#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sb3 s LYS 2 N 0.00 3.56 0.06 2.12 1.02 -1.26 0.18 119.74 125.42 1sb3 s LYS 2 Ca 0.00 0.00 0.01 0.00 0.02 0.00 0.00 55.97 56.00 1sb3 s LYS 2 Cb 0.00 -3.19 -0.03 0.00 -0.52 0.00 0.00 37.83 34.09 1sb3 s LYS 2 CO 0.00 0.75 -0.05 -0.80 -0.92 0.00 0.00 175.35 174.33 1sb3 s ASN 3 N -1.09 0.72 0.23 2.83 0.01 -0.49 -4.86 114.94 112.29 1sb3 s ASN 3 Ca 0.18 -0.85 -0.30 0.00 -0.71 0.00 0.00 52.86 51.18 1sb3 s ASN 3 Cb -0.13 0.12 -0.10 0.00 0.41 0.00 0.00 41.25 41.55 1sb3 s ASN 3 CO 0.07 -0.45 1.45 -0.63 -1.51 0.00 0.00 177.10 176.03 1sb3 s ILE 4 N -3.03 2.71 -0.13 0.60 1.01 -1.26 -1.13 121.20 119.97 1sb3 s ILE 4 Ca 0.02 0.58 0.01 0.00 0.00 0.00 0.00 60.65 61.27 1sb3 s ILE 4 Cb 0.01 -3.37 0.02 0.00 0.01 0.00 0.00 42.46 39.13 1sb3 s ILE 4 CO -0.05 0.08 -0.15 -0.22 0.00 0.00 0.00 174.94 174.60 1sb3 s LEU 5 N -0.09 1.74 -0.09 2.97 2.96 0.19 -4.91 118.68 121.44 1sb3 s LEU 5 Ca 0.61 -0.46 0.04 0.00 -0.22 0.00 0.00 54.13 54.10 1sb3 s LEU 5 Cb -0.42 -1.15 -0.00 0.00 0.50 0.00 0.00 46.19 45.12 1sb3 s LEU 5 CO 0.41 -0.01 -0.24 -0.13 -1.32 0.00 0.00 176.35 175.06 1sb3 s ARG 6 N 1.17 2.92 0.27 1.98 0.52 -1.26 -1.23 118.95 123.33 1sb3 s ARG 6 Ca -0.02 -0.87 -0.20 0.00 -0.52 0.00 0.00 55.73 54.12 1sb3 s ARG 6 Cb -0.14 -2.24 0.06 0.00 0.52 0.00 0.00 34.95 33.14 1sb3 s ARG 6 CO -0.05 0.20 0.88 -0.48 0.02 0.00 0.00 175.30 175.87 1sb3 s LEU 7 N 0.28 -0.07 -0.18 2.53 0.05 -0.98 0.15 118.68 120.46 1sb3 s LEU 7 Ca -0.17 -0.80 -0.02 0.00 0.05 0.00 0.00 54.13 53.19 1sb3 s LEU 7 Cb -0.17 2.50 -0.00 0.00 -2.05 0.00 0.00 46.19 46.47 1sb3 s LEU 7 CO 0.08 -1.31 -0.10 -0.89 -0.55 0.00 0.00 176.35 173.58 1sb3 s THR 8 N -2.70 2.98 -0.14 5.48 2.01 -0.76 -0.62 115.64 121.89 1sb3 s THR 8 Ca 0.16 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.53 1sb3 s THR 8 Cb -0.04 -2.31 0.02 0.00 0.01 0.00 0.00 72.50 70.18 1sb3 s THR 8 CO 0.07 0.48 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.09 1sb3 s LEU 9 N 1.08 1.88 -1.63 4.42 2.96 0.42 0.11 118.68 127.92 1sb3 s LEU 9 Ca 0.00 -0.52 -0.15 0.00 -0.22 0.00 0.00 54.13 53.24 1sb3 s LEU 9 Cb -0.15 -1.27 0.12 0.00 0.50 0.00 0.00 46.19 45.40 1sb3 s LEU 9 CO -0.02 0.02 0.74 0.59 -1.32 0.00 0.00 176.35 176.35 1sb3 n ASN 10 N 4.34 -2.92 0.00 3.68 3.02 0.37 -0.74 115.26 123.01 1sb3 n ASN 10 Ca -0.19 -0.99 0.00 0.00 -0.03 0.00 0.00 54.58 53.37 1sb3 n ASN 10 Cb 0.51 -2.93 0.00 0.00 -0.61 0.00 0.00 39.78 36.75 1sb3 n ASN 10 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1sb3 n GLY 11 N -1.55 1.24 3.37 7.41 0.00 -1.26 -4.97 105.19 109.43 1sb3 n GLY 11 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1sb3 n GLY 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sb3 s ARG 12 N -0.20 2.05 0.19 1.61 0.52 0.08 -5.10 118.95 118.09 1sb3 s ARG 12 Ca 0.00 -0.97 -0.30 0.00 -0.52 0.00 0.00 55.73 53.94 1sb3 s ARG 12 Cb 0.00 -2.09 -0.08 0.00 0.52 0.00 0.00 34.95 33.30 1sb3 s ARG 12 CO 0.00 0.55 1.23 0.00 0.02 0.00 0.00 175.30 177.10 1sb3 s ALA 13 N -0.74 3.46 0.03 2.13 0.00 -1.26 -0.44 121.76 124.94 1sb3 s ALA 13 Ca 0.12 1.00 0.08 0.00 0.00 0.00 0.00 51.96 53.15 1sb3 s ALA 13 Cb -0.10 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.56 1sb3 s ALA 13 CO 0.01 -0.42 -0.23 1.03 0.00 0.00 0.00 175.76 176.15 1sb3 s ARG 14 N -0.19 1.62 -0.32 0.00 1.81 0.21 -4.91 118.95 117.17 1sb3 s ARG 14 Ca 0.54 -0.98 0.01 0.00 -1.72 0.00 0.00 55.73 53.58 1sb3 s ARG 14 Cb -0.34 -1.73 0.14 0.00 -0.45 0.00 0.00 34.95 32.58 1sb3 s ARG 14 CO 0.37 0.45 0.31 -2.00 -0.68 0.00 0.00 175.30 173.75 1sb3 s GLU 15 N -1.08 0.45 0.15 3.54 2.12 -1.25 -2.31 118.70 120.32 1sb3 s GLU 15 Ca 0.09 -0.51 0.07 0.00 0.36 0.00 0.00 54.97 54.98 1sb3 s GLU 15 Cb -0.09 -0.75 -0.04 0.00 0.26 0.00 0.00 34.13 33.50 1sb3 s GLU 15 CO 0.01 -1.10 -0.15 -0.51 -0.54 0.00 0.00 175.26 172.97 1sb3 s ASP 16 N 1.92 2.29 -0.42 -1.70 -0.00 -0.36 -4.94 116.67 113.46 1sb3 s ASP 16 Ca 0.13 -0.86 -0.20 0.00 -0.00 0.00 0.00 52.55 51.61 1sb3 s ASP 16 Cb -0.15 -0.10 0.02 0.00 -0.00 0.00 0.00 42.92 42.68 1sb3 s ASP 16 CO -0.20 -0.12 0.63 -0.76 -0.00 0.00 0.00 175.17 174.73 1sb3 s LEU 17 N -2.66 4.44 -0.04 1.23 1.43 -1.26 0.54 118.68 122.36 1sb3 s LEU 17 Ca 0.13 -0.22 0.06 0.00 -1.03 0.00 0.00 54.13 53.07 1sb3 s LEU 17 Cb -0.04 -2.73 -0.01 0.00 0.03 0.00 0.00 46.19 43.43 1sb3 s LEU 17 CO 0.05 -0.72 -0.22 -0.69 0.23 0.00 0.00 176.35 174.99 1sb3 s VAL 18 N 2.77 1.79 0.28 -1.59 1.01 -0.28 -4.84 120.40 119.53 1sb3 s VAL 18 Ca 0.23 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 60.97 1sb3 s VAL 18 Cb -0.14 -1.50 -0.12 0.00 0.00 0.00 0.00 36.38 34.61 1sb3 s VAL 18 CO 0.18 0.50 1.46 -2.65 0.00 0.00 0.00 175.10 174.59 1sb3 n PRO 19 N 2.80 2.31 -0.01 2.72 -0.02 -1.26 -1.39 135.00 140.15 1sb3 n PRO 19 Ca -0.17 0.82 0.16 0.00 -2.02 0.00 0.00 63.50 62.29 1sb3 n PRO 19 Cb 0.52 -2.51 0.61 0.00 -0.02 0.00 0.00 33.50 32.10 1sb3 n PRO 19 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1sb3 h ASP 20 N 4.07 0.15 -0.50 2.55 3.45 -0.62 -1.36 116.42 124.16 1sb3 h ASP 20 Ca -0.46 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 56.94 1sb3 h ASP 20 Cb 1.26 -0.03 -0.04 0.00 -0.56 0.00 0.00 39.33 39.96 1sb3 h ASP 20 CO 0.74 0.09 0.08 -0.46 -1.57 0.00 0.00 179.24 178.12 1sb3 n ASN 21 N -4.43 4.55 -4.72 6.45 2.04 -1.26 -4.79 115.26 113.09 1sb3 n ASN 21 Ca 0.09 -2.81 -0.39 0.00 -0.44 0.00 0.00 54.58 51.03 1sb3 n ASN 21 Cb 0.47 -0.67 -0.05 0.00 -2.53 0.00 0.00 39.78 37.00 1sb3 n ASN 21 CO 0.00 0.00 0.00 -0.32 -0.44 0.00 0.00 177.26 176.50 1sb3 s MET 22 N -2.41 4.38 0.47 -3.83 1.75 -0.51 -5.00 119.30 114.15 1sb3 s MET 22 Ca 0.43 0.65 -0.22 0.00 -1.25 0.00 0.00 55.69 55.30 1sb3 s MET 22 Cb 0.33 -3.44 -0.08 0.00 2.84 0.00 0.00 34.83 34.48 1sb3 s MET 22 CO 0.12 0.11 1.11 -0.51 -0.65 0.00 0.00 175.02 175.19 1sb3 s LEU 23 N 0.72 3.94 0.38 4.11 1.43 -1.26 -0.11 118.68 127.89 1sb3 s LEU 23 Ca 0.31 2.14 0.05 0.00 -1.03 0.00 0.00 54.13 55.61 1sb3 s LEU 23 Cb -0.16 -4.38 0.77 0.00 0.03 0.00 0.00 46.19 42.44 1sb3 s LEU 23 CO 0.14 -0.87 2.03 0.25 0.23 0.00 0.00 176.35 178.12 1sb3 h LEU 24 N 1.83 0.59 -0.19 1.79 5.85 -0.64 -1.35 115.31 123.19 1sb3 h LEU 24 Ca -0.49 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.22 1sb3 h LEU 24 Cb 1.24 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 1sb3 h LEU 24 CO 0.60 0.42 0.11 0.25 -0.34 0.00 0.00 178.44 179.47 1sb3 h LEU 25 N 0.69 0.17 -0.61 2.25 5.85 -1.45 -1.09 115.31 121.13 1sb3 h LEU 25 Ca 0.21 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.79 1sb3 h LEU 25 Cb -0.02 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1sb3 h LEU 25 CO -0.05 0.13 -0.42 0.44 -0.34 0.00 0.00 178.44 178.20 1sb3 h ASP 26 N 0.22 0.67 -0.41 1.25 3.32 -1.70 -0.93 116.42 118.84 1sb3 h ASP 26 Ca 0.07 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.83 1sb3 h ASP 26 Cb -0.00 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1sb3 h ASP 26 CO -0.04 1.00 0.26 0.22 -1.72 0.00 0.00 179.24 178.96 1sb3 h TYR 27 N 0.51 0.49 0.01 4.55 3.20 -1.06 0.25 116.97 124.92 1sb3 h TYR 27 Ca 0.04 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 1sb3 h TYR 27 Cb 0.94 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.05 1sb3 h TYR 27 CO 0.04 0.30 -0.00 -0.07 -1.64 0.00 0.00 178.16 176.78 1sb3 h LEU 28 N 0.53 -0.01 -0.17 2.82 3.38 -1.02 -0.84 115.31 119.99 1sb3 h LEU 28 Ca 0.16 -0.30 -0.22 0.00 0.09 0.00 0.00 57.88 57.61 1sb3 h LEU 28 Cb -0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.73 1sb3 h LEU 28 CO -0.05 0.29 -0.80 0.03 0.09 0.00 0.00 178.44 178.00 1sb3 h ARG 29 N -0.31 0.75 0.00 1.13 3.08 -1.10 0.17 114.38 118.09 1sb3 h ARG 29 Ca -0.00 -0.63 -0.33 0.00 0.07 0.00 0.00 59.98 59.09 1sb3 h ARG 29 Cb 0.31 0.14 -0.06 0.00 0.08 0.00 0.00 29.97 30.43 1sb3 h ARG 29 CO 0.00 1.23 -2.27 0.39 -1.07 0.00 0.00 179.97 178.26 1sb3 n GLU 30 N -3.92 0.78 -0.03 0.04 1.02 0.86 -3.08 120.64 116.31 1sb3 n GLU 30 Ca -0.07 0.08 -0.19 0.00 -0.02 0.00 0.00 57.16 56.95 1sb3 n GLU 30 Cb 0.76 -1.46 -0.13 0.00 -0.02 0.00 0.00 31.44 30.59 1sb3 n GLU 30 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1sb3 h THR 31 N 0.00 1.37 0.00 2.62 2.02 -1.14 -3.37 112.91 114.41 1sb3 h THR 31 Ca -0.50 -2.37 -0.04 0.00 0.77 0.00 0.00 66.41 64.27 1sb3 h THR 31 Cb 1.91 2.95 -0.01 0.00 -1.74 0.00 0.00 68.15 71.26 1sb3 h THR 31 CO -0.04 0.60 -1.13 0.52 0.37 0.00 0.00 175.52 175.84 1sb3 n VAL 32 N -4.30 0.75 -1.42 3.16 0.31 -0.47 -4.98 118.33 111.38 1sb3 n VAL 32 Ca -0.19 -0.58 0.00 0.00 -0.01 0.00 0.00 64.34 63.56 1sb3 n VAL 32 Cb 0.70 -0.43 0.00 0.00 -0.91 0.00 0.00 33.84 33.20 1sb3 n VAL 32 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1sb3 n GLY 33 N 1.24 0.38 3.39 2.92 0.00 -0.60 -5.00 105.19 107.51 1sb3 n GLY 33 Ca -0.03 -1.00 -0.45 0.00 0.00 0.00 0.00 46.02 44.54 1sb3 n GLY 33 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sb3 s LEU 34 N 0.00 5.49 0.00 0.99 1.43 0.49 -4.90 118.68 122.18 1sb3 s LEU 34 Ca 0.00 -1.77 0.31 0.00 -1.03 0.00 0.00 54.13 51.64 1sb3 s LEU 34 Cb 0.00 -2.32 1.68 0.00 0.03 0.00 0.00 46.19 45.59 1sb3 s LEU 34 CO 0.00 -1.03 2.10 0.35 0.23 0.00 0.00 176.35 178.00 1sb3 n THR 35 N 5.28 0.00 -0.32 5.49 -2.24 -1.26 -3.80 114.28 117.43 1sb3 n THR 35 Ca 0.03 -0.06 -0.04 0.00 -2.27 0.00 0.00 64.05 61.71 1sb3 n THR 35 Cb 0.45 -0.26 0.08 0.00 -2.10 0.00 0.00 70.33 68.51 1sb3 n THR 35 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1sb3 h GLY 36 N 4.97 1.28 -5.07 3.38 0.00 -1.96 -3.39 103.07 102.27 1sb3 h GLY 36 Ca 0.00 -0.56 -0.55 0.00 0.00 0.00 0.00 47.33 46.22 1sb3 h GLY 36 CO 0.00 0.54 0.94 -1.59 0.00 0.00 0.00 176.54 176.42 1sb3 s THR 37 N -5.91 3.84 0.37 4.70 2.01 -1.26 -4.70 115.64 114.69 1sb3 s THR 37 Ca -0.13 1.10 0.07 0.00 0.31 0.00 0.00 61.69 63.05 1sb3 s THR 37 Cb 0.16 -3.71 -0.02 0.00 0.01 0.00 0.00 72.50 68.94 1sb3 s THR 37 CO 0.82 -0.06 0.37 -0.54 -0.69 0.00 0.00 174.62 174.51 1sb3 s LYS 38 N 3.26 2.73 -0.26 4.92 -0.14 -1.15 -4.91 119.74 124.19 1sb3 s LYS 38 Ca 0.64 -1.32 0.00 0.00 -1.36 0.00 0.00 55.97 53.93 1sb3 s LYS 38 Cb -0.29 -2.52 0.04 0.00 -1.68 0.00 0.00 37.83 33.38 1sb3 s LYS 38 CO 0.24 -0.03 -0.08 -1.14 -0.76 0.00 0.00 175.35 173.58 1sb3 s GLN 39 N -4.09 2.58 0.00 1.68 0.74 -1.26 -2.51 119.66 116.80 1sb3 s GLN 39 Ca 0.45 -1.14 0.09 0.00 0.05 0.00 0.00 55.36 54.82 1sb3 s GLN 39 Cb -0.06 -2.95 0.01 0.00 1.10 0.00 0.00 33.01 31.11 1sb3 s GLN 39 CO 0.28 -0.48 0.64 0.41 -0.55 0.00 0.00 175.29 175.60 1sb3 n GLY 40 N 4.58 -0.22 2.78 2.59 0.00 -1.26 -5.05 105.19 108.61 1sb3 n GLY 40 Ca -0.16 -0.27 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 1sb3 n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 n ASP 42 N -1.61 2.11 0.00 0.00 8.00 -1.26 -4.90 116.55 118.89 1sb3 n ASP 42 Ca -0.02 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.61 1sb3 n ASP 42 Cb 0.47 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1sb3 n ASP 42 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sb3 n GLY 43 N 1.19 0.78 2.59 0.44 0.00 -1.26 -5.03 105.19 103.89 1sb3 n GLY 43 Ca 0.16 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1sb3 n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sb3 n GLY 44 N 0.00 0.39 0.01 -0.02 0.00 -1.26 -4.92 105.19 99.39 1sb3 n GLY 44 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1sb3 n GLY 44 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sb3 n GLU 45 N -1.66 0.38 0.00 1.61 1.02 -1.26 -4.75 120.64 115.98 1sb3 n GLU 45 Ca 0.00 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1sb3 n GLU 45 Cb 0.14 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 1sb3 n GLU 45 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sb3 n GLY 47 N 1.62 0.58 0.29 0.00 0.00 -1.19 -1.24 105.19 105.24 1sb3 n GLY 47 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 1sb3 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 h ALA 48 N 0.00 1.11 -0.54 4.61 0.00 -1.89 -1.94 119.26 120.61 1sb3 h ALA 48 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1sb3 h ALA 48 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1sb3 h ALA 48 CO 0.00 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1sb3 s THR 50 N -2.07 2.77 0.36 0.00 2.01 -0.73 -1.64 115.64 116.34 1sb3 s THR 50 Ca 0.45 0.52 0.04 0.00 0.31 0.00 0.00 61.69 63.01 1sb3 s THR 50 Cb 0.31 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 1sb3 s THR 50 CO 0.18 0.04 0.13 0.68 -0.69 0.00 0.00 174.62 174.96 1sb3 s VAL 51 N 1.32 0.60 -0.11 3.82 -7.23 -0.21 -4.49 120.40 114.10 1sb3 s VAL 51 Ca 0.70 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.84 1sb3 s VAL 51 Cb -0.42 -2.48 -0.03 0.00 0.56 0.00 0.00 36.38 34.01 1sb3 s VAL 51 CO 0.31 0.00 0.01 -0.76 -0.31 0.00 0.00 175.10 174.36 1sb3 s LEU 52 N -3.51 3.63 -0.20 1.32 1.43 -0.37 -0.99 118.68 119.99 1sb3 s LEU 52 Ca 0.30 0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 53.52 1sb3 s LEU 52 Cb 0.04 -1.85 0.05 0.00 0.03 0.00 0.00 46.19 44.47 1sb3 s LEU 52 CO 0.16 0.33 -0.03 -0.69 0.23 0.00 0.00 176.35 176.34 1sb3 s VAL 53 N -0.59 1.17 -1.32 -1.59 1.01 0.13 -1.03 120.40 118.17 1sb3 s VAL 53 Ca 0.10 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1sb3 s VAL 53 Cb -0.12 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.81 1sb3 s VAL 53 CO 0.02 -0.04 0.63 0.47 0.00 0.00 0.00 175.10 176.18 1sb3 n ASP 54 N 4.83 -1.08 0.00 3.32 8.00 0.50 -1.95 116.55 130.17 1sb3 n ASP 54 Ca -0.11 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.51 1sb3 n ASP 54 Cb 0.46 -3.79 0.00 0.00 -0.02 0.00 0.00 41.12 37.77 1sb3 n ASP 54 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1sb3 n ASP 55 N -3.03 0.00 -4.69 -2.24 10.43 -1.26 -4.99 116.55 110.77 1sb3 n ASP 55 Ca -0.30 0.00 -0.31 0.00 2.57 0.00 0.00 54.79 56.75 1sb3 n ASP 55 Cb 0.68 -0.71 -0.08 0.00 1.84 0.00 0.00 41.12 42.85 1sb3 n ASP 55 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 1sb3 s ARG 56 N -0.14 2.63 0.42 -1.24 1.81 -0.82 -4.58 118.95 117.03 1sb3 s ARG 56 Ca 0.00 -0.76 -0.25 0.00 -1.72 0.00 0.00 55.73 52.99 1sb3 s ARG 56 Cb 0.00 -2.58 -0.08 0.00 -0.45 0.00 0.00 34.95 31.83 1sb3 s ARG 56 CO 0.00 0.57 1.26 -1.25 -0.68 0.00 0.00 175.30 175.19 1sb3 s PRO 57 N -2.08 3.91 -0.11 3.54 0.04 -1.26 -0.69 135.00 138.35 1sb3 s PRO 57 Ca 0.24 2.04 -0.09 0.00 0.04 0.00 0.00 61.00 63.22 1sb3 s PRO 57 Cb -0.12 -2.66 0.03 0.00 0.04 0.00 0.00 34.50 31.79 1sb3 s PRO 57 CO 0.16 -0.50 0.29 0.50 0.04 0.00 0.00 177.00 177.49 1sb3 s ARG 58 N -2.35 0.32 -0.45 4.56 6.06 -0.17 -4.84 118.95 122.09 1sb3 s ARG 58 Ca 0.59 0.45 -0.28 0.00 -2.50 0.00 0.00 55.73 53.99 1sb3 s ARG 58 Cb -0.35 0.10 0.03 0.00 0.06 0.00 0.00 34.95 34.79 1sb3 s ARG 58 CO 0.44 -0.07 1.06 -0.51 -2.50 0.00 0.00 175.30 173.73 1sb3 s LEU 59 N 0.43 3.78 0.49 -0.88 1.43 -1.26 -1.04 118.68 121.62 1sb3 s LEU 59 Ca -0.02 0.45 0.18 0.00 -1.03 0.00 0.00 54.13 53.70 1sb3 s LEU 59 Cb -0.04 -3.44 1.21 0.00 0.03 0.00 0.00 46.19 43.95 1sb3 s LEU 59 CO -0.02 -1.14 2.07 0.00 0.23 0.00 0.00 176.35 177.49 1sb3 h ALA 60 N 9.03 1.69 0.00 4.21 0.00 -1.67 -1.32 119.26 131.21 1sb3 h ALA 60 Ca -0.23 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1sb3 h ALA 60 Cb 1.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1sb3 h ALA 60 CO 1.08 0.14 0.00 0.00 0.00 0.00 0.00 179.25 180.48 1sb3 n SER 62 N -2.74 4.45 -3.76 0.00 7.64 -0.51 -4.89 113.62 113.81 1sb3 n SER 62 Ca 0.03 -3.78 -0.14 0.00 1.01 0.00 0.00 58.87 55.98 1sb3 n SER 62 Cb 0.38 -0.41 -0.15 0.00 -1.01 0.00 0.00 64.21 63.01 1sb3 n SER 62 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1sb3 s THR 63 N -4.35 -0.06 0.19 0.44 2.01 -1.13 -4.89 115.64 107.85 1sb3 s THR 63 Ca 0.49 0.21 -0.30 0.00 0.31 0.00 0.00 61.69 62.40 1sb3 s THR 63 Cb 0.41 -0.14 -0.08 0.00 0.01 0.00 0.00 72.50 72.70 1sb3 s THR 63 CO 0.02 0.08 1.03 -0.76 -0.69 0.00 0.00 174.62 174.31 1sb3 s LEU 64 N 1.13 4.53 0.31 4.42 1.43 -1.26 -0.39 118.68 128.85 1sb3 s LEU 64 Ca -0.09 2.01 0.06 0.00 -1.03 0.00 0.00 54.13 55.09 1sb3 s LEU 64 Cb -0.12 -3.60 0.74 0.00 0.03 0.00 0.00 46.19 43.23 1sb3 s LEU 64 CO -0.04 -0.09 1.78 0.00 0.23 0.00 0.00 176.35 178.23 1sb3 h ALA 65 N 4.84 1.68 0.00 4.21 0.00 -0.72 0.85 119.26 130.13 1sb3 h ALA 65 Ca -0.44 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1sb3 h ALA 65 Cb 1.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1sb3 h ALA 65 CO 0.71 -0.05 0.00 0.72 0.00 0.00 0.00 179.25 180.62 1sb3 n HIS 66 N -4.76 0.68 0.80 0.00 -0.00 -1.26 -2.09 115.22 108.60 1sb3 n HIS 66 Ca 0.23 0.30 0.13 0.00 -0.00 0.00 0.00 57.72 58.38 1sb3 n HIS 66 Cb 0.57 -0.98 0.52 0.00 -0.00 0.00 0.00 29.99 30.10 1sb3 n HIS 66 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1sb3 n GLN 67 N -2.15 0.10 -0.83 -0.41 6.02 0.29 -3.16 117.38 117.25 1sb3 n GLN 67 Ca 0.01 0.11 0.07 0.00 -0.01 0.00 0.00 57.00 57.19 1sb3 n GLN 67 Cb 0.15 -1.62 0.39 0.00 1.02 0.00 0.00 30.24 30.17 1sb3 n GLN 67 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1sb3 n VAL 68 N -1.79 2.62 -1.67 5.09 0.24 -0.89 -4.99 118.33 116.94 1sb3 n VAL 68 Ca 0.06 -1.43 -0.46 0.00 -2.04 0.00 0.00 64.34 60.47 1sb3 n VAL 68 Cb 0.35 -0.23 -0.04 0.00 -1.47 0.00 0.00 33.84 32.46 1sb3 n VAL 68 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1sb3 n ALA 69 N 0.58 1.17 -1.04 2.33 0.00 -1.19 -1.66 120.51 120.70 1sb3 n ALA 69 Ca 0.27 0.44 -0.01 0.00 0.00 0.00 0.00 53.44 54.13 1sb3 n ALA 69 Cb 1.14 -2.31 -0.01 0.00 0.00 0.00 0.00 19.45 18.27 1sb3 n ALA 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sb3 n GLY 70 N 2.94 0.40 3.86 0.00 0.00 0.40 -4.97 105.19 107.83 1sb3 n GLY 70 Ca 0.15 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 1sb3 n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sb3 s LYS 71 N -1.20 2.50 -0.32 1.61 1.02 -0.66 -4.89 119.74 117.80 1sb3 s LYS 71 Ca 0.00 -1.58 -0.12 0.00 0.02 0.00 0.00 55.97 54.29 1sb3 s LYS 71 Cb 0.00 -2.34 -0.03 0.00 -0.52 0.00 0.00 37.83 34.94 1sb3 s LYS 71 CO 0.00 -0.20 0.22 0.21 -0.92 0.00 0.00 175.35 174.67 1sb3 s LYS 72 N -4.11 3.68 -0.09 1.68 2.20 -1.26 -1.83 119.74 120.02 1sb3 s LYS 72 Ca 0.47 -0.51 0.01 0.00 -0.36 0.00 0.00 55.97 55.58 1sb3 s LYS 72 Cb -0.02 -3.75 -0.03 0.00 -1.51 0.00 0.00 37.83 32.52 1sb3 s LYS 72 CO 0.27 -0.34 -0.09 0.08 -0.36 0.00 0.00 175.35 174.91 1sb3 s VAL 73 N 1.74 3.48 -0.02 4.02 1.01 0.12 -0.37 120.40 130.38 1sb3 s VAL 73 Ca 0.07 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1sb3 s VAL 73 Cb -0.17 -2.43 0.00 0.00 0.00 0.00 0.00 36.38 33.79 1sb3 s VAL 73 CO 0.11 0.57 -0.07 -1.61 0.00 0.00 0.00 175.10 174.10 1sb3 s GLU 74 N -0.43 0.76 0.46 2.72 2.02 -0.20 -0.48 118.70 123.55 1sb3 s GLU 74 Ca 0.06 -0.23 0.05 0.00 0.02 0.00 0.00 54.97 54.87 1sb3 s GLU 74 Cb -0.12 -0.73 -0.03 0.00 0.10 0.00 0.00 34.13 33.35 1sb3 s GLU 74 CO 0.02 0.08 0.15 0.95 0.02 0.00 0.00 175.26 176.48 1sb3 s THR 75 N 0.22 1.86 0.53 3.63 -4.23 -1.26 -1.23 115.64 115.16 1sb3 s THR 75 Ca -0.03 -1.78 0.24 0.00 -1.18 0.00 0.00 61.69 58.94 1sb3 s THR 75 Cb -0.08 -2.64 0.38 0.00 1.34 0.00 0.00 72.50 71.50 1sb3 s THR 75 CO 0.00 0.00 2.02 1.62 -0.54 0.00 0.00 174.62 177.72 1sb3 h VAL 76 N 1.34 0.75 0.00 2.29 3.04 -1.90 -1.41 116.25 120.36 1sb3 h VAL 76 Ca -0.42 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 1sb3 h VAL 76 Cb 1.27 0.77 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 1sb3 h VAL 76 CO 0.71 0.00 0.00 -0.33 -1.01 0.00 0.00 177.57 176.94 1sb3 h GLU 77 N 0.00 0.00 0.00 4.17 3.07 -1.96 -2.82 114.58 117.04 1sb3 h GLU 77 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1sb3 h GLU 77 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1sb3 h GLU 77 CO -0.00 0.00 -0.56 -1.13 -1.40 0.00 0.00 179.01 175.91 1sb3 n SER 78 N -2.72 0.58 -0.04 1.42 3.41 -0.53 -4.47 113.62 111.27 1sb3 n SER 78 Ca -0.01 -0.03 -0.08 0.00 -0.26 0.00 0.00 58.87 58.49 1sb3 n SER 78 Cb 0.16 0.20 0.08 0.00 -0.26 0.00 0.00 64.21 64.39 1sb3 n SER 78 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1sb3 h LEU 79 N 0.00 0.69-10.36 1.04 3.38 -1.63 -3.45 115.31 104.98 1sb3 h LEU 79 Ca 0.00 -0.30 -0.50 0.00 0.09 0.00 0.00 57.88 57.17 1sb3 h LEU 79 Cb 0.63 -0.19 0.10 0.00 0.09 0.00 0.00 40.66 41.29 1sb3 h LEU 79 CO 0.00 1.00 0.35 0.00 0.09 0.00 0.00 178.44 179.88 1sb3 s ALA 80 N -4.32 2.46 -0.38 1.53 0.00 -1.26 -4.33 121.76 115.47 1sb3 s ALA 80 Ca -0.08 -0.02 -0.07 0.00 0.00 0.00 0.00 51.96 51.78 1sb3 s ALA 80 Cb 0.12 -3.15 0.06 0.00 0.00 0.00 0.00 23.12 20.15 1sb3 s ALA 80 CO 0.84 -1.48 0.17 0.99 0.00 0.00 0.00 175.76 176.28 1sb3 s THR 81 N -3.08 3.87 0.00 0.00 2.01 -0.08 -4.93 115.64 113.44 1sb3 s THR 81 Ca 0.59 -1.34 0.00 0.00 0.31 0.00 0.00 61.69 61.25 1sb3 s THR 81 Cb -0.14 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 69.05 1sb3 s THR 81 CO 0.55 -0.36 0.00 0.00 -0.69 0.00 0.00 174.62 174.12 1sb3 n GLN 82 N 4.82 0.00 -0.04 4.92 1.13 -1.26 -0.71 117.38 126.24 1sb3 n GLN 82 Ca -0.10 0.00 0.11 0.00 -1.94 0.00 0.00 57.00 55.06 1sb3 n GLN 82 Cb 0.44 0.00 0.48 0.00 0.11 0.00 0.00 30.24 31.27 1sb3 n GLN 82 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1sb3 n GLY 83 N 0.00 -0.29 3.68 1.08 0.00 -1.26 -4.86 105.19 103.53 1sb3 n GLY 83 Ca 0.00 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 1sb3 n GLY 83 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sb3 s THR 84 N -1.90 4.99 0.54 2.61 2.01 0.11 -5.04 115.64 118.97 1sb3 s THR 84 Ca 0.32 1.37 -0.20 0.00 0.31 0.00 0.00 61.69 63.48 1sb3 s THR 84 Cb 0.16 -4.02 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 1sb3 s THR 84 CO 0.25 0.13 1.19 -0.76 -0.69 0.00 0.00 174.62 174.75 1sb3 s LEU 85 N 1.64 3.80 0.80 4.42 1.43 -1.26 -0.90 118.68 128.61 1sb3 s LEU 85 Ca 0.34 2.36 -0.12 0.00 -1.03 0.00 0.00 54.13 55.67 1sb3 s LEU 85 Cb -0.16 -4.47 0.07 0.00 0.03 0.00 0.00 46.19 41.66 1sb3 s LEU 85 CO 0.13 -1.32 1.12 -0.94 0.23 0.00 0.00 176.35 175.57 1sb3 s SER 86 N -1.51 4.50 0.31 2.29 1.04 -1.26 -4.80 113.70 114.27 1sb3 s SER 86 Ca 0.72 1.08 0.00 0.00 0.48 0.00 0.00 55.95 58.23 1sb3 s SER 86 Cb -0.29 -1.75 0.51 0.00 0.10 0.00 0.00 66.02 64.59 1sb3 s SER 86 CO 0.33 -1.94 1.93 0.11 0.98 0.00 0.00 173.24 174.65 1sb3 h LYS 87 N -1.07 0.87 -0.20 4.02 1.57 -1.95 0.30 116.57 120.11 1sb3 h LYS 87 Ca -0.47 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.19 1sb3 h LYS 87 Cb 1.29 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 1sb3 h LYS 87 CO 0.62 0.66 0.06 1.25 -0.57 0.00 0.00 179.45 181.47 1sb3 h LEU 88 N 0.87 0.29 -0.63 2.94 5.85 -1.92 -1.14 115.31 121.57 1sb3 h LEU 88 Ca 0.22 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1sb3 h LEU 88 Cb 0.06 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1sb3 h LEU 88 CO -0.03 0.42 0.27 1.56 -0.34 0.00 0.00 178.44 180.32 1sb3 h GLN 89 N 0.14 0.92 -0.70 1.25 4.20 -1.83 -2.17 115.11 116.93 1sb3 h GLN 89 Ca 0.06 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1sb3 h GLN 89 Cb 0.24 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 1sb3 h GLN 89 CO -0.00 0.77 0.27 0.00 -0.67 0.00 0.00 178.83 179.20 1sb3 h ALA 90 N 1.11 1.17 -0.36 3.87 0.00 -0.81 -2.06 119.26 122.18 1sb3 h ALA 90 Ca 0.21 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1sb3 h ALA 90 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1sb3 h ALA 90 CO -0.02 0.60 0.04 0.00 0.00 0.00 0.00 179.25 179.87 1sb3 h ALA 91 N 1.29 0.48 -0.82 0.00 0.00 -0.96 0.22 119.26 119.46 1sb3 h ALA 91 Ca 0.23 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1sb3 h ALA 91 Cb 0.20 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1sb3 h ALA 91 CO -0.02 0.20 0.53 0.74 0.00 0.00 0.00 179.25 180.70 1sb3 h PHE 92 N 0.43 1.05 0.32 0.00 -1.00 -1.10 0.79 116.94 117.44 1sb3 h PHE 92 Ca 0.11 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.89 1sb3 h PHE 92 Cb 0.39 -0.35 0.00 0.00 3.61 0.00 0.00 35.95 39.60 1sb3 h PHE 92 CO 0.03 0.67 -0.15 1.25 -1.61 0.00 0.00 178.31 178.49 1sb3 h HIS 93 N 1.12 -0.40 -0.15 -0.55 2.76 -1.16 0.18 115.15 116.95 1sb3 h HIS 93 Ca 0.30 -0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 58.37 1sb3 h HIS 93 Cb -0.11 0.13 -0.01 0.00 1.55 0.00 0.00 27.41 28.97 1sb3 h HIS 93 CO -0.01 -0.11 -0.31 0.93 -1.30 0.00 0.00 177.93 177.13 1sb3 h GLU 94 N -0.68 0.30 -0.02 5.26 5.08 -0.38 -2.95 114.58 121.19 1sb3 h GLU 94 Ca -0.04 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1sb3 h GLU 94 Cb 0.47 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1sb3 h GLU 94 CO 0.07 0.59 -0.05 1.63 -1.00 0.00 0.00 179.01 180.25 1sb3 n LYS 95 N -4.10 1.80 -3.17 2.33 4.76 0.26 -4.96 118.16 115.08 1sb3 n LYS 95 Ca -0.01 -1.27 -0.14 0.00 -2.87 0.00 0.00 58.31 54.02 1sb3 n LYS 95 Cb 0.42 -1.47 0.07 0.00 -1.84 0.00 0.00 35.03 32.20 1sb3 n LYS 95 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1sb3 n LEU 96 N 0.50 -3.48 -0.21 -0.35 7.94 -0.85 -4.85 117.00 115.71 1sb3 n LEU 96 Ca 0.16 -0.47 0.09 0.00 -1.11 0.00 0.00 56.01 54.69 1sb3 n LEU 96 Cb 0.45 -2.53 0.47 0.00 0.53 0.00 0.00 43.42 42.33 1sb3 n LEU 96 CO 0.18 0.34 0.81 0.61 -1.11 0.00 0.00 177.39 178.22 1sb3 n GLY 97 N -1.23 -0.50 2.81 -3.96 0.00 0.58 -4.65 105.19 98.24 1sb3 n GLY 97 Ca -0.17 -0.23 -0.17 0.00 0.00 0.00 0.00 46.02 45.45 1sb3 n GLY 97 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1sb3 s THR 98 N -1.92 0.16 0.00 2.61 -1.32 -1.23 -4.60 115.64 109.34 1sb3 s THR 98 Ca 0.29 0.10 0.00 0.00 -1.21 0.00 0.00 61.69 60.86 1sb3 s THR 98 Cb 0.14 -0.26 0.00 0.00 -1.51 0.00 0.00 72.50 70.87 1sb3 s THR 98 CO 0.23 0.14 0.00 0.00 -2.21 0.00 0.00 174.62 172.78 1sb3 n GLN 99 N 4.15 0.00 0.18 7.08 6.02 -1.26 -4.81 117.38 128.74 1sb3 n GLN 99 Ca -0.26 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 56.75 1sb3 n GLN 99 Cb 0.50 0.00 0.35 0.00 1.02 0.00 0.00 30.24 32.11 1sb3 n GLN 99 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1sb3 n GLY 101 N -0.44 0.92 0.28 0.00 0.00 -1.26 -4.98 105.19 99.71 1sb3 n GLY 101 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 1sb3 n GLY 101 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1sb3 h PHE 102 N 0.00 1.15 -0.00 1.61 3.57 -2.01 -2.89 116.94 118.37 1sb3 h PHE 102 Ca 0.00 -0.29 0.00 0.00 3.53 0.00 0.00 57.97 61.21 1sb3 h PHE 102 Cb 0.00 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.48 1sb3 h PHE 102 CO 0.00 1.13 -0.19 0.00 -2.23 0.00 0.00 178.31 177.02 1sb3 h THR 104 N 0.29 1.06 -0.60 0.00 2.02 -1.88 0.40 112.91 114.20 1sb3 h THR 104 Ca 0.00 -0.16 0.04 0.00 0.77 0.00 0.00 66.41 67.06 1sb3 h THR 104 Cb 0.44 0.55 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 1sb3 h THR 104 CO 0.00 0.08 0.35 -0.65 0.37 0.00 0.00 175.52 175.67 1sb3 h PRO 105 N 0.47 0.65 -0.44 6.66 0.11 -1.76 0.27 132.00 137.95 1sb3 h PRO 105 Ca 0.14 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.09 1sb3 h PRO 105 Cb -0.02 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 1sb3 h PRO 105 CO -0.06 0.43 -0.24 0.78 -0.21 0.00 0.00 178.00 178.71 1sb3 h GLY 106 N 0.67 0.98 1.03 -0.55 0.00 -1.57 -1.27 103.07 102.36 1sb3 h GLY 106 Ca 0.26 -0.87 -0.09 0.00 0.00 0.00 0.00 47.33 46.63 1sb3 h GLY 106 CO -0.14 0.79 -0.05 1.98 0.00 0.00 0.00 176.54 179.12 1sb3 h MET 107 N 0.77 0.91 -0.44 4.80 -1.53 -0.43 -1.72 114.93 117.29 1sb3 h MET 107 Ca 0.10 -0.32 -0.13 0.00 -3.44 0.00 0.00 59.70 55.91 1sb3 h MET 107 Cb 0.79 -0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.76 1sb3 h MET 107 CO 0.07 0.96 -0.26 0.82 0.14 0.00 0.00 176.91 178.64 1sb3 h ILE 108 N 0.77 1.27 -0.55 1.77 2.04 -0.40 -1.54 117.51 120.87 1sb3 h ILE 108 Ca 0.13 -1.42 -0.10 0.00 1.00 0.00 0.00 64.86 64.48 1sb3 h ILE 108 Cb 0.59 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1sb3 h ILE 108 CO 0.04 0.48 -0.05 0.24 0.00 0.00 0.00 178.15 178.86 1sb3 h MET 109 N 0.80 0.98 -0.16 2.37 2.86 -1.06 0.67 114.93 121.38 1sb3 h MET 109 Ca 0.10 -0.32 -0.08 0.00 -2.06 0.00 0.00 59.70 57.34 1sb3 h MET 109 Cb 0.83 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 1sb3 h MET 109 CO 0.07 0.99 -0.25 0.00 1.06 0.00 0.00 176.91 178.78 1sb3 h ALA 110 N 1.05 1.28 -0.33 6.32 0.00 -1.22 -1.76 119.26 124.59 1sb3 h ALA 110 Ca 0.15 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 1sb3 h ALA 110 Cb 0.58 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1sb3 h ALA 110 CO 0.04 0.48 -0.40 0.77 0.00 0.00 0.00 179.25 180.13 1sb3 h SER 111 N 0.26 0.87 -0.50 0.00 0.02 -0.72 -2.25 113.55 111.23 1sb3 h SER 111 Ca 0.04 -0.40 -0.03 0.00 -0.84 0.00 0.00 61.79 60.56 1sb3 h SER 111 Cb 0.59 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1sb3 h SER 111 CO 0.04 1.16 0.19 -0.08 -1.14 0.00 0.00 176.83 177.01 1sb3 h GLU 112 N 0.66 0.75 -0.55 3.45 4.57 -0.52 -0.45 114.58 122.51 1sb3 h GLU 112 Ca 0.05 -0.14 -0.02 0.00 -1.18 0.00 0.00 59.36 58.07 1sb3 h GLU 112 Cb 0.97 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.42 1sb3 h GLU 112 CO 0.09 0.67 0.25 0.00 -1.18 0.00 0.00 179.01 178.85 1sb3 h ALA 113 N 1.04 0.71 0.02 2.92 0.00 -1.25 -1.38 119.26 121.32 1sb3 h ALA 113 Ca 0.17 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1sb3 h ALA 113 Cb 0.20 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1sb3 h ALA 113 CO -0.01 0.28 -0.01 1.25 0.00 0.00 0.00 179.25 180.76 1sb3 h LEU 114 N 0.74 -0.03 -1.79 0.00 5.85 -1.11 -2.50 115.31 116.47 1sb3 h LEU 114 Ca 0.19 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 1sb3 h LEU 114 Cb 0.13 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1sb3 h LEU 114 CO -0.02 0.01 -0.14 -0.07 -0.34 0.00 0.00 178.44 177.88 1sb3 h LEU 115 N -0.06 0.00 -0.27 2.25 3.38 -0.82 0.29 115.31 120.09 1sb3 h LEU 115 Ca -0.00 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 1sb3 h LEU 115 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1sb3 h LEU 115 CO 0.01 0.14 -0.89 0.03 0.09 0.00 0.00 178.44 177.81 1sb3 h ARG 116 N 0.00 0.17 0.04 1.13 3.08 -1.01 -3.22 114.38 114.57 1sb3 h ARG 116 Ca -0.00 -0.19 -0.30 0.00 0.07 0.00 0.00 59.98 59.56 1sb3 h ARG 116 Cb 0.40 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 1sb3 h ARG 116 CO 0.02 0.95 -1.68 -0.22 -1.07 0.00 0.00 179.97 177.97 1sb3 h LYS 117 N 0.09 0.09 -2.60 0.04 3.64 -0.92 -3.43 116.57 113.49 1sb3 h LYS 117 Ca -0.04 -0.15 -0.59 0.00 -1.27 0.00 0.00 60.65 58.59 1sb3 h LYS 117 Cb 1.53 0.06 -0.39 0.00 -0.41 0.00 0.00 32.23 33.01 1sb3 h LYS 117 CO 0.13 0.77 -0.86 1.21 -2.27 0.00 0.00 179.45 178.43 1sb3 s ASN 118 N -6.47 2.56 0.58 4.20 3.84 0.97 -5.01 114.94 115.61 1sb3 s ASN 118 Ca -0.08 -2.79 0.29 0.00 0.21 0.00 0.00 52.86 50.49 1sb3 s ASN 118 Cb 0.08 -0.62 1.46 0.00 -0.55 0.00 0.00 41.25 41.61 1sb3 s ASN 118 CO 0.82 -0.22 1.88 -0.65 -2.79 0.00 0.00 177.10 176.14 1sb3 h PRO 119 N 6.22 0.00 -2.29 0.43 0.11 -1.77 -3.16 132.00 131.54 1sb3 h PRO 119 Ca 0.15 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.67 1sb3 h PRO 119 Cb 0.92 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.63 1sb3 h PRO 119 CO 0.39 0.00 -0.89 0.45 -0.21 0.00 0.00 178.00 177.74 1sb3 n SER 120 N -3.82 1.19 -4.78 -2.05 2.88 -1.26 -4.78 113.62 101.00 1sb3 n SER 120 Ca 0.11 -2.85 -0.36 0.00 -1.33 0.00 0.00 58.87 54.44 1sb3 n SER 120 Cb 0.74 -0.64 -0.04 0.00 -0.75 0.00 0.00 64.21 63.53 1sb3 n SER 120 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1sb3 s PRO 121 N -1.19 4.09 0.68 -1.46 0.04 -1.20 -5.04 135.00 130.92 1sb3 s PRO 121 Ca 0.34 1.52 -0.10 0.00 0.04 0.00 0.00 61.00 62.79 1sb3 s PRO 121 Cb 0.10 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 32.18 1sb3 s PRO 121 CO -0.12 -0.21 1.06 -1.54 0.04 0.00 0.00 177.00 176.23 1sb3 s SER 122 N -1.60 5.49 0.22 6.66 1.04 -1.26 -4.85 113.70 119.40 1sb3 s SER 122 Ca 0.59 1.05 -0.08 0.00 0.48 0.00 0.00 55.95 58.00 1sb3 s SER 122 Cb -0.22 -1.90 0.28 0.00 0.10 0.00 0.00 66.02 64.29 1sb3 s SER 122 CO 0.27 -1.28 1.79 -0.09 0.98 0.00 0.00 173.24 174.92 1sb3 h ARG 123 N -0.55 0.63 -0.31 4.02 2.43 -2.00 -0.48 114.38 118.12 1sb3 h ARG 123 Ca -0.45 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 58.64 1sb3 h ARG 123 Cb 1.25 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1sb3 h ARG 123 CO 0.63 0.41 0.02 -0.44 -1.51 0.00 0.00 179.97 179.09 1sb3 h ASP 124 N 0.64 0.43 0.61 -3.80 3.45 -2.00 -2.25 116.42 113.51 1sb3 h ASP 124 Ca 0.32 -0.07 -0.12 0.00 0.43 0.00 0.00 57.03 57.60 1sb3 h ASP 124 Cb 0.27 -0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 38.91 1sb3 h ASP 124 CO -0.22 0.48 -0.55 -0.33 -1.57 0.00 0.00 179.24 177.04 1sb3 h GLU 125 N 0.45 0.00 -0.07 3.56 5.08 -1.50 -0.78 114.58 121.32 1sb3 h GLU 125 Ca 0.10 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1sb3 h GLU 125 Cb 0.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1sb3 h GLU 125 CO 0.00 0.55 -0.11 0.82 -1.00 0.00 0.00 179.01 179.28 1sb3 h ILE 126 N 0.00 1.40 -0.72 3.13 2.04 -0.69 -1.87 117.51 120.81 1sb3 h ILE 126 Ca -0.01 -1.38 0.05 0.00 1.00 0.00 0.00 64.86 64.52 1sb3 h ILE 126 Cb 1.01 2.16 -0.05 0.00 -0.74 0.00 0.00 36.82 39.20 1sb3 h ILE 126 CO 0.07 0.38 0.43 0.11 0.00 0.00 0.00 178.15 179.15 1sb3 h LYS 127 N -0.28 0.80 -0.43 2.37 1.57 -1.37 -0.72 116.57 118.51 1sb3 h LYS 127 Ca 0.01 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1sb3 h LYS 127 Cb 0.67 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1sb3 h LYS 127 CO 0.03 0.53 -0.02 0.00 -0.57 0.00 0.00 179.45 179.41 1sb3 h ALA 128 N 1.34 1.15 -0.02 3.86 0.00 -1.07 -1.26 119.26 123.26 1sb3 h ALA 128 Ca 0.30 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 1sb3 h ALA 128 Cb 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1sb3 h ALA 128 CO -0.14 0.55 -0.75 0.00 0.00 0.00 0.00 179.25 178.91 1sb3 h ALA 129 N 1.31 0.71 -0.45 0.00 0.00 -0.45 -3.13 119.26 117.26 1sb3 h ALA 129 Ca 0.13 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1sb3 h ALA 129 Cb 0.45 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1sb3 h ALA 129 CO 0.02 0.86 0.00 1.28 0.00 0.00 0.00 179.25 181.41 1sb3 n LEU 130 N -3.73 2.86 -0.18 0.00 4.77 -0.37 -4.57 117.00 115.78 1sb3 n LEU 130 Ca -0.02 -1.35 0.21 0.00 -0.03 0.00 0.00 56.01 54.82 1sb3 n LEU 130 Cb 0.72 -0.29 0.58 0.00 -2.33 0.00 0.00 43.42 42.09 1sb3 n LEU 130 CO 0.45 0.67 1.22 0.00 -1.33 0.00 0.00 177.39 178.41 1sb3 h ALA 131 N 4.15 2.37 -0.35 -1.18 0.00 -1.17 -0.51 119.26 122.56 1sb3 h ALA 131 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1sb3 h ALA 131 Cb 0.76 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1sb3 h ALA 131 CO 0.00 -0.61 0.00 0.41 0.00 0.00 0.00 179.25 179.05 1sb3 n GLY 132 N -1.58 1.26 3.47 0.00 0.00 -1.26 -4.83 105.19 102.24 1sb3 n GLY 132 Ca 0.17 -0.62 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 1sb3 n GLY 132 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1sb3 s ASN 133 N -1.44 5.99 0.07 1.61 0.01 -0.20 -3.20 114.94 117.78 1sb3 s ASN 133 Ca 0.36 -0.72 -0.20 0.00 -0.71 0.00 0.00 52.86 51.59 1sb3 s ASN 133 Cb 0.21 -2.12 -0.07 0.00 0.41 0.00 0.00 41.25 39.68 1sb3 s ASN 133 CO 0.29 -0.35 0.59 -0.76 -1.51 0.00 0.00 177.10 175.36 1sb3 s LEU 134 N 1.67 4.52 -0.01 0.60 1.43 -0.37 -5.01 118.68 121.50 1sb3 s LEU 134 Ca 0.05 1.28 0.03 0.00 -1.03 0.00 0.00 54.13 54.46 1sb3 s LEU 134 Cb -0.18 -2.94 -0.00 0.00 0.03 0.00 0.00 46.19 43.10 1sb3 s LEU 134 CO 0.09 0.24 -0.10 0.00 0.23 0.00 0.00 176.35 176.82 1sb3 n ARG 136 N 2.99 1.20 0.01 0.00 3.00 -1.26 -4.73 116.66 117.86 1sb3 n ARG 136 Ca -0.15 -0.08 -0.22 0.00 -0.00 0.00 0.00 57.85 57.40 1sb3 n ARG 136 Cb 0.56 -1.28 -0.14 0.00 0.00 0.00 0.00 32.46 31.60 1sb3 n ARG 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1sb3 h THR 138 N -0.02 0.26 -0.01 0.00 1.35 -1.94 -3.47 112.91 109.07 1sb3 h THR 138 Ca -0.40 -1.44 -0.00 0.00 -0.55 0.00 0.00 66.41 64.01 1sb3 h THR 138 Cb 1.98 1.88 -0.00 0.00 -1.73 0.00 0.00 68.15 70.28 1sb3 h THR 138 CO 0.08 0.15 -0.00 0.61 -0.25 0.00 0.00 175.52 176.10 1sb3 n GLY 139 N 1.22 0.36 4.70 5.82 0.00 -1.26 -3.98 105.19 112.04 1sb3 n GLY 139 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1sb3 n GLY 139 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1sb3 n TYR 140 N -2.68 0.00 -0.13 1.61 4.01 -1.26 -4.83 117.16 113.89 1sb3 n TYR 140 Ca -0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.67 1sb3 n TYR 140 Cb 0.17 -0.25 -0.01 0.00 -0.31 0.00 0.00 39.34 38.94 1sb3 n TYR 140 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1sb3 h VAL 141 N 0.00 0.26 0.00 -0.72 2.07 -2.00 -0.82 116.25 115.05 1sb3 h VAL 141 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1sb3 h VAL 141 Cb 0.00 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1sb3 h VAL 141 CO 0.00 0.00 0.00 0.11 0.02 0.00 0.00 177.57 177.70 1sb3 h LYS 142 N -0.22 0.00 -0.33 1.57 1.57 -1.85 -2.61 116.57 114.70 1sb3 h LYS 142 Ca 0.19 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.87 1sb3 h LYS 142 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1sb3 h LYS 142 CO -0.54 0.00 -0.15 0.82 -0.57 0.00 0.00 179.45 179.01 1sb3 h ILE 143 N 0.00 1.29 -0.58 1.86 2.04 -1.42 -0.15 117.51 120.55 1sb3 h ILE 143 Ca 0.00 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.58 1sb3 h ILE 143 Cb 0.65 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1sb3 h ILE 143 CO 0.00 0.41 0.28 0.40 0.00 0.00 0.00 178.15 179.24 1sb3 h ILE 144 N 0.46 1.21 -0.90 -0.67 2.04 -1.11 -1.35 117.51 117.18 1sb3 h ILE 144 Ca 0.08 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 1sb3 h ILE 144 Cb 0.68 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1sb3 h ILE 144 CO 0.05 0.23 0.51 0.50 0.00 0.00 0.00 178.15 179.44 1sb3 h LYS 145 N 0.78 1.25 -0.67 2.37 3.64 -1.33 -1.49 116.57 121.12 1sb3 h LYS 145 Ca 0.20 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1sb3 h LYS 145 Cb 0.11 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1sb3 h LYS 145 CO -0.03 0.90 0.37 0.77 -2.27 0.00 0.00 179.45 179.20 1sb3 h SER 146 N 1.26 0.84 -0.41 4.20 0.02 -0.35 0.83 113.55 119.94 1sb3 h SER 146 Ca 0.32 -0.09 -0.14 0.00 -0.84 0.00 0.00 61.79 61.04 1sb3 h SER 146 Cb 0.01 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 1sb3 h SER 146 CO -0.05 0.69 -0.28 0.58 -1.14 0.00 0.00 176.83 176.63 1sb3 h VAL 147 N 0.92 1.27 -0.57 2.27 2.07 -0.91 -0.59 116.25 120.70 1sb3 h VAL 147 Ca 0.24 -1.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.25 1sb3 h VAL 147 Cb 0.04 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1sb3 h VAL 147 CO -0.04 0.49 0.10 -0.33 0.02 0.00 0.00 177.57 177.82 1sb3 h GLU 148 N 0.79 0.94 -0.41 1.57 5.08 -0.92 -0.11 114.58 121.52 1sb3 h GLU 148 Ca 0.09 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 1sb3 h GLU 148 Cb 0.85 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1sb3 h GLU 148 CO 0.08 0.89 0.17 1.15 -1.00 0.00 0.00 179.01 180.29 1sb3 h THR 149 N 0.84 1.19 -0.52 1.13 2.02 -0.68 -1.80 112.91 115.08 1sb3 h THR 149 Ca 0.18 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.76 1sb3 h THR 149 Cb 0.40 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 1sb3 h THR 149 CO 0.01 0.22 0.31 0.00 0.37 0.00 0.00 175.52 176.42 1sb3 h ALA 150 N 1.01 0.67 -0.35 6.16 0.00 -0.90 -0.96 119.26 124.89 1sb3 h ALA 150 Ca 0.14 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1sb3 h ALA 150 Cb 0.18 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1sb3 h ALA 150 CO -0.01 0.16 0.16 0.00 0.00 0.00 0.00 179.25 179.56 1sb3 h ALA 151 N 1.15 0.43 -0.39 0.00 0.00 -0.73 -0.90 119.26 118.81 1sb3 h ALA 151 Ca 0.19 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1sb3 h ALA 151 Cb 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1sb3 h ALA 151 CO -0.03 -0.22 0.13 0.00 0.00 0.00 0.00 179.25 179.13 1sb3 h ALA 152 N 1.20 0.52 -0.14 0.00 0.00 -1.15 0.16 119.26 119.84 1sb3 h ALA 152 Ca 0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1sb3 h ALA 152 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1sb3 h ALA 152 CO -0.12 0.16 0.02 0.00 0.00 0.00 0.00 179.25 179.30 1sb3 h ALA 153 N 0.97 1.78 0.00 0.00 0.00 -0.78 -2.74 119.26 118.49 1sb3 h ALA 153 Ca 0.13 -0.07 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 1sb3 h ALA 153 Cb 0.25 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1sb3 h ALA 153 CO -0.01 0.17 -1.45 0.00 0.00 0.00 0.00 179.25 177.97 1sb3 h ARG 154 N 0.19 0.00 -6.61 0.00 3.08 -0.96 -3.49 114.38 106.59 1sb3 h ARG 154 Ca 0.05 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.51 1sb3 h ARG 154 Cb 0.11 0.00 0.13 0.00 0.08 0.00 0.00 29.97 30.28 1sb3 h ARG 154 CO -0.00 0.41 0.17 -0.11 -1.07 0.00 0.00 179.97 179.37 1sb3 n LEU 155 N -2.99 2.47 -4.72 3.04 7.94 0.55 -4.97 117.00 118.32 1sb3 n LEU 155 Ca -0.11 1.07 -0.42 0.00 -1.11 0.00 0.00 56.01 55.45 1sb3 n LEU 155 Cb 0.92 -1.35 -0.03 0.00 0.53 0.00 0.00 43.42 43.49 1sb3 n LEU 155 CO 0.44 -1.41 0.79 0.00 -1.11 0.00 0.00 177.39 176.09 1sb3 h GLU 157 N 6.38 1.08 0.00 0.00 5.08 -1.96 -3.00 114.58 122.16 1sb3 h GLU 157 Ca -0.42 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 57.75 1sb3 h GLU 157 Cb 1.22 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1sb3 h GLU 157 CO 0.77 0.88 0.00 0.39 -1.00 0.00 0.00 179.01 180.05 1sb3 n GLU 158 N -4.29 0.90 -4.07 2.33 4.71 -1.26 -4.81 120.64 114.15 1sb3 n GLU 158 Ca 0.06 0.00 -0.27 0.00 -0.01 0.00 0.00 57.16 56.95 1sb3 n GLU 158 Cb 0.18 -1.34 -0.04 0.00 -1.01 0.00 0.00 31.44 29.24 1sb3 n GLU 158 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1sb3 s GLY 159 N -1.71 2.46 0.33 0.62 0.00 -1.13 -5.09 107.32 102.80 1sb3 s GLY 159 Ca 0.29 -1.36 -0.29 0.00 0.00 0.00 0.00 44.72 43.36 1sb3 s GLY 159 CO 0.22 -1.96 1.41 0.00 0.00 0.00 0.00 173.10 172.78 1sb3 s ALA 160 N -2.73 3.56 0.00 3.20 0.00 -1.26 -4.99 121.76 119.55 1sb3 s ALA 160 Ca 0.32 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.69 1sb3 s ALA 160 Cb -0.00 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1sb3 s ALA 160 CO 0.19 -0.83 0.03 0.54 0.00 0.00 0.00 175.76 175.69