#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 2.11 -0.04 2.61 0.05 -0.29 -5.00 118.68 118.11 2bl5 s LEU 2 Ca 0.00 -0.29 0.03 0.00 0.05 0.00 0.00 54.13 53.92 2bl5 s LEU 2 Cb 0.00 -0.32 0.00 0.00 -2.05 0.00 0.00 46.19 43.83 2bl5 s LEU 2 CO 0.00 -0.01 -0.13 -1.10 -0.55 0.00 0.00 176.35 174.56 2bl5 s GLN 3 N -0.71 1.43 -0.13 1.48 -0.21 -1.26 -1.06 119.66 119.19 2bl5 s GLN 3 Ca -0.01 -0.44 0.02 0.00 0.02 0.00 0.00 55.36 54.95 2bl5 s GLN 3 Cb -0.05 -1.26 0.00 0.00 1.00 0.00 0.00 33.01 32.70 2bl5 s GLN 3 CO 0.00 0.14 -0.20 -1.21 -2.12 0.00 0.00 175.29 171.90 2bl5 s GLU 4 N 0.26 3.09 -0.24 2.91 2.02 -0.78 -4.98 118.70 120.98 2bl5 s GLU 4 Ca -0.06 -0.83 -0.03 0.00 0.02 0.00 0.00 54.97 54.07 2bl5 s GLU 4 Cb -0.11 -2.46 0.01 0.00 0.10 0.00 0.00 34.13 31.67 2bl5 s GLU 4 CO 0.02 0.05 -0.04 0.15 0.02 0.00 0.00 175.26 175.46 2bl5 s LYS 5 N 0.68 3.09 -0.55 1.61 3.01 -1.26 -1.11 119.74 125.21 2bl5 s LYS 5 Ca -0.10 -0.82 -0.15 0.00 -1.01 0.00 0.00 55.97 53.90 2bl5 s LYS 5 Cb -0.16 -3.02 0.13 0.00 -1.01 0.00 0.00 37.83 33.77 2bl5 s LYS 5 CO 0.01 -0.32 0.50 -0.51 0.51 0.00 0.00 175.35 175.55 2bl5 s LEU 6 N 1.41 6.17 0.25 3.17 1.43 0.11 -4.94 118.68 126.27 2bl5 s LEU 6 Ca 0.03 -1.86 -0.30 0.00 -1.03 0.00 0.00 54.13 50.98 2bl5 s LEU 6 Cb -0.16 -2.19 -0.09 0.00 0.03 0.00 0.00 46.19 43.79 2bl5 s LEU 6 CO -0.04 -0.83 1.11 -0.31 0.23 0.00 0.00 176.35 176.52 2bl5 s TYR 7 N 1.49 3.56 -0.19 0.29 1.51 -1.26 -1.62 117.35 121.13 2bl5 s TYR 7 Ca 0.04 1.64 -0.01 0.00 -1.01 0.00 0.00 57.07 57.73 2bl5 s TYR 7 Cb -0.28 -3.31 0.05 0.00 -0.11 0.00 0.00 41.96 38.31 2bl5 s TYR 7 CO 0.02 -0.66 -0.01 0.14 -1.11 0.00 0.00 175.55 173.93 2bl5 s VAL 8 N -0.84 0.87 -0.74 0.71 -7.23 -1.06 -4.95 120.40 107.17 2bl5 s VAL 8 Ca 0.47 -0.67 -0.26 0.00 -1.81 0.00 0.00 61.98 59.71 2bl5 s VAL 8 Cb -0.32 -1.22 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 2bl5 s VAL 8 CO 0.39 -0.07 1.97 -2.16 -0.31 0.00 0.00 175.10 174.93 2bl5 s PRO 9 N 1.71 2.49 0.62 4.82 0.04 -1.26 -4.41 135.00 139.01 2bl5 s PRO 9 Ca -0.01 0.28 0.40 0.00 0.04 0.00 0.00 61.00 61.71 2bl5 s PRO 9 Cb -0.17 -4.71 2.02 0.00 0.04 0.00 0.00 34.50 31.68 2bl5 s PRO 9 CO -0.07 -3.15 2.23 -0.24 0.04 0.00 0.00 177.00 175.80 2bl5 h VAL 10 N 7.15 0.05 -0.33 -0.36 3.04 -1.85 0.19 116.25 124.15 2bl5 h VAL 10 Ca -0.09 -0.20 -0.04 0.00 -1.01 0.00 0.00 66.70 65.35 2bl5 h VAL 10 Cb 1.09 1.19 -0.02 0.00 -2.01 0.00 0.00 31.29 31.55 2bl5 h VAL 10 CO 1.20 0.01 0.02 0.11 -1.01 0.00 0.00 177.57 177.89 2bl5 h LYS 11 N 0.00 0.50 0.09 4.17 1.57 -1.97 -2.78 116.57 118.15 2bl5 h LYS 11 Ca -0.00 -0.10 -0.26 0.00 -1.87 0.00 0.00 60.65 58.43 2bl5 h LYS 11 Cb 0.19 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 2bl5 h LYS 11 CO 0.00 0.51 -1.17 0.93 -0.57 0.00 0.00 179.45 179.16 2bl5 h GLU 12 N 0.48 0.20 -2.79 3.15 4.39 -1.01 -3.39 114.58 115.61 2bl5 h GLU 12 Ca 0.11 -0.34 -0.61 0.00 0.34 0.00 0.00 59.36 58.86 2bl5 h GLU 12 Cb 0.29 0.13 -0.42 0.00 -0.10 0.00 0.00 28.75 28.64 2bl5 h GLU 12 CO 0.01 1.16 -0.61 0.66 -1.16 0.00 0.00 179.01 179.07 2bl5 n TYR 13 N -3.49 3.10 0.25 4.33 4.02 -0.87 -4.90 117.16 119.59 2bl5 n TYR 13 Ca -0.06 -4.21 0.13 0.00 -0.01 0.00 0.00 57.90 53.74 2bl5 n TYR 13 Cb 0.99 -0.56 0.62 0.00 -0.02 0.00 0.00 39.34 40.38 2bl5 n TYR 13 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 2bl5 h PRO 14 N 5.04 0.00 0.00 -0.72 0.11 -1.72 -2.67 132.00 132.05 2bl5 h PRO 14 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2bl5 h PRO 14 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 2bl5 h PRO 14 CO 0.73 0.15 -0.99 -3.47 -0.21 0.00 0.00 178.00 174.21 2bl5 n ASP 15 N -3.42 0.64 -4.36 -2.05 -0.08 -1.26 -4.70 116.55 101.32 2bl5 n ASP 15 Ca -0.01 -0.34 -0.42 0.00 -1.51 0.00 0.00 54.79 52.51 2bl5 n ASP 15 Cb 0.33 0.80 -0.10 0.00 2.34 0.00 0.00 41.12 44.49 2bl5 n ASP 15 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 2bl5 s PHE 16 N -3.15 3.27 -0.79 -0.67 5.36 -1.01 -5.02 117.98 115.98 2bl5 s PHE 16 Ca 0.05 -1.05 -0.24 0.00 -0.96 0.00 0.00 56.93 54.73 2bl5 s PHE 16 Cb 0.15 -2.78 0.06 0.00 -0.34 0.00 0.00 43.02 40.11 2bl5 s PHE 16 CO 0.80 -0.73 1.20 0.54 -1.46 0.00 0.00 175.22 175.57 2bl5 s ASN 17 N 1.98 6.28 0.27 6.13 6.03 -1.26 -4.85 114.94 129.52 2bl5 s ASN 17 Ca 0.03 -0.99 -0.02 0.00 -1.03 0.00 0.00 52.86 50.85 2bl5 s ASN 17 Cb -0.21 -2.50 0.42 0.00 -3.03 0.00 0.00 41.25 35.93 2bl5 s ASN 17 CO 0.06 -1.56 1.90 -0.26 -2.03 0.00 0.00 177.10 175.20 2bl5 h PHE 18 N 9.70 1.17 -0.19 1.54 0.04 -1.92 0.45 116.94 127.75 2bl5 h PHE 18 Ca -0.14 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.64 2bl5 h PHE 18 Cb 1.05 -0.39 -0.01 0.00 2.20 0.00 0.00 35.95 38.80 2bl5 h PHE 18 CO 1.11 0.62 0.03 -0.39 -0.60 0.00 0.00 178.31 179.09 2bl5 h VAL 19 N 1.16 1.22 0.00 -0.55 -1.51 -1.89 0.78 116.25 115.47 2bl5 h VAL 19 Ca 0.42 -0.73 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 2bl5 h VAL 19 Cb 0.14 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 30.64 2bl5 h VAL 19 CO -0.16 0.22 0.00 0.61 -1.23 0.00 0.00 177.57 177.02 2bl5 n GLY 20 N -0.44 -0.82 0.13 5.19 0.00 -0.60 -0.37 105.19 108.29 2bl5 n GLY 20 Ca -0.04 0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 2bl5 n GLY 20 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2bl5 n ARG 21 N -1.86 0.61 -0.02 1.61 3.00 0.15 -3.63 116.66 116.52 2bl5 n ARG 21 Ca 0.00 0.24 -0.09 0.00 -0.00 0.00 0.00 57.85 58.01 2bl5 n ARG 21 Cb 0.07 -1.52 -0.07 0.00 0.00 0.00 0.00 32.46 30.94 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 -0.64 0.93 0.00 5.15 1.08 0.91 -3.37 117.51 121.57 2bl5 h ILE 22 Ca -0.64 -1.53 0.00 0.00 -0.39 0.00 0.00 64.86 62.30 2bl5 h ILE 22 Cb 1.71 1.70 0.00 0.00 -3.07 0.00 0.00 36.82 37.16 2bl5 h ILE 22 CO -0.29 0.29 -1.05 0.00 -0.69 0.00 0.00 178.15 176.42 2bl5 n LEU 23 N -4.77 0.66 0.00 1.44 -0.00 -0.53 -3.03 117.00 110.77 2bl5 n LEU 23 Ca -0.06 -0.40 0.00 0.00 -0.00 0.00 0.00 56.01 55.55 2bl5 n LEU 23 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.68 2bl5 n LEU 23 CO 0.21 0.17 0.12 0.61 -0.00 0.00 0.00 177.39 178.50 2bl5 n GLY 24 N 1.43 -2.26 0.05 1.47 0.00 0.50 -1.46 105.19 104.91 2bl5 n GLY 24 Ca 0.02 0.20 0.11 0.00 0.00 0.00 0.00 46.02 46.36 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 -0.38 0.34 -0.31 1.61 -0.04 -1.25 -4.32 135.00 130.66 2bl5 n PRO 25 Ca 0.00 0.02 0.08 0.00 -0.04 0.00 0.00 63.50 63.56 2bl5 n PRO 25 Cb 0.00 -1.64 0.18 0.00 -0.04 0.00 0.00 33.50 32.00 2bl5 n PRO 25 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2bl5 n ARG 26 N -2.09 1.61 0.26 0.54 5.12 -1.26 -4.71 116.66 116.13 2bl5 n ARG 26 Ca 0.02 -2.84 0.12 0.00 -1.93 0.00 0.00 57.85 53.21 2bl5 n ARG 26 Cb 0.46 -1.60 0.64 0.00 -1.16 0.00 0.00 32.46 30.80 2bl5 n ARG 26 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 2bl5 h GLY 27 N 0.55 0.00 -0.26 -0.13 0.00 -1.16 -1.80 103.07 100.28 2bl5 h GLY 27 Ca 0.02 0.00 0.22 0.00 0.00 0.00 0.00 47.33 47.57 2bl5 h GLY 27 CO 0.06 0.00 0.35 -2.00 0.00 0.00 0.00 176.54 174.95 2bl5 h LEU 28 N 0.00 0.24 -0.51 3.11 5.85 -1.84 -1.43 115.31 120.73 2bl5 h LEU 28 Ca 0.00 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 2bl5 h LEU 28 Cb 0.57 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 2bl5 h LEU 28 CO 0.00 -0.04 0.25 0.00 -0.34 0.00 0.00 178.44 178.31 2bl5 h THR 29 N 0.34 1.19 -0.87 1.05 1.03 -1.63 -0.99 112.91 113.04 2bl5 h THR 29 Ca 0.55 -0.54 0.00 0.00 -0.01 0.00 0.00 66.41 66.41 2bl5 h THR 29 Cb 1.07 0.61 -0.04 0.00 -1.07 0.00 0.00 68.15 68.71 2bl5 h THR 29 CO -0.56 0.21 0.55 0.00 -0.01 0.00 0.00 175.52 175.72 2bl5 h ALA 30 N 1.09 1.10 -0.28 0.00 0.00 -1.47 0.60 119.26 120.31 2bl5 h ALA 30 Ca 0.18 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 2bl5 h ALA 30 Cb 0.11 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2bl5 h ALA 30 CO -0.02 0.54 -0.38 -0.22 0.00 0.00 0.00 179.25 179.17 2bl5 h LYS 31 N 1.18 0.64 -0.11 0.00 1.63 -1.20 -2.77 116.57 115.93 2bl5 h LYS 31 Ca 0.31 -0.31 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 2bl5 h LYS 31 Cb -0.09 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.53 2bl5 h LYS 31 CO -0.06 0.91 -0.45 1.96 -3.45 0.00 0.00 179.45 178.35 2bl5 h GLN 32 N 0.53 0.27 -0.26 1.90 1.08 0.13 -2.12 115.11 116.63 2bl5 h GLN 32 Ca 0.05 -0.14 -0.09 0.00 -1.45 0.00 0.00 58.65 57.02 2bl5 h GLN 32 Cb 0.89 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.32 2bl5 h GLN 32 CO 0.08 0.67 -0.17 -0.07 -0.95 0.00 0.00 178.83 178.39 2bl5 h LEU 33 N 0.22 0.61 -0.53 1.46 3.38 -0.72 0.29 115.31 120.02 2bl5 h LEU 33 Ca 0.01 -0.43 -0.13 0.00 0.09 0.00 0.00 57.88 57.42 2bl5 h LEU 33 Cb 0.89 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2bl5 h LEU 33 CO 0.07 0.91 -0.20 1.05 0.09 0.00 0.00 178.44 180.36 2bl5 h GLU 34 N 0.30 0.98 -0.41 1.13 4.11 -1.23 0.48 114.58 119.94 2bl5 h GLU 34 Ca 0.05 -0.41 -0.07 0.00 0.07 0.00 0.00 59.36 59.00 2bl5 h GLU 34 Cb 0.70 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2bl5 h GLU 34 CO 0.05 1.08 -0.02 0.00 0.07 0.00 0.00 179.01 180.19 2bl5 h ALA 35 N 0.91 0.55 0.00 1.06 0.00 -1.27 -2.07 119.26 118.44 2bl5 h ALA 35 Ca 0.11 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 2bl5 h ALA 35 Cb 0.77 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2bl5 h ALA 35 CO 0.06 0.35 -0.59 0.93 0.00 0.00 0.00 179.25 180.00 2bl5 h GLU 36 N 0.56 0.00 0.00 0.00 4.39 -0.31 -3.38 114.58 115.84 2bl5 h GLU 36 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2bl5 h GLU 36 Cb 0.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2bl5 h GLU 36 CO 0.02 0.86 -0.20 1.79 -1.16 0.00 0.00 179.01 180.32 2bl5 h THR 37 N -1.00 0.00 0.00 1.13 1.35 -0.18 -3.46 112.91 110.75 2bl5 h THR 37 Ca -0.15 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 2bl5 h THR 37 Cb 1.03 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 2bl5 h THR 37 CO -0.09 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.79 2bl5 n GLY 38 N 1.20 0.81 3.31 5.82 0.00 -0.78 -4.77 105.19 110.77 2bl5 n GLY 38 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 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 1.47 3.33 -0.53 0.00 -2.85 0.05 -2.60 119.74 118.61 2bl5 s LYS 40 Ca 0.04 -0.91 -0.28 0.00 -1.00 0.00 0.00 55.97 53.81 2bl5 s LYS 40 Cb -0.16 -4.60 0.02 0.00 -2.06 0.00 0.00 37.83 31.04 2bl5 s LYS 40 CO -0.01 -1.99 1.26 -1.50 0.10 0.00 0.00 175.35 173.21 2bl5 s ILE 41 N 4.46 3.99 -0.13 3.79 2.07 -1.26 -2.54 121.20 131.58 2bl5 s ILE 41 Ca 0.33 0.93 -0.03 0.00 -1.41 0.00 0.00 60.65 60.47 2bl5 s ILE 41 Cb -0.08 -4.56 -0.03 0.00 0.13 0.00 0.00 42.46 37.91 2bl5 s ILE 41 CO 0.03 -1.14 -0.02 0.00 -1.91 0.00 0.00 174.94 171.90 2bl5 s MET 42 N 4.96 3.46 -0.07 3.50 0.23 0.13 -4.90 119.30 126.61 2bl5 s MET 42 Ca 0.49 -0.47 -0.28 0.00 -1.03 0.00 0.00 55.69 54.40 2bl5 s MET 42 Cb -0.09 -2.90 -0.02 0.00 -1.53 0.00 0.00 34.83 30.29 2bl5 s MET 42 CO 0.28 0.40 0.94 0.08 -2.03 0.00 0.00 175.02 174.69 2bl5 s VAL 43 N -0.06 4.86 0.34 5.16 1.01 -1.26 -1.42 120.40 129.02 2bl5 s VAL 43 Ca 0.03 1.93 0.08 0.00 0.00 0.00 0.00 61.98 64.01 2bl5 s VAL 43 Cb -0.13 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 2bl5 s VAL 43 CO 0.02 0.09 0.21 -0.13 0.00 0.00 0.00 175.10 175.29 2bl5 s ARG 44 N 1.52 2.54 0.00 2.72 1.81 0.15 -4.62 118.95 123.07 2bl5 s ARG 44 Ca 0.47 -1.42 0.00 0.00 -1.72 0.00 0.00 55.73 53.06 2bl5 s ARG 44 Cb -0.19 -2.32 0.00 0.00 -0.45 0.00 0.00 34.95 31.99 2bl5 s ARG 44 CO 0.21 0.11 0.00 0.41 -0.68 0.00 0.00 175.30 175.35 2bl5 n GLY 45 N -1.25 -1.19 3.63 -3.53 0.00 -0.53 0.30 105.19 102.63 2bl5 n GLY 45 Ca -0.03 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.45 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 4.11 0.00 1.61 -2.85 -1.24 -3.58 119.74 117.79 2bl5 s LYS 46 Ca 0.00 0.81 0.00 0.00 -1.00 0.00 0.00 55.97 55.78 2bl5 s LYS 46 Cb 0.00 -3.67 0.00 0.00 -2.06 0.00 0.00 37.83 32.10 2bl5 s LYS 46 CO 0.00 -0.57 0.00 0.41 0.10 0.00 0.00 175.35 175.29 2bl5 n GLY 47 N 3.92 1.65 0.19 0.59 0.00 -1.26 -4.79 105.19 105.49 2bl5 n GLY 47 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 2bl5 n GLY 47 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2bl5 h SER 48 N 0.00 -0.36 -0.19 1.61 0.02 -1.82 -3.39 113.55 109.42 2bl5 h SER 48 Ca 0.00 0.01 -0.17 0.00 -0.84 0.00 0.00 61.79 60.79 2bl5 h SER 48 Cb 0.00 0.09 -0.20 0.00 0.14 0.00 0.00 62.40 62.44 2bl5 h SER 48 CO 0.00 -0.07 -0.72 0.23 -1.14 0.00 0.00 176.83 175.13 2bl5 n MET 49 N -4.25 1.70 0.00 3.45 2.81 -1.26 -4.94 117.12 114.63 2bl5 n MET 49 Ca -0.05 -3.24 0.00 0.00 -1.81 0.00 0.00 57.70 52.60 2bl5 n MET 49 Cb 0.17 -1.43 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 2bl5 n MET 49 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2bl5 n ARG 50 N -0.67 0.19 -2.72 0.03 5.12 -1.26 -4.74 116.66 112.60 2bl5 n ARG 50 Ca 0.21 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.72 2bl5 n ARG 50 Cb 0.85 -1.29 -0.05 0.00 -1.16 0.00 0.00 32.46 30.81 2bl5 n ARG 50 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2bl5 s ASP 51 N 0.33 7.53 0.32 0.55 -1.08 -1.26 -4.94 116.67 118.12 2bl5 s ASP 51 Ca 0.00 1.85 0.04 0.00 -0.52 0.00 0.00 52.55 53.92 2bl5 s ASP 51 Cb 0.00 -2.59 0.66 0.00 -1.46 0.00 0.00 42.92 39.53 2bl5 s ASP 51 CO 0.00 -0.02 1.86 0.11 0.52 0.00 0.00 175.17 177.65 2bl5 h LYS 52 N 5.20 0.84 -0.16 4.34 1.57 -2.00 0.12 116.57 126.48 2bl5 h LYS 52 Ca -0.43 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.27 2bl5 h LYS 52 Cb 1.21 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 2bl5 h LYS 52 CO 0.71 0.56 0.00 1.57 -0.57 0.00 0.00 179.45 181.72 2bl5 h LYS 53 N 0.87 0.23 0.07 3.15 2.10 -1.95 -2.22 116.57 118.83 2bl5 h LYS 53 Ca 0.46 -0.03 -0.26 0.00 -2.00 0.00 0.00 60.65 58.82 2bl5 h LYS 53 Cb 0.54 -0.04 0.01 0.00 -0.90 0.00 0.00 32.23 31.83 2bl5 h LYS 53 CO -0.22 0.25 -1.11 -0.22 -2.00 0.00 0.00 179.45 176.15 2bl5 h LYS 54 N 0.23 0.38 0.00 0.07 3.64 -1.08 0.12 116.57 119.93 2bl5 h LYS 54 Ca 0.06 -0.51 -0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2bl5 h LYS 54 Cb 0.15 0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2bl5 h LYS 54 CO 0.00 1.19 -0.01 0.93 -2.27 0.00 0.00 179.45 179.29 2bl5 h GLU 55 N 0.17 0.00 0.11 1.90 5.08 -0.94 0.90 114.58 121.80 2bl5 h GLU 55 Ca -0.12 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 57.93 2bl5 h GLU 55 Cb 1.79 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.03 2bl5 h GLU 55 CO 0.19 0.01 -1.62 0.93 -1.00 0.00 0.00 179.01 177.53 2bl5 h GLU 56 N 0.00 0.23 0.04 2.33 5.08 -1.10 -3.31 114.58 117.86 2bl5 h GLU 56 Ca -0.00 -0.39 -0.36 0.00 -1.00 0.00 0.00 59.36 57.60 2bl5 h GLU 56 Cb 0.03 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 2bl5 h GLU 56 CO 0.00 1.19 -2.09 0.00 -1.00 0.00 0.00 179.01 177.11 2bl5 n GLN 57 N -3.82 0.66 -0.82 2.33 10.64 -0.00 -4.31 117.38 122.06 2bl5 n GLN 57 Ca -0.28 0.29 0.07 0.00 -1.83 0.00 0.00 57.00 55.25 2bl5 n GLN 57 Cb 0.93 -1.63 0.38 0.00 -0.86 0.00 0.00 30.24 29.07 2bl5 n GLN 57 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2bl5 n ASN 58 N -3.74 5.40 -4.48 2.61 4.13 0.30 -5.00 115.26 114.48 2bl5 n ASN 58 Ca -0.40 -2.96 -0.47 0.00 1.68 0.00 0.00 54.58 52.43 2bl5 n ASN 58 Cb 0.93 -0.66 -0.02 0.00 -1.54 0.00 0.00 39.78 38.49 2bl5 n ASN 58 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 2bl5 n ARG 59 N 0.39 0.54 -0.31 3.52 1.85 -0.26 -1.91 116.66 120.48 2bl5 n ARG 59 Ca 0.27 0.19 0.00 0.00 -1.00 0.00 0.00 57.85 57.31 2bl5 n ARG 59 Cb 1.15 -1.34 0.00 0.00 -1.05 0.00 0.00 32.46 31.22 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 1.69 2.19 3.92 2.89 0.00 -1.26 -5.01 105.19 109.62 2bl5 n GLY 60 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.02 2.85 0.16 1.61 -0.14 -0.80 -4.57 119.74 118.83 2bl5 s LYS 61 Ca 0.00 -0.08 0.12 0.00 -1.36 0.00 0.00 55.97 54.65 2bl5 s LYS 61 Cb 0.00 -2.28 0.54 0.00 -1.68 0.00 0.00 37.83 34.41 2bl5 s LYS 61 CO 0.00 -0.72 0.56 -2.30 -0.76 0.00 0.00 175.35 172.13 2bl5 n PRO 62 N -2.58 -0.01 -0.12 -1.68 -0.02 -1.26 0.72 135.00 130.05 2bl5 n PRO 62 Ca 0.05 0.45 -0.05 0.00 -2.02 0.00 0.00 63.50 61.92 2bl5 n PRO 62 Cb 0.58 -0.89 0.14 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 0.80 0.68 2.55 2.35 -1.91 -1.69 115.58 118.35 2bl5 h ASN 63 Ca 0.32 -0.21 -0.10 0.00 -0.55 0.00 0.00 56.30 55.76 2bl5 h ASN 63 Cb 1.04 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.18 2bl5 h ASN 63 CO -0.16 0.88 -1.40 0.79 -1.65 0.00 0.00 177.43 175.89 2bl5 n TRP 64 N -4.20 0.81 -0.07 1.19 5.03 0.22 -2.36 117.44 118.07 2bl5 n TRP 64 Ca 0.02 0.26 -0.07 0.00 3.03 0.00 0.00 57.50 60.74 2bl5 n TRP 64 Cb 0.32 -0.97 -0.01 0.00 -1.03 0.00 0.00 31.31 29.61 2bl5 n TRP 64 CO 0.00 0.00 0.00 1.49 -0.03 0.00 0.00 177.69 179.15 2bl5 h GLU 65 N 0.00 -0.20 -0.11 -0.99 4.22 -0.48 -2.16 114.58 114.86 2bl5 h GLU 65 Ca -0.11 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.34 2bl5 h GLU 65 Cb 1.36 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.66 2bl5 h GLU 65 CO 0.02 -0.14 0.00 -2.39 -2.18 0.00 0.00 179.01 174.33 2bl5 n HIS 66 N -5.38 0.12 0.23 0.92 1.44 -0.70 -4.07 115.22 107.79 2bl5 n HIS 66 Ca 0.00 -0.06 0.06 0.00 -2.01 0.00 0.00 57.72 55.71 2bl5 n HIS 66 Cb 0.29 0.00 0.56 0.00 0.12 0.00 0.00 29.99 30.96 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 4.09 0.02 -0.75 2.39 7.12 -0.99 0.21 115.31 127.39 2bl5 h LEU 67 Ca 0.00 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 2bl5 h LEU 67 Cb 0.88 -0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.00 2bl5 h LEU 67 CO 0.00 0.11 0.00 -0.46 -0.13 0.00 0.00 178.44 177.96 2bl5 n ASN 68 N -4.42 1.15 -4.13 1.25 0.23 -1.23 -3.99 115.26 104.12 2bl5 n ASN 68 Ca -0.03 -1.45 -0.15 0.00 -0.53 0.00 0.00 54.58 52.43 2bl5 n ASN 68 Cb 0.17 -0.02 0.04 0.00 -2.08 0.00 0.00 39.78 37.89 2bl5 n ASN 68 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2bl5 n GLU 69 N -0.08 0.74 -3.71 -3.83 -0.58 -0.05 -5.06 120.64 108.08 2bl5 n GLU 69 Ca 0.19 -2.32 -0.36 0.00 -0.42 0.00 0.00 57.16 54.25 2bl5 n GLU 69 Cb 0.28 -0.11 -0.06 0.00 -0.57 0.00 0.00 31.44 30.99 2bl5 n GLU 69 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2bl5 s ASP 70 N -3.58 6.56 -0.23 1.62 2.15 -1.26 -3.64 116.67 118.28 2bl5 s ASP 70 Ca 0.41 0.66 -0.34 0.00 0.43 0.00 0.00 52.55 53.71 2bl5 s ASP 70 Cb -0.03 -2.13 -0.11 0.00 -0.30 0.00 0.00 42.92 40.35 2bl5 s ASP 70 CO 0.26 0.30 2.05 -0.11 -0.17 0.00 0.00 175.17 177.50 2bl5 n LEU 71 N 1.47 2.78 -3.84 -1.34 7.94 -1.26 -3.78 117.00 118.97 2bl5 n LEU 71 Ca -0.14 0.63 -0.10 0.00 -1.11 0.00 0.00 56.01 55.30 2bl5 n LEU 71 Cb 0.53 -1.33 -0.08 0.00 0.53 0.00 0.00 43.42 43.07 2bl5 n LEU 71 CO 0.38 -0.47 -0.08 -1.38 -1.11 0.00 0.00 177.39 174.73 2bl5 s HIS 72 N 6.03 0.07 -0.21 1.96 -3.43 0.15 -2.56 115.29 117.30 2bl5 s HIS 72 Ca 1.02 -0.36 -0.14 0.00 -0.80 0.00 0.00 55.06 54.78 2bl5 s HIS 72 Cb -0.74 -0.02 -0.04 0.00 -1.43 0.00 0.00 32.58 30.34 2bl5 s HIS 72 CO 0.49 -0.48 0.30 0.14 -2.00 0.00 0.00 174.74 173.20 2bl5 s VAL 73 N -3.03 5.27 -0.17 -5.38 -7.23 -0.64 0.30 120.40 109.51 2bl5 s VAL 73 Ca -0.01 0.51 0.01 0.00 -1.81 0.00 0.00 61.98 60.67 2bl5 s VAL 73 Cb 0.01 -3.64 0.03 0.00 0.56 0.00 0.00 36.38 33.34 2bl5 s VAL 73 CO -0.06 0.30 -0.12 -0.22 -0.31 0.00 0.00 175.10 174.69 2bl5 s LEU 74 N 1.10 1.98 -0.46 1.32 0.20 -0.51 0.04 118.68 122.35 2bl5 s LEU 74 Ca 0.15 -0.69 -0.27 0.00 0.69 0.00 0.00 54.13 54.01 2bl5 s LEU 74 Cb -0.14 -1.20 0.03 0.00 -0.43 0.00 0.00 46.19 44.45 2bl5 s LEU 74 CO 0.06 -0.10 0.99 0.27 -0.29 0.00 0.00 176.35 177.28 2bl5 s ILE 75 N 1.44 4.39 -0.34 6.68 -4.36 -0.26 0.17 121.20 128.93 2bl5 s ILE 75 Ca 0.02 0.93 -0.11 0.00 -0.26 0.00 0.00 60.65 61.23 2bl5 s ILE 75 Cb -0.15 -4.48 -0.00 0.00 1.25 0.00 0.00 42.46 39.08 2bl5 s ILE 75 CO -0.09 -0.87 0.19 -0.89 0.24 0.00 0.00 174.94 173.51 2bl5 s THR 76 N 3.97 4.79 -0.23 8.37 2.01 -1.05 -1.87 115.64 131.63 2bl5 s THR 76 Ca 0.41 -0.47 -0.00 0.00 0.31 0.00 0.00 61.69 61.93 2bl5 s THR 76 Cb -0.09 -3.51 0.03 0.00 0.01 0.00 0.00 72.50 68.94 2bl5 s THR 76 CO 0.28 -0.03 -0.11 0.54 -0.69 0.00 0.00 174.62 174.60 2bl5 s VAL 77 N 1.63 2.56 -0.70 3.82 0.11 -0.23 -0.77 120.40 126.83 2bl5 s VAL 77 Ca 0.04 -1.03 -0.14 0.00 -2.93 0.00 0.00 61.98 57.92 2bl5 s VAL 77 Cb -0.18 -2.25 0.18 0.00 -1.53 0.00 0.00 36.38 32.60 2bl5 s VAL 77 CO 0.08 0.30 0.64 -1.61 -3.33 0.00 0.00 175.10 171.18 2bl5 s GLU 78 N 1.30 3.30 0.01 1.54 2.02 -1.26 -1.14 118.70 124.47 2bl5 s GLU 78 Ca 0.01 -2.16 -0.08 0.00 0.02 0.00 0.00 54.97 52.76 2bl5 s GLU 78 Cb -0.16 -4.34 0.03 0.00 0.10 0.00 0.00 34.13 29.76 2bl5 s GLU 78 CO -0.07 -1.30 0.36 -3.47 0.02 0.00 0.00 175.26 170.80 2bl5 n ASP 79 N 4.47 -0.41 0.00 -0.19 2.03 -1.26 -5.00 116.55 116.19 2bl5 n ASP 79 Ca 0.02 -1.13 0.00 0.00 0.52 0.00 0.00 54.79 54.20 2bl5 n ASP 79 Cb 0.44 0.64 0.00 0.00 -0.72 0.00 0.00 41.12 41.48 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 -2.37 -0.19 0.00 -1.67 0.00 -1.26 -4.62 120.51 110.40 2bl5 n ALA 80 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2bl5 n ALA 80 Cb 0.17 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2bl5 n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bl5 n GLN 81 N -1.14 0.00 0.22 0.00 10.64 -1.26 -4.87 117.38 120.96 2bl5 n GLN 81 Ca 0.00 0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 55.03 2bl5 n GLN 81 Cb 0.00 0.00 -0.07 0.00 -0.86 0.00 0.00 30.24 29.31 2bl5 n GLN 81 CO 0.00 0.00 0.00 -0.97 -1.83 0.00 0.00 177.06 174.26 2bl5 h ASN 82 N 0.00 -1.04 0.14 2.61 -0.73 -1.98 0.52 115.58 115.10 2bl5 h ASN 82 Ca 0.00 0.08 -0.20 0.00 1.87 0.00 0.00 56.30 58.06 2bl5 h ASN 82 Cb 0.00 0.34 -0.00 0.00 0.27 0.00 0.00 38.32 38.93 2bl5 h ASN 82 CO 0.00 -0.50 -0.75 -0.09 -0.37 0.00 0.00 177.43 175.73 2bl5 h ARG 83 N -0.75 0.51 -0.18 6.67 2.43 -1.99 -2.55 114.38 118.52 2bl5 h ARG 83 Ca -0.05 -0.42 -0.04 0.00 -0.81 0.00 0.00 59.98 58.66 2bl5 h ARG 83 Cb 0.65 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 2bl5 h ARG 83 CO -0.05 1.05 -0.03 0.00 -1.51 0.00 0.00 179.97 179.43 2bl5 h ALA 84 N 0.83 0.25 -0.12 2.80 0.00 -1.79 -1.52 119.26 119.69 2bl5 h ALA 84 Ca -0.04 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 2bl5 h ALA 84 Cb 1.34 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2bl5 h ALA 84 CO 0.14 -0.00 -0.21 1.05 0.00 0.00 0.00 179.25 180.23 2bl5 h GLU 85 N 0.06 0.21 -0.32 0.00 4.11 0.00 0.17 114.58 118.81 2bl5 h GLU 85 Ca 0.05 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.41 2bl5 h GLU 85 Cb 0.45 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2bl5 h GLU 85 CO 0.01 0.42 0.17 1.25 0.07 0.00 0.00 179.01 180.93 2bl5 h LEU 86 N 0.19 0.40 -0.30 3.06 5.85 -1.22 -0.06 115.31 123.23 2bl5 h LEU 86 Ca 0.03 -0.10 -0.19 0.00 0.84 0.00 0.00 57.88 58.46 2bl5 h LEU 86 Cb 0.48 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2bl5 h LEU 86 CO 0.03 0.39 -0.62 0.50 -0.34 0.00 0.00 178.44 178.40 2bl5 h LYS 87 N 0.39 0.78 -0.15 1.25 3.64 -0.51 -3.00 116.57 118.98 2bl5 h LYS 87 Ca 0.11 -0.54 -0.13 0.00 -1.27 0.00 0.00 60.65 58.82 2bl5 h LYS 87 Cb 0.08 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2bl5 h LYS 87 CO -0.02 1.16 -0.46 1.37 -2.27 0.00 0.00 179.45 179.23 2bl5 h LEU 88 N 0.58 0.40 -0.49 5.20 8.10 -0.64 -2.73 115.31 125.73 2bl5 h LEU 88 Ca -0.01 -0.19 -0.10 0.00 0.11 0.00 0.00 57.88 57.70 2bl5 h LEU 88 Cb 1.22 -0.11 -0.02 0.00 -0.44 0.00 0.00 40.66 41.31 2bl5 h LEU 88 CO 0.13 0.81 -0.07 0.07 -4.11 0.00 0.00 178.44 175.27 2bl5 h LYS 89 N 0.30 0.92 -0.53 0.17 2.10 -0.95 0.64 116.57 119.23 2bl5 h LYS 89 Ca 0.02 -0.33 -0.12 0.00 -2.00 0.00 0.00 60.65 58.22 2bl5 h LYS 89 Cb 0.93 -0.06 -0.02 0.00 -0.90 0.00 0.00 32.23 32.18 2bl5 h LYS 89 CO 0.08 0.98 -0.13 0.07 -2.00 0.00 0.00 179.45 178.45 2bl5 h ARG 90 N 0.78 1.02 -0.29 0.07 0.11 -1.53 0.27 114.38 114.81 2bl5 h ARG 90 Ca 0.13 -0.39 -0.05 0.00 0.10 0.00 0.00 59.98 59.77 2bl5 h ARG 90 Cb 0.62 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 31.63 2bl5 h ARG 90 CO 0.04 1.08 -0.03 0.00 0.10 0.00 0.00 179.97 181.15 2bl5 h ALA 91 N 0.93 0.39 0.00 0.08 0.00 -1.18 -2.55 119.26 116.93 2bl5 h ALA 91 Ca 0.13 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2bl5 h ALA 91 Cb 0.70 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2bl5 h ALA 91 CO 0.05 0.17 -0.41 -0.24 0.00 0.00 0.00 179.25 178.83 2bl5 h VAL 92 N 0.30 1.10 -0.44 0.00 3.04 0.40 -1.75 116.25 118.90 2bl5 h VAL 92 Ca 0.08 -1.49 -0.03 0.00 -1.01 0.00 0.00 66.70 64.25 2bl5 h VAL 92 Cb 0.49 1.85 -0.02 0.00 -2.01 0.00 0.00 31.29 31.59 2bl5 h VAL 92 CO 0.02 0.40 0.15 -0.33 -1.01 0.00 0.00 177.57 176.80 2bl5 h GLU 93 N 0.00 0.63 -0.73 4.17 5.08 -0.25 0.56 114.58 124.05 2bl5 h GLU 93 Ca -0.00 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 2bl5 h GLU 93 Cb 0.82 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.92 2bl5 h GLU 93 CO 0.05 0.54 0.22 0.93 -1.00 0.00 0.00 179.01 179.76 2bl5 h GLU 94 N 0.63 1.13 -0.27 2.33 5.08 -0.92 -1.93 114.58 120.63 2bl5 h GLU 94 Ca 0.15 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 2bl5 h GLU 94 Cb 0.17 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2bl5 h GLU 94 CO -0.01 0.96 -0.19 0.28 -1.00 0.00 0.00 179.01 179.05 2bl5 h VAL 95 N 1.08 1.25 -0.78 3.13 2.07 -0.85 -2.31 116.25 119.84 2bl5 h VAL 95 Ca 0.23 -1.14 0.12 0.00 0.82 0.00 0.00 66.70 66.73 2bl5 h VAL 95 Cb 0.31 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2bl5 h VAL 95 CO -0.01 0.37 0.51 0.11 0.02 0.00 0.00 177.57 178.57 2bl5 h LYS 96 N 0.43 0.58 0.18 1.57 1.57 0.86 0.67 116.57 122.44 2bl5 h LYS 96 Ca 0.07 -0.03 -0.31 0.00 -1.87 0.00 0.00 60.65 58.51 2bl5 h LYS 96 Cb 0.58 -0.13 0.02 0.00 0.08 0.00 0.00 32.23 32.78 2bl5 h LYS 96 CO 0.04 0.38 -1.35 -0.22 -0.57 0.00 0.00 179.45 177.73 2bl5 h LYS 97 N 0.59 0.43 0.00 3.15 3.64 -1.14 -2.94 116.57 120.31 2bl5 h LYS 97 Ca 0.37 -0.71 -0.01 0.00 -1.27 0.00 0.00 60.65 59.02 2bl5 h LYS 97 Cb 0.62 0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.70 2bl5 h LYS 97 CO -0.14 1.34 -0.07 -0.07 -2.27 0.00 0.00 179.45 178.24 2bl5 h LEU 98 N 0.13 0.00 0.12 5.20 -0.00 -0.76 -3.04 115.31 116.95 2bl5 h LEU 98 Ca -0.20 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.68 2bl5 h LEU 98 Cb 2.05 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.71 2bl5 h LEU 98 CO 0.24 0.07 -0.06 -0.07 -0.00 0.00 0.00 178.44 178.62 2bl5 h LEU 99 N 0.00 -0.13 -9.56 1.67 3.38 0.50 -3.45 115.31 107.72 2bl5 h LEU 99 Ca -0.00 -0.12 -0.57 0.00 0.09 0.00 0.00 57.88 57.28 2bl5 h LEU 99 Cb 0.18 0.03 0.06 0.00 0.09 0.00 0.00 40.66 41.03 2bl5 h LEU 99 CO 0.01 0.04 0.81 0.52 0.09 0.00 0.00 178.44 179.91 2bl5 n VAL 100 N -5.09 0.22 -0.05 1.22 0.31 -1.15 -4.81 118.33 108.98 2bl5 n VAL 100 Ca -0.08 -0.05 0.25 0.00 -0.01 0.00 0.00 64.34 64.44 2bl5 n VAL 100 Cb 0.14 -1.62 0.71 0.00 -0.91 0.00 0.00 33.84 32.16 2bl5 n VAL 100 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2bl5 h PRO 101 N 5.70 0.00 0.00 5.55 0.13 -1.90 -3.44 132.00 138.03 2bl5 h PRO 101 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2bl5 h PRO 101 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2bl5 h PRO 101 CO 0.87 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.64 2bl5 n ALA 102 N -2.48 0.00 1.02 -0.56 0.00 -1.26 -4.56 120.51 112.67 2bl5 n ALA 102 Ca 0.14 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.60 2bl5 n ALA 102 Cb 0.86 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.41 2bl5 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bl5 n ALA 103 N 0.00 2.63 0.00 0.00 0.00 -1.26 -4.91 120.51 116.97 2bl5 n ALA 103 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2bl5 n ALA 103 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2bl5 n ALA 103 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2bl5 n GLU 104 N 0.12 0.00 0.00 0.00 4.07 -1.26 -4.42 120.64 119.15 2bl5 n GLU 104 Ca 0.07 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.17 2bl5 n GLU 104 Cb 0.30 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.68 2bl5 n GLU 104 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2bl5 n GLY 105 N 0.00 1.80 3.45 8.31 0.00 -1.26 -4.98 105.19 112.51 2bl5 n GLY 105 Ca 0.00 -0.67 -0.47 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 0.67 0.00 1.61 1.02 -1.26 -0.70 120.64 121.98 2bl5 n GLU 106 Ca 0.00 0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 2bl5 n GLU 106 Cb 0.00 -2.27 0.00 0.00 -0.02 0.00 0.00 31.44 29.15 2bl5 n GLU 106 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2bl5 n ASP 107 N 10.70 0.00 0.12 1.62 9.92 -1.26 -4.61 116.55 133.04 2bl5 n ASP 107 Ca 0.48 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.77 2bl5 n ASP 107 Cb 0.20 -0.07 0.41 0.00 -0.64 0.00 0.00 41.12 41.03 2bl5 n ASP 107 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 2bl5 h SER 108 N 0.00 0.22 -0.75 -2.24 0.87 -1.53 -1.14 113.55 108.97 2bl5 h SER 108 Ca 0.00 -0.04 0.09 0.00 -1.23 0.00 0.00 61.79 60.61 2bl5 h SER 108 Cb 0.00 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 61.85 2bl5 h SER 108 CO 0.00 0.34 0.50 -0.07 -0.53 0.00 0.00 176.83 177.07 2bl5 h LEU 109 N 0.23 0.62 0.01 2.23 3.38 -1.12 0.46 115.31 121.12 2bl5 h LEU 109 Ca 0.05 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2bl5 h LEU 109 Cb 0.31 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2bl5 h LEU 109 CO 0.02 0.38 -0.01 0.50 0.09 0.00 0.00 178.44 179.42 2bl5 h LYS 110 N 0.69 -0.01 -0.57 1.13 1.63 -1.51 -3.08 116.57 114.86 2bl5 h LYS 110 Ca 0.34 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 60.10 2bl5 h LYS 110 Cb 0.42 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.03 2bl5 h LYS 110 CO -0.12 0.77 0.17 0.87 -3.45 0.00 0.00 179.45 177.69 2bl5 h LYS 111 N -0.94 0.89 0.00 1.90 1.79 -1.06 -2.68 116.57 116.47 2bl5 h LYS 111 Ca -0.00 -0.19 -0.03 0.00 -2.18 0.00 0.00 60.65 58.25 2bl5 h LYS 111 Cb 0.80 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.32 2bl5 h LYS 111 CO 0.00 0.80 -0.14 0.52 -1.08 0.00 0.00 179.45 179.56 2bl5 h MET 112 N 0.80 0.00 -0.06 3.15 2.86 -0.22 -1.66 114.93 119.80 2bl5 h MET 112 Ca 0.18 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.64 2bl5 h MET 112 Cb 0.29 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2bl5 h MET 112 CO -0.01 0.14 -0.75 -0.22 1.06 0.00 0.00 176.91 177.13 2bl5 h LYS 113 N 0.00 0.35 0.00 1.72 3.11 -1.38 0.33 116.57 120.69 2bl5 h LYS 113 Ca -0.00 -0.30 0.00 0.00 -2.81 0.00 0.00 60.65 57.54 2bl5 h LYS 113 Cb 0.67 0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.97 2bl5 h LYS 113 CO 0.02 0.95 -0.08 -0.07 -2.81 0.00 0.00 179.45 177.45 2bl5 h LEU 114 N 0.23 0.00 0.00 5.20 3.38 -1.23 -3.40 115.31 119.49 2bl5 h LEU 114 Ca -0.03 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.58 2bl5 h LEU 114 Cb 1.33 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.03 2bl5 h LEU 114 CO 0.13 0.24 -2.09 0.80 0.09 0.00 0.00 178.44 177.61 2bl5 n MET 115 N -3.14 0.57 0.04 1.13 1.56 -0.67 -4.48 117.12 112.14 2bl5 n MET 115 Ca -0.01 0.32 0.05 0.00 -0.27 0.00 0.00 57.70 57.79 2bl5 n MET 115 Cb 0.04 -1.54 0.23 0.00 2.15 0.00 0.00 33.22 34.10 2bl5 n MET 115 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 2bl5 n GLU 116 N -4.32 0.04 0.07 2.12 -0.58 -1.14 -2.49 120.64 114.35 2bl5 n GLU 116 Ca -0.45 0.46 0.08 0.00 -0.42 0.00 0.00 57.16 56.83 2bl5 n GLU 116 Cb 0.79 -1.62 0.52 0.00 -0.57 0.00 0.00 31.44 30.57 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 0.27 -2.32 -4.62 7.12 -0.57 -3.47 115.31 111.72 2bl5 h LEU 117 Ca 0.00 -0.00 -0.22 0.00 0.13 0.00 0.00 57.88 57.78 2bl5 h LEU 117 Cb 0.09 -0.06 0.16 0.00 -0.53 0.00 0.00 40.66 40.31 2bl5 h LEU 117 CO 0.00 0.19 -0.68 0.00 -0.13 0.00 0.00 178.44 177.82 2bl5 n ALA 118 N -2.51 -1.99 -1.14 1.25 0.00 -1.04 -4.98 120.51 110.11 2bl5 n ALA 118 Ca 0.03 0.07 -0.31 0.00 0.00 0.00 0.00 53.44 53.23 2bl5 n ALA 118 Cb 0.15 -4.06 0.11 0.00 0.00 0.00 0.00 19.45 15.65 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 -3.31 3.02 -0.94 0.00 -0.00 -1.26 -4.85 121.20 113.87 2bl5 s ILE 119 Ca 0.27 0.33 -0.24 0.00 -0.00 0.00 0.00 60.65 61.01 2bl5 s ILE 119 Cb -0.04 -2.72 0.00 0.00 -0.00 0.00 0.00 42.46 39.71 2bl5 s ILE 119 CO 0.60 -0.43 1.68 -0.76 -0.00 0.00 0.00 174.94 176.02 2bl5 s LEU 120 N -6.09 3.33 -0.02 0.37 2.01 -1.26 -4.67 118.68 112.35 2bl5 s LEU 120 Ca 0.62 -0.98 0.07 0.00 0.01 0.00 0.00 54.13 53.84 2bl5 s LEU 120 Cb -0.18 -2.56 0.17 0.00 0.01 0.00 0.00 46.19 43.62 2bl5 s LEU 120 CO 0.57 -2.10 1.13 -0.46 1.01 0.00 0.00 176.35 176.50 2bl5 n ASN 121 N 11.29 2.49 0.00 2.29 0.23 -1.26 -4.99 115.26 125.31 2bl5 n ASN 121 Ca 0.34 -2.15 0.00 0.00 -0.53 0.00 0.00 54.58 52.24 2bl5 n ASN 121 Cb 0.49 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 38.04 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 -0.20 2.88 0.18 4.83 0.00 -1.26 -4.82 105.19 106.80 2bl5 n GLY 122 Ca 0.07 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 0.71 -3.48 2.61 2.02 -1.94 -3.30 112.91 109.52 2bl5 h THR 123 Ca 0.00 0.00 -0.71 0.00 0.77 0.00 0.00 66.41 66.47 2bl5 h THR 123 Cb 0.00 0.71 -0.34 0.00 -1.74 0.00 0.00 68.15 66.77 2bl5 h THR 123 CO 0.00 0.00 -0.21 -0.31 0.37 0.00 0.00 175.52 175.37 2bl5 s TYR 124 N -6.13 3.63 -1.34 3.16 2.02 -1.26 -4.82 117.35 112.61 2bl5 s TYR 124 Ca -0.15 -2.78 0.26 0.00 -0.37 0.00 0.00 57.07 54.03 2bl5 s TYR 124 Cb 0.05 -3.28 0.65 0.00 -0.40 0.00 0.00 41.96 38.99 2bl5 s TYR 124 CO 0.65 -0.81 1.51 -2.13 -1.57 0.00 0.00 175.55 173.19 2bl5 n ARG 125 N 3.04 0.37 0.03 -0.62 0.63 -1.25 -3.80 116.66 115.07 2bl5 n ARG 125 Ca 0.14 -0.21 0.05 0.00 -0.92 0.00 0.00 57.85 56.90 2bl5 n ARG 125 Cb 0.38 -1.50 0.45 0.00 0.45 0.00 0.00 32.46 32.25 2bl5 n ARG 125 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 2bl5 h ASP 126 N 0.52 0.42 0.00 6.15 3.58 -1.92 -1.76 116.42 123.41 2bl5 h ASP 126 Ca 0.00 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.44 2bl5 h ASP 126 Cb 0.50 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2bl5 h ASP 126 CO 0.00 0.30 0.00 0.00 -2.88 0.00 0.00 179.24 176.66 2bl5 n ALA 127 N -2.48 2.36 -0.06 -0.78 0.00 -1.25 -2.81 120.51 115.48 2bl5 n ALA 127 Ca 0.03 -0.07 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 2bl5 n ALA 127 Cb 0.07 -1.18 0.07 0.00 0.00 0.00 0.00 19.45 18.40 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 0.76 -2.84 0.00 -0.73 -1.57 -3.44 115.58 107.75 2bl5 h ASN 128 Ca 0.00 -0.32 -0.63 0.00 1.87 0.00 0.00 56.30 57.22 2bl5 h ASN 128 Cb 0.00 -0.21 -0.05 0.00 0.27 0.00 0.00 38.32 38.32 2bl5 h ASN 128 CO 0.00 1.03 -0.43 -0.76 -0.37 0.00 0.00 177.43 176.91 2bl5 s LEU 129 N -8.73 4.37 0.00 0.34 2.01 -1.12 -5.11 118.68 110.44 2bl5 s LEU 129 Ca -0.09 0.49 0.01 0.00 0.01 0.00 0.00 54.13 54.55 2bl5 s LEU 129 Cb 0.12 -2.58 0.01 0.00 0.01 0.00 0.00 46.19 43.75 2bl5 s LEU 129 CO 0.84 0.28 0.11 0.29 1.01 0.00 0.00 176.35 178.87 2bl5 n LYS 130 N 1.17 0.71 -0.23 1.70 5.02 -1.26 -4.93 118.16 120.34 2bl5 n LYS 130 Ca -0.12 -3.77 -0.04 0.00 -2.02 0.00 0.00 58.31 52.37 2bl5 n LYS 130 Cb 0.53 0.86 0.07 0.00 -0.02 0.00 0.00 35.03 36.47 2bl5 n LYS 130 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2bl5 h SER 131 N 1.12 0.64 0.00 4.39 4.64 -2.00 -0.02 113.55 122.32 2bl5 h SER 131 Ca -0.42 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2bl5 h SER 131 Cb 1.32 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2bl5 h SER 131 CO 0.69 0.44 0.00 -0.81 -0.87 0.00 0.00 176.83 176.28 2bl5 n PRO 132 N -4.71 0.54 -0.14 4.77 -0.04 -1.26 -1.21 135.00 132.94 2bl5 n PRO 132 Ca 0.07 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.60 2bl5 n PRO 132 Cb 0.10 -1.31 0.14 0.00 -0.04 0.00 0.00 33.50 32.39 2bl5 n PRO 132 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bl5 n ALA 133 N -0.81 2.35 -0.19 0.55 0.00 -0.04 -5.04 120.51 117.34 2bl5 n ALA 133 Ca 0.08 -2.14 0.00 0.00 0.00 0.00 0.00 53.44 51.38 2bl5 n ALA 133 Cb 0.04 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.11 2bl5 n ALA 133 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2bl5 n LEU 134 N -0.93 0.00 0.00 0.00 4.77 -0.35 -4.73 117.00 115.76 2bl5 n LEU 134 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2bl5 n LEU 134 Cb 0.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2bl5 n LEU 134 CO 0.04 0.00 0.00 1.57 -1.33 0.00 0.00 177.39 177.67