#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bx5 s ILE 2 N 0.00 4.51 -0.27 5.18 -1.09 -1.26 -5.03 121.20 123.24 2bx5 s ILE 2 Ca 0.00 0.72 -0.07 0.00 -2.23 0.00 0.00 60.65 59.07 2bx5 s ILE 2 Cb 0.00 -4.41 -0.01 0.00 -1.58 0.00 0.00 42.46 36.46 2bx5 s ILE 2 CO 0.00 -0.79 0.07 -1.10 -1.23 0.00 0.00 174.94 171.88 2bx5 s GLN 3 N 3.65 3.35 0.72 2.79 -0.21 -1.26 -4.71 119.66 124.00 2bx5 s GLN 3 Ca 0.36 -0.68 -0.03 0.00 0.02 0.00 0.00 55.36 55.03 2bx5 s GLN 3 Cb -0.11 -3.33 0.11 0.00 1.00 0.00 0.00 33.01 30.68 2bx5 s GLN 3 CO 0.25 -0.32 1.00 -1.64 -2.12 0.00 0.00 175.29 172.46 2bx5 s MET 4 N 1.55 1.81 -0.24 2.91 -1.94 -1.26 -2.84 119.30 119.28 2bx5 s MET 4 Ca 0.05 -0.81 -0.04 0.00 -1.71 0.00 0.00 55.69 53.18 2bx5 s MET 4 Cb -0.16 -2.27 0.09 0.00 2.01 0.00 0.00 34.83 34.50 2bx5 s MET 4 CO 0.02 -1.39 0.17 0.99 -0.01 0.00 0.00 175.02 174.80 2bx5 s THR 5 N -3.18 -0.19 0.03 2.05 2.01 -0.09 -4.86 115.64 111.42 2bx5 s THR 5 Ca 0.64 -0.42 -0.19 0.00 0.31 0.00 0.00 61.69 62.04 2bx5 s THR 5 Cb -0.07 -0.81 -0.06 0.00 0.01 0.00 0.00 72.50 71.57 2bx5 s THR 5 CO 0.44 -0.45 0.55 -1.58 -0.69 0.00 0.00 174.62 172.89 2bx5 s GLN 6 N 2.20 4.21 -0.05 4.92 0.74 -1.26 -2.35 119.66 128.07 2bx5 s GLN 6 Ca 0.07 0.69 -0.12 0.00 0.05 0.00 0.00 55.36 56.04 2bx5 s GLN 6 Cb -0.16 -3.28 0.02 0.00 1.10 0.00 0.00 33.01 30.70 2bx5 s GLN 6 CO -0.23 0.55 0.28 -1.54 -0.55 0.00 0.00 175.29 173.79 2bx5 s SER 7 N -0.76 -0.21 1.09 6.67 1.04 -0.41 -4.58 113.70 116.54 2bx5 s SER 7 Ca 0.29 0.26 -0.15 0.00 0.48 0.00 0.00 55.95 56.83 2bx5 s SER 7 Cb -0.19 0.43 0.15 0.00 0.10 0.00 0.00 66.02 66.51 2bx5 s SER 7 CO 0.17 -0.29 0.45 -2.65 0.98 0.00 0.00 173.24 171.90 2bx5 n PRO 8 N 1.98 -1.52 -0.06 4.02 -0.02 -1.26 -0.50 135.00 137.64 2bx5 n PRO 8 Ca -0.18 -0.41 -0.17 0.00 -2.02 0.00 0.00 63.50 60.71 2bx5 n PRO 8 Cb 0.57 -1.91 -0.13 0.00 -0.02 0.00 0.00 33.50 32.01 2bx5 n PRO 8 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2bx5 h SER 9 N -2.14 0.09 -0.90 2.55 0.02 -1.81 -3.41 113.55 107.96 2bx5 h SER 9 Ca -0.53 -0.87 0.00 0.00 -0.84 0.00 0.00 61.79 59.55 2bx5 h SER 9 Cb 1.33 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.84 2bx5 h SER 9 CO 0.41 1.21 0.00 -1.54 -1.14 0.00 0.00 176.83 175.77 2bx5 n SER 10 N -4.45 0.37 -3.63 3.07 3.41 -1.26 -4.14 113.62 106.99 2bx5 n SER 10 Ca -0.17 -0.36 -0.01 0.00 -0.26 0.00 0.00 58.87 58.08 2bx5 n SER 10 Cb 0.61 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.55 2bx5 n SER 10 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2bx5 s LEU 11 N 0.00 -0.11 -0.20 1.04 0.20 -1.13 -4.88 118.68 113.59 2bx5 s LEU 11 Ca 0.00 -0.15 -0.15 0.00 0.69 0.00 0.00 54.13 54.52 2bx5 s LEU 11 Cb 0.00 1.57 0.06 0.00 -0.43 0.00 0.00 46.19 47.39 2bx5 s LEU 11 CO 0.00 -0.42 0.52 -0.44 -0.29 0.00 0.00 176.35 175.72 2bx5 s SER 12 N -2.79 -0.61 0.09 3.68 0.01 -1.26 -4.13 113.70 108.69 2bx5 s SER 12 Ca 0.12 1.09 -0.03 0.00 1.31 0.00 0.00 55.95 58.45 2bx5 s SER 12 Cb 0.02 1.04 -0.03 0.00 0.21 0.00 0.00 66.02 67.26 2bx5 s SER 12 CO -0.03 -0.20 0.06 0.00 0.41 0.00 0.00 173.24 173.48 2bx5 s ALA 13 N 0.86 0.46 0.73 1.44 0.00 -0.08 -4.94 121.76 120.23 2bx5 s ALA 13 Ca -0.05 -1.17 -0.03 0.00 0.00 0.00 0.00 51.96 50.71 2bx5 s ALA 13 Cb -0.05 0.53 0.10 0.00 0.00 0.00 0.00 23.12 23.70 2bx5 s ALA 13 CO -0.07 -0.45 0.67 -1.13 0.00 0.00 0.00 175.76 174.78 2bx5 n SER 14 N -0.00 0.55 -4.76 0.00 3.41 -1.26 -4.56 113.62 106.99 2bx5 n SER 14 Ca -0.11 -1.55 -0.40 0.00 -0.26 0.00 0.00 58.87 56.56 2bx5 n SER 14 Cb 0.62 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 64.05 2bx5 n SER 14 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2bx5 s VAL 15 N -2.09 4.24 -0.93 -3.33 -7.23 -1.26 -4.48 120.40 105.32 2bx5 s VAL 15 Ca 0.42 1.88 -0.04 0.00 -1.81 0.00 0.00 61.98 62.43 2bx5 s VAL 15 Cb -0.02 -4.23 -0.04 0.00 0.56 0.00 0.00 36.38 32.65 2bx5 s VAL 15 CO 0.28 0.51 0.83 0.61 -0.31 0.00 0.00 175.10 177.02 2bx5 n GLY 16 N 1.56 -1.20 2.61 2.32 0.00 0.21 -4.88 105.19 105.81 2bx5 n GLY 16 Ca -0.04 0.54 -0.13 0.00 0.00 0.00 0.00 46.02 46.39 2bx5 n GLY 16 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2bx5 n ASP 17 N -2.63 -2.25 0.00 1.61 2.03 -1.25 -4.54 116.55 109.52 2bx5 n ASP 17 Ca -0.04 -2.79 0.00 0.00 0.52 0.00 0.00 54.79 52.47 2bx5 n ASP 17 Cb 0.57 0.91 0.00 0.00 -0.72 0.00 0.00 41.12 41.88 2bx5 n ASP 17 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2bx5 n ARG 18 N 2.63 0.00 -2.70 -0.67 0.63 -1.03 -3.70 116.66 111.82 2bx5 n ARG 18 Ca 0.21 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.77 2bx5 n ARG 18 Cb 0.54 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.40 2bx5 n ARG 18 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2bx5 s VAL 19 N 0.00 4.05 -0.57 5.15 1.01 -0.84 -4.94 120.40 124.26 2bx5 s VAL 19 Ca 0.00 1.58 0.05 0.00 0.00 0.00 0.00 61.98 63.60 2bx5 s VAL 19 Cb 0.00 -3.82 0.17 0.00 0.00 0.00 0.00 36.38 32.73 2bx5 s VAL 19 CO 0.00 0.01 0.43 0.41 0.00 0.00 0.00 175.10 175.95 2bx5 n THR 20 N 0.12 0.33 -1.42 3.92 -1.04 -1.26 -2.11 114.28 112.82 2bx5 n THR 20 Ca 0.04 -4.21 -0.31 0.00 -2.04 0.00 0.00 64.05 57.53 2bx5 n THR 20 Cb 0.51 -1.94 0.08 0.00 -1.82 0.00 0.00 70.33 67.15 2bx5 n THR 20 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2bx5 s ILE 21 N -0.78 3.58 0.01 12.58 1.01 0.25 -4.76 121.20 133.08 2bx5 s ILE 21 Ca 0.29 0.51 -0.18 0.00 0.00 0.00 0.00 60.65 61.26 2bx5 s ILE 21 Cb -0.00 -3.14 0.03 0.00 0.01 0.00 0.00 42.46 39.36 2bx5 s ILE 21 CO -0.18 -0.67 0.40 0.42 0.00 0.00 0.00 174.94 174.91 2bx5 s THR 22 N -2.99 0.05 -0.27 2.92 -4.23 0.34 -2.51 115.64 108.94 2bx5 s THR 22 Ca 0.60 -0.41 -0.02 0.00 -1.18 0.00 0.00 61.69 60.68 2bx5 s THR 22 Cb -0.16 -0.82 0.12 0.00 1.34 0.00 0.00 72.50 72.98 2bx5 s THR 22 CO 0.55 -0.23 0.25 0.00 -0.54 0.00 0.00 174.62 174.66 2bx5 s ARG 24 N 2.31 2.94 0.33 0.00 0.52 -0.99 -2.52 118.95 121.55 2bx5 s ARG 24 Ca 0.09 -0.27 0.04 0.00 -0.52 0.00 0.00 55.73 55.07 2bx5 s ARG 24 Cb -0.15 -2.41 -0.03 0.00 0.52 0.00 0.00 34.95 32.88 2bx5 s ARG 24 CO -0.30 -0.53 0.16 0.00 0.02 0.00 0.00 175.30 174.66 2bx5 s ALA 25 N -2.79 2.13 -1.54 2.13 0.00 -1.08 -0.91 121.76 119.70 2bx5 s ALA 25 Ca 0.52 -1.71 0.10 0.00 0.00 0.00 0.00 51.96 50.87 2bx5 s ALA 25 Cb -0.10 1.10 0.35 0.00 0.00 0.00 0.00 23.12 24.47 2bx5 s ALA 25 CO 0.42 -0.49 1.22 -1.13 0.00 0.00 0.00 175.76 175.78 2bx5 n SER 26 N -1.06 2.43 0.00 0.00 3.41 -1.13 -4.93 113.62 112.33 2bx5 n SER 26 Ca 0.00 -2.15 0.00 0.00 -0.26 0.00 0.00 58.87 56.46 2bx5 n SER 26 Cb 0.65 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 2bx5 n SER 26 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2bx5 n GLN 27 N 0.49 0.00 -1.52 4.33 -0.06 -1.26 -4.87 117.38 114.48 2bx5 n GLN 27 Ca 0.13 0.00 -0.28 0.00 -2.00 0.00 0.00 57.00 54.85 2bx5 n GLN 27 Cb 0.45 0.00 -0.14 0.00 -4.06 0.00 0.00 30.24 26.49 2bx5 n GLN 27 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2bx5 n SER 28 N 0.00 0.45 -1.33 1.69 2.88 -1.25 -4.55 113.62 111.51 2bx5 n SER 28 Ca 0.00 -0.54 -0.01 0.00 -1.33 0.00 0.00 58.87 56.99 2bx5 n SER 28 Cb 0.00 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.38 2bx5 n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bx5 n ILE 29 N 7.25 1.66 0.00 2.46 3.06 -0.53 -4.84 119.36 128.42 2bx5 n ILE 29 Ca 0.57 -0.37 0.00 0.00 -2.50 0.00 0.00 62.75 60.45 2bx5 n ILE 29 Cb 0.25 -1.29 0.00 0.00 0.54 0.00 0.00 39.64 39.14 2bx5 n ILE 29 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 2bx5 n SER 30 N 1.04 0.00 0.00 9.51 2.88 -1.26 -1.11 113.62 124.67 2bx5 n SER 30 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2bx5 n SER 30 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2bx5 n SER 30 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2bx5 n SER 31 N 2.81 2.79 -3.85 -3.46 2.88 -1.26 -2.14 113.62 111.39 2bx5 n SER 31 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 2bx5 n SER 31 Cb 0.00 0.33 -0.03 0.00 -0.75 0.00 0.00 64.21 63.75 2bx5 n SER 31 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2bx5 n TYR 32 N -1.25 0.00 -4.22 0.66 0.53 -0.27 -4.20 117.16 108.42 2bx5 n TYR 32 Ca 0.00 -0.15 -0.10 0.00 -1.02 0.00 0.00 57.90 56.63 2bx5 n TYR 32 Cb 0.23 -0.50 -0.03 0.00 -1.03 0.00 0.00 39.34 38.01 2bx5 n TYR 32 CO 0.00 0.00 0.00 -0.11 -1.02 0.00 0.00 176.86 175.73 2bx5 n LEU 33 N 5.10 0.00 0.00 7.72 7.94 -1.26 0.65 117.00 137.15 2bx5 n LEU 33 Ca 0.14 -1.22 0.00 0.00 -1.11 0.00 0.00 56.01 53.82 2bx5 n LEU 33 Cb 0.30 0.35 0.01 0.00 0.53 0.00 0.00 43.42 44.61 2bx5 n LEU 33 CO 0.53 -0.19 0.87 -0.46 -1.11 0.00 0.00 177.39 177.03 2bx5 n ASN 34 N -1.69 -1.24 -3.69 1.96 6.94 -1.15 -0.82 115.26 115.57 2bx5 n ASN 34 Ca -0.04 -1.44 -0.17 0.00 -0.02 0.00 0.00 54.58 52.91 2bx5 n ASN 34 Cb 0.24 1.96 -0.16 0.00 -2.36 0.00 0.00 39.78 39.46 2bx5 n ASN 34 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 2bx5 s TRP 35 N -2.31 -0.07 0.57 -2.53 0.52 -0.25 -2.97 118.94 111.90 2bx5 s TRP 35 Ca 0.24 0.42 0.07 0.00 0.02 0.00 0.00 56.10 56.86 2bx5 s TRP 35 Cb -0.01 -0.31 0.07 0.00 -1.15 0.00 0.00 33.47 32.06 2bx5 s TRP 35 CO 0.02 -0.21 0.60 0.71 0.02 0.00 0.00 176.95 178.08 2bx5 s TYR 36 N 1.99 1.38 -0.24 -1.98 1.51 0.12 0.24 117.35 120.36 2bx5 s TYR 36 Ca 0.01 -0.83 -0.27 0.00 -1.01 0.00 0.00 57.07 54.97 2bx5 s TYR 36 Cb -0.12 -2.02 0.13 0.00 -0.11 0.00 0.00 41.96 39.84 2bx5 s TYR 36 CO -0.05 -0.85 1.07 -1.14 -1.11 0.00 0.00 175.55 173.47 2bx5 s GLN 37 N -4.49 0.48 -0.08 -0.62 0.74 0.41 -1.88 119.66 114.22 2bx5 s GLN 37 Ca 0.46 0.35 -0.30 0.00 0.05 0.00 0.00 55.36 55.92 2bx5 s GLN 37 Cb -0.04 0.23 0.10 0.00 1.10 0.00 0.00 33.01 34.41 2bx5 s GLN 37 CO 0.29 -0.10 0.86 1.14 -0.55 0.00 0.00 175.29 176.93 2bx5 s GLN 38 N -0.36 0.81 -0.26 1.67 0.00 -1.19 -1.66 119.66 118.66 2bx5 s GLN 38 Ca 0.02 0.05 -0.17 0.00 -0.00 0.00 0.00 55.36 55.26 2bx5 s GLN 38 Cb -0.03 0.38 -0.03 0.00 0.00 0.00 0.00 33.01 33.33 2bx5 s GLN 38 CO -0.04 -0.28 0.49 0.15 0.00 0.00 0.00 175.29 175.60 2bx5 s LYS 39 N -1.70 4.05 0.22 9.60 1.02 -1.26 -3.37 119.74 128.30 2bx5 s LYS 39 Ca -0.03 0.26 -0.31 0.00 0.02 0.00 0.00 55.97 55.91 2bx5 s LYS 39 Cb -0.00 -3.66 -0.15 0.00 -0.52 0.00 0.00 37.83 33.50 2bx5 s LYS 39 CO 0.01 -0.34 1.21 -2.30 -0.92 0.00 0.00 175.35 173.01 2bx5 n PRO 40 N 5.50 1.49 0.00 -1.68 -0.02 -1.26 -0.53 135.00 138.50 2bx5 n PRO 40 Ca -0.05 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2bx5 n PRO 40 Cb 0.50 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2bx5 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bx5 n GLY 41 N 1.89 2.17 0.00 -1.23 0.00 -1.26 -5.08 105.19 101.68 2bx5 n GLY 41 Ca 0.13 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2bx5 n GLY 41 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2bx5 n LYS 42 N 0.00 0.00 -3.57 1.61 3.00 0.31 -5.14 118.16 114.37 2bx5 n LYS 42 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.17 2bx5 n LYS 42 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 34.97 2bx5 n LYS 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2bx5 s ALA 43 N -3.86 -1.83 -0.50 3.14 0.00 -1.26 -5.00 121.76 112.44 2bx5 s ALA 43 Ca 0.00 1.59 -0.38 0.00 0.00 0.00 0.00 51.96 53.16 2bx5 s ALA 43 Cb 0.00 -0.57 -0.18 0.00 0.00 0.00 0.00 23.12 22.37 2bx5 s ALA 43 CO 0.00 -0.33 2.00 -2.30 0.00 0.00 0.00 175.76 175.12 2bx5 n PRO 44 N 1.37 0.00 -5.05 0.00 -0.02 -1.26 -4.53 135.00 125.51 2bx5 n PRO 44 Ca -0.15 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.01 2bx5 n PRO 44 Cb 0.57 -1.36 -0.16 0.00 -0.02 0.00 0.00 33.50 32.53 2bx5 n PRO 44 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2bx5 s LYS 45 N 5.75 3.14 -0.74 -0.52 1.02 -0.67 -4.95 119.74 122.78 2bx5 s LYS 45 Ca 1.10 -0.82 -0.22 0.00 0.02 0.00 0.00 55.97 56.05 2bx5 s LYS 45 Cb -1.33 -2.41 0.08 0.00 -0.52 0.00 0.00 37.83 33.65 2bx5 s LYS 45 CO 0.58 0.17 1.04 -1.17 -0.92 0.00 0.00 175.35 175.05 2bx5 s LEU 46 N 0.38 4.43 0.00 3.17 2.96 -1.26 -0.45 118.68 127.92 2bx5 s LEU 46 Ca -0.16 -1.21 0.00 0.00 -0.22 0.00 0.00 54.13 52.54 2bx5 s LEU 46 Cb -0.17 -2.43 0.00 0.00 0.50 0.00 0.00 46.19 44.09 2bx5 s LEU 46 CO 0.07 -1.38 0.00 0.18 -1.32 0.00 0.00 176.35 173.90 2bx5 n LEU 47 N 7.59 0.00 -4.86 -0.68 4.77 0.14 -4.87 117.00 119.08 2bx5 n LEU 47 Ca 0.04 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.71 2bx5 n LEU 47 Cb 0.47 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 2bx5 n LEU 47 CO 0.62 0.00 0.56 -0.63 -1.33 0.00 0.00 177.39 176.61 2bx5 s ILE 48 N 0.00 4.68 0.41 -0.08 1.01 -1.03 -4.01 121.20 122.18 2bx5 s ILE 48 Ca 0.00 0.88 0.06 0.00 0.00 0.00 0.00 60.65 61.58 2bx5 s ILE 48 Cb 0.00 -3.74 -0.07 0.00 0.01 0.00 0.00 42.46 38.66 2bx5 s ILE 48 CO 0.00 -0.64 0.02 -0.31 0.00 0.00 0.00 174.94 174.01 2bx5 s TYR 49 N -2.54 2.31 0.00 3.97 4.12 -0.66 -1.09 117.35 123.46 2bx5 s TYR 49 Ca 0.55 -0.78 0.00 0.00 0.02 0.00 0.00 57.07 56.85 2bx5 s TYR 49 Cb -0.10 -1.64 0.00 0.00 -1.52 0.00 0.00 41.96 38.69 2bx5 s TYR 49 CO 0.33 0.31 0.00 0.00 0.02 0.00 0.00 175.55 176.21 2bx5 n ALA 50 N -0.95 0.00 0.00 3.71 0.00 -0.00 -2.33 120.51 120.94 2bx5 n ALA 50 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2bx5 n ALA 50 Cb 0.67 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.39 2bx5 n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bx5 n ALA 51 N 0.57 0.00 0.98 0.00 0.00 -1.17 -4.46 120.51 116.43 2bx5 n ALA 51 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 2bx5 n ALA 51 Cb 0.22 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.76 2bx5 n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bx5 n SER 52 N 3.65 2.82 -4.54 0.00 3.41 -1.25 -4.06 113.62 113.64 2bx5 n SER 52 Ca 0.00 -1.91 -0.41 0.00 -0.26 0.00 0.00 58.87 56.29 2bx5 n SER 52 Cb 0.00 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.00 2bx5 n SER 52 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2bx5 s SER 53 N -2.04 6.25 1.16 4.04 0.15 -0.98 -4.72 113.70 117.55 2bx5 s SER 53 Ca 0.26 -0.75 -0.17 0.00 0.70 0.00 0.00 55.95 56.00 2bx5 s SER 53 Cb 0.19 -2.55 0.26 0.00 -1.71 0.00 0.00 66.02 62.21 2bx5 s SER 53 CO 0.34 -1.72 0.58 0.18 1.20 0.00 0.00 173.24 173.82 2bx5 n LEU 54 N 9.09 0.00 -4.21 3.45 4.77 -1.26 -1.66 117.00 127.18 2bx5 n LEU 54 Ca 0.10 -0.59 -0.16 0.00 -0.03 0.00 0.00 56.01 55.33 2bx5 n LEU 54 Cb 0.49 -0.84 -0.11 0.00 -2.33 0.00 0.00 43.42 40.64 2bx5 n LEU 54 CO 0.69 -2.58 -0.43 -1.10 -1.33 0.00 0.00 177.39 172.64 2bx5 s GLN 55 N -4.06 0.93 -1.37 3.23 -1.52 -1.26 -4.63 119.66 110.98 2bx5 s GLN 55 Ca 0.45 -1.19 -0.07 0.00 -1.95 0.00 0.00 55.36 52.60 2bx5 s GLN 55 Cb -0.08 -0.71 0.09 0.00 -0.22 0.00 0.00 33.01 32.09 2bx5 s GLN 55 CO 0.38 0.12 2.40 0.43 -0.25 0.00 0.00 175.29 178.38 2bx5 n SER 56 N 0.55 7.61 0.00 5.90 7.64 -1.26 -3.30 113.62 130.76 2bx5 n SER 56 Ca -0.16 -3.03 0.00 0.00 1.01 0.00 0.00 58.87 56.69 2bx5 n SER 56 Cb 0.57 -1.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 2bx5 n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bx5 n GLY 57 N 2.27 0.03 3.77 0.23 0.00 -1.26 -5.11 105.19 105.12 2bx5 n GLY 57 Ca 0.62 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 46.21 2bx5 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bx5 s VAL 58 N 0.00 2.22 0.29 1.61 0.11 -1.21 -5.05 120.40 118.37 2bx5 s VAL 58 Ca 0.00 0.21 0.03 0.00 -2.93 0.00 0.00 61.98 59.29 2bx5 s VAL 58 Cb 0.00 -3.13 -0.03 0.00 -1.53 0.00 0.00 36.38 31.68 2bx5 s VAL 58 CO 0.00 0.05 0.45 -2.16 -3.33 0.00 0.00 175.10 170.11 2bx5 s PRO 59 N -1.83 3.46 0.00 1.54 0.04 -1.26 -4.66 135.00 132.29 2bx5 s PRO 59 Ca 0.53 -0.54 0.00 0.00 0.04 0.00 0.00 61.00 61.03 2bx5 s PRO 59 Cb -0.45 -2.78 0.00 0.00 0.04 0.00 0.00 34.50 31.31 2bx5 s PRO 59 CO 0.59 0.30 0.45 -1.13 0.04 0.00 0.00 177.00 177.24 2bx5 n SER 60 N -1.56 0.00 0.06 6.66 3.41 -1.26 -3.12 113.62 117.81 2bx5 n SER 60 Ca -0.07 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.65 2bx5 n SER 60 Cb 0.56 0.00 0.45 0.00 -0.26 0.00 0.00 64.21 64.97 2bx5 n SER 60 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2bx5 n ARG 61 N -0.95 0.12 -4.17 4.33 0.63 -1.26 -4.82 116.66 110.53 2bx5 n ARG 61 Ca 0.00 0.24 -0.23 0.00 -0.92 0.00 0.00 57.85 56.94 2bx5 n ARG 61 Cb 0.00 -1.68 -0.05 0.00 0.45 0.00 0.00 32.46 31.18 2bx5 n ARG 61 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2bx5 s PHE 62 N -3.11 2.97 -0.30 -0.14 0.40 -1.18 0.74 117.98 117.36 2bx5 s PHE 62 Ca 0.09 -0.14 -0.12 0.00 -0.60 0.00 0.00 56.93 56.16 2bx5 s PHE 62 Cb 0.12 -1.34 0.18 0.00 0.51 0.00 0.00 43.02 42.49 2bx5 s PHE 62 CO 0.43 0.55 1.04 -1.12 0.70 0.00 0.00 175.22 176.83 2bx5 s SER 63 N -3.72 -0.45 0.21 1.36 0.01 -1.24 -4.97 113.70 104.90 2bx5 s SER 63 Ca 0.32 0.13 0.01 0.00 1.31 0.00 0.00 55.95 57.73 2bx5 s SER 63 Cb -0.08 1.32 0.02 0.00 0.21 0.00 0.00 66.02 67.49 2bx5 s SER 63 CO 0.23 -0.08 0.16 0.61 0.41 0.00 0.00 173.24 174.57 2bx5 n GLY 64 N 5.26 1.59 0.00 3.44 0.00 -1.21 -3.24 105.19 111.03 2bx5 n GLY 64 Ca 0.03 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.95 2bx5 n GLY 64 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bx5 n SER 65 N -2.91 0.00 0.00 1.61 7.64 -1.16 -4.46 113.62 114.35 2bx5 n SER 65 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2bx5 n SER 65 Cb 0.11 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2bx5 n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bx5 n GLY 66 N 0.00 3.98 3.81 0.23 0.00 -1.26 -2.74 105.19 109.20 2bx5 n GLY 66 Ca 0.00 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 2bx5 n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2bx5 s SER 67 N 0.00 4.29 1.86 1.61 0.15 -1.26 -4.56 113.70 115.79 2bx5 s SER 67 Ca 0.00 -1.55 0.00 0.00 0.70 0.00 0.00 55.95 55.10 2bx5 s SER 67 Cb 0.00 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 2bx5 s SER 67 CO 0.00 -0.95 0.00 0.61 1.20 0.00 0.00 173.24 174.10 2bx5 n GLY 68 N -1.43 2.65 0.00 9.45 0.00 -0.91 -3.81 105.19 111.15 2bx5 n GLY 68 Ca -0.15 0.20 0.01 0.00 0.00 0.00 0.00 46.02 46.08 2bx5 n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2bx5 n THR 69 N 0.00 0.01 -3.96 2.61 -1.04 -1.26 -1.45 114.28 109.18 2bx5 n THR 69 Ca 0.00 -0.04 -0.31 0.00 -2.04 0.00 0.00 64.05 61.66 2bx5 n THR 69 Cb 0.00 0.33 -0.15 0.00 -1.82 0.00 0.00 70.33 68.69 2bx5 n THR 69 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2bx5 s ASP 70 N -2.28 4.42 0.22 8.00 -1.08 -1.25 -2.64 116.67 122.06 2bx5 s ASP 70 Ca -0.01 -1.77 0.10 0.00 -0.52 0.00 0.00 52.55 50.36 2bx5 s ASP 70 Cb 0.01 -1.40 -0.05 0.00 -1.46 0.00 0.00 42.92 40.02 2bx5 s ASP 70 CO 0.06 -0.33 -0.20 -0.36 0.52 0.00 0.00 175.17 174.87 2bx5 s PHE 71 N 1.14 2.10 -0.18 -5.34 0.40 -1.05 -4.69 117.98 110.37 2bx5 s PHE 71 Ca 0.04 -0.41 -0.01 0.00 -0.60 0.00 0.00 56.93 55.96 2bx5 s PHE 71 Cb -0.19 -0.99 0.05 0.00 0.51 0.00 0.00 43.02 42.40 2bx5 s PHE 71 CO -0.10 0.51 -0.01 0.99 0.70 0.00 0.00 175.22 177.31 2bx5 s THR 72 N -2.20 0.87 -0.19 0.64 2.01 -1.11 -1.54 115.64 114.12 2bx5 s THR 72 Ca 0.23 -0.62 -0.06 0.00 0.31 0.00 0.00 61.69 61.55 2bx5 s THR 72 Cb -0.05 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.23 2bx5 s THR 72 CO 0.10 -0.03 0.02 -0.22 -0.69 0.00 0.00 174.62 173.80 2bx5 s LEU 73 N 1.72 3.42 -0.21 4.42 2.96 -1.04 -2.97 118.68 126.97 2bx5 s LEU 73 Ca -0.01 -0.12 -0.03 0.00 -0.22 0.00 0.00 54.13 53.76 2bx5 s LEU 73 Cb -0.16 -1.86 0.07 0.00 0.50 0.00 0.00 46.19 44.73 2bx5 s LEU 73 CO -0.07 0.10 0.07 -0.89 -1.32 0.00 0.00 176.35 174.24 2bx5 s THR 74 N 0.79 0.32 -0.63 3.68 2.01 -1.20 0.84 115.64 121.45 2bx5 s THR 74 Ca 0.01 -0.58 -0.26 0.00 0.31 0.00 0.00 61.69 61.17 2bx5 s THR 74 Cb -0.14 -0.98 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 2bx5 s THR 74 CO 0.02 -0.36 2.05 -0.63 -0.69 0.00 0.00 174.62 175.01 2bx5 s ILE 75 N 1.94 3.26 0.51 1.82 1.01 -0.90 -3.72 121.20 125.12 2bx5 s ILE 75 Ca 0.02 0.06 0.28 0.00 0.00 0.00 0.00 60.65 61.02 2bx5 s ILE 75 Cb -0.17 -3.66 0.46 0.00 0.01 0.00 0.00 42.46 39.11 2bx5 s ILE 75 CO -0.14 -0.63 1.88 -1.28 0.00 0.00 0.00 174.94 174.76 2bx5 h SER 76 N 15.53 0.10 -1.02 3.58 0.87 0.07 -2.22 113.55 130.44 2bx5 h SER 76 Ca -0.19 0.01 -0.32 0.00 -1.23 0.00 0.00 61.79 60.07 2bx5 h SER 76 Cb 1.16 -0.01 -0.23 0.00 -0.44 0.00 0.00 62.40 62.89 2bx5 h SER 76 CO 1.19 0.03 -0.67 -0.24 -0.53 0.00 0.00 176.83 176.61 2bx5 n SER 77 N -4.33 -2.17 -4.54 6.23 2.88 -1.26 -2.47 113.62 107.96 2bx5 n SER 77 Ca 0.19 -2.94 -0.64 0.00 -1.33 0.00 0.00 58.87 54.16 2bx5 n SER 77 Cb 0.91 1.01 -0.11 0.00 -0.75 0.00 0.00 64.21 65.28 2bx5 n SER 77 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2bx5 n LEU 78 N 2.19 1.13 -4.74 2.46 7.94 -1.24 -4.17 117.00 120.57 2bx5 n LEU 78 Ca 0.17 0.95 -0.40 0.00 -1.11 0.00 0.00 56.01 55.62 2bx5 n LEU 78 Cb 0.57 -0.92 -0.05 0.00 0.53 0.00 0.00 43.42 43.55 2bx5 n LEU 78 CO 0.05 -0.78 0.47 -1.10 -1.11 0.00 0.00 177.39 174.92 2bx5 s GLN 79 N 4.35 4.49 0.32 1.96 1.11 -1.26 0.65 119.66 131.28 2bx5 s GLN 79 Ca 1.11 1.05 0.11 0.00 0.01 0.00 0.00 55.36 57.63 2bx5 s GLN 79 Cb -1.45 -3.39 0.96 0.00 -1.01 0.00 0.00 33.01 28.11 2bx5 s GLN 79 CO 0.73 0.21 1.68 -1.35 0.01 0.00 0.00 175.29 176.57 2bx5 h PRO 80 N 5.99 0.36 -2.23 2.91 0.11 -1.94 -3.34 132.00 133.86 2bx5 h PRO 80 Ca -0.43 -0.02 -0.52 0.00 0.11 0.00 0.00 66.00 65.14 2bx5 h PRO 80 Cb 1.20 -0.08 -0.13 0.00 0.11 0.00 0.00 31.00 32.10 2bx5 h PRO 80 CO 0.72 0.24 1.02 -0.85 -0.21 0.00 0.00 178.00 178.92 2bx5 n GLU 81 N -5.04 2.98 -0.84 1.05 0.00 -1.26 -4.10 120.64 113.43 2bx5 n GLU 81 Ca 0.28 -2.38 -0.01 0.00 0.00 0.00 0.00 57.16 55.05 2bx5 n GLU 81 Cb 0.86 -2.29 -0.01 0.00 0.00 0.00 0.00 31.44 29.99 2bx5 n GLU 81 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2bx5 n ASP 82 N 1.57 -0.07 -4.54 -1.84 5.68 -1.26 -5.06 116.55 111.04 2bx5 n ASP 82 Ca 0.54 -1.70 -0.34 0.00 -0.50 0.00 0.00 54.79 52.78 2bx5 n ASP 82 Cb 0.52 -0.03 -0.07 0.00 -1.14 0.00 0.00 41.12 40.40 2bx5 n ASP 82 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 2bx5 n PHE 83 N 0.10 1.16 -3.64 2.11 7.35 -1.26 -4.79 117.46 118.49 2bx5 n PHE 83 Ca -0.06 0.16 -0.05 0.00 -0.76 0.00 0.00 57.45 56.74 2bx5 n PHE 83 Cb 0.73 -2.50 -0.07 0.00 0.35 0.00 0.00 39.48 37.99 2bx5 n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2bx5 s ALA 84 N 11.39 -2.14 1.01 3.13 0.00 -1.25 -4.30 121.76 129.60 2bx5 s ALA 84 Ca 1.07 2.19 -0.14 0.00 0.00 0.00 0.00 51.96 55.09 2bx5 s ALA 84 Cb -0.43 -1.60 0.10 0.00 0.00 0.00 0.00 23.12 21.19 2bx5 s ALA 84 CO 0.30 -0.34 0.51 2.41 0.00 0.00 0.00 175.76 178.65 2bx5 n THR 85 N 3.56 0.00 -3.36 0.00 -1.04 -1.22 -3.51 114.28 108.71 2bx5 n THR 85 Ca -0.18 -0.21 -0.15 0.00 -2.04 0.00 0.00 64.05 61.48 2bx5 n THR 85 Cb 0.58 -0.72 -0.08 0.00 -1.82 0.00 0.00 70.33 68.29 2bx5 n THR 85 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2bx5 s TYR 86 N -2.40 -0.58 -0.13 -1.42 1.51 -1.05 -3.20 117.35 110.08 2bx5 s TYR 86 Ca 0.60 -0.24 -0.05 0.00 -1.01 0.00 0.00 57.07 56.37 2bx5 s TYR 86 Cb -0.20 -0.35 -0.04 0.00 -0.11 0.00 0.00 41.96 41.26 2bx5 s TYR 86 CO 0.65 -0.96 0.05 0.71 -1.11 0.00 0.00 175.55 174.89 2bx5 s TYR 87 N 2.11 3.27 0.12 2.71 1.51 -0.79 -4.13 117.35 122.15 2bx5 s TYR 87 Ca 0.12 0.19 -0.30 0.00 -1.01 0.00 0.00 57.07 56.06 2bx5 s TYR 87 Cb -0.14 -1.92 -0.06 0.00 -0.11 0.00 0.00 41.96 39.73 2bx5 s TYR 87 CO -0.23 0.39 1.05 0.00 -1.11 0.00 0.00 175.55 175.65 2bx5 s GLN 89 N 0.05 1.65 0.63 0.00 0.74 -1.16 0.93 119.66 122.49 2bx5 s GLN 89 Ca 0.50 -0.65 -0.15 0.00 0.05 0.00 0.00 55.36 55.10 2bx5 s GLN 89 Cb -0.26 -2.18 -0.02 0.00 1.10 0.00 0.00 33.01 31.64 2bx5 s GLN 89 CO 0.32 -0.44 1.07 -1.14 -0.55 0.00 0.00 175.29 174.55 2bx5 s GLN 90 N 1.54 3.10 -0.20 1.67 -0.44 -1.20 -2.92 119.66 121.22 2bx5 s GLN 90 Ca -0.00 1.23 0.14 0.00 -2.50 0.00 0.00 55.36 54.22 2bx5 s GLN 90 Cb -0.16 -2.00 0.44 0.00 -1.64 0.00 0.00 33.01 29.65 2bx5 s GLN 90 CO -0.08 -0.99 1.19 0.45 0.50 0.00 0.00 175.29 176.36 2bx5 n SER 91 N -2.30 2.47 -0.07 6.67 2.88 0.21 -4.24 113.62 119.24 2bx5 n SER 91 Ca 0.09 -3.29 -0.05 0.00 -1.33 0.00 0.00 58.87 54.29 2bx5 n SER 91 Cb 0.53 -0.43 -0.02 0.00 -0.75 0.00 0.00 64.21 63.54 2bx5 n SER 91 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2bx5 h TYR 92 N 1.53 0.00 -2.69 0.66 3.20 -1.91 -3.47 116.97 114.28 2bx5 h TYR 92 Ca 0.05 0.00 -0.41 0.00 3.14 0.00 0.00 58.73 61.51 2bx5 h TYR 92 Cb 1.35 0.00 -0.38 0.00 1.54 0.00 0.00 36.73 39.24 2bx5 h TYR 92 CO 0.65 0.14 -0.70 -1.54 -1.64 0.00 0.00 178.16 175.07 2bx5 s SER 93 N -5.78 2.16 -0.00 -2.11 1.04 -1.26 -5.09 113.70 102.65 2bx5 s SER 93 Ca -0.12 -0.63 -0.39 0.00 0.48 0.00 0.00 55.95 55.29 2bx5 s SER 93 Cb 0.02 0.05 -0.18 0.00 0.10 0.00 0.00 66.02 66.01 2bx5 s SER 93 CO 0.20 -0.37 1.28 0.35 0.98 0.00 0.00 173.24 175.69 2bx5 n THR 94 N 5.29 0.02 -2.27 2.02 -2.24 -1.26 -3.49 114.28 112.35 2bx5 n THR 94 Ca -0.06 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.29 2bx5 n THR 94 Cb 0.47 -0.52 -0.02 0.00 -2.10 0.00 0.00 70.33 68.16 2bx5 n THR 94 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2bx5 s PRO 95 N 0.66 4.01 -0.52 -0.78 0.02 -1.26 -4.87 135.00 132.26 2bx5 s PRO 95 Ca 0.89 1.62 -0.28 0.00 0.02 0.00 0.00 61.00 63.25 2bx5 s PRO 95 Cb -1.11 -3.91 0.01 0.00 0.02 0.00 0.00 34.50 29.52 2bx5 s PRO 95 CO 0.54 -1.01 1.39 -0.80 -0.33 0.00 0.00 177.00 176.78 2bx5 s ASN 96 N 3.06 6.22 0.37 2.53 0.01 -1.23 -4.79 114.94 121.12 2bx5 s ASN 96 Ca 0.63 0.44 0.07 0.00 -0.71 0.00 0.00 52.86 53.29 2bx5 s ASN 96 Cb -0.23 -2.54 -0.01 0.00 0.41 0.00 0.00 41.25 38.88 2bx5 s ASN 96 CO 0.23 -1.60 0.48 0.42 -1.51 0.00 0.00 177.10 175.12 2bx5 s THR 97 N 5.76 3.58 0.18 1.60 -4.23 -1.26 -4.94 115.64 116.33 2bx5 s THR 97 Ca 0.54 -1.06 0.07 0.00 -1.18 0.00 0.00 61.69 60.06 2bx5 s THR 97 Cb -0.11 -3.23 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 2bx5 s THR 97 CO 0.28 -0.10 0.05 -0.36 -0.54 0.00 0.00 174.62 173.94 2bx5 s PHE 98 N -2.26 2.93 1.10 3.99 0.40 -1.26 -3.25 117.98 119.62 2bx5 s PHE 98 Ca 0.48 -0.11 -0.17 0.00 -0.60 0.00 0.00 56.93 56.53 2bx5 s PHE 98 Cb -0.09 -1.40 0.24 0.00 0.51 0.00 0.00 43.02 42.28 2bx5 s PHE 98 CO 0.31 0.53 1.16 0.20 0.70 0.00 0.00 175.22 178.12 2bx5 s GLY 99 N -3.10 1.62 0.09 4.36 0.00 0.26 -4.67 107.32 105.89 2bx5 s GLY 99 Ca 0.29 -0.91 -0.07 0.00 0.00 0.00 0.00 44.72 44.03 2bx5 s GLY 99 CO 0.20 -0.11 1.19 1.46 0.00 0.00 0.00 173.10 175.84 2bx5 h GLN 100 N -2.19 0.41 0.00 2.90 4.20 -1.87 -3.44 115.11 115.11 2bx5 h GLN 100 Ca -0.46 -0.56 0.00 0.00 0.06 0.00 0.00 58.65 57.69 2bx5 h GLN 100 Cb 1.29 0.19 0.00 0.00 0.30 0.00 0.00 27.48 29.25 2bx5 h GLN 100 CO 0.40 1.22 0.00 0.41 -0.67 0.00 0.00 178.83 180.19 2bx5 n GLY 101 N 1.29 4.56 2.49 3.46 0.00 -1.26 -5.04 105.19 110.70 2bx5 n GLY 101 Ca -0.09 -1.18 -0.25 0.00 0.00 0.00 0.00 46.02 44.50 2bx5 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bx5 s THR 102 N -1.35 0.08 -0.50 2.61 2.01 -1.26 -4.44 115.64 112.80 2bx5 s THR 102 Ca 0.00 -1.97 -0.44 0.00 0.31 0.00 0.00 61.69 59.60 2bx5 s THR 102 Cb 0.00 -1.04 -0.19 0.00 0.01 0.00 0.00 72.50 71.28 2bx5 s THR 102 CO 0.00 -0.98 2.13 0.29 -0.69 0.00 0.00 174.62 175.37 2bx5 n LYS 103 N 3.48 0.00 -3.73 4.92 4.01 -1.26 -2.52 118.16 123.07 2bx5 n LYS 103 Ca 0.20 0.00 -0.38 0.00 -0.51 0.00 0.00 58.31 57.62 2bx5 n LYS 103 Cb 0.44 -1.49 -0.12 0.00 -0.51 0.00 0.00 35.03 33.35 2bx5 n LYS 103 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2bx5 s VAL 104 N 5.96 3.77 -0.28 -0.18 1.01 -1.23 -2.86 120.40 126.58 2bx5 s VAL 104 Ca 1.19 -1.32 -0.10 0.00 0.00 0.00 0.00 61.98 61.75 2bx5 s VAL 104 Cb -1.49 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 31.63 2bx5 s VAL 104 CO 0.66 -0.31 0.16 -0.70 0.00 0.00 0.00 175.10 174.91 2bx5 s GLU 105 N 1.37 3.75 0.00 2.72 2.56 -1.26 -3.84 118.70 124.00 2bx5 s GLU 105 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.97 54.53 2bx5 s GLU 105 Cb -0.21 -3.58 0.00 0.00 2.00 0.00 0.00 34.13 32.34 2bx5 s GLU 105 CO 0.02 -0.24 0.04 -0.89 -0.56 0.00 0.00 175.26 173.63