#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dp0 s GLN 9 N 0.00 -1.77 0.00 1.96 -1.52 -1.26 -5.01 119.66 112.06 3dp0 s GLN 9 Ca 0.00 0.01 0.00 0.00 -1.95 0.00 0.00 55.36 53.42 3dp0 s GLN 9 Cb 0.00 -1.53 0.00 0.00 -0.22 0.00 0.00 33.01 31.26 3dp0 s GLN 9 CO 0.00 -4.09 0.16 0.45 -0.25 0.00 0.00 175.29 171.56 3dp0 n SER 10 N -5.04 0.32 -4.02 5.90 2.88 -1.26 -4.85 113.62 107.55 3dp0 n SER 10 Ca 0.13 -0.64 -0.26 0.00 -1.33 0.00 0.00 58.87 56.76 3dp0 n SER 10 Cb 0.60 0.56 -0.17 0.00 -0.75 0.00 0.00 64.21 64.44 3dp0 n SER 10 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 3dp0 s GLN 11 N -0.56 1.86 -0.04 -1.46 -0.44 -1.26 -2.80 119.66 114.96 3dp0 s GLN 11 Ca 0.00 -0.44 0.02 0.00 -2.50 0.00 0.00 55.36 52.44 3dp0 s GLN 11 Cb 0.00 -1.60 0.01 0.00 -1.64 0.00 0.00 33.01 29.78 3dp0 s GLN 11 CO 0.00 -0.05 -0.08 -0.06 0.50 0.00 0.00 175.29 175.60 3dp0 s PHE 12 N 0.93 0.96 0.48 1.67 0.40 -0.50 -5.00 117.98 116.92 3dp0 s PHE 12 Ca -0.09 -0.27 0.06 0.00 -0.60 0.00 0.00 56.93 56.03 3dp0 s PHE 12 Cb -0.15 -0.73 0.02 0.00 0.51 0.00 0.00 43.02 42.68 3dp0 s PHE 12 CO 0.00 -0.15 0.66 -0.06 0.70 0.00 0.00 175.22 176.37 3dp0 s PHE 13 N 0.45 2.75 0.38 0.36 0.40 -1.26 -0.57 117.98 120.49 3dp0 s PHE 13 Ca -0.07 -0.28 0.21 0.00 -0.60 0.00 0.00 56.93 56.19 3dp0 s PHE 13 Cb -0.11 -2.51 1.32 0.00 0.51 0.00 0.00 43.02 42.22 3dp0 s PHE 13 CO 0.01 -0.63 1.60 0.97 0.70 0.00 0.00 175.22 177.87 3dp0 h ILE 14 N 0.40 0.07 -0.20 0.64 6.09 -1.88 0.29 117.51 122.93 3dp0 h ILE 14 Ca -0.40 -0.03 -0.09 0.00 -1.37 0.00 0.00 64.86 62.97 3dp0 h ILE 14 Cb 1.29 -0.01 -0.01 0.00 0.47 0.00 0.00 36.82 38.55 3dp0 h ILE 14 CO 0.47 0.01 -0.27 -0.33 -3.07 0.00 0.00 178.15 174.96 3dp0 h GLU 15 N 0.07 0.39 -0.15 2.19 3.07 -1.94 -1.89 114.58 116.32 3dp0 h GLU 15 Ca 0.83 -0.15 -0.18 0.00 -0.50 0.00 0.00 59.36 59.36 3dp0 h GLU 15 Cb 2.21 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 30.09 3dp0 h GLU 15 CO -0.68 0.63 -0.63 0.45 -1.40 0.00 0.00 179.01 177.38 3dp0 h HIS 16 N 0.34 0.72 -0.41 4.33 3.86 -0.80 -3.03 115.15 120.16 3dp0 h HIS 16 Ca 0.05 -0.28 -0.03 0.00 -1.16 0.00 0.00 60.37 58.95 3dp0 h HIS 16 Cb 0.66 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.99 3dp0 h HIS 16 CO 0.02 1.04 0.13 0.82 0.86 0.00 0.00 177.93 180.80 3dp0 h ILE 17 N 0.41 1.21 0.00 2.45 2.04 -1.15 -2.65 117.51 119.82 3dp0 h ILE 17 Ca -0.01 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 3dp0 h ILE 17 Cb 1.20 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 38.18 3dp0 h ILE 17 CO 0.12 0.25 -0.04 -0.07 0.00 0.00 0.00 178.15 178.41 3dp0 h LEU 18 N 0.52 0.00 0.00 1.44 3.38 -1.32 -0.32 115.31 119.01 3dp0 h LEU 18 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3dp0 h LEU 18 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3dp0 h LEU 18 CO -0.01 0.04 -0.50 0.00 0.09 0.00 0.00 178.44 178.06 3dp0 n GLN 19 N -3.41 0.12 -0.06 1.13 6.02 -1.01 -4.44 117.38 115.72 3dp0 n GLN 19 Ca -0.02 0.04 -0.12 0.00 -0.01 0.00 0.00 57.00 56.88 3dp0 n GLN 19 Cb 0.16 -1.58 -0.04 0.00 1.02 0.00 0.00 30.24 29.80 3dp0 n GLN 19 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 3dp0 n ILE 20 N -1.75 1.02 -2.75 5.09 2.08 -0.78 -4.41 119.36 117.85 3dp0 n ILE 20 Ca 0.05 -0.05 -0.37 0.00 0.56 0.00 0.00 62.75 62.94 3dp0 n ILE 20 Cb 0.38 -1.81 -0.06 0.00 -0.75 0.00 0.00 39.64 37.40 3dp0 n ILE 20 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 3dp0 s LEU 21 N -7.06 4.34 0.34 1.39 1.43 -0.20 -4.78 118.68 114.15 3dp0 s LEU 21 Ca -0.19 1.87 0.20 0.00 -1.03 0.00 0.00 54.13 54.98 3dp0 s LEU 21 Cb 0.06 -4.00 0.18 0.00 0.03 0.00 0.00 46.19 42.46 3dp0 s LEU 21 CO 0.26 -0.09 1.45 1.55 0.23 0.00 0.00 176.35 179.74 3dp0 h PRO 22 N 3.18 0.00 -6.77 1.29 0.13 -1.88 -3.44 132.00 124.50 3dp0 h PRO 22 Ca -0.47 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.09 3dp0 h PRO 22 Cb 1.19 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.44 3dp0 h PRO 22 CO 0.65 0.18 0.44 0.72 -0.23 0.00 0.00 178.00 179.76 3dp0 n HIS 23 N -3.08 2.02 -4.31 1.56 8.25 -1.26 -5.02 115.22 113.37 3dp0 n HIS 23 Ca 0.02 0.53 -0.19 0.00 -0.26 0.00 0.00 57.72 57.82 3dp0 n HIS 23 Cb 0.62 -2.36 -0.09 0.00 1.12 0.00 0.00 29.99 29.28 3dp0 n HIS 23 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3dp0 s ARG 24 N -2.08 1.67 0.37 -0.41 1.81 -1.26 -4.67 118.95 114.38 3dp0 s ARG 24 Ca 0.60 -1.96 -0.28 0.00 -1.72 0.00 0.00 55.73 52.36 3dp0 s ARG 24 Cb -0.54 0.10 -0.11 0.00 -0.45 0.00 0.00 34.95 33.96 3dp0 s ARG 24 CO 0.59 -0.55 1.44 -0.47 -0.68 0.00 0.00 175.30 175.63 3dp0 s TYR 25 N -3.55 2.71 -0.61 -0.53 6.14 -1.26 0.78 117.35 121.04 3dp0 s TYR 25 Ca 0.37 1.24 -0.02 0.00 0.64 0.00 0.00 57.07 59.30 3dp0 s TYR 25 Cb 0.04 -3.93 0.40 0.00 0.42 0.00 0.00 41.96 38.88 3dp0 s TYR 25 CO 0.22 -2.68 2.04 -0.35 0.64 0.00 0.00 175.55 175.42 3dp0 n PRO 26 N 0.53 2.52 -0.11 4.97 -0.04 -1.26 -4.92 135.00 136.69 3dp0 n PRO 26 Ca 0.01 -2.95 0.03 0.00 -0.04 0.00 0.00 63.50 60.55 3dp0 n PRO 26 Cb 0.40 -2.16 0.05 0.00 -0.04 0.00 0.00 33.50 31.75 3dp0 n PRO 26 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3dp0 n MET 27 N -0.64 1.41 -3.33 0.54 2.81 0.23 -4.93 117.12 113.22 3dp0 n MET 27 Ca 0.56 -1.63 -0.45 0.00 -1.81 0.00 0.00 57.70 54.36 3dp0 n MET 27 Cb 0.63 -1.01 -0.06 0.00 -0.71 0.00 0.00 33.22 32.07 3dp0 n MET 27 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 3dp0 s LEU 28 N -1.33 5.98 -0.53 4.03 2.96 -0.90 -4.56 118.68 124.33 3dp0 s LEU 28 Ca 0.11 -1.62 0.02 0.00 -0.22 0.00 0.00 54.13 52.42 3dp0 s LEU 28 Cb 0.10 -2.21 0.44 0.00 0.50 0.00 0.00 46.19 45.02 3dp0 s LEU 28 CO 0.01 -0.79 1.65 0.18 -1.32 0.00 0.00 176.35 176.08 3dp0 n LEU 29 N 5.26 6.43 -3.64 -0.68 4.77 -1.26 -4.90 117.00 122.99 3dp0 n LEU 29 Ca -0.13 -4.60 -0.16 0.00 -0.03 0.00 0.00 56.01 51.08 3dp0 n LEU 29 Cb 0.41 -0.71 -0.15 0.00 -2.33 0.00 0.00 43.42 40.64 3dp0 n LEU 29 CO 0.52 1.80 -0.21 -0.69 -1.33 0.00 0.00 177.39 177.48 3dp0 s VAL 30 N -4.84 -0.30 -0.12 4.08 1.01 -1.26 -4.66 120.40 114.31 3dp0 s VAL 30 Ca 0.57 0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.89 3dp0 s VAL 30 Cb 0.46 -0.38 -0.24 0.00 0.00 0.00 0.00 36.38 36.22 3dp0 s VAL 30 CO -0.05 0.09 0.36 0.47 0.00 0.00 0.00 175.10 175.97 3dp0 n ASP 31 N 5.33 1.21 -3.65 3.32 8.00 -0.45 -4.94 116.55 125.36 3dp0 n ASP 31 Ca -0.05 0.21 -0.14 0.00 0.71 0.00 0.00 54.79 55.53 3dp0 n ASP 31 Cb 0.50 -0.14 -0.06 0.00 -0.02 0.00 0.00 41.12 41.39 3dp0 n ASP 31 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3dp0 s ARG 32 N -2.56 0.91 -0.22 -1.24 3.52 -0.93 -2.72 118.95 115.72 3dp0 s ARG 32 Ca -0.14 -0.26 -0.01 0.00 -0.13 0.00 0.00 55.73 55.19 3dp0 s ARG 32 Cb 0.07 0.41 0.01 0.00 -1.56 0.00 0.00 34.95 33.89 3dp0 s ARG 32 CO 0.78 -0.31 -0.10 0.42 -0.81 0.00 0.00 175.30 175.28 3dp0 s ILE 33 N -2.17 2.74 -0.04 4.11 1.01 0.27 -1.28 121.20 125.85 3dp0 s ILE 33 Ca -0.07 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.77 3dp0 s ILE 33 Cb -0.01 -2.27 -0.25 0.00 0.01 0.00 0.00 42.46 39.93 3dp0 s ILE 33 CO -0.00 0.38 0.70 0.71 0.00 0.00 0.00 174.94 176.73 3dp0 h THR 34 N 5.94 0.95 -3.17 2.92 1.35 -1.46 -1.32 112.91 118.13 3dp0 h THR 34 Ca -0.40 -2.69 -0.08 0.00 -0.55 0.00 0.00 66.41 62.69 3dp0 h THR 34 Cb 1.13 2.59 -0.16 0.00 -1.73 0.00 0.00 68.15 69.98 3dp0 h THR 34 CO 0.60 0.73 -0.15 -1.83 -0.25 0.00 0.00 175.52 174.63 3dp0 s GLU 35 N -2.60 0.90 -0.29 4.72 -1.05 -1.11 -4.43 118.70 114.84 3dp0 s GLU 35 Ca -0.10 -0.46 -0.14 0.00 -0.15 0.00 0.00 54.97 54.12 3dp0 s GLU 35 Cb 0.07 0.40 0.10 0.00 -0.44 0.00 0.00 34.13 34.27 3dp0 s GLU 35 CO 0.82 -0.31 0.70 -1.17 0.95 0.00 0.00 175.26 176.25 3dp0 s LEU 36 N -2.14 -0.98 -0.24 1.83 0.20 -1.17 -1.43 118.68 114.75 3dp0 s LEU 36 Ca -0.04 1.48 -0.02 0.00 0.69 0.00 0.00 54.13 56.24 3dp0 s LEU 36 Cb -0.00 2.30 0.02 0.00 -0.43 0.00 0.00 46.19 48.08 3dp0 s LEU 36 CO -0.04 -0.22 -0.07 -1.10 -0.29 0.00 0.00 176.35 174.63 3dp0 s GLN 37 N 2.07 2.95 0.13 1.98 -0.21 0.78 -4.77 119.66 122.58 3dp0 s GLN 37 Ca -0.08 -0.90 -0.35 0.00 0.02 0.00 0.00 55.36 54.05 3dp0 s GLN 37 Cb -0.07 -2.96 -0.15 0.00 1.00 0.00 0.00 33.01 30.83 3dp0 s GLN 37 CO -0.19 -0.35 1.45 0.00 -2.12 0.00 0.00 175.29 174.08 3dp0 n ALA 38 N 4.69 0.22 -0.95 6.09 0.00 -1.26 -1.20 120.51 128.10 3dp0 n ALA 38 Ca -0.17 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.75 3dp0 n ALA 38 Cb 0.48 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.72 3dp0 n ALA 38 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dp0 n ASN 39 N 2.93 -4.47 0.13 0.00 3.02 -1.26 -4.72 115.26 110.88 3dp0 n ASN 39 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 3dp0 n ASN 39 Cb 0.24 -2.54 0.00 0.00 -0.61 0.00 0.00 39.78 36.87 3dp0 n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dp0 n GLN 40 N -0.37 0.00 -4.01 3.52 1.13 -0.55 -4.79 117.38 112.30 3dp0 n GLN 40 Ca 0.00 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.98 3dp0 n GLN 40 Cb 0.31 -0.11 -0.09 0.00 0.11 0.00 0.00 30.24 30.46 3dp0 n GLN 40 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 3dp0 s LYS 41 N -2.00 0.64 -0.23 -1.09 2.20 -0.34 -0.85 119.74 118.07 3dp0 s LYS 41 Ca 0.00 -1.07 -0.21 0.00 -0.36 0.00 0.00 55.97 54.33 3dp0 s LYS 41 Cb 0.00 0.24 0.06 0.00 -1.51 0.00 0.00 37.83 36.62 3dp0 s LYS 41 CO 0.00 -0.15 0.62 -1.50 -0.36 0.00 0.00 175.35 173.97 3dp0 s ILE 42 N -3.60 -0.00 -0.07 5.43 2.07 -0.67 -0.16 121.20 124.20 3dp0 s ILE 42 Ca 0.04 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.30 3dp0 s ILE 42 Cb 0.05 -0.87 0.01 0.00 0.13 0.00 0.00 42.46 41.79 3dp0 s ILE 42 CO -0.09 0.00 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.13 3dp0 s VAL 43 N 0.42 1.12 0.35 4.00 1.01 -0.51 -1.84 120.40 124.94 3dp0 s VAL 43 Ca -0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 3dp0 s VAL 43 Cb -0.04 -1.04 -0.00 0.00 0.00 0.00 0.00 36.38 35.29 3dp0 s VAL 43 CO -0.00 0.36 0.45 0.00 0.00 0.00 0.00 175.10 175.90 3dp0 s ALA 44 N 0.81 0.96 0.16 5.51 0.00 -0.48 -1.36 121.76 127.37 3dp0 s ALA 44 Ca -0.12 -1.62 -0.21 0.00 0.00 0.00 0.00 51.96 50.01 3dp0 s ALA 44 Cb -0.15 1.20 0.06 0.00 0.00 0.00 0.00 23.12 24.23 3dp0 s ALA 44 CO 0.02 -0.77 0.57 1.52 0.00 0.00 0.00 175.76 177.09 3dp0 s TYR 45 N -3.07 -0.42 -0.05 0.00 -0.85 -0.40 0.13 117.35 112.68 3dp0 s TYR 45 Ca 0.32 0.16 0.01 0.00 -0.52 0.00 0.00 57.07 57.04 3dp0 s TYR 45 Cb -0.00 0.50 0.02 0.00 0.38 0.00 0.00 41.96 42.86 3dp0 s TYR 45 CO 0.22 -0.86 -0.05 0.21 -1.52 0.00 0.00 175.55 173.55 3dp0 s LYS 46 N -3.78 0.93 0.32 -3.49 2.20 -0.50 -1.34 119.74 114.08 3dp0 s LYS 46 Ca 0.03 -0.13 -0.27 0.00 -0.36 0.00 0.00 55.97 55.24 3dp0 s LYS 46 Cb -0.01 -0.94 -0.09 0.00 -1.51 0.00 0.00 37.83 35.28 3dp0 s LYS 46 CO -0.11 -0.09 1.01 -0.80 -0.36 0.00 0.00 175.35 175.00 3dp0 s ASN 47 N 0.99 7.23 -0.24 1.43 0.01 -1.26 -1.90 114.94 121.21 3dp0 s ASN 47 Ca -0.10 2.02 -0.06 0.00 -0.71 0.00 0.00 52.86 54.01 3dp0 s ASN 47 Cb -0.14 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 38.90 3dp0 s ASN 47 CO -0.00 -0.15 0.03 -0.63 -1.51 0.00 0.00 177.10 174.83 3dp0 s ILE 48 N -1.43 4.00 0.15 0.60 -1.09 -0.07 -4.93 121.20 118.43 3dp0 s ILE 48 Ca 0.49 -0.28 0.07 0.00 -2.23 0.00 0.00 60.65 58.70 3dp0 s ILE 48 Cb -0.24 -2.85 -0.04 0.00 -1.58 0.00 0.00 42.46 37.75 3dp0 s ILE 48 CO 0.31 0.37 -0.16 0.28 -1.23 0.00 0.00 174.94 174.51 3dp0 s THR 49 N 1.51 1.57 0.39 2.92 -1.32 -1.26 0.56 115.64 120.01 3dp0 s THR 49 Ca 0.06 -1.87 0.17 0.00 -1.21 0.00 0.00 61.69 58.84 3dp0 s THR 49 Cb -0.15 -1.73 0.17 0.00 -1.51 0.00 0.00 72.50 69.29 3dp0 s THR 49 CO 0.01 -0.41 1.93 0.15 -2.21 0.00 0.00 174.62 174.10 3dp0 h PHE 50 N 3.27 0.00 0.00 9.09 3.57 -1.96 -3.26 116.94 127.66 3dp0 h PHE 50 Ca -0.40 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.06 3dp0 h PHE 50 Cb 1.20 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 3dp0 h PHE 50 CO 0.67 0.25 -0.01 -1.71 -2.23 0.00 0.00 178.31 175.28 3dp0 n ASN 51 N -4.02 3.15 -4.17 0.41 5.15 -1.26 -4.74 115.26 109.77 3dp0 n ASN 51 Ca -0.02 -1.92 -0.25 0.00 -0.60 0.00 0.00 54.58 51.79 3dp0 n ASN 51 Cb 0.32 -0.73 -0.15 0.00 -0.53 0.00 0.00 39.78 38.69 3dp0 n ASN 51 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3dp0 s GLU 52 N 1.16 1.38 0.45 1.20 2.02 -1.23 -5.06 118.70 118.63 3dp0 s GLU 52 Ca 0.14 -0.66 0.11 0.00 0.02 0.00 0.00 54.97 54.58 3dp0 s GLU 52 Cb 0.07 -1.36 1.02 0.00 0.10 0.00 0.00 34.13 33.96 3dp0 s GLU 52 CO 0.00 0.37 2.07 0.22 0.02 0.00 0.00 175.26 177.94 3dp0 h ASP 53 N 5.58 0.22 -0.32 -0.19 3.58 -1.94 -2.77 116.42 120.59 3dp0 h ASP 53 Ca -0.37 -0.01 0.09 0.00 0.42 0.00 0.00 57.03 57.16 3dp0 h ASP 53 Cb 1.15 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 42.13 3dp0 h ASP 53 CO 0.48 0.20 0.23 -0.37 -2.88 0.00 0.00 179.24 176.90 3dp0 h VAL 54 N 0.25 0.82 0.00 2.25 -1.51 -1.97 -1.62 116.25 114.48 3dp0 h VAL 54 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.54 3dp0 h VAL 54 Cb 0.05 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 30.04 3dp0 h VAL 54 CO -0.01 0.00 0.00 -0.26 -1.23 0.00 0.00 177.57 176.07 3dp0 h PHE 55 N 0.00 0.00 0.00 5.19 0.05 -1.77 -2.55 116.94 117.86 3dp0 h PHE 55 Ca 0.15 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.93 3dp0 h PHE 55 Cb 0.61 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.56 3dp0 h PHE 55 CO 0.00 0.00 -0.05 -0.91 -0.18 0.00 0.00 178.31 177.17 3dp0 h ASN 56 N 0.00 0.00 0.00 2.17 2.35 -1.48 -3.25 115.58 115.37 3dp0 h ASN 56 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3dp0 h ASN 56 Cb 0.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.74 3dp0 h ASN 56 CO 0.00 0.05 0.00 0.61 -1.65 0.00 0.00 177.43 176.44 3dp0 n GLY 57 N -0.48 0.22 2.40 2.83 0.00 -0.99 -4.42 105.19 104.74 3dp0 n GLY 57 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 3dp0 n GLY 57 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3dp0 n HIS 58 N -0.20 -1.38 -4.33 1.61 -0.00 -1.01 -4.53 115.22 105.39 3dp0 n HIS 58 Ca 0.00 -2.97 -0.17 0.00 -0.00 0.00 0.00 57.72 54.58 3dp0 n HIS 58 Cb 0.27 0.34 -0.10 0.00 -0.00 0.00 0.00 29.99 30.50 3dp0 n HIS 58 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 3dp0 s PHE 59 N -0.25 1.61 0.04 1.57 0.40 -0.49 -1.24 117.98 119.61 3dp0 s PHE 59 Ca 0.33 -0.66 -0.36 0.00 -0.60 0.00 0.00 56.93 55.65 3dp0 s PHE 59 Cb 0.11 -0.80 -0.15 0.00 0.51 0.00 0.00 43.02 42.70 3dp0 s PHE 59 CO -0.15 0.25 1.57 -2.30 0.70 0.00 0.00 175.22 175.29 3dp0 n PRO 60 N -0.36 1.72 -0.94 0.24 -0.02 -1.26 -0.43 135.00 133.96 3dp0 n PRO 60 Ca -0.08 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3dp0 n PRO 60 Cb 0.61 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 3dp0 n PRO 60 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3dp0 n ASN 61 N 3.91 -3.79 -2.92 2.55 3.02 -1.26 -4.86 115.26 111.91 3dp0 n ASN 61 Ca 0.19 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.61 3dp0 n ASN 61 Cb 0.24 -2.15 0.00 0.00 -0.61 0.00 0.00 39.78 37.26 3dp0 n ASN 61 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3dp0 n LYS 62 N -0.88 0.70 -1.59 3.52 4.81 0.43 -5.11 118.16 120.05 3dp0 n LYS 62 Ca 0.00 -2.29 -0.44 0.00 -0.87 0.00 0.00 58.31 54.71 3dp0 n LYS 62 Cb 0.24 -1.40 -0.04 0.00 0.02 0.00 0.00 35.03 33.85 3dp0 n LYS 62 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3dp0 n PRO 63 N 1.78 1.92 -3.86 1.64 -0.04 -1.22 -1.40 135.00 133.83 3dp0 n PRO 63 Ca 0.15 0.56 -0.28 0.00 -0.04 0.00 0.00 63.50 63.89 3dp0 n PRO 63 Cb 0.58 -3.07 -0.16 0.00 -0.04 0.00 0.00 33.50 30.81 3dp0 n PRO 63 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3dp0 s ILE 64 N 7.59 1.00 0.07 0.52 1.01 -0.37 -4.48 121.20 126.53 3dp0 s ILE 64 Ca 1.01 -0.66 -0.33 0.00 0.00 0.00 0.00 60.65 60.67 3dp0 s ILE 64 Cb -0.45 -1.26 -0.12 0.00 0.01 0.00 0.00 42.46 40.64 3dp0 s ILE 64 CO 0.39 0.02 1.79 0.33 0.00 0.00 0.00 174.94 177.47 3dp0 n PHE 65 N 4.90 2.44 -1.64 3.97 7.35 0.38 -4.58 117.46 130.28 3dp0 n PHE 65 Ca -0.11 -0.01 -0.47 0.00 -0.76 0.00 0.00 57.45 56.10 3dp0 n PHE 65 Cb 0.47 -2.67 -0.04 0.00 0.35 0.00 0.00 39.48 37.60 3dp0 n PHE 65 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 3dp0 n PRO 66 N 5.47 1.73 -0.05 -7.13 -0.02 -1.26 -4.58 135.00 129.17 3dp0 n PRO 66 Ca 0.19 0.62 0.01 0.00 -2.02 0.00 0.00 63.50 62.30 3dp0 n PRO 66 Cb 0.33 -2.24 0.31 0.00 -0.02 0.00 0.00 33.50 31.88 3dp0 n PRO 66 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3dp0 h GLY 67 N 4.25 0.68 2.00 -1.23 0.00 -1.99 -2.07 103.07 104.72 3dp0 h GLY 67 Ca -0.45 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 46.47 3dp0 h GLY 67 CO 0.76 0.31 -0.37 -0.39 0.00 0.00 0.00 176.54 176.85 3dp0 h VAL 68 N 0.63 1.03 0.00 4.60 -1.51 -2.00 -2.31 116.25 116.69 3dp0 h VAL 68 Ca 0.15 -1.40 0.00 0.00 -1.23 0.00 0.00 66.70 64.23 3dp0 h VAL 68 Cb 0.14 1.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.11 3dp0 h VAL 68 CO -0.01 0.37 0.00 -0.07 -1.23 0.00 0.00 177.57 176.62 3dp0 h LEU 69 N 0.00 0.00 -0.07 4.19 3.38 -1.75 -1.88 115.31 119.19 3dp0 h LEU 69 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 3dp0 h LEU 69 Cb 0.78 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.54 3dp0 h LEU 69 CO 0.05 0.00 -0.55 0.40 0.09 0.00 0.00 178.44 178.43 3dp0 h ILE 70 N 0.00 1.38 -0.46 1.22 2.04 -1.21 -2.12 117.51 118.35 3dp0 h ILE 70 Ca 0.00 -1.91 0.02 0.00 1.00 0.00 0.00 64.86 63.97 3dp0 h ILE 70 Cb 0.72 2.32 -0.03 0.00 -0.74 0.00 0.00 36.82 39.09 3dp0 h ILE 70 CO 0.00 0.57 0.27 0.58 0.00 0.00 0.00 178.15 179.57 3dp0 h VAL 71 N 0.06 1.04 -0.80 1.67 2.07 -1.28 -1.55 116.25 117.45 3dp0 h VAL 71 Ca -0.05 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.34 3dp0 h VAL 71 Cb 1.21 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 31.38 3dp0 h VAL 71 CO 0.11 0.10 0.49 -0.08 0.02 0.00 0.00 177.57 178.21 3dp0 h GLU 72 N 0.54 0.89 -0.01 1.57 4.57 -1.31 0.18 114.58 121.01 3dp0 h GLU 72 Ca 0.19 -0.05 -0.10 0.00 -1.18 0.00 0.00 59.36 58.22 3dp0 h GLU 72 Cb 0.03 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 3dp0 h GLU 72 CO -0.09 0.59 -0.45 0.78 -1.18 0.00 0.00 179.01 178.66 3dp0 h GLY 73 N 0.92 0.03 1.25 1.92 0.00 -0.79 -1.25 103.07 105.15 3dp0 h GLY 73 Ca 0.34 -0.03 -0.21 0.00 0.00 0.00 0.00 47.33 47.43 3dp0 h GLY 73 CO -0.16 0.03 -0.73 -0.33 0.00 0.00 0.00 176.54 175.35 3dp0 h MET 74 N 0.03 0.75 -0.18 4.80 2.86 -0.40 -2.43 114.93 120.36 3dp0 h MET 74 Ca -0.00 -0.58 -0.08 0.00 -2.06 0.00 0.00 59.70 56.97 3dp0 h MET 74 Cb 0.80 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.56 3dp0 h MET 74 CO 0.06 1.20 -0.24 0.00 1.06 0.00 0.00 176.91 178.99 3dp0 h ALA 75 N 0.64 1.25 -0.02 6.32 0.00 -0.70 -1.82 119.26 124.93 3dp0 h ALA 75 Ca -0.04 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 3dp0 h ALA 75 Cb 1.34 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 3dp0 h ALA 75 CO 0.15 0.50 -0.73 1.96 0.00 0.00 0.00 179.25 181.13 3dp0 h GLN 76 N 0.30 0.13 -0.59 0.00 4.20 -1.18 -0.13 115.11 117.85 3dp0 h GLN 76 Ca 0.05 -0.11 -0.09 0.00 0.06 0.00 0.00 58.65 58.55 3dp0 h GLN 76 Cb 0.59 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 3dp0 h GLN 76 CO 0.04 0.80 0.01 0.77 -0.67 0.00 0.00 178.83 179.78 3dp0 h SER 77 N 0.09 1.01 -0.46 1.46 0.02 -1.00 -1.12 113.55 113.56 3dp0 h SER 77 Ca -0.02 -0.30 -0.12 0.00 -0.84 0.00 0.00 61.79 60.51 3dp0 h SER 77 Cb 1.28 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 3dp0 h SER 77 CO 0.10 1.07 -0.19 1.23 -1.14 0.00 0.00 176.83 177.90 3dp0 h GLY 78 N 0.93 1.01 1.24 -3.77 0.00 -1.16 -2.10 103.07 99.23 3dp0 h GLY 78 Ca 0.17 -0.89 0.01 0.00 0.00 0.00 0.00 47.33 46.62 3dp0 h GLY 78 CO 0.03 0.81 0.50 -1.33 0.00 0.00 0.00 176.54 176.55 3dp0 h GLY 79 N 0.78 1.05 1.13 4.60 0.00 -0.67 0.62 103.07 110.57 3dp0 h GLY 79 Ca 0.11 -0.39 -0.16 0.00 0.00 0.00 0.00 47.33 46.88 3dp0 h GLY 79 CO 0.06 0.37 -0.41 -2.75 0.00 0.00 0.00 176.54 173.81 3dp0 h PHE 80 N 0.99 1.12 -0.41 5.60 3.04 -1.06 -1.19 116.94 125.04 3dp0 h PHE 80 Ca 0.28 -0.35 -0.01 0.00 3.98 0.00 0.00 57.97 61.87 3dp0 h PHE 80 Cb -0.09 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.18 3dp0 h PHE 80 CO -0.00 1.18 0.20 1.25 -2.02 0.00 0.00 178.31 178.92 3dp0 h LEU 81 N 0.74 0.52 0.47 0.59 5.85 -0.55 -2.17 115.31 120.77 3dp0 h LEU 81 Ca 0.05 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 3dp0 h LEU 81 Cb 1.01 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.91 3dp0 h LEU 81 CO 0.10 0.49 -0.29 0.00 -0.34 0.00 0.00 178.44 178.41 3dp0 h ALA 82 N 1.05 -0.73 -0.27 1.25 0.00 0.36 -1.98 119.26 118.95 3dp0 h ALA 82 Ca 0.14 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.95 3dp0 h ALA 82 Cb 0.10 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 3dp0 h ALA 82 CO -0.02 -0.92 0.04 0.35 0.00 0.00 0.00 179.25 178.70 3dp0 h PHE 83 N -0.72 0.06 0.00 0.00 3.57 -1.13 -1.55 116.94 117.16 3dp0 h PHE 83 Ca -0.05 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.42 3dp0 h PHE 83 Cb 0.59 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 3dp0 h PHE 83 CO -0.09 0.00 -0.21 1.79 -2.23 0.00 0.00 178.31 177.57 3dp0 h THR 84 N 0.13 0.60 -0.00 4.41 1.35 -1.40 -0.90 112.91 117.11 3dp0 h THR 84 Ca 0.13 -0.99 -0.16 0.00 -0.55 0.00 0.00 66.41 64.83 3dp0 h THR 84 Cb 0.14 1.66 -0.02 0.00 -1.73 0.00 0.00 68.15 68.19 3dp0 h THR 84 CO -0.18 0.21 -0.77 0.28 -0.25 0.00 0.00 175.52 174.81 3dp0 h SER 85 N 0.00 0.02 0.03 5.36 0.02 -0.83 0.43 113.55 118.58 3dp0 h SER 85 Ca -0.00 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 3dp0 h SER 85 Cb 0.64 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.18 3dp0 h SER 85 CO 0.03 0.78 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.41 3dp0 h LEU 86 N 0.01 -0.04 -1.80 5.07 4.07 -0.76 -3.42 115.31 118.44 3dp0 h LEU 86 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3dp0 h LEU 86 Cb 1.37 0.01 0.00 0.00 1.08 0.00 0.00 40.66 43.12 3dp0 h LEU 86 CO 0.10 0.15 0.00 0.79 -1.08 0.00 0.00 178.44 178.40 3dp0 n TRP 87 N -3.09 0.11 -4.13 1.13 8.01 -0.39 -5.10 117.44 113.97 3dp0 n TRP 87 Ca -0.01 -0.08 0.00 0.00 -1.31 0.00 0.00 57.50 56.10 3dp0 n TRP 87 Cb 0.02 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.31 3dp0 n TRP 87 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3dp0 n GLY 88 N 0.88 -1.49 3.28 6.99 0.00 0.14 -4.19 105.19 110.79 3dp0 n GLY 88 Ca 0.10 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.40 3dp0 n GLY 88 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3dp0 n PHE 89 N -0.11 4.27 -3.73 1.61 7.35 -1.26 -4.20 117.46 121.40 3dp0 n PHE 89 Ca 0.00 -2.94 -0.36 0.00 -0.76 0.00 0.00 57.45 53.39 3dp0 n PHE 89 Cb 0.00 -2.51 -0.10 0.00 0.35 0.00 0.00 39.48 37.22 3dp0 n PHE 89 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3dp0 s ASP 90 N 3.54 5.21 0.40 -2.13 -1.08 -1.26 -4.96 116.67 116.38 3dp0 s ASP 90 Ca 0.50 -2.91 0.11 0.00 -0.52 0.00 0.00 52.55 49.73 3dp0 s ASP 90 Cb 0.06 -1.85 0.93 0.00 -1.46 0.00 0.00 42.92 40.60 3dp0 s ASP 90 CO 0.02 -0.35 1.94 -0.65 0.52 0.00 0.00 175.17 176.64 3dp0 h PRO 91 N 6.94 0.53 -0.08 4.34 0.11 -1.90 -1.67 132.00 140.28 3dp0 h PRO 91 Ca -0.01 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 65.91 3dp0 h PRO 91 Cb 0.94 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.92 3dp0 h PRO 91 CO 0.71 0.35 -0.65 0.93 -0.21 0.00 0.00 178.00 179.13 3dp0 h GLU 92 N 0.55 0.30 0.01 1.05 4.39 -1.93 -1.16 114.58 117.79 3dp0 h GLU 92 Ca 0.34 -0.22 -0.24 0.00 0.34 0.00 0.00 59.36 59.58 3dp0 h GLU 92 Cb 0.59 0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.29 3dp0 h GLU 92 CO -0.12 0.85 -0.98 0.82 -1.16 0.00 0.00 179.01 178.42 3dp0 h ILE 93 N 0.22 1.38 -0.09 3.13 2.04 -1.89 -3.29 117.51 119.00 3dp0 h ILE 93 Ca -0.01 -2.43 -0.09 0.00 1.00 0.00 0.00 64.86 63.32 3dp0 h ILE 93 Cb 1.18 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 39.69 3dp0 h ILE 93 CO 0.10 0.73 -0.36 0.00 0.00 0.00 0.00 178.15 178.62 3dp0 h ALA 94 N 0.65 1.22 0.00 1.87 0.00 -1.16 -3.21 119.26 118.63 3dp0 h ALA 94 Ca -0.09 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3dp0 h ALA 94 Cb 1.63 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.33 3dp0 h ALA 94 CO 0.18 0.53 0.00 0.36 0.00 0.00 0.00 179.25 180.32 3dp0 n LYS 95 N -4.07 0.18 -0.05 0.00 2.85 -0.45 -2.42 118.16 114.20 3dp0 n LYS 95 Ca -0.01 0.13 0.05 0.00 -1.05 0.00 0.00 58.31 57.42 3dp0 n LYS 95 Cb 0.43 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.38 3dp0 n LYS 95 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 3dp0 n THR 96 N -1.18 1.35 -4.31 0.58 -2.24 -1.21 -5.05 114.28 102.22 3dp0 n THR 96 Ca 0.05 -1.52 -0.26 0.00 -2.27 0.00 0.00 64.05 60.05 3dp0 n THR 96 Cb 0.05 0.18 -0.09 0.00 -2.10 0.00 0.00 70.33 68.37 3dp0 n THR 96 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3dp0 s LYS 97 N -1.80 2.04 0.42 -0.78 1.02 -1.01 0.73 119.74 120.36 3dp0 s LYS 97 Ca 0.15 -1.33 0.04 0.00 0.02 0.00 0.00 55.97 54.85 3dp0 s LYS 97 Cb 0.13 -2.12 -0.02 0.00 -0.52 0.00 0.00 37.83 35.30 3dp0 s LYS 97 CO 0.01 0.42 0.15 0.96 -0.92 0.00 0.00 175.35 175.97 3dp0 s ILE 98 N -1.83 0.48 -0.05 2.17 -4.36 -0.08 -4.55 121.20 112.98 3dp0 s ILE 98 Ca 0.26 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.63 3dp0 s ILE 98 Cb -0.08 -2.29 0.03 0.00 1.25 0.00 0.00 42.46 41.37 3dp0 s ILE 98 CO 0.16 0.00 0.03 -0.69 0.24 0.00 0.00 174.94 174.67 3dp0 s VAL 99 N -3.18 0.13 0.02 8.37 1.01 -1.26 -1.66 120.40 123.84 3dp0 s VAL 99 Ca 0.23 0.25 -0.00 0.00 0.00 0.00 0.00 61.98 62.45 3dp0 s VAL 99 Cb 0.01 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 3dp0 s VAL 99 CO 0.15 0.21 0.14 -0.31 0.00 0.00 0.00 175.10 175.29 3dp0 s TYR 100 N 1.91 3.41 0.04 5.22 1.51 0.36 -4.91 117.35 124.89 3dp0 s TYR 100 Ca 0.03 0.24 -0.22 0.00 -1.01 0.00 0.00 57.07 56.11 3dp0 s TYR 100 Cb -0.12 -1.75 -0.06 0.00 -0.11 0.00 0.00 41.96 39.92 3dp0 s TYR 100 CO -0.04 0.59 0.67 0.12 -1.11 0.00 0.00 175.55 175.77 3dp0 s PHE 101 N -1.34 3.74 -0.18 2.71 2.19 -1.26 0.35 117.98 124.20 3dp0 s PHE 101 Ca 0.28 1.35 -0.08 0.00 0.33 0.00 0.00 56.93 58.81 3dp0 s PHE 101 Cb -0.12 -2.68 -0.08 0.00 -1.31 0.00 0.00 43.02 38.83 3dp0 s PHE 101 CO 0.20 0.38 -0.22 -1.33 1.83 0.00 0.00 175.22 176.08 3dp0 n MET 102 N 2.47 0.38 -3.99 10.12 2.81 0.10 -4.87 117.12 124.14 3dp0 n MET 102 Ca -0.06 0.16 -0.10 0.00 -1.81 0.00 0.00 57.70 55.89 3dp0 n MET 102 Cb 0.50 -1.16 -0.07 0.00 -0.71 0.00 0.00 33.22 31.78 3dp0 n MET 102 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 3dp0 s THR 103 N -2.33 0.05 -0.10 2.03 -4.23 -0.72 -4.99 115.64 105.35 3dp0 s THR 103 Ca -0.25 -1.46 -0.05 0.00 -1.18 0.00 0.00 61.69 58.75 3dp0 s THR 103 Cb 0.09 -1.95 0.04 0.00 1.34 0.00 0.00 72.50 72.02 3dp0 s THR 103 CO 0.32 -0.23 0.24 -0.63 -0.54 0.00 0.00 174.62 173.78 3dp0 s ILE 104 N -3.99 -0.03 0.16 2.99 1.01 -1.26 -2.00 121.20 118.06 3dp0 s ILE 104 Ca 0.20 0.13 -0.02 0.00 0.00 0.00 0.00 60.65 60.95 3dp0 s ILE 104 Cb 0.03 -0.36 -0.04 0.00 0.01 0.00 0.00 42.46 42.10 3dp0 s ILE 104 CO 0.02 0.05 0.12 -1.81 0.00 0.00 0.00 174.94 173.32 3dp0 s ASP 105 N 1.09 0.22 -0.91 3.58 1.11 0.07 -4.97 116.67 116.85 3dp0 s ASP 105 Ca -0.08 -1.22 -0.05 0.00 0.18 0.00 0.00 52.55 51.38 3dp0 s ASP 105 Cb -0.09 0.35 0.01 0.00 1.07 0.00 0.00 42.92 44.25 3dp0 s ASP 105 CO -0.07 -0.79 0.09 0.29 1.18 0.00 0.00 175.17 175.87 3dp0 n LYS 106 N -0.17 -0.87 -3.73 8.23 4.01 -1.26 -2.44 118.16 121.94 3dp0 n LYS 106 Ca -0.03 0.01 -0.37 0.00 -0.51 0.00 0.00 58.31 57.40 3dp0 n LYS 106 Cb 0.64 -1.97 -0.06 0.00 -0.51 0.00 0.00 35.03 33.13 3dp0 n LYS 106 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 3dp0 s VAL 107 N -3.91 5.34 -0.02 -0.18 -7.23 -1.26 -4.16 120.40 108.98 3dp0 s VAL 107 Ca 0.07 0.43 0.00 0.00 -1.81 0.00 0.00 61.98 60.67 3dp0 s VAL 107 Cb -0.04 -3.52 0.03 0.00 0.56 0.00 0.00 36.38 33.41 3dp0 s VAL 107 CO 0.61 0.58 0.01 -0.75 -0.31 0.00 0.00 175.10 175.25 3dp0 s LYS 108 N -0.89 0.15 -0.25 4.82 2.20 -0.85 -4.97 119.74 119.96 3dp0 s LYS 108 Ca 0.18 0.12 -0.10 0.00 -0.36 0.00 0.00 55.97 55.80 3dp0 s LYS 108 Cb -0.13 -0.38 -0.05 0.00 -1.51 0.00 0.00 37.83 35.76 3dp0 s LYS 108 CO 0.07 -0.15 0.16 -0.06 -0.36 0.00 0.00 175.35 175.01 3dp0 s PHE 109 N 1.02 3.28 -0.24 4.03 0.40 -1.26 -1.82 117.98 123.39 3dp0 s PHE 109 Ca -0.10 0.16 0.03 0.00 -0.60 0.00 0.00 56.93 56.42 3dp0 s PHE 109 Cb -0.13 -2.28 -0.16 0.00 0.51 0.00 0.00 43.02 40.95 3dp0 s PHE 109 CO -0.02 0.00 -0.20 0.54 0.70 0.00 0.00 175.22 176.24 3dp0 n ARG 110 N 4.45 0.62 -4.05 0.44 1.74 -0.01 -4.99 116.66 114.86 3dp0 n ARG 110 Ca -0.15 0.13 -0.17 0.00 -0.77 0.00 0.00 57.85 56.89 3dp0 n ARG 110 Cb 0.52 -1.48 -0.16 0.00 -1.02 0.00 0.00 32.46 30.32 3dp0 n ARG 110 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3dp0 s ILE 111 N -2.48 0.33 0.46 0.55 1.01 -1.15 -5.02 121.20 114.89 3dp0 s ILE 111 Ca -0.31 -0.05 -0.24 0.00 0.00 0.00 0.00 60.65 60.04 3dp0 s ILE 111 Cb 0.08 -0.36 -0.08 0.00 0.01 0.00 0.00 42.46 42.12 3dp0 s ILE 111 CO 0.57 0.15 1.33 -2.16 0.00 0.00 0.00 174.94 174.83 3dp0 s PRO 112 N 0.66 3.68 -0.21 2.79 0.04 -1.26 -4.78 135.00 135.92 3dp0 s PRO 112 Ca -0.07 2.19 -0.10 0.00 0.04 0.00 0.00 61.00 63.06 3dp0 s PRO 112 Cb -0.11 -2.57 -0.05 0.00 0.04 0.00 0.00 34.50 31.81 3dp0 s PRO 112 CO -0.01 -0.75 0.14 0.08 0.04 0.00 0.00 177.00 176.51 3dp0 s VAL 113 N -1.29 5.39 0.29 -0.36 1.01 -1.26 -5.03 120.40 119.15 3dp0 s VAL 113 Ca 0.62 0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.86 3dp0 s VAL 113 Cb -0.39 -3.48 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 3dp0 s VAL 113 CO 0.49 0.41 -0.06 0.42 0.00 0.00 0.00 175.10 176.36 3dp0 s THR 114 N 0.56 1.71 0.24 3.92 -4.23 -1.26 -0.47 115.64 116.11 3dp0 s THR 114 Ca 0.08 -2.13 -0.31 0.00 -1.18 0.00 0.00 61.69 58.15 3dp0 s THR 114 Cb -0.12 -2.48 -0.14 0.00 1.34 0.00 0.00 72.50 71.11 3dp0 s THR 114 CO -0.00 -0.28 1.36 -2.65 -0.54 0.00 0.00 174.62 172.50 3dp0 n PRO 115 N -0.61 1.93 0.00 3.99 -0.02 -1.26 -1.86 135.00 137.16 3dp0 n PRO 115 Ca -0.05 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 3dp0 n PRO 115 Cb 0.63 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 3dp0 n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dp0 n GLY 116 N 1.99 0.29 3.87 -1.23 0.00 0.19 -4.91 105.19 105.39 3dp0 n GLY 116 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3dp0 n GLY 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dp0 s ASP 117 N -2.13 6.64 -0.55 1.61 -0.00 -0.78 -4.91 116.67 116.54 3dp0 s ASP 117 Ca 0.00 0.99 -0.06 0.00 -0.00 0.00 0.00 52.55 53.47 3dp0 s ASP 117 Cb 0.00 -2.25 0.14 0.00 -0.00 0.00 0.00 42.92 40.81 3dp0 s ASP 117 CO 0.00 -0.13 0.40 -0.60 -0.00 0.00 0.00 175.17 174.84 3dp0 s ARG 118 N -2.96 2.54 -0.52 8.23 3.52 -1.26 -0.89 118.95 127.61 3dp0 s ARG 118 Ca 0.49 -2.10 -0.28 0.00 -0.13 0.00 0.00 55.73 53.70 3dp0 s ARG 118 Cb -0.11 -3.86 0.01 0.00 -1.56 0.00 0.00 34.95 29.43 3dp0 s ARG 118 CO 0.22 -1.18 1.48 -1.17 -0.81 0.00 0.00 175.30 173.84 3dp0 s LEU 119 N 0.72 3.43 -0.25 -0.88 2.96 -0.80 -4.49 118.68 119.39 3dp0 s LEU 119 Ca 0.11 0.46 -0.16 0.00 -0.22 0.00 0.00 54.13 54.33 3dp0 s LEU 119 Cb -0.22 -3.13 -0.04 0.00 0.50 0.00 0.00 46.19 43.31 3dp0 s LEU 119 CO -0.03 -1.72 0.40 -0.70 -1.32 0.00 0.00 176.35 172.97 3dp0 s GLU 120 N 5.56 4.07 -0.05 1.98 2.12 0.15 -1.41 118.70 131.11 3dp0 s GLU 120 Ca 0.57 0.12 -0.17 0.00 0.36 0.00 0.00 54.97 55.86 3dp0 s GLU 120 Cb -0.12 -3.62 -0.05 0.00 0.26 0.00 0.00 34.13 30.60 3dp0 s GLU 120 CO 0.27 -0.21 0.46 0.71 -0.54 0.00 0.00 175.26 175.94 3dp0 s TYR 121 N 1.87 3.62 -0.26 5.30 1.51 0.34 0.86 117.35 130.60 3dp0 s TYR 121 Ca 0.17 0.97 -0.01 0.00 -1.01 0.00 0.00 57.07 57.18 3dp0 s TYR 121 Cb -0.15 -2.45 0.08 0.00 -0.11 0.00 0.00 41.96 39.33 3dp0 s TYR 121 CO 0.09 0.39 0.05 -1.01 -1.11 0.00 0.00 175.55 173.96 3dp0 s HIS 122 N -0.18 1.62 -0.01 2.71 3.76 -0.06 -1.38 115.29 121.74 3dp0 s HIS 122 Ca 0.25 -1.46 0.07 0.00 -0.15 0.00 0.00 55.06 53.77 3dp0 s HIS 122 Cb -0.16 -1.48 -0.02 0.00 1.11 0.00 0.00 32.58 32.03 3dp0 s HIS 122 CO 0.12 -0.77 -0.23 -0.51 -0.85 0.00 0.00 174.74 172.50 3dp0 s LEU 123 N 1.65 2.27 -0.02 0.89 2.01 -0.77 -1.47 118.68 123.24 3dp0 s LEU 123 Ca 0.04 -0.42 0.05 0.00 0.01 0.00 0.00 54.13 53.81 3dp0 s LEU 123 Cb -0.17 -1.40 -0.01 0.00 0.01 0.00 0.00 46.19 44.62 3dp0 s LEU 123 CO -0.16 0.31 -0.18 -1.61 1.01 0.00 0.00 176.35 175.72 3dp0 s GLU 124 N -0.78 1.60 -0.26 1.70 2.02 0.54 -1.67 118.70 121.85 3dp0 s GLU 124 Ca 0.11 -0.65 -0.29 0.00 0.02 0.00 0.00 54.97 54.16 3dp0 s GLU 124 Cb -0.10 -1.49 -0.01 0.00 0.10 0.00 0.00 34.13 32.63 3dp0 s GLU 124 CO 0.00 0.36 1.34 0.08 0.02 0.00 0.00 175.26 177.06 3dp0 s VAL 125 N -0.30 4.11 0.01 2.63 1.01 -0.03 -1.02 120.40 126.81 3dp0 s VAL 125 Ca 0.04 1.27 0.10 0.00 0.00 0.00 0.00 61.98 63.39 3dp0 s VAL 125 Cb -0.08 -4.06 -0.23 0.00 0.00 0.00 0.00 36.38 32.01 3dp0 s VAL 125 CO 0.00 -0.38 0.87 -0.07 0.00 0.00 0.00 175.10 175.53 3dp0 h LEU 126 N 10.74 0.02 -7.00 3.92 3.38 -0.59 -3.48 115.31 122.31 3dp0 h LEU 126 Ca -0.27 -0.04 0.20 0.00 0.09 0.00 0.00 57.88 57.86 3dp0 h LEU 126 Cb 1.11 -0.01 -0.32 0.00 0.09 0.00 0.00 40.66 41.53 3dp0 h LEU 126 CO 1.02 1.03 0.90 -0.75 0.09 0.00 0.00 178.44 180.73 3dp0 s LYS 127 N -2.64 0.05 -0.06 1.13 2.20 -0.89 -5.02 119.74 114.52 3dp0 s LYS 127 Ca -0.03 0.05 -0.22 0.00 -0.36 0.00 0.00 55.97 55.41 3dp0 s LYS 127 Cb 0.09 0.03 0.05 0.00 -1.51 0.00 0.00 37.83 36.48 3dp0 s LYS 127 CO 0.82 -0.01 0.50 -3.38 -0.36 0.00 0.00 175.35 172.92 3dp0 s HIS 128 N -0.14 -0.44 -0.24 4.03 -3.43 -1.26 -0.03 115.29 113.78 3dp0 s HIS 128 Ca 0.08 0.81 -0.04 0.00 -0.80 0.00 0.00 55.06 55.10 3dp0 s HIS 128 Cb -0.04 0.24 0.13 0.00 -1.43 0.00 0.00 32.58 31.47 3dp0 s HIS 128 CO -0.15 -0.46 0.44 0.21 -2.00 0.00 0.00 174.74 172.79 3dp0 s LYS 129 N -1.00 0.39 7.74 -0.38 2.20 -0.53 -5.02 119.74 123.15 3dp0 s LYS 129 Ca -0.10 0.83 0.00 0.00 -0.36 0.00 0.00 55.97 56.34 3dp0 s LYS 129 Cb -0.03 0.03 0.00 0.00 -1.51 0.00 0.00 37.83 36.32 3dp0 s LYS 129 CO 0.06 -0.48 0.00 0.41 -0.36 0.00 0.00 175.35 174.98 3dp0 n GLY 130 N 5.39 3.30 0.20 5.54 0.00 -1.26 -2.04 105.19 116.33 3dp0 n GLY 130 Ca -0.05 -0.14 0.12 0.00 0.00 0.00 0.00 46.02 45.95 3dp0 n GLY 130 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3dp0 h MET 131 N 0.00 0.00 -6.00 1.61 2.86 -1.97 -3.44 114.93 107.98 3dp0 h MET 131 Ca 0.00 0.00 -0.61 0.00 -2.06 0.00 0.00 59.70 57.03 3dp0 h MET 131 Cb 0.00 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 31.55 3dp0 h MET 131 CO 0.00 0.00 0.50 0.42 1.06 0.00 0.00 176.91 178.89 3dp0 s ILE 132 N -3.20 4.55 -0.10 -1.22 1.01 -0.86 -2.51 121.20 118.87 3dp0 s ILE 132 Ca 0.07 0.68 0.00 0.00 0.00 0.00 0.00 60.65 61.40 3dp0 s ILE 132 Cb 0.06 -4.38 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 3dp0 s ILE 132 CO 0.66 -0.75 -0.09 0.26 0.00 0.00 0.00 174.94 175.02 3dp0 s TRP 133 N 3.54 2.89 -0.26 3.97 0.52 -0.86 -1.45 118.94 127.30 3dp0 s TRP 133 Ca 0.34 -0.21 0.02 0.00 0.02 0.00 0.00 56.10 56.28 3dp0 s TRP 133 Cb -0.11 -1.78 0.06 0.00 -1.15 0.00 0.00 33.47 30.49 3dp0 s TRP 133 CO 0.24 0.12 -0.09 -1.14 0.02 0.00 0.00 176.95 176.10 3dp0 s GLN 134 N -0.31 2.06 0.28 4.98 0.74 0.95 -1.68 119.66 126.69 3dp0 s GLN 134 Ca 0.04 -1.28 0.10 0.00 0.05 0.00 0.00 55.36 54.27 3dp0 s GLN 134 Cb -0.13 -2.82 -0.05 0.00 1.10 0.00 0.00 33.01 31.12 3dp0 s GLN 134 CO 0.02 -0.59 -0.04 0.14 -0.55 0.00 0.00 175.29 174.27 3dp0 s VAL 135 N 1.17 3.11 0.08 1.34 -7.23 -0.22 0.19 120.40 118.84 3dp0 s VAL 135 Ca -0.07 -2.02 -0.10 0.00 -1.81 0.00 0.00 61.98 57.97 3dp0 s VAL 135 Cb -0.20 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 34.02 3dp0 s VAL 135 CO -0.05 -0.35 0.22 -0.83 -0.31 0.00 0.00 175.10 173.77 3dp0 s GLY 136 N -3.65 0.03 0.00 2.32 0.00 -0.19 -0.97 107.32 104.86 3dp0 s GLY 136 Ca 0.32 -0.45 0.00 0.00 0.00 0.00 0.00 44.72 44.59 3dp0 s GLY 136 CO 0.19 -0.64 0.00 0.61 0.00 0.00 0.00 173.10 173.25 3dp0 n GLY 137 N 0.12 -0.52 3.35 0.20 0.00 0.18 -0.34 105.19 108.19 3dp0 n GLY 137 Ca -0.16 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 44.77 3dp0 n GLY 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dp0 s THR 138 N -3.37 0.81 -0.10 2.61 -4.23 -0.54 -0.91 115.64 109.89 3dp0 s THR 138 Ca 0.00 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.54 3dp0 s THR 138 Cb 0.00 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 71.23 3dp0 s THR 138 CO 0.00 -0.08 -0.24 0.00 -0.54 0.00 0.00 174.62 173.77 3dp0 s ALA 139 N -3.58 2.16 0.05 3.99 0.00 0.78 -0.88 121.76 124.29 3dp0 s ALA 139 Ca 0.35 -0.98 0.07 0.00 0.00 0.00 0.00 51.96 51.41 3dp0 s ALA 139 Cb 0.08 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 3dp0 s ALA 139 CO 0.13 0.25 -0.19 -0.65 0.00 0.00 0.00 175.76 175.30 3dp0 s GLN 140 N 0.40 1.23 -0.15 0.00 -0.21 0.25 -1.11 119.66 120.07 3dp0 s GLN 140 Ca -0.17 -0.93 -0.00 0.00 0.02 0.00 0.00 55.36 54.27 3dp0 s GLN 140 Cb -0.18 -1.34 0.04 0.00 1.00 0.00 0.00 33.01 32.53 3dp0 s GLN 140 CO 0.08 0.33 -0.07 0.08 -2.12 0.00 0.00 175.29 173.59 3dp0 s VAL 141 N -0.88 1.14 -1.27 1.09 1.01 -0.52 0.30 120.40 121.27 3dp0 s VAL 141 Ca 0.06 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 3dp0 s VAL 141 Cb -0.09 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 3dp0 s VAL 141 CO 0.02 0.22 0.75 -0.67 0.00 0.00 0.00 175.10 175.41 3dp0 n ASP 142 N 4.88 -1.87 0.00 3.32 4.64 -1.26 -2.08 116.55 124.18 3dp0 n ASP 142 Ca -0.12 -0.81 0.00 0.00 -1.38 0.00 0.00 54.79 52.48 3dp0 n ASP 142 Cb 0.48 -4.19 0.00 0.00 -1.04 0.00 0.00 41.12 36.38 3dp0 n ASP 142 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3dp0 n GLY 143 N -1.52 1.09 3.92 0.27 0.00 -1.26 -4.98 105.19 102.72 3dp0 n GLY 143 Ca -0.27 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.44 3dp0 n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dp0 s LYS 144 N -0.16 3.47 -0.23 1.61 1.02 -0.88 -5.06 119.74 119.50 3dp0 s LYS 144 Ca 0.00 -0.38 -0.23 0.00 0.02 0.00 0.00 55.97 55.39 3dp0 s LYS 144 Cb 0.00 -3.00 -0.01 0.00 -0.52 0.00 0.00 37.83 34.30 3dp0 s LYS 144 CO 0.00 0.58 0.73 0.08 -0.92 0.00 0.00 175.35 175.82 3dp0 s VAL 145 N -1.54 4.92 -0.45 3.17 1.01 -1.26 -1.44 120.40 124.80 3dp0 s VAL 145 Ca 0.36 1.37 0.18 0.00 0.00 0.00 0.00 61.98 63.89 3dp0 s VAL 145 Cb -0.13 -4.03 -0.24 0.00 0.00 0.00 0.00 36.38 31.99 3dp0 s VAL 145 CO 0.27 -0.00 0.59 1.33 0.00 0.00 0.00 175.10 177.29 3dp0 n VAL 146 N 5.11 0.00 -3.56 2.92 0.24 -0.27 -4.52 118.33 118.26 3dp0 n VAL 146 Ca 0.02 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 61.93 3dp0 n VAL 146 Cb 0.48 0.56 -0.06 0.00 -1.47 0.00 0.00 33.84 33.36 3dp0 n VAL 146 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dp0 s ALA 147 N -2.96 -1.81 0.04 2.33 0.00 -1.05 -0.83 121.76 117.48 3dp0 s ALA 147 Ca 0.00 1.55 0.07 0.00 0.00 0.00 0.00 51.96 53.58 3dp0 s ALA 147 Cb 0.13 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.77 3dp0 s ALA 147 CO 0.74 -0.35 -0.19 -1.21 0.00 0.00 0.00 175.76 174.76 3dp0 s GLU 148 N -0.76 1.28 0.07 0.00 2.02 -0.76 -0.15 118.70 120.40 3dp0 s GLU 148 Ca -0.06 -0.87 -0.26 0.00 0.02 0.00 0.00 54.97 53.80 3dp0 s GLU 148 Cb -0.01 -1.36 0.08 0.00 0.10 0.00 0.00 34.13 32.94 3dp0 s GLU 148 CO 0.06 0.35 0.73 0.00 0.02 0.00 0.00 175.26 176.41 3dp0 s ALA 149 N -0.78 -1.71 -0.02 5.21 0.00 -0.09 -2.00 121.76 122.37 3dp0 s ALA 149 Ca 0.06 0.80 0.00 0.00 0.00 0.00 0.00 51.96 52.83 3dp0 s ALA 149 Cb -0.08 0.56 0.03 0.00 0.00 0.00 0.00 23.12 23.63 3dp0 s ALA 149 CO 0.01 -0.68 0.01 -2.00 0.00 0.00 0.00 175.76 173.10 3dp0 s GLU 150 N -3.17 0.16 0.08 0.00 2.12 -1.02 -0.65 118.70 116.22 3dp0 s GLU 150 Ca 0.01 0.10 -0.13 0.00 0.36 0.00 0.00 54.97 55.31 3dp0 s GLU 150 Cb -0.01 -0.36 0.02 0.00 0.26 0.00 0.00 34.13 34.04 3dp0 s GLU 150 CO -0.09 -0.13 0.30 -0.48 -0.54 0.00 0.00 175.26 174.33 3dp0 s LEU 151 N 0.92 0.87 -0.09 2.70 0.05 -0.14 -0.75 118.68 122.24 3dp0 s LEU 151 Ca -0.09 -0.34 0.01 0.00 0.05 0.00 0.00 54.13 53.76 3dp0 s LEU 151 Cb -0.12 1.42 0.02 0.00 -2.05 0.00 0.00 46.19 45.46 3dp0 s LEU 151 CO -0.02 -0.71 -0.10 -0.75 -0.55 0.00 0.00 176.35 174.22 3dp0 s LYS 152 N -3.24 1.61 0.12 1.48 2.20 -0.85 -1.06 119.74 120.01 3dp0 s LYS 152 Ca -0.00 -0.33 0.06 0.00 -0.36 0.00 0.00 55.97 55.34 3dp0 s LYS 152 Cb 0.01 -1.52 -0.04 0.00 -1.51 0.00 0.00 37.83 34.78 3dp0 s LYS 152 CO -0.08 -0.14 -0.15 0.00 -0.36 0.00 0.00 175.35 174.62 3dp0 s ALA 153 N 1.26 1.56 -0.05 3.13 0.00 -0.67 0.01 121.76 126.99 3dp0 s ALA 153 Ca -0.03 -1.30 0.07 0.00 0.00 0.00 0.00 51.96 50.70 3dp0 s ALA 153 Cb -0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 3dp0 s ALA 153 CO -0.03 0.14 -0.25 1.41 0.00 0.00 0.00 175.76 177.02 3dp0 s MET 154 N -2.58 2.42 -0.13 0.00 1.75 0.16 -2.02 119.30 118.89 3dp0 s MET 154 Ca 0.09 -0.91 -0.15 0.00 -1.25 0.00 0.00 55.69 53.47 3dp0 s MET 154 Cb -0.06 -2.13 -0.05 0.00 2.84 0.00 0.00 34.83 35.44 3dp0 s MET 154 CO 0.03 0.44 0.34 0.42 -0.65 0.00 0.00 175.02 175.61 3dp0 s ILE 155 N -0.31 5.25 0.00 10.11 1.01 -1.05 -0.49 121.20 135.73 3dp0 s ILE 155 Ca 0.01 0.66 -0.01 0.00 0.00 0.00 0.00 60.65 61.31 3dp0 s ILE 155 Cb -0.13 -3.67 -0.00 0.00 0.01 0.00 0.00 42.46 38.67 3dp0 s ILE 155 CO 0.02 0.41 0.01 0.00 0.00 0.00 0.00 174.94 175.38 3dp0 s ALA 156 N 0.23 -0.01 0.08 9.38 0.00 -0.66 -4.79 121.76 125.99 3dp0 s ALA 156 Ca 0.19 -0.13 -0.31 0.00 0.00 0.00 0.00 51.96 51.72 3dp0 s ALA 156 Cb -0.14 0.02 -0.08 0.00 0.00 0.00 0.00 23.12 22.92 3dp0 s ALA 156 CO 0.06 -0.05 1.60 -2.00 0.00 0.00 0.00 175.76 175.37 3dp0 s GLU 157 N -0.42 4.21 0.18 0.00 2.56 -1.26 -0.90 118.70 123.07 3dp0 s GLU 157 Ca -0.05 2.29 -0.32 0.00 0.00 0.00 0.00 54.97 56.90 3dp0 s GLU 157 Cb -0.03 -3.49 -0.11 0.00 2.00 0.00 0.00 34.13 32.49 3dp0 s GLU 157 CO -0.00 -0.68 1.74 0.50 -0.56 0.00 0.00 175.26 176.26 3dp0 s ARG 158 N 2.26 4.14 0.00 4.30 3.52 0.22 -4.87 118.95 128.52 3dp0 s ARG 158 Ca 0.72 2.58 0.00 0.00 -0.13 0.00 0.00 55.73 58.90 3dp0 s ARG 158 Cb -0.40 -3.23 0.00 0.00 -1.56 0.00 0.00 34.95 29.76 3dp0 s ARG 158 CO 0.31 -0.77 0.00 -0.85 -0.81 0.00 0.00 175.30 173.19