#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bx5 n ILE 2 N 0.00 2.74 -4.83 0.53 2.08 -1.26 -5.03 119.36 113.58 2bx5 n ILE 2 Ca 0.00 -0.50 -0.25 0.00 0.56 0.00 0.00 62.75 62.56 2bx5 n ILE 2 Cb 0.00 -0.92 -0.15 0.00 -0.75 0.00 0.00 39.64 37.81 2bx5 n ILE 2 CO 0.00 0.00 0.00 -1.58 0.56 0.00 0.00 176.55 175.53 2bx5 s GLN 3 N -2.25 1.47 -0.98 0.38 2.00 -1.26 -4.91 119.66 114.12 2bx5 s GLN 3 Ca 0.69 -0.62 -0.07 0.00 -2.00 0.00 0.00 55.36 53.37 2bx5 s GLN 3 Cb -0.47 -1.39 0.25 0.00 0.80 0.00 0.00 33.01 32.19 2bx5 s GLN 3 CO 0.53 0.35 0.92 -1.64 -0.50 0.00 0.00 175.29 174.95 2bx5 s MET 4 N -0.33 3.72 -1.15 1.67 -1.94 -1.26 -2.86 119.30 117.16 2bx5 s MET 4 Ca 0.05 -3.14 -0.17 0.00 -1.71 0.00 0.00 55.69 50.72 2bx5 s MET 4 Cb -0.08 -4.28 0.12 0.00 2.01 0.00 0.00 34.83 32.60 2bx5 s MET 4 CO -0.00 -1.25 1.46 0.95 -0.01 0.00 0.00 175.02 176.16 2bx5 s THR 5 N -1.10 4.55 0.21 2.05 -4.23 0.26 -4.29 115.64 113.09 2bx5 s THR 5 Ca 0.28 -1.93 0.06 0.00 -1.18 0.00 0.00 61.69 58.91 2bx5 s THR 5 Cb -0.10 -4.99 -0.04 0.00 1.34 0.00 0.00 72.50 68.72 2bx5 s THR 5 CO -0.09 -1.76 0.20 -1.58 -0.54 0.00 0.00 174.62 170.85 2bx5 s GLN 6 N 3.06 3.03 -0.20 3.99 0.74 -1.26 -0.27 119.66 128.74 2bx5 s GLN 6 Ca 0.44 -0.91 -0.19 0.00 0.05 0.00 0.00 55.36 54.76 2bx5 s GLN 6 Cb -0.01 -2.67 0.05 0.00 1.10 0.00 0.00 33.01 31.48 2bx5 s GLN 6 CO -0.01 0.45 0.54 -1.54 -0.55 0.00 0.00 175.29 174.17 2bx5 s SER 7 N -3.53 -0.57 0.00 6.67 1.04 0.35 -4.79 113.70 112.88 2bx5 s SER 7 Ca 0.32 1.09 0.00 0.00 0.48 0.00 0.00 55.95 57.85 2bx5 s SER 7 Cb -0.09 1.10 0.00 0.00 0.10 0.00 0.00 66.02 67.13 2bx5 s SER 7 CO 0.25 -0.19 0.00 -0.81 0.98 0.00 0.00 173.24 173.47 2bx5 n PRO 8 N 2.82 2.78 0.00 4.02 -0.05 -1.26 -2.19 135.00 141.12 2bx5 n PRO 8 Ca -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.31 2bx5 n PRO 8 Cb 0.56 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 34.01 2bx5 n PRO 8 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 2bx5 n SER 9 N 0.00 0.00 -4.96 3.54 3.41 -1.26 -4.41 113.62 109.94 2bx5 n SER 9 Ca 0.00 0.46 -0.22 0.00 -0.26 0.00 0.00 58.87 58.85 2bx5 n SER 9 Cb 0.00 -0.49 0.03 0.00 -0.26 0.00 0.00 64.21 63.49 2bx5 n SER 9 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2bx5 s SER 10 N -3.02 5.46 -0.47 4.04 0.01 -1.26 -2.69 113.70 115.77 2bx5 s SER 10 Ca 0.00 0.11 0.06 0.00 1.31 0.00 0.00 55.95 57.43 2bx5 s SER 10 Cb 0.00 -1.11 0.23 0.00 0.21 0.00 0.00 66.02 65.35 2bx5 s SER 10 CO 0.00 -1.00 0.79 0.18 0.41 0.00 0.00 173.24 173.62 2bx5 n LEU 11 N -2.27 -2.36 -4.60 2.44 4.32 -1.14 -4.92 117.00 108.46 2bx5 n LEU 11 Ca 0.06 -3.54 -0.41 0.00 -0.02 0.00 0.00 56.01 52.10 2bx5 n LEU 11 Cb 0.59 0.78 0.02 0.00 -1.62 0.00 0.00 43.42 43.19 2bx5 n LEU 11 CO 0.46 2.00 0.55 -0.24 -1.22 0.00 0.00 177.39 178.94 2bx5 n SER 12 N 1.81 1.04 -3.63 -1.43 2.88 -1.26 -3.94 113.62 109.09 2bx5 n SER 12 Ca 0.13 0.98 -0.00 0.00 -1.33 0.00 0.00 58.87 58.65 2bx5 n SER 12 Cb 0.60 -1.35 0.01 0.00 -0.75 0.00 0.00 64.21 62.72 2bx5 n SER 12 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bx5 s ALA 13 N -1.34 -2.05 0.19 -1.46 0.00 -1.25 -4.84 121.76 111.01 2bx5 s ALA 13 Ca 0.65 0.12 0.08 0.00 0.00 0.00 0.00 51.96 52.82 2bx5 s ALA 13 Cb -0.53 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2bx5 s ALA 13 CO 0.55 -1.09 -0.02 -1.54 0.00 0.00 0.00 175.76 173.66 2bx5 s SER 14 N -3.35 4.60 0.37 0.00 1.04 -1.26 -3.09 113.70 112.00 2bx5 s SER 14 Ca 0.21 -0.49 -0.24 0.00 0.48 0.00 0.00 55.95 55.92 2bx5 s SER 14 Cb 0.00 -0.91 -0.14 0.00 0.10 0.00 0.00 66.02 65.07 2bx5 s SER 14 CO 0.00 0.08 0.50 0.52 0.98 0.00 0.00 173.24 175.32 2bx5 n VAL 15 N -0.22 1.61 0.00 5.02 0.31 -1.26 -4.11 118.33 119.68 2bx5 n VAL 15 Ca -0.09 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.74 2bx5 n VAL 15 Cb 0.56 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 33.09 2bx5 n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bx5 n GLY 16 N 1.87 3.08 3.84 2.92 0.00 -0.75 -4.85 105.19 111.30 2bx5 n GLY 16 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2bx5 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bx5 s ASP 17 N -1.20 6.84 -1.36 1.61 -0.00 -1.26 -3.05 116.67 118.24 2bx5 s ASP 17 Ca 0.00 1.34 -0.15 0.00 -0.00 0.00 0.00 52.55 53.74 2bx5 s ASP 17 Cb 0.00 -2.40 0.07 0.00 -0.00 0.00 0.00 42.92 40.60 2bx5 s ASP 17 CO 0.00 -0.18 1.95 -1.14 -0.00 0.00 0.00 175.17 175.81 2bx5 n ARG 18 N -0.19 3.10 -2.32 8.23 0.63 -1.18 -3.69 116.66 121.23 2bx5 n ARG 18 Ca 0.03 -3.04 -0.42 0.00 -0.92 0.00 0.00 57.85 53.49 2bx5 n ARG 18 Cb 0.53 -3.32 -0.03 0.00 0.45 0.00 0.00 32.46 30.10 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 3.20 3.98 -0.19 5.15 1.01 -1.05 -4.95 120.40 127.55 2bx5 s VAL 19 Ca 0.49 1.31 -0.05 0.00 0.00 0.00 0.00 61.98 63.73 2bx5 s VAL 19 Cb 0.09 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 2bx5 s VAL 19 CO -0.01 -0.03 -0.01 -0.89 0.00 0.00 0.00 175.10 174.16 2bx5 s THR 20 N 2.60 3.92 -0.17 3.92 2.01 -1.26 -2.21 115.64 124.45 2bx5 s THR 20 Ca 0.60 -0.33 0.01 0.00 0.31 0.00 0.00 61.69 62.28 2bx5 s THR 20 Cb -0.28 -2.76 0.01 0.00 0.01 0.00 0.00 72.50 69.48 2bx5 s THR 20 CO 0.23 0.44 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.79 2bx5 s ILE 21 N 0.88 2.30 0.02 1.82 1.01 -1.11 -4.88 121.20 121.25 2bx5 s ILE 21 Ca 0.01 -0.88 0.06 0.00 0.00 0.00 0.00 60.65 59.84 2bx5 s ILE 21 Cb -0.14 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2bx5 s ILE 21 CO 0.02 0.53 -0.15 0.42 0.00 0.00 0.00 174.94 175.76 2bx5 s THR 22 N 1.07 3.03 0.14 2.92 -4.23 -0.93 -0.09 115.64 117.55 2bx5 s THR 22 Ca -0.01 -1.04 0.05 0.00 -1.18 0.00 0.00 61.69 59.51 2bx5 s THR 22 Cb -0.14 -2.28 -0.04 0.00 1.34 0.00 0.00 72.50 71.38 2bx5 s THR 22 CO -0.06 0.37 0.09 0.00 -0.54 0.00 0.00 174.62 174.48 2bx5 s ARG 24 N -2.86 0.13 0.66 0.00 1.81 0.63 -1.33 118.95 118.00 2bx5 s ARG 24 Ca 0.29 0.29 -0.10 0.00 -1.72 0.00 0.00 55.73 54.49 2bx5 s ARG 24 Cb -0.11 -0.99 -0.00 0.00 -0.45 0.00 0.00 34.95 33.40 2bx5 s ARG 24 CO 0.22 -0.55 1.04 0.00 -0.68 0.00 0.00 175.30 175.33 2bx5 s ALA 25 N 2.30 3.02 -1.24 2.13 0.00 0.72 0.91 121.76 129.60 2bx5 s ALA 25 Ca 0.05 -0.31 0.24 0.00 0.00 0.00 0.00 51.96 51.94 2bx5 s ALA 25 Cb -0.15 -2.98 0.33 0.00 0.00 0.00 0.00 23.12 20.33 2bx5 s ALA 25 CO -0.10 -0.93 1.29 -1.13 0.00 0.00 0.00 175.76 174.89 2bx5 n SER 26 N -2.85 0.86 -3.97 0.00 3.41 -1.13 -4.76 113.62 105.18 2bx5 n SER 26 Ca 0.06 -0.67 -0.09 0.00 -0.26 0.00 0.00 58.87 57.91 2bx5 n SER 26 Cb 0.56 0.43 -0.06 0.00 -0.26 0.00 0.00 64.21 64.88 2bx5 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bx5 s GLN 27 N -2.86 1.45 -0.34 4.33 -2.07 -1.26 -4.99 119.66 113.93 2bx5 s GLN 27 Ca 0.14 -1.21 -0.39 0.00 -1.82 0.00 0.00 55.36 52.08 2bx5 s GLN 27 Cb 0.18 0.45 -0.15 0.00 -1.09 0.00 0.00 33.01 32.40 2bx5 s GLN 27 CO 0.69 -0.59 1.96 0.45 -1.32 0.00 0.00 175.29 176.48 2bx5 n SER 28 N -0.35 2.07 -3.37 12.60 2.88 -1.26 -4.56 113.62 121.63 2bx5 n SER 28 Ca -0.03 0.79 -0.32 0.00 -1.33 0.00 0.00 58.87 57.98 2bx5 n SER 28 Cb 0.62 -1.15 -0.03 0.00 -0.75 0.00 0.00 64.21 62.90 2bx5 n SER 28 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 2bx5 n ILE 29 N 5.78 3.74 0.00 2.46 -5.35 0.16 -4.96 119.36 121.19 2bx5 n ILE 29 Ca 0.36 -5.60 0.00 0.00 -0.27 0.00 0.00 62.75 57.23 2bx5 n ILE 29 Cb 0.14 -1.75 0.00 0.00 -1.74 0.00 0.00 39.64 36.29 2bx5 n ILE 29 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2bx5 n SER 30 N 0.36 0.00 0.00 7.28 2.88 -1.26 -1.54 113.62 121.35 2bx5 n SER 30 Ca 0.33 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 2bx5 n SER 30 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 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 -2.36 0.00 -2.86 -3.46 2.88 -1.26 -1.71 113.62 104.85 2bx5 n SER 31 Ca 0.00 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2bx5 n SER 31 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 0.00 0.00 -3.93 0.66 4.02 -0.59 -3.00 117.16 114.32 2bx5 n TYR 32 Ca 0.00 -0.30 -0.35 0.00 -0.01 0.00 0.00 57.90 57.24 2bx5 n TYR 32 Cb 0.02 -0.51 -0.10 0.00 -0.02 0.00 0.00 39.34 38.73 2bx5 n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2bx5 s LEU 33 N 0.00 3.79 -0.09 7.72 2.96 -1.26 -2.56 118.68 129.24 2bx5 s LEU 33 Ca 0.00 0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 53.94 2bx5 s LEU 33 Cb 0.00 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 2bx5 s LEU 33 CO 0.00 0.13 -0.04 0.20 -1.32 0.00 0.00 176.35 175.32 2bx5 s ASN 34 N 0.65 4.85 -0.11 3.68 0.01 0.82 -1.42 114.94 123.41 2bx5 s ASN 34 Ca 0.04 0.01 0.01 0.00 -0.71 0.00 0.00 52.86 52.21 2bx5 s ASN 34 Cb -0.13 -1.36 -0.02 0.00 0.41 0.00 0.00 41.25 40.15 2bx5 s ASN 34 CO 0.01 0.33 -0.14 0.26 -1.51 0.00 0.00 177.10 176.06 2bx5 s TRP 35 N -0.63 2.77 -0.32 2.20 0.52 0.11 0.09 118.94 123.68 2bx5 s TRP 35 Ca 0.10 -0.59 -0.02 0.00 0.02 0.00 0.00 56.10 55.61 2bx5 s TRP 35 Cb -0.12 -1.80 0.12 0.00 -1.15 0.00 0.00 33.47 30.53 2bx5 s TRP 35 CO 0.02 -0.16 0.17 0.71 0.02 0.00 0.00 176.95 177.71 2bx5 s TYR 36 N 0.17 0.61 -0.06 -1.98 1.51 0.11 -0.52 117.35 117.19 2bx5 s TYR 36 Ca -0.08 -1.30 -0.29 0.00 -1.01 0.00 0.00 57.07 54.38 2bx5 s TYR 36 Cb -0.15 -0.97 -0.02 0.00 -0.11 0.00 0.00 41.96 40.71 2bx5 s TYR 36 CO 0.05 -0.83 0.97 -1.14 -1.11 0.00 0.00 175.55 173.49 2bx5 s GLN 37 N 1.55 4.47 -0.27 -0.62 0.74 -0.80 -0.77 119.66 123.97 2bx5 s GLN 37 Ca 0.13 1.36 0.01 0.00 0.05 0.00 0.00 55.36 56.92 2bx5 s GLN 37 Cb -0.20 -3.51 0.08 0.00 1.10 0.00 0.00 33.01 30.49 2bx5 s GLN 37 CO -0.18 -0.19 0.00 -1.14 -0.55 0.00 0.00 175.29 173.24 2bx5 s GLN 38 N 1.55 1.39 0.38 1.67 -0.44 0.25 -1.70 119.66 122.76 2bx5 s GLN 38 Ca 0.49 -1.19 -0.24 0.00 -2.50 0.00 0.00 55.36 51.91 2bx5 s GLN 38 Cb -0.19 -2.59 -0.09 0.00 -1.64 0.00 0.00 33.01 28.49 2bx5 s GLN 38 CO 0.22 -0.76 1.01 0.15 0.50 0.00 0.00 175.29 176.42 2bx5 s LYS 39 N 1.34 4.27 0.33 1.67 1.02 -1.26 -1.46 119.74 125.65 2bx5 s LYS 39 Ca 0.01 1.43 -0.17 0.00 0.02 0.00 0.00 55.97 57.26 2bx5 s LYS 39 Cb -0.19 -2.57 -0.09 0.00 -0.52 0.00 0.00 37.83 34.47 2bx5 s LYS 39 CO -0.11 -0.03 0.78 -1.25 -0.92 0.00 0.00 175.35 173.82 2bx5 s PRO 40 N -2.46 4.08 0.00 -1.68 0.05 -1.26 -3.32 135.00 130.42 2bx5 s PRO 40 Ca 0.56 0.78 0.00 0.00 0.05 0.00 0.00 61.00 62.40 2bx5 s PRO 40 Cb -0.20 -2.45 0.00 0.00 0.05 0.00 0.00 34.50 31.91 2bx5 s PRO 40 CO 0.25 0.15 0.00 0.41 0.05 0.00 0.00 177.00 177.86 2bx5 n GLY 41 N -0.27 2.47 0.00 0.56 0.00 -1.26 -4.91 105.19 101.78 2bx5 n GLY 41 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2bx5 n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bx5 n LYS 42 N -2.00 0.00 -3.49 1.61 4.76 -1.21 -5.18 118.16 112.65 2bx5 n LYS 42 Ca 0.00 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.33 2bx5 n LYS 42 Cb 0.00 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.16 2bx5 n LYS 42 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bx5 s ALA 43 N -2.93 -1.77 0.17 7.82 0.00 -1.25 -5.05 121.76 118.74 2bx5 s ALA 43 Ca 0.00 0.98 -0.12 0.00 0.00 0.00 0.00 51.96 52.82 2bx5 s ALA 43 Cb 0.00 0.36 -0.07 0.00 0.00 0.00 0.00 23.12 23.41 2bx5 s ALA 43 CO 0.00 -0.63 0.53 -1.25 0.00 0.00 0.00 175.76 174.42 2bx5 s PRO 44 N -2.83 3.89 -0.02 0.00 0.05 -1.26 -4.53 135.00 130.29 2bx5 s PRO 44 Ca 0.01 0.38 0.04 0.00 0.05 0.00 0.00 61.00 61.48 2bx5 s PRO 44 Cb -0.01 -2.83 -0.03 0.00 0.05 0.00 0.00 34.50 31.68 2bx5 s PRO 44 CO -0.07 0.43 -0.13 0.15 0.05 0.00 0.00 177.00 177.43 2bx5 s LYS 45 N -2.27 2.46 -0.77 4.56 1.02 -0.69 -4.96 119.74 119.08 2bx5 s LYS 45 Ca 0.41 -0.74 -0.25 0.00 0.02 0.00 0.00 55.97 55.41 2bx5 s LYS 45 Cb -0.13 -2.39 -0.06 0.00 -0.52 0.00 0.00 37.83 34.73 2bx5 s LYS 45 CO 0.20 0.61 2.07 -1.17 -0.92 0.00 0.00 175.35 176.14 2bx5 s LEU 46 N -1.00 3.16 0.00 3.17 2.96 -1.26 -1.90 118.68 123.81 2bx5 s LEU 46 Ca 0.13 -0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.93 2bx5 s LEU 46 Cb -0.11 -2.54 0.00 0.00 0.50 0.00 0.00 46.19 44.04 2bx5 s LEU 46 CO 0.03 -2.91 0.25 0.18 -1.32 0.00 0.00 176.35 172.58 2bx5 n LEU 47 N 14.86 0.00 -4.89 -0.68 4.77 0.32 -4.61 117.00 126.78 2bx5 n LEU 47 Ca 0.37 0.25 -0.25 0.00 -0.03 0.00 0.00 56.01 56.34 2bx5 n LEU 47 Cb 0.48 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.53 2bx5 n LEU 47 CO 0.62 0.00 -0.14 -0.63 -1.33 0.00 0.00 177.39 175.92 2bx5 s ILE 48 N -0.49 4.95 0.27 -0.08 1.09 -1.20 -1.56 121.20 124.18 2bx5 s ILE 48 Ca 0.00 -0.92 -0.19 0.00 -1.10 0.00 0.00 60.65 58.44 2bx5 s ILE 48 Cb 0.00 -3.57 0.01 0.00 -1.06 0.00 0.00 42.46 37.84 2bx5 s ILE 48 CO 0.00 -0.15 0.66 -0.72 -0.10 0.00 0.00 174.94 174.63 2bx5 s TYR 49 N -1.81 -0.06 -1.43 3.97 1.13 -1.19 0.05 117.35 118.00 2bx5 s TYR 49 Ca 0.33 -0.37 0.00 0.00 -1.41 0.00 0.00 57.07 55.62 2bx5 s TYR 49 Cb -0.10 0.59 0.00 0.00 -1.10 0.00 0.00 41.96 41.35 2bx5 s TYR 49 CO 0.26 -1.18 0.00 0.00 -2.51 0.00 0.00 175.55 172.13 2bx5 n ALA 50 N -0.44 -0.21 0.00 9.51 0.00 -1.07 -3.56 120.51 124.75 2bx5 n ALA 50 Ca -0.04 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2bx5 n ALA 50 Cb 0.60 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 18.22 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 1.25 0.00 0.03 0.00 0.00 -0.51 -4.54 120.51 116.74 2bx5 n ALA 51 Ca -0.13 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.30 2bx5 n ALA 51 Cb 0.61 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.06 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 0.93 0.71 -4.62 0.00 3.41 -1.23 -1.96 113.62 110.87 2bx5 n SER 52 Ca 0.00 0.09 -0.30 0.00 -0.26 0.00 0.00 58.87 58.40 2bx5 n SER 52 Cb 0.00 -0.23 0.19 0.00 -0.26 0.00 0.00 64.21 63.91 2bx5 n SER 52 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2bx5 s SER 53 N -5.60 2.37 0.36 4.04 1.04 -1.25 -3.04 113.70 111.61 2bx5 s SER 53 Ca -0.01 1.91 0.03 0.00 0.48 0.00 0.00 55.95 58.37 2bx5 s SER 53 Cb 0.00 -2.46 -0.02 0.00 0.10 0.00 0.00 66.02 63.65 2bx5 s SER 53 CO 0.01 -3.40 0.53 -0.76 0.98 0.00 0.00 173.24 170.60 2bx5 s LEU 54 N -6.76 3.95 1.04 2.42 1.43 -1.26 -3.18 118.68 116.32 2bx5 s LEU 54 Ca 0.67 0.16 -0.14 0.00 -1.03 0.00 0.00 54.13 53.79 2bx5 s LEU 54 Cb -0.23 -3.04 0.21 0.00 0.03 0.00 0.00 46.19 43.16 2bx5 s LEU 54 CO 0.60 -0.41 1.10 -1.10 0.23 0.00 0.00 176.35 176.77 2bx5 s GLN 55 N -4.29 0.08 -0.15 1.70 -1.52 -0.60 -4.85 119.66 110.03 2bx5 s GLN 55 Ca 0.43 0.34 -0.29 0.00 -1.95 0.00 0.00 55.36 53.88 2bx5 s GLN 55 Cb -0.10 -1.71 -0.01 0.00 -0.22 0.00 0.00 33.01 30.98 2bx5 s GLN 55 CO 0.34 -2.93 1.06 -1.12 -0.25 0.00 0.00 175.29 172.39 2bx5 s SER 56 N -3.62 7.15 0.00 5.90 0.01 -1.26 -3.99 113.70 117.89 2bx5 s SER 56 Ca 0.67 1.52 0.00 0.00 1.31 0.00 0.00 55.95 59.45 2bx5 s SER 56 Cb -0.16 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.52 2bx5 s SER 56 CO 0.57 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 174.26 2bx5 n GLY 57 N 3.24 0.43 3.80 3.44 0.00 -1.26 -5.08 105.19 109.76 2bx5 n GLY 57 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.13 5.23 0.30 1.61 0.11 -1.26 -5.10 120.40 119.17 2bx5 s VAL 58 Ca 0.00 0.62 0.00 0.00 -2.93 0.00 0.00 61.98 59.67 2bx5 s VAL 58 Cb 0.00 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 31.22 2bx5 s VAL 58 CO 0.00 0.50 0.00 -2.65 -3.33 0.00 0.00 175.10 169.62 2bx5 n PRO 59 N 2.60 1.74 -0.01 1.54 -0.02 -1.26 -4.81 135.00 134.78 2bx5 n PRO 59 Ca -0.14 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.39 2bx5 n PRO 59 Cb 0.53 -0.61 -0.11 0.00 -0.02 0.00 0.00 33.50 33.29 2bx5 n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bx5 n SER 60 N 1.83 1.79 0.31 2.55 3.41 -1.26 -4.33 113.62 117.92 2bx5 n SER 60 Ca 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.79 2bx5 n SER 60 Cb 0.00 1.54 1.00 0.00 -0.26 0.00 0.00 64.21 66.49 2bx5 n SER 60 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2bx5 h ARG 61 N 0.00 0.00 -5.71 4.33 -0.00 -1.91 -3.41 114.38 107.68 2bx5 h ARG 61 Ca -0.04 0.00 -0.60 0.00 -0.00 0.00 0.00 59.98 59.34 2bx5 h ARG 61 Cb 0.78 0.00 -0.09 0.00 -0.00 0.00 0.00 29.97 30.66 2bx5 h ARG 61 CO 0.00 0.02 0.29 -0.06 -0.00 0.00 0.00 179.97 180.22 2bx5 s PHE 62 N -4.26 3.33 -0.17 4.08 0.40 -1.26 -0.95 117.98 119.16 2bx5 s PHE 62 Ca -0.04 1.02 -0.08 0.00 -0.60 0.00 0.00 56.93 57.23 2bx5 s PHE 62 Cb 0.13 -2.93 0.07 0.00 0.51 0.00 0.00 43.02 40.81 2bx5 s PHE 62 CO 0.49 -0.30 0.39 -1.54 0.70 0.00 0.00 175.22 174.97 2bx5 s SER 63 N 1.31 -0.34 0.55 1.36 1.04 -1.07 -4.94 113.70 111.63 2bx5 s SER 63 Ca 0.32 0.89 -0.11 0.00 0.48 0.00 0.00 55.95 57.53 2bx5 s SER 63 Cb -0.16 0.96 -0.05 0.00 0.10 0.00 0.00 66.02 66.88 2bx5 s SER 63 CO 0.09 -0.21 0.95 -0.83 0.98 0.00 0.00 173.24 174.22 2bx5 s GLY 64 N 1.92 1.72 -0.00 7.32 0.00 -1.17 -2.50 107.32 114.62 2bx5 s GLY 64 Ca -0.06 -0.14 -0.30 0.00 0.00 0.00 0.00 44.72 44.23 2bx5 s GLY 64 CO -0.12 0.10 1.14 -1.35 0.00 0.00 0.00 173.10 172.87 2bx5 s SER 65 N -3.89 -0.14 0.00 1.64 1.04 0.02 -4.04 113.70 108.34 2bx5 s SER 65 Ca 0.54 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.80 2bx5 s SER 65 Cb -0.11 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.28 2bx5 s SER 65 CO 0.46 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.81 2bx5 n GLY 66 N -0.39 3.13 2.98 7.32 0.00 -1.26 0.98 105.19 117.95 2bx5 n GLY 66 Ca -0.06 -1.96 -0.14 0.00 0.00 0.00 0.00 46.02 43.86 2bx5 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bx5 s SER 67 N 0.00 0.38 0.00 1.61 1.04 -1.17 -4.94 113.70 110.63 2bx5 s SER 67 Ca 0.00 0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.97 2bx5 s SER 67 Cb 0.00 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.72 2bx5 s SER 67 CO 0.00 -0.24 0.00 0.61 0.98 0.00 0.00 173.24 174.59 2bx5 n GLY 68 N 5.27 1.28 0.00 7.32 0.00 -0.70 -4.50 105.19 113.86 2bx5 n GLY 68 Ca -0.07 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 0.00 -3.70 2.61 -1.04 -1.26 0.37 114.28 111.26 2bx5 n THR 69 Ca 0.00 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.65 2bx5 n THR 69 Cb 0.00 -0.35 -0.07 0.00 -1.82 0.00 0.00 70.33 68.08 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 -3.40 6.36 0.19 8.00 -1.08 -1.26 0.26 116.67 125.74 2bx5 s ASP 70 Ca 0.00 0.42 0.03 0.00 -0.52 0.00 0.00 52.55 52.48 2bx5 s ASP 70 Cb 0.00 -2.12 -0.01 0.00 -1.46 0.00 0.00 42.92 39.33 2bx5 s ASP 70 CO 0.00 0.23 0.19 0.49 0.52 0.00 0.00 175.17 176.60 2bx5 n PHE 71 N 3.02 -0.59 -3.64 -5.34 3.01 -0.44 -3.03 117.46 110.45 2bx5 n PHE 71 Ca -0.16 -1.52 -0.05 0.00 1.01 0.00 0.00 57.45 56.73 2bx5 n PHE 71 Cb 0.53 0.20 -0.06 0.00 -0.01 0.00 0.00 39.48 40.13 2bx5 n PHE 71 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2bx5 s THR 72 N -2.73 -0.14 0.25 4.37 2.01 0.28 -2.63 115.64 117.04 2bx5 s THR 72 Ca 0.21 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.22 2bx5 s THR 72 Cb 0.01 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.48 2bx5 s THR 72 CO 0.15 0.00 0.43 -0.22 -0.69 0.00 0.00 174.62 174.29 2bx5 s LEU 73 N 1.77 4.19 -0.32 4.42 2.96 0.88 -0.80 118.68 131.77 2bx5 s LEU 73 Ca -0.09 0.34 0.04 0.00 -0.22 0.00 0.00 54.13 54.20 2bx5 s LEU 73 Cb -0.06 -3.14 0.17 0.00 0.50 0.00 0.00 46.19 43.66 2bx5 s LEU 73 CO -0.19 -0.12 0.46 -0.89 -1.32 0.00 0.00 176.35 174.29 2bx5 s THR 74 N -2.01 -0.69 -0.29 3.68 2.01 -1.04 -2.76 115.64 114.54 2bx5 s THR 74 Ca 0.38 -0.33 -0.29 0.00 0.31 0.00 0.00 61.69 61.76 2bx5 s THR 74 Cb -0.10 -0.80 0.01 0.00 0.01 0.00 0.00 72.50 71.62 2bx5 s THR 74 CO 0.31 -0.26 1.13 -0.63 -0.69 0.00 0.00 174.62 174.49 2bx5 s ILE 75 N 2.30 4.44 0.03 1.82 1.09 -0.94 -2.59 121.20 127.35 2bx5 s ILE 75 Ca 0.12 1.67 0.10 0.00 -1.10 0.00 0.00 60.65 61.44 2bx5 s ILE 75 Cb -0.11 -4.31 -0.20 0.00 -1.06 0.00 0.00 42.46 36.78 2bx5 s ILE 75 CO -0.22 -0.41 1.04 0.28 -0.10 0.00 0.00 174.94 175.53 2bx5 h SER 76 N 8.25 0.00 -5.15 3.58 0.02 -1.28 -2.78 113.55 116.20 2bx5 h SER 76 Ca -0.22 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.60 2bx5 h SER 76 Cb 1.07 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.44 2bx5 h SER 76 CO 1.02 0.95 -0.66 -0.55 -1.14 0.00 0.00 176.83 176.45 2bx5 s SER 77 N -6.42 0.38 0.25 3.07 0.15 -1.25 -3.12 113.70 106.76 2bx5 s SER 77 Ca -0.01 -0.80 0.09 0.00 0.70 0.00 0.00 55.95 55.93 2bx5 s SER 77 Cb 0.09 0.18 -0.05 0.00 -1.71 0.00 0.00 66.02 64.53 2bx5 s SER 77 CO 0.82 -0.51 -0.14 -0.22 1.20 0.00 0.00 173.24 174.39 2bx5 s LEU 78 N -2.41 2.57 -0.11 3.45 2.96 -1.17 -4.75 118.68 119.22 2bx5 s LEU 78 Ca -0.01 -1.06 -0.18 0.00 -0.22 0.00 0.00 54.13 52.66 2bx5 s LEU 78 Cb 0.02 -0.82 0.04 0.00 0.50 0.00 0.00 46.19 45.93 2bx5 s LEU 78 CO -0.07 -0.14 0.44 -1.10 -1.32 0.00 0.00 176.35 174.17 2bx5 s GLN 79 N -3.62 0.65 0.36 1.98 -1.52 -1.26 -1.81 119.66 114.45 2bx5 s GLN 79 Ca 0.27 0.32 0.25 0.00 -1.95 0.00 0.00 55.36 54.25 2bx5 s GLN 79 Cb -0.01 0.31 1.31 0.00 -0.22 0.00 0.00 33.01 34.39 2bx5 s GLN 79 CO 0.11 -0.14 1.77 -1.35 -0.25 0.00 0.00 175.29 175.43 2bx5 h PRO 80 N 4.59 0.00 -0.64 2.91 0.11 -2.00 0.60 132.00 137.57 2bx5 h PRO 80 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2bx5 h PRO 80 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2bx5 h PRO 80 CO 0.30 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.24 2bx5 n GLU 81 N -2.39 3.97 -0.07 1.05 0.00 -1.26 -4.19 120.64 117.75 2bx5 n GLU 81 Ca -0.01 -2.83 -0.08 0.00 0.00 0.00 0.00 57.16 54.24 2bx5 n GLU 81 Cb 0.08 -1.99 -0.15 0.00 0.00 0.00 0.00 31.44 29.38 2bx5 n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2bx5 n ASP 82 N 0.94 0.24 0.00 -1.84 8.00 0.21 -4.90 116.55 119.20 2bx5 n ASP 82 Ca 0.25 0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.87 2bx5 n ASP 82 Cb 0.95 0.78 0.00 0.00 -0.02 0.00 0.00 41.12 42.83 2bx5 n ASP 82 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2bx5 n PHE 83 N -2.79 0.00 -4.05 1.24 -0.00 -1.23 -4.76 117.46 105.86 2bx5 n PHE 83 Ca -0.26 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.08 2bx5 n PHE 83 Cb 1.08 0.00 -0.11 0.00 -0.00 0.00 0.00 39.48 40.45 2bx5 n PHE 83 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2bx5 s ALA 84 N 0.00 0.47 -0.04 3.13 0.00 -1.25 -4.70 121.76 119.36 2bx5 s ALA 84 Ca 0.00 -0.84 -0.30 0.00 0.00 0.00 0.00 51.96 50.82 2bx5 s ALA 84 Cb 0.00 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 2bx5 s ALA 84 CO 0.00 -0.14 1.36 0.99 0.00 0.00 0.00 175.76 177.97 2bx5 s THR 85 N -2.02 3.89 -0.28 0.00 2.01 -0.53 -2.80 115.64 115.90 2bx5 s THR 85 Ca -0.07 1.22 -0.08 0.00 0.31 0.00 0.00 61.69 63.07 2bx5 s THR 85 Cb -0.06 -3.79 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 2bx5 s THR 85 CO -0.02 -0.02 0.11 -0.31 -0.69 0.00 0.00 174.62 173.68 2bx5 s TYR 86 N 2.64 3.14 0.38 4.92 1.51 -0.78 0.84 117.35 130.00 2bx5 s TYR 86 Ca 0.62 -0.58 0.08 0.00 -1.01 0.00 0.00 57.07 56.18 2bx5 s TYR 86 Cb -0.29 -2.29 -0.02 0.00 -0.11 0.00 0.00 41.96 39.25 2bx5 s TYR 86 CO 0.24 -0.44 0.36 0.71 -1.11 0.00 0.00 175.55 175.32 2bx5 s TYR 87 N 1.60 2.81 0.36 2.71 1.51 0.05 -1.15 117.35 125.24 2bx5 s TYR 87 Ca 0.05 -0.40 0.04 0.00 -1.01 0.00 0.00 57.07 55.75 2bx5 s TYR 87 Cb -0.16 -2.03 -0.05 0.00 -0.11 0.00 0.00 41.96 39.61 2bx5 s TYR 87 CO 0.05 -0.02 0.08 0.00 -1.11 0.00 0.00 175.55 174.55 2bx5 s GLN 89 N -3.83 0.98 -0.38 0.00 0.74 0.11 -0.56 119.66 116.73 2bx5 s GLN 89 Ca 0.30 0.09 -0.05 0.00 0.05 0.00 0.00 55.36 55.76 2bx5 s GLN 89 Cb 0.06 0.46 0.08 0.00 1.10 0.00 0.00 33.01 34.71 2bx5 s GLN 89 CO 0.14 -0.34 0.16 1.14 -0.55 0.00 0.00 175.29 175.84 2bx5 s GLN 90 N -1.68 2.33 0.00 1.67 0.00 -1.18 0.28 119.66 121.09 2bx5 s GLN 90 Ca -0.06 -1.51 0.02 0.00 -0.00 0.00 0.00 55.36 53.80 2bx5 s GLN 90 Cb -0.00 -3.52 0.11 0.00 0.00 0.00 0.00 33.01 29.60 2bx5 s GLN 90 CO 0.04 -0.88 0.40 0.45 0.00 0.00 0.00 175.29 175.30 2bx5 n SER 91 N 4.71 0.00 0.06 12.60 2.88 -1.06 -3.31 113.62 129.50 2bx5 n SER 91 Ca -0.08 -0.43 -0.09 0.00 -1.33 0.00 0.00 58.87 56.94 2bx5 n SER 91 Cb 0.43 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.82 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 0.00 -0.23 -3.21 0.66 3.20 -1.91 -3.48 116.97 111.99 2bx5 h TYR 92 Ca 0.00 -0.01 -0.38 0.00 3.14 0.00 0.00 58.73 61.48 2bx5 h TYR 92 Cb 0.00 0.08 -0.14 0.00 1.54 0.00 0.00 36.73 38.20 2bx5 h TYR 92 CO 0.00 0.13 -0.69 -1.54 -1.64 0.00 0.00 178.16 174.42 2bx5 s SER 93 N -5.40 2.01 -0.01 -2.11 1.04 -1.21 -5.07 113.70 102.95 2bx5 s SER 93 Ca -0.10 -1.11 0.04 0.00 0.48 0.00 0.00 55.95 55.25 2bx5 s SER 93 Cb 0.00 -0.04 -0.03 0.00 0.10 0.00 0.00 66.02 66.06 2bx5 s SER 93 CO 0.38 -0.38 -0.10 0.42 0.98 0.00 0.00 173.24 174.54 2bx5 s THR 94 N -3.28 3.43 0.14 2.02 -4.23 -1.26 -0.55 115.64 111.91 2bx5 s THR 94 Ca 0.23 -0.79 -0.34 0.00 -1.18 0.00 0.00 61.69 59.61 2bx5 s THR 94 Cb 0.03 -2.45 -0.15 0.00 1.34 0.00 0.00 72.50 71.27 2bx5 s THR 94 CO 0.06 0.44 1.41 -2.65 -0.54 0.00 0.00 174.62 173.34 2bx5 n PRO 95 N 1.77 1.62 -1.68 3.99 -0.02 -1.26 -4.23 135.00 135.19 2bx5 n PRO 95 Ca -0.16 0.58 -0.48 0.00 -2.02 0.00 0.00 63.50 61.42 2bx5 n PRO 95 Cb 0.52 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.71 2bx5 n PRO 95 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2bx5 n ASN 96 N 2.71 3.34 -4.72 2.55 3.02 0.29 -4.69 115.26 117.76 2bx5 n ASN 96 Ca 0.16 1.00 -0.23 0.00 -0.03 0.00 0.00 54.58 55.49 2bx5 n ASN 96 Cb 0.25 -1.39 -0.06 0.00 -0.61 0.00 0.00 39.78 37.97 2bx5 n ASN 96 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2bx5 s THR 97 N 3.15 3.89 0.10 3.41 -4.23 -1.26 -4.90 115.64 115.79 2bx5 s THR 97 Ca 0.89 -1.69 0.09 0.00 -1.18 0.00 0.00 61.69 59.80 2bx5 s THR 97 Cb -0.69 -3.09 -0.04 0.00 1.34 0.00 0.00 72.50 70.02 2bx5 s THR 97 CO 0.48 -0.36 -0.19 -0.36 -0.54 0.00 0.00 174.62 173.64 2bx5 s PHE 98 N -2.24 2.51 1.34 3.99 0.40 -1.26 -3.13 117.98 119.59 2bx5 s PHE 98 Ca 0.32 -0.28 -0.20 0.00 -0.60 0.00 0.00 56.93 56.17 2bx5 s PHE 98 Cb -0.07 -1.37 0.34 0.00 0.51 0.00 0.00 43.02 42.43 2bx5 s PHE 98 CO 0.22 0.34 0.98 0.20 0.70 0.00 0.00 175.22 177.66 2bx5 s GLY 99 N -1.92 1.47 0.19 4.36 0.00 0.27 -4.75 107.32 106.94 2bx5 s GLY 99 Ca 0.17 -0.72 0.25 0.00 0.00 0.00 0.00 44.72 44.41 2bx5 s GLY 99 CO 0.08 0.22 1.75 0.61 0.00 0.00 0.00 173.10 175.76 2bx5 n GLN 100 N -5.35 0.20 -0.06 2.90 0.00 -1.26 -4.87 117.38 108.94 2bx5 n GLN 100 Ca 0.11 0.27 0.01 0.00 0.00 0.00 0.00 57.00 57.39 2bx5 n GLN 100 Cb 0.59 -1.78 -0.00 0.00 0.00 0.00 0.00 30.24 29.04 2bx5 n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2bx5 n GLY 101 N 0.76 -2.66 2.71 2.61 0.00 -1.26 -4.94 105.19 102.41 2bx5 n GLY 101 Ca 0.04 -1.43 -0.30 0.00 0.00 0.00 0.00 46.02 44.34 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 -3.10 1.35 0.43 2.61 2.01 -0.30 -4.47 115.64 114.17 2bx5 s THR 102 Ca 0.00 -2.47 -0.24 0.00 0.31 0.00 0.00 61.69 59.30 2bx5 s THR 102 Cb 0.00 -1.95 -0.08 0.00 0.01 0.00 0.00 72.50 70.48 2bx5 s THR 102 CO 0.00 -0.88 1.13 -0.54 -0.69 0.00 0.00 174.62 173.63 2bx5 s LYS 103 N 0.45 3.95 -0.05 4.92 1.02 -1.09 -1.86 119.74 127.06 2bx5 s LYS 103 Ca 0.17 1.69 0.02 0.00 0.02 0.00 0.00 55.97 57.88 2bx5 s LYS 103 Cb -0.24 -2.50 0.01 0.00 -0.52 0.00 0.00 37.83 34.58 2bx5 s LYS 103 CO -0.01 -0.37 -0.11 0.08 -0.92 0.00 0.00 175.35 174.02 2bx5 s VAL 104 N -1.56 0.98 0.63 3.17 1.01 -1.12 -2.90 120.40 120.61 2bx5 s VAL 104 Ca 0.60 -0.41 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 2bx5 s VAL 104 Cb -0.27 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.18 2bx5 s VAL 104 CO 0.33 0.31 1.04 -1.61 0.00 0.00 0.00 175.10 175.17 2bx5 s GLU 105 N 0.55 3.50 0.00 2.72 8.01 -1.25 -3.91 118.70 128.32 2bx5 s GLU 105 Ca -0.11 0.76 0.00 0.00 0.01 0.00 0.00 54.97 55.64 2bx5 s GLU 105 Cb -0.14 -2.07 0.00 0.00 -4.31 0.00 0.00 34.13 27.61 2bx5 s GLU 105 CO 0.02 -0.64 0.00 -0.89 0.01 0.00 0.00 175.26 173.76