#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 3.61 -0.10 1.69 1.43 -0.03 -4.96 118.68 120.32 2bl5 s LEU 2 Ca 0.00 0.05 0.04 0.00 -1.03 0.00 0.00 54.13 53.19 2bl5 s LEU 2 Cb 0.00 -1.88 -0.00 0.00 0.03 0.00 0.00 46.19 44.34 2bl5 s LEU 2 CO 0.00 0.24 -0.22 -1.10 0.23 0.00 0.00 176.35 175.49 2bl5 s GLN 3 N -0.02 3.02 -0.18 1.70 -0.21 -1.26 -0.05 119.66 122.66 2bl5 s GLN 3 Ca 0.04 -0.85 0.01 0.00 0.02 0.00 0.00 55.36 54.58 2bl5 s GLN 3 Cb -0.13 -2.33 0.02 0.00 1.00 0.00 0.00 33.01 31.57 2bl5 s GLN 3 CO 0.02 0.22 -0.20 -1.21 -2.12 0.00 0.00 175.29 172.00 2bl5 s GLU 4 N 0.25 2.96 -0.26 2.91 0.41 -0.00 -4.97 118.70 119.99 2bl5 s GLU 4 Ca -0.15 -0.84 -0.05 0.00 -0.41 0.00 0.00 54.97 53.53 2bl5 s GLU 4 Cb -0.17 -2.57 0.01 0.00 -1.78 0.00 0.00 34.13 29.62 2bl5 s GLU 4 CO 0.08 -0.22 0.01 0.15 -0.49 0.00 0.00 175.26 174.79 2bl5 s LYS 5 N 1.29 3.08 -0.50 1.61 3.01 -1.26 -0.73 119.74 126.24 2bl5 s LYS 5 Ca 0.05 -0.84 -0.09 0.00 -1.01 0.00 0.00 55.97 54.08 2bl5 s LYS 5 Cb -0.13 -3.17 0.13 0.00 -1.01 0.00 0.00 37.83 33.64 2bl5 s LYS 5 CO -0.13 -0.37 0.37 -0.51 0.51 0.00 0.00 175.35 175.22 2bl5 s LEU 6 N 1.44 5.73 0.39 3.17 1.43 0.13 -4.94 118.68 126.03 2bl5 s LEU 6 Ca 0.02 -2.02 -0.27 0.00 -1.03 0.00 0.00 54.13 50.84 2bl5 s LEU 6 Cb -0.16 -2.01 -0.10 0.00 0.03 0.00 0.00 46.19 43.95 2bl5 s LEU 6 CO -0.01 -0.67 1.39 -0.31 0.23 0.00 0.00 176.35 176.99 2bl5 s TYR 7 N 1.21 2.69 -0.17 0.29 1.51 -1.26 -1.86 117.35 119.76 2bl5 s TYR 7 Ca 0.07 1.30 -0.03 0.00 -1.01 0.00 0.00 57.07 57.40 2bl5 s TYR 7 Cb -0.25 -3.85 0.05 0.00 -0.11 0.00 0.00 41.96 37.80 2bl5 s TYR 7 CO -0.01 -2.55 0.03 0.54 -1.11 0.00 0.00 175.55 172.44 2bl5 s VAL 8 N -1.18 0.51 -0.81 0.71 0.11 -1.08 -4.91 120.40 113.75 2bl5 s VAL 8 Ca 0.55 -0.44 -0.25 0.00 -2.93 0.00 0.00 61.98 58.91 2bl5 s VAL 8 Cb -0.43 -0.95 -0.01 0.00 -1.53 0.00 0.00 36.38 33.46 2bl5 s VAL 8 CO 0.56 -0.12 1.75 -2.16 -3.33 0.00 0.00 175.10 171.80 2bl5 s PRO 9 N 1.88 2.84 0.52 1.54 0.04 -1.26 -4.52 135.00 136.03 2bl5 s PRO 9 Ca 0.00 -0.15 0.29 0.00 0.04 0.00 0.00 61.00 61.19 2bl5 s PRO 9 Cb -0.16 -4.79 1.41 0.00 0.04 0.00 0.00 34.50 31.00 2bl5 s PRO 9 CO -0.08 -2.82 2.03 -0.24 0.04 0.00 0.00 177.00 175.94 2bl5 h VAL 10 N 6.90 0.41 -0.12 -0.36 3.04 -1.84 0.22 116.25 124.51 2bl5 h VAL 10 Ca -0.05 -0.61 -0.03 0.00 -1.01 0.00 0.00 66.70 65.00 2bl5 h VAL 10 Cb 1.06 1.44 -0.01 0.00 -2.01 0.00 0.00 31.29 31.77 2bl5 h VAL 10 CO 1.26 0.11 -0.08 0.11 -1.01 0.00 0.00 177.57 177.96 2bl5 h LYS 11 N 0.00 0.17 0.06 4.17 1.57 -1.96 -2.52 116.57 118.06 2bl5 h LYS 11 Ca -0.00 -0.03 -0.24 0.00 -1.87 0.00 0.00 60.65 58.51 2bl5 h LYS 11 Cb 0.43 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2bl5 h LYS 11 CO 0.01 0.26 -1.09 0.93 -0.57 0.00 0.00 179.45 179.00 2bl5 h GLU 12 N 0.17 0.14 -2.93 3.15 4.39 -1.35 -3.40 114.58 114.75 2bl5 h GLU 12 Ca 0.04 -0.22 -0.61 0.00 0.34 0.00 0.00 59.36 58.90 2bl5 h GLU 12 Cb 0.25 0.08 -0.41 0.00 -0.10 0.00 0.00 28.75 28.58 2bl5 h GLU 12 CO 0.01 1.09 -0.71 0.71 -1.16 0.00 0.00 179.01 178.95 2bl5 s TYR 13 N -2.75 2.61 0.15 4.33 2.02 -0.85 -4.93 117.35 117.93 2bl5 s TYR 13 Ca -0.02 -2.89 0.33 0.00 -0.37 0.00 0.00 57.07 54.13 2bl5 s TYR 13 Cb 0.09 -2.13 1.37 0.00 -0.40 0.00 0.00 41.96 40.89 2bl5 s TYR 13 CO 0.85 -0.68 1.99 -1.00 -1.57 0.00 0.00 175.55 175.13 2bl5 h PRO 14 N 5.87 0.00 0.00 -1.71 0.13 -1.75 -2.99 132.00 131.56 2bl5 h PRO 14 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2bl5 h PRO 14 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2bl5 h PRO 14 CO 0.58 0.03 -1.23 -3.47 -0.23 0.00 0.00 178.00 173.69 2bl5 n ASP 15 N -3.15 0.75 -4.48 1.44 2.03 -1.26 -4.83 116.55 107.05 2bl5 n ASP 15 Ca 0.00 -0.71 -0.43 0.00 0.52 0.00 0.00 54.79 54.17 2bl5 n ASP 15 Cb 0.31 1.26 -0.09 0.00 -0.72 0.00 0.00 41.12 41.88 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 -3.06 3.21 -0.99 -0.67 5.36 -1.13 -5.01 117.98 115.69 2bl5 s PHE 16 Ca 0.03 -0.46 -0.23 0.00 -0.96 0.00 0.00 56.93 55.31 2bl5 s PHE 16 Cb 0.15 -2.72 0.05 0.00 -0.34 0.00 0.00 43.02 40.16 2bl5 s PHE 16 CO 0.84 -0.62 1.43 0.54 -1.46 0.00 0.00 175.22 175.95 2bl5 s ASN 17 N 1.74 6.47 0.42 6.13 4.22 -1.26 -4.85 114.94 127.81 2bl5 s ASN 17 Ca 0.08 -1.38 0.11 0.00 -2.14 0.00 0.00 52.86 49.54 2bl5 s ASN 17 Cb -0.18 -2.56 0.96 0.00 1.28 0.00 0.00 41.25 40.74 2bl5 s ASN 17 CO 0.12 -1.53 1.99 -0.26 -2.04 0.00 0.00 177.10 175.37 2bl5 h PHE 18 N 9.80 0.51 -0.00 1.54 0.04 -1.95 0.27 116.94 127.14 2bl5 h PHE 18 Ca 0.16 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.94 2bl5 h PHE 18 Cb 1.01 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 39.00 2bl5 h PHE 18 CO 1.26 0.26 -0.00 -0.39 -0.60 0.00 0.00 178.31 178.84 2bl5 h VAL 19 N 0.49 1.36 0.00 -0.55 -1.51 -1.88 0.81 116.25 114.97 2bl5 h VAL 19 Ca 0.27 -1.08 0.00 0.00 -1.23 0.00 0.00 66.70 64.66 2bl5 h VAL 19 Cb 0.41 2.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.67 2bl5 h VAL 19 CO -0.08 0.28 0.00 0.61 -1.23 0.00 0.00 177.57 177.15 2bl5 n GLY 20 N 0.14 -0.89 0.13 5.19 0.00 -0.85 -0.72 105.19 108.19 2bl5 n GLY 20 Ca -0.08 0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.01 0.70 -0.08 1.61 3.00 0.89 -3.84 116.66 116.93 2bl5 n ARG 21 Ca 0.00 0.32 -0.13 0.00 -0.00 0.00 0.00 57.85 58.04 2bl5 n ARG 21 Cb 0.09 -1.68 -0.08 0.00 0.00 0.00 0.00 32.46 30.79 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 -0.23 0.71 0.00 5.15 1.08 0.14 -3.41 117.51 120.95 2bl5 h ILE 22 Ca -0.44 -1.73 0.00 0.00 -0.39 0.00 0.00 64.86 62.30 2bl5 h ILE 22 Cb 1.84 1.53 0.00 0.00 -3.07 0.00 0.00 36.82 37.12 2bl5 h ILE 22 CO -0.02 0.24 -1.77 0.00 -0.69 0.00 0.00 178.15 175.91 2bl5 n LEU 23 N -4.56 0.23 0.00 1.44 -0.00 0.11 -3.10 117.00 111.11 2bl5 n LEU 23 Ca -0.17 -0.10 0.00 0.00 -0.00 0.00 0.00 56.01 55.74 2bl5 n LEU 23 Cb 0.44 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.86 2bl5 n LEU 23 CO 0.17 0.05 0.38 0.61 -0.00 0.00 0.00 177.39 178.60 2bl5 n GLY 24 N 1.31 -2.90 0.06 1.47 0.00 -0.46 -1.20 105.19 103.47 2bl5 n GLY 24 Ca -0.02 0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.47 0.38 -0.13 1.61 -0.04 -1.26 -4.32 135.00 129.77 2bl5 n PRO 25 Ca 0.00 0.04 0.10 0.00 -0.04 0.00 0.00 63.50 63.60 2bl5 n PRO 25 Cb 0.00 -1.67 0.15 0.00 -0.04 0.00 0.00 33.50 31.95 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 -2.18 1.45 0.07 0.54 3.00 -1.22 -4.72 116.66 113.60 2bl5 n ARG 26 Ca 0.02 -2.63 0.20 0.00 -0.00 0.00 0.00 57.85 55.43 2bl5 n ARG 26 Cb 0.47 -1.54 0.74 0.00 0.00 0.00 0.00 32.46 32.13 2bl5 n ARG 26 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 2bl5 h GLY 27 N 0.21 0.00 1.60 5.14 0.00 -1.09 0.14 103.07 109.07 2bl5 h GLY 27 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.38 2bl5 h GLY 27 CO 0.02 0.00 0.16 1.41 0.00 0.00 0.00 176.54 178.13 2bl5 h LEU 28 N 0.00 0.07 -0.80 3.11 -0.00 -1.84 -1.39 115.31 114.46 2bl5 h LEU 28 Ca 0.21 -0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.99 2bl5 h LEU 28 Cb 1.00 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.63 2bl5 h LEU 28 CO -0.00 0.05 -0.09 0.00 -0.00 0.00 0.00 178.44 178.39 2bl5 h THR 29 N 0.08 1.26 -0.44 0.22 1.03 -1.06 -0.63 112.91 113.36 2bl5 h THR 29 Ca 0.10 -1.16 -0.06 0.00 -0.01 0.00 0.00 66.41 65.28 2bl5 h THR 29 Cb 0.31 1.01 -0.02 0.00 -1.07 0.00 0.00 68.15 68.38 2bl5 h THR 29 CO -0.01 0.40 0.01 0.00 -0.01 0.00 0.00 175.52 175.91 2bl5 h ALA 30 N 1.16 1.19 -0.07 0.00 0.00 -1.37 -0.88 119.26 119.29 2bl5 h ALA 30 Ca 0.13 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 2bl5 h ALA 30 Cb 0.58 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2bl5 h ALA 30 CO 0.04 0.53 -0.45 0.87 0.00 0.00 0.00 179.25 180.24 2bl5 h LYS 31 N 0.68 0.17 -0.49 0.00 1.57 -1.21 -2.84 116.57 114.45 2bl5 h LYS 31 Ca 0.14 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2bl5 h LYS 31 Cb 0.40 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 2bl5 h LYS 31 CO 0.01 0.59 0.12 1.96 -0.57 0.00 0.00 179.45 181.57 2bl5 h GLN 32 N 0.14 0.78 -0.50 3.15 1.08 0.22 0.04 115.11 120.02 2bl5 h GLN 32 Ca 0.01 -0.19 -0.02 0.00 -1.45 0.00 0.00 58.65 57.00 2bl5 h GLN 32 Cb 0.85 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 28.16 2bl5 h GLN 32 CO 0.07 0.76 0.22 -0.07 -0.95 0.00 0.00 178.83 178.86 2bl5 h LEU 33 N 0.67 0.66 -0.05 1.46 4.07 -1.15 0.17 115.31 121.14 2bl5 h LEU 33 Ca 0.15 -0.14 -0.05 0.00 0.08 0.00 0.00 57.88 57.92 2bl5 h LEU 33 Cb 0.32 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.90 2bl5 h LEU 33 CO 0.00 0.62 -0.17 1.05 -1.08 0.00 0.00 178.44 178.86 2bl5 h GLU 34 N 0.66 0.20 -0.39 1.13 4.11 -0.80 -0.97 114.58 118.51 2bl5 h GLU 34 Ca 0.17 -0.15 -0.10 0.00 0.07 0.00 0.00 59.36 59.35 2bl5 h GLU 34 Cb 0.15 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2bl5 h GLU 34 CO -0.02 0.79 -0.13 0.00 0.07 0.00 0.00 179.01 179.72 2bl5 h ALA 35 N 0.41 0.55 0.00 1.06 0.00 -0.96 -1.99 119.26 118.33 2bl5 h ALA 35 Ca -0.01 -0.33 -0.23 0.00 0.00 0.00 0.00 54.91 54.34 2bl5 h ALA 35 Cb 0.81 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2bl5 h ALA 35 CO 0.04 0.44 -1.35 -1.91 0.00 0.00 0.00 179.25 176.47 2bl5 n GLU 36 N -4.31 0.55 0.08 0.00 4.07 0.57 -4.35 120.64 117.26 2bl5 n GLU 36 Ca -0.01 0.51 0.12 0.00 -0.06 0.00 0.00 57.16 57.72 2bl5 n GLU 36 Cb 0.38 -1.69 0.19 0.00 -0.06 0.00 0.00 31.44 30.26 2bl5 n GLU 36 CO 0.00 0.00 0.00 1.79 -0.06 0.00 0.00 177.13 178.86 2bl5 h THR 37 N -1.00 0.00 0.00 6.31 1.35 -1.23 -3.47 112.91 114.87 2bl5 h THR 37 Ca -0.35 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 2bl5 h THR 37 Cb 1.23 1.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 2bl5 h THR 37 CO -0.21 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.67 2bl5 n GLY 38 N 1.30 0.46 3.36 5.82 0.00 -0.70 -4.78 105.19 110.65 2bl5 n GLY 38 Ca 0.03 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 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 1.53 3.50 -0.22 0.00 2.20 0.12 -0.93 119.74 125.93 2bl5 s LYS 40 Ca 0.05 -1.04 -0.29 0.00 -0.36 0.00 0.00 55.97 54.33 2bl5 s LYS 40 Cb -0.16 -5.04 0.01 0.00 -1.51 0.00 0.00 37.83 31.13 2bl5 s LYS 40 CO 0.01 -2.12 1.05 -1.50 -0.36 0.00 0.00 175.35 172.43 2bl5 s ILE 41 N 4.75 4.65 -0.08 5.43 2.07 -1.26 -2.21 121.20 134.56 2bl5 s ILE 41 Ca 0.41 2.00 0.04 0.00 -1.41 0.00 0.00 60.65 61.69 2bl5 s ILE 41 Cb -0.03 -4.29 -0.01 0.00 0.13 0.00 0.00 42.46 38.26 2bl5 s ILE 41 CO -0.05 -0.18 -0.22 0.00 -1.91 0.00 0.00 174.94 172.59 2bl5 s MET 42 N 3.21 2.86 -0.34 3.50 0.23 0.18 -4.92 119.30 124.01 2bl5 s MET 42 Ca 0.45 -0.85 -0.29 0.00 -1.03 0.00 0.00 55.69 53.96 2bl5 s MET 42 Cb -0.15 -2.29 0.01 0.00 -1.53 0.00 0.00 34.83 30.86 2bl5 s MET 42 CO 0.07 0.29 1.22 0.08 -2.03 0.00 0.00 175.02 174.65 2bl5 s VAL 43 N 0.07 4.23 -0.27 5.16 1.01 -1.26 -1.26 120.40 128.09 2bl5 s VAL 43 Ca -0.10 1.38 -0.06 0.00 0.00 0.00 0.00 61.98 63.20 2bl5 s VAL 43 Cb -0.16 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.93 2bl5 s VAL 43 CO 0.06 -0.58 0.04 -0.13 0.00 0.00 0.00 175.10 174.49 2bl5 s ARG 44 N 4.13 3.19 0.00 2.72 0.52 0.10 -4.62 118.95 124.98 2bl5 s ARG 44 Ca 0.52 -0.78 0.00 0.00 -0.52 0.00 0.00 55.73 54.96 2bl5 s ARG 44 Cb -0.14 -3.27 0.00 0.00 0.52 0.00 0.00 34.95 32.07 2bl5 s ARG 44 CO 0.23 -0.36 0.00 0.41 0.02 0.00 0.00 175.30 175.60 2bl5 n GLY 45 N 4.84 -1.44 3.59 -3.53 0.00 0.86 0.59 105.19 110.11 2bl5 n GLY 45 Ca -0.16 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 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 -1.65 3.40 0.00 1.61 -2.85 -1.05 -3.36 119.74 115.83 2bl5 s LYS 46 Ca 0.00 0.99 0.00 0.00 -1.00 0.00 0.00 55.97 55.96 2bl5 s LYS 46 Cb 0.00 -4.11 0.00 0.00 -2.06 0.00 0.00 37.83 31.66 2bl5 s LYS 46 CO 0.00 -1.79 0.00 0.41 0.10 0.00 0.00 175.35 174.07 2bl5 n GLY 47 N 5.25 1.88 0.41 0.59 0.00 -1.26 -4.81 105.19 107.25 2bl5 n GLY 47 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.86 -0.49 1.61 0.87 -1.79 -3.34 113.55 109.55 2bl5 h SER 48 Ca 0.00 0.03 -0.36 0.00 -1.23 0.00 0.00 61.79 60.22 2bl5 h SER 48 Cb 0.00 0.22 -0.32 0.00 -0.44 0.00 0.00 62.40 61.86 2bl5 h SER 48 CO 0.00 -0.49 -0.79 0.23 -0.53 0.00 0.00 176.83 175.25 2bl5 n MET 49 N -5.45 2.72 0.00 2.24 2.81 -1.26 -4.92 117.12 113.25 2bl5 n MET 49 Ca -0.13 -3.77 0.00 0.00 -1.81 0.00 0.00 57.70 51.99 2bl5 n MET 49 Cb 0.40 -1.92 0.00 0.00 -0.71 0.00 0.00 33.22 30.99 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 -0.73 0.00 -2.19 0.03 3.00 -1.25 -4.75 116.66 110.76 2bl5 n ARG 50 Ca 0.32 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.78 2bl5 n ARG 50 Cb 0.89 -1.20 -0.01 0.00 0.00 0.00 0.00 32.46 32.14 2bl5 n ARG 50 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2bl5 s ASP 51 N 0.09 6.35 0.26 6.15 -1.08 -1.26 -4.92 116.67 122.26 2bl5 s ASP 51 Ca 0.00 2.45 0.01 0.00 -0.52 0.00 0.00 52.55 54.49 2bl5 s ASP 51 Cb 0.00 -2.62 0.34 0.00 -1.46 0.00 0.00 42.92 39.18 2bl5 s ASP 51 CO 0.00 -0.80 1.68 0.11 0.52 0.00 0.00 175.17 176.68 2bl5 h LYS 52 N 2.51 0.53 -0.12 4.34 6.56 -2.00 -1.91 116.57 126.47 2bl5 h LYS 52 Ca -0.49 -0.22 -0.12 0.00 -1.06 0.00 0.00 60.65 58.77 2bl5 h LYS 52 Cb 1.24 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.87 2bl5 h LYS 52 CO 0.62 0.76 -0.44 1.57 -2.06 0.00 0.00 179.45 179.90 2bl5 h LYS 53 N 0.46 0.28 -0.10 3.15 2.10 -1.95 -2.76 116.57 117.75 2bl5 h LYS 53 Ca 0.06 -0.14 -0.01 0.00 -2.00 0.00 0.00 60.65 58.56 2bl5 h LYS 53 Cb 0.73 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.06 2bl5 h LYS 53 CO 0.06 0.67 0.03 -0.22 -2.00 0.00 0.00 179.45 177.99 2bl5 h LYS 54 N 0.23 0.15 0.00 0.07 1.63 -1.68 -2.35 116.57 114.62 2bl5 h LYS 54 Ca 0.02 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.78 2bl5 h LYS 54 Cb 0.87 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.48 2bl5 h LYS 54 CO 0.07 0.28 -0.06 1.05 -3.45 0.00 0.00 179.45 177.34 2bl5 h GLU 55 N -0.02 0.00 0.30 1.90 4.11 -1.32 0.84 114.58 120.39 2bl5 h GLU 55 Ca 0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.45 2bl5 h GLU 55 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2bl5 h GLU 55 CO -0.00 0.06 -0.14 0.93 0.07 0.00 0.00 179.01 179.92 2bl5 h GLU 56 N 0.00 -0.38 0.00 1.06 5.08 -1.17 -3.36 114.58 115.81 2bl5 h GLU 56 Ca -0.00 0.03 -0.27 0.00 -1.00 0.00 0.00 59.36 58.12 2bl5 h GLU 56 Cb 0.32 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 2bl5 h GLU 56 CO 0.01 -0.18 -2.01 0.00 -1.00 0.00 0.00 179.01 175.84 2bl5 n GLN 57 N -5.04 0.76 -0.44 2.33 -0.00 -0.92 -4.48 117.38 109.58 2bl5 n GLN 57 Ca -0.06 0.08 0.07 0.00 -0.00 0.00 0.00 57.00 57.09 2bl5 n GLN 57 Cb 0.20 -1.36 0.27 0.00 -0.00 0.00 0.00 30.24 29.34 2bl5 n GLN 57 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2bl5 n ASN 58 N -2.90 3.59 -4.56 2.61 2.85 0.25 -4.95 115.26 112.15 2bl5 n ASN 58 Ca -0.30 -2.29 -0.37 0.00 -0.11 0.00 0.00 54.58 51.52 2bl5 n ASN 58 Cb 0.87 -0.48 0.06 0.00 1.24 0.00 0.00 39.78 41.47 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 0.83 0.59 0.00 1.20 1.85 0.14 -2.77 116.66 118.50 2bl5 n ARG 59 Ca 0.19 0.24 0.00 0.00 -1.00 0.00 0.00 57.85 57.29 2bl5 n ARG 59 Cb 0.67 -2.03 0.00 0.00 -1.05 0.00 0.00 32.46 30.05 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 1.40 2.92 3.76 2.89 0.00 -1.26 -4.99 105.19 109.91 2bl5 n GLY 60 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2bl5 n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bl5 s LYS 61 N -0.06 1.27 0.15 1.61 -0.14 -1.11 -3.97 119.74 117.49 2bl5 s LYS 61 Ca 0.00 0.51 0.11 0.00 -1.36 0.00 0.00 55.97 55.23 2bl5 s LYS 61 Cb 0.00 -1.84 0.50 0.00 -1.68 0.00 0.00 37.83 34.81 2bl5 s LYS 61 CO 0.00 -2.15 0.51 -2.30 -0.76 0.00 0.00 175.35 170.65 2bl5 n PRO 62 N -3.77 -0.01 -0.24 -1.68 -0.02 -1.26 0.13 135.00 128.15 2bl5 n PRO 62 Ca 0.06 0.41 -0.08 0.00 -2.02 0.00 0.00 63.50 61.87 2bl5 n PRO 62 Cb 0.57 -0.81 0.04 0.00 -0.02 0.00 0.00 33.50 33.28 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 1.07 0.51 2.55 2.35 -1.90 -0.71 115.58 119.45 2bl5 h ASN 63 Ca 0.29 -0.27 -0.27 0.00 -0.55 0.00 0.00 56.30 55.50 2bl5 h ASN 63 Cb 0.95 -0.29 -0.05 0.00 0.05 0.00 0.00 38.32 38.99 2bl5 h ASN 63 CO -0.15 1.07 -1.68 0.79 -1.65 0.00 0.00 177.43 175.81 2bl5 n TRP 64 N -4.21 0.96 -0.14 1.19 7.02 0.35 -2.24 117.44 120.38 2bl5 n TRP 64 Ca 0.04 0.34 -0.04 0.00 -1.02 0.00 0.00 57.50 56.83 2bl5 n TRP 64 Cb 0.31 -1.16 0.03 0.00 -2.42 0.00 0.00 31.31 28.06 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 0.04 -0.11 -0.99 4.81 -0.47 -0.77 114.58 117.09 2bl5 h GLU 65 Ca -0.27 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 2bl5 h GLU 65 Cb 1.95 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.32 2bl5 h GLU 65 CO 0.07 0.02 0.00 -2.39 -0.73 0.00 0.00 179.01 175.99 2bl5 n HIS 66 N -5.29 0.11 0.40 0.92 1.44 -0.30 -3.87 115.22 108.64 2bl5 n HIS 66 Ca 0.04 -0.06 0.13 0.00 -2.01 0.00 0.00 57.72 55.82 2bl5 n HIS 66 Cb 0.24 0.00 0.50 0.00 0.12 0.00 0.00 29.99 30.85 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 3.74 0.00 -1.60 2.39 6.46 -0.67 0.27 115.31 125.90 2bl5 h LEU 67 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2bl5 h LEU 67 Cb 0.80 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.73 2bl5 h LEU 67 CO 0.00 0.00 0.00 -0.46 -0.62 0.00 0.00 178.44 177.36 2bl5 n ASN 68 N -2.49 2.36 -4.97 1.25 0.23 -1.13 -3.24 115.26 107.27 2bl5 n ASN 68 Ca 0.02 -1.90 -0.21 0.00 -0.53 0.00 0.00 54.58 51.96 2bl5 n ASN 68 Cb 0.30 -0.23 -0.01 0.00 -2.08 0.00 0.00 39.78 37.76 2bl5 n ASN 68 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2bl5 s GLU 69 N -1.54 3.27 0.28 -3.83 2.02 -0.57 -5.01 118.70 113.32 2bl5 s GLU 69 Ca 0.33 -0.71 -0.29 0.00 0.02 0.00 0.00 54.97 54.31 2bl5 s GLU 69 Cb 0.18 -2.76 -0.09 0.00 0.10 0.00 0.00 34.13 31.55 2bl5 s GLU 69 CO 0.24 0.12 1.05 0.34 0.02 0.00 0.00 175.26 177.04 2bl5 s ASP 70 N -4.10 7.35 -0.24 -0.19 2.15 -1.26 -2.54 116.67 117.83 2bl5 s ASP 70 Ca 0.41 2.15 -0.32 0.00 0.43 0.00 0.00 52.55 55.23 2bl5 s ASP 70 Cb -0.09 -2.62 -0.09 0.00 -0.30 0.00 0.00 42.92 39.82 2bl5 s ASP 70 CO 0.33 -0.08 2.15 -0.11 -0.17 0.00 0.00 175.17 177.29 2bl5 n LEU 71 N 1.17 2.86 -4.02 -1.34 7.94 -1.26 -4.12 117.00 118.23 2bl5 n LEU 71 Ca -0.01 0.42 -0.10 0.00 -1.11 0.00 0.00 56.01 55.22 2bl5 n LEU 71 Cb 0.46 -1.41 -0.07 0.00 0.53 0.00 0.00 43.42 42.92 2bl5 n LEU 71 CO 0.52 -0.59 -0.05 -1.38 -1.11 0.00 0.00 177.39 174.78 2bl5 s HIS 72 N 7.17 0.55 -0.14 1.96 -3.43 0.20 -2.62 115.29 118.97 2bl5 s HIS 72 Ca 1.03 -0.89 -0.06 0.00 -0.80 0.00 0.00 55.06 54.33 2bl5 s HIS 72 Cb -0.60 -0.14 -0.04 0.00 -1.43 0.00 0.00 32.58 30.37 2bl5 s HIS 72 CO 0.44 -0.72 0.09 0.14 -2.00 0.00 0.00 174.74 172.68 2bl5 s VAL 73 N -4.01 5.04 -0.23 -5.38 -7.23 -0.78 0.00 120.40 107.81 2bl5 s VAL 73 Ca 0.22 0.04 0.00 0.00 -1.81 0.00 0.00 61.98 60.43 2bl5 s VAL 73 Cb 0.04 -3.22 0.06 0.00 0.56 0.00 0.00 36.38 33.82 2bl5 s VAL 73 CO 0.03 0.55 -0.05 -0.22 -0.31 0.00 0.00 175.10 175.10 2bl5 s LEU 74 N -0.41 2.45 -0.51 1.32 0.20 -0.39 0.20 118.68 121.54 2bl5 s LEU 74 Ca 0.10 -1.15 -0.27 0.00 0.69 0.00 0.00 54.13 53.51 2bl5 s LEU 74 Cb -0.12 -1.13 0.03 0.00 -0.43 0.00 0.00 46.19 44.54 2bl5 s LEU 74 CO 0.02 -0.24 1.04 0.27 -0.29 0.00 0.00 176.35 177.14 2bl5 s ILE 75 N 1.43 4.29 -0.28 6.68 -4.36 0.09 0.47 121.20 129.52 2bl5 s ILE 75 Ca -0.05 0.78 -0.09 0.00 -0.26 0.00 0.00 60.65 61.02 2bl5 s ILE 75 Cb -0.19 -4.56 -0.03 0.00 1.25 0.00 0.00 42.46 38.93 2bl5 s ILE 75 CO -0.06 -1.06 0.14 -0.89 0.24 0.00 0.00 174.94 173.31 2bl5 s THR 76 N 4.23 4.77 -0.16 8.37 2.01 -0.94 -0.82 115.64 133.10 2bl5 s THR 76 Ca 0.39 -0.12 0.01 0.00 0.31 0.00 0.00 61.69 62.28 2bl5 s THR 76 Cb -0.09 -3.31 0.01 0.00 0.01 0.00 0.00 72.50 69.12 2bl5 s THR 76 CO 0.26 0.22 -0.19 0.54 -0.69 0.00 0.00 174.62 174.76 2bl5 s VAL 77 N 1.67 2.28 -0.88 3.82 0.11 0.92 0.11 120.40 128.43 2bl5 s VAL 77 Ca 0.06 -0.89 -0.19 0.00 -2.93 0.00 0.00 61.98 58.03 2bl5 s VAL 77 Cb -0.16 -1.95 0.12 0.00 -1.53 0.00 0.00 36.38 32.86 2bl5 s VAL 77 CO 0.07 0.53 1.09 -1.61 -3.33 0.00 0.00 175.10 171.85 2bl5 s GLU 78 N 1.03 3.51 0.00 1.54 2.02 -1.26 -0.85 118.70 124.68 2bl5 s GLU 78 Ca -0.02 -1.60 0.00 0.00 0.02 0.00 0.00 54.97 53.37 2bl5 s GLU 78 Cb -0.14 -4.79 0.00 0.00 0.10 0.00 0.00 34.13 29.29 2bl5 s GLU 78 CO -0.06 -1.77 0.00 -3.47 0.02 0.00 0.00 175.26 169.98 2bl5 n ASP 79 N 6.73 0.00 -0.26 -0.19 -0.08 -1.26 -5.04 116.55 116.46 2bl5 n ASP 79 Ca 0.19 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.57 2bl5 n ASP 79 Cb 0.48 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.92 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 -0.08 4.05 -2.41 -1.67 0.00 -1.26 -4.30 120.51 114.84 2bl5 n ALA 80 Ca 0.00 -0.60 -0.37 0.00 0.00 0.00 0.00 53.44 52.46 2bl5 n ALA 80 Cb 0.00 -0.81 -0.06 0.00 0.00 0.00 0.00 19.45 18.58 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 -2.72 4.00 0.18 0.00 -0.21 -1.26 -4.97 119.66 114.68 2bl5 s GLN 81 Ca 0.14 0.50 0.25 0.00 0.02 0.00 0.00 55.36 56.28 2bl5 s GLN 81 Cb 0.17 -3.14 0.90 0.00 1.00 0.00 0.00 33.01 31.94 2bl5 s GLN 81 CO 0.70 0.62 1.77 0.09 -2.12 0.00 0.00 175.29 176.35 2bl5 n ASN 82 N 1.49 0.62 -0.10 5.90 4.13 -1.26 -2.20 115.26 123.83 2bl5 n ASN 82 Ca -0.10 0.58 -0.12 0.00 1.68 0.00 0.00 54.58 56.62 2bl5 n ASN 82 Cb 0.52 -0.74 0.00 0.00 -1.54 0.00 0.00 39.78 38.02 2bl5 n ASN 82 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 2bl5 h ARG 83 N 0.00 0.88 0.71 3.52 3.08 -1.98 -0.84 114.38 119.75 2bl5 h ARG 83 Ca 0.00 -0.45 -0.03 0.00 0.07 0.00 0.00 59.98 59.57 2bl5 h ARG 83 Cb 0.60 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2bl5 h ARG 83 CO 0.00 1.10 -0.48 0.00 -1.07 0.00 0.00 179.97 179.52 2bl5 h ALA 84 N 0.84 -1.24 -0.50 0.04 0.00 -1.81 -2.34 119.26 114.25 2bl5 h ALA 84 Ca 0.06 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.81 2bl5 h ALA 84 Cb 0.96 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 2bl5 h ALA 84 CO 0.09 -1.21 0.33 1.05 0.00 0.00 0.00 179.25 179.51 2bl5 h GLU 85 N -1.13 0.39 -0.70 0.00 4.11 -1.52 0.45 114.58 116.18 2bl5 h GLU 85 Ca -0.09 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.30 2bl5 h GLU 85 Cb 0.92 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 2bl5 h GLU 85 CO 0.07 0.26 0.39 1.25 0.07 0.00 0.00 179.01 181.05 2bl5 h LEU 86 N 0.40 0.85 -0.12 3.06 7.12 -0.88 0.35 115.31 126.09 2bl5 h LEU 86 Ca 0.22 -0.06 -0.08 0.00 0.13 0.00 0.00 57.88 58.09 2bl5 h LEU 86 Cb 0.35 -0.22 0.00 0.00 -0.53 0.00 0.00 40.66 40.26 2bl5 h LEU 86 CO -0.06 0.68 -0.23 0.50 -0.13 0.00 0.00 178.44 179.20 2bl5 h LYS 87 N 0.97 0.37 -0.18 1.25 3.64 -0.37 -2.59 116.57 119.66 2bl5 h LYS 87 Ca 0.25 -0.24 -0.17 0.00 -1.27 0.00 0.00 60.65 59.22 2bl5 h LYS 87 Cb 0.01 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2bl5 h LYS 87 CO -0.04 0.83 -0.58 1.37 -2.27 0.00 0.00 179.45 178.76 2bl5 h LEU 88 N -0.04 0.66 -0.98 5.20 -0.00 -1.27 -2.83 115.31 116.05 2bl5 h LEU 88 Ca 0.01 -0.37 -0.06 0.00 -0.00 0.00 0.00 57.88 57.46 2bl5 h LEU 88 Cb 0.82 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 41.26 2bl5 h LEU 88 CO 0.05 1.10 0.10 0.07 -0.00 0.00 0.00 178.44 179.76 2bl5 h LYS 89 N 0.45 0.84 -0.25 0.17 5.09 -0.32 0.32 116.57 122.87 2bl5 h LYS 89 Ca 0.00 -0.19 -0.16 0.00 0.09 0.00 0.00 60.65 60.39 2bl5 h LYS 89 Cb 1.15 -0.12 -0.01 0.00 0.10 0.00 0.00 32.23 33.35 2bl5 h LYS 89 CO 0.11 0.78 -0.49 0.07 -2.09 0.00 0.00 179.45 177.83 2bl5 h ARG 90 N 0.81 0.67 -0.15 0.07 0.11 -1.45 0.89 114.38 115.33 2bl5 h ARG 90 Ca 0.17 -0.39 -0.04 0.00 0.10 0.00 0.00 59.98 59.82 2bl5 h ARG 90 Cb 0.34 0.03 -0.00 0.00 1.11 0.00 0.00 29.97 31.45 2bl5 h ARG 90 CO 0.00 1.01 -0.05 0.00 0.10 0.00 0.00 179.97 181.03 2bl5 h ALA 91 N 0.92 0.21 0.00 0.08 0.00 -1.17 -2.45 119.26 116.84 2bl5 h ALA 91 Ca 0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2bl5 h ALA 91 Cb 1.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2bl5 h ALA 91 CO 0.10 -0.02 -0.22 -0.24 0.00 0.00 0.00 179.25 178.86 2bl5 h VAL 92 N -0.02 0.87 -0.15 0.00 3.04 -0.33 -0.87 116.25 118.79 2bl5 h VAL 92 Ca 0.04 -0.86 -0.06 0.00 -1.01 0.00 0.00 66.70 64.80 2bl5 h VAL 92 Cb 0.49 1.51 -0.01 0.00 -2.01 0.00 0.00 31.29 31.27 2bl5 h VAL 92 CO 0.02 0.22 -0.18 -0.33 -1.01 0.00 0.00 177.57 176.28 2bl5 h GLU 93 N 0.00 0.26 0.00 4.17 5.08 -0.60 0.40 114.58 123.88 2bl5 h GLU 93 Ca -0.00 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2bl5 h GLU 93 Cb 0.49 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2bl5 h GLU 93 CO 0.03 0.44 -0.27 0.93 -1.00 0.00 0.00 179.01 179.14 2bl5 h GLU 94 N 0.24 0.00 -0.09 2.33 5.08 -0.70 -1.56 114.58 119.87 2bl5 h GLU 94 Ca 0.04 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.26 2bl5 h GLU 94 Cb 0.47 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2bl5 h GLU 94 CO 0.03 0.27 -0.57 0.28 -1.00 0.00 0.00 179.01 178.01 2bl5 h VAL 95 N 0.00 1.37 -0.54 3.13 2.07 -0.37 -1.27 116.25 120.64 2bl5 h VAL 95 Ca -0.00 -1.90 0.12 0.00 0.82 0.00 0.00 66.70 65.74 2bl5 h VAL 95 Cb 0.73 1.93 -0.03 0.00 -1.52 0.00 0.00 31.29 32.41 2bl5 h VAL 95 CO 0.03 0.57 0.37 0.11 0.02 0.00 0.00 177.57 178.67 2bl5 h LYS 96 N 0.21 0.18 0.00 1.57 1.57 0.68 0.90 116.57 121.69 2bl5 h LYS 96 Ca -0.00 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 2bl5 h LYS 96 Cb 1.07 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 2bl5 h LYS 96 CO 0.09 0.12 -0.63 0.87 -0.57 0.00 0.00 179.45 179.34 2bl5 h LYS 97 N 0.19 0.00 0.25 3.15 1.79 -0.91 -3.34 116.57 117.71 2bl5 h LYS 97 Ca 0.26 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.38 2bl5 h LYS 97 Cb 0.75 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.44 2bl5 h LYS 97 CO -0.04 0.63 -1.51 1.25 -1.08 0.00 0.00 179.45 178.69 2bl5 h LEU 98 N 0.00 0.84 -0.97 2.94 7.12 0.75 -3.31 115.31 122.67 2bl5 h LEU 98 Ca -0.01 -0.92 0.00 0.00 0.13 0.00 0.00 57.88 57.09 2bl5 h LEU 98 Cb 1.35 -0.27 0.00 0.00 -0.53 0.00 0.00 40.66 41.21 2bl5 h LEU 98 CO 0.08 1.72 0.00 0.00 -0.13 0.00 0.00 178.44 180.12 2bl5 n LEU 99 N -3.71 0.73 -4.68 2.25 -0.00 0.27 -4.80 117.00 107.07 2bl5 n LEU 99 Ca -0.18 -0.37 -0.42 0.00 -0.00 0.00 0.00 56.01 55.04 2bl5 n LEU 99 Cb 1.11 -0.37 -0.03 0.00 -0.00 0.00 0.00 43.42 44.13 2bl5 n LEU 99 CO 0.60 0.18 1.14 0.54 -0.00 0.00 0.00 177.39 179.85 2bl5 s VAL 100 N -1.03 3.76 -2.00 1.47 0.11 -1.25 -4.88 120.40 116.58 2bl5 s VAL 100 Ca 0.00 1.10 0.04 0.00 -2.93 0.00 0.00 61.98 60.19 2bl5 s VAL 100 Cb 0.00 -3.71 0.10 0.00 -1.53 0.00 0.00 36.38 31.25 2bl5 s VAL 100 CO 0.00 -0.02 0.66 -0.81 -3.33 0.00 0.00 175.10 171.60 2bl5 n PRO 101 N 5.65 0.45 -1.70 1.54 -0.04 -1.26 -4.75 135.00 134.89 2bl5 n PRO 101 Ca 0.14 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.17 2bl5 n PRO 101 Cb 0.44 -1.13 -0.03 0.00 -0.04 0.00 0.00 33.50 32.74 2bl5 n PRO 101 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bl5 s ALA 102 N -2.00 3.15 -1.71 0.55 0.00 -1.26 -4.84 121.76 115.65 2bl5 s ALA 102 Ca 0.05 0.97 0.02 0.00 0.00 0.00 0.00 51.96 53.01 2bl5 s ALA 102 Cb 0.03 -3.95 0.08 0.00 0.00 0.00 0.00 23.12 19.28 2bl5 s ALA 102 CO 0.04 -2.18 0.95 0.00 0.00 0.00 0.00 175.76 174.58 2bl5 n ALA 103 N 9.54 2.53 -2.68 0.00 0.00 -1.26 -4.78 120.51 123.86 2bl5 n ALA 103 Ca 0.24 -0.18 -0.37 0.00 0.00 0.00 0.00 53.44 53.13 2bl5 n ALA 103 Cb 0.43 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.82 2bl5 n ALA 103 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2bl5 s GLU 104 N -1.70 3.72 0.00 0.00 2.56 -1.26 -4.95 118.70 117.07 2bl5 s GLU 104 Ca 0.06 0.15 0.00 0.00 0.00 0.00 0.00 54.97 55.19 2bl5 s GLU 104 Cb 0.04 -3.22 0.00 0.00 2.00 0.00 0.00 34.13 32.95 2bl5 s GLU 104 CO 0.04 0.71 0.47 0.41 -0.56 0.00 0.00 175.26 176.33 2bl5 n GLY 105 N 1.95 0.65 2.99 -1.50 0.00 -1.26 -4.95 105.19 103.08 2bl5 n GLY 105 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 2bl5 n GLY 105 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bl5 s GLU 106 N 0.00 1.98 0.00 1.61 2.02 -1.26 -4.73 118.70 118.32 2bl5 s GLU 106 Ca 0.00 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.10 2bl5 s GLU 106 Cb 0.00 -2.47 0.00 0.00 0.10 0.00 0.00 34.13 31.76 2bl5 s GLU 106 CO 0.00 -0.46 0.00 -3.47 0.02 0.00 0.00 175.26 171.35 2bl5 n ASP 107 N 4.67 0.00 0.13 -0.19 2.03 -1.26 -4.63 116.55 117.30 2bl5 n ASP 107 Ca -0.14 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.22 2bl5 n ASP 107 Cb 0.46 0.00 0.52 0.00 -0.72 0.00 0.00 41.12 41.38 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 0.23 -0.31 1.67 0.87 -1.96 -0.48 113.55 113.57 2bl5 h SER 108 Ca 0.00 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.58 2bl5 h SER 108 Cb 0.00 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 2bl5 h SER 108 CO 0.00 0.19 0.21 -0.07 -0.53 0.00 0.00 176.83 176.64 2bl5 h LEU 109 N 0.27 0.25 0.00 2.23 3.38 -1.85 0.26 115.31 119.85 2bl5 h LEU 109 Ca 0.07 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2bl5 h LEU 109 Cb 0.02 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2bl5 h LEU 109 CO -0.01 0.17 -0.54 0.50 0.09 0.00 0.00 178.44 178.65 2bl5 h LYS 110 N 0.29 0.00 0.08 1.13 3.64 -1.53 -3.33 116.57 116.85 2bl5 h LYS 110 Ca 0.13 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2bl5 h LYS 110 Cb 0.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2bl5 h LYS 110 CO -0.03 0.57 -0.04 0.87 -2.27 0.00 0.00 179.45 178.55 2bl5 h LYS 111 N -1.00 -0.10 0.01 1.90 1.79 -1.14 -3.24 116.57 114.79 2bl5 h LYS 111 Ca -0.12 0.01 -0.25 0.00 -2.18 0.00 0.00 60.65 58.11 2bl5 h LYS 111 Cb 0.79 0.02 0.01 0.00 -1.58 0.00 0.00 32.23 31.48 2bl5 h LYS 111 CO -0.07 0.44 -1.02 0.52 -1.08 0.00 0.00 179.45 178.24 2bl5 h MET 112 N -0.89 0.56 -0.20 3.15 2.86 -0.72 -0.33 114.93 119.37 2bl5 h MET 112 Ca -0.01 -0.62 -0.13 0.00 -2.06 0.00 0.00 59.70 56.88 2bl5 h MET 112 Cb 0.59 0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.42 2bl5 h MET 112 CO 0.02 1.23 -0.43 -0.22 1.06 0.00 0.00 176.91 178.57 2bl5 h LYS 113 N 0.31 0.48 0.00 1.72 1.63 -1.57 -0.81 116.57 118.34 2bl5 h LYS 113 Ca -0.11 -0.25 0.00 0.00 -0.85 0.00 0.00 60.65 59.44 2bl5 h LYS 113 Cb 1.67 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.30 2bl5 h LYS 113 CO 0.19 0.83 -0.30 -0.11 -3.45 0.00 0.00 179.45 176.60 2bl5 n LEU 114 N -4.01 1.02 -0.05 5.20 7.94 -1.21 -4.35 117.00 121.54 2bl5 n LEU 114 Ca -0.02 0.45 -0.22 0.00 -1.11 0.00 0.00 56.01 55.12 2bl5 n LEU 114 Cb 0.52 -0.71 -0.13 0.00 0.53 0.00 0.00 43.42 43.64 2bl5 n LEU 114 CO 0.45 -0.48 -0.88 0.80 -1.11 0.00 0.00 177.39 176.17 2bl5 n MET 115 N -3.59 0.69 0.07 1.96 1.56 -0.27 -3.93 117.12 113.61 2bl5 n MET 115 Ca -0.04 0.31 0.09 0.00 -0.27 0.00 0.00 57.70 57.79 2bl5 n MET 115 Cb 0.16 -1.67 0.39 0.00 2.15 0.00 0.00 33.22 34.24 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 -3.70 0.10 0.28 2.12 -0.58 -0.37 -1.49 120.64 116.99 2bl5 n GLU 116 Ca -0.36 0.37 0.16 0.00 -0.42 0.00 0.00 57.16 56.91 2bl5 n GLU 116 Cb 0.95 -1.70 0.85 0.00 -0.57 0.00 0.00 31.44 30.97 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 0.05 -4.62 7.12 -1.26 -3.46 115.31 113.14 2bl5 h LEU 117 Ca 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.99 2bl5 h LEU 117 Cb 0.26 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.38 2bl5 h LEU 117 CO 0.00 0.06 -0.02 0.00 -0.13 0.00 0.00 178.44 178.35 2bl5 n ALA 118 N -2.22 -0.02 0.00 1.25 0.00 -0.56 -4.93 120.51 114.05 2bl5 n ALA 118 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2bl5 n ALA 118 Cb 0.20 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.19 2bl5 n ALA 118 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2bl5 n ILE 119 N -2.80 0.00 -2.49 0.00 -5.35 -1.26 -4.59 119.36 102.86 2bl5 n ILE 119 Ca -0.01 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.13 2bl5 n ILE 119 Cb 0.12 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 37.99 2bl5 n ILE 119 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2bl5 s LEU 120 N 0.00 3.82 0.00 7.28 2.01 -1.26 -5.01 118.68 125.52 2bl5 s LEU 120 Ca 0.00 1.95 -0.13 0.00 0.01 0.00 0.00 54.13 55.97 2bl5 s LEU 120 Cb 0.00 -4.56 0.05 0.00 0.01 0.00 0.00 46.19 41.68 2bl5 s LEU 120 CO 0.00 -0.85 0.62 -0.46 1.01 0.00 0.00 176.35 176.68 2bl5 n ASN 121 N -1.04 -1.21 -0.21 2.29 0.23 -1.26 -5.04 115.26 109.02 2bl5 n ASN 121 Ca 0.10 -1.70 0.12 0.00 -0.53 0.00 0.00 54.58 52.57 2bl5 n ASN 121 Cb 0.52 1.99 0.25 0.00 -2.08 0.00 0.00 39.78 40.46 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 -0.44 -0.69 0.15 4.83 0.00 -1.26 -3.85 105.19 103.93 2bl5 n GLY 122 Ca -0.03 -0.45 -0.24 0.00 0.00 0.00 0.00 46.02 45.30 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 1.01 1.19 -3.35 2.61 2.02 -1.99 -3.40 112.91 111.00 2bl5 h THR 123 Ca 0.00 -2.65 -0.66 0.00 0.77 0.00 0.00 66.41 63.87 2bl5 h THR 123 Cb 0.54 2.98 -0.39 0.00 -1.74 0.00 0.00 68.15 69.54 2bl5 h THR 123 CO 0.00 0.82 -0.49 -0.31 0.37 0.00 0.00 175.52 175.91 2bl5 s TYR 124 N -2.59 3.40 -0.77 3.16 2.02 -1.25 -4.82 117.35 116.49 2bl5 s TYR 124 Ca -0.11 -3.08 0.25 0.00 -0.37 0.00 0.00 57.07 53.76 2bl5 s TYR 124 Cb 0.04 -2.94 0.47 0.00 -0.40 0.00 0.00 41.96 39.13 2bl5 s TYR 124 CO 0.92 -0.72 1.40 0.54 -1.57 0.00 0.00 175.55 176.13 2bl5 n ARG 125 N 2.86 0.19 0.09 -0.62 1.74 -1.26 -4.06 116.66 115.59 2bl5 n ARG 125 Ca 0.11 0.06 -0.03 0.00 -0.77 0.00 0.00 57.85 57.21 2bl5 n ARG 125 Cb 0.35 -1.62 -0.02 0.00 -1.02 0.00 0.00 32.46 30.15 2bl5 n ARG 125 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2bl5 h ASP 126 N 0.00 -0.19 -0.96 0.55 5.19 -1.92 -3.20 116.42 115.89 2bl5 h ASP 126 Ca 0.00 0.01 -0.49 0.00 -0.62 0.00 0.00 57.03 55.92 2bl5 h ASP 126 Cb 0.66 0.05 -0.08 0.00 0.18 0.00 0.00 39.33 40.14 2bl5 h ASP 126 CO 0.00 -0.13 1.25 0.00 -3.12 0.00 0.00 179.24 177.24 2bl5 s ALA 127 N -3.48 2.35 0.00 3.45 0.00 -1.26 -0.51 121.76 122.32 2bl5 s ALA 127 Ca -0.03 -2.02 0.00 0.00 0.00 0.00 0.00 51.96 49.91 2bl5 s ALA 127 Cb 0.00 -4.54 0.00 0.00 0.00 0.00 0.00 23.12 18.58 2bl5 s ALA 127 CO 0.10 -4.05 0.00 -1.71 0.00 0.00 0.00 175.76 170.10 2bl5 n ASN 128 N 10.70 0.00 -0.12 0.00 5.15 -1.25 -4.79 115.26 124.94 2bl5 n ASN 128 Ca 0.36 0.00 -0.18 0.00 -0.60 0.00 0.00 54.58 54.16 2bl5 n ASN 128 Cb 0.49 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.63 2bl5 n ASN 128 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2bl5 n LEU 129 N 0.00 2.85 -3.67 1.20 0.00 -1.02 -4.63 117.00 111.72 2bl5 n LEU 129 Ca 0.00 -0.08 -0.41 0.00 0.00 0.00 0.00 56.01 55.52 2bl5 n LEU 129 Cb 0.00 -0.85 -0.00 0.00 0.00 0.00 0.00 43.42 42.56 2bl5 n LEU 129 CO 0.00 0.87 2.39 0.29 0.00 0.00 0.00 177.39 180.95 2bl5 n LYS 130 N -3.33 3.71 -3.41 1.96 5.02 0.34 -4.81 118.16 117.63 2bl5 n LYS 130 Ca -0.45 -3.16 -0.08 0.00 -2.02 0.00 0.00 58.31 52.61 2bl5 n LYS 130 Cb 0.95 -2.91 -0.08 0.00 -0.02 0.00 0.00 35.03 32.98 2bl5 n LYS 130 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2bl5 s SER 131 N 1.37 -0.06 0.07 4.39 0.01 -1.26 -4.55 113.70 113.67 2bl5 s SER 131 Ca 0.48 0.50 0.27 0.00 1.31 0.00 0.00 55.95 58.51 2bl5 s SER 131 Cb 0.14 1.29 0.90 0.00 0.21 0.00 0.00 66.02 68.56 2bl5 s SER 131 CO -0.05 -0.28 1.73 -0.81 0.41 0.00 0.00 173.24 174.25 2bl5 n PRO 132 N 5.38 0.11 -3.53 12.44 -0.04 -1.26 -4.36 135.00 143.74 2bl5 n PRO 132 Ca -0.05 0.07 -0.27 0.00 -0.04 0.00 0.00 63.50 63.21 2bl5 n PRO 132 Cb 0.50 -1.61 -0.09 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.62 3.69 -3.97 0.55 0.00 -1.26 -4.98 120.51 112.92 2bl5 n ALA 133 Ca 0.06 -4.50 -0.31 0.00 0.00 0.00 0.00 53.44 48.69 2bl5 n ALA 133 Cb 0.38 -0.92 -0.15 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.97 4.42 0.00 0.00 1.43 -1.26 -5.20 118.68 116.09 2bl5 s LEU 134 Ca 0.35 -2.42 0.00 0.00 -1.03 0.00 0.00 54.13 51.03 2bl5 s LEU 134 Cb 0.10 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.74 2bl5 s LEU 134 CO -0.07 -0.33 0.00 1.57 0.23 0.00 0.00 176.35 177.75