#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 2.53 -0.04 2.61 2.96 -0.41 -4.98 118.68 121.34 2bl5 s LEU 2 Ca 0.00 -0.36 0.02 0.00 -0.22 0.00 0.00 54.13 53.57 2bl5 s LEU 2 Cb 0.00 -1.53 0.01 0.00 0.50 0.00 0.00 46.19 45.17 2bl5 s LEU 2 CO 0.00 0.21 -0.10 -1.10 -1.32 0.00 0.00 176.35 174.04 2bl5 s GLN 3 N 0.04 1.25 -0.20 1.98 -0.21 -1.26 -0.52 119.66 120.75 2bl5 s GLN 3 Ca -0.06 -0.34 0.01 0.00 0.02 0.00 0.00 55.36 54.98 2bl5 s GLN 3 Cb -0.15 -1.11 0.02 0.00 1.00 0.00 0.00 33.01 32.77 2bl5 s GLN 3 CO 0.05 0.08 -0.17 -1.21 -2.12 0.00 0.00 175.29 171.92 2bl5 s GLU 4 N 0.41 2.93 -0.29 2.91 2.02 -0.85 -5.00 118.70 120.84 2bl5 s GLU 4 Ca -0.08 -0.88 -0.09 0.00 0.02 0.00 0.00 54.97 53.95 2bl5 s GLU 4 Cb -0.12 -2.67 -0.02 0.00 0.10 0.00 0.00 34.13 31.43 2bl5 s GLU 4 CO 0.02 -0.26 0.13 0.15 0.02 0.00 0.00 175.26 175.32 2bl5 s LYS 5 N 1.29 3.51 -0.66 1.61 3.01 -1.26 -1.82 119.74 125.41 2bl5 s LYS 5 Ca 0.03 -0.60 -0.16 0.00 -1.01 0.00 0.00 55.97 54.23 2bl5 s LYS 5 Cb -0.14 -3.50 0.15 0.00 -1.01 0.00 0.00 37.83 33.33 2bl5 s LYS 5 CO -0.11 -0.32 0.67 -0.51 0.51 0.00 0.00 175.35 175.59 2bl5 s LEU 6 N 1.63 6.11 0.19 3.17 1.43 0.21 -4.93 118.68 126.50 2bl5 s LEU 6 Ca 0.05 -2.00 -0.30 0.00 -1.03 0.00 0.00 54.13 50.85 2bl5 s LEU 6 Cb -0.16 -2.24 -0.08 0.00 0.03 0.00 0.00 46.19 43.73 2bl5 s LEU 6 CO 0.06 -0.84 1.24 -0.31 0.23 0.00 0.00 176.35 176.72 2bl5 s TYR 7 N 1.48 3.36 -0.22 0.29 2.02 -1.26 -0.74 117.35 122.29 2bl5 s TYR 7 Ca 0.11 1.35 0.01 0.00 -0.37 0.00 0.00 57.07 58.17 2bl5 s TYR 7 Cb -0.21 -3.50 0.05 0.00 -0.40 0.00 0.00 41.96 37.91 2bl5 s TYR 7 CO -0.01 -1.46 -0.07 0.14 -1.57 0.00 0.00 175.55 172.59 2bl5 s VAL 8 N 0.02 1.50 -0.64 0.71 -7.23 -1.03 -4.93 120.40 108.79 2bl5 s VAL 8 Ca 0.54 -1.08 -0.26 0.00 -1.81 0.00 0.00 61.98 59.37 2bl5 s VAL 8 Cb -0.34 -1.70 -0.05 0.00 0.56 0.00 0.00 36.38 34.85 2bl5 s VAL 8 CO 0.37 -0.00 2.08 -2.16 -0.31 0.00 0.00 175.10 175.08 2bl5 s PRO 9 N 1.43 2.37 0.57 4.82 0.04 -1.26 -4.36 135.00 138.61 2bl5 s PRO 9 Ca -0.04 0.69 0.35 0.00 0.04 0.00 0.00 61.00 62.04 2bl5 s PRO 9 Cb -0.18 -4.58 1.69 0.00 0.04 0.00 0.00 34.50 31.47 2bl5 s PRO 9 CO -0.07 -3.15 2.12 -0.24 0.04 0.00 0.00 177.00 175.70 2bl5 h VAL 10 N 7.25 0.18 0.00 -0.36 3.04 -1.87 0.16 116.25 124.65 2bl5 h VAL 10 Ca -0.18 -0.39 -0.07 0.00 -1.01 0.00 0.00 66.70 65.05 2bl5 h VAL 10 Cb 1.15 1.33 -0.01 0.00 -2.01 0.00 0.00 31.29 31.75 2bl5 h VAL 10 CO 1.18 0.04 -0.35 0.11 -1.01 0.00 0.00 177.57 177.54 2bl5 h LYS 11 N 0.00 0.00 0.06 4.17 1.57 -1.97 -2.79 116.57 117.61 2bl5 h LYS 11 Ca -0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 2bl5 h LYS 11 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2bl5 h LYS 11 CO 0.01 0.35 -1.10 0.93 -0.57 0.00 0.00 179.45 179.07 2bl5 h GLU 12 N 0.00 0.15 -2.62 3.15 4.39 -1.09 -3.39 114.58 115.17 2bl5 h GLU 12 Ca -0.00 -0.24 -0.61 0.00 0.34 0.00 0.00 59.36 58.85 2bl5 h GLU 12 Cb 0.68 0.09 -0.42 0.00 -0.10 0.00 0.00 28.75 29.01 2bl5 h GLU 12 CO 0.05 1.10 -0.62 0.66 -1.16 0.00 0.00 179.01 179.03 2bl5 n TYR 13 N -3.47 3.10 0.21 4.33 4.02 -0.82 -4.87 117.16 119.66 2bl5 n TYR 13 Ca -0.04 -4.17 0.08 0.00 -0.01 0.00 0.00 57.90 53.75 2bl5 n TYR 13 Cb 0.96 -0.55 0.47 0.00 -0.02 0.00 0.00 39.34 40.20 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 4.81 0.00 0.00 -0.72 0.13 -1.75 -3.00 132.00 131.47 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 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2bl5 h PRO 14 CO 0.74 0.27 -0.78 -0.25 -0.23 0.00 0.00 178.00 177.76 2bl5 n ASP 15 N -3.60 0.64 -4.19 1.44 8.00 -1.26 -4.69 116.55 112.88 2bl5 n ASP 15 Ca -0.01 -0.35 -0.36 0.00 0.71 0.00 0.00 54.79 54.78 2bl5 n ASP 15 Cb 0.41 0.56 -0.13 0.00 -0.02 0.00 0.00 41.12 41.94 2bl5 n ASP 15 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2bl5 s PHE 16 N -3.08 3.32 -0.77 1.24 5.36 -1.13 -5.05 117.98 117.87 2bl5 s PHE 16 Ca 0.08 -1.84 -0.26 0.00 -0.96 0.00 0.00 56.93 53.95 2bl5 s PHE 16 Cb 0.16 -2.37 0.04 0.00 -0.34 0.00 0.00 43.02 40.51 2bl5 s PHE 16 CO 0.77 -0.82 1.25 0.54 -1.46 0.00 0.00 175.22 175.51 2bl5 s ASN 17 N 1.41 6.22 0.43 6.13 4.22 -1.26 -4.82 114.94 127.28 2bl5 s ASN 17 Ca -0.02 -0.72 0.12 0.00 -2.14 0.00 0.00 52.86 50.10 2bl5 s ASN 17 Cb -0.20 -2.54 0.95 0.00 1.28 0.00 0.00 41.25 40.75 2bl5 s ASN 17 CO -0.01 -1.71 2.00 -0.26 -2.04 0.00 0.00 177.10 175.08 2bl5 h PHE 18 N 9.90 0.14 0.20 1.54 0.04 -1.96 0.25 116.94 127.04 2bl5 h PHE 18 Ca -0.20 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.55 2bl5 h PHE 18 Cb 1.05 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.16 2bl5 h PHE 18 CO 1.13 0.23 -0.10 0.28 -0.60 0.00 0.00 178.31 179.26 2bl5 h VAL 19 N 0.14 0.88 0.00 -0.55 2.07 -1.91 0.74 116.25 117.62 2bl5 h VAL 19 Ca 0.03 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 2bl5 h VAL 19 Cb 0.25 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2bl5 h VAL 19 CO 0.01 0.10 -0.03 1.23 0.02 0.00 0.00 177.57 178.91 2bl5 h GLY 20 N -0.50 0.00 0.72 2.17 0.00 -1.84 0.14 103.07 103.76 2bl5 h GLY 20 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.01 2bl5 h GLY 20 CO 0.05 0.00 -1.43 -0.09 0.00 0.00 0.00 176.54 175.07 2bl5 h ARG 21 N 0.00 0.31 0.00 4.80 9.65 -0.25 -3.28 114.38 125.62 2bl5 h ARG 21 Ca -0.00 -0.54 -0.06 0.00 -1.10 0.00 0.00 59.98 58.29 2bl5 h ARG 21 Cb 0.31 0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.08 2bl5 h ARG 21 CO 0.00 1.26 -0.65 0.82 2.80 0.00 0.00 179.97 184.20 2bl5 h ILE 22 N -0.17 0.27 -0.01 1.20 1.08 0.83 -3.41 117.51 117.29 2bl5 h ILE 22 Ca -0.29 -1.32 0.00 0.00 -0.39 0.00 0.00 64.86 62.86 2bl5 h ILE 22 Cb 1.86 0.62 0.00 0.00 -3.07 0.00 0.00 36.82 36.24 2bl5 h ILE 22 CO 0.12 0.09 -0.29 0.00 -0.69 0.00 0.00 178.15 177.38 2bl5 n LEU 23 N -4.58 1.86 0.00 1.44 -0.00 -0.21 -3.79 117.00 111.71 2bl5 n LEU 23 Ca -0.13 -0.81 0.00 0.00 -0.00 0.00 0.00 56.01 55.07 2bl5 n LEU 23 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.77 2bl5 n LEU 23 CO 0.12 0.35 0.13 0.61 -0.00 0.00 0.00 177.39 178.60 2bl5 n GLY 24 N 1.17 -2.43 0.14 1.47 0.00 0.31 -1.12 105.19 104.72 2bl5 n GLY 24 Ca 0.08 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.36 2bl5 n GLY 24 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bl5 h PRO 25 N 0.00 0.00 -0.37 1.61 0.13 -1.86 -3.35 132.00 128.16 2bl5 h PRO 25 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2bl5 h PRO 25 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2bl5 h PRO 25 CO 0.00 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.31 2bl5 n ARG 26 N -2.71 3.37 -0.08 0.86 1.74 -1.25 -4.52 116.66 114.06 2bl5 n ARG 26 Ca 0.02 -2.81 0.25 0.00 -0.77 0.00 0.00 57.85 54.54 2bl5 n ARG 26 Cb 0.52 -1.86 0.72 0.00 -1.02 0.00 0.00 32.46 30.82 2bl5 n ARG 26 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2bl5 h GLY 27 N 2.45 0.00 0.19 -0.13 0.00 -1.22 0.55 103.07 104.91 2bl5 h GLY 27 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.50 2bl5 h GLY 27 CO 0.25 0.00 0.59 1.41 0.00 0.00 0.00 176.54 178.79 2bl5 h LEU 28 N 0.00 0.78 -0.89 3.11 3.38 -1.84 -1.44 115.31 118.42 2bl5 h LEU 28 Ca 0.33 0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.31 2bl5 h LEU 28 Cb 1.44 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 2bl5 h LEU 28 CO -0.00 0.30 -0.11 0.00 0.09 0.00 0.00 178.44 178.72 2bl5 h THR 29 N 0.79 1.25 -0.64 0.22 1.03 -1.24 0.89 112.91 115.21 2bl5 h THR 29 Ca 0.55 -1.13 -0.03 0.00 -0.01 0.00 0.00 66.41 65.79 2bl5 h THR 29 Cb 0.81 1.07 -0.03 0.00 -1.07 0.00 0.00 68.15 68.92 2bl5 h THR 29 CO -0.36 0.38 0.26 0.00 -0.01 0.00 0.00 175.52 175.79 2bl5 h ALA 30 N 1.24 1.25 -0.40 0.00 0.00 -1.36 0.15 119.26 120.14 2bl5 h ALA 30 Ca 0.11 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 2bl5 h ALA 30 Cb 0.56 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2bl5 h ALA 30 CO 0.03 0.55 -0.34 -0.22 0.00 0.00 0.00 179.25 179.28 2bl5 h LYS 31 N 0.92 0.94 -0.63 0.00 3.11 -1.04 -2.72 116.57 117.15 2bl5 h LYS 31 Ca 0.22 -0.47 -0.09 0.00 -2.81 0.00 0.00 60.65 57.49 2bl5 h LYS 31 Cb 0.17 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.38 2bl5 h LYS 31 CO -0.02 1.13 0.03 1.96 -2.81 0.00 0.00 179.45 179.74 2bl5 h GLN 32 N 0.76 1.08 -0.51 1.90 1.08 0.07 -1.27 115.11 118.21 2bl5 h GLN 32 Ca 0.07 -0.32 -0.01 0.00 -1.45 0.00 0.00 58.65 56.93 2bl5 h GLN 32 Cb 0.93 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 28.23 2bl5 h GLN 32 CO 0.09 1.03 0.26 -0.07 -0.95 0.00 0.00 178.83 179.19 2bl5 h LEU 33 N 0.99 0.66 -0.54 1.46 4.07 -0.68 0.24 115.31 121.51 2bl5 h LEU 33 Ca 0.18 -0.11 -0.16 0.00 0.08 0.00 0.00 57.88 57.87 2bl5 h LEU 33 Cb 0.52 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 2bl5 h LEU 33 CO 0.03 0.58 -0.53 1.05 -1.08 0.00 0.00 178.44 178.48 2bl5 h GLU 34 N 0.68 0.55 -0.42 1.13 4.11 -1.11 0.36 114.58 119.88 2bl5 h GLU 34 Ca 0.18 -0.34 -0.09 0.00 0.07 0.00 0.00 59.36 59.18 2bl5 h GLU 34 Cb 0.09 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2bl5 h GLU 34 CO -0.03 0.94 -0.08 0.00 0.07 0.00 0.00 179.01 179.91 2bl5 h ALA 35 N 0.99 0.57 0.03 1.06 0.00 -0.95 -2.71 119.26 118.25 2bl5 h ALA 35 Ca 0.01 -0.31 -0.33 0.00 0.00 0.00 0.00 54.91 54.28 2bl5 h ALA 35 Cb 1.07 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 2bl5 h ALA 35 CO 0.10 0.43 -1.83 0.39 0.00 0.00 0.00 179.25 178.35 2bl5 n GLU 36 N -4.33 0.63 0.19 0.00 1.02 0.82 -4.38 120.64 114.59 2bl5 n GLU 36 Ca -0.01 0.39 0.12 0.00 -0.02 0.00 0.00 57.16 57.64 2bl5 n GLU 36 Cb 0.36 -1.67 0.13 0.00 -0.02 0.00 0.00 31.44 30.23 2bl5 n GLU 36 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2bl5 h THR 37 N -0.61 0.01 0.00 2.62 1.35 -0.46 -3.47 112.91 112.36 2bl5 h THR 37 Ca -0.46 -1.01 0.00 0.00 -0.55 0.00 0.00 66.41 64.38 2bl5 h THR 37 Cb 1.62 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.92 2bl5 h THR 37 CO -0.16 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 175.73 2bl5 n GLY 38 N 1.12 0.58 3.24 5.82 0.00 -1.02 -4.73 105.19 110.21 2bl5 n GLY 38 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 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 1.13 3.26 -0.54 0.00 -2.85 0.14 -2.20 119.74 118.69 2bl5 s LYS 40 Ca 0.01 -1.53 -0.28 0.00 -1.00 0.00 0.00 55.97 53.16 2bl5 s LYS 40 Cb -0.14 -4.44 0.02 0.00 -2.06 0.00 0.00 37.83 31.20 2bl5 s LYS 40 CO -0.04 -1.60 1.32 -1.50 0.10 0.00 0.00 175.35 173.63 2bl5 s ILE 41 N 2.50 3.92 -0.13 3.79 2.07 -1.26 -2.39 121.20 129.69 2bl5 s ILE 41 Ca 0.19 0.84 -0.04 0.00 -1.41 0.00 0.00 60.65 60.23 2bl5 s ILE 41 Cb -0.17 -4.51 -0.03 0.00 0.13 0.00 0.00 42.46 37.88 2bl5 s ILE 41 CO 0.01 -1.14 0.01 0.00 -1.91 0.00 0.00 174.94 171.90 2bl5 s MET 42 N 5.14 3.47 -0.40 3.50 0.23 0.15 -4.88 119.30 126.52 2bl5 s MET 42 Ca 0.50 -0.41 -0.26 0.00 -1.03 0.00 0.00 55.69 54.49 2bl5 s MET 42 Cb -0.10 -2.96 0.02 0.00 -1.53 0.00 0.00 34.83 30.26 2bl5 s MET 42 CO 0.27 0.45 0.93 0.08 -2.03 0.00 0.00 175.02 174.72 2bl5 s VAL 43 N -0.18 4.54 0.51 5.16 1.01 -1.26 -1.23 120.40 128.95 2bl5 s VAL 43 Ca 0.05 1.04 0.05 0.00 0.00 0.00 0.00 61.98 63.13 2bl5 s VAL 43 Cb -0.12 -4.37 0.04 0.00 0.00 0.00 0.00 36.38 31.92 2bl5 s VAL 43 CO 0.02 -0.64 0.71 -0.13 0.00 0.00 0.00 175.10 175.05 2bl5 s ARG 44 N 3.58 2.57 0.30 2.72 0.52 0.20 -4.31 118.95 124.54 2bl5 s ARG 44 Ca 0.38 -1.09 0.00 0.00 -0.52 0.00 0.00 55.73 54.50 2bl5 s ARG 44 Cb -0.11 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.75 2bl5 s ARG 44 CO 0.21 -0.60 0.00 0.41 0.02 0.00 0.00 175.30 175.35 2bl5 n GLY 45 N -2.16 -1.79 3.63 -3.53 0.00 0.13 0.21 105.19 101.67 2bl5 n GLY 45 Ca 0.09 -1.88 -0.43 0.00 0.00 0.00 0.00 46.02 43.80 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 3.98 0.00 1.61 -2.85 -1.17 -3.50 119.74 117.81 2bl5 s LYS 46 Ca 0.00 0.90 0.00 0.00 -1.00 0.00 0.00 55.97 55.87 2bl5 s LYS 46 Cb 0.00 -3.77 0.00 0.00 -2.06 0.00 0.00 37.83 32.00 2bl5 s LYS 46 CO 0.00 -0.98 0.00 0.41 0.10 0.00 0.00 175.35 174.88 2bl5 n GLY 47 N 4.11 1.86 0.35 0.59 0.00 -1.26 -4.79 105.19 106.05 2bl5 n GLY 47 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2bl5 n GLY 47 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2bl5 h SER 48 N 0.00 -0.72 -0.41 1.61 0.87 -1.75 -3.36 113.55 109.80 2bl5 h SER 48 Ca 0.00 0.02 -0.30 0.00 -1.23 0.00 0.00 61.79 60.28 2bl5 h SER 48 Cb 0.00 0.19 -0.29 0.00 -0.44 0.00 0.00 62.40 61.86 2bl5 h SER 48 CO 0.00 -0.34 -0.78 0.23 -0.53 0.00 0.00 176.83 175.41 2bl5 n MET 49 N -5.24 2.42 0.00 2.24 2.81 -1.26 -4.92 117.12 113.17 2bl5 n MET 49 Ca -0.11 -3.63 0.00 0.00 -1.81 0.00 0.00 57.70 52.16 2bl5 n MET 49 Cb 0.33 -1.79 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 2bl5 n MET 49 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 2bl5 n ARG 50 N -0.72 0.00 -2.19 0.03 3.00 -1.26 -4.69 116.66 110.83 2bl5 n ARG 50 Ca 0.28 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.73 2bl5 n ARG 50 Cb 0.88 -1.16 -0.02 0.00 0.00 0.00 0.00 32.46 32.16 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 -0.06 6.83 0.21 6.15 1.01 -1.26 -4.93 116.67 124.63 2bl5 s ASP 51 Ca 0.00 2.59 -0.07 0.00 0.71 0.00 0.00 52.55 55.78 2bl5 s ASP 51 Cb 0.00 -2.64 0.16 0.00 1.01 0.00 0.00 42.92 41.45 2bl5 s ASP 51 CO 0.00 -0.48 1.77 0.11 0.21 0.00 0.00 175.17 176.77 2bl5 h LYS 52 N 3.39 1.17 -0.39 8.23 1.79 -2.00 -1.19 116.57 127.57 2bl5 h LYS 52 Ca -0.49 -0.23 -0.02 0.00 -2.18 0.00 0.00 60.65 57.73 2bl5 h LYS 52 Cb 1.22 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.68 2bl5 h LYS 52 CO 0.65 0.97 0.14 1.57 -1.08 0.00 0.00 179.45 181.71 2bl5 h LYS 53 N 1.13 0.56 -0.25 3.15 2.10 -1.95 -2.33 116.57 118.99 2bl5 h LYS 53 Ca 0.25 -0.08 -0.15 0.00 -2.00 0.00 0.00 60.65 58.68 2bl5 h LYS 53 Cb 0.26 -0.10 -0.00 0.00 -0.90 0.00 0.00 32.23 31.49 2bl5 h LYS 53 CO -0.01 0.48 -0.42 0.87 -2.00 0.00 0.00 179.45 178.36 2bl5 h LYS 54 N 0.56 0.72 0.00 0.07 1.57 -1.55 -0.88 116.57 117.06 2bl5 h LYS 54 Ca 0.14 -0.45 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 2bl5 h LYS 54 Cb 0.14 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 2bl5 h LYS 54 CO -0.01 1.07 -0.03 1.05 -0.57 0.00 0.00 179.45 180.96 2bl5 h GLU 55 N 0.45 0.00 0.01 3.15 4.11 -1.01 0.78 114.58 122.06 2bl5 h GLU 55 Ca 0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.45 2bl5 h GLU 55 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2bl5 h GLU 55 CO 0.10 0.03 -0.00 0.93 0.07 0.00 0.00 179.01 180.13 2bl5 h GLU 56 N 0.00 -0.01 0.00 1.06 5.08 -1.05 -3.37 114.58 116.29 2bl5 h GLU 56 Ca -0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 2bl5 h GLU 56 Cb 0.43 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 2bl5 h GLU 56 CO 0.00 0.28 -1.97 0.00 -1.00 0.00 0.00 179.01 176.32 2bl5 n GLN 57 N -4.74 0.58 -0.09 2.33 10.64 -0.37 -4.41 117.38 121.32 2bl5 n GLN 57 Ca -0.03 0.09 0.04 0.00 -1.83 0.00 0.00 57.00 55.27 2bl5 n GLN 57 Cb 0.14 -1.34 0.14 0.00 -0.86 0.00 0.00 30.24 28.32 2bl5 n GLN 57 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2bl5 n ASN 58 N -2.95 1.00 -4.65 2.61 2.85 0.13 -4.91 115.26 109.35 2bl5 n ASN 58 Ca -0.29 -1.93 -0.35 0.00 -0.11 0.00 0.00 54.58 51.90 2bl5 n ASN 58 Cb 0.84 -0.12 0.10 0.00 1.24 0.00 0.00 39.78 41.84 2bl5 n ASN 58 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 2bl5 n ARG 59 N 0.02 0.38 -0.34 1.20 1.85 0.23 -2.86 116.66 117.14 2bl5 n ARG 59 Ca 0.08 0.19 0.00 0.00 -1.00 0.00 0.00 57.85 57.12 2bl5 n ARG 59 Cb 0.17 -2.32 0.00 0.00 -1.05 0.00 0.00 32.46 29.26 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 0.87 2.11 3.94 2.89 0.00 -1.26 -5.00 105.19 108.74 2bl5 n GLY 60 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.03 2.91 0.21 1.61 -0.14 -1.14 -4.64 119.74 118.53 2bl5 s LYS 61 Ca 0.00 -0.38 0.18 0.00 -1.36 0.00 0.00 55.97 54.41 2bl5 s LYS 61 Cb 0.00 -2.45 0.67 0.00 -1.68 0.00 0.00 37.83 34.38 2bl5 s LYS 61 CO 0.00 -0.50 0.64 -2.30 -0.76 0.00 0.00 175.35 172.43 2bl5 n PRO 62 N -2.30 -0.01 -0.19 -1.68 -0.02 -1.26 0.60 135.00 130.15 2bl5 n PRO 62 Ca 0.04 0.47 -0.09 0.00 -2.02 0.00 0.00 63.50 61.90 2bl5 n PRO 62 Cb 0.58 -1.02 0.01 0.00 -0.02 0.00 0.00 33.50 33.05 2bl5 n PRO 62 CO 0.00 0.00 0.00 -2.95 1.98 0.00 0.00 175.50 174.53 2bl5 h ASN 63 N 0.00 0.91 0.74 2.55 -0.00 -1.91 -0.41 115.58 117.46 2bl5 h ASN 63 Ca 0.38 -0.30 -0.13 0.00 -0.00 0.00 0.00 56.30 56.25 2bl5 h ASN 63 Cb 1.40 -0.24 -0.02 0.00 -0.00 0.00 0.00 38.32 39.45 2bl5 h ASN 63 CO -0.08 0.98 -1.34 0.79 -0.00 0.00 0.00 177.43 177.77 2bl5 n TRP 64 N -4.30 0.95 -0.13 4.14 7.02 0.20 -2.12 117.44 123.20 2bl5 n TRP 64 Ca 0.02 0.31 -0.04 0.00 -1.02 0.00 0.00 57.50 56.76 2bl5 n TRP 64 Cb 0.31 -1.05 0.04 0.00 -2.42 0.00 0.00 31.31 28.19 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 0.19 -0.09 -0.99 4.81 -0.57 -1.68 114.58 116.25 2bl5 h GLU 65 Ca -0.13 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2bl5 h GLU 65 Cb 1.45 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.78 2bl5 h GLU 65 CO 0.03 0.12 0.00 -2.39 -0.73 0.00 0.00 179.01 176.05 2bl5 n HIS 66 N -5.12 0.09 0.29 0.92 1.44 -0.19 -4.11 115.22 108.53 2bl5 n HIS 66 Ca 0.03 -0.04 0.15 0.00 -2.01 0.00 0.00 57.72 55.85 2bl5 n HIS 66 Cb 0.21 0.00 0.85 0.00 0.12 0.00 0.00 29.99 31.17 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 3.97 0.00 -0.46 2.39 5.85 -0.76 0.75 115.31 127.05 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 0.85 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.88 2bl5 h LEU 67 CO 0.00 0.05 -0.15 -0.46 -0.34 0.00 0.00 178.44 177.55 2bl5 n ASN 68 N -3.70 0.86 -4.66 1.25 0.23 -1.23 -3.04 115.26 104.98 2bl5 n ASN 68 Ca -0.02 -0.89 -0.26 0.00 -0.53 0.00 0.00 54.58 52.87 2bl5 n ASN 68 Cb 0.15 0.03 0.11 0.00 -2.08 0.00 0.00 39.78 37.99 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 -2.38 1.66 0.13 -3.83 2.02 -0.45 -4.99 118.70 110.86 2bl5 s GLU 69 Ca 0.29 -0.48 -0.18 0.00 0.02 0.00 0.00 54.97 54.62 2bl5 s GLU 69 Cb 0.20 -2.11 -0.07 0.00 0.10 0.00 0.00 34.13 32.24 2bl5 s GLU 69 CO 0.46 -1.61 0.60 0.34 0.02 0.00 0.00 175.26 175.07 2bl5 s ASP 70 N -4.67 6.99 -0.20 -0.19 2.15 -1.26 -3.14 116.67 116.35 2bl5 s ASP 70 Ca 0.65 1.24 -0.36 0.00 0.43 0.00 0.00 52.55 54.52 2bl5 s ASP 70 Cb -0.08 -2.35 -0.13 0.00 -0.30 0.00 0.00 42.92 40.07 2bl5 s ASP 70 CO 0.47 0.16 1.91 -0.11 -0.17 0.00 0.00 175.17 177.44 2bl5 n LEU 71 N 1.19 2.91 -3.83 -1.34 7.94 -1.25 -3.85 117.00 118.77 2bl5 n LEU 71 Ca -0.07 0.87 -0.10 0.00 -1.11 0.00 0.00 56.01 55.61 2bl5 n LEU 71 Cb 0.51 -1.29 -0.07 0.00 0.53 0.00 0.00 43.42 43.10 2bl5 n LEU 71 CO 0.42 -0.30 -0.06 -1.38 -1.11 0.00 0.00 177.39 174.96 2bl5 s HIS 72 N 4.69 0.08 -0.25 1.96 -3.43 0.13 -2.47 115.29 116.01 2bl5 s HIS 72 Ca 0.98 -0.43 -0.09 0.00 -0.80 0.00 0.00 55.06 54.73 2bl5 s HIS 72 Cb -0.82 -0.01 -0.04 0.00 -1.43 0.00 0.00 32.58 30.28 2bl5 s HIS 72 CO 0.55 -0.53 0.11 0.14 -2.00 0.00 0.00 174.74 173.01 2bl5 s VAL 73 N -3.44 4.72 -0.17 -5.38 -7.23 0.08 0.59 120.40 109.57 2bl5 s VAL 73 Ca 0.02 -0.04 0.01 0.00 -1.81 0.00 0.00 61.98 60.16 2bl5 s VAL 73 Cb 0.03 -3.21 0.02 0.00 0.56 0.00 0.00 36.38 33.78 2bl5 s VAL 73 CO -0.09 0.33 -0.16 -0.22 -0.31 0.00 0.00 175.10 174.65 2bl5 s LEU 74 N 1.45 1.95 -0.49 1.32 2.96 -0.36 0.67 118.68 126.18 2bl5 s LEU 74 Ca 0.06 -0.60 -0.27 0.00 -0.22 0.00 0.00 54.13 53.10 2bl5 s LEU 74 Cb -0.15 -1.31 0.03 0.00 0.50 0.00 0.00 46.19 45.26 2bl5 s LEU 74 CO 0.05 -0.04 1.03 0.27 -1.32 0.00 0.00 176.35 176.34 2bl5 s ILE 75 N 1.39 4.32 -0.42 6.68 -4.36 -0.75 0.34 121.20 128.40 2bl5 s ILE 75 Ca 0.04 0.88 -0.12 0.00 -0.26 0.00 0.00 60.65 61.19 2bl5 s ILE 75 Cb -0.13 -4.54 0.06 0.00 1.25 0.00 0.00 42.46 39.10 2bl5 s ILE 75 CO -0.11 -0.98 0.29 -0.89 0.24 0.00 0.00 174.94 173.49 2bl5 s THR 76 N 4.15 4.68 -0.24 8.37 2.01 -1.01 -2.01 115.64 131.59 2bl5 s THR 76 Ca 0.41 -1.12 -0.01 0.00 0.31 0.00 0.00 61.69 61.27 2bl5 s THR 76 Cb -0.09 -3.76 0.02 0.00 0.01 0.00 0.00 72.50 68.68 2bl5 s THR 76 CO 0.28 -0.45 -0.07 0.54 -0.69 0.00 0.00 174.62 174.22 2bl5 s VAL 77 N 1.54 2.83 -0.87 3.82 0.11 0.33 0.25 120.40 128.40 2bl5 s VAL 77 Ca 0.03 -0.98 -0.17 0.00 -2.93 0.00 0.00 61.98 57.93 2bl5 s VAL 77 Cb -0.22 -2.41 0.17 0.00 -1.53 0.00 0.00 36.38 32.38 2bl5 s VAL 77 CO 0.05 0.24 0.96 -1.61 -3.33 0.00 0.00 175.10 171.42 2bl5 s GLU 78 N 1.33 3.58 0.00 1.54 2.02 -1.26 -1.29 118.70 124.62 2bl5 s GLU 78 Ca 0.01 -2.03 0.00 0.00 0.02 0.00 0.00 54.97 52.97 2bl5 s GLU 78 Cb -0.16 -4.69 0.00 0.00 0.10 0.00 0.00 34.13 29.38 2bl5 s GLU 78 CO -0.05 -1.57 0.00 -3.47 0.02 0.00 0.00 175.26 170.19 2bl5 n ASP 79 N 5.49 0.00 -0.57 -0.19 -0.08 -1.26 -5.01 116.55 114.92 2bl5 n ASP 79 Ca 0.18 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.58 2bl5 n ASP 79 Cb 0.48 0.00 0.05 0.00 2.34 0.00 0.00 41.12 43.99 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 -0.39 3.29 -2.08 -1.67 0.00 -1.26 -4.52 120.51 113.88 2bl5 n ALA 80 Ca 0.00 -0.63 -0.42 0.00 0.00 0.00 0.00 53.44 52.38 2bl5 n ALA 80 Cb 0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 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 -2.38 4.22 0.32 0.00 -0.21 -1.26 -4.89 119.66 115.46 2bl5 s GLN 81 Ca 0.21 2.12 0.08 0.00 0.02 0.00 0.00 55.36 57.79 2bl5 s GLN 81 Cb 0.19 -3.77 0.53 0.00 1.00 0.00 0.00 33.01 30.95 2bl5 s GLN 81 CO 0.51 -0.74 1.74 -0.91 -2.12 0.00 0.00 175.29 173.77 2bl5 h ASN 82 N 8.70 0.19 -0.47 5.90 -0.26 -2.00 -2.20 115.58 125.44 2bl5 h ASN 82 Ca -0.39 -0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.27 2bl5 h ASN 82 Cb 1.18 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 38.36 2bl5 h ASN 82 CO 0.94 0.57 0.27 0.08 -1.06 0.00 0.00 177.43 178.22 2bl5 h ARG 83 N 0.16 0.67 0.76 0.81 0.11 -1.99 -1.45 114.38 113.44 2bl5 h ARG 83 Ca 0.02 -0.07 -0.04 0.00 0.10 0.00 0.00 59.98 59.99 2bl5 h ARG 83 Cb 0.76 -0.14 0.00 0.00 1.11 0.00 0.00 29.97 31.71 2bl5 h ARG 83 CO 0.06 0.50 -0.40 0.00 0.10 0.00 0.00 179.97 180.22 2bl5 h ALA 84 N 1.61 -1.26 -0.41 0.08 0.00 -1.73 -2.61 119.26 114.94 2bl5 h ALA 84 Ca 0.18 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2bl5 h ALA 84 Cb 0.02 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2bl5 h ALA 84 CO -0.03 -1.20 0.27 1.05 0.00 0.00 0.00 179.25 179.34 2bl5 h GLU 85 N -1.07 0.32 -0.73 0.00 4.11 -1.27 0.25 114.58 116.18 2bl5 h GLU 85 Ca -0.10 -0.02 -0.03 0.00 0.07 0.00 0.00 59.36 59.28 2bl5 h GLU 85 Cb 0.83 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 2bl5 h GLU 85 CO 0.14 0.21 0.36 1.25 0.07 0.00 0.00 179.01 181.04 2bl5 h LEU 86 N 0.33 0.94 -0.16 3.06 7.12 -1.20 0.70 115.31 126.10 2bl5 h LEU 86 Ca 0.18 -0.10 -0.10 0.00 0.13 0.00 0.00 57.88 57.99 2bl5 h LEU 86 Cb 0.28 -0.24 -0.00 0.00 -0.53 0.00 0.00 40.66 40.17 2bl5 h LEU 86 CO -0.04 0.79 -0.28 0.50 -0.13 0.00 0.00 178.44 179.28 2bl5 h LYS 87 N 1.04 0.48 -0.15 1.25 3.64 -0.12 -2.69 116.57 120.01 2bl5 h LYS 87 Ca 0.25 -0.30 -0.14 0.00 -1.27 0.00 0.00 60.65 59.20 2bl5 h LYS 87 Cb 0.10 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2bl5 h LYS 87 CO -0.03 0.90 -0.52 1.37 -2.27 0.00 0.00 179.45 178.89 2bl5 h LEU 88 N 0.11 0.45 -0.87 5.20 -0.00 -1.33 -2.90 115.31 115.96 2bl5 h LEU 88 Ca 0.01 -0.23 -0.08 0.00 -0.00 0.00 0.00 57.88 57.58 2bl5 h LEU 88 Cb 0.86 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 41.38 2bl5 h LEU 88 CO 0.06 0.89 -0.06 0.07 -0.00 0.00 0.00 178.44 179.40 2bl5 h LYS 89 N 0.32 0.77 -0.37 0.17 5.09 -0.82 0.42 116.57 122.14 2bl5 h LYS 89 Ca 0.01 -0.23 -0.11 0.00 0.09 0.00 0.00 60.65 60.41 2bl5 h LYS 89 Cb 1.02 -0.08 -0.01 0.00 0.10 0.00 0.00 32.23 33.26 2bl5 h LYS 89 CO 0.09 0.82 -0.21 0.07 -2.09 0.00 0.00 179.45 178.13 2bl5 h ARG 90 N 0.70 0.79 -0.28 0.07 0.11 -1.46 0.12 114.38 114.44 2bl5 h ARG 90 Ca 0.13 -0.36 -0.03 0.00 0.10 0.00 0.00 59.98 59.82 2bl5 h ARG 90 Cb 0.52 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.58 2bl5 h ARG 90 CO 0.03 0.99 0.06 0.00 0.10 0.00 0.00 179.97 181.14 2bl5 h ALA 91 N 0.79 0.37 0.00 0.08 0.00 -1.27 -2.61 119.26 116.62 2bl5 h ALA 91 Ca 0.08 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2bl5 h ALA 91 Cb 0.77 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2bl5 h ALA 91 CO 0.06 0.04 -0.34 -0.24 0.00 0.00 0.00 179.25 178.77 2bl5 h VAL 92 N 0.28 1.02 -0.23 0.00 3.04 -0.12 -2.02 116.25 118.22 2bl5 h VAL 92 Ca 0.09 -1.26 -0.07 0.00 -1.01 0.00 0.00 66.70 64.45 2bl5 h VAL 92 Cb 0.31 1.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.30 2bl5 h VAL 92 CO 0.00 0.33 -0.15 -0.33 -1.01 0.00 0.00 177.57 176.42 2bl5 h GLU 93 N 0.00 0.39 -0.29 4.17 5.08 -0.47 0.50 114.58 123.96 2bl5 h GLU 93 Ca -0.00 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 2bl5 h GLU 93 Cb 0.70 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2bl5 h GLU 93 CO 0.04 0.54 -0.13 0.93 -1.00 0.00 0.00 179.01 179.40 2bl5 h GLU 94 N 0.36 0.49 -0.44 2.33 5.08 -1.01 -1.08 114.58 120.30 2bl5 h GLU 94 Ca 0.07 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2bl5 h GLU 94 Cb 0.48 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2bl5 h GLU 94 CO 0.03 0.61 0.03 0.28 -1.00 0.00 0.00 179.01 178.96 2bl5 h VAL 95 N 0.45 1.22 -0.28 3.13 2.07 -0.81 -1.93 116.25 120.10 2bl5 h VAL 95 Ca 0.08 -0.89 0.08 0.00 0.82 0.00 0.00 66.70 66.80 2bl5 h VAL 95 Cb 0.50 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2bl5 h VAL 95 CO 0.03 0.31 0.21 0.11 0.02 0.00 0.00 177.57 178.25 2bl5 h LYS 96 N 0.67 0.00 0.00 1.57 1.57 0.12 1.20 116.57 121.70 2bl5 h LYS 96 Ca 0.14 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 2bl5 h LYS 96 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2bl5 h LYS 96 CO 0.01 0.00 -0.35 0.87 -0.57 0.00 0.00 179.45 179.41 2bl5 h LYS 97 N 0.00 0.00 0.18 3.15 6.56 -0.73 -3.33 116.57 122.40 2bl5 h LYS 97 Ca 0.13 0.00 -0.35 0.00 -1.06 0.00 0.00 60.65 59.38 2bl5 h LYS 97 Cb 0.54 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.21 2bl5 h LYS 97 CO -0.00 0.35 -1.72 -0.07 -2.06 0.00 0.00 179.45 175.95 2bl5 h LEU 98 N 0.00 0.61 -0.25 2.94 3.38 0.88 -3.33 115.31 119.55 2bl5 h LEU 98 Ca -0.00 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.08 2bl5 h LEU 98 Cb 1.11 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2bl5 h LEU 98 CO 0.05 1.75 0.00 0.00 0.09 0.00 0.00 178.44 180.32 2bl5 n LEU 99 N -3.58 0.18 -4.73 1.67 -0.00 0.35 -4.70 117.00 106.18 2bl5 n LEU 99 Ca -0.23 -0.09 -0.41 0.00 -0.00 0.00 0.00 56.01 55.28 2bl5 n LEU 99 Cb 1.08 -0.09 -0.04 0.00 -0.00 0.00 0.00 43.42 44.36 2bl5 n LEU 99 CO 0.52 0.04 0.68 -0.69 -0.00 0.00 0.00 177.39 177.95 2bl5 s VAL 100 N -1.75 4.39 -1.52 1.47 1.01 -1.25 -4.93 120.40 117.82 2bl5 s VAL 100 Ca 0.00 2.01 0.00 0.00 0.00 0.00 0.00 61.98 63.99 2bl5 s VAL 100 Cb 0.00 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 32.09 2bl5 s VAL 100 CO 0.00 0.32 0.29 -0.81 0.00 0.00 0.00 175.10 174.90 2bl5 n PRO 101 N 2.67 0.38 -1.71 2.72 -0.04 -1.26 -4.84 135.00 132.92 2bl5 n PRO 101 Ca 0.02 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.11 2bl5 n PRO 101 Cb 0.49 -1.09 0.06 0.00 -0.04 0.00 0.00 33.50 32.92 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 -0.11 1.06 0.23 0.55 0.00 -1.26 -4.90 120.51 116.08 2bl5 n ALA 102 Ca 0.00 0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.54 2bl5 n ALA 102 Cb 0.05 -2.30 0.54 0.00 0.00 0.00 0.00 19.45 17.73 2bl5 n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bl5 h ALA 103 N 0.61 1.20 -2.38 0.00 0.00 -1.97 -3.44 119.26 113.27 2bl5 h ALA 103 Ca -0.51 -0.21 -0.31 0.00 0.00 0.00 0.00 54.91 53.89 2bl5 h ALA 103 Cb 1.34 -0.04 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 2bl5 h ALA 103 CO 0.53 0.29 -0.63 -1.83 0.00 0.00 0.00 179.25 177.61 2bl5 s GLU 104 N -3.99 1.29 -0.64 0.00 1.03 -1.26 -5.06 118.70 110.07 2bl5 s GLU 104 Ca -0.02 -1.68 -0.01 0.00 0.03 0.00 0.00 54.97 53.30 2bl5 s GLU 104 Cb 0.12 -0.13 0.43 0.00 -0.80 0.00 0.00 34.13 33.76 2bl5 s GLU 104 CO 0.64 -0.28 1.90 0.41 -1.33 0.00 0.00 175.26 176.60 2bl5 n GLY 105 N -0.37 5.89 0.00 -3.83 0.00 -1.26 -4.95 105.19 100.67 2bl5 n GLY 105 Ca -0.01 -2.40 0.00 0.00 0.00 0.00 0.00 46.02 43.61 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 -0.82 0.00 0.00 1.61 0.28 -1.26 -4.89 120.64 115.56 2bl5 n GLU 106 Ca 0.58 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.58 2bl5 n GLU 106 Cb 0.63 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.50 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 -1.54 0.00 0.15 -1.84 2.03 -1.26 -4.34 116.55 109.74 2bl5 n ASP 107 Ca 0.00 0.00 0.09 0.00 0.52 0.00 0.00 54.79 55.40 2bl5 n ASP 107 Cb 0.00 0.00 0.60 0.00 -0.72 0.00 0.00 41.12 41.00 2bl5 n ASP 107 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2bl5 h SER 108 N 0.00 0.11 -0.83 1.67 0.87 -1.94 0.19 113.55 113.63 2bl5 h SER 108 Ca 0.00 -0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2bl5 h SER 108 Cb 0.00 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 2bl5 h SER 108 CO 0.00 0.08 0.55 -0.07 -0.53 0.00 0.00 176.83 176.86 2bl5 h LEU 109 N 0.13 0.95 0.16 2.23 3.38 -1.90 0.38 115.31 120.64 2bl5 h LEU 109 Ca 0.09 -0.02 -0.32 0.00 0.09 0.00 0.00 57.88 57.71 2bl5 h LEU 109 Cb 0.19 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.70 2bl5 h LEU 109 CO -0.01 0.69 -1.63 0.50 0.09 0.00 0.00 178.44 178.08 2bl5 h LYS 110 N 1.13 0.34 -0.38 1.13 3.64 -1.46 -3.18 116.57 117.80 2bl5 h LYS 110 Ca 0.30 -0.59 -0.10 0.00 -1.27 0.00 0.00 60.65 59.00 2bl5 h LYS 110 Cb -0.13 0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2bl5 h LYS 110 CO -0.07 1.28 -0.17 0.87 -2.27 0.00 0.00 179.45 179.09 2bl5 h LYS 111 N -0.04 0.70 0.00 1.90 1.79 -0.52 -1.52 116.57 118.89 2bl5 h LYS 111 Ca -0.33 -0.25 -0.13 0.00 -2.18 0.00 0.00 60.65 57.76 2bl5 h LYS 111 Cb 1.98 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 32.56 2bl5 h LYS 111 CO 0.14 0.83 -0.60 0.52 -1.08 0.00 0.00 179.45 179.26 2bl5 h MET 112 N 0.63 0.00 -0.11 3.15 2.86 -0.39 0.17 114.93 121.24 2bl5 h MET 112 Ca 0.10 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.54 2bl5 h MET 112 Cb 0.64 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.30 2bl5 h MET 112 CO 0.05 0.60 -0.74 -0.22 1.06 0.00 0.00 176.91 177.66 2bl5 h LYS 113 N 0.00 0.53 0.00 1.72 3.11 -1.47 0.23 116.57 120.68 2bl5 h LYS 113 Ca -0.01 -0.42 0.00 0.00 -2.81 0.00 0.00 60.65 57.41 2bl5 h LYS 113 Cb 1.24 0.09 0.00 0.00 -1.00 0.00 0.00 32.23 32.56 2bl5 h LYS 113 CO 0.08 1.05 -0.07 1.25 -2.81 0.00 0.00 179.45 178.95 2bl5 h LEU 114 N 0.36 0.00 0.01 5.20 5.85 -1.06 -3.38 115.31 122.28 2bl5 h LEU 114 Ca -0.04 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.33 2bl5 h LEU 114 Cb 1.32 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.30 2bl5 h LEU 114 CO 0.13 0.24 -1.97 0.80 -0.34 0.00 0.00 178.44 177.30 2bl5 n MET 115 N -3.15 0.59 0.06 1.25 1.56 0.54 -4.21 117.12 113.76 2bl5 n MET 115 Ca -0.01 0.39 0.07 0.00 -0.27 0.00 0.00 57.70 57.88 2bl5 n MET 115 Cb 0.04 -1.61 0.31 0.00 2.15 0.00 0.00 33.22 34.11 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 -4.22 0.07 -0.26 2.12 -0.58 -0.75 -1.20 120.64 115.82 2bl5 n GLU 116 Ca -0.43 0.42 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 2bl5 n GLU 116 Cb 0.82 -1.66 0.13 0.00 -0.57 0.00 0.00 31.44 30.16 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 1.00 -6.20 -4.62 7.12 -0.71 -3.35 115.31 108.54 2bl5 h LEU 117 Ca 0.00 -0.12 -0.50 0.00 0.13 0.00 0.00 57.88 57.39 2bl5 h LEU 117 Cb 0.16 -0.26 -0.34 0.00 -0.53 0.00 0.00 40.66 39.70 2bl5 h LEU 117 CO 0.00 0.85 -0.85 0.00 -0.13 0.00 0.00 178.44 178.31 2bl5 s ALA 118 N -5.60 0.57 0.00 1.25 0.00 -0.34 -5.04 121.76 112.61 2bl5 s ALA 118 Ca -0.12 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 49.97 2bl5 s ALA 118 Cb 0.16 -1.82 0.00 0.00 0.00 0.00 0.00 23.12 21.47 2bl5 s ALA 118 CO 0.82 -2.06 0.39 -0.89 0.00 0.00 0.00 175.76 174.02 2bl5 n ILE 119 N 3.24 0.00 -2.68 0.00 5.41 -1.08 -4.61 119.36 119.63 2bl5 n ILE 119 Ca 0.23 0.82 -0.43 0.00 1.00 0.00 0.00 62.75 64.37 2bl5 n ILE 119 Cb 0.47 -1.68 -0.02 0.00 -0.71 0.00 0.00 39.64 37.70 2bl5 n ILE 119 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 2bl5 s LEU 120 N -3.25 4.15 0.27 1.39 -0.00 -1.26 -4.78 118.68 115.20 2bl5 s LEU 120 Ca 0.00 1.42 -0.20 0.00 -0.00 0.00 0.00 54.13 55.35 2bl5 s LEU 120 Cb 0.00 -3.53 0.06 0.00 -0.00 0.00 0.00 46.19 42.73 2bl5 s LEU 120 CO 0.00 -0.59 0.92 0.54 -0.00 0.00 0.00 176.35 177.22 2bl5 s ASN 121 N 1.17 -0.02 0.41 1.48 2.20 -1.26 -4.94 114.94 113.98 2bl5 s ASN 121 Ca 0.45 -0.85 0.19 0.00 -0.94 0.00 0.00 52.86 51.71 2bl5 s ASN 121 Cb -0.16 0.66 1.11 0.00 -2.00 0.00 0.00 41.25 40.86 2bl5 s ASN 121 CO 0.10 -1.29 1.80 1.23 -2.94 0.00 0.00 177.10 176.00 2bl5 h GLY 122 N 2.00 1.05 2.00 0.45 0.00 -1.96 0.83 103.07 107.44 2bl5 h GLY 122 Ca -0.29 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 2bl5 h GLY 122 CO 0.36 -0.09 -0.17 -0.84 0.00 0.00 0.00 176.54 175.81 2bl5 h THR 123 N 0.39 0.98 0.00 4.70 2.02 -1.96 -3.35 112.91 115.68 2bl5 h THR 123 Ca 0.55 -0.60 -0.10 0.00 0.77 0.00 0.00 66.41 67.04 2bl5 h THR 123 Cb 1.43 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.16 2bl5 h THR 123 CO -0.25 0.16 -1.13 -1.22 0.37 0.00 0.00 175.52 173.46 2bl5 n TYR 124 N -4.13 0.00 0.00 3.16 4.01 0.44 -5.00 117.16 115.63 2bl5 n TYR 124 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2bl5 n TYR 124 Cb 0.24 -0.24 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2bl5 n TYR 124 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2bl5 n ARG 125 N -3.45 0.00 0.18 -0.72 0.00 0.26 -4.03 116.66 108.89 2bl5 n ARG 125 Ca -0.12 0.00 0.14 0.00 -0.00 0.00 0.00 57.85 57.86 2bl5 n ARG 125 Cb 0.49 0.00 0.54 0.00 0.00 0.00 0.00 32.46 33.49 2bl5 n ARG 125 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2bl5 h ASP 126 N 0.00 0.00 0.25 6.15 3.58 -1.95 -1.71 116.42 122.75 2bl5 h ASP 126 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2bl5 h ASP 126 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2bl5 h ASP 126 CO 0.00 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.36 2bl5 n ALA 127 N -1.88 1.26 0.23 -0.78 0.00 -1.26 -1.47 120.51 116.61 2bl5 n ALA 127 Ca 0.02 0.14 0.08 0.00 0.00 0.00 0.00 53.44 53.68 2bl5 n ALA 127 Cb 0.27 -1.32 0.56 0.00 0.00 0.00 0.00 19.45 18.96 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 0.00 1.19 0.00 -1.24 -1.66 -2.13 115.58 111.73 2bl5 h ASN 128 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2bl5 h ASN 128 Cb 0.13 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.18 2bl5 h ASN 128 CO 0.00 0.20 -0.16 0.18 -1.29 0.00 0.00 177.43 176.37 2bl5 n LEU 129 N -3.95 0.60 -3.06 0.34 4.77 -0.54 -4.53 117.00 110.63 2bl5 n LEU 129 Ca -0.02 0.45 -0.02 0.00 -0.03 0.00 0.00 56.01 56.40 2bl5 n LEU 129 Cb 0.29 -0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 2bl5 n LEU 129 CO 0.34 -0.10 0.09 -0.75 -1.33 0.00 0.00 177.39 175.64 2bl5 s LYS 130 N -3.08 0.91 -0.02 3.23 2.20 -0.83 -5.15 119.74 117.00 2bl5 s LYS 130 Ca 0.11 -0.59 -0.02 0.00 -0.36 0.00 0.00 55.97 55.11 2bl5 s LYS 130 Cb 0.14 0.01 -0.04 0.00 -1.51 0.00 0.00 37.83 36.43 2bl5 s LYS 130 CO 0.61 -1.24 0.13 -1.12 -0.36 0.00 0.00 175.35 173.37 2bl5 s SER 131 N 1.47 6.05 0.24 1.43 0.01 -1.03 -4.79 113.70 117.07 2bl5 s SER 131 Ca 0.21 0.27 -0.05 0.00 1.31 0.00 0.00 55.95 57.69 2bl5 s SER 131 Cb -0.03 -1.84 0.24 0.00 0.21 0.00 0.00 66.02 64.60 2bl5 s SER 131 CO -0.06 0.28 1.78 -0.65 0.41 0.00 0.00 173.24 175.00 2bl5 h PRO 132 N 4.08 1.05 -2.32 12.44 0.11 -2.01 -3.25 132.00 142.10 2bl5 h PRO 132 Ca -0.50 -0.21 -0.78 0.00 0.11 0.00 0.00 66.00 64.62 2bl5 h PRO 132 Cb 1.19 -0.16 -0.29 0.00 0.11 0.00 0.00 31.00 31.85 2bl5 h PRO 132 CO 0.65 0.90 0.80 0.00 -0.21 0.00 0.00 178.00 180.13 2bl5 n ALA 133 N -2.45 5.80 -0.05 -0.75 0.00 -1.26 -4.74 120.51 117.06 2bl5 n ALA 133 Ca 0.06 -4.64 0.00 0.00 0.00 0.00 0.00 53.44 48.85 2bl5 n ALA 133 Cb 0.22 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.65 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 0.07 0.12 0.00 0.00 4.77 -1.23 -5.14 117.00 115.59 2bl5 n LEU 134 Ca 0.43 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.97 2bl5 n LEU 134 Cb 0.28 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2bl5 n LEU 134 CO 0.52 -0.48 0.00 1.57 -1.33 0.00 0.00 177.39 177.67