 s ILE 94 Ca 0.50 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.60 1tc5 s ILE 94 Cb -0.10 -1.14 0.03 0.00 0.01 0.00 0.00 42.46 41.25 1tc5 s ILE 94 CO 0.25 0.38 -0.16 -0.22 0.00 0.00 0.00 174.94 175.19 1tc5 s LEU 95 N 0.55 2.50 -0.18 2.97 2.96 -0.49 -0.50 118.68 126.50 1tc5 s LEU 95 Ca -0.14 -0.78 -0.03 0.00 -0.22 0.00 0.00 54.13 52.96 1tc5 s LEU 95 Cb -0.16 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 44.99 1tc5 s LEU 95 CO 0.04 -0.04 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.34 1tc5 s ILE 96 N 1.27 3.56 -0.13 6.68 1.01 0.44 -0.08 121.20 133.96 1tc5 s ILE 96 Ca 0.02 -0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.23 1tc5 s ILE 96 Cb -0.15 -2.58 0.01 0.00 0.01 0.00 0.00 42.46 39.76 1tc5 s ILE 96 CO -0.10 0.47 -0.18 -0.69 0.00 0.00 0.00 174.94 174.43 1tc5 s VAL 97 N 0.80 1.77 0.00 2.92 1.01 0.12 -0.92 120.40 126.11 1tc5 s VAL 97 Ca -0.02 -0.80 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 1tc5 s VAL 97 Cb -0.15 -1.60 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 1tc5 s VAL 97 CO 0.02 0.49 1.38 -2.16 0.00 0.00 0.00 175.10 174.83 1tc5 s PRO 98 N 0.98 4.29 -0.40 2.72 0.04 -1.26 -1.58 135.00 139.79 1tc5 s PRO 98 Ca -0.05 1.94 0.06 0.00 0.04 0.00 0.00 61.00 62.99 1tc5 s PRO 98 Cb -0.15 -3.55 0.20 0.00 0.04 0.00 0.00 34.50 31.05 1tc5 s PRO 98 CO -0.03 -0.55 0.41 1.04 0.04 0.00 0.00 177.00 177.91 1tc5 n GLN 99 N 5.24 0.39 0.26 4.56 1.13 -0.07 -4.84 117.38 124.05 1tc5 n GLN 99 Ca 0.13 -3.18 0.12 0.00 -1.94 0.00 0.00 57.00 52.13 1tc5 n GLN 99 Cb 0.44 -1.49 0.72 0.00 0.11 0.00 0.00 30.24 30.02 1tc5 n GLN 99 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1tc5 h ALA 100 N 4.99 1.35 0.00 -1.58 0.00 -1.93 -2.63 119.26 119.47 1tc5 h ALA 100 Ca 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1tc5 h ALA 100 Cb 0.90 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1tc5 h ALA 100 CO 0.40 0.14 0.00 -1.13 0.00 0.00 0.00 179.25 178.67 1tc5 n SER 101 N -3.74 0.47 0.29 0.00 3.41 -1.26 -1.95 113.62 110.84 1tc5 n SER 101 Ca -0.02 0.68 0.18 0.00 -0.26 0.00 0.00 58.87 59.46 1tc5 n SER 101 Cb 0.22 -0.76 0.95 0.00 -0.26 0.00 0.00 64.21 64.37 1tc5 n SER 101 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1tc5 h LEU 102 N 0.00 0.00 -0.25 1.04 3.38 -1.85 -1.10 115.31 116.53 1tc5 h LEU 102 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tc5 h LEU 102 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1tc5 h LEU 102 CO 0.00 0.00 -0.28 0.61 0.09 0.00 0.00 178.44 178.86 1tc5 n GLY 103 N -1.24 -0.94 3.71 0.83 0.00 -0.82 -4.94 105.19 101.79 1tc5 n GLY 103 Ca -0.01 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 1tc5 n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tc5 n GLY 104 N 1.39 0.62 3.15 -0.02 0.00 -0.42 -4.57 105.19 105.34 1tc5 n GLY 104 Ca 0.10 0.20 -0.20 0.00 0.00 0.00 0.00 46.02 46.13 1tc5 n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tc5 s LYS 105 N -2.22 0.90 0.19 1.61 1.02 -0.46 -4.97 119.74 115.81 1tc5 s LYS 105 Ca 0.61 -0.82 -0.32 0.00 0.02 0.00 0.00 55.97 55.46 1tc5 s LYS 105 Cb -0.50 -0.92 -0.11 0.00 -0.52 0.00 0.00 37.83 35.78 1tc5 s LYS 105 CO 0.58 0.22 1.62 0.08 -0.92 0.00 0.00 175.35 176.93 1tc5 s VAL 106 N -0.97 2.37 -0.27 3.17 1.01 -1.26 -0.69 120.40 123.76 1tc5 s VAL 106 Ca 0.01 0.27 -0.02 0.00 0.00 0.00 0.00 61.98 62.24 1tc5 s VAL 106 Cb -0.08 -3.17 0.09 0.00 0.00 0.00 0.00 36.38 33.21 1tc5 s VAL 106 CO 0.02 0.02 0.08 -0.75 0.00 0.00 0.00 175.10 174.47 1tc5 s LYS 107 N 0.97 0.63 7.19 2.72 2.20 -0.03 -4.85 119.74 128.58 1tc5 s LYS 107 Ca 0.71 -0.77 0.00 0.00 -0.36 0.00 0.00 55.97 55.55 1tc5 s LYS 107 Cb -0.46 -1.92 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 1tc5 s LYS 107 CO 0.33 -0.87 0.00 0.41 -0.36 0.00 0.00 175.35 174.86 1tc5 n GLY 108 N 4.97 3.10 1.04 5.54 0.00 -1.26 -1.05 105.19 117.54 1tc5 n GLY 108 Ca -0.05 0.23 0.01 0.00 0.00 0.00 0.00 46.02 46.20 1tc5 n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tc5 n ARG 109 N 8.29 2.24 -3.72 1.61 1.74 -1.26 -4.99 116.66 120.56 1tc5 n ARG 109 Ca 0.00 -3.03 -0.17 0.00 -0.77 0.00 0.00 57.85 53.89 1tc5 n ARG 109 Cb 0.00 -1.83 -0.05 0.00 -1.02 0.00 0.00 32.46 29.56 1tc5 n ARG 109 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1tc5 n SER 110 N -0.91 0.44 -4.24 0.55 3.41 -0.22 -5.16 113.62 107.49 1tc5 n SER 110 Ca 0.29 -2.61 -0.30 0.00 -0.26 0.00 0.00 58.87 55.98 1tc5 n SER 110 Cb 0.98 0.96 -0.16 0.00 -0.26 0.00 0.00 64.21 65.74 1tc5 n SER 110 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1tc5 s VAL 111 N -2.82 1.94 0.03 -3.33 1.01 -1.26 -0.85 120.40 115.11 1tc5 s VAL 111 Ca 0.21 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.24 1tc5 s VAL 111 Cb 0.01 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 1tc5 s VAL 111 CO 0.15 0.54 -0.09 0.00 0.00 0.00 0.00 175.10 175.70 1tc5 s GLN 112 N -0.14 2.40 -0.23 2.72 1.03 0.13 -4.90 119.66 120.68 1tc5 s GLN 112 Ca -0.03 -0.82 0.11 0.00 0.04 0.00 0.00 55.36 54.66 1tc5 s GLN 112 Cb -0.13 -2.41 0.44 0.00 0.03 0.00 0.00 33.01 30.93 1tc5 s GLN 112 CO 0.03 0.57 1.29 1.19 -2.54 0.00 0.00 175.29 175.84 1tc5 n PHE 113 N 1.39 0.34 0.28 9.60 3.72 -1.26 -1.36 117.46 130.18 1tc5 n PHE 113 Ca -0.15 -1.49 0.15 0.00 -0.05 0.00 0.00 57.45 55.91 1tc5 n PHE 113 Cb 0.52 -0.32 0.85 0.00 -0.94 0.00 0.00 39.48 39.59 1tc5 n PHE 113 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1tc5 h HIS 114 N 0.95 0.00 0.00 1.38 3.86 -1.96 -1.54 115.15 117.83 1tc5 h HIS 114 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1tc5 h HIS 114 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 1tc5 h HIS 114 CO 0.79 0.06 0.00 1.04 0.86 0.00 0.00 177.93 180.68 1tc5 n GLN 115 N -3.58 0.09 -2.57 2.45 6.02 -1.26 -4.85 117.38 113.67 1tc5 n GLN 115 Ca -0.02 0.10 -0.41 0.00 -0.01 0.00 0.00 57.00 56.66 1tc5 n GLN 115 Cb 0.18 -1.61 -0.04 0.00 1.02 0.00 0.00 30.24 29.79 1tc5 n GLN 115 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1tc5 s LEU 116 N -3.51 4.43 0.76 1.08 1.02 -0.58 -0.21 118.68 121.67 1tc5 s LEU 116 Ca 0.12 1.92 -0.15 0.00 0.02 0.00 0.00 54.13 56.05 1tc5 s LEU 116 Cb 0.16 -3.59 0.06 0.00 0.02 0.00 0.00 46.19 42.84 1tc5 s LEU 116 CO 0.52 -0.27 1.23 0.68 0.02 0.00 0.00 176.35 178.53 1tc5 s VAL 117 N 0.43 2.07 0.88 -1.59 -7.23 -0.87 -4.82 120.40 109.26 1tc5 s VAL 117 Ca 0.52 0.03 -0.13 0.00 -1.81 0.00 0.00 61.98 60.59 1tc5 s VAL 117 Cb -0.27 -2.60 0.05 0.00 0.56 0.00 0.00 36.38 34.13 1tc5 s VAL 117 CO 0.31 -0.02 0.73 0.00 -0.31 0.00 0.00 175.10 175.81 1tc5 n ALA 118 N -2.90 -1.54 -0.02 1.32 0.00 -1.26 -4.71 120.51 111.39 1tc5 n ALA 118 Ca 0.14 -0.48 -0.09 0.00 0.00 0.00 0.00 53.44 53.01 1tc5 n ALA 118 Cb 0.50 -1.98 -0.04 0.00 0.00 0.00 0.00 19.45 17.94 1tc5 n ALA 118 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1tc5 h LYS 119 N -1.28 -0.01 -0.02 0.00 3.64 -1.98 -0.52 116.57 116.40 1tc5 h LYS 119 Ca -0.44 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 58.79 1tc5 h LYS 119 Cb 1.29 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 1tc5 h LYS 119 CO 0.39 -0.00 -0.68 -0.44 -2.27 0.00 0.00 179.45 176.45 1tc5 h ASP 120 N -0.01 0.11 -0.28 4.20 3.32 -1.99 0.23 116.42 122.00 1tc5 h ASP 120 Ca 0.08 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.00 1tc5 h ASP 120 Cb 0.12 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1tc5 h ASP 120 CO -0.17 0.75 -0.05 0.58 -1.72 0.00 0.00 179.24 178.64 1tc5 h VAL 121 N 0.06 1.27 -0.58 -1.35 2.07 -1.89 -2.20 116.25 113.64 1tc5 h VAL 121 Ca -0.01 -1.04 -0.10 0.00 0.82 0.00 0.00 66.70 66.37 1tc5 h VAL 121 Cb 1.20 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 1tc5 h VAL 121 CO 0.09 0.33 -0.03 1.23 0.02 0.00 0.00 177.57 179.22 1tc5 h GLY 122 N 0.29 1.11 0.95 2.17 0.00 -0.85 -1.23 103.07 105.50 1tc5 h GLY 122 Ca 0.07 -0.82 0.02 0.00 0.00 0.00 0.00 47.33 46.60 1tc5 h GLY 122 CO 0.02 0.76 0.37 0.00 0.00 0.00 0.00 176.54 177.69 1tc5 h ALA 123 N 1.02 0.75 -0.22 3.60 0.00 -0.92 -0.12 119.26 123.37 1tc5 h ALA 123 Ca 0.16 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1tc5 h ALA 123 Cb 0.58 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1tc5 h ALA 123 CO 0.03 0.13 -0.06 0.00 0.00 0.00 0.00 179.25 179.36 1tc5 h ALA 124 N 1.23 0.30 -0.72 0.00 0.00 -1.19 -1.34 119.26 117.54 1tc5 h ALA 124 Ca 0.22 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1tc5 h ALA 124 Cb -0.04 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1tc5 h ALA 124 CO -0.07 0.09 0.20 -0.07 0.00 0.00 0.00 179.25 179.40 1tc5 h LEU 125 N 0.15 1.07 -0.12 0.00 3.38 -1.17 -1.38 115.31 117.25 1tc5 h LEU 125 Ca 0.05 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1tc5 h LEU 125 Cb 0.52 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1tc5 h LEU 125 CO 0.02 1.01 0.02 0.22 0.09 0.00 0.00 178.44 179.80 1tc5 h TYR 126 N 1.08 0.22 -0.65 1.13 3.20 -0.94 0.15 116.97 121.16 1tc5 h TYR 126 Ca 0.23 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.11 1tc5 h TYR 126 Cb 0.34 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.51 1tc5 h TYR 126 CO 0.03 0.40 0.38 0.22 -1.64 0.00 0.00 178.16 177.55 1tc5 h ASP 127 N -0.03 0.59 -0.46 -2.11 3.58 -1.20 -1.00 116.42 115.79 1tc5 h ASP 127 Ca 0.04 0.02 -0.13 0.00 0.42 0.00 0.00 57.03 57.37 1tc5 h ASP 127 Cb 0.30 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 1tc5 h ASP 127 CO 0.00 0.40 -0.22 -0.09 -2.88 0.00 0.00 179.24 176.45 1tc5 h ARG 128 N 0.72 0.97 -0.68 0.28 9.65 -0.97 -1.54 114.38 122.82 1tc5 h ARG 128 Ca 0.28 -0.42 -0.06 0.00 -1.10 0.00 0.00 59.98 58.68 1tc5 h ARG 128 Cb 0.10 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.63 1tc5 h ARG 128 CO -0.14 1.09 0.19 0.35 2.80 0.00 0.00 179.97 184.26 1tc5 h PHE 129 N 0.81 1.11 -0.47 2.20 3.57 -0.50 -1.56 116.94 122.10 1tc5 h PHE 129 Ca 0.10 -0.12 -0.14 0.00 3.53 0.00 0.00 57.97 61.35 1tc5 h PHE 129 Cb 0.80 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1tc5 h PHE 129 CO 0.05 0.90 -0.23 0.00 -2.23 0.00 0.00 178.31 176.80 1tc5 h HIS 131 N 0.85 0.05 -0.53 0.00 -0.00 -1.05 -1.30 115.15 113.16 1tc5 h HIS 131 Ca 0.11 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.46 1tc5 h HIS 131 Cb 0.81 0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 28.22 1tc5 h HIS 131 CO 0.05 -0.01 0.20 0.74 -0.00 0.00 0.00 177.93 178.91 1tc5 h PHE 132 N 0.13 0.76 -0.13 5.26 0.04 -1.17 -1.13 116.94 120.70 1tc5 h PHE 132 Ca 0.14 -0.04 -0.05 0.00 2.80 0.00 0.00 57.97 60.81 1tc5 h PHE 132 Cb 0.16 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.08 1tc5 h PHE 132 CO -0.19 0.60 -0.13 0.28 -0.60 0.00 0.00 178.31 178.28 1tc5 h VAL 133 N 0.75 1.35 -0.66 -0.55 2.07 -1.16 -1.55 116.25 116.50 1tc5 h VAL 133 Ca 0.18 -1.28 0.12 0.00 0.82 0.00 0.00 66.70 66.54 1tc5 h VAL 133 Cb 0.17 1.90 -0.09 0.00 -1.52 0.00 0.00 31.29 31.74 1tc5 h VAL 133 CO -0.02 0.37 0.19 0.03 0.02 0.00 0.00 177.57 178.17 1tc5 h ARG 134 N -0.06 0.32 -0.36 1.57 3.08 -0.97 -1.06 114.38 116.91 1tc5 h ARG 134 Ca 0.02 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1tc5 h ARG 134 Cb 0.65 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 1tc5 h ARG 134 CO 0.03 0.21 -0.02 0.28 -1.07 0.00 0.00 179.97 179.41 1tc5 h VAL 135 N 0.33 1.26 0.00 2.04 2.07 -1.11 -0.68 116.25 120.17 1tc5 h VAL 135 Ca 0.35 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1tc5 h VAL 135 Cb 0.52 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1tc5 h VAL 135 CO -0.40 0.34 0.00 0.00 0.02 0.00 0.00 177.57 177.53 1tc5 h ALA 136 N 0.85 1.00 -0.22 1.67 0.00 -0.73 -2.37 119.26 119.46 1tc5 h ALA 136 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1tc5 h ALA 136 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1tc5 h ALA 136 CO 0.02 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.81 1tc5 n ARG 137 N -2.45 2.09 -1.57 0.00 5.12 -0.45 -4.98 116.66 114.42 1tc5 n ARG 137 Ca 0.02 -1.95 -0.06 0.00 -1.93 0.00 0.00 57.85 53.93 1tc5 n ARG 137 Cb 0.25 -1.41 -0.02 0.00 -1.16 0.00 0.00 32.46 30.12 1tc5 n ARG 137 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1tc5 n GLY 138 N 1.18 0.54 3.73 -0.13 0.00 -0.79 -4.99 105.19 104.75 1tc5 n GLY 138 Ca 0.15 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 1tc5 n GLY 138 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tc5 s VAL 139 N -2.26 2.99 -0.84 1.61 1.01 -0.33 -4.94 120.40 117.64 1tc5 s VAL 139 Ca 0.00 0.78 -0.25 0.00 0.00 0.00 0.00 61.98 62.50 1tc5 s VAL 139 Cb 0.00 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.91 1tc5 s VAL 139 CO 0.00 0.10 1.40 -0.62 0.00 0.00 0.00 175.10 175.98 1tc5 s ASP 140 N 0.61 6.18 0.14 3.32 -1.08 -1.26 -4.79 116.67 119.79 1tc5 s ASP 140 Ca 0.61 -0.76 0.18 0.00 -0.52 0.00 0.00 52.55 52.06 1tc5 s ASP 140 Cb -0.39 -2.56 0.77 0.00 -1.46 0.00 0.00 42.92 39.28 1tc5 s ASP 140 CO 0.37 -1.80 1.54 -0.62 0.52 0.00 0.00 175.17 175.19 1tc5 n GLU 141 N 9.18 0.10 0.02 4.34 1.02 -1.26 -1.37 120.64 132.66 1tc5 n GLU 141 Ca 0.16 0.39 0.13 0.00 -0.02 0.00 0.00 57.16 57.82 1tc5 n GLU 141 Cb 0.50 -1.71 0.42 0.00 -0.02 0.00 0.00 31.44 30.63 1tc5 n GLU 141 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1tc5 n SER 142 N -1.89 0.33 -0.37 1.62 3.41 -1.26 -3.87 113.62 111.59 1tc5 n SER 142 Ca 0.02 0.20 0.08 0.00 -0.26 0.00 0.00 58.87 58.90 1tc5 n SER 142 Cb 0.16 -0.19 -0.00 0.00 -0.26 0.00 0.00 64.21 63.93 1tc5 n SER 142 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1tc5 n ARG 143 N -1.63 1.67 -4.46 4.33 5.12 -0.47 -4.98 116.66 116.24 1tc5 n ARG 143 Ca 0.06 -0.82 -0.24 0.00 -1.93 0.00 0.00 57.85 54.92 1tc5 n ARG 143 Cb 0.36 -1.27 -0.10 0.00 -1.16 0.00 0.00 32.46 30.28 1tc5 n ARG 143 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1tc5 s VAL 144 N -1.88 2.53 0.00 1.55 -7.23 -1.21 -1.01 120.40 113.16 1tc5 s VAL 144 Ca 0.13 -2.34 0.00 0.00 -1.81 0.00 0.00 61.98 57.96 1tc5 s VAL 144 Cb 0.13 -2.39 0.00 0.00 0.56 0.00 0.00 36.38 34.68 1tc5 s VAL 144 CO 0.40 -0.37 0.00 -0.90 -0.31 0.00 0.00 175.10 173.92 1tc5 n ASP 145 N -0.67 0.00 0.27 4.85 5.68 0.30 -4.70 116.55 122.29 1tc5 n ASP 145 Ca -0.05 -0.82 0.11 0.00 -0.50 0.00 0.00 54.79 53.53 1tc5 n ASP 145 Cb 0.60 0.00 0.75 0.00 -1.14 0.00 0.00 41.12 41.33 1tc5 n ASP 145 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1tc5 h ALA 146 N -0.49 1.64 -0.40 2.12 0.00 -1.98 -2.01 119.26 118.14 1tc5 h ALA 146 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1tc5 h ALA 146 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1tc5 h ALA 146 CO 0.00 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.40 1tc5 n ASN 147 N -4.08 3.31 0.00 0.00 4.13 -1.26 -4.84 115.26 112.52 1tc5 n ASN 147 Ca -0.03 -1.97 0.00 0.00 1.68 0.00 0.00 54.58 54.26 1tc5 n ASN 147 Cb 0.14 -0.26 0.00 0.00 -1.54 0.00 0.00 39.78 38.12 1tc5 n ASN 147 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1tc5 n GLY 148 N 1.48 0.77 3.91 7.41 0.00 -0.76 -1.18 105.19 116.83 1tc5 n GLY 148 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1tc5 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tc5 s ALA 149 N -2.86 3.27 0.34 4.61 0.00 -1.26 -4.68 121.76 121.18 1tc5 s ALA 149 Ca 0.00 -0.60 -0.28 0.00 0.00 0.00 0.00 51.96 51.08 1tc5 s ALA 149 Cb 0.00 -2.66 -0.12 0.00 0.00 0.00 0.00 23.12 20.33 1tc5 s ALA 149 CO 0.00 -0.76 1.31 -2.30 0.00 0.00 0.00 175.76 174.02 1tc5 n PRO 150 N -2.58 2.19 -0.07 0.00 -0.02 -1.26 -0.54 135.00 132.73 1tc5 n PRO 150 Ca 0.04 0.77 -0.08 0.00 -2.02 0.00 0.00 63.50 62.21 1tc5 n PRO 150 Cb 0.57 -2.37 0.08 0.00 -0.02 0.00 0.00 33.50 31.76 1tc5 n PRO 150 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tc5 h ARG 151 N 2.62 0.73 -5.82 -0.52 3.08 -1.35 -3.40 114.38 109.72 1tc5 h ARG 151 Ca -0.47 -0.33 -0.60 0.00 0.07 0.00 0.00 59.98 58.66 1tc5 h ARG 151 Cb 1.28 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 31.22 1tc5 h ARG 151 CO 0.63 0.94 0.45 0.45 -1.07 0.00 0.00 179.97 181.37 1tc5 s SER 152 N -6.79 6.74 0.62 7.04 0.15 -1.26 -4.94 113.70 115.26 1tc5 s SER 152 Ca -0.09 0.81 0.34 0.00 0.70 0.00 0.00 55.95 57.72 1tc5 s SER 152 Cb 0.13 -2.43 1.95 0.00 -1.71 0.00 0.00 66.02 63.96 1tc5 s SER 152 CO 0.84 -0.60 2.21 1.05 1.20 0.00 0.00 173.24 177.94 1tc5 h GLU 153 N 7.97 0.00 0.00 5.44 9.09 -1.99 -1.50 114.58 133.59 1tc5 h GLU 153 Ca -0.24 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.17 1tc5 h GLU 153 Cb 1.09 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.19 1tc5 h GLU 153 CO 0.89 0.00 0.00 0.78 0.05 0.00 0.00 179.01 180.73 1tc5 h GLY 154 N 0.00 0.00 1.09 1.06 0.00 -1.94 -2.92 103.07 100.36 1tc5 h GLY 154 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1tc5 h GLY 154 CO -0.00 0.00 -0.40 1.22 0.00 0.00 0.00 176.54 177.36 1tc5 n ASP 155 N -2.84 0.46 -4.76 0.19 8.00 -0.57 -4.95 116.55 112.08 1tc5 n ASP 155 Ca 0.03 -0.19 -0.39 0.00 0.71 0.00 0.00 54.79 54.95 1tc5 n ASP 155 Cb 0.40 0.12 0.02 0.00 -0.02 0.00 0.00 41.12 41.64 1tc5 n ASP 155 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1tc5 s ALA 156 N -2.95 3.08 0.84 2.24 0.00 -1.11 -4.88 121.76 118.98 1tc5 s ALA 156 Ca 0.13 1.29 -0.14 0.00 0.00 0.00 0.00 51.96 53.24 1tc5 s ALA 156 Cb 0.18 -3.53 0.01 0.00 0.00 0.00 0.00 23.12 19.78 1tc5 s ALA 156 CO 0.66 -1.08 0.52 -2.30 0.00 0.00 0.00 175.76 173.56 1tc5 n PRO 157 N -0.42 0.00 -1.63 0.00 -0.02 -1.26 -4.95 135.00 126.73 1tc5 n PRO 157 Ca 0.07 0.05 -0.36 0.00 -2.02 0.00 0.00 63.50 61.24 1tc5 n PRO 157 Cb 0.44 -1.90 0.08 0.00 -0.02 0.00 0.00 33.50 32.10 1tc5 n PRO 157 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1tc5 s LYS 158 N -3.31 2.38 0.29 -0.52 -2.85 -1.26 -4.92 119.74 109.55 1tc5 s LYS 158 Ca 0.62 1.99 0.11 0.00 -1.00 0.00 0.00 55.97 57.70 1tc5 s LYS 158 Cb -0.28 -1.83 0.40 0.00 -2.06 0.00 0.00 37.83 34.06 1tc5 s LYS 158 CO 0.62 -1.71 1.63 0.00 0.10 0.00 0.00 175.35 175.99 1tc5 h ALA 159 N 0.26 0.98 -2.24 0.59 0.00 -1.99 -3.46 119.26 113.41 1tc5 h ALA 159 Ca -0.50 -0.53 -0.29 0.00 0.00 0.00 0.00 54.91 53.59 1tc5 h ALA 159 Cb 1.33 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.88 1tc5 h ALA 159 CO 0.52 0.73 -0.69 -1.21 0.00 0.00 0.00 179.25 178.60 1tc5 s GLU 160 N -3.61 1.02 0.00 0.00 2.02 -1.26 -5.11 118.70 111.76 1tc5 s GLU 160 Ca -0.01 -1.45 0.00 0.00 0.02 0.00 0.00 54.97 53.53 1tc5 s GLU 160 Cb 0.12 -0.39 0.00 0.00 0.10 0.00 0.00 34.13 33.96 1tc5 s GLU 160 CO 0.75 -0.02 0.00 0.41 0.02 0.00 0.00 175.26 176.42 1tc5 n GLY 161 N -0.18 -1.15 3.69 -1.39 0.00 -1.26 -4.94 105.19 99.96 1tc5 n GLY 161 Ca -0.09 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 1tc5 n GLY 161 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1tc5 n TRP 162 N -0.51 2.27 -4.42 1.61 -0.00 -1.26 -5.00 117.44 110.13 1tc5 n TRP 162 Ca 0.00 0.48 -0.25 0.00 -0.00 0.00 0.00 57.50 57.73 1tc5 n TRP 162 Cb 0.00 -2.45 -0.13 0.00 -0.00 0.00 0.00 31.31 28.73 1tc5 n TRP 162 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 177.69 178.65 1tc5 s ILE 163 N -0.59 1.74 0.43 5.87 -4.36 -1.26 -5.06 121.20 117.97 1tc5 s ILE 163 Ca 0.61 -1.44 -0.23 0.00 -0.26 0.00 0.00 60.65 59.34 1tc5 s ILE 163 Cb -0.60 -1.55 -0.09 0.00 1.25 0.00 0.00 42.46 41.47 1tc5 s ILE 163 CO 0.56 0.04 1.04 -0.75 0.24 0.00 0.00 174.94 176.07 1tc5 s LYS 164 N -1.67 4.03 0.90 0.37 2.20 -1.26 -4.58 119.74 119.73 1tc5 s LYS 164 Ca 0.07 1.44 -0.12 0.00 -0.36 0.00 0.00 55.97 57.01 1tc5 s LYS 164 Cb -0.10 -2.36 0.09 0.00 -1.51 0.00 0.00 37.83 33.95 1tc5 s LYS 164 CO 0.03 -0.24 0.89 2.48 -0.36 0.00 0.00 175.35 178.15 1tc5 n TYR 165 N -0.42 0.09 -2.67 4.03 0.18 -1.26 -4.51 117.16 112.59 1tc5 n TYR 165 Ca 0.07 0.34 -0.04 0.00 1.88 0.00 0.00 57.90 60.15 1tc5 n TYR 165 Cb 0.51 -1.94 0.11 0.00 -0.38 0.00 0.00 39.34 37.64 1tc5 n TYR 165 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 1tc5 n ASN 166 N -2.97 -1.58 -3.43 9.48 4.05 -1.21 -4.99 115.26 114.61 1tc5 n ASN 166 Ca 0.10 -2.25 -0.25 0.00 0.45 0.00 0.00 54.58 52.64 1tc5 n ASN 166 Cb 0.52 0.81 0.04 0.00 1.23 0.00 0.00 39.78 42.38 1tc5 n ASN 166 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1tc5 n SER 167 N -1.06 -5.54 -4.85 1.20 7.64 -0.39 -4.95 113.62 105.67 1tc5 n SER 167 Ca -0.12 -0.48 -0.32 0.00 1.01 0.00 0.00 58.87 58.96 1tc5 n SER 167 Cb 0.84 -4.44 -0.06 0.00 -1.01 0.00 0.00 64.21 59.54 1tc5 n SER 167 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1tc5 s ARG 168 N -6.13 4.02 -0.37 1.43 0.52 -1.26 -4.81 118.95 112.35 1tc5 s ARG 168 Ca 0.48 0.74 0.01 0.00 -0.52 0.00 0.00 55.73 56.44 1tc5 s ARG 168 Cb -0.23 -2.37 0.11 0.00 0.52 0.00 0.00 34.95 32.98 1tc5 s ARG 168 CO 0.59 0.09 0.14 0.08 0.02 0.00 0.00 175.30 176.23 1tc5 s VAL 169 N -2.07 1.39 -0.09 3.52 1.01 -1.26 -1.11 120.40 121.79 1tc5 s VAL 169 Ca 0.55 -2.06 -0.10 0.00 0.00 0.00 0.00 61.98 60.38 1tc5 s VAL 169 Cb -0.10 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 1tc5 s VAL 169 CO 0.18 -0.74 0.23 -0.63 0.00 0.00 0.00 175.10 174.14 1tc5 s ILE 170 N 0.97 5.35 -0.01 2.22 -1.09 0.35 -4.25 121.20 124.73 1tc5 s ILE 170 Ca 0.13 0.41 -0.02 0.00 -2.23 0.00 0.00 60.65 58.94 1tc5 s ILE 170 Cb -0.20 -3.51 -0.00 0.00 -1.58 0.00 0.00 42.46 37.17 1tc5 s ILE 170 CO -0.12 0.59 0.04 -0.94 -1.23 0.00 0.00 174.94 173.28 1tc5 s SER 171 N -0.95 0.03 0.73 3.58 1.04 -0.32 -0.42 113.70 117.39 1tc5 s SER 171 Ca 0.18 -0.08 -0.14 0.00 0.48 0.00 0.00 55.95 56.39 1tc5 s SER 171 Cb -0.13 0.12 0.04 0.00 0.10 0.00 0.00 66.02 66.14 1tc5 s SER 171 CO 0.07 -0.13 1.14 -0.83 0.98 0.00 0.00 173.24 174.47 1tc5 s GLY 172 N -0.50 2.07 -0.25 7.32 0.00 -0.09 -4.44 107.32 111.44 1tc5 s GLY 172 Ca -0.06 0.61 -0.29 0.00 0.00 0.00 0.00 44.72 44.98 1tc5 s GLY 172 CO -0.00 0.98 1.14 -1.59 0.00 0.00 0.00 173.10 173.63 1tc5 s THR 173 N -2.37 4.46 0.27 0.90 2.01 -1.26 -4.89 115.64 114.76 1tc5 s THR 173 Ca 0.68 1.73 -0.31 0.00 0.31 0.00 0.00 61.69 64.11 1tc5 s THR 173 Cb -0.23 -4.24 -0.12 0.00 0.01 0.00 0.00 72.50 67.92 1tc5 s THR 173 CO 0.47 -0.29 1.57 0.33 -0.69 0.00 0.00 174.62 176.02 1tc5 n PHE 174 N 6.71 2.69 -0.12 4.92 7.35 -1.26 -1.99 117.46 135.76 1tc5 n PHE 174 Ca 0.13 0.26 0.00 0.00 -0.76 0.00 0.00 57.45 57.08 1tc5 n PHE 174 Cb 0.46 -2.58 0.00 0.00 0.35 0.00 0.00 39.48 37.71 1tc5 n PHE 174 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1tc5 n GLY 175 N 2.43 1.92 3.92 7.13 0.00 -1.26 -5.04 105.19 114.28 1tc5 n GLY 175 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1tc5 n GLY 175 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1tc5 s ASN 176 N -3.35 5.48 -0.04 1.61 -0.87 -0.84 -5.05 114.94 111.88 1tc5 s ASN 176 Ca 0.00 0.71 -0.30 0.00 -1.57 0.00 0.00 52.86 51.70 1tc5 s ASN 176 Cb 0.00 -1.65 -0.03 0.00 -0.02 0.00 0.00 41.25 39.55 1tc5 s ASN 176 CO 0.00 -1.15 1.18 -0.60 -2.57 0.00 0.00 177.10 173.96 1tc5 s ARG 177 N -5.05 4.38 -1.17 -0.60 3.52 -1.26 -4.96 118.95 113.80 1tc5 s ARG 177 Ca 0.55 1.66 -0.05 0.00 -0.13 0.00 0.00 55.73 57.76 1tc5 s ARG 177 Cb -0.11 -3.52 0.23 0.00 -1.56 0.00 0.00 34.95 30.00 1tc5 s ARG 177 CO 0.46 -0.39 1.89 1.04 -0.81 0.00 0.00 175.30 177.48 1tc5 n GLN 178 N 4.94 4.59 -1.64 5.12 1.13 -1.26 -4.67 117.38 125.58 1tc5 n GLN 178 Ca 0.10 -4.10 -0.46 0.00 -1.94 0.00 0.00 57.00 50.61 1tc5 n GLN 178 Cb 0.47 -2.62 -0.03 0.00 0.11 0.00 0.00 30.24 28.17 1tc5 n GLN 178 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1tc5 n GLY 179 N 1.36 0.53 2.93 1.08 0.00 -1.26 -4.83 105.19 104.99 1tc5 n GLY 179 Ca 0.44 0.49 -0.13 0.00 0.00 0.00 0.00 46.02 46.81 1tc5 n GLY 179 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tc5 s LEU 180 N 0.19 1.37 -0.10 0.99 2.96 -1.26 -0.67 118.68 122.16 1tc5 s LEU 180 Ca 0.68 0.19 0.03 0.00 -0.22 0.00 0.00 54.13 54.81 1tc5 s LEU 180 Cb -0.70 0.28 0.01 0.00 0.50 0.00 0.00 46.19 46.28 1tc5 s LEU 180 CO 0.52 -0.07 -0.19 -0.13 -1.32 0.00 0.00 176.35 175.16 1tc5 s ARG 181 N 0.43 2.51 -0.04 1.98 0.52 -0.14 -5.00 118.95 119.21 1tc5 s ARG 181 Ca -0.03 -0.68 0.01 0.00 -0.52 0.00 0.00 55.73 54.51 1tc5 s ARG 181 Cb -0.05 -2.01 0.02 0.00 0.52 0.00 0.00 34.95 33.43 1tc5 s ARG 181 CO -0.02 0.04 -0.04 0.12 0.02 0.00 0.00 175.30 175.43 1tc5 s PHE 182 N 0.68 0.67 -0.04 -0.53 5.36 -1.26 -0.62 117.98 122.25 1tc5 s PHE 182 Ca -0.12 -0.17 0.06 0.00 -0.96 0.00 0.00 56.93 55.74 1tc5 s PHE 182 Cb -0.16 -0.61 -0.01 0.00 -0.34 0.00 0.00 43.02 41.89 1tc5 s PHE 182 CO 0.03 -0.18 -0.21 -1.21 -1.46 0.00 0.00 175.22 172.19 1tc5 s GLU 183 N 0.91 1.99 -0.06 10.12 2.02 -0.24 -5.02 118.70 128.42 1tc5 s GLU 183 Ca -0.11 -0.76 -0.08 0.00 0.02 0.00 0.00 54.97 54.03 1tc5 s GLU 183 Cb -0.14 -1.79 0.02 0.00 0.10 0.00 0.00 34.13 32.32 1tc5 s GLU 183 CO -0.00 0.38 0.21 0.45 0.02 0.00 0.00 175.26 176.32 1tc5 s SER 184 N -0.25 -0.17 0.00 -0.19 0.15 -1.26 -0.82 113.70 111.16 1tc5 s SER 184 Ca 0.01 0.26 0.27 0.00 0.70 0.00 0.00 55.95 57.19 1tc5 s SER 184 Cb -0.11 0.38 1.53 0.00 -1.71 0.00 0.00 66.02 66.12 1tc5 s SER 184 CO 0.01 -0.19 1.99 -0.62 1.20 0.00 0.00 173.24 175.64 1tc5 n GLU 185 N 2.43 1.08 0.00 5.44 -0.58 -1.26 -4.80 120.64 122.95 1tc5 n GLU 185 Ca -0.16 -0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.47 1tc5 n GLU 185 Cb 0.57 -1.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.02 1tc5 n GLU 185 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1tc5 n GLY 186 N 0.95 1.23 0.31 0.62 0.00 -1.26 -5.05 105.19 101.99 1tc5 n GLY 186 Ca 0.20 0.24 0.13 0.00 0.00 0.00 0.00 46.02 46.58 1tc5 n GLY 186 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1tc5 h PRO 187 N 0.00 0.04 -6.62 1.61 0.11 -1.87 -3.41 132.00 121.86 1tc5 h PRO 187 Ca 0.00 -0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.58 1tc5 h PRO 187 Cb 0.00 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 31.03 1tc5 h PRO 187 CO 0.00 0.03 -0.92 0.34 -0.21 0.00 0.00 178.00 177.24 1tc5 n PHE 188 N -4.47 -1.57 -1.99 0.65 7.35 -1.26 -0.41 117.46 115.75 1tc5 n PHE 188 Ca 0.03 0.66 -0.42 0.00 -0.76 0.00 0.00 57.45 56.96 1tc5 n PHE 188 Cb 0.30 -3.48 -0.03 0.00 0.35 0.00 0.00 39.48 36.63 1tc5 n PHE 188 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1tc5 s THR 189 N -3.99 2.82 0.15 -2.13 2.01 -1.26 -4.69 115.64 108.56 1tc5 s THR 189 Ca 0.06 0.57 0.07 0.00 0.31 0.00 0.00 61.69 62.71 1tc5 s THR 189 Cb -0.03 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 69.07 1tc5 s THR 189 CO 0.91 0.04 -0.05 -1.00 -0.69 0.00 0.00 174.62 173.84 1tc5 s HIS 190 N 1.25 2.78 -0.20 4.92 3.76 0.01 -4.96 115.29 122.85 1tc5 s HIS 190 Ca 0.69 -0.15 -0.01 0.00 -0.15 0.00 0.00 55.06 55.43 1tc5 s HIS 190 Cb -0.42 -1.38 0.06 0.00 1.11 0.00 0.00 32.58 31.95 1tc5 s HIS 190 CO 0.31 0.49 -0.00 1.41 -0.85 0.00 0.00 174.74 176.10 1tc5 s MET 191 N -2.69 1.04 -0.10 1.40 1.75 -1.26 -0.53 119.30 118.92 1tc5 s MET 191 Ca 0.25 -0.57 0.02 0.00 -1.25 0.00 0.00 55.69 54.14 1tc5 s MET 191 Cb -0.10 -2.18 -0.01 0.00 2.84 0.00 0.00 34.83 35.38 1tc5 s MET 191 CO 0.17 -0.58 -0.18 -0.06 -0.65 0.00 0.00 175.02 173.72 1tc5 s PHE 192 N 1.70 2.68 -0.22 4.11 0.08 -0.55 -5.00 117.98 120.77 1tc5 s PHE 192 Ca -0.02 -0.67 -0.15 0.00 0.12 0.00 0.00 56.93 56.21 1tc5 s PHE 192 Cb -0.17 -1.74 -0.04 0.00 -0.57 0.00 0.00 43.02 40.50 1tc5 s PHE 192 CO -0.07 -0.20 0.36 -0.51 -0.10 0.00 0.00 175.22 174.70 1tc5 s ASP 193 N 0.10 6.35 0.00 1.36 1.01 -1.26 -1.20 116.67 123.02 1tc5 s ASP 193 Ca -0.08 0.40 0.06 0.00 0.71 0.00 0.00 52.55 53.64 1tc5 s ASP 193 Cb -0.15 -2.21 0.04 0.00 1.01 0.00 0.00 42.92 41.61 1tc5 s ASP 193 CO 0.05 -0.08 0.68 -0.38 0.21 0.00 0.00 175.17 175.65