#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sb3 s ASN 2 N 0.00 6.97 0.14 6.12 0.01 -1.26 -5.02 114.94 121.90 1sb3 s ASN 2 Ca 0.00 1.18 -0.31 0.00 -0.71 0.00 0.00 52.86 53.02 1sb3 s ASN 2 Cb 0.00 -2.44 -0.08 0.00 0.41 0.00 0.00 41.25 39.13 1sb3 s ASN 2 CO 0.00 -0.31 1.41 -0.63 -1.51 0.00 0.00 177.10 176.06 1sb3 s ILE 3 N 1.72 3.17 0.05 0.60 1.01 -1.26 -5.04 121.20 121.45 1sb3 s ILE 3 Ca 0.38 0.85 -0.05 0.00 0.00 0.00 0.00 60.65 61.84 1sb3 s ILE 3 Cb -0.17 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.73 1sb3 s ILE 3 CO 0.15 0.08 0.07 -0.76 0.00 0.00 0.00 174.94 174.47 1sb3 s LEU 4 N 0.93 1.96 0.78 2.97 1.43 -1.26 -4.67 118.68 120.83 1sb3 s LEU 4 Ca 0.64 -0.72 -0.11 0.00 -1.03 0.00 0.00 54.13 52.90 1sb3 s LEU 4 Cb -0.38 0.55 0.07 0.00 0.03 0.00 0.00 46.19 46.46 1sb3 s LEU 4 CO 0.32 -0.59 1.11 0.42 0.23 0.00 0.00 176.35 177.84 1sb3 s THR 5 N -3.34 2.97 -0.58 5.49 -4.23 -1.26 -4.85 115.64 109.84 1sb3 s THR 5 Ca 0.01 0.34 -0.07 0.00 -1.18 0.00 0.00 61.69 60.80 1sb3 s THR 5 Cb 0.03 -2.74 -0.18 0.00 1.34 0.00 0.00 72.50 70.95 1sb3 s THR 5 CO -0.08 -0.38 3.11 -0.67 -0.54 0.00 0.00 174.62 176.06 1sb3 n ASP 6 N -3.45 6.01 -4.81 3.99 2.03 -1.26 -4.94 116.55 114.11 1sb3 n ASP 6 Ca 0.10 -2.44 -0.32 0.00 0.52 0.00 0.00 54.79 52.66 1sb3 n ASP 6 Cb 0.52 -1.35 0.03 0.00 -0.72 0.00 0.00 41.12 39.61 1sb3 n ASP 6 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1sb3 s PHE 7 N 1.69 3.05 0.26 -0.67 -0.12 -1.26 -4.98 117.98 115.95 1sb3 s PHE 7 Ca 0.62 1.46 -0.17 0.00 -0.05 0.00 0.00 56.93 58.79 1sb3 s PHE 7 Cb 0.24 -2.94 -0.08 0.00 -0.63 0.00 0.00 43.02 39.61 1sb3 s PHE 7 CO -0.02 -1.18 0.71 1.03 -0.05 0.00 0.00 175.22 175.70 1sb3 s ARG 8 N -4.62 4.09 -0.29 1.99 1.81 -0.68 -4.92 118.95 116.33 1sb3 s ARG 8 Ca 0.60 0.72 0.02 0.00 -1.72 0.00 0.00 55.73 55.35 1sb3 s ARG 8 Cb -0.15 -2.66 0.07 0.00 -0.45 0.00 0.00 34.95 31.76 1sb3 s ARG 8 CO 0.47 0.28 -0.04 0.99 -0.68 0.00 0.00 175.30 176.33 1sb3 s THR 9 N -1.75 2.37 0.09 0.02 2.01 -1.26 -0.99 115.64 116.12 1sb3 s THR 9 Ca 0.48 -1.80 -0.20 0.00 0.31 0.00 0.00 61.69 60.48 1sb3 s THR 9 Cb -0.13 -2.50 -0.07 0.00 0.01 0.00 0.00 72.50 69.81 1sb3 s THR 9 CO 0.19 -0.22 0.60 -1.00 -0.69 0.00 0.00 174.62 173.51 1sb3 s HIS 10 N 1.07 3.82 -0.59 4.92 3.76 -0.21 -4.95 115.29 123.11 1sb3 s HIS 10 Ca -0.03 1.33 0.06 0.00 -0.15 0.00 0.00 55.06 56.27 1sb3 s HIS 10 Cb -0.20 -2.54 0.21 0.00 1.11 0.00 0.00 32.58 31.17 1sb3 s HIS 10 CO -0.05 0.58 0.58 0.54 -0.85 0.00 0.00 174.74 175.54 1sb3 n ARG 11 N 1.69 1.73 -2.04 1.40 1.74 -1.26 -0.54 116.66 119.38 1sb3 n ARG 11 Ca -0.10 -4.20 -0.36 0.00 -0.77 0.00 0.00 57.85 52.42 1sb3 n ARG 11 Cb 0.50 -2.03 0.03 0.00 -1.02 0.00 0.00 32.46 29.94 1sb3 n ARG 11 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1sb3 s PRO 12 N -1.63 3.06 0.00 5.56 0.04 -1.26 -4.95 135.00 135.82 1sb3 s PRO 12 Ca 0.33 1.82 0.22 0.00 0.04 0.00 0.00 61.00 63.42 1sb3 s PRO 12 Cb 0.08 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 1sb3 s PRO 12 CO -0.10 -1.14 1.04 0.00 0.04 0.00 0.00 177.00 176.84 1sb3 n ALA 13 N -1.48 4.20 -2.18 8.56 0.00 -1.26 -3.54 120.51 124.81 1sb3 n ALA 13 Ca 0.13 -0.58 -0.07 0.00 0.00 0.00 0.00 53.44 52.92 1sb3 n ALA 13 Cb 0.49 -0.83 -0.09 0.00 0.00 0.00 0.00 19.45 19.02 1sb3 n ALA 13 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1sb3 s THR 14 N -2.82 0.20 0.25 0.00 -4.23 -1.26 -2.94 115.64 104.84 1sb3 s THR 14 Ca 0.12 -1.70 -0.06 0.00 -1.18 0.00 0.00 61.69 58.88 1sb3 s THR 14 Cb 0.17 -1.49 0.24 0.00 1.34 0.00 0.00 72.50 72.76 1sb3 s THR 14 CO 0.75 -0.93 1.91 -0.07 -0.54 0.00 0.00 174.62 175.73 1sb3 h LEU 15 N 3.07 1.15 -0.32 4.79 3.38 -1.93 -1.22 115.31 124.23 1sb3 h LEU 15 Ca -0.34 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.59 1sb3 h LEU 15 Cb 1.15 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1sb3 h LEU 15 CO 0.64 0.86 0.19 0.00 0.09 0.00 0.00 178.44 180.22 1sb3 h ALA 16 N 1.34 0.40 -0.77 1.53 0.00 -1.99 0.16 119.26 119.94 1sb3 h ALA 16 Ca 0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1sb3 h ALA 16 Cb -0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1sb3 h ALA 16 CO -0.07 -0.17 0.44 -0.44 0.00 0.00 0.00 179.25 179.01 1sb3 h ASP 17 N 0.39 0.95 -0.29 0.00 3.32 -1.86 -0.54 116.42 118.40 1sb3 h ASP 17 Ca 0.13 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1sb3 h ASP 17 Cb -0.00 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 1sb3 h ASP 17 CO -0.06 0.76 0.14 0.00 -1.72 0.00 0.00 179.24 178.36 1sb3 h ALA 18 N 1.23 0.37 -0.71 3.45 0.00 -0.58 -1.65 119.26 121.38 1sb3 h ALA 18 Ca 0.27 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1sb3 h ALA 18 Cb 0.01 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1sb3 h ALA 18 CO -0.05 -0.07 0.46 0.28 0.00 0.00 0.00 179.25 179.87 1sb3 h VAL 19 N 0.33 1.14 -0.68 0.00 2.07 -0.32 -1.04 116.25 117.76 1sb3 h VAL 19 Ca 0.10 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.24 1sb3 h VAL 19 Cb 0.12 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.00 1sb3 h VAL 19 CO -0.01 0.17 0.16 0.78 0.02 0.00 0.00 177.57 178.69 1sb3 h ASN 20 N 0.91 1.03 -0.16 0.57 2.35 -0.91 -2.61 115.58 116.76 1sb3 h ASN 20 Ca 0.27 -0.21 -0.09 0.00 -0.55 0.00 0.00 56.30 55.72 1sb3 h ASN 20 Cb -0.05 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.04 1sb3 h ASN 20 CO -0.08 0.99 -0.18 0.00 -1.65 0.00 0.00 177.43 176.50 1sb3 h ALA 21 N 1.14 1.11 0.00 -0.83 0.00 -0.68 -2.49 119.26 117.51 1sb3 h ALA 21 Ca 0.22 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1sb3 h ALA 21 Cb 0.36 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1sb3 h ALA 21 CO 0.00 0.55 0.00 1.28 0.00 0.00 0.00 179.25 181.08 1sb3 n LEU 22 N -4.16 0.00 0.07 0.00 4.77 -0.45 -3.09 117.00 114.14 1sb3 n LEU 22 Ca 0.00 0.22 -0.06 0.00 -0.03 0.00 0.00 56.01 56.15 1sb3 n LEU 22 Cb 0.37 -0.22 0.11 0.00 -2.33 0.00 0.00 43.42 41.35 1sb3 n LEU 22 CO 0.42 -0.11 0.49 0.00 -1.33 0.00 0.00 177.39 176.85 1sb3 h ALA 23 N 2.77 0.83 -2.30 -1.18 0.00 -1.41 -3.37 119.26 114.60 1sb3 h ALA 23 Ca 0.00 -0.53 -0.52 0.00 0.00 0.00 0.00 54.91 53.86 1sb3 h ALA 23 Cb 0.11 -0.08 0.18 0.00 0.00 0.00 0.00 17.79 18.00 1sb3 h ALA 23 CO 0.00 0.71 0.25 0.00 0.00 0.00 0.00 179.25 180.21 1sb3 s ALA 24 N -3.82 1.64 0.65 0.00 0.00 -1.18 -4.97 121.76 114.07 1sb3 s ALA 24 Ca -0.05 0.56 -0.15 0.00 0.00 0.00 0.00 51.96 52.32 1sb3 s ALA 24 Cb 0.12 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.81 1sb3 s ALA 24 CO 0.80 -2.55 1.10 -1.21 0.00 0.00 0.00 175.76 173.91 1sb3 s GLU 25 N -4.65 2.91 -1.50 0.00 2.02 -1.26 -3.85 118.70 112.37 1sb3 s GLU 25 Ca 0.66 1.35 -0.02 0.00 0.02 0.00 0.00 54.97 56.99 1sb3 s GLU 25 Cb -0.22 -1.97 0.01 0.00 0.10 0.00 0.00 34.13 32.06 1sb3 s GLU 25 CO 0.57 -1.16 0.24 0.00 0.02 0.00 0.00 175.26 174.93 1sb3 n ALA 26 N -2.34 -1.96 -3.40 5.21 0.00 -1.26 -4.55 120.51 112.21 1sb3 n ALA 26 Ca 0.10 -0.33 -0.33 0.00 0.00 0.00 0.00 53.44 52.89 1sb3 n ALA 26 Cb 0.52 -1.27 -0.16 0.00 0.00 0.00 0.00 19.45 18.55 1sb3 n ALA 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1sb3 s THR 27 N -4.11 2.39 0.05 0.00 2.01 -1.25 0.16 115.64 114.89 1sb3 s THR 27 Ca 0.06 -0.88 0.09 0.00 0.31 0.00 0.00 61.69 61.27 1sb3 s THR 27 Cb -0.03 -1.97 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 1sb3 s THR 27 CO 0.95 0.54 -0.26 -0.76 -0.69 0.00 0.00 174.62 174.39 1sb3 s LEU 28 N 0.63 2.17 0.60 4.42 1.43 -0.65 -4.96 118.68 122.32 1sb3 s LEU 28 Ca -0.10 -0.59 -0.17 0.00 -1.03 0.00 0.00 54.13 52.24 1sb3 s LEU 28 Cb -0.16 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.74 1sb3 s LEU 28 CO 0.03 0.26 1.11 -2.84 0.23 0.00 0.00 176.35 175.13 1sb3 s PRO 29 N -1.26 3.09 -0.05 1.29 0.02 -1.26 -0.07 135.00 136.77 1sb3 s PRO 29 Ca 0.12 1.46 -0.00 0.00 0.02 0.00 0.00 61.00 62.60 1sb3 s PRO 29 Cb -0.10 -1.98 0.03 0.00 0.02 0.00 0.00 34.50 32.46 1sb3 s PRO 29 CO 0.02 -1.03 -0.01 -1.17 -0.33 0.00 0.00 177.00 174.48 1sb3 s LEU 30 N -4.37 0.99 0.00 -5.54 2.96 0.20 -4.72 118.68 108.20 1sb3 s LEU 30 Ca 0.69 -0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.53 1sb3 s LEU 30 Cb -0.21 -0.36 0.00 0.00 0.50 0.00 0.00 46.19 46.11 1sb3 s LEU 30 CO 0.35 -0.12 0.00 0.61 -1.32 0.00 0.00 176.35 175.87 1sb3 n GLY 31 N 4.48 0.49 0.02 7.98 0.00 -1.26 -0.95 105.19 115.95 1sb3 n GLY 31 Ca -0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.95 1sb3 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 n ALA 32 N -3.00 2.07 -1.01 4.61 0.00 -1.26 -4.72 120.51 117.20 1sb3 n ALA 32 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 53.44 53.37 1sb3 n ALA 32 Cb 0.00 -1.39 -0.00 0.00 0.00 0.00 0.00 19.45 18.06 1sb3 n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sb3 n GLY 33 N 0.91 0.46 0.27 0.00 0.00 -1.26 -4.92 105.19 100.65 1sb3 n GLY 33 Ca 0.05 -0.17 0.16 0.00 0.00 0.00 0.00 46.02 46.06 1sb3 n GLY 33 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1sb3 h THR 34 N 0.00 0.18 0.00 2.61 1.35 -1.95 -1.49 112.91 113.61 1sb3 h THR 34 Ca -0.01 -0.61 -0.36 0.00 -0.55 0.00 0.00 66.41 64.88 1sb3 h THR 34 Cb 0.14 1.51 -0.06 0.00 -1.73 0.00 0.00 68.15 68.02 1sb3 h THR 34 CO 0.01 0.06 -2.25 -0.67 -0.25 0.00 0.00 175.52 172.42 1sb3 n ASP 35 N -3.21 1.96 -0.10 5.36 4.64 -1.26 -4.60 116.55 119.33 1sb3 n ASP 35 Ca -0.00 0.09 -0.13 0.00 -1.38 0.00 0.00 54.79 53.38 1sb3 n ASP 35 Cb 0.31 -0.52 -0.04 0.00 -1.04 0.00 0.00 41.12 39.84 1sb3 n ASP 35 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 1sb3 h LEU 36 N -0.43 0.75 -0.42 -2.67 5.85 -1.97 -3.07 115.31 113.34 1sb3 h LEU 36 Ca -0.53 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 57.68 1sb3 h LEU 36 Cb 1.62 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 1sb3 h LEU 36 CO -0.22 1.04 0.05 -0.07 -0.34 0.00 0.00 178.44 178.90 1sb3 h LEU 37 N 0.46 0.69 -0.95 2.25 3.38 -1.55 0.31 115.31 119.90 1sb3 h LEU 37 Ca 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1sb3 h LEU 37 Cb 0.80 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 1sb3 h LEU 37 CO 0.06 0.79 0.57 -0.65 0.09 0.00 0.00 178.44 179.30 1sb3 h PRO 38 N 0.56 1.29 -0.27 1.13 0.11 -1.75 0.92 132.00 134.00 1sb3 h PRO 38 Ca 0.13 -0.12 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1sb3 h PRO 38 Cb 0.40 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 1sb3 h PRO 38 CO 0.01 0.90 0.08 -0.91 -0.21 0.00 0.00 178.00 177.87 1sb3 h ASN 39 N 1.31 0.40 -0.19 -2.05 4.21 -1.35 -2.09 115.58 115.80 1sb3 h ASN 39 Ca 0.34 -0.21 -0.08 0.00 1.21 0.00 0.00 56.30 57.56 1sb3 h ASN 39 Cb -0.05 -0.10 -0.02 0.00 -1.12 0.00 0.00 38.32 37.03 1sb3 h ASN 39 CO -0.06 0.50 -0.14 -0.07 -1.29 0.00 0.00 177.43 176.38 1sb3 h LEU 40 N 0.27 0.57 -1.33 1.61 3.38 -0.01 -0.52 115.31 119.29 1sb3 h LEU 40 Ca 0.09 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1sb3 h LEU 40 Cb 0.25 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1sb3 h LEU 40 CO -0.00 0.74 -0.23 0.03 0.09 0.00 0.00 178.44 179.07 1sb3 h ARG 41 N 0.54 0.16 -0.00 1.13 3.08 -0.67 -0.82 114.38 117.80 1sb3 h ARG 41 Ca 0.09 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1sb3 h ARG 41 Cb 0.55 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1sb3 h ARG 41 CO 0.03 0.39 -0.00 0.54 -1.07 0.00 0.00 179.97 179.86 1sb3 n ARG 42 N -4.21 1.16 -0.57 0.04 1.74 -0.80 -4.89 116.66 109.13 1sb3 n ARG 42 Ca -0.01 -0.27 0.00 0.00 -0.77 0.00 0.00 57.85 56.80 1sb3 n ARG 42 Cb 0.32 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1sb3 n ARG 42 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sb3 n GLY 43 N 1.06 0.66 2.95 -0.13 0.00 -0.31 -2.30 105.19 107.12 1sb3 n GLY 43 Ca 0.22 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 1sb3 n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1sb3 n LEU 44 N 0.00 6.48 0.00 0.99 4.77 -0.25 -4.82 117.00 124.18 1sb3 n LEU 44 Ca 0.00 -4.77 0.00 0.00 -0.03 0.00 0.00 56.01 51.21 1sb3 n LEU 44 Cb 0.00 -1.44 0.00 0.00 -2.33 0.00 0.00 43.42 39.65 1sb3 n LEU 44 CO 0.00 1.41 0.00 0.61 -1.33 0.00 0.00 177.39 178.08 1sb3 n GLY 45 N 2.55 4.32 2.21 -0.72 0.00 -1.26 -4.42 105.19 107.87 1sb3 n GLY 45 Ca 0.36 -1.31 -0.24 0.00 0.00 0.00 0.00 46.02 44.82 1sb3 n GLY 45 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1sb3 n HIS 46 N -1.49 -0.17 -2.08 1.61 8.25 -1.26 -4.90 115.22 115.19 1sb3 n HIS 46 Ca 0.00 -3.58 -0.36 0.00 -0.26 0.00 0.00 57.72 53.52 1sb3 n HIS 46 Cb 0.00 -0.33 0.03 0.00 1.12 0.00 0.00 29.99 30.80 1sb3 n HIS 46 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1sb3 s PRO 47 N -1.19 3.07 0.05 -0.41 0.04 -1.26 -4.95 135.00 130.35 1sb3 s PRO 47 Ca 0.35 1.78 0.22 0.00 0.04 0.00 0.00 61.00 63.39 1sb3 s PRO 47 Cb 0.16 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.68 1sb3 s PRO 47 CO -0.11 -1.12 0.89 0.00 0.04 0.00 0.00 177.00 176.70 1sb3 n ALA 48 N -1.51 3.21 -3.53 8.56 0.00 0.12 -4.41 120.51 122.95 1sb3 n ALA 48 Ca 0.13 -0.42 -0.12 0.00 0.00 0.00 0.00 53.44 53.03 1sb3 n ALA 48 Cb 0.50 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.98 1sb3 n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb3 s ALA 49 N -3.29 -1.83 0.02 0.00 0.00 -1.10 -1.69 121.76 113.87 1sb3 s ALA 49 Ca 0.00 1.28 0.08 0.00 0.00 0.00 0.00 51.96 53.32 1sb3 s ALA 49 Cb 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.14 1sb3 s ALA 49 CO 0.83 -0.45 -0.23 -0.51 0.00 0.00 0.00 175.76 175.39 1sb3 s LEU 50 N -1.59 2.11 -0.39 0.00 1.43 -0.17 -1.63 118.68 118.44 1sb3 s LEU 50 Ca -0.03 -0.49 -0.04 0.00 -1.03 0.00 0.00 54.13 52.54 1sb3 s LEU 50 Cb -0.00 -1.16 0.09 0.00 0.03 0.00 0.00 46.19 45.14 1sb3 s LEU 50 CO 0.00 0.25 0.17 -0.69 0.23 0.00 0.00 176.35 176.31 1sb3 s VAL 51 N -0.68 3.41 0.01 -1.59 1.01 0.90 -1.04 120.40 122.43 1sb3 s VAL 51 Ca 0.09 -1.79 -0.30 0.00 0.00 0.00 0.00 61.98 59.98 1sb3 s VAL 51 Cb -0.09 -3.21 -0.06 0.00 0.00 0.00 0.00 36.38 33.01 1sb3 s VAL 51 CO 0.01 -0.54 1.49 -0.62 0.00 0.00 0.00 175.10 175.44 1sb3 s ASP 52 N 1.77 6.76 0.00 3.32 2.15 0.30 -0.63 116.67 130.35 1sb3 s ASP 52 Ca 0.04 2.23 0.21 0.00 0.43 0.00 0.00 52.55 55.46 1sb3 s ASP 52 Cb -0.22 -2.56 -0.18 0.00 -0.30 0.00 0.00 42.92 39.65 1sb3 s ASP 52 CO -0.02 -0.78 0.94 0.18 -0.17 0.00 0.00 175.17 175.31 1sb3 n LEU 53 N 5.58 1.11 0.00 -1.34 4.77 -0.12 -4.01 117.00 123.00 1sb3 n LEU 53 Ca 0.14 -0.52 0.07 0.00 -0.03 0.00 0.00 56.01 55.67 1sb3 n LEU 53 Cb 0.43 -0.01 0.30 0.00 -2.33 0.00 0.00 43.42 41.81 1sb3 n LEU 53 CO 0.60 0.26 0.72 0.35 -1.33 0.00 0.00 177.39 178.00 1sb3 n THR 54 N -1.32 1.04 0.76 -5.08 -2.24 -1.26 -2.42 114.28 103.77 1sb3 n THR 54 Ca 0.05 0.26 0.12 0.00 -2.27 0.00 0.00 64.05 62.21 1sb3 n THR 54 Cb 0.35 -1.03 0.13 0.00 -2.10 0.00 0.00 70.33 67.68 1sb3 n THR 54 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sb3 n GLY 55 N -0.07 1.20 3.61 3.38 0.00 -1.26 -4.91 105.19 107.15 1sb3 n GLY 55 Ca 0.03 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 1sb3 n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sb3 s ILE 56 N -1.81 4.20 0.30 -0.61 1.01 -1.01 -4.56 121.20 118.72 1sb3 s ILE 56 Ca 0.31 1.28 -0.29 0.00 0.00 0.00 0.00 60.65 61.94 1sb3 s ILE 56 Cb 0.21 -4.43 -0.12 0.00 0.01 0.00 0.00 42.46 38.12 1sb3 s ILE 56 CO 0.30 -0.79 1.41 0.47 0.00 0.00 0.00 174.94 176.33 1sb3 n ASP 57 N 7.81 3.09 0.00 3.58 8.00 -1.15 -2.26 116.55 135.62 1sb3 n ASP 57 Ca 0.13 1.18 0.00 0.00 0.71 0.00 0.00 54.79 56.81 1sb3 n ASP 57 Cb 0.48 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.08 1sb3 n ASP 57 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sb3 n GLY 58 N 1.49 1.32 0.12 0.44 0.00 -1.26 -4.86 105.19 102.43 1sb3 n GLY 58 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1sb3 n GLY 58 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1sb3 n LEU 59 N 0.00 0.68 -0.98 0.99 7.94 -0.96 -2.94 117.00 121.74 1sb3 n LEU 59 Ca 0.00 0.63 0.09 0.00 -1.11 0.00 0.00 56.01 55.62 1sb3 n LEU 59 Cb 0.00 -0.49 0.22 0.00 0.53 0.00 0.00 43.42 43.67 1sb3 n LEU 59 CO 0.00 -0.42 0.68 0.00 -1.11 0.00 0.00 177.39 176.53 1sb3 n ALA 60 N -1.76 2.32 -1.90 1.96 0.00 -1.26 -1.05 120.51 118.81 1sb3 n ALA 60 Ca 0.03 -1.13 -0.41 0.00 0.00 0.00 0.00 53.44 51.93 1sb3 n ALA 60 Cb 0.29 -0.69 -0.03 0.00 0.00 0.00 0.00 19.45 19.03 1sb3 n ALA 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1sb3 s THR 61 N -1.09 3.06 -0.10 0.00 2.01 -1.15 -4.13 115.64 114.24 1sb3 s THR 61 Ca 0.35 0.94 0.02 0.00 0.31 0.00 0.00 61.69 63.31 1sb3 s THR 61 Cb 0.19 -3.60 -0.02 0.00 0.01 0.00 0.00 72.50 69.08 1sb3 s THR 61 CO 0.25 0.17 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.57 1sb3 s ILE 62 N -0.39 2.84 0.18 1.82 1.01 -1.26 -1.16 121.20 124.24 1sb3 s ILE 62 Ca 0.53 -0.76 -0.17 0.00 0.00 0.00 0.00 60.65 60.25 1sb3 s ILE 62 Cb -0.37 -2.15 0.03 0.00 0.01 0.00 0.00 42.46 39.98 1sb3 s ILE 62 CO 0.43 0.55 0.50 -0.94 0.00 0.00 0.00 174.94 175.48 1sb3 s SER 63 N 0.03 -0.27 -0.23 3.58 1.04 0.32 -5.00 113.70 113.17 1sb3 s SER 63 Ca -0.06 -0.43 -0.05 0.00 0.48 0.00 0.00 55.95 55.89 1sb3 s SER 63 Cb -0.15 0.56 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 1sb3 s SER 63 CO 0.05 -1.01 0.00 0.42 0.98 0.00 0.00 173.24 173.68 1sb3 s THR 64 N -3.86 3.75 1.21 2.02 -4.23 -1.26 0.53 115.64 113.80 1sb3 s THR 64 Ca 0.08 -0.36 -0.19 0.00 -1.18 0.00 0.00 61.69 60.03 1sb3 s THR 64 Cb -0.00 -2.73 0.29 0.00 1.34 0.00 0.00 72.50 71.40 1sb3 s THR 64 CO -0.05 0.39 1.10 -0.76 -0.54 0.00 0.00 174.62 174.76 1sb3 s LEU 65 N 1.50 0.63 0.11 4.79 1.02 0.12 -4.91 118.68 121.95 1sb3 s LEU 65 Ca 0.06 0.66 -0.28 0.00 0.02 0.00 0.00 54.13 54.58 1sb3 s LEU 65 Cb -0.15 -2.38 -0.09 0.00 0.02 0.00 0.00 46.19 43.59 1sb3 s LEU 65 CO -0.00 -4.17 1.63 0.00 0.02 0.00 0.00 176.35 173.83 1sb3 h ALA 66 N -2.61 -0.51 0.00 4.21 0.00 -2.00 -2.38 119.26 115.97 1sb3 h ALA 66 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1sb3 h ALA 66 Cb 1.30 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1sb3 h ALA 66 CO 0.34 -0.84 0.00 -0.40 0.00 0.00 0.00 179.25 178.36 1sb3 n ASP 67 N -5.40 0.35 0.00 0.00 3.85 -1.26 -4.81 116.55 109.28 1sb3 n ASP 67 Ca -0.07 -1.48 0.00 0.00 -0.71 0.00 0.00 54.79 52.52 1sb3 n ASP 67 Cb 0.31 -0.17 0.00 0.00 -1.35 0.00 0.00 41.12 39.90 1sb3 n ASP 67 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1sb3 n GLY 68 N 0.19 0.69 3.80 6.12 0.00 -0.90 -4.67 105.19 110.43 1sb3 n GLY 68 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1sb3 n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sb3 s SER 69 N -2.38 5.93 -0.16 1.61 0.01 -1.26 -4.15 113.70 113.30 1sb3 s SER 69 Ca 0.00 1.84 -0.09 0.00 1.31 0.00 0.00 55.95 59.01 1sb3 s SER 69 Cb 0.00 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.65 1sb3 s SER 69 CO 0.00 -1.07 0.14 -0.22 0.41 0.00 0.00 173.24 172.51 1sb3 s LEU 70 N -4.26 4.29 -0.15 2.44 2.96 0.35 0.14 118.68 124.45 1sb3 s LEU 70 Ca 0.64 0.35 0.02 0.00 -0.22 0.00 0.00 54.13 54.92 1sb3 s LEU 70 Cb -0.16 -2.10 0.01 0.00 0.50 0.00 0.00 46.19 44.44 1sb3 s LEU 70 CO 0.33 0.28 -0.20 -0.60 -1.32 0.00 0.00 176.35 174.84 1sb3 s ARG 71 N -0.24 3.06 -0.19 1.98 3.52 0.19 -0.26 118.95 127.00 1sb3 s ARG 71 Ca 0.11 -0.83 0.01 0.00 -0.13 0.00 0.00 55.73 54.90 1sb3 s ARG 71 Cb -0.12 -2.51 0.04 0.00 -1.56 0.00 0.00 34.95 30.80 1sb3 s ARG 71 CO 0.01 -0.05 -0.13 0.42 -0.81 0.00 0.00 175.30 174.74 1sb3 s ILE 72 N 0.92 1.73 0.63 4.11 1.01 0.10 -0.52 121.20 129.18 1sb3 s ILE 72 Ca -0.04 -0.95 -0.18 0.00 0.00 0.00 0.00 60.65 59.48 1sb3 s ILE 72 Cb -0.15 -1.72 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 1sb3 s ILE 72 CO -0.04 0.29 1.23 -0.83 0.00 0.00 0.00 174.94 175.59 1sb3 s GLY 73 N 1.38 2.71 0.53 6.18 0.00 -0.31 -0.41 107.32 117.40 1sb3 s GLY 73 Ca 0.01 1.04 0.35 0.00 0.00 0.00 0.00 44.72 46.13 1sb3 s GLY 73 CO -0.09 1.45 2.08 0.00 0.00 0.00 0.00 173.10 176.53 1sb3 h ALA 74 N 0.61 1.00 -0.01 3.20 0.00 -0.80 -2.38 119.26 120.89 1sb3 h ALA 74 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1sb3 h ALA 74 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1sb3 h ALA 74 CO 0.54 0.00 -0.15 0.41 0.00 0.00 0.00 179.25 180.04 1sb3 n GLY 75 N -0.81 -0.51 3.77 0.00 0.00 -0.22 -0.76 105.19 106.66 1sb3 n GLY 75 Ca -0.01 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 1sb3 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 s ALA 76 N -2.34 3.27 0.43 4.61 0.00 -0.90 -4.58 121.76 122.25 1sb3 s ALA 76 Ca 0.30 1.32 -0.12 0.00 0.00 0.00 0.00 51.96 53.46 1sb3 s ALA 76 Cb 0.20 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 1sb3 s ALA 76 CO 0.46 -0.95 0.82 0.95 0.00 0.00 0.00 175.76 177.04 1sb3 s THR 77 N -1.23 4.73 0.40 0.00 -4.23 -1.26 -1.11 115.64 112.94 1sb3 s THR 77 Ca 0.58 0.74 0.09 0.00 -1.18 0.00 0.00 61.69 61.91 1sb3 s THR 77 Cb -0.40 -3.74 0.21 0.00 1.34 0.00 0.00 72.50 69.91 1sb3 s THR 77 CO 0.52 -0.58 1.99 -0.07 -0.54 0.00 0.00 174.62 175.94 1sb3 h LEU 78 N 1.13 0.33 -0.26 4.79 3.38 -1.20 -1.41 115.31 122.07 1sb3 h LEU 78 Ca -0.47 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.42 1sb3 h LEU 78 Cb 1.19 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1sb3 h LEU 78 CO 0.63 0.35 -0.01 -0.08 0.09 0.00 0.00 178.44 179.43 1sb3 h GLU 79 N 0.36 0.47 -0.73 1.13 4.81 -1.60 0.10 114.58 119.12 1sb3 h GLU 79 Ca 0.09 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1sb3 h GLU 79 Cb 0.17 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 1sb3 h GLU 79 CO -0.00 0.64 0.47 0.00 -0.73 0.00 0.00 179.01 179.39 1sb3 h ALA 80 N 0.81 0.94 -0.33 2.92 0.00 -1.70 -1.52 119.26 120.39 1sb3 h ALA 80 Ca 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1sb3 h ALA 80 Cb 0.43 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1sb3 h ALA 80 CO 0.02 0.29 0.09 0.82 0.00 0.00 0.00 179.25 180.46 1sb3 h ILE 81 N 0.94 1.22 0.00 0.00 2.04 -1.09 -0.26 117.51 120.35 1sb3 h ILE 81 Ca 0.28 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1sb3 h ILE 81 Cb -0.04 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1sb3 h ILE 81 CO -0.09 0.25 0.00 0.00 0.00 0.00 0.00 178.15 178.31 1sb3 h ALA 82 N 0.92 1.00 0.00 1.87 0.00 -0.66 -3.09 119.26 119.30 1sb3 h ALA 82 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1sb3 h ALA 82 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1sb3 h ALA 82 CO 0.00 0.00 -0.63 0.39 0.00 0.00 0.00 179.25 179.01 1sb3 n GLU 83 N -2.64 2.85 -1.81 0.00 1.02 -0.60 -4.92 120.64 114.54 1sb3 n GLU 83 Ca 0.01 -0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.71 1sb3 n GLU 83 Cb 0.23 -1.08 -0.03 0.00 -0.02 0.00 0.00 31.44 30.54 1sb3 n GLU 83 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1sb3 s HIS 84 N -2.18 1.54 0.19 -0.32 2.46 -0.13 -4.90 115.29 111.95 1sb3 s HIS 84 Ca 0.04 0.19 -0.11 0.00 0.47 0.00 0.00 55.06 55.65 1sb3 s HIS 84 Cb 0.09 -4.05 0.22 0.00 -0.13 0.00 0.00 32.58 28.70 1sb3 s HIS 84 CO 0.50 -4.20 1.75 -0.44 -2.47 0.00 0.00 174.74 169.88 1sb3 h ASP 85 N 11.95 0.22 -0.72 9.88 3.32 -1.90 -0.91 116.42 138.25 1sb3 h ASP 85 Ca -0.41 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 56.67 1sb3 h ASP 85 Cb 1.21 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 1sb3 h ASP 85 CO 0.97 0.14 0.31 0.00 -1.72 0.00 0.00 179.24 178.94 1sb3 h ALA 86 N 1.37 0.93 -0.48 3.45 0.00 -1.98 -1.59 119.26 120.95 1sb3 h ALA 86 Ca 0.27 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1sb3 h ALA 86 Cb 0.30 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1sb3 h ALA 86 CO -0.26 0.53 0.03 0.82 0.00 0.00 0.00 179.25 180.37 1sb3 h ILE 87 N 1.02 1.26 -0.12 0.00 2.04 -1.78 -1.28 117.51 118.65 1sb3 h ILE 87 Ca 0.24 -1.01 -0.07 0.00 1.00 0.00 0.00 64.86 65.03 1sb3 h ILE 87 Cb 0.18 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1sb3 h ILE 87 CO -0.02 0.35 -0.23 0.03 0.00 0.00 0.00 178.15 178.28 1sb3 h ARG 88 N 0.69 0.21 0.14 2.37 3.08 -0.86 0.24 114.38 120.24 1sb3 h ARG 88 Ca 0.14 -0.06 -0.33 0.00 0.07 0.00 0.00 59.98 59.80 1sb3 h ARG 88 Cb 0.46 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 1sb3 h ARG 88 CO 0.02 0.43 -1.69 1.79 -1.07 0.00 0.00 179.97 179.45 1sb3 h THR 89 N 0.19 0.98 0.05 2.04 1.35 -1.21 -3.33 112.91 112.98 1sb3 h THR 89 Ca 0.03 -2.61 -0.38 0.00 -0.55 0.00 0.00 66.41 62.90 1sb3 h THR 89 Cb 0.52 2.71 -0.05 0.00 -1.73 0.00 0.00 68.15 69.60 1sb3 h THR 89 CO 0.04 0.83 -2.29 0.41 -0.25 0.00 0.00 175.52 174.25 1sb3 n THR 90 N -3.49 1.61 -2.70 6.82 -1.04 -0.49 -4.63 114.28 110.36 1sb3 n THR 90 Ca -0.22 -0.61 -0.25 0.00 -2.04 0.00 0.00 64.05 60.94 1sb3 n THR 90 Cb 1.06 -1.54 -0.01 0.00 -1.82 0.00 0.00 70.33 68.01 1sb3 n THR 90 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1sb3 n TRP 91 N -3.35 3.23 -0.32 -1.42 8.01 0.80 -4.87 117.44 119.52 1sb3 n TRP 91 Ca -0.40 -3.43 0.28 0.00 -1.31 0.00 0.00 57.50 52.64 1sb3 n TRP 91 Cb 1.01 -0.27 0.62 0.00 -2.01 0.00 0.00 31.31 30.66 1sb3 n TRP 91 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1sb3 h PRO 92 N 2.78 0.20 -0.51 -0.99 0.13 -1.55 -0.60 132.00 131.46 1sb3 h PRO 92 Ca 0.19 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1sb3 h PRO 92 Cb 0.80 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 31.86 1sb3 h PRO 92 CO 0.79 0.13 0.31 0.00 -0.23 0.00 0.00 178.00 179.00 1sb3 h ALA 93 N 1.54 1.59 -0.34 -0.56 0.00 -1.88 0.19 119.26 119.79 1sb3 h ALA 93 Ca 0.58 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.35 1sb3 h ALA 93 Cb 1.84 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 1sb3 h ALA 93 CO -0.17 0.36 -0.11 1.25 0.00 0.00 0.00 179.25 180.58 1sb3 h LEU 94 N 0.69 0.69 -0.84 0.00 5.85 -1.43 -0.19 115.31 120.08 1sb3 h LEU 94 Ca 0.18 -0.38 -0.10 0.00 0.84 0.00 0.00 57.88 58.42 1sb3 h LEU 94 Cb -0.04 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1sb3 h LEU 94 CO -0.04 0.91 -0.23 0.00 -0.34 0.00 0.00 178.44 178.75 1sb3 h ALA 95 N 0.80 1.01 -0.01 1.25 0.00 -1.34 -1.64 119.26 119.34 1sb3 h ALA 95 Ca 0.08 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1sb3 h ALA 95 Cb 0.62 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1sb3 h ALA 95 CO 0.04 0.59 0.00 1.96 0.00 0.00 0.00 179.25 181.84 1sb3 h GLN 96 N 0.54 0.02 -0.47 0.00 4.20 -0.45 -2.08 115.11 116.87 1sb3 h GLN 96 Ca 0.08 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 1sb3 h GLN 96 Cb 0.68 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 1sb3 h GLN 96 CO 0.05 0.22 0.21 0.00 -0.67 0.00 0.00 178.83 178.64 1sb3 h ALA 97 N 0.80 0.61 -0.69 3.87 0.00 -0.88 -2.30 119.26 120.66 1sb3 h ALA 97 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1sb3 h ALA 97 Cb 0.21 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1sb3 h ALA 97 CO -0.00 0.19 0.44 0.00 0.00 0.00 0.00 179.25 179.88 1sb3 h ALA 98 N 1.05 0.87 0.00 0.00 0.00 -1.28 -2.34 119.26 117.57 1sb3 h ALA 98 Ca 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1sb3 h ALA 98 Cb 0.15 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1sb3 h ALA 98 CO -0.02 0.31 -0.22 1.49 0.00 0.00 0.00 179.25 180.82 1sb3 h GLU 99 N 0.93 0.00 0.00 0.00 4.81 -1.20 -2.75 114.58 116.38 1sb3 h GLU 99 Ca 0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1sb3 h GLU 99 Cb -0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.30 1sb3 h GLU 99 CO -0.05 0.22 0.00 -1.13 -0.73 0.00 0.00 179.01 177.32 1sb3 n SER 100 N -3.64 0.00 -4.71 1.04 3.41 -0.88 -4.86 113.62 103.99 1sb3 n SER 100 Ca -0.01 0.42 -0.42 0.00 -0.26 0.00 0.00 58.87 58.60 1sb3 n SER 100 Cb 0.35 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 63.80 1sb3 n SER 100 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1sb3 s VAL 101 N -2.94 4.28 0.00 -3.33 1.01 -1.04 -4.84 120.40 113.54 1sb3 s VAL 101 Ca 0.15 1.63 0.00 0.00 0.00 0.00 0.00 61.98 63.76 1sb3 s VAL 101 Cb 0.18 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.52 1sb3 s VAL 101 CO 0.50 0.09 0.00 0.00 0.00 0.00 0.00 175.10 175.69 1sb3 n ALA 102 N 4.26 0.00 -2.48 5.51 0.00 -1.25 -4.69 120.51 121.86 1sb3 n ALA 102 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.28 1sb3 n ALA 102 Cb 0.47 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.84 1sb3 n ALA 102 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1sb3 s GLY 103 N -0.00 2.31 0.34 0.00 0.00 -1.26 -0.92 107.32 107.79 1sb3 s GLY 103 Ca 0.00 -2.11 0.02 0.00 0.00 0.00 0.00 44.72 42.62 1sb3 s GLY 103 CO 0.00 -1.94 2.00 -0.56 0.00 0.00 0.00 173.10 172.60 1sb3 h PRO 104 N 1.54 0.88 -0.39 2.90 0.13 -1.94 -1.46 132.00 133.66 1sb3 h PRO 104 Ca -0.43 -0.05 -0.13 0.00 -0.87 0.00 0.00 66.00 64.51 1sb3 h PRO 104 Cb 1.25 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 1sb3 h PRO 104 CO 0.71 0.58 -0.28 1.15 -0.23 0.00 0.00 178.00 179.94 1sb3 h THR 105 N 0.91 1.28 -0.53 1.56 2.02 -1.96 -1.02 112.91 115.18 1sb3 h THR 105 Ca 0.26 -1.44 -0.01 0.00 0.77 0.00 0.00 66.41 65.99 1sb3 h THR 105 Cb -0.07 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 1sb3 h THR 105 CO -0.06 0.48 0.29 0.45 0.37 0.00 0.00 175.52 177.05 1sb3 h HIS 106 N 0.69 0.72 0.00 3.16 3.86 -1.81 -2.63 115.15 119.14 1sb3 h HIS 106 Ca 0.08 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.26 1sb3 h HIS 106 Cb 0.86 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 29.09 1sb3 h HIS 106 CO 0.06 0.53 -0.07 0.00 0.86 0.00 0.00 177.93 179.30 1sb3 h ARG 107 N 0.70 0.00 0.00 2.45 3.08 -0.94 0.33 114.38 120.01 1sb3 h ARG 107 Ca 0.19 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 1sb3 h ARG 107 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1sb3 h ARG 107 CO -0.03 0.07 -0.05 0.00 -1.07 0.00 0.00 179.97 178.89 1sb3 h ALA 108 N 1.93 1.13 0.00 0.04 0.00 -0.80 -1.85 119.26 119.71 1sb3 h ALA 108 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1sb3 h ALA 108 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1sb3 h ALA 108 CO 0.01 0.06 -0.70 0.00 0.00 0.00 0.00 179.25 178.62 1sb3 n ALA 109 N -2.17 1.67 -1.60 0.00 0.00 -0.92 -4.86 120.51 112.61 1sb3 n ALA 109 Ca -0.02 0.00 -0.49 0.00 0.00 0.00 0.00 53.44 52.93 1sb3 n ALA 109 Cb 0.20 0.15 -0.04 0.00 0.00 0.00 0.00 19.45 19.76 1sb3 n ALA 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb3 n ALA 110 N -1.49 -0.37 -2.34 0.00 0.00 0.11 -4.45 120.51 111.97 1sb3 n ALA 110 Ca 0.00 0.47 -0.21 0.00 0.00 0.00 0.00 53.44 53.70 1sb3 n ALA 110 Cb 0.31 -2.11 0.01 0.00 0.00 0.00 0.00 19.45 17.66 1sb3 n ALA 110 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1sb3 s THR 111 N 0.16 3.87 0.07 0.00 -4.23 -1.26 -1.29 115.64 112.96 1sb3 s THR 111 Ca 0.77 -0.74 -0.19 0.00 -1.18 0.00 0.00 61.69 60.35 1sb3 s THR 111 Cb -0.84 -3.39 -0.10 0.00 1.34 0.00 0.00 72.50 69.51 1sb3 s THR 111 CO 0.49 -0.21 1.44 0.25 -0.54 0.00 0.00 174.62 176.04 1sb3 h LEU 112 N 0.59 0.47 -0.96 4.79 5.85 -0.97 -1.06 115.31 124.02 1sb3 h LEU 112 Ca -0.45 -0.40 -0.03 0.00 0.84 0.00 0.00 57.88 57.84 1sb3 h LEU 112 Cb 1.26 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 1sb3 h LEU 112 CO 0.54 0.76 0.36 1.23 -0.34 0.00 0.00 178.44 181.00 1sb3 h GLY 113 N 0.17 1.19 1.39 3.75 0.00 -1.23 -1.80 103.07 106.54 1sb3 h GLY 113 Ca 0.05 -0.59 -0.14 0.00 0.00 0.00 0.00 47.33 46.66 1sb3 h GLY 113 CO 0.03 0.56 -0.39 -1.33 0.00 0.00 0.00 176.54 175.41 1sb3 h GLY 114 N 1.13 0.73 0.94 4.60 0.00 -1.76 -1.58 103.07 107.15 1sb3 h GLY 114 Ca 0.26 -0.73 -0.03 0.00 0.00 0.00 0.00 47.33 46.83 1sb3 h GLY 114 CO -0.03 0.66 0.13 -0.57 0.00 0.00 0.00 176.54 176.73 1sb3 h ASN 115 N 0.55 0.62 -0.38 0.19 -0.73 -0.71 -1.21 115.58 113.92 1sb3 h ASN 115 Ca 0.05 -0.21 -0.13 0.00 1.87 0.00 0.00 56.30 57.88 1sb3 h ASN 115 Cb 0.92 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 39.34 1sb3 h ASN 115 CO 0.08 0.66 -0.28 -0.07 -0.37 0.00 0.00 177.43 177.46 1sb3 h LEU 116 N 0.54 0.89 -1.30 0.34 3.38 -1.29 -3.07 115.31 114.81 1sb3 h LEU 116 Ca 0.14 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1sb3 h LEU 116 Cb 0.27 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1sb3 h LEU 116 CO -0.00 1.14 0.00 0.00 0.09 0.00 0.00 178.44 179.67 1sb3 n GLN 118 N 0.34 -0.12 -1.92 0.00 10.64 -0.46 -4.96 117.38 120.90 1sb3 n GLN 118 Ca 0.10 0.03 -0.31 0.00 -1.83 0.00 0.00 57.00 54.99 1sb3 n GLN 118 Cb 0.33 -2.25 0.01 0.00 -0.86 0.00 0.00 30.24 27.48 1sb3 n GLN 118 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1sb3 s ASP 119 N -2.21 6.09 0.68 2.61 3.68 -1.26 -5.02 116.67 121.23 1sb3 s ASP 119 Ca 0.67 1.52 -0.11 0.00 2.13 0.00 0.00 52.55 56.76 1sb3 s ASP 119 Cb -0.26 -2.49 -0.00 0.00 -1.45 0.00 0.00 42.92 38.72 1sb3 s ASP 119 CO 0.57 -0.96 1.06 0.42 0.13 0.00 0.00 175.17 176.38 1sb3 s THR 120 N -2.99 4.04 0.11 1.71 -4.23 -1.26 -4.74 115.64 108.28 1sb3 s THR 120 Ca 0.57 0.70 0.08 0.00 -1.18 0.00 0.00 61.69 61.87 1sb3 s THR 120 Cb -0.12 -3.42 -0.04 0.00 1.34 0.00 0.00 72.50 70.26 1sb3 s THR 120 CO 0.48 -0.83 -0.21 -0.13 -0.54 0.00 0.00 174.62 173.40 1sb3 s ARG 121 N -4.92 1.15 -0.16 3.99 0.52 0.68 -4.88 118.95 115.34 1sb3 s ARG 121 Ca 0.59 -1.20 -0.29 0.00 -0.52 0.00 0.00 55.73 54.31 1sb3 s ARG 121 Cb -0.14 -1.39 0.09 0.00 0.52 0.00 0.00 34.95 34.03 1sb3 s ARG 121 CO 0.52 0.32 0.80 0.00 0.02 0.00 0.00 175.30 176.96 1sb3 n THR 123 N 1.48 1.11 1.04 0.00 -2.24 0.48 -1.31 114.28 114.84 1sb3 n THR 123 Ca -0.15 0.28 0.11 0.00 -2.27 0.00 0.00 64.05 62.02 1sb3 n THR 123 Cb 0.57 -1.06 0.06 0.00 -2.10 0.00 0.00 70.33 67.79 1sb3 n THR 123 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1sb3 n PHE 124 N -1.52 0.00 -0.09 4.78 3.01 -1.26 -4.53 117.46 117.84 1sb3 n PHE 124 Ca 0.03 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.29 1sb3 n PHE 124 Cb 0.15 -0.06 -0.07 0.00 -0.01 0.00 0.00 39.48 39.49 1sb3 n PHE 124 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1sb3 n TYR 125 N -0.92 0.00 -2.01 1.38 9.36 -0.43 -4.71 117.16 119.84 1sb3 n TYR 125 Ca 0.07 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.87 1sb3 n TYR 125 Cb 0.38 -0.67 0.00 0.00 -0.63 0.00 0.00 39.34 38.41 1sb3 n TYR 125 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1sb3 n ASN 126 N -3.83 4.25 -3.99 2.98 3.02 -0.42 -4.80 115.26 112.47 1sb3 n ASN 126 Ca -0.37 -2.88 -0.10 0.00 -0.03 0.00 0.00 54.58 51.20 1sb3 n ASN 126 Cb 0.76 -1.66 -0.07 0.00 -0.61 0.00 0.00 39.78 38.20 1sb3 n ASN 126 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1sb3 s GLN 127 N 3.17 1.15 0.91 3.52 -1.52 -1.26 -4.92 119.66 120.70 1sb3 s GLN 127 Ca 0.48 -1.22 -0.12 0.00 -1.95 0.00 0.00 55.36 52.55 1sb3 s GLN 127 Cb 0.11 0.37 0.14 0.00 -0.22 0.00 0.00 33.01 33.40 1sb3 s GLN 127 CO -0.04 -0.42 1.09 -1.54 -0.25 0.00 0.00 175.29 174.14 1sb3 s SER 128 N -2.98 3.39 0.19 5.90 1.04 -1.26 -4.78 113.70 115.20 1sb3 s SER 128 Ca 0.19 1.39 -0.12 0.00 0.48 0.00 0.00 55.95 57.89 1sb3 s SER 128 Cb 0.04 -2.07 0.13 0.00 0.10 0.00 0.00 66.02 64.21 1sb3 s SER 128 CO 0.01 -2.68 1.84 -0.08 0.98 0.00 0.00 173.24 173.32 1sb3 h GLU 129 N -1.58 0.76 -0.23 4.02 4.57 -1.81 0.69 114.58 121.00 1sb3 h GLU 129 Ca -0.50 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.63 1sb3 h GLU 129 Cb 1.29 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 1sb3 h GLU 129 CO 0.56 0.50 0.15 2.35 -1.18 0.00 0.00 179.01 181.40 1sb3 h TRP 130 N 0.79 0.29 -0.20 0.92 7.01 -1.92 0.10 115.95 122.93 1sb3 h TRP 130 Ca 0.24 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.24 1sb3 h TRP 130 Cb -0.03 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 26.92 1sb3 h TRP 130 CO -0.04 0.18 0.10 2.35 -2.79 0.00 0.00 178.44 178.24 1sb3 h TRP 131 N 0.32 0.29 -0.11 2.65 7.01 -1.79 -1.80 115.95 122.51 1sb3 h TRP 131 Ca 0.09 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.01 1sb3 h TRP 131 Cb -0.03 -0.09 -0.00 0.00 -2.10 0.00 0.00 29.16 26.94 1sb3 h TRP 131 CO -0.06 0.29 -0.18 0.00 -2.79 0.00 0.00 178.44 175.69 1sb3 h ARG 132 N 0.20 0.31 -0.36 2.65 3.08 -0.75 -2.33 114.38 117.19 1sb3 h ARG 132 Ca 0.07 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 1sb3 h ARG 132 Cb 0.10 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1sb3 h ARG 132 CO -0.01 0.77 0.05 0.66 -1.07 0.00 0.00 179.97 180.37 1sb3 h SER 133 N -0.11 0.49 0.27 7.04 4.64 -0.86 0.24 113.55 125.26 1sb3 h SER 133 Ca 0.01 -0.08 -0.04 0.00 -0.47 0.00 0.00 61.79 61.21 1sb3 h SER 133 Cb 0.75 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 1sb3 h SER 133 CO 0.04 0.53 -0.19 1.23 -0.87 0.00 0.00 176.83 177.57 1sb3 h GLY 134 N 0.79 0.00 -2.49 -0.77 0.00 -1.23 -2.42 103.07 96.96 1sb3 h GLY 134 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1sb3 h GLY 134 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 174.53 1sb3 n ASN 135 N -4.07 3.64 0.00 0.19 4.05 -0.01 -4.93 115.26 114.13 1sb3 n ASN 135 Ca -0.02 -2.00 0.00 0.00 0.45 0.00 0.00 54.58 53.01 1sb3 n ASN 135 Cb 0.27 -0.43 0.00 0.00 1.23 0.00 0.00 39.78 40.85 1sb3 n ASN 135 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1sb3 n GLY 136 N 1.58 0.38 7.00 8.20 0.00 -0.69 -4.87 105.19 116.80 1sb3 n GLY 136 Ca 0.23 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1sb3 n GLY 136 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1sb3 n TYR 137 N -3.00 -0.37 -3.81 1.61 4.02 0.63 -4.50 117.16 111.75 1sb3 n TYR 137 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.84 1sb3 n TYR 137 Cb 0.00 0.11 -0.00 0.00 -0.02 0.00 0.00 39.34 39.43 1sb3 n TYR 137 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1sb3 h LEU 139 N 2.00 0.13 -1.67 0.00 5.85 -1.12 0.20 115.31 120.70 1sb3 h LEU 139 Ca -0.25 0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.66 1sb3 h LEU 139 Cb 1.24 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.40 1sb3 h LEU 139 CO 0.30 0.01 0.30 0.50 -0.34 0.00 0.00 178.44 179.20 1sb3 h LYS 140 N 0.33 0.40 -2.04 1.25 3.64 -1.86 -3.43 116.57 114.86 1sb3 h LYS 140 Ca 0.43 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.85 1sb3 h LYS 140 Cb 0.73 -0.09 -0.21 0.00 -0.41 0.00 0.00 32.23 32.25 1sb3 h LYS 140 CO -0.48 0.27 -0.14 -0.47 -2.27 0.00 0.00 179.45 176.35 1sb3 s TYR 141 N -5.39 -1.29 0.00 1.91 5.04 -0.61 -4.98 117.35 112.03 1sb3 s TYR 141 Ca -0.08 2.26 0.00 0.00 -2.44 0.00 0.00 57.07 56.82 1sb3 s TYR 141 Cb 0.18 0.76 0.00 0.00 0.35 0.00 0.00 41.96 43.25 1sb3 s TYR 141 CO 0.73 -0.65 0.00 1.63 -1.34 0.00 0.00 175.55 175.93 1sb3 n LYS 142 N 5.36 -1.65 -1.77 4.97 5.02 -1.24 -3.00 118.16 125.85 1sb3 n LYS 142 Ca -0.12 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 1sb3 n LYS 142 Cb 0.50 -4.72 0.00 0.00 -0.02 0.00 0.00 35.03 30.79 1sb3 n LYS 142 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sb3 n GLY 143 N 0.35 4.30 0.00 0.72 0.00 -0.04 -4.66 105.19 105.86 1sb3 n GLY 143 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1sb3 n GLY 143 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1sb3 n ASP 144 N -2.13 0.37 -4.25 1.61 5.68 -1.26 -3.97 116.55 112.59 1sb3 n ASP 144 Ca 0.00 -1.15 -0.27 0.00 -0.50 0.00 0.00 54.79 52.87 1sb3 n ASP 144 Cb 0.00 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 39.83 1sb3 n ASP 144 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1sb3 s LYS 145 N -0.15 1.60 -0.13 0.11 2.20 -1.26 -4.62 119.74 117.49 1sb3 s LYS 145 Ca 0.00 -0.87 -0.14 0.00 -0.36 0.00 0.00 55.97 54.60 1sb3 s LYS 145 Cb 0.00 -1.64 -0.05 0.00 -1.51 0.00 0.00 37.83 34.63 1sb3 s LYS 145 CO 0.00 0.44 0.31 0.00 -0.36 0.00 0.00 175.35 175.74 1sb3 n HIS 147 N 3.23 0.00 -0.08 0.00 -0.00 -1.26 -3.59 115.22 113.52 1sb3 n HIS 147 Ca -0.12 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.37 1sb3 n HIS 147 Cb 0.52 -0.16 -0.12 0.00 -0.00 0.00 0.00 29.99 30.23 1sb3 n HIS 147 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1sb3 n VAL 148 N -1.17 1.59 -3.93 1.59 0.31 -1.26 -4.69 118.33 110.76 1sb3 n VAL 148 Ca 0.07 -0.22 -0.30 0.00 -0.01 0.00 0.00 64.34 63.88 1sb3 n VAL 148 Cb 0.35 -1.94 -0.14 0.00 -0.91 0.00 0.00 33.84 31.19 1sb3 n VAL 148 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1sb3 s ILE 149 N -2.43 2.22 0.63 2.52 -1.09 -1.26 -4.98 121.20 116.81 1sb3 s ILE 149 Ca -0.28 -2.74 0.31 0.00 -2.23 0.00 0.00 60.65 55.70 1sb3 s ILE 149 Cb 0.07 -2.59 0.35 0.00 -1.58 0.00 0.00 42.46 38.71 1sb3 s ILE 149 CO 0.63 -0.73 2.00 -0.37 -1.23 0.00 0.00 174.94 175.24 1sb3 h VAL 150 N 5.95 0.22 -0.87 2.92 -1.51 -1.84 -1.10 116.25 120.02 1sb3 h VAL 150 Ca -0.06 0.00 0.19 0.00 -1.23 0.00 0.00 66.70 65.60 1sb3 h VAL 150 Cb 0.95 0.73 -0.06 0.00 -2.13 0.00 0.00 31.29 30.78 1sb3 h VAL 150 CO 0.59 0.00 0.58 0.50 -1.23 0.00 0.00 177.57 178.00 1sb3 h LYS 151 N 0.00 0.41 -4.62 5.19 3.64 -1.95 -3.43 116.57 115.81 1sb3 h LYS 151 Ca 0.08 -0.02 -0.41 0.00 -1.27 0.00 0.00 60.65 59.03 1sb3 h LYS 151 Cb 0.69 -0.09 0.05 0.00 -0.41 0.00 0.00 32.23 32.47 1sb3 h LYS 151 CO -0.00 0.27 -0.61 0.43 -2.27 0.00 0.00 179.45 177.27 1sb3 n SER 152 N -4.50 -5.98 0.17 4.20 7.64 -0.42 -4.85 113.62 109.88 1sb3 n SER 152 Ca 0.18 -0.31 0.04 0.00 1.01 0.00 0.00 58.87 59.79 1sb3 n SER 152 Cb 0.65 -4.83 0.25 0.00 -1.01 0.00 0.00 64.21 59.28 1sb3 n SER 152 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1sb3 h ASP 153 N -1.42 0.00 -5.17 6.43 2.03 -1.88 -3.47 116.42 112.94 1sb3 h ASP 153 Ca -0.53 0.00 0.10 0.00 -0.73 0.00 0.00 57.03 55.87 1sb3 h ASP 153 Cb 1.36 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.82 1sb3 h ASP 153 CO 0.57 0.45 0.38 0.00 -1.03 0.00 0.00 179.24 179.60 1sb3 s ARG 154 N -3.47 1.62 0.08 4.15 1.70 -1.26 -5.14 118.95 116.62 1sb3 s ARG 154 Ca 0.01 -0.96 -0.26 0.00 -0.47 0.00 0.00 55.73 54.05 1sb3 s ARG 154 Cb 0.11 0.51 -0.06 0.00 -0.57 0.00 0.00 34.95 34.94 1sb3 s ARG 154 CO 0.71 -0.75 0.79 0.00 -1.08 0.00 0.00 175.30 174.97 1sb3 n TYR 156 N 2.54 1.01 -1.63 0.00 4.02 -1.26 -0.42 117.16 121.41 1sb3 n TYR 156 Ca -0.03 -0.83 -0.42 0.00 -0.01 0.00 0.00 57.90 56.61 1sb3 n TYR 156 Cb 0.50 -0.31 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 1sb3 n TYR 156 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1sb3 n ALA 157 N -0.31 0.42 -2.26 -0.72 0.00 -1.26 -4.65 120.51 111.73 1sb3 n ALA 157 Ca 0.21 0.28 -0.38 0.00 0.00 0.00 0.00 53.44 53.56 1sb3 n ALA 157 Cb 0.88 -2.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.15 1sb3 n ALA 157 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1sb3 s THR 158 N -1.20 4.72 -0.27 0.00 2.01 -0.57 -3.91 115.64 116.42 1sb3 s THR 158 Ca 0.61 1.16 -0.18 0.00 0.31 0.00 0.00 61.69 63.59 1sb3 s THR 158 Cb -0.58 -3.87 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 1sb3 s THR 158 CO 0.58 0.44 0.51 -0.47 -0.69 0.00 0.00 174.62 174.99 1sb3 s TYR 159 N -1.25 3.26 -0.21 4.92 5.04 0.11 -0.23 117.35 128.99 1sb3 s TYR 159 Ca 0.33 0.59 0.15 0.00 -2.44 0.00 0.00 57.07 55.70 1sb3 s TYR 159 Cb -0.18 -2.74 0.50 0.00 0.35 0.00 0.00 41.96 39.89 1sb3 s TYR 159 CO 0.20 -0.31 1.41 0.72 -1.34 0.00 0.00 175.55 176.23 1sb3 n HIS 160 N 5.56 0.91 -2.15 4.97 8.25 -1.26 -1.08 115.22 130.41 1sb3 n HIS 160 Ca -0.04 -1.09 -0.42 0.00 -0.26 0.00 0.00 57.72 55.91 1sb3 n HIS 160 Cb 0.50 -0.35 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 1sb3 n HIS 160 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1sb3 s GLY 161 N -2.19 2.23 0.05 -1.41 0.00 -1.26 -4.23 107.32 100.51 1sb3 s GLY 161 Ca 0.42 1.16 0.02 0.00 0.00 0.00 0.00 44.72 46.33 1sb3 s GLY 161 CO 0.06 2.22 1.03 -0.55 0.00 0.00 0.00 173.10 175.86 1sb3 h ASP 162 N 5.85 0.21 0.04 1.64 3.32 -1.90 -3.39 116.42 122.19 1sb3 h ASP 162 Ca -0.44 -0.26 -0.24 0.00 0.02 0.00 0.00 57.03 56.11 1sb3 h ASP 162 Cb 1.21 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 40.71 1sb3 h ASP 162 CO 0.81 1.22 -0.90 0.58 -1.72 0.00 0.00 179.24 179.22 1sb3 h VAL 163 N 0.04 1.31 -0.54 -1.35 2.07 -1.91 -3.36 116.25 112.51 1sb3 h VAL 163 Ca -0.15 -2.18 0.08 0.00 0.82 0.00 0.00 66.70 65.27 1sb3 h VAL 163 Cb 1.92 2.22 -0.10 0.00 -1.52 0.00 0.00 31.29 33.81 1sb3 h VAL 163 CO 0.15 0.67 -0.46 0.00 0.02 0.00 0.00 177.57 177.95 1sb3 h ALA 164 N 0.57 -0.44 -0.73 1.67 0.00 -1.92 -0.95 119.26 117.47 1sb3 h ALA 164 Ca -0.08 0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1sb3 h ALA 164 Cb 1.54 1.00 -0.05 0.00 0.00 0.00 0.00 17.79 20.28 1sb3 h ALA 164 CO 0.17 -0.88 0.49 -1.00 0.00 0.00 0.00 179.25 178.03 1sb3 h PRO 165 N -0.27 0.52 -0.25 0.00 0.13 -1.80 0.24 132.00 130.59 1sb3 h PRO 165 Ca 0.15 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.16 1sb3 h PRO 165 Cb 0.57 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.57 1sb3 h PRO 165 CO -0.67 0.35 -0.18 0.00 -0.23 0.00 0.00 178.00 177.27 1sb3 h ALA 166 N 1.64 0.35 -0.12 -0.56 0.00 -1.37 -2.38 119.26 116.83 1sb3 h ALA 166 Ca 0.35 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1sb3 h ALA 166 Cb 0.62 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1sb3 h ALA 166 CO -0.12 0.28 -0.19 -0.07 0.00 0.00 0.00 179.25 179.15 1sb3 h LEU 167 N 0.27 0.18 -0.30 0.00 3.38 -0.56 -2.47 115.31 115.82 1sb3 h LEU 167 Ca 0.05 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1sb3 h LEU 167 Cb 0.72 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1sb3 h LEU 167 CO 0.05 0.38 -0.00 0.24 0.09 0.00 0.00 178.44 179.20 1sb3 h MET 168 N 0.18 0.52 0.00 1.13 2.86 -0.71 -1.59 114.93 117.33 1sb3 h MET 168 Ca 0.03 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1sb3 h MET 168 Cb 0.44 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.05 1sb3 h MET 168 CO 0.03 0.68 0.00 -0.39 1.06 0.00 0.00 176.91 178.28 1sb3 h VAL 169 N 0.31 0.00 -0.10 -2.22 -1.51 -1.30 -2.23 116.25 109.21 1sb3 h VAL 169 Ca 0.08 -0.47 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 1sb3 h VAL 169 Cb 0.44 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1sb3 h VAL 169 CO 0.02 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.54 1sb3 n LEU 170 N -2.53 1.33 -3.53 4.19 4.77 -0.94 -4.70 117.00 115.59 1sb3 n LEU 170 Ca 0.03 -0.53 -0.23 0.00 -0.03 0.00 0.00 56.01 55.26 1sb3 n LEU 170 Cb 0.35 -0.06 0.08 0.00 -2.33 0.00 0.00 43.42 41.46 1sb3 n LEU 170 CO 0.26 0.26 0.23 -0.67 -1.33 0.00 0.00 177.39 176.15 1sb3 n ASP 171 N 0.08 -5.83 -4.82 -1.43 2.03 -0.84 -4.41 116.55 101.32 1sb3 n ASP 171 Ca 0.17 -0.54 -0.31 0.00 0.52 0.00 0.00 54.79 54.63 1sb3 n ASP 171 Cb 0.29 -4.98 0.04 0.00 -0.72 0.00 0.00 41.12 35.75 1sb3 n ASP 171 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1sb3 s ALA 172 N -3.32 2.73 0.02 -1.67 0.00 -0.63 -4.51 121.76 114.38 1sb3 s ALA 172 Ca 0.51 0.11 0.08 0.00 0.00 0.00 0.00 51.96 52.67 1sb3 s ALA 172 Cb -0.23 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.69 1sb3 s ALA 172 CO 0.72 -1.12 -0.25 1.03 0.00 0.00 0.00 175.76 176.15 1sb3 s ARG 173 N -4.92 1.95 -0.21 0.00 0.52 0.45 -0.76 118.95 115.98 1sb3 s ARG 173 Ca 0.58 -1.03 -0.06 0.00 -0.52 0.00 0.00 55.73 54.70 1sb3 s ARG 173 Cb -0.14 -2.04 -0.03 0.00 0.52 0.00 0.00 34.95 33.26 1sb3 s ARG 173 CO 0.52 0.53 0.04 0.00 0.02 0.00 0.00 175.30 176.42 1sb3 s ALA 174 N -0.77 3.18 -0.30 2.13 0.00 0.47 -1.11 121.76 125.35 1sb3 s ALA 174 Ca 0.12 -0.95 -0.13 0.00 0.00 0.00 0.00 51.96 50.99 1sb3 s ALA 174 Cb -0.10 -1.90 -0.03 0.00 0.00 0.00 0.00 23.12 21.09 1sb3 s ALA 174 CO 0.02 -0.14 0.28 -2.00 0.00 0.00 0.00 175.76 173.92 1sb3 s GLU 175 N 0.98 3.78 -0.07 0.00 2.12 0.42 -2.04 118.70 123.89 1sb3 s GLU 175 Ca 0.03 -0.33 0.00 0.00 0.36 0.00 0.00 54.97 55.03 1sb3 s GLU 175 Cb -0.14 -3.72 -0.03 0.00 0.26 0.00 0.00 34.13 30.49 1sb3 s GLU 175 CO 0.02 -0.34 -0.05 0.42 -0.54 0.00 0.00 175.26 174.78 1sb3 s ILE 176 N 1.89 3.89 -0.05 -3.70 1.01 0.29 -0.13 121.20 124.40 1sb3 s ILE 176 Ca 0.10 -0.41 0.04 0.00 0.00 0.00 0.00 60.65 60.38 1sb3 s ILE 176 Cb -0.16 -2.60 -0.00 0.00 0.01 0.00 0.00 42.46 39.70 1sb3 s ILE 176 CO 0.11 0.60 -0.17 -0.69 0.00 0.00 0.00 174.94 174.79 1sb3 s VAL 177 N -0.83 1.44 0.02 2.92 1.01 -0.67 -0.92 120.40 123.37 1sb3 s VAL 177 Ca 0.13 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.39 1sb3 s VAL 177 Cb -0.11 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.03 1sb3 s VAL 177 CO 0.02 0.41 0.03 0.61 0.00 0.00 0.00 175.10 176.18 1sb3 n GLY 178 N 3.19 2.68 0.23 4.51 0.00 -0.33 -1.10 105.19 114.37 1sb3 n GLY 178 Ca -0.18 -1.26 0.06 0.00 0.00 0.00 0.00 46.02 44.64 1sb3 n GLY 178 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sb3 h PRO 179 N 0.00 0.00 0.00 1.61 0.13 -1.83 -1.69 132.00 130.22 1sb3 h PRO 179 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1sb3 h PRO 179 Cb 0.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.20 1sb3 h PRO 179 CO 0.02 0.18 0.00 0.00 -0.23 0.00 0.00 178.00 177.98 1sb3 h ALA 180 N 1.82 1.00 0.00 -0.56 0.00 -1.95 -3.50 119.26 116.07 1sb3 h ALA 180 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1sb3 h ALA 180 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1sb3 h ALA 180 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1sb3 n GLY 181 N 1.05 0.69 3.87 0.00 0.00 -0.64 -5.07 105.19 105.10 1sb3 n GLY 181 Ca 0.04 -2.15 -0.36 0.00 0.00 0.00 0.00 46.02 43.56 1sb3 n GLY 181 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1sb3 s LYS 182 N -0.68 3.71 0.00 1.61 2.20 -1.26 -1.19 119.74 124.13 1sb3 s LYS 182 Ca 0.00 0.12 -0.18 0.00 -0.36 0.00 0.00 55.97 55.55 1sb3 s LYS 182 Cb 0.00 -3.10 0.03 0.00 -1.51 0.00 0.00 37.83 33.25 1sb3 s LYS 182 CO 0.00 0.65 0.40 -0.98 -0.36 0.00 0.00 175.35 175.06 1sb3 s ARG 183 N -1.55 0.82 0.00 4.03 1.70 -0.09 -5.00 118.95 118.85 1sb3 s ARG 183 Ca 0.27 -0.19 0.06 0.00 -0.47 0.00 0.00 55.73 55.39 1sb3 s ARG 183 Cb -0.14 0.37 -0.02 0.00 -0.57 0.00 0.00 34.95 34.59 1sb3 s ARG 183 CO 0.15 -0.25 -0.17 0.99 -1.08 0.00 0.00 175.30 174.93 1sb3 s THR 184 N -1.74 1.37 0.05 4.99 2.01 -1.26 -0.55 115.64 120.51 1sb3 s THR 184 Ca -0.10 -0.83 -0.02 0.00 0.31 0.00 0.00 61.69 61.06 1sb3 s THR 184 Cb -0.03 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.29 1sb3 s THR 184 CO 0.03 0.32 0.00 0.68 -0.69 0.00 0.00 174.62 174.96 1sb3 s VAL 185 N -0.50 0.19 0.47 3.82 -7.23 -0.86 -4.97 120.40 111.31 1sb3 s VAL 185 Ca 0.06 -1.56 -0.24 0.00 -1.81 0.00 0.00 61.98 58.42 1sb3 s VAL 185 Cb -0.07 -1.27 -0.07 0.00 0.56 0.00 0.00 36.38 35.53 1sb3 s VAL 185 CO -0.00 -0.86 1.38 -2.84 -0.31 0.00 0.00 175.10 172.47 1sb3 s PRO 186 N -3.45 3.58 0.26 4.82 0.02 -1.26 -0.40 135.00 138.58 1sb3 s PRO 186 Ca 0.02 2.32 -0.01 0.00 0.02 0.00 0.00 61.00 63.35 1sb3 s PRO 186 Cb 0.04 -2.56 0.51 0.00 0.02 0.00 0.00 34.50 32.52 1sb3 s PRO 186 CO -0.08 -0.87 1.78 -0.24 -0.33 0.00 0.00 177.00 177.26 1sb3 h VAL 187 N 2.08 0.79 -0.80 3.83 3.04 -1.25 -1.15 116.25 122.79 1sb3 h VAL 187 Ca -0.51 -0.24 0.23 0.00 -1.01 0.00 0.00 66.70 65.17 1sb3 h VAL 187 Cb 1.27 0.02 -0.03 0.00 -2.01 0.00 0.00 31.29 30.54 1sb3 h VAL 187 CO 0.60 0.13 0.59 0.00 -1.01 0.00 0.00 177.57 177.88 1sb3 h ALA 188 N 1.53 2.75 -0.00 3.17 0.00 -1.89 0.12 119.26 124.94 1sb3 h ALA 188 Ca 0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1sb3 h ALA 188 Cb 0.57 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1sb3 h ALA 188 CO -0.32 -1.00 -0.00 1.04 0.00 0.00 0.00 179.25 178.96 1sb3 n GLN 189 N -4.26 0.69 0.27 0.00 6.02 -0.43 -3.11 117.38 116.55 1sb3 n GLN 189 Ca 0.16 -0.02 0.16 0.00 -0.01 0.00 0.00 57.00 57.30 1sb3 n GLN 189 Cb 0.88 -1.50 0.60 0.00 1.02 0.00 0.00 30.24 31.24 1sb3 n GLN 189 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1sb3 h LEU 190 N 0.04 0.00 -9.58 1.08 7.12 -0.84 -3.43 115.31 109.70 1sb3 h LEU 190 Ca 0.00 0.00 -0.61 0.00 0.13 0.00 0.00 57.88 57.40 1sb3 h LEU 190 Cb 0.17 0.00 -0.10 0.00 -0.53 0.00 0.00 40.66 40.20 1sb3 h LEU 190 CO 0.00 0.00 -0.63 -0.36 -0.13 0.00 0.00 178.44 177.32 1sb3 s PHE 191 N -3.59 2.99 -0.03 1.25 0.08 -1.18 -1.16 117.98 116.34 1sb3 s PHE 191 Ca 0.02 -0.06 0.03 0.00 0.12 0.00 0.00 56.93 57.04 1sb3 s PHE 191 Cb 0.08 -1.47 -0.00 0.00 -0.57 0.00 0.00 43.02 41.06 1sb3 s PHE 191 CO 0.56 0.51 -0.13 0.50 -0.10 0.00 0.00 175.22 176.56 1sb3 s ARG 192 N -2.81 1.30 -1.48 0.44 3.52 -0.06 -4.78 118.95 115.08 1sb3 s ARG 192 Ca 0.28 -0.45 -0.13 0.00 -0.13 0.00 0.00 55.73 55.30 1sb3 s ARG 192 Cb -0.10 -1.17 0.01 0.00 -1.56 0.00 0.00 34.95 32.13 1sb3 s ARG 192 CO 0.20 0.19 2.37 -1.91 -0.81 0.00 0.00 175.30 175.34 1sb3 n GLU 193 N 3.16 3.00 -3.60 5.12 2.13 -1.26 -4.39 120.64 124.79 1sb3 n GLU 193 Ca -0.18 -2.51 -0.15 0.00 0.66 0.00 0.00 57.16 54.98 1sb3 n GLU 193 Cb 0.54 -3.19 -0.13 0.00 0.27 0.00 0.00 31.44 28.93 1sb3 n GLU 193 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1sb3 s SER 194 N 3.02 0.61 0.43 4.31 0.15 -1.26 -4.88 113.70 116.08 1sb3 s SER 194 Ca 0.51 0.36 0.21 0.00 0.70 0.00 0.00 55.95 57.74 1sb3 s SER 194 Cb 0.15 0.63 1.17 0.00 -1.71 0.00 0.00 66.02 66.25 1sb3 s SER 194 CO -0.08 -0.26 1.80 1.23 1.20 0.00 0.00 173.24 177.13 1sb3 h GLY 195 N 8.29 0.93 -1.85 9.45 0.00 -0.96 -1.94 103.07 116.99 1sb3 h GLY 195 Ca -0.15 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1sb3 h GLY 195 CO 0.18 -0.08 0.00 0.00 0.00 0.00 0.00 176.54 176.64 1sb3 n ALA 196 N -2.53 2.36 -2.87 3.60 0.00 -1.26 -4.45 120.51 115.37 1sb3 n ALA 196 Ca 0.23 -0.99 -0.12 0.00 0.00 0.00 0.00 53.44 52.56 1sb3 n ALA 196 Cb 0.88 -0.68 0.05 0.00 0.00 0.00 0.00 19.45 19.69 1sb3 n ALA 196 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1sb3 n GLU 197 N 1.12 0.97 0.00 0.00 1.02 -0.92 -5.00 120.64 117.83 1sb3 n GLU 197 Ca 0.16 -2.33 0.15 0.00 -0.02 0.00 0.00 57.16 55.11 1sb3 n GLU 197 Cb 0.51 -1.26 0.82 0.00 -0.02 0.00 0.00 31.44 31.49 1sb3 n GLU 197 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 1sb3 n HIS 198 N 0.54 0.00 -4.80 -0.32 1.44 -0.78 -4.49 115.22 106.81 1sb3 n HIS 198 Ca 0.12 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.56 1sb3 n HIS 198 Cb 0.67 -0.11 -0.15 0.00 0.12 0.00 0.00 29.99 30.53 1sb3 n HIS 198 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1sb3 s LEU 199 N -2.23 2.14 -0.11 2.39 1.43 -1.26 -0.88 118.68 120.16 1sb3 s LEU 199 Ca 0.39 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1sb3 s LEU 199 Cb 0.21 -1.08 0.37 0.00 0.03 0.00 0.00 46.19 45.72 1sb3 s LEU 199 CO 0.41 0.21 1.09 0.35 0.23 0.00 0.00 176.35 178.63 1sb3 n THR 200 N 1.98 1.30 -2.95 5.49 -2.24 -0.31 -4.83 114.28 112.71 1sb3 n THR 200 Ca -0.17 -0.65 -0.37 0.00 -2.27 0.00 0.00 64.05 60.59 1sb3 n THR 200 Cb 0.53 -0.42 -0.06 0.00 -2.10 0.00 0.00 70.33 68.28 1sb3 n THR 200 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1sb3 s LEU 201 N -1.26 4.41 0.40 3.22 1.43 -1.26 -5.05 118.68 120.57 1sb3 s LEU 201 Ca 0.25 1.63 0.08 0.00 -1.03 0.00 0.00 54.13 55.06 1sb3 s LEU 201 Cb 0.19 -3.66 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 1sb3 s LEU 201 CO 0.07 0.05 0.49 -1.61 0.23 0.00 0.00 176.35 175.57 1sb3 s GLU 202 N -1.78 2.77 0.10 1.70 0.41 -1.26 -4.97 118.70 115.67 1sb3 s GLU 202 Ca 0.44 -1.30 -0.36 0.00 -0.41 0.00 0.00 54.97 53.33 1sb3 s GLU 202 Cb -0.19 -2.64 -0.17 0.00 -1.78 0.00 0.00 34.13 29.35 1sb3 s GLU 202 CO 0.24 -0.18 1.23 1.17 -0.49 0.00 0.00 175.26 177.22 1sb3 n LYS 203 N -1.71 0.94 -0.92 1.61 3.00 -1.26 -0.54 118.16 119.27 1sb3 n LYS 203 Ca 0.05 0.34 0.00 0.00 -0.00 0.00 0.00 58.31 58.70 1sb3 n LYS 203 Cb 0.60 -1.90 0.00 0.00 0.00 0.00 0.00 35.03 33.72 1sb3 n LYS 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1sb3 n GLY 204 N 2.22 1.09 3.86 3.14 0.00 -1.26 -4.67 105.19 109.57 1sb3 n GLY 204 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1sb3 n GLY 204 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sb3 s GLU 205 N -0.03 3.80 0.08 1.61 2.02 0.29 -4.20 118.70 122.29 1sb3 s GLU 205 Ca 0.00 0.25 0.07 0.00 0.02 0.00 0.00 54.97 55.31 1sb3 s GLU 205 Cb 0.00 -3.11 -0.03 0.00 0.10 0.00 0.00 34.13 31.09 1sb3 s GLU 205 CO 0.00 0.63 -0.18 -0.51 0.02 0.00 0.00 175.26 175.22 1sb3 s LEU 206 N -1.50 2.27 -0.21 1.80 1.43 -0.25 -4.80 118.68 117.41 1sb3 s LEU 206 Ca 0.28 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.50 1sb3 s LEU 206 Cb -0.15 -0.76 -0.01 0.00 0.03 0.00 0.00 46.19 45.30 1sb3 s LEU 206 CO 0.15 0.02 0.79 -0.22 0.23 0.00 0.00 176.35 177.33 1sb3 s LEU 207 N -1.74 4.12 -0.17 1.79 2.96 -1.26 -1.67 118.68 122.71 1sb3 s LEU 207 Ca 0.04 1.03 0.12 0.00 -0.22 0.00 0.00 54.13 55.10 1sb3 s LEU 207 Cb -0.10 -3.14 -0.23 0.00 0.50 0.00 0.00 46.19 43.22 1sb3 s LEU 207 CO 0.03 -0.44 0.15 0.00 -1.32 0.00 0.00 176.35 174.77 1sb3 n ALA 208 N 5.63 1.45 -3.58 5.97 0.00 0.82 -4.66 120.51 126.14 1sb3 n ALA 208 Ca 0.04 -1.14 -0.07 0.00 0.00 0.00 0.00 53.44 52.27 1sb3 n ALA 208 Cb 0.48 -0.33 -0.02 0.00 0.00 0.00 0.00 19.45 19.58 1sb3 n ALA 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sb3 s ALA 209 N -2.52 -1.76 -0.03 0.00 0.00 -1.08 -0.86 121.76 115.51 1sb3 s ALA 209 Ca -0.14 0.71 0.06 0.00 0.00 0.00 0.00 51.96 52.58 1sb3 s ALA 209 Cb 0.07 0.51 -0.01 0.00 0.00 0.00 0.00 23.12 23.69 1sb3 s ALA 209 CO 0.78 -0.80 -0.20 0.42 0.00 0.00 0.00 175.76 175.96 1sb3 s ILE 210 N -3.21 1.65 -0.09 0.00 -1.09 0.46 -0.44 121.20 118.48 1sb3 s ILE 210 Ca 0.07 -0.86 0.04 0.00 -2.23 0.00 0.00 60.65 57.66 1sb3 s ILE 210 Cb -0.01 -1.39 0.00 0.00 -1.58 0.00 0.00 42.46 39.48 1sb3 s ILE 210 CO -0.06 0.47 -0.21 -1.61 -1.23 0.00 0.00 174.94 172.30 1sb3 s GLU 211 N -0.24 2.61 -0.18 2.79 2.02 -0.27 0.01 118.70 125.44 1sb3 s GLU 211 Ca 0.02 -0.74 -0.01 0.00 0.02 0.00 0.00 54.97 54.26 1sb3 s GLU 211 Cb -0.10 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.11 1sb3 s GLU 211 CO 0.01 0.15 -0.13 0.08 0.02 0.00 0.00 175.26 175.39 1sb3 s VAL 212 N 0.40 2.75 0.75 2.63 1.01 0.64 -0.41 120.40 128.17 1sb3 s VAL 212 Ca -0.17 -0.72 -0.11 0.00 0.00 0.00 0.00 61.98 60.98 1sb3 s VAL 212 Cb -0.17 -2.19 0.04 0.00 0.00 0.00 0.00 36.38 34.06 1sb3 s VAL 212 CO 0.07 0.49 1.08 -2.16 0.00 0.00 0.00 175.10 174.58 1sb3 s PRO 213 N 1.10 2.45 0.59 2.72 0.04 -1.26 0.13 135.00 140.77 1sb3 s PRO 213 Ca 0.00 0.93 -0.19 0.00 0.04 0.00 0.00 61.00 61.79 1sb3 s PRO 213 Cb -0.14 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 1sb3 s PRO 213 CO -0.04 -1.44 0.98 -2.30 0.04 0.00 0.00 177.00 174.24 1sb3 n PRO 214 N -3.35 0.95 0.18 0.56 -0.02 -1.26 -4.78 135.00 127.27 1sb3 n PRO 214 Ca 0.08 0.36 0.06 0.00 -2.02 0.00 0.00 63.50 61.98 1sb3 n PRO 214 Cb 0.54 -2.17 0.16 0.00 -0.02 0.00 0.00 33.50 32.01 1sb3 n PRO 214 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1sb3 h THR 215 N 0.57 0.62 0.00 3.45 1.35 -1.90 -3.49 112.91 113.52 1sb3 h THR 215 Ca -0.48 -1.71 0.00 0.00 -0.55 0.00 0.00 66.41 63.66 1sb3 h THR 215 Cb 1.36 2.18 0.00 0.00 -1.73 0.00 0.00 68.15 69.96 1sb3 h THR 215 CO 0.51 0.33 0.00 0.61 -0.25 0.00 0.00 175.52 176.72 1sb3 n GLY 216 N 0.93 3.45 0.25 5.82 0.00 -1.26 -1.30 105.19 113.07 1sb3 n GLY 216 Ca 0.02 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.89 1sb3 n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sb3 n ALA 217 N 11.14 2.49 -2.39 4.61 0.00 -1.26 -4.89 120.51 130.20 1sb3 n ALA 217 Ca 0.00 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.86 1sb3 n ALA 217 Cb 0.00 -1.01 -0.06 0.00 0.00 0.00 0.00 19.45 18.38 1sb3 n ALA 217 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1sb3 s TRP 218 N -1.83 3.51 0.01 0.00 0.52 -0.42 -4.55 118.94 116.19 1sb3 s TRP 218 Ca 0.11 0.96 0.05 0.00 0.02 0.00 0.00 56.10 57.24 1sb3 s TRP 218 Cb 0.06 -2.31 -0.02 0.00 -1.15 0.00 0.00 33.47 30.05 1sb3 s TRP 218 CO 0.08 0.35 -0.16 -1.54 0.02 0.00 0.00 176.95 175.70 1sb3 s SER 219 N -2.04 1.92 0.10 2.95 1.04 -0.74 -4.89 113.70 112.04 1sb3 s SER 219 Ca 0.42 -0.38 -0.02 0.00 0.48 0.00 0.00 55.95 56.45 1sb3 s SER 219 Cb -0.13 -0.18 -0.03 0.00 0.10 0.00 0.00 66.02 65.78 1sb3 s SER 219 CO 0.20 0.14 0.05 0.00 0.98 0.00 0.00 173.24 174.62 1sb3 s ALA 220 N -0.58 0.55 0.21 5.32 0.00 -1.26 -0.02 121.76 125.97 1sb3 s ALA 220 Ca 0.05 -1.24 -0.17 0.00 0.00 0.00 0.00 51.96 50.60 1sb3 s ALA 220 Cb -0.07 0.60 0.02 0.00 0.00 0.00 0.00 23.12 23.67 1sb3 s ALA 220 CO 0.00 -0.46 0.53 0.00 0.00 0.00 0.00 175.76 175.83 1sb3 s ALA 221 N -3.97 -0.86 0.01 0.00 0.00 -0.42 -4.09 121.76 112.42 1sb3 s ALA 221 Ca 0.15 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 51.84 1sb3 s ALA 221 Cb 0.07 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 24.05 1sb3 s ALA 221 CO -0.04 -0.82 -0.12 -0.47 0.00 0.00 0.00 175.76 174.30 1sb3 s TYR 222 N -3.89 1.09 -0.03 0.00 5.04 -1.26 -1.74 117.35 116.56 1sb3 s TYR 222 Ca 0.11 -0.25 0.01 0.00 -2.44 0.00 0.00 57.07 54.50 1sb3 s TYR 222 Cb -0.01 -0.69 0.02 0.00 0.35 0.00 0.00 41.96 41.63 1sb3 s TYR 222 CO -0.01 -0.00 -0.02 0.45 -1.34 0.00 0.00 175.55 174.63 1sb3 s SER 223 N -0.56 0.55 0.09 4.32 0.15 -0.34 -4.87 113.70 113.03 1sb3 s SER 223 Ca 0.03 -0.06 0.08 0.00 0.70 0.00 0.00 55.95 56.70 1sb3 s SER 223 Cb -0.06 -0.23 -0.03 0.00 -1.71 0.00 0.00 66.02 63.99 1sb3 s SER 223 CO 0.00 -0.05 -0.21 -0.75 1.20 0.00 0.00 173.24 173.43 1sb3 s LYS 224 N 0.68 1.21 -0.09 5.44 2.20 -1.26 -0.89 119.74 127.03 1sb3 s LYS 224 Ca -0.07 -1.12 0.04 0.00 -0.36 0.00 0.00 55.97 54.46 1sb3 s LYS 224 Cb -0.11 -1.46 -0.00 0.00 -1.51 0.00 0.00 37.83 34.76 1sb3 s LYS 224 CO -0.01 0.35 -0.23 0.08 -0.36 0.00 0.00 175.35 175.18 1sb3 s VAL 225 N -1.06 1.94 0.08 4.02 1.01 -0.23 -5.01 120.40 121.14 1sb3 s VAL 225 Ca 0.07 -0.96 -0.18 0.00 0.00 0.00 0.00 61.98 60.91 1sb3 s VAL 225 Cb -0.10 -1.67 0.04 0.00 0.00 0.00 0.00 36.38 34.65 1sb3 s VAL 225 CO 0.04 0.54 0.42 0.00 0.00 0.00 0.00 175.10 176.09 1sb3 s ARG 226 N 0.26 0.99 -0.05 2.72 1.70 -1.26 -0.30 118.95 123.00 1sb3 s ARG 226 Ca -0.15 -0.48 -0.27 0.00 -0.47 0.00 0.00 55.73 54.36 1sb3 s ARG 226 Cb -0.17 0.44 -0.22 0.00 -0.57 0.00 0.00 34.95 34.44 1sb3 s ARG 226 CO 0.07 -0.36 1.16 0.82 -1.08 0.00 0.00 175.30 175.92 1sb3 h ILE 227 N 2.75 1.47 -3.55 4.99 2.04 -1.97 -3.44 117.51 119.81 1sb3 h ILE 227 Ca -0.32 -1.40 -0.47 0.00 1.00 0.00 0.00 64.86 63.67 1sb3 h ILE 227 Cb 1.23 2.43 0.06 0.00 -0.74 0.00 0.00 36.82 39.79 1sb3 h ILE 227 CO 0.45 0.36 0.15 -0.13 0.00 0.00 0.00 178.15 178.98 1sb3 s ARG 228 N -3.83 2.81 0.00 2.37 0.52 -1.26 -4.98 118.95 114.58 1sb3 s ARG 228 Ca -0.17 -0.11 0.16 0.00 -0.52 0.00 0.00 55.73 55.09 1sb3 s ARG 228 Cb 0.01 -2.29 0.53 0.00 0.52 0.00 0.00 34.95 33.72 1sb3 s ARG 228 CO 0.68 -0.74 1.40 -0.25 0.02 0.00 0.00 175.30 176.41 1sb3 n ASP 229 N -2.58 1.71 -3.65 0.23 10.43 -1.26 -4.80 116.55 116.63 1sb3 n ASP 229 Ca 0.05 -1.85 -0.09 0.00 2.57 0.00 0.00 54.79 55.47 1sb3 n ASP 229 Cb 0.58 -0.17 -0.02 0.00 1.84 0.00 0.00 41.12 43.35 1sb3 n ASP 229 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1sb3 s ALA 230 N -1.67 -1.42 0.00 2.24 0.00 -1.26 -5.00 121.76 114.65 1sb3 s ALA 230 Ca 0.27 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1sb3 s ALA 230 Cb 0.15 0.85 0.00 0.00 0.00 0.00 0.00 23.12 24.11 1sb3 s ALA 230 CO 0.21 -0.91 0.00 0.28 0.00 0.00 0.00 175.76 175.34 1sb3 n VAL 231 N -0.42 0.00 -1.54 0.00 0.31 -0.10 -4.95 118.33 111.62 1sb3 n VAL 231 Ca -0.10 0.00 -0.47 0.00 -0.01 0.00 0.00 64.34 63.76 1sb3 n VAL 231 Cb 0.62 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.52 1sb3 n VAL 231 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1sb3 n ASP 232 N 2.20 0.74 -4.71 4.52 10.43 -1.26 -3.97 116.55 124.48 1sb3 n ASP 232 Ca 0.00 1.16 -0.30 0.00 2.57 0.00 0.00 54.79 58.22 1sb3 n ASP 232 Cb 0.00 -1.19 0.14 0.00 1.84 0.00 0.00 41.12 41.91 1sb3 n ASP 232 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1sb3 s PHE 233 N -0.80 2.29 0.17 1.24 0.08 -1.26 -4.57 117.98 115.13 1sb3 s PHE 233 Ca 0.64 1.28 -0.30 0.00 0.12 0.00 0.00 56.93 58.68 1sb3 s PHE 233 Cb -0.80 -3.16 -0.08 0.00 -0.57 0.00 0.00 43.02 38.41 1sb3 s PHE 233 CO 0.57 -2.40 1.20 -1.25 -0.10 0.00 0.00 175.22 173.24 1sb3 s PRO 234 N -4.92 4.48 0.28 0.24 0.04 -1.26 -4.76 135.00 129.11 1sb3 s PRO 234 Ca 0.63 1.86 0.15 0.00 0.04 0.00 0.00 61.00 63.68 1sb3 s PRO 234 Cb -0.18 -3.25 0.17 0.00 0.04 0.00 0.00 34.50 31.28 1sb3 s PRO 234 CO 0.57 -0.11 1.49 -0.07 0.04 0.00 0.00 177.00 178.92 1sb3 h LEU 235 N 5.47 0.00 -7.00 -3.56 3.38 -0.98 -3.43 115.31 109.19 1sb3 h LEU 235 Ca -0.44 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.55 1sb3 h LEU 235 Cb 1.21 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.73 1sb3 h LEU 235 CO 0.76 0.54 0.34 0.00 0.09 0.00 0.00 178.44 180.17 1sb3 s ALA 236 N -3.08 -1.89 -0.04 1.53 0.00 -1.23 -4.72 121.76 112.33 1sb3 s ALA 236 Ca 0.03 1.81 -0.03 0.00 0.00 0.00 0.00 51.96 53.76 1sb3 s ALA 236 Cb 0.09 -1.08 0.02 0.00 0.00 0.00 0.00 23.12 22.15 1sb3 s ALA 236 CO 0.74 -0.29 0.11 0.20 0.00 0.00 0.00 175.76 176.52 1sb3 s GLY 237 N -0.11 -0.05 -0.06 0.00 0.00 -0.36 -1.07 107.32 105.68 1sb3 s GLY 237 Ca -0.00 0.41 -0.00 0.00 0.00 0.00 0.00 44.72 45.13 1sb3 s GLY 237 CO -0.01 0.53 -0.02 0.14 0.00 0.00 0.00 173.10 173.73 1sb3 s VAL 238 N 0.50 0.47 -0.05 1.40 1.01 -0.07 -0.82 120.40 122.85 1sb3 s VAL 238 Ca -0.04 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.94 1sb3 s VAL 238 Cb -0.05 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 1sb3 s VAL 238 CO -0.02 0.24 -0.05 0.00 0.00 0.00 0.00 175.10 175.27 1sb3 s ALA 239 N 1.40 3.08 0.01 5.51 0.00 0.00 -1.20 121.76 130.55 1sb3 s ALA 239 Ca -0.04 -0.91 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 1sb3 s ALA 239 Cb -0.13 -1.26 -0.01 0.00 0.00 0.00 0.00 23.12 21.71 1sb3 s ALA 239 CO -0.03 0.59 0.01 0.00 0.00 0.00 0.00 175.76 176.33 1sb3 s ALA 240 N -0.90 0.02 -0.04 0.00 0.00 -0.71 -0.87 121.76 119.25 1sb3 s ALA 240 Ca 0.14 -0.38 0.03 0.00 0.00 0.00 0.00 51.96 51.76 1sb3 s ALA 240 Cb -0.11 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1sb3 s ALA 240 CO 0.04 -0.13 -0.13 0.00 0.00 0.00 0.00 175.76 175.54 1sb3 s ALA 241 N -1.12 1.20 0.03 0.00 0.00 0.21 -1.30 121.76 120.78 1sb3 s ALA 241 Ca -0.12 -0.47 0.04 0.00 0.00 0.00 0.00 51.96 51.41 1sb3 s ALA 241 Cb -0.07 -0.46 -0.02 0.00 0.00 0.00 0.00 23.12 22.57 1sb3 s ALA 241 CO -0.00 0.18 -0.13 -1.17 0.00 0.00 0.00 175.76 174.63 1sb3 s LEU 242 N 0.29 2.14 -0.18 0.00 2.96 0.97 -0.76 118.68 124.11 1sb3 s LEU 242 Ca -0.07 -0.40 -0.00 0.00 -0.22 0.00 0.00 54.13 53.44 1sb3 s LEU 242 Cb -0.12 -0.56 0.04 0.00 0.50 0.00 0.00 46.19 46.05 1sb3 s LEU 242 CO 0.02 0.04 -0.06 -1.58 -1.32 0.00 0.00 176.35 173.45 1sb3 s GLN 243 N -0.96 1.53 -0.18 1.98 0.74 -0.19 -1.79 119.66 120.79 1sb3 s GLN 243 Ca 0.01 -0.63 -0.05 0.00 0.05 0.00 0.00 55.36 54.75 1sb3 s GLN 243 Cb -0.07 -2.16 -0.03 0.00 1.10 0.00 0.00 33.01 31.85 1sb3 s GLN 243 CO 0.01 -0.46 -0.00 0.50 -0.55 0.00 0.00 175.29 174.78 1sb3 s ARG 244 N 1.57 3.68 -0.33 1.67 3.52 -1.26 -0.61 118.95 127.20 1sb3 s ARG 244 Ca -0.01 -0.50 -0.02 0.00 -0.13 0.00 0.00 55.73 55.08 1sb3 s ARG 244 Cb -0.16 -3.04 0.07 0.00 -1.56 0.00 0.00 34.95 30.26 1sb3 s ARG 244 CO -0.08 0.13 0.05 0.34 -0.81 0.00 0.00 175.30 174.93 1sb3 s ASP 245 N 0.69 4.96 1.71 -2.12 2.15 -0.08 -4.89 116.67 119.10 1sb3 s ASP 245 Ca -0.00 -1.52 0.00 0.00 0.43 0.00 0.00 52.55 51.46 1sb3 s ASP 245 Cb -0.14 -1.73 0.00 0.00 -0.30 0.00 0.00 42.92 40.75 1sb3 s ASP 245 CO 0.02 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 1sb3 n GLY 246 N 4.59 1.17 0.84 2.66 0.00 -1.26 -0.36 105.19 112.83 1sb3 n GLY 246 Ca -0.09 0.46 0.05 0.00 0.00 0.00 0.00 46.02 46.44 1sb3 n GLY 246 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sb3 n ASP 247 N 10.84 1.62 -4.29 1.61 10.43 -1.26 -5.03 116.55 130.46 1sb3 n ASP 247 Ca 0.00 -3.47 -0.22 0.00 2.57 0.00 0.00 54.79 53.67 1sb3 n ASP 247 Cb 0.00 -0.48 -0.12 0.00 1.84 0.00 0.00 41.12 42.37 1sb3 n ASP 247 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 1sb3 s ARG 248 N -2.53 1.14 -0.49 -1.24 0.52 0.52 -4.32 118.95 112.54 1sb3 s ARG 248 Ca 0.37 -1.25 -0.26 0.00 -0.52 0.00 0.00 55.73 54.08 1sb3 s ARG 248 Cb 0.37 -1.24 0.03 0.00 0.52 0.00 0.00 34.95 34.64 1sb3 s ARG 248 CO -0.09 0.27 0.96 0.42 0.02 0.00 0.00 175.30 176.88 1sb3 s ILE 249 N -1.65 4.40 -0.04 1.52 1.01 0.23 -0.90 121.20 125.77 1sb3 s ILE 249 Ca 0.09 0.69 -0.01 0.00 0.00 0.00 0.00 60.65 61.43 1sb3 s ILE 249 Cb -0.08 -4.49 -0.26 0.00 0.01 0.00 0.00 42.46 37.64 1sb3 s ILE 249 CO 0.05 -0.95 0.70 0.00 0.00 0.00 0.00 174.94 174.74 1sb3 h ALA 250 N 9.18 0.42 -3.29 9.38 0.00 -1.19 0.15 119.26 133.90 1sb3 h ALA 250 Ca -0.24 -1.26 -0.19 0.00 0.00 0.00 0.00 54.91 53.22 1sb3 h ALA 250 Cb 1.07 0.43 -0.26 0.00 0.00 0.00 0.00 17.79 19.04 1sb3 h ALA 250 CO 1.06 1.28 -0.55 0.20 0.00 0.00 0.00 179.25 181.24 1sb3 s GLY 251 N -5.14 -0.07 -0.14 0.00 0.00 -0.62 -4.82 107.32 96.53 1sb3 s GLY 251 Ca -0.11 0.29 -0.09 0.00 0.00 0.00 0.00 44.72 44.81 1sb3 s GLY 251 CO 0.83 0.23 0.34 -2.27 0.00 0.00 0.00 173.10 172.22 1sb3 s LEU 252 N -0.17 0.31 -0.04 0.66 2.96 -1.26 -1.02 118.68 120.12 1sb3 s LEU 252 Ca -0.02 0.72 0.01 0.00 -0.22 0.00 0.00 54.13 54.62 1sb3 s LEU 252 Cb -0.02 1.12 0.02 0.00 0.50 0.00 0.00 46.19 47.80 1sb3 s LEU 252 CO 0.00 -0.16 -0.05 -0.13 -1.32 0.00 0.00 176.35 174.69 1sb3 s ARG 253 N 0.96 0.81 -0.03 1.98 0.52 0.06 -4.87 118.95 118.39 1sb3 s ARG 253 Ca -0.06 -0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.01 1sb3 s ARG 253 Cb -0.07 -0.80 0.03 0.00 0.52 0.00 0.00 34.95 34.62 1sb3 s ARG 253 CO -0.07 -0.04 0.01 0.08 0.02 0.00 0.00 175.30 175.30 1sb3 s VAL 254 N 0.73 0.10 -0.01 3.52 1.01 -1.26 -0.62 120.40 123.88 1sb3 s VAL 254 Ca -0.10 0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.06 1sb3 s VAL 254 Cb -0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 36.38 36.02 1sb3 s VAL 254 CO 0.00 0.13 -0.14 0.00 0.00 0.00 0.00 175.10 175.10 1sb3 s ALA 255 N 1.12 1.14 0.21 5.51 0.00 -0.05 -0.14 121.76 129.54 1sb3 s ALA 255 Ca -0.08 -0.61 0.11 0.00 0.00 0.00 0.00 51.96 51.37 1sb3 s ALA 255 Cb -0.13 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 1sb3 s ALA 255 CO -0.02 0.27 -0.17 0.96 0.00 0.00 0.00 175.76 176.80 1sb3 s ILE 256 N -0.36 2.69 0.19 0.00 -4.36 0.19 -0.82 121.20 118.74 1sb3 s ILE 256 Ca 0.05 -1.99 -0.09 0.00 -0.26 0.00 0.00 60.65 58.37 1sb3 s ILE 256 Cb -0.05 -2.34 -0.01 0.00 1.25 0.00 0.00 42.46 41.31 1sb3 s ILE 256 CO -0.00 -0.18 0.31 0.28 0.24 0.00 0.00 174.94 175.58 1sb3 s THR 257 N -1.88 0.04 -0.67 8.37 -1.32 0.00 -1.53 115.64 118.65 1sb3 s THR 257 Ca 0.24 -1.46 0.00 0.00 -1.21 0.00 0.00 61.69 59.27 1sb3 s THR 257 Cb -0.08 -1.99 0.00 0.00 -1.51 0.00 0.00 72.50 68.93 1sb3 s THR 257 CO 0.13 -0.20 0.00 0.61 -2.21 0.00 0.00 174.62 172.95 1sb3 n GLY 258 N -0.26 0.84 0.00 6.08 0.00 -0.24 -1.22 105.19 110.39 1sb3 n GLY 258 Ca -0.05 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1sb3 n GLY 258 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sb3 n SER 259 N 0.30 2.07 -3.91 1.61 3.41 -1.26 -4.42 113.62 111.43 1sb3 n SER 259 Ca -0.06 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.34 1sb3 n SER 259 Cb 0.27 0.29 -0.09 0.00 -0.26 0.00 0.00 64.21 64.42 1sb3 n SER 259 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1sb3 s ASN 260 N -1.43 1.98 0.00 4.04 0.02 -1.26 -3.44 114.94 114.85 1sb3 s ASN 260 Ca 0.00 -1.63 0.14 0.00 -1.02 0.00 0.00 52.86 50.35 1sb3 s ASN 260 Cb 0.00 0.45 0.80 0.00 0.02 0.00 0.00 41.25 42.52 1sb3 s ASN 260 CO 0.00 -0.93 1.30 -1.20 0.02 0.00 0.00 177.10 176.29 1sb3 n SER 261 N -1.18 0.00 -3.70 -1.22 7.64 -1.25 -0.72 113.62 113.20 1sb3 n SER 261 Ca 0.00 -0.27 -0.13 0.00 1.01 0.00 0.00 58.87 59.48 1sb3 n SER 261 Cb 0.64 -0.09 -0.07 0.00 -1.01 0.00 0.00 64.21 63.68 1sb3 n SER 261 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sb3 s ALA 262 N -2.18 -0.92 0.26 -0.43 0.00 -1.26 -4.24 121.76 112.99 1sb3 s ALA 262 Ca 0.19 0.27 -0.30 0.00 0.00 0.00 0.00 51.96 52.12 1sb3 s ALA 262 Cb 0.10 0.29 -0.09 0.00 0.00 0.00 0.00 23.12 23.41 1sb3 s ALA 262 CO 0.18 -0.41 1.01 -1.25 0.00 0.00 0.00 175.76 175.28 1sb3 s PRO 263 N -2.27 4.75 0.04 0.00 0.04 -1.26 -4.85 135.00 131.44 1sb3 s PRO 263 Ca -0.07 1.61 0.02 0.00 0.04 0.00 0.00 61.00 62.61 1sb3 s PRO 263 Cb -0.01 -3.21 -0.02 0.00 0.04 0.00 0.00 34.50 31.29 1sb3 s PRO 263 CO -0.01 0.38 -0.08 -0.51 0.04 0.00 0.00 177.00 176.81 1sb3 s LEU 264 N -1.34 2.21 0.24 -3.56 1.43 -0.58 -4.94 118.68 112.14 1sb3 s LEU 264 Ca 0.43 -0.48 -0.28 0.00 -1.03 0.00 0.00 54.13 52.77 1sb3 s LEU 264 Cb -0.28 -0.22 -0.09 0.00 0.03 0.00 0.00 46.19 45.63 1sb3 s LEU 264 CO 0.35 -0.14 0.90 -0.04 0.23 0.00 0.00 176.35 177.65 1sb3 s MET 265 N -1.34 4.73 -0.23 1.70 -1.94 -1.26 -0.64 119.30 120.33 1sb3 s MET 265 Ca -0.07 1.37 -0.08 0.00 -1.71 0.00 0.00 55.69 55.20 1sb3 s MET 265 Cb -0.09 -3.16 -0.04 0.00 2.01 0.00 0.00 34.83 33.56 1sb3 s MET 265 CO 0.00 0.47 0.09 0.08 -0.01 0.00 0.00 175.02 175.66 1sb3 s VAL 266 N -1.28 4.71 -0.21 -6.03 1.01 0.80 -4.95 120.40 114.45 1sb3 s VAL 266 Ca 0.42 -0.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.07 1sb3 s VAL 266 Cb -0.24 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1sb3 s VAL 266 CO 0.29 0.37 1.85 -2.16 0.00 0.00 0.00 175.10 175.45 1sb3 s PRO 267 N 1.10 3.57 -0.12 2.72 0.04 -1.26 -4.50 135.00 136.55 1sb3 s PRO 267 Ca 0.05 1.81 0.16 0.00 0.04 0.00 0.00 61.00 63.06 1sb3 s PRO 267 Cb -0.14 -4.17 0.26 0.00 0.04 0.00 0.00 34.50 30.49 1sb3 s PRO 267 CO 0.04 -1.58 1.13 1.33 0.04 0.00 0.00 177.00 177.96 1sb3 n VAL 268 N 6.88 1.63 -0.12 -0.36 0.24 -1.26 -4.80 118.33 120.53 1sb3 n VAL 268 Ca 0.23 -2.00 0.16 0.00 -2.04 0.00 0.00 64.34 60.68 1sb3 n VAL 268 Cb 0.45 -0.12 0.54 0.00 -1.47 0.00 0.00 33.84 33.24 1sb3 n VAL 268 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1sb3 h ASP 269 N 0.08 0.30 0.00 -1.34 3.32 -1.91 -1.43 116.42 115.44 1sb3 h ASP 269 Ca -0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1sb3 h ASP 269 Cb 1.07 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1sb3 h ASP 269 CO 0.00 0.16 0.14 0.00 -1.72 0.00 0.00 179.24 177.82 1sb3 n ALA 270 N -2.55 0.78 0.73 3.45 0.00 -1.26 -0.30 120.51 121.36 1sb3 n ALA 270 Ca 0.13 0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.73 1sb3 n ALA 270 Cb 0.52 -0.87 -0.13 0.00 0.00 0.00 0.00 19.45 18.97 1sb3 n ALA 270 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1sb3 n LEU 271 N -1.71 0.73 -4.70 0.00 4.77 -0.54 -4.86 117.00 110.70 1sb3 n LEU 271 Ca -0.00 -0.39 -0.42 0.00 -0.03 0.00 0.00 56.01 55.17 1sb3 n LEU 271 Cb 0.15 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1sb3 n LEU 271 CO 0.03 0.18 1.30 -0.76 -1.33 0.00 0.00 177.39 176.82 1sb3 s LEU 272 N -3.29 4.37 0.00 2.23 1.43 0.59 -1.78 118.68 122.23 1sb3 s LEU 272 Ca 0.04 2.58 0.00 0.00 -1.03 0.00 0.00 54.13 55.72 1sb3 s LEU 272 Cb 0.15 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.79 1sb3 s LEU 272 CO 0.84 -0.88 0.00 0.61 0.23 0.00 0.00 176.35 177.15 1sb3 n GLY 273 N 3.92 2.99 3.72 -3.19 0.00 0.51 -5.00 105.19 108.15 1sb3 n GLY 273 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1sb3 n GLY 273 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sb3 s GLY 274 N -2.57 1.68 0.62 -0.02 0.00 -0.73 -4.46 107.32 101.83 1sb3 s GLY 274 Ca 0.00 -1.18 0.01 0.00 0.00 0.00 0.00 44.72 43.55 1sb3 s GLY 274 CO 0.00 -0.28 0.86 -1.31 0.00 0.00 0.00 173.10 172.37 1sb3 s ASN 275 N -4.39 4.91 -0.54 1.64 -0.87 -1.26 -0.60 114.94 113.83 1sb3 s ASN 275 Ca 0.74 -0.19 -0.07 0.00 -1.57 0.00 0.00 52.86 51.76 1sb3 s ASN 275 Cb -0.05 -0.47 0.14 0.00 -0.02 0.00 0.00 41.25 40.84 1sb3 s ASN 275 CO 0.55 -1.43 0.39 0.86 -2.57 0.00 0.00 177.10 174.89 1sb3 s TRP 276 N -2.91 3.49 0.32 2.20 -0.11 -1.26 -4.73 118.94 115.95 1sb3 s TRP 276 Ca 0.61 -2.19 0.05 0.00 1.22 0.00 0.00 56.10 55.79 1sb3 s TRP 276 Cb -0.08 -3.41 -0.03 0.00 -1.50 0.00 0.00 33.47 28.44 1sb3 s TRP 276 CO 0.41 -0.95 0.22 0.16 -4.62 0.00 0.00 176.95 172.17 1sb3 s ASP 277 N 1.98 1.65 0.32 5.86 1.47 -1.26 -5.00 116.67 121.70 1sb3 s ASP 277 Ca 0.10 -1.68 0.09 0.00 1.18 0.00 0.00 52.55 52.24 1sb3 s ASP 277 Cb -0.22 0.51 0.82 0.00 -0.34 0.00 0.00 42.92 43.69 1sb3 s ASP 277 CO -0.03 -1.00 1.78 0.44 0.68 0.00 0.00 175.17 177.04 1sb3 h ASP 278 N 2.15 0.71 -0.56 2.11 3.45 -1.99 0.36 116.42 122.64 1sb3 h ASP 278 Ca -0.29 0.10 -0.08 0.00 0.43 0.00 0.00 57.03 57.19 1sb3 h ASP 278 Cb 1.24 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 39.96 1sb3 h ASP 278 CO 0.43 0.23 0.04 0.00 -1.57 0.00 0.00 179.24 178.36 1sb3 h ALA 279 N 1.65 0.95 -0.20 3.45 0.00 -1.97 -1.73 119.26 121.42 1sb3 h ALA 279 Ca 0.58 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1sb3 h ALA 279 Cb 1.02 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1sb3 h ALA 279 CO -0.37 0.64 -0.34 0.00 0.00 0.00 0.00 179.25 179.18 1sb3 h ALA 280 N 1.10 0.31 -0.84 0.00 0.00 -1.31 -2.52 119.26 116.00 1sb3 h ALA 280 Ca 0.18 -0.43 0.06 0.00 0.00 0.00 0.00 54.91 54.72 1sb3 h ALA 280 Cb 0.49 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1sb3 h ALA 280 CO 0.02 0.36 0.52 0.00 0.00 0.00 0.00 179.25 180.15 1sb3 h ALA 281 N 0.60 1.16 -0.25 0.00 0.00 -0.92 -0.43 119.26 119.42 1sb3 h ALA 281 Ca 0.01 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1sb3 h ALA 281 Cb 0.93 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1sb3 h ALA 281 CO 0.08 0.26 -0.17 1.49 0.00 0.00 0.00 179.25 180.90 1sb3 h GLU 282 N 0.94 0.44 -0.13 0.00 4.57 -1.24 0.10 114.58 119.27 1sb3 h GLU 282 Ca 0.37 -0.13 -0.13 0.00 -1.18 0.00 0.00 59.36 58.29 1sb3 h GLU 282 Cb 0.18 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1sb3 h GLU 282 CO -0.18 0.60 -0.47 1.15 -1.18 0.00 0.00 179.01 178.93 1sb3 h THR 283 N 0.40 1.33 0.26 0.32 2.02 -0.78 -2.20 112.91 114.26 1sb3 h THR 283 Ca 0.07 -1.67 -0.01 0.00 0.77 0.00 0.00 66.41 65.57 1sb3 h THR 283 Cb 0.53 1.74 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1sb3 h THR 283 CO 0.03 0.50 -0.12 0.25 0.37 0.00 0.00 175.52 176.56 1sb3 h LEU 284 N 0.27 -0.29 -0.65 2.58 5.85 -0.37 -0.39 115.31 122.31 1sb3 h LEU 284 Ca 0.02 -0.17 0.13 0.00 0.84 0.00 0.00 57.88 58.70 1sb3 h LEU 284 Cb 0.93 0.08 -0.12 0.00 0.37 0.00 0.00 40.66 41.92 1sb3 h LEU 284 CO 0.08 0.02 -0.11 0.00 -0.34 0.00 0.00 178.44 178.08 1sb3 h ALA 285 N 0.04 0.51 -0.05 1.25 0.00 -0.91 0.55 119.26 120.65 1sb3 h ALA 285 Ca -0.04 0.24 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 1sb3 h ALA 285 Cb 0.44 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1sb3 h ALA 285 CO 0.06 -0.42 -0.47 1.96 0.00 0.00 0.00 179.25 180.38 1sb3 h GLN 286 N 0.03 0.13 -0.39 0.00 1.08 -1.32 0.12 115.11 114.75 1sb3 h GLN 286 Ca 0.33 -0.06 -0.13 0.00 -1.45 0.00 0.00 58.65 57.33 1sb3 h GLN 286 Cb 0.52 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 1sb3 h GLN 286 CO -0.64 0.57 -0.25 -0.07 -0.95 0.00 0.00 178.83 177.49 1sb3 h LEU 287 N 0.10 0.90 -0.50 1.46 3.38 0.11 -1.69 115.31 119.07 1sb3 h LEU 287 Ca 0.00 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 57.49 1sb3 h LEU 287 Cb 0.87 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1sb3 h LEU 287 CO 0.07 1.13 0.09 0.58 0.09 0.00 0.00 178.44 180.40 1sb3 h VAL 288 N 0.67 1.25 -0.95 1.22 2.07 0.21 -2.49 116.25 118.22 1sb3 h VAL 288 Ca 0.08 -0.91 0.01 0.00 0.82 0.00 0.00 66.70 66.70 1sb3 h VAL 288 Cb 0.82 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1sb3 h VAL 288 CO 0.07 0.33 0.63 -0.09 0.02 0.00 0.00 177.57 178.53 1sb3 h ARG 289 N 0.71 1.25 -0.18 1.57 2.43 -0.61 -0.68 114.38 118.87 1sb3 h ARG 289 Ca 0.15 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1sb3 h ARG 289 Cb 0.38 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1sb3 h ARG 289 CO 0.01 0.83 0.05 -0.22 -1.51 0.00 0.00 179.97 179.13 1sb3 h LYS 290 N 1.29 0.28 -0.61 0.20 1.63 -1.08 -3.11 116.57 115.17 1sb3 h LYS 290 Ca 0.35 -0.06 -0.07 0.00 -0.85 0.00 0.00 60.65 60.01 1sb3 h LYS 290 Cb -0.14 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.42 1sb3 h LYS 290 CO -0.08 0.40 0.10 1.15 -3.45 0.00 0.00 179.45 177.57 1sb3 h THR 291 N 0.10 1.26 -4.23 1.00 2.02 -1.20 -3.44 112.91 108.42 1sb3 h THR 291 Ca 0.06 -1.01 -0.52 0.00 0.77 0.00 0.00 66.41 65.71 1sb3 h THR 291 Cb 0.25 0.73 0.15 0.00 -1.74 0.00 0.00 68.15 67.53 1sb3 h THR 291 CO -0.00 0.37 0.34 -0.94 0.37 0.00 0.00 175.52 175.66 1sb3 s SER 292 N -6.40 4.21 -0.41 4.18 1.04 -0.28 -5.00 113.70 111.03 1sb3 s SER 292 Ca -0.12 2.14 0.09 0.00 0.48 0.00 0.00 55.95 58.54 1sb3 s SER 292 Cb 0.13 -2.56 0.30 0.00 0.10 0.00 0.00 66.02 63.99 1sb3 s SER 292 CO 0.84 -2.24 0.78 -3.20 0.98 0.00 0.00 173.24 170.39 1sb3 n ASN 293 N -3.11 -0.56 -4.64 7.02 4.05 -1.25 -4.93 115.26 111.85 1sb3 n ASN 293 Ca 0.12 -3.12 -0.42 0.00 0.45 0.00 0.00 54.58 51.60 1sb3 n ASN 293 Cb 0.52 0.27 -0.03 0.00 1.23 0.00 0.00 39.78 41.77 1sb3 n ASN 293 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1sb3 s VAL 294 N -1.08 3.21 0.29 3.44 1.01 -1.22 -4.66 120.40 121.38 1sb3 s VAL 294 Ca 0.34 0.24 0.09 0.00 0.00 0.00 0.00 61.98 62.64 1sb3 s VAL 294 Cb 0.27 -3.19 -0.06 0.00 0.00 0.00 0.00 36.38 33.40 1sb3 s VAL 294 CO -0.11 -0.06 -0.11 -0.76 0.00 0.00 0.00 175.10 174.06 1sb3 s LEU 295 N 5.53 2.60 -1.40 3.92 1.43 -1.26 -4.98 118.68 124.52 1sb3 s LEU 295 Ca 0.87 -1.14 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 1sb3 s LEU 295 Cb -0.36 -0.85 0.08 0.00 0.03 0.00 0.00 46.19 45.09 1sb3 s LEU 295 CO 0.36 -0.20 2.22 -1.14 0.23 0.00 0.00 176.35 177.82 1sb3 n ARG 296 N -0.64 3.43 0.00 1.70 3.00 -1.26 -4.28 116.66 118.62 1sb3 n ARG 296 Ca -0.06 -2.98 0.10 0.00 -0.00 0.00 0.00 57.85 54.92 1sb3 n ARG 296 Cb 0.62 -3.02 -0.04 0.00 0.00 0.00 0.00 32.46 30.03 1sb3 n ARG 296 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1sb3 n THR 297 N 3.89 0.00 -4.15 5.15 -2.24 -1.26 -4.89 114.28 110.78 1sb3 n THR 297 Ca 0.52 -0.21 -0.26 0.00 -2.27 0.00 0.00 64.05 61.83 1sb3 n THR 297 Cb 0.34 1.17 -0.07 0.00 -2.10 0.00 0.00 70.33 69.67 1sb3 n THR 297 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1sb3 s THR 298 N -2.46 4.08 0.32 4.28 -4.23 -1.26 -0.39 115.64 115.99 1sb3 s THR 298 Ca 0.14 -1.26 0.10 0.00 -1.18 0.00 0.00 61.69 59.49 1sb3 s THR 298 Cb 0.16 -3.06 0.05 0.00 1.34 0.00 0.00 72.50 70.99 1sb3 s THR 298 CO 0.60 -0.10 1.74 -0.29 -0.54 0.00 0.00 174.62 176.03 1sb3 h ILE 299 N 2.28 1.31 -3.92 2.99 2.10 -1.98 -3.43 117.51 116.86 1sb3 h ILE 299 Ca -0.47 -1.49 -0.46 0.00 1.08 0.00 0.00 64.86 63.52 1sb3 h ILE 299 Cb 1.20 1.74 -0.02 0.00 -1.09 0.00 0.00 36.82 38.65 1sb3 h ILE 299 CO 0.60 0.43 0.35 -0.89 -1.08 0.00 0.00 178.15 177.57 1sb3 s THR 300 N -4.11 4.20 0.71 2.19 2.01 -1.26 -5.02 115.64 114.36 1sb3 s THR 300 Ca -0.03 1.73 -0.15 0.00 0.31 0.00 0.00 61.69 63.54 1sb3 s THR 300 Cb 0.14 -3.92 0.03 0.00 0.01 0.00 0.00 72.50 68.76 1sb3 s THR 300 CO 0.75 0.05 1.19 -0.83 -0.69 0.00 0.00 174.62 175.10 1sb3 s GLY 301 N -1.70 2.34 0.16 4.40 0.00 -1.26 -4.90 107.32 106.36 1sb3 s GLY 301 Ca 0.53 0.83 -0.10 0.00 0.00 0.00 0.00 44.72 45.98 1sb3 s GLY 301 CO 0.22 1.23 1.57 -2.08 0.00 0.00 0.00 173.10 174.04 1sb3 h VAL 302 N -0.17 1.27 -0.14 1.40 2.07 -1.93 -2.50 116.25 116.26 1sb3 h VAL 302 Ca -0.48 -1.32 0.04 0.00 0.82 0.00 0.00 66.70 65.76 1sb3 h VAL 302 Cb 1.29 1.05 -0.05 0.00 -1.52 0.00 0.00 31.29 32.06 1sb3 h VAL 302 CO 0.51 0.46 -0.14 0.50 0.02 0.00 0.00 177.57 178.92 1sb3 h LYS 303 N 0.88 -0.16 -0.05 1.57 3.64 -1.95 -0.26 116.57 120.23 1sb3 h LYS 303 Ca 0.12 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1sb3 h LYS 303 Cb 0.74 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1sb3 h LYS 303 CO 0.06 -0.11 0.01 -0.92 -2.27 0.00 0.00 179.45 176.22 1sb3 h TYR 304 N -0.17 0.08 -0.57 1.91 3.20 -1.96 -1.04 116.97 118.41 1sb3 h TYR 304 Ca 0.10 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.02 1sb3 h TYR 304 Cb 0.31 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 1sb3 h TYR 304 CO -0.26 0.28 0.38 0.00 -1.64 0.00 0.00 178.16 176.92 1sb3 h ARG 305 N -0.14 0.49 0.01 1.82 3.08 -1.12 -1.28 114.38 117.24 1sb3 h ARG 305 Ca 0.01 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 1sb3 h ARG 305 Cb 0.24 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.19 1sb3 h ARG 305 CO 0.00 0.33 -0.48 -0.09 -1.07 0.00 0.00 179.97 178.66 1sb3 h ARG 306 N 0.51 0.30 -0.32 0.04 2.43 -0.92 -2.44 114.38 113.99 1sb3 h ARG 306 Ca 0.25 -0.34 0.07 0.00 -0.81 0.00 0.00 59.98 59.15 1sb3 h ARG 306 Cb 0.34 0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 29.93 1sb3 h ARG 306 CO -0.07 1.05 -0.11 -0.09 -1.51 0.00 0.00 179.97 179.23 1sb3 h ARG 307 N -0.29 -0.05 -0.01 0.20 2.43 -0.71 -1.78 114.38 114.17 1sb3 h ARG 307 Ca -0.06 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 58.98 1sb3 h ARG 307 Cb 1.22 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.76 1sb3 h ARG 307 CO 0.09 -0.03 -0.60 -0.39 -1.51 0.00 0.00 179.97 177.53 1sb3 h VAL 308 N -0.05 1.42 0.01 0.20 -1.51 -1.34 -1.19 116.25 113.79 1sb3 h VAL 308 Ca 0.16 -2.03 0.02 0.00 -1.23 0.00 0.00 66.70 63.61 1sb3 h VAL 308 Cb 0.29 2.09 -0.02 0.00 -2.13 0.00 0.00 31.29 31.52 1sb3 h VAL 308 CO -0.36 0.58 -0.10 0.25 -1.23 0.00 0.00 177.57 176.72 1sb3 h LEU 309 N 0.03 -0.29 -0.29 4.19 5.85 -0.89 0.14 115.31 124.04 1sb3 h LEU 309 Ca -0.01 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1sb3 h LEU 309 Cb 1.06 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 1sb3 h LEU 309 CO 0.08 -0.15 0.12 -0.07 -0.34 0.00 0.00 178.44 178.09 1sb3 h LEU 310 N -0.18 0.40 -0.54 2.25 4.07 -1.23 -2.44 115.31 117.64 1sb3 h LEU 310 Ca 0.03 -0.16 0.05 0.00 0.08 0.00 0.00 57.88 57.88 1sb3 h LEU 310 Cb 0.22 -0.10 -0.05 0.00 1.08 0.00 0.00 40.66 41.81 1sb3 h LEU 310 CO -0.09 0.45 0.28 0.00 -1.08 0.00 0.00 178.44 177.99 1sb3 h ALA 311 N 0.97 0.69 0.00 1.53 0.00 -0.90 -2.37 119.26 119.18 1sb3 h ALA 311 Ca 0.10 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1sb3 h ALA 311 Cb 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1sb3 h ALA 311 CO -0.01 -0.06 -0.01 -0.84 0.00 0.00 0.00 179.25 178.33 1sb3 h ILE 312 N 0.54 0.02 -0.74 0.00 3.07 -0.66 -2.27 117.51 117.48 1sb3 h ILE 312 Ca 0.24 -0.82 -0.06 0.00 1.55 0.00 0.00 64.86 65.77 1sb3 h ILE 312 Cb 0.13 1.80 -0.03 0.00 -0.27 0.00 0.00 36.82 38.46 1sb3 h ILE 312 CO -0.16 0.01 0.22 0.77 -1.05 0.00 0.00 178.15 177.94 1sb3 h SER 313 N 0.00 1.08 0.14 2.16 4.64 -0.93 0.89 113.55 121.53 1sb3 h SER 313 Ca -0.00 -0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 61.11 1sb3 h SER 313 Cb 0.80 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1sb3 h SER 313 CO 0.00 1.00 -0.07 0.03 -0.87 0.00 0.00 176.83 176.93 1sb3 h ARG 314 N 1.10 -0.18 -0.67 4.77 3.08 -1.35 -2.88 114.38 118.24 1sb3 h ARG 314 Ca 0.24 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.44 1sb3 h ARG 314 Cb 0.32 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.31 1sb3 h ARG 314 CO -0.01 0.14 0.13 -0.22 -1.07 0.00 0.00 179.97 178.94 1sb3 h LYS 315 N -0.52 0.23 -0.18 0.04 3.64 -1.06 0.18 116.57 118.90 1sb3 h LYS 315 Ca -0.02 -0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 1sb3 h LYS 315 Cb 0.41 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1sb3 h LYS 315 CO 0.03 0.15 -0.54 -0.24 -2.27 0.00 0.00 179.45 176.58 1sb3 h VAL 316 N 0.24 1.32 -0.24 2.00 3.04 -0.86 -0.05 116.25 121.69 1sb3 h VAL 316 Ca 0.36 -1.79 -0.08 0.00 -1.01 0.00 0.00 66.70 64.19 1sb3 h VAL 316 Cb 0.59 1.77 -0.01 0.00 -2.01 0.00 0.00 31.29 31.63 1sb3 h VAL 316 CO -0.48 0.55 -0.15 0.58 -1.01 0.00 0.00 177.57 177.06 1sb3 h VAL 317 N 0.42 1.31 -0.46 1.51 2.07 -1.16 -2.49 116.25 117.44 1sb3 h VAL 317 Ca 0.01 -1.26 0.08 0.00 0.82 0.00 0.00 66.70 66.35 1sb3 h VAL 317 Cb 1.08 1.60 -0.07 0.00 -1.52 0.00 0.00 31.29 32.38 1sb3 h VAL 317 CO 0.10 0.39 0.08 -0.78 0.02 0.00 0.00 177.57 177.38 1sb3 h ASP 318 N 0.25 -0.03 -0.96 0.57 1.82 -0.56 0.12 116.42 117.63 1sb3 h ASP 318 Ca 0.05 0.09 0.07 0.00 -0.39 0.00 0.00 57.03 56.84 1sb3 h ASP 318 Cb 0.67 0.12 -0.07 0.00 0.68 0.00 0.00 39.33 40.74 1sb3 h ASP 318 CO 0.04 0.02 0.62 1.56 -1.61 0.00 0.00 179.24 179.87 1sb3 h GLN 319 N 0.21 1.08 -0.07 0.28 4.20 -0.87 -0.57 115.11 119.38 1sb3 h GLN 319 Ca 0.23 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 1sb3 h GLN 319 Cb 0.30 -0.24 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1sb3 h GLN 319 CO -0.31 0.72 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.45 1sb3 h LEU 320 N 1.12 0.16 -0.30 1.46 3.38 -0.83 -2.98 115.31 117.30 1sb3 h LEU 320 Ca 0.42 -0.45 0.04 0.00 0.09 0.00 0.00 57.88 57.98 1sb3 h LEU 320 Cb 0.18 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1sb3 h LEU 320 CO -0.18 0.58 0.07 -0.25 0.09 0.00 0.00 178.44 178.75 1sb3 h TRP 321 N -0.26 0.12 -0.00 1.13 2.91 -0.46 -2.19 115.95 117.18 1sb3 h TRP 321 Ca 0.01 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1sb3 h TRP 321 Cb 0.53 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.17 1sb3 h TRP 321 CO 0.08 0.03 0.00 0.39 -1.03 0.00 0.00 178.44 177.91 1sb3 n GLU 322 N -5.08 1.01 0.00 2.65 -0.58 -0.25 -5.10 120.64 113.30 1sb3 n GLU 322 Ca 0.00 -0.02 0.15 0.00 -0.42 0.00 0.00 57.16 56.87 1sb3 n GLU 322 Cb 0.13 -1.03 0.69 0.00 -0.57 0.00 0.00 31.44 30.65 1sb3 n GLU 322 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65