#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 2.76 -0.03 2.61 0.05 -0.80 -4.95 118.68 118.31 2bl5 s LEU 2 Ca 0.00 -0.37 0.02 0.00 0.05 0.00 0.00 54.13 53.82 2bl5 s LEU 2 Cb 0.00 -1.60 0.01 0.00 -2.05 0.00 0.00 46.19 42.55 2bl5 s LEU 2 CO 0.00 0.25 -0.06 -1.10 -0.55 0.00 0.00 176.35 174.89 2bl5 s GLN 3 N -1.52 0.84 -0.13 1.48 -0.21 -1.25 -0.83 119.66 118.03 2bl5 s GLN 3 Ca 0.16 -0.18 0.01 0.00 0.02 0.00 0.00 55.36 55.37 2bl5 s GLN 3 Cb -0.11 -0.81 0.02 0.00 1.00 0.00 0.00 33.01 33.11 2bl5 s GLN 3 CO 0.07 0.00 -0.16 -1.21 -2.12 0.00 0.00 175.29 171.87 2bl5 s GLU 4 N 0.56 2.44 -0.27 2.91 2.02 -0.67 -4.96 118.70 120.73 2bl5 s GLU 4 Ca -0.08 -0.63 -0.07 0.00 0.02 0.00 0.00 54.97 54.21 2bl5 s GLU 4 Cb -0.11 -2.11 -0.01 0.00 0.10 0.00 0.00 34.13 32.00 2bl5 s GLU 4 CO 0.00 -0.12 0.07 0.15 0.02 0.00 0.00 175.26 175.38 2bl5 s LYS 5 N 1.14 3.37 -0.50 1.61 3.01 -1.26 -1.23 119.74 125.88 2bl5 s LYS 5 Ca -0.02 -0.66 -0.09 0.00 -1.01 0.00 0.00 55.97 54.19 2bl5 s LYS 5 Cb -0.14 -3.32 0.13 0.00 -1.01 0.00 0.00 37.83 33.49 2bl5 s LYS 5 CO -0.05 -0.31 0.37 -0.51 0.51 0.00 0.00 175.35 175.36 2bl5 s LEU 6 N 1.55 5.70 0.36 3.17 1.43 0.17 -4.95 118.68 126.12 2bl5 s LEU 6 Ca 0.05 -2.05 -0.27 0.00 -1.03 0.00 0.00 54.13 50.83 2bl5 s LEU 6 Cb -0.16 -2.00 -0.09 0.00 0.03 0.00 0.00 46.19 43.97 2bl5 s LEU 6 CO 0.02 -0.65 1.18 -0.31 0.23 0.00 0.00 176.35 176.83 2bl5 s TYR 7 N 1.16 3.16 -0.17 0.29 1.51 -1.26 -1.42 117.35 120.62 2bl5 s TYR 7 Ca 0.08 1.55 -0.01 0.00 -1.01 0.00 0.00 57.07 57.68 2bl5 s TYR 7 Cb -0.25 -3.43 0.04 0.00 -0.11 0.00 0.00 41.96 38.22 2bl5 s TYR 7 CO -0.02 -1.28 -0.04 0.14 -1.11 0.00 0.00 175.55 173.23 2bl5 s VAL 8 N -1.31 1.06 -0.90 0.71 -7.23 -1.07 -4.92 120.40 106.73 2bl5 s VAL 8 Ca 0.53 -0.62 -0.25 0.00 -1.81 0.00 0.00 61.98 59.83 2bl5 s VAL 8 Cb -0.33 -1.26 -0.05 0.00 0.56 0.00 0.00 36.38 35.30 2bl5 s VAL 8 CO 0.42 0.10 1.95 -2.16 -0.31 0.00 0.00 175.10 175.10 2bl5 s PRO 9 N 1.65 2.55 0.60 4.82 0.04 -1.26 -4.45 135.00 138.95 2bl5 s PRO 9 Ca 0.00 -0.29 0.38 0.00 0.04 0.00 0.00 61.00 61.14 2bl5 s PRO 9 Cb -0.15 -5.06 1.91 0.00 0.04 0.00 0.00 34.50 31.24 2bl5 s PRO 9 CO -0.08 -3.38 2.20 -0.24 0.04 0.00 0.00 177.00 175.54 2bl5 h VAL 10 N 7.26 0.11 0.00 -0.36 3.04 -1.85 0.21 116.25 124.66 2bl5 h VAL 10 Ca 0.10 -0.25 -0.06 0.00 -1.01 0.00 0.00 66.70 65.47 2bl5 h VAL 10 Cb 1.00 1.22 -0.01 0.00 -2.01 0.00 0.00 31.29 31.50 2bl5 h VAL 10 CO 1.21 0.02 -0.31 0.11 -1.01 0.00 0.00 177.57 177.59 2bl5 h LYS 11 N 0.00 0.00 0.18 4.17 1.57 -1.96 -2.84 116.57 117.69 2bl5 h LYS 11 Ca -0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 2bl5 h LYS 11 Cb 0.22 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.56 2bl5 h LYS 11 CO 0.00 0.31 -1.34 0.93 -0.57 0.00 0.00 179.45 178.78 2bl5 h GLU 12 N 0.00 0.45 -3.11 3.15 4.39 -0.97 -3.41 114.58 115.08 2bl5 h GLU 12 Ca -0.00 -0.73 -0.62 0.00 0.34 0.00 0.00 59.36 58.34 2bl5 h GLU 12 Cb 0.64 0.27 -0.41 0.00 -0.10 0.00 0.00 28.75 29.14 2bl5 h GLU 12 CO 0.04 1.34 -0.62 0.71 -1.16 0.00 0.00 179.01 179.32 2bl5 s TYR 13 N -2.70 3.25 0.29 4.33 2.02 -0.88 -4.91 117.35 118.74 2bl5 s TYR 13 Ca -0.07 -3.19 0.18 0.00 -0.37 0.00 0.00 57.07 53.61 2bl5 s TYR 13 Cb 0.06 -2.59 0.81 0.00 -0.40 0.00 0.00 41.96 39.83 2bl5 s TYR 13 CO 0.92 -0.62 1.81 -1.35 -1.57 0.00 0.00 175.55 174.74 2bl5 h PRO 14 N 5.76 0.00 0.00 -1.71 0.11 -1.79 -3.06 132.00 131.31 2bl5 h PRO 14 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2bl5 h PRO 14 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2bl5 h PRO 14 CO 0.68 0.35 -0.85 -3.47 -0.21 0.00 0.00 178.00 174.50 2bl5 n ASP 15 N -3.75 0.63 -4.31 -2.05 2.03 -1.26 -4.67 116.55 103.17 2bl5 n ASP 15 Ca -0.01 -0.15 -0.40 0.00 0.52 0.00 0.00 54.79 54.75 2bl5 n ASP 15 Cb 0.44 0.56 -0.11 0.00 -0.72 0.00 0.00 41.12 41.29 2bl5 n ASP 15 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2bl5 s PHE 16 N -3.16 3.29 -0.69 -0.67 5.36 -1.16 -5.03 117.98 115.94 2bl5 s PHE 16 Ca 0.05 -1.32 -0.26 0.00 -0.96 0.00 0.00 56.93 54.44 2bl5 s PHE 16 Cb 0.15 -2.70 0.04 0.00 -0.34 0.00 0.00 43.02 40.16 2bl5 s PHE 16 CO 0.77 -0.77 1.17 0.54 -1.46 0.00 0.00 175.22 175.47 2bl5 s ASN 17 N 1.85 6.21 0.42 6.13 6.03 -1.26 -4.83 114.94 129.49 2bl5 s ASN 17 Ca 0.02 -0.51 0.09 0.00 -1.03 0.00 0.00 52.86 51.42 2bl5 s ASN 17 Cb -0.21 -2.51 0.91 0.00 -3.03 0.00 0.00 41.25 36.41 2bl5 s ASN 17 CO 0.04 -1.65 2.06 -0.26 -2.03 0.00 0.00 177.10 175.25 2bl5 h PHE 18 N 9.81 0.46 0.04 1.54 0.04 -1.96 0.67 116.94 127.54 2bl5 h PHE 18 Ca -0.28 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.50 2bl5 h PHE 18 Cb 1.06 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.05 2bl5 h PHE 18 CO 1.06 0.28 -0.02 0.28 -0.60 0.00 0.00 178.31 179.32 2bl5 h VAL 19 N 0.49 1.31 0.00 -0.55 2.07 -1.90 0.29 116.25 117.96 2bl5 h VAL 19 Ca 0.15 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.49 2bl5 h VAL 19 Cb 0.00 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 2bl5 h VAL 19 CO -0.03 0.30 0.00 1.23 0.02 0.00 0.00 177.57 179.08 2bl5 h GLY 20 N -0.58 0.00 0.02 2.17 0.00 -1.70 0.11 103.07 103.09 2bl5 h GLY 20 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 2bl5 h GLY 20 CO 0.01 0.00 -2.44 -2.13 0.00 0.00 0.00 176.54 171.98 2bl5 n ARG 21 N -2.60 0.61 -0.01 4.80 0.63 0.23 -3.63 116.66 116.70 2bl5 n ARG 21 Ca -0.02 0.25 -0.12 0.00 -0.92 0.00 0.00 57.85 57.05 2bl5 n ARG 21 Cb 0.08 -1.52 -0.09 0.00 0.45 0.00 0.00 32.46 31.37 2bl5 n ARG 21 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2bl5 h ILE 22 N -0.68 1.23 0.00 5.15 1.08 -0.13 -3.37 117.51 120.78 2bl5 h ILE 22 Ca -0.64 -1.49 0.00 0.00 -0.39 0.00 0.00 64.86 62.34 2bl5 h ILE 22 Cb 1.69 2.13 0.00 0.00 -3.07 0.00 0.00 36.82 37.58 2bl5 h ILE 22 CO -0.30 0.34 -0.82 0.00 -0.69 0.00 0.00 178.15 176.68 2bl5 n LEU 23 N -4.80 0.60 0.00 1.44 -0.00 -0.48 -3.15 117.00 110.61 2bl5 n LEU 23 Ca -0.08 -0.44 0.00 0.00 -0.00 0.00 0.00 56.01 55.49 2bl5 n LEU 23 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.73 2bl5 n LEU 23 CO 0.29 0.15 0.22 0.61 -0.00 0.00 0.00 177.39 178.66 2bl5 n GLY 24 N 1.38 -3.10 0.05 1.47 0.00 0.26 -1.01 105.19 104.25 2bl5 n GLY 24 Ca 0.02 0.39 0.12 0.00 0.00 0.00 0.00 46.02 46.55 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 -0.69 0.30 -0.37 1.61 -0.04 -1.26 -4.35 135.00 130.21 2bl5 n PRO 25 Ca 0.00 0.05 0.08 0.00 -0.04 0.00 0.00 63.50 63.59 2bl5 n PRO 25 Cb 0.00 -1.65 0.23 0.00 -0.04 0.00 0.00 33.50 32.04 2bl5 n PRO 25 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2bl5 n ARG 26 N -2.06 2.75 0.30 0.54 0.63 -1.24 -4.65 116.66 112.92 2bl5 n ARG 26 Ca 0.02 -2.71 0.17 0.00 -0.92 0.00 0.00 57.85 54.42 2bl5 n ARG 26 Cb 0.44 -1.74 0.93 0.00 0.45 0.00 0.00 32.46 32.55 2bl5 n ARG 26 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 2bl5 h GLY 27 N 1.61 0.00 0.30 5.14 0.00 -1.02 -1.18 103.07 107.92 2bl5 h GLY 27 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 47.33 47.48 2bl5 h GLY 27 CO 0.17 0.00 0.60 1.41 0.00 0.00 0.00 176.54 178.72 2bl5 h LEU 28 N 0.00 0.82 -1.19 3.11 -0.00 -1.83 -1.68 115.31 114.53 2bl5 h LEU 28 Ca 0.00 0.07 -0.04 0.00 -0.00 0.00 0.00 57.88 57.91 2bl5 h LEU 28 Cb 0.27 -0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 40.83 2bl5 h LEU 28 CO 0.00 0.37 0.08 0.00 -0.00 0.00 0.00 178.44 178.89 2bl5 h THR 29 N 0.86 1.20 -0.45 0.22 1.03 -1.52 0.37 112.91 114.62 2bl5 h THR 29 Ca 0.53 -0.73 -0.09 0.00 -0.01 0.00 0.00 66.41 66.10 2bl5 h THR 29 Cb 0.68 0.80 -0.01 0.00 -1.07 0.00 0.00 68.15 68.54 2bl5 h THR 29 CO -0.33 0.26 -0.07 0.00 -0.01 0.00 0.00 175.52 175.38 2bl5 h ALA 30 N 1.47 0.61 -0.20 0.00 0.00 -1.49 -2.18 119.26 117.46 2bl5 h ALA 30 Ca 0.14 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 2bl5 h ALA 30 Cb 0.27 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2bl5 h ALA 30 CO 0.00 0.46 -0.46 -0.22 0.00 0.00 0.00 179.25 179.04 2bl5 h LYS 31 N 0.67 0.51 -0.23 0.00 3.64 -0.99 -2.78 116.57 117.39 2bl5 h LYS 31 Ca 0.12 -0.28 -0.07 0.00 -1.27 0.00 0.00 60.65 59.15 2bl5 h LYS 31 Cb 0.59 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 2bl5 h LYS 31 CO 0.04 0.86 -0.17 1.96 -2.27 0.00 0.00 179.45 179.87 2bl5 h GLN 32 N 0.41 0.40 -0.27 1.90 1.08 -0.14 -0.44 115.11 118.05 2bl5 h GLN 32 Ca 0.03 -0.12 -0.08 0.00 -1.45 0.00 0.00 58.65 57.03 2bl5 h GLN 32 Cb 0.96 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.34 2bl5 h GLN 32 CO 0.08 0.56 -0.13 -0.07 -0.95 0.00 0.00 178.83 178.33 2bl5 h LEU 33 N 0.37 0.58 -0.51 1.46 4.07 -1.13 0.32 115.31 120.46 2bl5 h LEU 33 Ca 0.07 -0.41 -0.16 0.00 0.08 0.00 0.00 57.88 57.45 2bl5 h LEU 33 Cb 0.52 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 2bl5 h LEU 33 CO 0.03 0.86 -0.58 1.05 -1.08 0.00 0.00 178.44 178.72 2bl5 h GLU 34 N 0.30 0.51 -0.41 1.13 4.11 -1.22 0.43 114.58 119.42 2bl5 h GLU 34 Ca 0.06 -0.34 -0.08 0.00 0.07 0.00 0.00 59.36 59.07 2bl5 h GLU 34 Cb 0.64 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2bl5 h GLU 34 CO 0.04 0.95 -0.07 0.00 0.07 0.00 0.00 179.01 179.99 2bl5 h ALA 35 N 0.98 0.56 0.00 1.06 0.00 -1.00 -2.87 119.26 117.99 2bl5 h ALA 35 Ca -0.00 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 2bl5 h ALA 35 Cb 1.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2bl5 h ALA 35 CO 0.11 0.42 -0.59 0.93 0.00 0.00 0.00 179.25 180.12 2bl5 h GLU 36 N 0.60 0.00 0.00 0.00 4.39 -0.23 -3.40 114.58 115.94 2bl5 h GLU 36 Ca 0.11 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.71 2bl5 h GLU 36 Cb 0.59 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 2bl5 h GLU 36 CO 0.04 0.72 -0.72 1.79 -1.16 0.00 0.00 179.01 179.68 2bl5 h THR 37 N -1.00 0.62 0.00 1.13 1.35 -0.30 -3.47 112.91 111.24 2bl5 h THR 37 Ca -0.14 -1.95 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2bl5 h THR 37 Cb 0.92 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.55 2bl5 h THR 37 CO -0.09 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.15 2bl5 n GLY 38 N 1.25 0.96 3.59 5.82 0.00 -1.08 -4.71 105.19 111.02 2bl5 n GLY 38 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 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 1.87 3.46 -0.26 0.00 2.36 0.10 -2.41 119.74 124.85 2bl5 s LYS 40 Ca 0.10 -1.14 -0.29 0.00 -2.55 0.00 0.00 55.97 52.08 2bl5 s LYS 40 Cb -0.16 -4.89 0.01 0.00 -1.05 0.00 0.00 37.83 31.74 2bl5 s LYS 40 CO 0.11 -2.01 1.16 -1.50 1.55 0.00 0.00 175.35 174.65 2bl5 s ILE 41 N 4.27 4.42 -0.08 5.43 2.07 -1.26 -2.40 121.20 133.64 2bl5 s ILE 41 Ca 0.37 1.66 0.03 0.00 -1.41 0.00 0.00 60.65 61.30 2bl5 s ILE 41 Cb -0.05 -4.25 -0.02 0.00 0.13 0.00 0.00 42.46 38.27 2bl5 s ILE 41 CO -0.03 -0.34 -0.17 0.00 -1.91 0.00 0.00 174.94 172.49 2bl5 s MET 42 N 3.64 2.87 0.20 3.50 0.23 0.18 -4.91 119.30 125.00 2bl5 s MET 42 Ca 0.49 -0.75 -0.30 0.00 -1.03 0.00 0.00 55.69 54.11 2bl5 s MET 42 Cb -0.16 -2.42 -0.08 0.00 -1.53 0.00 0.00 34.83 30.64 2bl5 s MET 42 CO 0.15 0.40 0.97 0.08 -2.03 0.00 0.00 175.02 174.58 2bl5 s VAL 43 N -0.16 4.15 0.21 5.16 1.01 -1.26 -1.05 120.40 128.46 2bl5 s VAL 43 Ca -0.02 2.02 0.05 0.00 0.00 0.00 0.00 61.98 64.04 2bl5 s VAL 43 Cb -0.14 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.91 2bl5 s VAL 43 CO 0.03 0.42 -0.07 -0.13 0.00 0.00 0.00 175.10 175.36 2bl5 s ARG 44 N -0.80 1.31 0.37 2.72 0.52 0.12 -4.78 118.95 118.40 2bl5 s ARG 44 Ca 0.43 -1.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.02 2bl5 s ARG 44 Cb -0.26 -0.84 0.00 0.00 0.52 0.00 0.00 34.95 34.37 2bl5 s ARG 44 CO 0.32 0.04 0.00 0.41 0.02 0.00 0.00 175.30 176.09 2bl5 n GLY 45 N -0.39 -2.36 3.76 -3.53 0.00 -0.28 -0.11 105.19 102.28 2bl5 n GLY 45 Ca -0.07 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.56 4.39 0.00 1.61 -2.85 -0.90 -1.91 119.74 119.52 2bl5 s LYS 46 Ca 0.00 2.15 0.00 0.00 -1.00 0.00 0.00 55.97 57.12 2bl5 s LYS 46 Cb 0.00 -3.11 0.00 0.00 -2.06 0.00 0.00 37.83 32.66 2bl5 s LYS 46 CO 0.00 -0.17 0.00 0.41 0.10 0.00 0.00 175.35 175.69 2bl5 n GLY 47 N 1.25 2.35 0.00 0.59 0.00 -1.26 -4.14 105.19 103.98 2bl5 n GLY 47 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.17 2bl5 n GLY 47 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bl5 n SER 48 N 0.00 0.00 -1.48 1.61 7.64 -0.80 -3.16 113.62 117.43 2bl5 n SER 48 Ca 0.00 -1.12 -0.09 0.00 1.01 0.00 0.00 58.87 58.67 2bl5 n SER 48 Cb 0.00 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.40 2bl5 n SER 48 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 2bl5 n MET 49 N -0.93 2.12 0.03 1.43 0.00 -1.26 -4.58 117.12 113.94 2bl5 n MET 49 Ca 0.20 -3.12 0.13 0.00 0.00 0.00 0.00 57.70 54.91 2bl5 n MET 49 Cb 0.09 -1.94 0.40 0.00 0.00 0.00 0.00 33.22 31.77 2bl5 n MET 49 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 2bl5 n ARG 50 N -1.04 0.11 -3.72 2.12 0.00 -1.19 -4.37 116.66 108.57 2bl5 n ARG 50 Ca 0.40 0.06 -0.37 0.00 -0.00 0.00 0.00 57.85 57.94 2bl5 n ARG 50 Cb 1.22 -1.60 -0.11 0.00 -0.00 0.00 0.00 32.46 31.97 2bl5 n ARG 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2bl5 s ASP 51 N -3.54 5.36 0.24 2.89 1.01 -1.26 -4.95 116.67 116.41 2bl5 s ASP 51 Ca 0.11 -2.02 -0.06 0.00 0.71 0.00 0.00 52.55 51.29 2bl5 s ASP 51 Cb 0.16 -1.87 0.30 0.00 1.01 0.00 0.00 42.92 42.52 2bl5 s ASP 51 CO 0.62 -0.58 1.86 0.50 0.21 0.00 0.00 175.17 177.78 2bl5 h LYS 52 N 8.13 0.97 -0.87 8.23 1.63 -1.98 0.62 116.57 133.29 2bl5 h LYS 52 Ca -0.15 -0.06 0.01 0.00 -0.85 0.00 0.00 60.65 59.61 2bl5 h LYS 52 Cb 1.05 -0.22 -0.05 0.00 -0.60 0.00 0.00 32.23 32.42 2bl5 h LYS 52 CO 0.74 0.64 0.58 1.57 -3.45 0.00 0.00 179.45 179.52 2bl5 h LYS 53 N 1.00 1.13 -0.70 1.90 2.10 -1.96 -2.62 116.57 117.41 2bl5 h LYS 53 Ca 0.36 -0.07 -0.05 0.00 -2.00 0.00 0.00 60.65 58.89 2bl5 h LYS 53 Cb 0.10 -0.25 -0.03 0.00 -0.90 0.00 0.00 32.23 31.15 2bl5 h LYS 53 CO -0.15 0.75 0.25 -0.22 -2.00 0.00 0.00 179.45 178.08 2bl5 h LYS 54 N 1.16 1.06 0.00 0.07 3.64 -1.31 -0.52 116.57 120.68 2bl5 h LYS 54 Ca 0.33 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2bl5 h LYS 54 Cb -0.10 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.55 2bl5 h LYS 54 CO -0.08 0.88 0.00 1.05 -2.27 0.00 0.00 179.45 179.03 2bl5 h GLU 55 N 1.03 0.00 0.31 1.90 -0.00 -1.20 0.34 114.58 116.95 2bl5 h GLU 55 Ca 0.23 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.58 2bl5 h GLU 55 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.00 2bl5 h GLU 55 CO -0.01 0.00 -0.15 0.93 -0.00 0.00 0.00 179.01 179.78 2bl5 h GLU 56 N 0.00 -0.40 0.00 1.06 5.08 -0.73 -3.34 114.58 116.25 2bl5 h GLU 56 Ca 0.00 0.03 -0.29 0.00 -1.00 0.00 0.00 59.36 58.10 2bl5 h GLU 56 Cb 0.71 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 30.00 2bl5 h GLU 56 CO 0.00 -0.13 -2.10 0.00 -1.00 0.00 0.00 179.01 175.78 2bl5 n GLN 57 N -5.05 0.63 -0.02 2.33 0.00 -0.95 -4.50 117.38 109.82 2bl5 n GLN 57 Ca -0.07 0.10 0.13 0.00 0.00 0.00 0.00 57.00 57.15 2bl5 n GLN 57 Cb 0.23 -1.39 0.61 0.00 0.00 0.00 0.00 30.24 29.69 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 -3.00 0.80 -4.42 2.61 5.03 0.92 -4.91 115.26 112.29 2bl5 n ASN 58 Ca -0.33 -1.39 -0.41 0.00 0.87 0.00 0.00 54.58 53.31 2bl5 n ASN 58 Cb 0.88 -0.02 0.01 0.00 -1.02 0.00 0.00 39.78 39.63 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 -0.33 0.44 0.00 3.52 1.85 0.31 -2.65 116.66 119.80 2bl5 n ARG 59 Ca 0.19 0.16 0.00 0.00 -1.00 0.00 0.00 57.85 57.20 2bl5 n ARG 59 Cb 0.22 -1.41 0.00 0.00 -1.05 0.00 0.00 32.46 30.22 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 1.91 3.08 3.81 2.89 0.00 -1.26 -5.05 105.19 110.57 2bl5 n GLY 60 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2bl5 n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bl5 s LYS 61 N -0.27 1.74 0.06 1.61 -2.85 -1.08 -4.15 119.74 114.80 2bl5 s LYS 61 Ca 0.00 0.45 0.04 0.00 -1.00 0.00 0.00 55.97 55.46 2bl5 s LYS 61 Cb 0.00 -1.89 0.23 0.00 -2.06 0.00 0.00 37.83 34.10 2bl5 s LYS 61 CO 0.00 -1.82 0.26 -2.30 0.10 0.00 0.00 175.35 171.60 2bl5 n PRO 62 N -3.53 -0.01 0.08 1.78 -0.02 -1.26 0.76 135.00 132.80 2bl5 n PRO 62 Ca 0.07 0.23 -0.10 0.00 -2.02 0.00 0.00 63.50 61.68 2bl5 n PRO 62 Cb 0.58 -0.41 -0.03 0.00 -0.02 0.00 0.00 33.50 33.61 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 0.28 1.03 2.55 2.35 -1.89 0.65 115.58 120.55 2bl5 h ASN 63 Ca 0.14 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 2bl5 h ASN 63 Cb 0.39 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2bl5 h ASN 63 CO -0.12 1.07 -0.82 -0.50 -1.65 0.00 0.00 177.43 175.41 2bl5 h TRP 64 N 0.11 0.00 0.74 1.19 4.06 0.09 0.32 115.95 122.46 2bl5 h TRP 64 Ca -0.05 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.86 2bl5 h TRP 64 Cb 1.58 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.75 2bl5 h TRP 64 CO 0.03 0.00 -0.36 1.49 -3.56 0.00 0.00 178.44 176.05 2bl5 h GLU 65 N 0.00 -0.96 -0.13 0.49 4.81 -0.61 -3.31 114.58 114.87 2bl5 h GLU 65 Ca 0.00 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2bl5 h GLU 65 Cb 0.93 0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.53 2bl5 h GLU 65 CO 0.00 -0.62 0.00 -2.39 -0.73 0.00 0.00 179.01 175.27 2bl5 n HIS 66 N -5.48 0.16 0.23 0.92 1.44 0.18 -3.77 115.22 108.89 2bl5 n HIS 66 Ca -0.14 -0.08 0.15 0.00 -2.01 0.00 0.00 57.72 55.65 2bl5 n HIS 66 Cb 0.41 0.00 0.81 0.00 0.12 0.00 0.00 29.99 31.33 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 3.25 0.00 -1.01 2.39 5.85 -0.43 0.73 115.31 126.09 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 0.70 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2bl5 h LEU 67 CO 0.00 0.00 0.00 0.59 -0.34 0.00 0.00 178.44 178.69 2bl5 n ASN 68 N -2.55 1.48 -4.91 1.25 3.02 -1.25 -3.80 115.26 108.50 2bl5 n ASN 68 Ca -0.02 -1.87 -0.27 0.00 -0.03 0.00 0.00 54.58 52.39 2bl5 n ASN 68 Cb 0.06 -0.15 -0.00 0.00 -0.61 0.00 0.00 39.78 39.07 2bl5 n ASN 68 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2bl5 s GLU 69 N -1.69 2.24 0.03 3.52 2.02 0.09 -5.02 118.70 119.89 2bl5 s GLU 69 Ca 0.24 -2.05 -0.10 0.00 0.02 0.00 0.00 54.97 53.07 2bl5 s GLU 69 Cb 0.12 -2.08 -0.05 0.00 0.10 0.00 0.00 34.13 32.22 2bl5 s GLU 69 CO 0.18 -0.65 0.36 -0.51 0.02 0.00 0.00 175.26 174.65 2bl5 s ASP 70 N -4.30 6.64 -0.15 -0.19 1.01 -1.26 -2.12 116.67 116.29 2bl5 s ASP 70 Ca 0.33 0.76 -0.35 0.00 0.71 0.00 0.00 52.55 54.00 2bl5 s ASP 70 Cb -0.02 -2.17 -0.12 0.00 1.01 0.00 0.00 42.92 41.61 2bl5 s ASP 70 CO 0.21 0.25 1.88 -0.11 0.21 0.00 0.00 175.17 177.60 2bl5 n LEU 71 N 1.26 3.14 -3.96 1.23 7.94 -1.25 -4.04 117.00 121.32 2bl5 n LEU 71 Ca -0.11 0.94 -0.09 0.00 -1.11 0.00 0.00 56.01 55.64 2bl5 n LEU 71 Cb 0.53 -1.32 -0.07 0.00 0.53 0.00 0.00 43.42 43.09 2bl5 n LEU 71 CO 0.40 -0.19 -0.04 -1.38 -1.11 0.00 0.00 177.39 175.07 2bl5 s HIS 72 N 4.30 0.39 -0.05 1.96 -3.43 0.84 -2.61 115.29 116.69 2bl5 s HIS 72 Ca 0.95 -0.76 -0.02 0.00 -0.80 0.00 0.00 55.06 54.43 2bl5 s HIS 72 Cb -0.78 -0.08 -0.04 0.00 -1.43 0.00 0.00 32.58 30.26 2bl5 s HIS 72 CO 0.54 -0.69 0.07 0.14 -2.00 0.00 0.00 174.74 172.81 2bl5 s VAL 73 N -3.96 4.77 -0.08 -5.38 -7.23 -0.50 0.12 120.40 108.14 2bl5 s VAL 73 Ca 0.16 -0.25 -0.01 0.00 -1.81 0.00 0.00 61.98 60.07 2bl5 s VAL 73 Cb 0.04 -3.12 0.03 0.00 0.56 0.00 0.00 36.38 33.89 2bl5 s VAL 73 CO -0.01 0.47 -0.01 -0.22 -0.31 0.00 0.00 175.10 175.02 2bl5 s LEU 74 N -1.38 0.67 -0.53 1.32 0.20 -0.22 0.42 118.68 119.17 2bl5 s LEU 74 Ca 0.19 -0.12 -0.25 0.00 0.69 0.00 0.00 54.13 54.64 2bl5 s LEU 74 Cb -0.12 -0.50 0.04 0.00 -0.43 0.00 0.00 46.19 45.18 2bl5 s LEU 74 CO 0.09 -0.18 0.94 0.27 -0.29 0.00 0.00 176.35 177.18 2bl5 s ILE 75 N 1.94 4.40 -0.24 6.68 -4.36 -0.36 0.48 121.20 129.74 2bl5 s ILE 75 Ca 0.05 0.41 -0.08 0.00 -0.26 0.00 0.00 60.65 60.77 2bl5 s ILE 75 Cb -0.12 -4.52 -0.04 0.00 1.25 0.00 0.00 42.46 39.03 2bl5 s ILE 75 CO -0.06 -1.05 0.10 -0.89 0.24 0.00 0.00 174.94 173.28 2bl5 s THR 76 N 3.92 4.66 -0.04 8.37 2.01 -1.01 -1.66 115.64 131.89 2bl5 s THR 76 Ca 0.32 -0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.32 2bl5 s THR 76 Cb -0.12 -3.17 -0.02 0.00 0.01 0.00 0.00 72.50 69.20 2bl5 s THR 76 CO 0.21 0.34 -0.20 0.54 -0.69 0.00 0.00 174.62 174.83 2bl5 s VAL 77 N 1.39 2.58 -0.52 3.82 0.11 -0.01 0.00 120.40 127.77 2bl5 s VAL 77 Ca 0.06 -0.90 -0.02 0.00 -2.93 0.00 0.00 61.98 58.19 2bl5 s VAL 77 Cb -0.15 -1.96 0.14 0.00 -1.53 0.00 0.00 36.38 32.87 2bl5 s VAL 77 CO 0.05 0.58 0.31 -1.61 -3.33 0.00 0.00 175.10 171.10 2bl5 s GLU 78 N -0.62 2.22 0.02 1.54 0.41 -1.26 -1.90 118.70 119.12 2bl5 s GLU 78 Ca 0.09 -2.24 -0.17 0.00 -0.41 0.00 0.00 54.97 52.24 2bl5 s GLU 78 Cb -0.11 -3.60 0.06 0.00 -1.78 0.00 0.00 34.13 28.70 2bl5 s GLU 78 CO 0.00 -1.11 0.77 -3.47 -0.49 0.00 0.00 175.26 170.96 2bl5 n ASP 79 N 3.89 -0.85 0.00 -0.19 2.03 -1.26 -4.96 116.55 115.21 2bl5 n ASP 79 Ca 0.04 -1.27 0.08 0.00 0.52 0.00 0.00 54.79 54.16 2bl5 n ASP 79 Cb 0.39 1.34 0.37 0.00 -0.72 0.00 0.00 41.12 42.50 2bl5 n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2bl5 n ALA 80 N -1.67 1.80 0.00 -1.67 0.00 -1.26 -4.90 120.51 112.81 2bl5 n ALA 80 Ca -0.07 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2bl5 n ALA 80 Cb 0.37 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2bl5 n ALA 80 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2bl5 n GLN 81 N -1.45 0.00 -0.01 0.00 7.27 -1.26 -4.83 117.38 117.09 2bl5 n GLN 81 Ca 0.05 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 57.00 2bl5 n GLN 81 Cb 0.18 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 32.75 2bl5 n GLN 81 CO 0.00 0.00 0.00 -0.97 0.07 0.00 0.00 177.06 176.16 2bl5 h ASN 82 N 0.00 -1.35 -0.42 1.69 -0.00 -1.99 0.89 115.58 114.40 2bl5 h ASN 82 Ca 0.00 0.16 -0.11 0.00 -0.00 0.00 0.00 56.30 56.35 2bl5 h ASN 82 Cb 0.00 0.53 -0.02 0.00 -0.00 0.00 0.00 38.32 38.83 2bl5 h ASN 82 CO 0.00 -0.37 -0.16 -0.09 -0.00 0.00 0.00 177.43 176.81 2bl5 h ARG 83 N -0.45 0.90 -0.37 6.67 9.65 -2.00 -2.91 114.38 125.86 2bl5 h ARG 83 Ca 0.03 -0.34 -0.14 0.00 -1.10 0.00 0.00 59.98 58.42 2bl5 h ARG 83 Cb 0.53 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.05 2bl5 h ARG 83 CO -0.35 0.99 -0.31 0.00 2.80 0.00 0.00 179.97 183.10 2bl5 h ALA 84 N 1.02 0.54 -0.16 2.80 0.00 -1.61 -2.71 119.26 119.14 2bl5 h ALA 84 Ca 0.12 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 2bl5 h ALA 84 Cb 0.69 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2bl5 h ALA 84 CO 0.05 0.59 -0.31 1.05 0.00 0.00 0.00 179.25 180.64 2bl5 h GLU 85 N 0.68 0.31 -0.40 0.00 4.11 0.81 0.42 114.58 120.51 2bl5 h GLU 85 Ca 0.07 -0.12 -0.01 0.00 0.07 0.00 0.00 59.36 59.37 2bl5 h GLU 85 Cb 0.90 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 2bl5 h GLU 85 CO 0.08 0.59 0.22 1.25 0.07 0.00 0.00 179.01 181.22 2bl5 h LEU 86 N 0.27 0.49 -0.30 3.06 7.12 -1.41 -0.10 115.31 124.45 2bl5 h LEU 86 Ca 0.04 -0.08 -0.15 0.00 0.13 0.00 0.00 57.88 57.82 2bl5 h LEU 86 Cb 0.68 -0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 40.68 2bl5 h LEU 86 CO 0.05 0.43 -0.40 0.50 -0.13 0.00 0.00 178.44 178.89 2bl5 h LYS 87 N 0.52 0.79 -0.17 1.25 3.64 -0.99 -2.88 116.57 118.72 2bl5 h LYS 87 Ca 0.14 -0.46 -0.14 0.00 -1.27 0.00 0.00 60.65 58.92 2bl5 h LYS 87 Cb 0.04 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2bl5 h LYS 87 CO -0.02 1.09 -0.48 1.37 -2.27 0.00 0.00 179.45 179.14 2bl5 h LEU 88 N 0.56 0.49 -0.51 5.20 8.10 -0.15 -2.75 115.31 126.25 2bl5 h LEU 88 Ca 0.03 -0.24 -0.12 0.00 0.11 0.00 0.00 57.88 57.67 2bl5 h LEU 88 Cb 1.00 -0.14 -0.02 0.00 -0.44 0.00 0.00 40.66 41.06 2bl5 h LEU 88 CO 0.09 0.89 -0.15 0.07 -4.11 0.00 0.00 178.44 175.24 2bl5 h LYS 89 N 0.36 1.00 -0.40 0.17 5.09 -0.97 0.40 116.57 122.23 2bl5 h LYS 89 Ca 0.02 -0.40 -0.12 0.00 0.09 0.00 0.00 60.65 60.24 2bl5 h LYS 89 Cb 0.97 -0.05 -0.01 0.00 0.10 0.00 0.00 32.23 33.24 2bl5 h LYS 89 CO 0.09 1.08 -0.24 0.07 -2.09 0.00 0.00 179.45 178.35 2bl5 h ARG 90 N 0.87 0.80 -0.14 0.07 0.11 -1.52 0.18 114.38 114.75 2bl5 h ARG 90 Ca 0.13 -0.33 -0.05 0.00 0.10 0.00 0.00 59.98 59.82 2bl5 h ARG 90 Cb 0.72 -0.03 -0.00 0.00 1.11 0.00 0.00 29.97 31.77 2bl5 h ARG 90 CO 0.06 0.96 -0.09 0.00 0.10 0.00 0.00 179.97 180.99 2bl5 h ALA 91 N 1.03 0.20 0.00 0.08 0.00 -1.23 -2.67 119.26 116.67 2bl5 h ALA 91 Ca 0.09 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 2bl5 h ALA 91 Cb 0.76 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2bl5 h ALA 91 CO 0.06 0.03 -0.39 -0.24 0.00 0.00 0.00 179.25 178.71 2bl5 h VAL 92 N -0.04 1.14 -0.12 0.00 3.04 -0.11 -1.79 116.25 118.38 2bl5 h VAL 92 Ca 0.03 -1.40 -0.06 0.00 -1.01 0.00 0.00 66.70 64.25 2bl5 h VAL 92 Cb 0.59 1.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.64 2bl5 h VAL 92 CO 0.03 0.38 -0.21 -0.33 -1.01 0.00 0.00 177.57 176.42 2bl5 h GLU 93 N 0.00 0.20 -0.59 4.17 5.08 -0.57 0.33 114.58 123.20 2bl5 h GLU 93 Ca -0.00 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2bl5 h GLU 93 Cb 0.76 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 2bl5 h GLU 93 CO 0.05 0.42 0.22 0.93 -1.00 0.00 0.00 179.01 179.63 2bl5 h GLU 94 N 0.19 0.86 -0.46 2.33 4.39 -0.98 -1.90 114.58 119.02 2bl5 h GLU 94 Ca 0.03 -0.14 -0.08 0.00 0.34 0.00 0.00 59.36 59.51 2bl5 h GLU 94 Cb 0.49 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2bl5 h GLU 94 CO 0.03 0.72 -0.06 0.28 -1.16 0.00 0.00 179.01 178.83 2bl5 h VAL 95 N 0.85 1.25 -0.34 3.13 2.07 -0.66 -1.62 116.25 120.93 2bl5 h VAL 95 Ca 0.20 -1.09 0.10 0.00 0.82 0.00 0.00 66.70 66.73 2bl5 h VAL 95 Cb 0.19 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2bl5 h VAL 95 CO -0.02 0.38 0.25 0.11 0.02 0.00 0.00 177.57 178.31 2bl5 h LYS 96 N 0.72 0.00 0.00 1.57 1.79 0.30 1.14 116.57 122.09 2bl5 h LYS 96 Ca 0.13 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.43 2bl5 h LYS 96 Cb 0.52 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.15 2bl5 h LYS 96 CO 0.03 0.00 -0.81 -0.22 -1.08 0.00 0.00 179.45 177.37 2bl5 h LYS 97 N 0.00 0.00 0.15 3.15 3.64 -0.64 -3.37 116.57 119.50 2bl5 h LYS 97 Ca 0.16 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.19 2bl5 h LYS 97 Cb 0.67 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 2bl5 h LYS 97 CO -0.00 0.81 -1.87 -0.07 -2.27 0.00 0.00 179.45 176.05 2bl5 h LEU 98 N 0.00 0.50 -0.60 5.20 -0.00 0.87 -3.34 115.31 117.93 2bl5 h LEU 98 Ca -0.01 -0.94 0.00 0.00 -0.00 0.00 0.00 57.88 56.93 2bl5 h LEU 98 Cb 1.47 -0.16 0.00 0.00 -0.00 0.00 0.00 40.66 41.97 2bl5 h LEU 98 CO 0.11 1.82 0.00 0.00 -0.00 0.00 0.00 178.44 180.37 2bl5 n LEU 99 N -3.56 0.22 -4.74 1.67 -0.00 0.34 -4.71 117.00 106.22 2bl5 n LEU 99 Ca -0.29 -0.11 -0.41 0.00 -0.00 0.00 0.00 56.01 55.20 2bl5 n LEU 99 Cb 1.05 -0.11 -0.04 0.00 -0.00 0.00 0.00 43.42 44.32 2bl5 n LEU 99 CO 0.46 0.05 0.80 -0.69 -0.00 0.00 0.00 177.39 178.01 2bl5 s VAL 100 N -1.40 3.91 -2.00 1.47 1.01 -1.26 -4.91 120.40 117.22 2bl5 s VAL 100 Ca 0.00 1.62 0.10 0.00 0.00 0.00 0.00 61.98 63.70 2bl5 s VAL 100 Cb 0.00 -4.03 0.30 0.00 0.00 0.00 0.00 36.38 32.65 2bl5 s VAL 100 CO 0.00 0.26 1.05 -0.81 0.00 0.00 0.00 175.10 175.60 2bl5 n PRO 101 N 2.53 0.40 -0.75 2.72 -0.04 -1.26 -4.82 135.00 133.77 2bl5 n PRO 101 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2bl5 n PRO 101 Cb 0.46 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.91 0.00 -2.44 0.55 0.00 -1.26 -4.91 120.51 111.54 2bl5 n ALA 102 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.13 2bl5 n ALA 102 Cb 0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 19.45 19.23 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 -3.13 2.80 -0.29 0.00 0.00 -1.26 -4.37 121.76 115.51 2bl5 s ALA 103 Ca 0.00 -2.57 -0.01 0.00 0.00 0.00 0.00 51.96 49.39 2bl5 s ALA 103 Cb 0.00 -4.63 0.00 0.00 0.00 0.00 0.00 23.12 18.49 2bl5 s ALA 103 CO 0.00 -3.86 0.02 -1.91 0.00 0.00 0.00 175.76 170.01 2bl5 n GLU 104 N 8.48 -3.47 -0.53 0.00 2.13 -1.26 -4.97 120.64 121.02 2bl5 n GLU 104 Ca 0.45 2.77 0.07 0.00 0.66 0.00 0.00 57.16 61.11 2bl5 n GLU 104 Cb 0.47 -5.22 0.18 0.00 0.27 0.00 0.00 31.44 27.14 2bl5 n GLU 104 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bl5 n GLY 105 N 0.75 4.81 1.26 8.31 0.00 -1.26 -5.09 105.19 113.98 2bl5 n GLY 105 Ca -0.03 -1.23 0.14 0.00 0.00 0.00 0.00 46.02 44.90 2bl5 n GLY 105 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2bl5 n GLU 106 N -1.09 -2.58 -1.66 1.61 0.28 -1.26 -4.79 120.64 111.15 2bl5 n GLU 106 Ca 0.17 2.03 -0.14 0.00 -0.16 0.00 0.00 57.16 59.06 2bl5 n GLU 106 Cb 0.70 -3.16 -0.05 0.00 1.43 0.00 0.00 31.44 30.37 2bl5 n GLU 106 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2bl5 n ASP 107 N -4.18 -3.84 0.12 -1.84 -0.08 -1.26 -4.78 116.55 100.69 2bl5 n ASP 107 Ca -0.05 0.30 0.11 0.00 -1.51 0.00 0.00 54.79 53.63 2bl5 n ASP 107 Cb 0.60 -3.47 0.48 0.00 2.34 0.00 0.00 41.12 41.06 2bl5 n ASP 107 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2bl5 n SER 108 N -0.91 0.56 -0.02 1.67 7.64 -1.26 -2.80 113.62 118.50 2bl5 n SER 108 Ca -0.15 0.66 -0.11 0.00 1.01 0.00 0.00 58.87 60.29 2bl5 n SER 108 Cb 0.50 -0.77 -0.09 0.00 -1.01 0.00 0.00 64.21 62.83 2bl5 n SER 108 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2bl5 h LEU 109 N 0.00 -0.05 0.00 -3.43 -0.00 -1.96 -3.21 115.31 106.66 2bl5 h LEU 109 Ca 0.00 -0.61 0.00 0.00 -0.00 0.00 0.00 57.88 57.27 2bl5 h LEU 109 Cb 0.27 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 2bl5 h LEU 109 CO 0.00 0.68 -0.12 0.11 -0.00 0.00 0.00 178.44 179.11 2bl5 h LYS 110 N -0.89 0.00 0.00 1.13 1.79 -1.94 -3.33 116.57 113.34 2bl5 h LYS 110 Ca -0.01 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.28 2bl5 h LYS 110 Cb 0.66 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.28 2bl5 h LYS 110 CO 0.01 0.00 -0.88 1.57 -1.08 0.00 0.00 179.45 179.07 2bl5 h LYS 111 N -0.32 0.00 0.00 3.15 2.10 -1.79 -2.50 116.57 117.21 2bl5 h LYS 111 Ca 0.00 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.47 2bl5 h LYS 111 Cb 0.12 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.43 2bl5 h LYS 111 CO 0.00 0.88 -0.84 0.52 -2.00 0.00 0.00 179.45 178.02 2bl5 h MET 112 N 0.00 0.10 -0.08 0.07 2.86 -1.69 1.00 114.93 117.18 2bl5 h MET 112 Ca -0.01 -0.11 -0.17 0.00 -2.06 0.00 0.00 59.70 57.36 2bl5 h MET 112 Cb 1.60 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 33.29 2bl5 h MET 112 CO 0.11 0.88 -0.67 -0.22 1.06 0.00 0.00 176.91 178.07 2bl5 h LYS 113 N 0.05 0.36 0.00 1.72 1.63 -1.54 -1.12 116.57 117.68 2bl5 h LYS 113 Ca -0.03 -0.27 -0.04 0.00 -0.85 0.00 0.00 60.65 59.46 2bl5 h LYS 113 Cb 1.46 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 33.14 2bl5 h LYS 113 CO 0.12 0.90 -0.59 1.25 -3.45 0.00 0.00 179.45 177.68 2bl5 h LEU 114 N 0.25 0.00 0.00 5.20 5.85 -1.40 -3.38 115.31 121.83 2bl5 h LEU 114 Ca -0.02 -0.12 -0.17 0.00 0.84 0.00 0.00 57.88 58.41 2bl5 h LEU 114 Cb 1.22 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 2bl5 h LEU 114 CO 0.11 0.87 -1.04 -0.03 -0.34 0.00 0.00 178.44 178.02 2bl5 h MET 115 N -1.00 0.00 0.00 1.25 4.05 -0.99 -3.36 114.93 114.87 2bl5 h MET 115 Ca -0.07 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 2bl5 h MET 115 Cb 0.62 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.42 2bl5 h MET 115 CO -0.04 0.81 0.00 0.39 0.23 0.00 0.00 176.91 178.30 2bl5 n GLU 116 N -4.48 0.09 0.29 0.39 -0.58 -0.96 -1.43 120.64 113.96 2bl5 n GLU 116 Ca -0.26 0.42 0.18 0.00 -0.42 0.00 0.00 57.16 57.07 2bl5 n GLU 116 Cb 0.59 -1.70 0.84 0.00 -0.57 0.00 0.00 31.44 30.60 2bl5 n GLU 116 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2bl5 h LEU 117 N 0.00 0.00 1.81 -4.62 7.12 -1.35 -3.46 115.31 114.81 2bl5 h LEU 117 Ca 0.00 0.00 -0.27 0.00 0.13 0.00 0.00 57.88 57.74 2bl5 h LEU 117 Cb 0.20 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.31 2bl5 h LEU 117 CO 0.00 0.04 -0.34 0.00 -0.13 0.00 0.00 178.44 178.01 2bl5 n ALA 118 N -2.13 -0.38 -0.93 1.25 0.00 -0.52 -4.98 120.51 112.81 2bl5 n ALA 118 Ca -0.01 0.12 -0.31 0.00 0.00 0.00 0.00 53.44 53.25 2bl5 n ALA 118 Cb 0.23 -1.60 0.15 0.00 0.00 0.00 0.00 19.45 18.22 2bl5 n ALA 118 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2bl5 s ILE 119 N -2.66 2.55 -0.84 0.00 -5.25 -1.26 -4.89 121.20 108.85 2bl5 s ILE 119 Ca 0.00 0.18 -0.25 0.00 -0.99 0.00 0.00 60.65 59.59 2bl5 s ILE 119 Cb 0.00 -2.42 0.01 0.00 2.95 0.00 0.00 42.46 43.00 2bl5 s ILE 119 CO 0.00 -0.24 1.61 -0.76 -1.79 0.00 0.00 174.94 173.77 2bl5 s LEU 120 N -6.39 3.29 0.00 0.37 2.01 -1.26 -4.79 118.68 111.91 2bl5 s LEU 120 Ca 0.65 -0.67 0.00 0.00 0.01 0.00 0.00 54.13 54.11 2bl5 s LEU 120 Cb -0.20 -2.56 0.00 0.00 0.01 0.00 0.00 46.19 43.44 2bl5 s LEU 120 CO 0.58 -2.07 0.00 -0.46 1.01 0.00 0.00 176.35 175.41 2bl5 n ASN 121 N 11.04 0.00 -0.29 2.29 0.23 -1.26 -4.96 115.26 122.32 2bl5 n ASN 121 Ca 0.25 0.16 0.00 0.00 -0.53 0.00 0.00 54.58 54.46 2bl5 n ASN 121 Cb 0.50 -0.38 0.00 0.00 -2.08 0.00 0.00 39.78 37.81 2bl5 n ASN 121 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bl5 n GLY 122 N 1.89 0.91 0.07 4.83 0.00 -1.26 -4.97 105.19 106.66 2bl5 n GLY 122 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2bl5 n GLY 122 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2bl5 h THR 123 N 4.20 1.13 -3.47 2.61 2.02 -1.92 -3.45 112.91 114.03 2bl5 h THR 123 Ca 0.00 -1.90 -0.64 0.00 0.77 0.00 0.00 66.41 64.63 2bl5 h THR 123 Cb 1.01 2.19 -0.23 0.00 -1.74 0.00 0.00 68.15 69.38 2bl5 h THR 123 CO 0.00 0.38 -0.65 -0.31 0.37 0.00 0.00 175.52 175.31 2bl5 s TYR 124 N -2.06 3.06 -0.09 3.16 2.02 -1.26 -4.96 117.35 117.22 2bl5 s TYR 124 Ca -0.15 -0.44 0.15 0.00 -0.37 0.00 0.00 57.07 56.26 2bl5 s TYR 124 Cb -0.01 -2.12 -0.17 0.00 -0.40 0.00 0.00 41.96 39.26 2bl5 s TYR 124 CO 0.47 -0.26 0.77 -0.09 -1.57 0.00 0.00 175.55 174.87 2bl5 h ARG 125 N 7.65 0.00 0.00 -0.62 9.65 -1.99 -3.39 114.38 125.68 2bl5 h ARG 125 Ca -0.37 0.00 -0.29 0.00 -1.10 0.00 0.00 59.98 58.22 2bl5 h ARG 125 Cb 1.18 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.70 2bl5 h ARG 125 CO 0.61 0.38 -2.10 -0.40 2.80 0.00 0.00 179.97 181.26 2bl5 n ASP 126 N -2.96 0.27 0.00 -3.80 5.75 -1.26 -3.81 116.55 110.75 2bl5 n ASP 126 Ca -0.12 0.13 0.07 0.00 -0.01 0.00 0.00 54.79 54.86 2bl5 n ASP 126 Cb 0.93 0.80 0.42 0.00 -1.03 0.00 0.00 41.12 42.23 2bl5 n ASP 126 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bl5 n ALA 127 N -2.62 1.99 0.07 2.12 0.00 -1.26 -1.39 120.51 119.42 2bl5 n ALA 127 Ca -0.24 -0.09 -0.03 0.00 0.00 0.00 0.00 53.44 53.09 2bl5 n ALA 127 Cb 1.04 -1.24 0.21 0.00 0.00 0.00 0.00 19.45 19.46 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 0.00 0.34 0.00 0.00 -0.73 -1.76 -3.36 115.58 110.08 2bl5 h ASN 128 Ca 0.00 -0.14 -0.41 0.00 1.87 0.00 0.00 56.30 57.63 2bl5 h ASN 128 Cb 0.03 -0.09 -0.06 0.00 0.27 0.00 0.00 38.32 38.47 2bl5 h ASN 128 CO 0.00 0.69 -2.23 -0.11 -0.37 0.00 0.00 177.43 175.41 2bl5 n LEU 129 N -4.05 1.94 -4.77 0.34 7.94 -0.48 -4.94 117.00 112.97 2bl5 n LEU 129 Ca -0.01 0.36 -0.39 0.00 -1.11 0.00 0.00 56.01 54.86 2bl5 n LEU 129 Cb 0.47 -0.86 -0.06 0.00 0.53 0.00 0.00 43.42 43.50 2bl5 n LEU 129 CO 0.42 0.50 0.26 -1.59 -1.11 0.00 0.00 177.39 175.88 2bl5 s LYS 130 N -2.47 4.28 -0.34 1.96 -2.85 -1.02 -5.04 119.74 114.25 2bl5 s LYS 130 Ca -0.36 0.68 -0.20 0.00 -1.00 0.00 0.00 55.97 55.08 2bl5 s LYS 130 Cb 0.13 -3.34 -0.00 0.00 -2.06 0.00 0.00 37.83 32.56 2bl5 s LYS 130 CO 0.52 0.39 0.62 -1.12 0.10 0.00 0.00 175.35 175.86 2bl5 s SER 131 N -0.23 6.44 0.02 0.03 0.01 -1.26 -4.51 113.70 114.20 2bl5 s SER 131 Ca 0.30 0.21 -0.27 0.00 1.31 0.00 0.00 55.95 57.50 2bl5 s SER 131 Cb -0.18 -2.32 -0.16 0.00 0.21 0.00 0.00 66.02 63.57 2bl5 s SER 131 CO 0.16 -0.55 1.27 -0.65 0.41 0.00 0.00 173.24 173.88 2bl5 h PRO 132 N 8.38 -0.70 0.00 12.44 0.11 -1.96 -3.42 132.00 146.84 2bl5 h PRO 132 Ca -0.27 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2bl5 h PRO 132 Cb 1.11 0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2bl5 h PRO 132 CO 0.82 -0.40 -0.10 0.00 -0.21 0.00 0.00 178.00 178.11 2bl5 n ALA 133 N -2.56 1.71 -3.66 -0.75 0.00 -1.26 -5.05 120.51 108.94 2bl5 n ALA 133 Ca -0.11 -0.24 -0.37 0.00 0.00 0.00 0.00 53.44 52.71 2bl5 n ALA 133 Cb 0.33 -0.10 -0.08 0.00 0.00 0.00 0.00 19.45 19.60 2bl5 n ALA 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bl5 s LEU 134 N 0.00 5.47 0.00 0.00 1.43 -1.26 -5.34 118.68 118.98 2bl5 s LEU 134 Ca 0.00 -3.12 0.00 0.00 -1.03 0.00 0.00 54.13 49.98 2bl5 s LEU 134 Cb 0.00 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.32 2bl5 s LEU 134 CO 0.00 -0.33 0.00 1.57 0.23 0.00 0.00 176.35 177.82