#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bl5 s LEU 2 N 0.00 2.02 -0.05 2.61 0.05 -0.36 -5.01 118.68 117.94 2bl5 s LEU 2 Ca 0.00 -0.34 0.03 0.00 0.05 0.00 0.00 54.13 53.87 2bl5 s LEU 2 Cb 0.00 -0.97 0.00 0.00 -2.05 0.00 0.00 46.19 43.17 2bl5 s LEU 2 CO 0.00 0.22 -0.14 -1.10 -0.55 0.00 0.00 176.35 174.78 2bl5 s GLN 3 N -0.39 1.62 -0.13 1.48 -0.21 -1.26 -0.85 119.66 119.91 2bl5 s GLN 3 Ca 0.06 -0.49 0.01 0.00 0.02 0.00 0.00 55.36 54.97 2bl5 s GLN 3 Cb -0.08 -1.39 -0.00 0.00 1.00 0.00 0.00 33.01 32.54 2bl5 s GLN 3 CO -0.00 0.14 -0.18 -1.21 -2.12 0.00 0.00 175.29 171.92 2bl5 s GLU 4 N 0.28 3.18 -0.25 2.91 2.02 -0.63 -4.96 118.70 121.25 2bl5 s GLU 4 Ca -0.08 -0.78 -0.04 0.00 0.02 0.00 0.00 54.97 54.09 2bl5 s GLU 4 Cb -0.12 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 31.60 2bl5 s GLU 4 CO 0.02 0.10 -0.01 0.15 0.02 0.00 0.00 175.26 175.54 2bl5 s LYS 5 N 0.59 3.10 -0.53 1.61 3.01 -1.26 -1.08 119.74 125.18 2bl5 s LYS 5 Ca -0.10 -0.82 -0.11 0.00 -1.01 0.00 0.00 55.97 53.93 2bl5 s LYS 5 Cb -0.16 -3.10 0.13 0.00 -1.01 0.00 0.00 37.83 33.69 2bl5 s LYS 5 CO 0.03 -0.34 0.43 -0.51 0.51 0.00 0.00 175.35 175.47 2bl5 s LEU 6 N 1.43 5.90 0.17 3.17 1.43 0.88 -4.96 118.68 126.70 2bl5 s LEU 6 Ca 0.03 -2.00 -0.30 0.00 -1.03 0.00 0.00 54.13 50.83 2bl5 s LEU 6 Cb -0.16 -2.07 -0.08 0.00 0.03 0.00 0.00 46.19 43.91 2bl5 s LEU 6 CO -0.02 -0.71 1.16 -0.31 0.23 0.00 0.00 176.35 176.70 2bl5 s TYR 7 N 1.25 3.48 -0.22 0.29 1.51 -1.26 -1.57 117.35 120.83 2bl5 s TYR 7 Ca 0.07 1.47 0.00 0.00 -1.01 0.00 0.00 57.07 57.60 2bl5 s TYR 7 Cb -0.26 -3.38 0.06 0.00 -0.11 0.00 0.00 41.96 38.27 2bl5 s TYR 7 CO -0.01 -1.01 -0.05 0.14 -1.11 0.00 0.00 175.55 173.52 2bl5 s VAL 8 N -0.02 1.43 -0.82 0.71 -7.23 -0.95 -4.96 120.40 108.56 2bl5 s VAL 8 Ca 0.52 -1.10 -0.25 0.00 -1.81 0.00 0.00 61.98 59.34 2bl5 s VAL 8 Cb -0.31 -1.69 -0.01 0.00 0.56 0.00 0.00 36.38 34.93 2bl5 s VAL 8 CO 0.35 -0.07 1.75 -2.16 -0.31 0.00 0.00 175.10 174.67 2bl5 s PRO 9 N 1.45 2.84 0.48 4.82 0.04 -1.26 -4.22 135.00 139.14 2bl5 s PRO 9 Ca -0.05 -0.18 0.18 0.00 0.04 0.00 0.00 61.00 60.99 2bl5 s PRO 9 Cb -0.18 -4.82 1.16 0.00 0.04 0.00 0.00 34.50 30.70 2bl5 s PRO 9 CO -0.07 -2.84 2.04 -0.24 0.04 0.00 0.00 177.00 175.93 2bl5 h VAL 10 N 6.92 0.97 0.00 -0.36 3.04 -1.87 0.13 116.25 125.08 2bl5 h VAL 10 Ca -0.03 -0.53 -0.05 0.00 -1.01 0.00 0.00 66.70 65.09 2bl5 h VAL 10 Cb 1.06 1.30 -0.01 0.00 -2.01 0.00 0.00 31.29 31.62 2bl5 h VAL 10 CO 1.26 0.14 -0.22 0.11 -1.01 0.00 0.00 177.57 177.85 2bl5 h LYS 11 N 0.00 0.00 0.00 4.17 1.79 -1.96 -2.37 116.57 118.20 2bl5 h LYS 11 Ca -0.00 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.29 2bl5 h LYS 11 Cb 0.28 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.91 2bl5 h LYS 11 CO 0.02 0.22 -0.86 0.93 -1.08 0.00 0.00 179.45 178.67 2bl5 h GLU 12 N 0.00 0.00 -2.62 3.15 4.39 -1.14 -3.38 114.58 114.97 2bl5 h GLU 12 Ca -0.00 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.09 2bl5 h GLU 12 Cb 0.60 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 28.84 2bl5 h GLU 12 CO 0.03 0.86 -0.68 0.66 -1.16 0.00 0.00 179.01 178.73 2bl5 n TYR 13 N -3.34 2.51 0.35 4.33 4.02 -0.82 -4.90 117.16 119.31 2bl5 n TYR 13 Ca 0.00 -4.07 0.14 0.00 -0.01 0.00 0.00 57.90 53.97 2bl5 n TYR 13 Cb 0.88 -0.46 0.58 0.00 -0.02 0.00 0.00 39.34 40.32 2bl5 n TYR 13 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2bl5 h PRO 14 N 4.93 0.00 -0.00 -0.72 0.13 -1.72 -1.82 132.00 132.79 2bl5 h PRO 14 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2bl5 h PRO 14 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2bl5 h PRO 14 CO 0.69 0.00 -0.62 -0.25 -0.23 0.00 0.00 178.00 177.59 2bl5 n ASP 15 N -2.56 0.67 -4.06 1.44 9.92 -1.26 -4.73 116.55 115.97 2bl5 n ASP 15 Ca 0.01 -0.48 -0.32 0.00 -0.53 0.00 0.00 54.79 53.47 2bl5 n ASP 15 Cb 0.24 0.44 -0.15 0.00 -0.64 0.00 0.00 41.12 41.02 2bl5 n ASP 15 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2bl5 s PHE 16 N -2.98 3.39 -0.89 1.24 5.36 -0.69 -5.06 117.98 118.36 2bl5 s PHE 16 Ca 0.11 -2.48 -0.24 0.00 -0.96 0.00 0.00 56.93 53.36 2bl5 s PHE 16 Cb 0.17 -2.17 0.05 0.00 -0.34 0.00 0.00 43.02 40.74 2bl5 s PHE 16 CO 0.74 -0.90 1.33 0.54 -1.46 0.00 0.00 175.22 175.47 2bl5 s ASN 17 N 1.06 6.37 0.35 6.13 4.22 -1.26 -4.82 114.94 127.00 2bl5 s ASN 17 Ca -0.04 -1.13 0.03 0.00 -2.14 0.00 0.00 52.86 49.58 2bl5 s ASN 17 Cb -0.20 -2.54 0.67 0.00 1.28 0.00 0.00 41.25 40.46 2bl5 s ASN 17 CO -0.06 -1.58 2.00 -0.26 -2.04 0.00 0.00 177.10 175.16 2bl5 h PHE 18 N 9.78 0.79 0.07 1.54 0.04 -1.95 0.36 116.94 127.55 2bl5 h PHE 18 Ca -0.00 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 2bl5 h PHE 18 Cb 1.03 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.92 2bl5 h PHE 18 CO 1.20 0.48 -0.03 -0.39 -0.60 0.00 0.00 178.31 178.96 2bl5 h VAL 19 N 0.83 1.17 0.00 -0.55 -1.51 -1.92 0.42 116.25 114.69 2bl5 h VAL 19 Ca 0.25 -0.83 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 2bl5 h VAL 19 Cb -0.01 1.71 0.00 0.00 -2.13 0.00 0.00 31.29 30.86 2bl5 h VAL 19 CO -0.06 0.21 0.00 1.23 -1.23 0.00 0.00 177.57 177.71 2bl5 h GLY 20 N -0.46 0.00 0.57 5.19 0.00 -1.81 0.29 103.07 106.84 2bl5 h GLY 20 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.96 2bl5 h GLY 20 CO 0.01 0.00 -2.00 -2.13 0.00 0.00 0.00 176.54 172.42 2bl5 n ARG 21 N -2.34 0.75 -0.09 4.80 3.00 0.12 -3.79 116.66 119.12 2bl5 n ARG 21 Ca -0.01 0.26 -0.14 0.00 -0.00 0.00 0.00 57.85 57.97 2bl5 n ARG 21 Cb 0.08 -1.70 -0.07 0.00 0.00 0.00 0.00 32.46 30.77 2bl5 n ARG 21 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2bl5 h ILE 22 N 0.04 0.50 0.00 5.15 1.08 0.73 -3.42 117.51 121.59 2bl5 h ILE 22 Ca -0.43 -1.63 -0.02 0.00 -0.39 0.00 0.00 64.86 62.39 2bl5 h ILE 22 Cb 2.01 1.20 -0.00 0.00 -3.07 0.00 0.00 36.82 36.96 2bl5 h ILE 22 CO 0.07 0.17 -1.89 0.00 -0.69 0.00 0.00 178.15 175.81 2bl5 n LEU 23 N -4.52 0.00 0.00 1.44 -0.00 0.79 -3.37 117.00 111.34 2bl5 n LEU 23 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.81 2bl5 n LEU 23 Cb 0.48 0.02 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 2bl5 n LEU 23 CO 0.15 0.02 0.18 0.61 -0.00 0.00 0.00 177.39 178.36 2bl5 n GLY 24 N 1.44 -2.76 0.10 1.47 0.00 0.09 -1.19 105.19 104.33 2bl5 n GLY 24 Ca -0.05 0.40 0.02 0.00 0.00 0.00 0.00 46.02 46.39 2bl5 n GLY 24 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2bl5 n PRO 25 N -0.63 0.62 -1.04 1.61 -0.04 -1.26 -4.43 135.00 129.84 2bl5 n PRO 25 Ca 0.00 0.19 -0.04 0.00 -0.04 0.00 0.00 63.50 63.61 2bl5 n PRO 25 Cb 0.00 -1.80 0.15 0.00 -0.04 0.00 0.00 33.50 31.81 2bl5 n PRO 25 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2bl5 n ARG 26 N -2.84 2.21 0.18 0.54 1.85 -1.25 -4.69 116.66 112.67 2bl5 n ARG 26 Ca -0.09 -3.55 0.10 0.00 -1.00 0.00 0.00 57.85 53.31 2bl5 n ARG 26 Cb 0.80 -1.84 0.55 0.00 -1.05 0.00 0.00 32.46 30.92 2bl5 n ARG 26 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2bl5 h GLY 27 N 1.36 0.00 0.66 2.89 0.00 -1.16 -0.14 103.07 106.68 2bl5 h GLY 27 Ca 0.13 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.64 2bl5 h GLY 27 CO 0.27 0.00 0.49 1.41 0.00 0.00 0.00 176.54 178.72 2bl5 h LEU 28 N 0.00 0.20 -0.68 3.11 -0.00 -1.84 -1.41 115.31 114.70 2bl5 h LEU 28 Ca 0.00 0.01 -0.00 0.00 -0.00 0.00 0.00 57.88 57.89 2bl5 h LEU 28 Cb 0.27 -0.03 -0.03 0.00 -0.00 0.00 0.00 40.66 40.87 2bl5 h LEU 28 CO 0.00 0.10 0.41 0.00 -0.00 0.00 0.00 178.44 178.95 2bl5 h THR 29 N 0.21 1.19 -0.75 0.22 1.03 -1.33 0.21 112.91 113.69 2bl5 h THR 29 Ca 0.35 -0.42 -0.06 0.00 -0.01 0.00 0.00 66.41 66.27 2bl5 h THR 29 Cb 1.06 0.25 -0.03 0.00 -1.07 0.00 0.00 68.15 68.36 2bl5 h THR 29 CO -0.07 0.20 0.25 0.00 -0.01 0.00 0.00 175.52 175.88 2bl5 h ALA 30 N 1.22 1.01 -0.68 0.00 0.00 -1.46 -0.90 119.26 118.45 2bl5 h ALA 30 Ca 0.24 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2bl5 h ALA 30 Cb -0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 2bl5 h ALA 30 CO -0.05 0.67 0.14 0.87 0.00 0.00 0.00 179.25 180.88 2bl5 h LYS 31 N 1.12 1.10 -0.31 0.00 1.57 -1.17 -2.71 116.57 116.16 2bl5 h LYS 31 Ca 0.24 -0.27 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2bl5 h LYS 31 Cb 0.29 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2bl5 h LYS 31 CO -0.01 0.98 -0.24 1.96 -0.57 0.00 0.00 179.45 181.58 2bl5 h GLN 32 N 1.03 0.60 -0.40 3.15 1.08 0.16 -1.64 115.11 119.09 2bl5 h GLN 32 Ca 0.21 -0.23 -0.08 0.00 -1.45 0.00 0.00 58.65 57.10 2bl5 h GLN 32 Cb 0.40 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 2bl5 h GLN 32 CO 0.01 0.79 -0.05 -0.07 -0.95 0.00 0.00 178.83 178.56 2bl5 h LEU 33 N 0.53 0.73 -0.41 1.46 3.38 -0.96 0.55 115.31 120.59 2bl5 h LEU 33 Ca 0.08 -0.34 -0.16 0.00 0.09 0.00 0.00 57.88 57.55 2bl5 h LEU 33 Cb 0.69 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2bl5 h LEU 33 CO 0.05 0.90 -0.41 1.05 0.09 0.00 0.00 178.44 180.12 2bl5 h GLU 34 N 0.56 0.89 -0.58 1.13 4.11 -1.17 0.62 114.58 120.14 2bl5 h GLU 34 Ca 0.11 -0.48 -0.10 0.00 0.07 0.00 0.00 59.36 58.95 2bl5 h GLU 34 Cb 0.55 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 2bl5 h GLU 34 CO 0.03 1.13 -0.05 0.00 0.07 0.00 0.00 179.01 180.19 2bl5 h ALA 35 N 0.80 0.79 0.01 1.06 0.00 -1.14 -1.52 119.26 119.26 2bl5 h ALA 35 Ca 0.05 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 2bl5 h ALA 35 Cb 1.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2bl5 h ALA 35 CO 0.10 0.66 -0.37 0.93 0.00 0.00 0.00 179.25 180.58 2bl5 h GLU 36 N 0.95 0.01 0.00 0.00 4.39 0.25 -3.39 114.58 116.79 2bl5 h GLU 36 Ca 0.16 -0.02 -0.20 0.00 0.34 0.00 0.00 59.36 59.64 2bl5 h GLU 36 Cb 0.61 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 2bl5 h GLU 36 CO 0.04 1.01 -1.53 0.25 -1.16 0.00 0.00 179.01 177.62 2bl5 n THR 37 N -4.54 1.24 -0.30 1.13 -2.24 0.21 -4.94 114.28 104.85 2bl5 n THR 37 Ca -0.16 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.91 2bl5 n THR 37 Cb 0.55 -0.76 0.00 0.00 -2.10 0.00 0.00 70.33 68.02 2bl5 n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bl5 n GLY 38 N 1.44 1.02 3.60 3.38 0.00 -0.57 -4.77 105.19 109.29 2bl5 n GLY 38 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 2bl5 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bl5 s LYS 40 N 2.02 3.40 -0.38 0.00 -2.85 -0.03 -2.45 119.74 119.46 2bl5 s LYS 40 Ca 0.14 -0.91 -0.29 0.00 -1.00 0.00 0.00 55.97 53.90 2bl5 s LYS 40 Cb -0.16 -4.78 0.01 0.00 -2.06 0.00 0.00 37.83 30.85 2bl5 s LYS 40 CO 0.10 -2.07 1.24 -1.50 0.10 0.00 0.00 175.35 173.22 2bl5 s ILE 41 N 4.73 4.17 -0.16 3.79 2.07 -1.26 -2.26 121.20 132.28 2bl5 s ILE 41 Ca 0.37 1.27 -0.06 0.00 -1.41 0.00 0.00 60.65 60.82 2bl5 s ILE 41 Cb -0.06 -4.34 -0.04 0.00 0.13 0.00 0.00 42.46 38.15 2bl5 s ILE 41 CO 0.00 -0.69 0.04 0.00 -1.91 0.00 0.00 174.94 172.39 2bl5 s MET 42 N 4.32 3.79 -0.20 3.50 0.23 0.27 -4.89 119.30 126.33 2bl5 s MET 42 Ca 0.53 -0.36 -0.27 0.00 -1.03 0.00 0.00 55.69 54.56 2bl5 s MET 42 Cb -0.12 -3.12 -0.00 0.00 -1.53 0.00 0.00 34.83 30.05 2bl5 s MET 42 CO 0.26 0.35 0.92 0.08 -2.03 0.00 0.00 175.02 174.60 2bl5 s VAL 43 N 0.14 4.79 0.55 5.16 1.01 -1.26 -0.27 120.40 130.52 2bl5 s VAL 43 Ca 0.04 1.80 0.05 0.00 0.00 0.00 0.00 61.98 63.87 2bl5 s VAL 43 Cb -0.12 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 32.08 2bl5 s VAL 43 CO 0.01 -0.07 0.39 -0.13 0.00 0.00 0.00 175.10 175.29 2bl5 s ARG 44 N 2.67 2.24 0.50 2.72 0.52 0.21 -4.69 118.95 123.11 2bl5 s ARG 44 Ca 0.41 -2.06 0.00 0.00 -0.52 0.00 0.00 55.73 53.55 2bl5 s ARG 44 Cb -0.16 -2.06 0.00 0.00 0.52 0.00 0.00 34.95 33.25 2bl5 s ARG 44 CO 0.10 -0.63 0.00 0.41 0.02 0.00 0.00 175.30 175.19 2bl5 n GLY 45 N -1.76 -1.87 3.61 -3.53 0.00 -0.50 -0.57 105.19 100.56 2bl5 n GLY 45 Ca -0.03 -1.76 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 2bl5 n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bl5 s LYS 46 N 0.00 3.91 0.00 1.61 -2.85 -1.18 -3.66 119.74 117.58 2bl5 s LYS 46 Ca 0.00 0.54 0.00 0.00 -1.00 0.00 0.00 55.97 55.51 2bl5 s LYS 46 Cb 0.00 -3.75 0.00 0.00 -2.06 0.00 0.00 37.83 32.02 2bl5 s LYS 46 CO 0.00 -0.73 0.00 0.41 0.10 0.00 0.00 175.35 175.13 2bl5 n GLY 47 N 4.27 1.26 0.27 0.59 0.00 -1.26 -4.76 105.19 105.56 2bl5 n GLY 47 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 2bl5 n GLY 47 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bl5 h SER 48 N 0.00 -0.56 -0.02 1.61 4.64 -1.84 -3.37 113.55 114.01 2bl5 h SER 48 Ca 0.00 0.02 -0.06 0.00 -0.47 0.00 0.00 61.79 61.28 2bl5 h SER 48 Cb 0.00 0.14 -0.12 0.00 -0.31 0.00 0.00 62.40 62.12 2bl5 h SER 48 CO 0.00 -0.28 -0.66 0.23 -0.87 0.00 0.00 176.83 175.25 2bl5 n MET 49 N -4.47 1.18 0.00 4.77 2.81 -1.26 -4.86 117.12 115.29 2bl5 n MET 49 Ca -0.08 -2.96 0.00 0.00 -1.81 0.00 0.00 57.70 52.85 2bl5 n MET 49 Cb 0.26 -1.18 0.00 0.00 -0.71 0.00 0.00 33.22 31.59 2bl5 n MET 49 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 2bl5 n ARG 50 N -0.66 1.00 -1.54 0.03 1.85 -1.26 -4.66 116.66 111.42 2bl5 n ARG 50 Ca 0.16 0.00 -0.40 0.00 -1.00 0.00 0.00 57.85 56.61 2bl5 n ARG 50 Cb 0.82 -1.12 0.03 0.00 -1.05 0.00 0.00 32.46 31.14 2bl5 n ARG 50 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 2bl5 n ASP 51 N 0.38 0.11 -0.31 2.89 2.03 -1.26 -4.46 116.55 115.92 2bl5 n ASP 51 Ca 0.00 0.88 0.09 0.00 0.52 0.00 0.00 54.79 56.28 2bl5 n ASP 51 Cb 0.44 -1.26 0.25 0.00 -0.72 0.00 0.00 41.12 39.82 2bl5 n ASP 51 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2bl5 h LYS 52 N 0.82 0.65 -0.10 -0.67 1.57 -1.99 0.20 116.57 117.06 2bl5 h LYS 52 Ca -0.45 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.28 2bl5 h LYS 52 Cb 1.37 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.53 2bl5 h LYS 52 CO 0.52 0.43 0.01 1.57 -0.57 0.00 0.00 179.45 181.41 2bl5 h LYS 53 N 0.67 0.16 -0.61 3.15 2.10 -1.96 -2.78 116.57 117.31 2bl5 h LYS 53 Ca 0.49 -0.05 0.02 0.00 -2.00 0.00 0.00 60.65 59.12 2bl5 h LYS 53 Cb 0.71 -0.02 -0.04 0.00 -0.90 0.00 0.00 32.23 31.98 2bl5 h LYS 53 CO -0.36 0.39 0.38 0.87 -2.00 0.00 0.00 179.45 178.73 2bl5 h LYS 54 N -0.09 0.73 0.00 0.07 1.57 -0.98 0.22 116.57 118.09 2bl5 h LYS 54 Ca 0.03 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2bl5 h LYS 54 Cb 0.31 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 2bl5 h LYS 54 CO 0.00 0.48 -0.02 1.05 -0.57 0.00 0.00 179.45 180.40 2bl5 h GLU 55 N 0.75 0.00 0.00 3.15 4.11 -1.04 0.53 114.58 122.08 2bl5 h GLU 55 Ca 0.24 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.67 2bl5 h GLU 55 Cb 0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 2bl5 h GLU 55 CO -0.09 0.02 -0.02 0.93 0.07 0.00 0.00 179.01 179.91 2bl5 h GLU 56 N 0.00 0.00 0.00 1.06 5.08 -0.31 -3.37 114.58 117.04 2bl5 h GLU 56 Ca -0.00 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.08 2bl5 h GLU 56 Cb 0.10 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 2bl5 h GLU 56 CO 0.00 0.13 -2.05 0.00 -1.00 0.00 0.00 179.01 176.09 2bl5 n GLN 57 N -4.75 1.17 -0.12 2.33 0.00 -0.58 -4.27 117.38 111.17 2bl5 n GLN 57 Ca -0.02 0.03 0.05 0.00 0.00 0.00 0.00 57.00 57.07 2bl5 n GLN 57 Cb 0.07 -1.38 0.15 0.00 0.00 0.00 0.00 30.24 29.07 2bl5 n GLN 57 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2bl5 n ASN 58 N -2.73 1.29 -4.61 2.61 5.03 0.12 -4.91 115.26 112.05 2bl5 n ASN 58 Ca -0.28 -1.95 -0.46 0.00 0.87 0.00 0.00 54.58 52.76 2bl5 n ASN 58 Cb 0.94 -0.15 -0.03 0.00 -1.02 0.00 0.00 39.78 39.52 2bl5 n ASN 58 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32 2bl5 n ARG 59 N 0.19 1.47 -0.11 3.52 1.85 0.14 -1.79 116.66 121.94 2bl5 n ARG 59 Ca 0.09 0.52 0.00 0.00 -1.00 0.00 0.00 57.85 57.46 2bl5 n ARG 59 Cb 0.21 -2.03 0.00 0.00 -1.05 0.00 0.00 32.46 29.60 2bl5 n ARG 59 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2bl5 n GLY 60 N 1.78 1.83 3.83 2.89 0.00 -1.26 -5.04 105.19 109.22 2bl5 n GLY 60 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2bl5 n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bl5 s LYS 61 N -0.33 1.87 0.18 1.61 -0.14 -0.74 -4.35 119.74 117.84 2bl5 s LYS 61 Ca 0.00 0.38 0.14 0.00 -1.36 0.00 0.00 55.97 55.12 2bl5 s LYS 61 Cb 0.00 -1.92 0.58 0.00 -1.68 0.00 0.00 37.83 34.81 2bl5 s LYS 61 CO 0.00 -1.71 0.58 -2.30 -0.76 0.00 0.00 175.35 171.16 2bl5 n PRO 62 N -3.45 -0.01 -0.08 -1.68 -0.02 -1.26 0.12 135.00 128.63 2bl5 n PRO 62 Ca 0.07 0.45 -0.04 0.00 -2.02 0.00 0.00 63.50 61.96 2bl5 n PRO 62 Cb 0.58 -0.93 0.17 0.00 -0.02 0.00 0.00 33.50 33.31 2bl5 n PRO 62 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2bl5 h ASN 63 N 0.00 0.70 0.63 2.55 2.35 -1.90 -0.55 115.58 119.35 2bl5 h ASN 63 Ca 0.33 -0.18 -0.15 0.00 -0.55 0.00 0.00 56.30 55.75 2bl5 h ASN 63 Cb 1.15 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 39.31 2bl5 h ASN 63 CO -0.13 0.81 -1.49 0.79 -1.65 0.00 0.00 177.43 175.76 2bl5 n TRP 64 N -4.19 0.84 -0.18 1.19 7.02 0.33 -1.72 117.44 120.72 2bl5 n TRP 64 Ca 0.02 0.27 -0.01 0.00 -1.02 0.00 0.00 57.50 56.76 2bl5 n TRP 64 Cb 0.33 -1.02 0.08 0.00 -2.42 0.00 0.00 31.31 28.27 2bl5 n TRP 64 CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 2bl5 h GLU 65 N 0.00 0.13 -0.06 -0.99 4.81 -0.47 -2.02 114.58 115.99 2bl5 h GLU 65 Ca -0.16 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2bl5 h GLU 65 Cb 1.52 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.88 2bl5 h GLU 65 CO 0.04 0.09 0.00 -2.39 -0.73 0.00 0.00 179.01 176.01 2bl5 n HIS 66 N -5.24 0.04 0.30 0.92 1.44 -0.28 -4.38 115.22 108.02 2bl5 n HIS 66 Ca 0.07 -0.02 0.18 0.00 -2.01 0.00 0.00 57.72 55.95 2bl5 n HIS 66 Cb 0.30 -0.00 0.89 0.00 0.12 0.00 0.00 29.99 31.31 2bl5 n HIS 66 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2bl5 h LEU 67 N 4.64 0.00 -0.78 2.39 5.85 -0.55 -0.37 115.31 126.48 2bl5 h LEU 67 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2bl5 h LEU 67 Cb 0.99 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2bl5 h LEU 67 CO 0.00 0.03 0.00 -0.46 -0.34 0.00 0.00 178.44 177.67 2bl5 n ASN 68 N -3.19 1.20 -4.99 1.25 0.23 -1.24 -3.47 115.26 105.04 2bl5 n ASN 68 Ca -0.01 -1.45 -0.19 0.00 -0.53 0.00 0.00 54.58 52.40 2bl5 n ASN 68 Cb 0.21 -0.02 0.02 0.00 -2.08 0.00 0.00 39.78 37.91 2bl5 n ASN 68 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2bl5 s GLU 69 N -1.96 2.71 0.34 -3.83 2.02 -0.27 -5.03 118.70 112.68 2bl5 s GLU 69 Ca 0.38 -1.07 -0.25 0.00 0.02 0.00 0.00 54.97 54.05 2bl5 s GLU 69 Cb 0.20 -2.65 -0.10 0.00 0.10 0.00 0.00 34.13 31.68 2bl5 s GLU 69 CO 0.32 -0.45 0.94 0.34 0.02 0.00 0.00 175.26 176.43 2bl5 s ASP 70 N -4.38 7.27 -0.21 -0.19 -1.08 -1.26 -3.07 116.67 113.74 2bl5 s ASP 70 Ca 0.56 1.80 -0.36 0.00 -0.52 0.00 0.00 52.55 54.03 2bl5 s ASP 70 Cb -0.10 -2.57 -0.12 0.00 -1.46 0.00 0.00 42.92 38.67 2bl5 s ASP 70 CO 0.35 -0.11 1.94 -0.11 0.52 0.00 0.00 175.17 177.76 2bl5 n LEU 71 N 0.39 2.83 -4.01 -1.34 0.00 -1.26 -3.67 117.00 109.94 2bl5 n LEU 71 Ca 0.03 0.83 -0.10 0.00 0.00 0.00 0.00 56.01 56.77 2bl5 n LEU 71 Cb 0.51 -1.29 -0.07 0.00 0.00 0.00 0.00 43.42 42.57 2bl5 n LEU 71 CO 0.43 -0.35 -0.02 -1.38 0.00 0.00 0.00 177.39 176.07 2bl5 s HIS 72 N 4.94 0.51 -0.20 1.96 -3.43 0.26 -2.25 115.29 117.09 2bl5 s HIS 72 Ca 0.99 -0.86 -0.06 0.00 -0.80 0.00 0.00 55.06 54.33 2bl5 s HIS 72 Cb -0.82 -0.09 -0.03 0.00 -1.43 0.00 0.00 32.58 30.20 2bl5 s HIS 72 CO 0.54 -0.76 0.04 0.14 -2.00 0.00 0.00 174.74 172.71 2bl5 s VAL 73 N -4.01 4.37 -0.19 -5.38 -7.23 -0.61 0.63 120.40 107.99 2bl5 s VAL 73 Ca 0.21 -0.17 0.01 0.00 -1.81 0.00 0.00 61.98 60.22 2bl5 s VAL 73 Cb 0.03 -2.98 0.04 0.00 0.56 0.00 0.00 36.38 34.03 2bl5 s VAL 73 CO 0.03 0.43 -0.11 -0.22 -0.31 0.00 0.00 175.10 174.92 2bl5 s LEU 74 N 0.82 2.14 -0.48 1.32 0.20 0.63 -0.08 118.68 123.23 2bl5 s LEU 74 Ca 0.02 -0.80 -0.27 0.00 0.69 0.00 0.00 54.13 53.77 2bl5 s LEU 74 Cb -0.14 -1.21 0.03 0.00 -0.43 0.00 0.00 46.19 44.44 2bl5 s LEU 74 CO 0.02 -0.13 1.05 0.27 -0.29 0.00 0.00 176.35 177.28 2bl5 s ILE 75 N 1.42 4.30 -0.35 6.68 -4.36 -0.24 0.97 121.20 129.62 2bl5 s ILE 75 Ca 0.00 1.00 -0.12 0.00 -0.26 0.00 0.00 60.65 61.27 2bl5 s ILE 75 Cb -0.15 -4.54 0.01 0.00 1.25 0.00 0.00 42.46 39.02 2bl5 s ILE 75 CO -0.09 -0.96 0.21 -0.89 0.24 0.00 0.00 174.94 173.45 2bl5 s THR 76 N 4.20 4.84 -0.15 8.37 2.01 -0.96 -1.61 115.64 132.34 2bl5 s THR 76 Ca 0.43 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.88 2bl5 s THR 76 Cb -0.08 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.84 2bl5 s THR 76 CO 0.29 -0.11 -0.17 0.54 -0.69 0.00 0.00 174.62 174.48 2bl5 s VAL 77 N 1.63 2.50 -0.87 3.82 0.11 -0.03 -0.85 120.40 126.70 2bl5 s VAL 77 Ca 0.04 -0.83 -0.15 0.00 -2.93 0.00 0.00 61.98 58.11 2bl5 s VAL 77 Cb -0.18 -2.04 0.20 0.00 -1.53 0.00 0.00 36.38 32.83 2bl5 s VAL 77 CO 0.08 0.52 0.88 -1.61 -3.33 0.00 0.00 175.10 171.64 2bl5 s GLU 78 N 0.81 3.63 0.00 1.54 2.02 -1.26 -1.23 118.70 124.21 2bl5 s GLU 78 Ca -0.06 -2.31 0.00 0.00 0.02 0.00 0.00 54.97 52.62 2bl5 s GLU 78 Cb -0.15 -4.57 0.00 0.00 0.10 0.00 0.00 34.13 29.51 2bl5 s GLU 78 CO -0.00 -1.42 0.00 -3.47 0.02 0.00 0.00 175.26 170.39 2bl5 n ASP 79 N 4.60 0.00 -0.19 -0.19 -0.08 -1.26 -5.03 116.55 114.40 2bl5 n ASP 79 Ca 0.17 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.56 2bl5 n ASP 79 Cb 0.47 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.87 2bl5 n ASP 79 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2bl5 n ALA 80 N -0.59 4.28 -1.88 -1.67 0.00 -1.26 -4.63 120.51 114.76 2bl5 n ALA 80 Ca 0.00 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 52.41 2bl5 n ALA 80 Cb 0.00 -0.79 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 2bl5 n ALA 80 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2bl5 s GLN 81 N -2.80 4.22 0.41 0.00 -0.21 -1.26 -4.90 119.66 115.12 2bl5 s GLN 81 Ca 0.12 2.38 0.10 0.00 0.02 0.00 0.00 55.36 57.98 2bl5 s GLN 81 Cb 0.17 -3.11 0.86 0.00 1.00 0.00 0.00 33.01 31.93 2bl5 s GLN 81 CO 0.75 -0.54 1.98 -0.91 -2.12 0.00 0.00 175.29 174.45 2bl5 h ASN 82 N 5.77 0.25 -0.86 5.90 4.21 -2.00 -1.57 115.58 127.29 2bl5 h ASN 82 Ca -0.45 -0.03 0.07 0.00 1.21 0.00 0.00 56.30 57.10 2bl5 h ASN 82 Cb 1.21 -0.06 -0.07 0.00 -1.12 0.00 0.00 38.32 38.28 2bl5 h ASN 82 CO 0.84 0.32 0.52 -0.09 -1.29 0.00 0.00 177.43 177.74 2bl5 h ARG 83 N 0.27 0.90 0.42 0.81 2.43 -1.98 0.94 114.38 118.16 2bl5 h ARG 83 Ca 0.06 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2bl5 h ARG 83 Cb 0.23 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2bl5 h ARG 83 CO 0.01 0.59 -0.20 0.00 -1.51 0.00 0.00 179.97 178.86 2bl5 h ALA 84 N 1.43 -0.57 -0.17 2.80 0.00 -1.59 -0.45 119.26 120.71 2bl5 h ALA 84 Ca 0.39 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 2bl5 h ALA 84 Cb 0.25 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2bl5 h ALA 84 CO -0.20 -0.79 -0.29 1.05 0.00 0.00 0.00 179.25 179.03 2bl5 h GLU 85 N -0.63 0.32 -0.57 0.00 4.11 -1.34 -1.24 114.58 115.23 2bl5 h GLU 85 Ca -0.06 -0.12 -0.05 0.00 0.07 0.00 0.00 59.36 59.20 2bl5 h GLU 85 Cb 0.47 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2bl5 h GLU 85 CO 0.10 0.59 0.15 1.25 0.07 0.00 0.00 179.01 181.16 2bl5 h LEU 86 N 0.29 0.85 -0.35 3.06 7.12 -0.62 0.66 115.31 126.32 2bl5 h LEU 86 Ca 0.04 -0.23 -0.14 0.00 0.13 0.00 0.00 57.88 57.69 2bl5 h LEU 86 Cb 0.66 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.56 2bl5 h LEU 86 CO 0.05 0.86 -0.31 0.50 -0.13 0.00 0.00 178.44 179.40 2bl5 h LYS 87 N 0.81 0.83 -0.24 1.25 3.64 -0.73 -2.75 116.57 119.38 2bl5 h LYS 87 Ca 0.18 -0.42 -0.15 0.00 -1.27 0.00 0.00 60.65 58.98 2bl5 h LYS 87 Cb 0.33 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2bl5 h LYS 87 CO 0.00 1.06 -0.48 1.37 -2.27 0.00 0.00 179.45 179.13 2bl5 h LEU 88 N 0.62 0.70 -0.77 5.20 8.10 -1.09 -2.71 115.31 125.37 2bl5 h LEU 88 Ca 0.06 -0.35 -0.11 0.00 0.11 0.00 0.00 57.88 57.59 2bl5 h LEU 88 Cb 0.89 -0.20 -0.01 0.00 -0.44 0.00 0.00 40.66 40.90 2bl5 h LEU 88 CO 0.08 1.07 -0.25 0.07 -4.11 0.00 0.00 178.44 175.30 2bl5 h LYS 89 N 0.51 0.65 -0.33 0.17 5.09 -0.80 0.38 116.57 122.25 2bl5 h LYS 89 Ca 0.03 -0.26 -0.17 0.00 0.09 0.00 0.00 60.65 60.34 2bl5 h LYS 89 Cb 1.02 -0.03 -0.00 0.00 0.10 0.00 0.00 32.23 33.32 2bl5 h LYS 89 CO 0.10 0.84 -0.45 0.07 -2.09 0.00 0.00 179.45 177.91 2bl5 h ARG 90 N 0.57 0.88 -0.45 0.07 0.11 -1.50 0.03 114.38 114.09 2bl5 h ARG 90 Ca 0.08 -0.51 -0.10 0.00 0.10 0.00 0.00 59.98 59.54 2bl5 h ARG 90 Cb 0.73 0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.84 2bl5 h ARG 90 CO 0.06 1.16 -0.11 0.00 0.10 0.00 0.00 179.97 181.17 2bl5 h ALA 91 N 0.72 0.62 0.00 0.08 0.00 -1.16 -2.57 119.26 116.95 2bl5 h ALA 91 Ca 0.04 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.49 2bl5 h ALA 91 Cb 1.05 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2bl5 h ALA 91 CO 0.11 0.52 -0.57 -0.24 0.00 0.00 0.00 179.25 179.06 2bl5 h VAL 92 N 0.71 1.26 -0.00 0.00 3.04 -0.21 -2.31 116.25 118.73 2bl5 h VAL 92 Ca 0.11 -2.06 -0.06 0.00 -1.01 0.00 0.00 66.70 63.68 2bl5 h VAL 92 Cb 0.66 2.16 -0.01 0.00 -2.01 0.00 0.00 31.29 32.09 2bl5 h VAL 92 CO 0.05 0.56 -0.30 -0.33 -1.01 0.00 0.00 177.57 176.54 2bl5 h GLU 93 N 0.00 0.01 -0.42 4.17 5.08 -0.82 0.40 114.58 123.00 2bl5 h GLU 93 Ca -0.01 -0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 2bl5 h GLU 93 Cb 1.12 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 2bl5 h GLU 93 CO 0.07 0.31 -0.03 0.93 -1.00 0.00 0.00 179.01 179.29 2bl5 h GLU 94 N 0.01 0.70 -0.80 2.33 5.08 -1.02 -1.51 114.58 119.36 2bl5 h GLU 94 Ca -0.00 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 2bl5 h GLU 94 Cb 0.53 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 2bl5 h GLU 94 CO 0.04 0.74 0.37 0.28 -1.00 0.00 0.00 179.01 179.44 2bl5 h VAL 95 N 0.65 1.25 -0.52 3.13 2.07 -0.75 -1.98 116.25 120.10 2bl5 h VAL 95 Ca 0.13 -0.73 0.15 0.00 0.82 0.00 0.00 66.70 67.06 2bl5 h VAL 95 Cb 0.45 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2bl5 h VAL 95 CO 0.02 0.31 0.37 0.50 0.02 0.00 0.00 177.57 178.79 2bl5 h LYS 96 N 1.15 0.01 -0.02 1.57 3.64 0.67 1.09 116.57 124.68 2bl5 h LYS 96 Ca 0.27 -0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.49 2bl5 h LYS 96 Cb 0.14 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 2bl5 h LYS 96 CO -0.03 0.01 -0.75 -0.22 -2.27 0.00 0.00 179.45 176.19 2bl5 h LYS 97 N 0.01 0.13 0.15 1.90 3.11 -0.58 -3.33 116.57 117.96 2bl5 h LYS 97 Ca 0.25 -0.11 -0.30 0.00 -2.81 0.00 0.00 60.65 57.67 2bl5 h LYS 97 Cb 0.97 0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.23 2bl5 h LYS 97 CO -0.01 0.81 -1.49 -0.07 -2.81 0.00 0.00 179.45 175.89 2bl5 h LEU 98 N 0.08 0.49 0.00 5.20 3.38 0.19 -3.36 115.31 121.29 2bl5 h LEU 98 Ca -0.02 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.06 2bl5 h LEU 98 Cb 1.32 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2bl5 h LEU 98 CO 0.11 1.67 0.00 0.00 0.09 0.00 0.00 178.44 180.31 2bl5 n LEU 99 N -3.82 0.00 -4.72 1.67 -0.00 0.33 -4.66 117.00 105.81 2bl5 n LEU 99 Ca -0.24 0.00 -0.40 0.00 -0.00 0.00 0.00 56.01 55.37 2bl5 n LEU 99 Cb 0.96 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 44.34 2bl5 n LEU 99 CO 0.46 0.00 0.39 0.54 -0.00 0.00 0.00 177.39 178.78 2bl5 s VAL 100 N -2.00 5.05 -1.12 1.47 0.11 -1.25 -4.93 120.40 117.73 2bl5 s VAL 100 Ca 0.09 1.44 0.05 0.00 -2.93 0.00 0.00 61.98 60.63 2bl5 s VAL 100 Cb 0.04 -4.04 0.06 0.00 -1.53 0.00 0.00 36.38 30.91 2bl5 s VAL 100 CO 0.07 0.25 1.12 -0.81 -3.33 0.00 0.00 175.10 172.41 2bl5 n PRO 101 N 3.78 0.02 0.00 1.54 -0.04 -1.26 -4.85 135.00 134.18 2bl5 n PRO 101 Ca -0.01 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 2bl5 n PRO 101 Cb 0.51 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2bl5 n PRO 101 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bl5 n ALA 102 N -1.44 0.00 -3.03 0.55 0.00 -1.26 -4.73 120.51 110.60 2bl5 n ALA 102 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.01 2bl5 n ALA 102 Cb 0.06 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.47 2bl5 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bl5 s ALA 103 N 0.00 3.40 -0.06 0.00 0.00 -1.26 -4.99 121.76 118.85 2bl5 s ALA 103 Ca 0.00 -2.37 -0.16 0.00 0.00 0.00 0.00 51.96 49.43 2bl5 s ALA 103 Cb 0.00 -3.73 0.03 0.00 0.00 0.00 0.00 23.12 19.42 2bl5 s ALA 103 CO 0.00 -2.59 0.37 -2.00 0.00 0.00 0.00 175.76 171.53 2bl5 s GLU 104 N 2.77 0.63 -0.32 0.00 -6.30 -1.26 -5.07 118.70 109.15 2bl5 s GLU 104 Ca 0.20 0.08 0.17 0.00 -2.50 0.00 0.00 54.97 52.91 2bl5 s GLU 104 Cb -0.17 0.29 0.45 0.00 0.00 0.00 0.00 34.13 34.70 2bl5 s GLU 104 CO 0.02 -0.16 1.24 0.41 0.02 0.00 0.00 175.26 176.79 2bl5 n GLY 105 N 1.75 1.70 1.51 -1.50 0.00 -1.26 -4.96 105.19 102.43 2bl5 n GLY 105 Ca -0.19 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2bl5 n GLY 105 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bl5 n GLU 106 N -0.73 0.00 -0.01 1.61 -0.58 -1.26 -4.93 120.64 114.74 2bl5 n GLU 106 Ca -0.01 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.65 2bl5 n GLU 106 Cb 0.84 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.64 2bl5 n GLU 106 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2bl5 h ASP 107 N 0.00 -0.08 0.20 1.62 1.82 -1.97 -2.37 116.42 115.65 2bl5 h ASP 107 Ca 0.00 -0.42 -0.02 0.00 -0.39 0.00 0.00 57.03 56.20 2bl5 h ASP 107 Cb 0.00 0.02 -0.00 0.00 0.68 0.00 0.00 39.33 40.03 2bl5 h ASP 107 CO 0.00 0.59 -0.11 -1.28 -1.61 0.00 0.00 179.24 176.84 2bl5 h SER 108 N -0.96 0.00 0.06 2.28 0.87 -1.94 0.52 113.55 114.37 2bl5 h SER 108 Ca -0.01 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2bl5 h SER 108 Cb 0.49 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 2bl5 h SER 108 CO 0.01 0.11 -0.03 -0.07 -0.53 0.00 0.00 176.83 176.32 2bl5 h LEU 109 N 0.00 -0.06 0.00 2.23 3.38 -1.92 -2.96 115.31 115.97 2bl5 h LEU 109 Ca -0.00 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2bl5 h LEU 109 Cb 0.24 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2bl5 h LEU 109 CO 0.01 0.63 -0.27 0.50 0.09 0.00 0.00 178.44 179.40 2bl5 h LYS 110 N -0.95 0.00 0.03 1.13 3.64 -1.27 -3.36 116.57 115.79 2bl5 h LYS 110 Ca -0.01 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2bl5 h LYS 110 Cb 0.54 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 2bl5 h LYS 110 CO 0.01 0.00 -0.02 -0.22 -2.27 0.00 0.00 179.45 176.96 2bl5 h LYS 111 N -0.60 -0.05 0.00 1.90 3.64 -1.21 -3.25 116.57 117.01 2bl5 h LYS 111 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2bl5 h LYS 111 Cb 0.27 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2bl5 h LYS 111 CO 0.00 0.62 0.00 1.98 -2.27 0.00 0.00 179.45 179.78 2bl5 h MET 112 N -0.81 0.00 -0.60 1.90 4.05 -0.23 -3.25 114.93 116.00 2bl5 h MET 112 Ca -0.00 0.00 0.05 0.00 -0.28 0.00 0.00 59.70 59.46 2bl5 h MET 112 Cb 0.69 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.45 2bl5 h MET 112 CO 0.01 0.00 0.40 -0.22 0.23 0.00 0.00 176.91 177.32 2bl5 h LYS 113 N 0.00 0.62 0.00 0.39 1.63 -1.55 0.09 116.57 117.75 2bl5 h LYS 113 Ca 0.00 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2bl5 h LYS 113 Cb 0.41 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.90 2bl5 h LYS 113 CO 0.00 0.41 -0.02 -0.07 -3.45 0.00 0.00 179.45 176.31 2bl5 h LEU 114 N 0.63 0.00 0.00 5.20 3.38 -1.76 -3.41 115.31 119.35 2bl5 h LEU 114 Ca 0.25 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.91 2bl5 h LEU 114 Cb 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.90 2bl5 h LEU 114 CO -0.07 0.23 -1.86 0.80 0.09 0.00 0.00 178.44 177.63 2bl5 n MET 115 N -3.20 0.56 0.05 1.13 0.00 -1.25 -4.65 117.12 109.76 2bl5 n MET 115 Ca -0.00 0.35 0.12 0.00 0.00 0.00 0.00 57.70 58.16 2bl5 n MET 115 Cb 0.01 -1.56 0.47 0.00 0.00 0.00 0.00 33.22 32.14 2bl5 n MET 115 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2bl5 n GLU 116 N -4.35 0.09 0.25 2.12 1.02 -1.01 -1.71 120.64 117.05 2bl5 n GLU 116 Ca -0.40 0.18 0.11 0.00 -0.02 0.00 0.00 57.16 57.04 2bl5 n GLU 116 Cb 0.74 -1.63 0.68 0.00 -0.02 0.00 0.00 31.44 31.20 2bl5 n GLU 116 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2bl5 h LEU 117 N 0.00 0.00 0.21 -4.62 3.38 -1.22 -3.45 115.31 109.60 2bl5 h LEU 117 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2bl5 h LEU 117 Cb 0.47 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 2bl5 h LEU 117 CO 0.00 0.14 -0.08 0.00 0.09 0.00 0.00 178.44 178.59 2bl5 n ALA 118 N -2.30 -0.07 0.00 1.53 0.00 -0.69 -4.21 120.51 114.77 2bl5 n ALA 118 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2bl5 n ALA 118 Cb 0.26 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.44 2bl5 n ALA 118 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2bl5 n ILE 119 N -2.34 0.00 -2.32 0.00 5.41 -1.26 -4.83 119.36 114.02 2bl5 n ILE 119 Ca -0.04 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.29 2bl5 n ILE 119 Cb 0.41 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.31 2bl5 n ILE 119 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2bl5 s LEU 120 N 0.00 4.35 0.00 1.39 2.01 -1.26 -4.69 118.68 120.48 2bl5 s LEU 120 Ca 0.00 2.10 0.00 0.00 0.01 0.00 0.00 54.13 56.24 2bl5 s LEU 120 Cb 0.00 -3.58 0.00 0.00 0.01 0.00 0.00 46.19 42.62 2bl5 s LEU 120 CO 0.00 -0.58 0.00 -0.46 1.01 0.00 0.00 176.35 176.32 2bl5 n ASN 121 N 4.33 0.00 -0.03 2.29 0.23 -1.26 -5.00 115.26 115.83 2bl5 n ASN 121 Ca 0.11 -0.47 0.11 0.00 -0.53 0.00 0.00 54.58 53.79 2bl5 n ASN 121 Cb 0.45 0.00 0.52 0.00 -2.08 0.00 0.00 39.78 38.67 2bl5 n ASN 121 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2bl5 h GLY 122 N 0.00 0.47 0.51 4.83 0.00 -1.97 -2.64 103.07 104.27 2bl5 h GLY 122 Ca 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 2bl5 h GLY 122 CO 0.00 0.10 -0.25 -0.84 0.00 0.00 0.00 176.54 175.55 2bl5 h THR 123 N 0.36 0.00 -1.18 4.70 2.02 -1.95 -3.28 112.91 113.57 2bl5 h THR 123 Ca 0.23 -0.19 -0.74 0.00 0.77 0.00 0.00 66.41 66.48 2bl5 h THR 123 Cb 0.44 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.72 2bl5 h THR 123 CO -0.06 0.00 2.38 -1.22 0.37 0.00 0.00 175.52 176.99 2bl5 n TYR 124 N -4.38 2.60 0.43 3.16 4.02 -1.13 -4.54 117.16 117.33 2bl5 n TYR 124 Ca -0.09 -2.82 0.13 0.00 -0.01 0.00 0.00 57.90 55.12 2bl5 n TYR 124 Cb 0.27 -1.82 0.46 0.00 -0.02 0.00 0.00 39.34 38.24 2bl5 n TYR 124 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2bl5 h ARG 125 N 4.59 0.00 0.13 -0.72 2.43 -1.53 -2.93 114.38 116.34 2bl5 h ARG 125 Ca 0.70 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.88 2bl5 h ARG 125 Cb 0.30 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 2bl5 h ARG 125 CO 1.47 0.00 -0.16 -0.44 -1.51 0.00 0.00 179.97 179.33 2bl5 h ASP 126 N 0.00 -0.42 0.17 -3.80 5.19 -1.86 -1.45 116.42 114.25 2bl5 h ASP 126 Ca 0.00 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 2bl5 h ASP 126 Cb 0.58 0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.24 2bl5 h ASP 126 CO 0.00 -0.23 -0.50 0.00 -3.12 0.00 0.00 179.24 175.39 2bl5 n ALA 127 N -2.39 3.61 -0.03 3.45 0.00 -1.23 -4.17 120.51 119.75 2bl5 n ALA 127 Ca -0.07 -0.50 -0.14 0.00 0.00 0.00 0.00 53.44 52.73 2bl5 n ALA 127 Cb 0.20 -0.97 -0.10 0.00 0.00 0.00 0.00 19.45 18.58 2bl5 n ALA 127 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2bl5 h ASN 128 N 1.12 0.18 -4.67 0.00 -1.24 -1.28 -3.46 115.58 106.22 2bl5 h ASN 128 Ca 0.00 -0.63 -0.28 0.00 0.71 0.00 0.00 56.30 56.10 2bl5 h ASN 128 Cb 0.58 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.55 2bl5 h ASN 128 CO 0.00 0.78 -0.13 0.18 -1.29 0.00 0.00 177.43 176.97 2bl5 n LEU 129 N -4.63 0.00 0.10 0.34 7.99 -0.57 -5.02 117.00 115.20 2bl5 n LEU 129 Ca -0.08 -1.38 0.12 0.00 -0.01 0.00 0.00 56.01 54.65 2bl5 n LEU 129 Cb 0.39 -0.03 0.13 0.00 -0.11 0.00 0.00 43.42 43.81 2bl5 n LEU 129 CO 0.37 -0.43 0.33 0.07 -1.51 0.00 0.00 177.39 176.23 2bl5 h LYS 130 N 0.00 0.00 -2.54 3.23 2.10 -1.84 -3.44 116.57 114.07 2bl5 h LYS 130 Ca -0.17 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.39 2bl5 h LYS 130 Cb 0.62 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 31.70 2bl5 h LYS 130 CO 0.26 0.00 -0.18 -1.12 -2.00 0.00 0.00 179.45 176.41 2bl5 s SER 131 N -4.82 -0.55 0.00 7.07 0.01 -1.26 -5.04 113.70 109.11 2bl5 s SER 131 Ca 0.05 1.00 0.00 0.00 1.31 0.00 0.00 55.95 58.30 2bl5 s SER 131 Cb 0.11 0.95 0.00 0.00 0.21 0.00 0.00 66.02 67.29 2bl5 s SER 131 CO 0.73 -0.18 1.21 -2.65 0.41 0.00 0.00 173.24 172.76 2bl5 n PRO 132 N 3.45 0.71 0.00 12.44 -0.02 -1.26 -3.94 135.00 146.37 2bl5 n PRO 132 Ca -0.17 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.43 2bl5 n PRO 132 Cb 0.56 -1.15 0.39 0.00 -0.02 0.00 0.00 33.50 33.29 2bl5 n PRO 132 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bl5 n ALA 133 N 1.36 3.12 -1.51 3.55 0.00 -1.26 -4.72 120.51 121.05 2bl5 n ALA 133 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2bl5 n ALA 133 Cb 0.35 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.57 2bl5 n ALA 133 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2bl5 n LEU 134 N -1.43 0.00 0.00 0.00 -0.00 -1.25 -5.26 117.00 109.06 2bl5 n LEU 134 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.08 2bl5 n LEU 134 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.75 2bl5 n LEU 134 CO 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 177.39 177.70