#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bs0 h TRP 3 N 0.00 0.27 -0.13 7.33 4.06 -2.06 -1.52 115.95 123.90 1bs0 h TRP 3 Ca 0.00 -0.03 -0.04 0.00 2.06 0.00 0.00 58.89 60.88 1bs0 h TRP 3 Cb 0.00 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 28.07 1bs0 h TRP 3 CO 0.00 0.37 -0.11 0.37 -3.56 0.00 0.00 178.44 175.51 1bs0 h GLN 4 N 0.09 0.20 -0.26 0.49 5.75 -2.05 -0.53 115.11 118.80 1bs0 h GLN 4 Ca 0.05 -0.04 -0.18 0.00 -0.15 0.00 0.00 58.65 58.33 1bs0 h GLN 4 Cb 0.23 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.75 1bs0 h GLN 4 CO -0.00 0.32 -0.55 0.93 -2.65 0.00 0.00 178.83 176.88 1bs0 h GLU 5 N 0.19 0.78 -0.13 1.69 5.08 -1.96 -0.38 114.58 119.85 1bs0 h GLU 5 Ca 0.04 -0.49 0.02 0.00 -1.00 0.00 0.00 59.36 57.93 1bs0 h GLU 5 Cb 0.33 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1bs0 h GLU 5 CO 0.02 1.12 0.00 -0.22 -1.00 0.00 0.00 179.01 178.93 1bs0 h LYS 6 N 0.59 0.05 0.01 2.33 3.64 -0.37 -0.62 116.57 122.21 1bs0 h LYS 6 Ca 0.01 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1bs0 h LYS 6 Cb 1.14 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1bs0 h LYS 6 CO 0.12 0.03 -0.00 0.82 -2.27 0.00 0.00 179.45 178.14 1bs0 h ILE 7 N 0.05 1.15 -0.77 2.00 1.08 -1.09 -1.75 117.51 118.17 1bs0 h ILE 7 Ca 0.06 -0.47 0.03 0.00 -0.39 0.00 0.00 64.86 64.09 1bs0 h ILE 7 Cb 0.07 1.47 -0.05 0.00 -3.07 0.00 0.00 36.82 35.24 1bs0 h ILE 7 CO -0.10 0.12 0.49 0.78 -0.69 0.00 0.00 178.15 178.75 1bs0 h ASN 8 N -0.21 0.82 -0.57 1.72 2.35 -1.09 -1.67 115.58 116.92 1bs0 h ASN 8 Ca -0.00 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.65 1bs0 h ASN 8 Cb 0.21 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 1bs0 h ASN 8 CO 0.00 0.57 0.02 0.00 -1.65 0.00 0.00 177.43 176.36 1bs0 h ALA 9 N 1.32 0.90 -0.40 -0.83 0.00 -1.03 -0.46 119.26 118.76 1bs0 h ALA 9 Ca 0.30 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1bs0 h ALA 9 Cb -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1bs0 h ALA 9 CO -0.11 0.65 -0.20 0.00 0.00 0.00 0.00 179.25 179.60 1bs0 h ALA 10 N 1.06 0.57 -0.50 0.00 0.00 -1.07 -2.73 119.26 116.60 1bs0 h ALA 10 Ca 0.17 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 1bs0 h ALA 10 Cb 0.52 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1bs0 h ALA 10 CO 0.03 0.53 -0.09 -0.07 0.00 0.00 0.00 179.25 179.64 1bs0 h LEU 11 N 0.66 0.90 -1.14 0.00 3.38 -1.12 -3.16 115.31 114.83 1bs0 h LEU 11 Ca 0.09 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 1bs0 h LEU 11 Cb 0.76 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1bs0 h LEU 11 CO 0.06 1.02 -0.30 0.44 0.09 0.00 0.00 178.44 179.74 1bs0 h ASP 12 N 0.82 0.21 1.34 -0.43 5.19 -1.06 -3.17 116.42 119.33 1bs0 h ASP 12 Ca 0.14 -0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 1bs0 h ASP 12 Cb 0.62 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.07 1bs0 h ASP 12 CO 0.04 0.51 0.00 0.00 -3.12 0.00 0.00 179.24 176.68 1bs0 h ALA 13 N 1.50 1.00 -2.55 3.45 0.00 -1.44 -3.46 119.26 117.77 1bs0 h ALA 13 Ca 0.03 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.41 1bs0 h ALA 13 Cb 0.64 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.47 1bs0 h ALA 13 CO 0.05 0.00 1.06 0.54 0.00 0.00 0.00 179.25 180.90 1bs0 n ARG 14 N -2.65 2.77 -1.59 0.00 1.74 -1.20 -4.98 116.66 110.75 1bs0 n ARG 14 Ca 0.03 1.00 -0.31 0.00 -0.77 0.00 0.00 57.85 57.81 1bs0 n ARG 14 Cb 0.38 -2.88 0.05 0.00 -1.02 0.00 0.00 32.46 29.00 1bs0 n ARG 14 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1bs0 s ARG 15 N 2.04 2.93 0.39 5.56 0.52 -1.26 -4.93 118.95 124.20 1bs0 s ARG 15 Ca 0.79 0.99 0.08 0.00 -0.52 0.00 0.00 55.73 57.07 1bs0 s ARG 15 Cb -0.50 -1.99 0.83 0.00 0.52 0.00 0.00 34.95 33.82 1bs0 s ARG 15 CO 0.35 -1.11 2.00 0.00 0.02 0.00 0.00 175.30 176.56 1bs0 h ALA 16 N -0.65 1.76 0.00 2.13 0.00 -1.97 -2.07 119.26 118.46 1bs0 h ALA 16 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1bs0 h ALA 16 Cb 1.21 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1bs0 h ALA 16 CO 0.56 0.16 -0.06 0.00 0.00 0.00 0.00 179.25 179.91 1bs0 n ALA 17 N -2.47 2.44 0.15 0.00 0.00 -1.26 -3.44 120.51 115.93 1bs0 n ALA 17 Ca 0.08 -0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.49 1bs0 n ALA 17 Cb 0.19 -1.43 0.17 0.00 0.00 0.00 0.00 19.45 18.38 1bs0 n ALA 17 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1bs0 n ASP 18 N -1.65 3.03 -4.78 0.00 5.75 -0.79 -4.64 116.55 113.47 1bs0 n ASP 18 Ca 0.07 -1.88 -0.39 0.00 -0.01 0.00 0.00 54.79 52.57 1bs0 n ASP 18 Cb 0.36 -0.21 -0.06 0.00 -1.03 0.00 0.00 41.12 40.18 1bs0 n ASP 18 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bs0 s ALA 19 N -1.20 3.52 0.14 2.12 0.00 -1.14 -4.91 121.76 120.30 1bs0 s ALA 19 Ca 0.30 0.05 -0.23 0.00 0.00 0.00 0.00 51.96 52.07 1bs0 s ALA 19 Cb 0.17 -2.71 -0.08 0.00 0.00 0.00 0.00 23.12 20.50 1bs0 s ALA 19 CO 0.24 0.26 0.72 -0.51 0.00 0.00 0.00 175.76 176.46 1bs0 s LEU 20 N -0.58 4.57 0.82 0.00 1.43 -1.26 -5.05 118.68 118.60 1bs0 s LEU 20 Ca 0.30 1.54 -0.11 0.00 -1.03 0.00 0.00 54.13 54.83 1bs0 s LEU 20 Cb -0.19 -3.20 0.08 0.00 0.03 0.00 0.00 46.19 42.91 1bs0 s LEU 20 CO 0.18 0.22 1.10 -0.13 0.23 0.00 0.00 176.35 177.95 1bs0 s ARG 21 N -1.17 1.91 0.76 1.70 0.52 -1.26 -4.99 118.95 116.43 1bs0 s ARG 21 Ca 0.34 0.70 -0.15 0.00 -0.52 0.00 0.00 55.73 56.10 1bs0 s ARG 21 Cb -0.22 -1.89 0.06 0.00 0.52 0.00 0.00 34.95 33.41 1bs0 s ARG 21 CO 0.24 -1.75 1.24 1.03 0.02 0.00 0.00 175.30 176.07 1bs0 s ARG 22 N -5.10 1.88 0.34 3.54 1.81 -1.26 -4.94 118.95 115.22 1bs0 s ARG 22 Ca 0.61 1.87 -0.27 0.00 -1.72 0.00 0.00 55.73 56.22 1bs0 s ARG 22 Cb -0.15 -1.79 -0.09 0.00 -0.45 0.00 0.00 34.95 32.47 1bs0 s ARG 22 CO 0.55 -2.06 1.16 1.03 -0.68 0.00 0.00 175.30 175.29 1bs0 s ARG 23 N -3.91 4.33 -0.24 3.54 0.52 -1.26 -5.01 118.95 116.92 1bs0 s ARG 23 Ca 0.76 1.86 -0.07 0.00 -0.52 0.00 0.00 55.73 57.76 1bs0 s ARG 23 Cb -0.32 -2.92 -0.03 0.00 0.52 0.00 0.00 34.95 32.21 1bs0 s ARG 23 CO 0.47 -0.09 0.06 1.52 0.02 0.00 0.00 175.30 177.29 1bs0 s TYR 24 N -1.30 3.10 0.17 -0.53 -0.85 -1.26 -5.07 117.35 111.60 1bs0 s TYR 24 Ca 0.51 -0.37 -0.30 0.00 -0.52 0.00 0.00 57.07 56.39 1bs0 s TYR 24 Cb -0.32 -2.21 -0.07 0.00 0.38 0.00 0.00 41.96 39.74 1bs0 s TYR 24 CO 0.41 -0.30 1.08 -1.25 -1.52 0.00 0.00 175.55 173.97 1bs0 s PRO 25 N 1.45 4.61 0.20 -3.49 0.04 -1.26 -5.05 135.00 131.49 1bs0 s PRO 25 Ca 0.05 1.68 0.11 0.00 0.04 0.00 0.00 61.00 62.88 1bs0 s PRO 25 Cb -0.15 -3.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 1bs0 s PRO 25 CO 0.03 0.10 -0.23 0.14 0.04 0.00 0.00 177.00 177.08 1bs0 s VAL 26 N -0.20 2.27 0.09 -0.36 -7.23 -1.26 -4.46 120.40 109.26 1bs0 s VAL 26 Ca 0.49 -2.04 0.05 0.00 -1.81 0.00 0.00 61.98 58.66 1bs0 s VAL 26 Cb -0.28 -2.09 -0.23 0.00 0.56 0.00 0.00 36.38 34.34 1bs0 s VAL 26 CO 0.34 -0.17 1.18 0.00 -0.31 0.00 0.00 175.10 176.13 1bs0 h ALA 27 N 3.13 0.33 -3.49 1.32 0.00 -0.38 -3.45 119.26 116.72 1bs0 h ALA 27 Ca -0.45 -0.96 -0.27 0.00 0.00 0.00 0.00 54.91 53.23 1bs0 h ALA 27 Cb 1.21 -0.05 -0.32 0.00 0.00 0.00 0.00 17.79 18.63 1bs0 h ALA 27 CO 0.49 1.22 -0.69 -0.65 0.00 0.00 0.00 179.25 179.62 1bs0 s GLN 28 N -2.68 0.01 0.00 0.00 -1.52 -1.16 -4.93 119.66 109.37 1bs0 s GLN 28 Ca -0.01 0.20 0.00 0.00 -1.95 0.00 0.00 55.36 53.60 1bs0 s GLN 28 Cb 0.09 -0.18 0.00 0.00 -0.22 0.00 0.00 33.01 32.70 1bs0 s GLN 28 CO 0.83 -0.13 0.14 0.41 -0.25 0.00 0.00 175.29 176.30 1bs0 n GLY 29 N 3.95 0.28 3.38 3.09 0.00 -1.26 -1.06 105.19 113.57 1bs0 n GLY 29 Ca -0.24 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1bs0 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bs0 s ALA 30 N -0.21 2.67 0.00 4.61 0.00 -1.26 -4.61 121.76 122.96 1bs0 s ALA 30 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1bs0 s ALA 30 Cb 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.85 1bs0 s ALA 30 CO 0.00 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.39 1bs0 n GLY 31 N 3.57 0.01 0.31 0.00 0.00 -1.26 -4.61 105.19 103.20 1bs0 n GLY 31 Ca -0.18 -1.75 -0.06 0.00 0.00 0.00 0.00 46.02 44.03 1bs0 n GLY 31 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1bs0 h ARG 32 N 0.00 0.99 -6.14 1.61 2.43 -1.86 -3.42 114.38 107.99 1bs0 h ARG 32 Ca 0.00 -0.26 -0.69 0.00 -0.81 0.00 0.00 59.98 58.22 1bs0 h ARG 32 Cb 0.00 -0.12 -0.28 0.00 -0.42 0.00 0.00 29.97 29.16 1bs0 h ARG 32 CO 0.00 0.92 -0.83 -1.58 -1.51 0.00 0.00 179.97 176.98 1bs0 s TRP 33 N -5.13 2.56 -0.06 2.20 0.52 -1.26 -0.79 118.94 116.98 1bs0 s TRP 33 Ca -0.11 -0.46 -0.00 0.00 0.02 0.00 0.00 56.10 55.55 1bs0 s TRP 33 Cb 0.15 -1.63 -0.03 0.00 -1.15 0.00 0.00 33.47 30.81 1bs0 s TRP 33 CO 0.83 -0.04 -0.02 -1.17 0.02 0.00 0.00 176.95 176.57 1bs0 s LEU 34 N -0.38 3.42 -0.16 2.99 0.20 0.11 -4.50 118.68 120.36 1bs0 s LEU 34 Ca 0.03 0.05 0.00 0.00 0.69 0.00 0.00 54.13 54.91 1bs0 s LEU 34 Cb -0.12 -1.81 0.03 0.00 -0.43 0.00 0.00 46.19 43.86 1bs0 s LEU 34 CO 0.02 0.35 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.64 1bs0 s VAL 35 N -0.90 1.43 -0.10 1.68 1.01 -0.23 -0.41 120.40 122.88 1bs0 s VAL 35 Ca 0.14 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 1bs0 s VAL 35 Cb -0.11 -1.43 0.03 0.00 0.00 0.00 0.00 36.38 34.86 1bs0 s VAL 35 CO 0.03 0.32 -0.05 0.00 0.00 0.00 0.00 175.10 175.41 1bs0 s ALA 36 N 1.53 1.15 0.00 5.51 0.00 -0.98 0.40 121.76 129.36 1bs0 s ALA 36 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1bs0 s ALA 36 Cb -0.14 -0.87 0.00 0.00 0.00 0.00 0.00 23.12 22.11 1bs0 s ALA 36 CO -0.09 -0.45 0.00 -0.25 0.00 0.00 0.00 175.76 174.97 1bs0 n ASP 37 N 5.00 0.00 -0.23 0.00 8.00 -1.26 -2.07 116.55 126.00 1bs0 n ASP 37 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1bs0 n ASP 37 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 1bs0 n ASP 37 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1bs0 n ASP 38 N 8.74 0.04 -4.74 -2.24 9.92 -1.26 -4.84 116.55 122.16 1bs0 n ASP 38 Ca 0.00 -1.48 -0.36 0.00 -0.53 0.00 0.00 54.79 52.43 1bs0 n ASP 38 Cb 0.00 -0.09 -0.08 0.00 -0.64 0.00 0.00 41.12 40.31 1bs0 n ASP 38 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1bs0 s ARG 39 N -0.03 3.56 -0.09 -1.24 1.81 -0.88 -5.10 118.95 116.99 1bs0 s ARG 39 Ca 0.00 -0.27 -0.21 0.00 -1.72 0.00 0.00 55.73 53.53 1bs0 s ARG 39 Cb 0.00 -3.12 -0.04 0.00 -0.45 0.00 0.00 34.95 31.34 1bs0 s ARG 39 CO 0.00 0.57 0.61 -0.65 -0.68 0.00 0.00 175.30 175.15 1bs0 s GLN 40 N -0.45 4.40 0.04 3.54 -1.52 -1.26 -2.33 119.66 122.08 1bs0 s GLN 40 Ca 0.10 0.71 0.06 0.00 -1.95 0.00 0.00 55.36 54.28 1bs0 s GLN 40 Cb -0.12 -3.44 -0.02 0.00 -0.22 0.00 0.00 33.01 29.21 1bs0 s GLN 40 CO 0.02 0.10 -0.17 0.71 -0.25 0.00 0.00 175.29 175.70 1bs0 s TYR 41 N 0.73 1.46 0.20 0.91 1.51 0.45 -4.94 117.35 117.67 1bs0 s TYR 41 Ca 0.33 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.73 1bs0 s TYR 41 Cb -0.17 -0.87 -0.09 0.00 -0.11 0.00 0.00 41.96 40.72 1bs0 s TYR 41 CO 0.15 0.05 1.43 -0.51 -1.11 0.00 0.00 175.55 175.56 1bs0 s LEU 42 N -1.08 4.39 -0.47 -1.29 1.43 0.33 0.07 118.68 122.06 1bs0 s LEU 42 Ca 0.04 2.56 -0.18 0.00 -1.03 0.00 0.00 54.13 55.51 1bs0 s LEU 42 Cb -0.08 -3.61 0.04 0.00 0.03 0.00 0.00 46.19 42.57 1bs0 s LEU 42 CO 0.01 -0.68 0.55 0.21 0.23 0.00 0.00 176.35 176.67 1bs0 s ASN 43 N 0.60 6.22 -0.31 2.29 3.84 0.03 0.29 114.94 127.90 1bs0 s ASN 43 Ca 0.61 -0.80 0.08 0.00 0.21 0.00 0.00 52.86 52.96 1bs0 s ASN 43 Cb -0.40 -2.26 0.48 0.00 -0.55 0.00 0.00 41.25 38.51 1bs0 s ASN 43 CO 0.38 -0.76 1.41 0.49 -2.79 0.00 0.00 177.10 175.84 1bs0 n PHE 44 N 5.91 1.49 -0.63 0.43 3.72 -0.64 -4.55 117.46 123.19 1bs0 n PHE 44 Ca -0.07 -1.87 0.00 0.00 -0.05 0.00 0.00 57.45 55.47 1bs0 n PHE 44 Cb 0.46 -0.51 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 1bs0 n PHE 44 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1bs0 n SER 45 N -1.01 0.58 -5.00 4.37 3.41 -1.24 -1.53 113.62 113.20 1bs0 n SER 45 Ca 0.36 -1.21 -0.18 0.00 -0.26 0.00 0.00 58.87 57.58 1bs0 n SER 45 Cb 0.94 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.90 1bs0 n SER 45 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1bs0 s SER 46 N -0.21 5.66 -0.08 4.04 1.04 -1.26 -4.93 113.70 117.96 1bs0 s SER 46 Ca 0.00 -0.28 0.19 0.00 0.48 0.00 0.00 55.95 56.34 1bs0 s SER 46 Cb 0.00 -0.84 0.68 0.00 0.10 0.00 0.00 66.02 65.96 1bs0 s SER 46 CO 0.00 -0.76 1.58 0.59 0.98 0.00 0.00 173.24 175.64 1bs0 n ASN 47 N -1.90 4.42 -3.53 7.02 3.02 -1.26 -4.78 115.26 118.25 1bs0 n ASN 47 Ca 0.06 -2.32 -0.40 0.00 -0.03 0.00 0.00 54.58 51.88 1bs0 n ASN 47 Cb 0.59 -0.55 -0.01 0.00 -0.61 0.00 0.00 39.78 39.20 1bs0 n ASN 47 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1bs0 n ASP 48 N 1.22 6.93 0.28 6.41 2.03 -1.26 -3.55 116.55 128.61 1bs0 n ASP 48 Ca 0.25 -2.84 0.14 0.00 0.52 0.00 0.00 54.79 52.86 1bs0 n ASP 48 Cb 0.80 -1.53 0.84 0.00 -0.72 0.00 0.00 41.12 40.51 1bs0 n ASP 48 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 1bs0 h TYR 49 N 5.25 0.00 -0.10 -0.67 0.05 -1.84 -1.63 116.97 118.03 1bs0 h TYR 49 Ca 0.70 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.48 1bs0 h TYR 49 Cb 0.42 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.16 1bs0 h TYR 49 CO 1.63 0.06 0.00 1.28 -1.05 0.00 0.00 178.16 180.08 1bs0 n LEU 50 N -3.67 2.37 -0.47 3.88 4.77 -1.26 -0.55 117.00 122.07 1bs0 n LEU 50 Ca -0.02 -1.20 -0.06 0.00 -0.03 0.00 0.00 56.01 54.70 1bs0 n LEU 50 Cb 0.17 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 1bs0 n LEU 50 CO 0.28 0.48 -0.06 0.61 -1.33 0.00 0.00 177.39 177.37 1bs0 n GLY 51 N 0.79 0.75 0.06 -0.72 0.00 -0.61 -4.43 105.19 101.02 1bs0 n GLY 51 Ca 0.09 -0.78 0.13 0.00 0.00 0.00 0.00 46.02 45.47 1bs0 n GLY 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bs0 n LEU 52 N -0.68 0.51 0.07 0.99 4.32 -1.26 -3.55 117.00 117.40 1bs0 n LEU 52 Ca -0.06 0.47 0.12 0.00 -0.02 0.00 0.00 56.01 56.52 1bs0 n LEU 52 Cb 0.23 -0.36 0.60 0.00 -1.62 0.00 0.00 43.42 42.27 1bs0 n LEU 52 CO 0.09 -0.08 1.14 0.77 -1.22 0.00 0.00 177.39 178.09 1bs0 h SER 53 N 0.00 0.14 -0.47 -1.43 4.64 -1.84 -1.75 113.55 112.84 1bs0 h SER 53 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 1bs0 h SER 53 Cb 0.64 -0.03 -0.08 0.00 -0.31 0.00 0.00 62.40 62.63 1bs0 h SER 53 CO 0.00 0.09 0.09 1.41 -0.87 0.00 0.00 176.83 177.55 1bs0 n HIS 54 N -4.47 1.56 -2.59 4.77 8.25 -1.23 -4.86 115.22 116.65 1bs0 n HIS 54 Ca 0.05 -1.17 -0.42 0.00 -0.26 0.00 0.00 57.72 55.91 1bs0 n HIS 54 Cb 0.31 -0.50 -0.03 0.00 1.12 0.00 0.00 29.99 30.89 1bs0 n HIS 54 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1bs0 s HIS 55 N -3.00 3.58 0.45 4.41 5.04 -0.66 -4.91 115.29 120.21 1bs0 s HIS 55 Ca 0.48 1.55 0.17 0.00 -1.54 0.00 0.00 55.06 55.72 1bs0 s HIS 55 Cb 0.40 -3.24 1.10 0.00 0.04 0.00 0.00 32.58 30.88 1bs0 s HIS 55 CO 0.09 -0.51 1.95 -1.00 -2.34 0.00 0.00 174.74 172.92 1bs0 h PRO 56 N 6.58 0.33 -0.18 2.88 0.13 -1.95 -0.50 132.00 139.30 1bs0 h PRO 56 Ca -0.42 -0.02 -0.20 0.00 -0.87 0.00 0.00 66.00 64.49 1bs0 h PRO 56 Cb 1.22 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1bs0 h PRO 56 CO 0.77 0.22 -0.68 1.96 -0.23 0.00 0.00 178.00 180.04 1bs0 h GLN 57 N 0.34 0.73 -0.26 0.86 4.20 -1.97 0.66 115.11 119.67 1bs0 h GLN 57 Ca 0.32 -0.54 -0.17 0.00 0.06 0.00 0.00 58.65 58.32 1bs0 h GLN 57 Cb 0.78 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.66 1bs0 h GLN 57 CO -0.09 1.16 -0.50 0.82 -0.67 0.00 0.00 178.83 179.56 1bs0 h ILE 58 N 0.53 1.29 -0.36 2.54 2.04 -1.75 -2.02 117.51 119.77 1bs0 h ILE 58 Ca -0.02 -1.69 0.03 0.00 1.00 0.00 0.00 64.86 64.18 1bs0 h ILE 58 Cb 1.29 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 39.03 1bs0 h ILE 58 CO 0.14 0.54 0.16 0.40 0.00 0.00 0.00 178.15 179.39 1bs0 h ILE 59 N 0.56 0.94 -0.86 -0.67 2.04 -1.06 -1.67 117.51 116.79 1bs0 h ILE 59 Ca 0.01 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.80 1bs0 h ILE 59 Cb 1.10 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 1bs0 h ILE 59 CO 0.11 0.06 0.55 -0.09 0.00 0.00 0.00 178.15 178.78 1bs0 h ARG 60 N 0.33 1.02 -0.29 2.37 9.65 -0.80 -1.56 114.38 125.10 1bs0 h ARG 60 Ca 0.16 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.95 1bs0 h ARG 60 Cb 0.10 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 28.44 1bs0 h ARG 60 CO -0.13 0.68 0.07 0.00 2.80 0.00 0.00 179.97 183.38 1bs0 h ALA 61 N 1.36 0.38 -0.84 2.80 0.00 -0.97 0.32 119.26 122.31 1bs0 h ALA 61 Ca 0.35 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.17 1bs0 h ALA 61 Cb 0.04 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 1bs0 h ALA 61 CO -0.13 0.04 0.50 2.35 0.00 0.00 0.00 179.25 182.02 1bs0 h TRP 62 N 0.31 0.91 -0.06 0.00 2.91 -1.09 -0.52 115.95 118.40 1bs0 h TRP 62 Ca 0.09 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 60.06 1bs0 h TRP 62 Cb 0.29 -0.29 0.00 0.00 -0.51 0.00 0.00 29.16 28.66 1bs0 h TRP 62 CO 0.01 0.40 -0.28 1.96 -1.03 0.00 0.00 178.44 179.51 1bs0 h GLN 63 N 0.86 0.30 -0.26 2.65 4.20 -0.47 -3.21 115.11 119.18 1bs0 h GLN 63 Ca 0.39 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.75 1bs0 h GLN 63 Cb 0.31 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1bs0 h GLN 63 CO -0.22 0.88 -0.31 1.96 -0.67 0.00 0.00 178.83 180.47 1bs0 h GLN 64 N -0.20 0.54 -0.01 1.46 4.20 -0.34 -2.98 115.11 117.79 1bs0 h GLN 64 Ca -0.02 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1bs0 h GLN 64 Cb 0.93 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.69 1bs0 h GLN 64 CO 0.06 0.79 0.01 0.78 -0.67 0.00 0.00 178.83 179.80 1bs0 h GLY 65 N 1.04 0.00 1.50 3.46 0.00 -1.16 -0.02 103.07 107.89 1bs0 h GLY 65 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.15 1bs0 h GLY 65 CO 0.06 0.00 -0.99 0.00 0.00 0.00 0.00 176.54 175.61 1bs0 h ALA 66 N 1.99 0.30 -0.56 3.60 0.00 -1.52 0.80 119.26 123.87 1bs0 h ALA 66 Ca 0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 54.17 1bs0 h ALA 66 Cb 0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1bs0 h ALA 66 CO -0.00 0.81 0.25 1.49 0.00 0.00 0.00 179.25 181.80 1bs0 h GLU 67 N 0.24 0.82 -0.11 0.00 4.57 -0.96 -0.37 114.58 118.76 1bs0 h GLU 67 Ca -0.09 -0.13 -0.17 0.00 -1.18 0.00 0.00 59.36 57.79 1bs0 h GLU 67 Cb 1.64 -0.14 0.01 0.00 -0.16 0.00 0.00 28.75 30.09 1bs0 h GLU 67 CO 0.17 0.69 -0.58 0.37 -1.18 0.00 0.00 179.01 178.48 1bs0 h GLN 68 N 0.76 0.60 -0.02 1.92 4.15 -1.07 -3.39 115.11 118.06 1bs0 h GLN 68 Ca 0.19 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 59.12 1bs0 h GLN 68 Cb 0.15 0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.94 1bs0 h GLN 68 CO -0.02 1.11 0.00 1.19 -1.93 0.00 0.00 178.83 179.18 1bs0 n PHE 69 N -4.15 0.02 -4.01 3.99 3.72 0.27 -5.09 117.46 112.21 1bs0 n PHE 69 Ca -0.08 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.13 1bs0 n PHE 69 Cb 0.64 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.17 1bs0 n PHE 69 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bs0 n GLY 70 N -0.09 -1.64 0.21 1.37 0.00 -0.15 -4.82 105.19 100.07 1bs0 n GLY 70 Ca 0.01 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1bs0 n GLY 70 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bs0 n ILE 71 N -0.00 0.00 -1.78 -0.61 2.08 -1.26 -4.19 119.36 113.60 1bs0 n ILE 71 Ca 0.00 0.14 -0.33 0.00 0.56 0.00 0.00 62.75 63.12 1bs0 n ILE 71 Cb 0.00 -1.04 0.05 0.00 -0.75 0.00 0.00 39.64 37.90 1bs0 n ILE 71 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1bs0 s GLY 72 N -2.20 2.19 0.37 7.39 0.00 -1.26 -3.90 107.32 109.92 1bs0 s GLY 72 Ca 0.00 0.57 0.23 0.00 0.00 0.00 0.00 44.72 45.53 1bs0 s GLY 72 CO 0.00 0.92 1.58 1.48 0.00 0.00 0.00 173.10 177.09 1bs0 h SER 73 N 0.09 0.00 0.00 1.64 4.64 -1.82 -3.46 113.55 114.64 1bs0 h SER 73 Ca -0.47 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1bs0 h SER 73 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1bs0 h SER 73 CO 0.54 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.11 1bs0 n GLY 74 N 1.15 0.81 0.00 -0.77 0.00 -1.26 -4.41 105.19 100.70 1bs0 n GLY 74 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1bs0 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bs0 n GLY 75 N -2.01 -0.36 3.91 -0.02 0.00 -1.26 -4.79 105.19 100.65 1bs0 n GLY 75 Ca 0.00 -1.12 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 1bs0 n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bs0 s SER 76 N -4.00 6.16 0.65 1.61 1.04 -1.26 -0.82 113.70 117.08 1bs0 s SER 76 Ca 0.00 0.92 0.43 0.00 0.48 0.00 0.00 55.95 57.78 1bs0 s SER 76 Cb 0.00 -2.17 2.27 0.00 0.10 0.00 0.00 66.02 66.21 1bs0 s SER 76 CO 0.00 -0.67 2.32 1.23 0.98 0.00 0.00 173.24 177.10 1bs0 h GLY 77 N 0.14 0.00 -1.07 7.32 0.00 -1.75 0.11 103.07 107.82 1bs0 h GLY 77 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1bs0 h GLY 77 CO 0.61 0.00 -0.14 1.42 0.00 0.00 0.00 176.54 178.43 1bs0 n HIS 78 N -3.11 0.00 0.00 5.60 8.25 -1.26 -4.23 115.22 120.47 1bs0 n HIS 78 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1bs0 n HIS 78 Cb 0.11 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1bs0 n HIS 78 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1bs0 n VAL 79 N 0.48 0.00 -0.39 1.59 0.31 -1.03 -5.01 118.33 114.27 1bs0 n VAL 79 Ca 0.14 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.57 1bs0 n VAL 79 Cb 0.48 0.00 0.30 0.00 -0.91 0.00 0.00 33.84 33.71 1bs0 n VAL 79 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1bs0 n SER 80 N 0.00 3.93 -1.55 4.52 3.41 -1.24 -4.48 113.62 118.22 1bs0 n SER 80 Ca 0.00 -2.09 0.07 0.00 -0.26 0.00 0.00 58.87 56.59 1bs0 n SER 80 Cb 0.00 -0.46 0.33 0.00 -0.26 0.00 0.00 64.21 63.82 1bs0 n SER 80 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bs0 n GLY 81 N 1.35 2.54 3.33 5.00 0.00 0.36 -4.77 105.19 113.01 1bs0 n GLY 81 Ca 0.23 -0.76 -0.46 0.00 0.00 0.00 0.00 46.02 45.02 1bs0 n GLY 81 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bs0 s TYR 82 N -2.11 3.23 0.46 1.61 5.04 -1.25 -4.33 117.35 120.00 1bs0 s TYR 82 Ca 0.46 -1.28 -0.20 0.00 -2.44 0.00 0.00 57.07 53.61 1bs0 s TYR 82 Cb 0.32 -3.86 -0.10 0.00 0.35 0.00 0.00 41.96 38.67 1bs0 s TYR 82 CO 0.18 -1.09 0.97 0.45 -1.34 0.00 0.00 175.55 174.72 1bs0 s SER 83 N 3.49 6.79 0.55 4.32 0.15 -1.26 -4.96 113.70 122.78 1bs0 s SER 83 Ca 0.07 1.69 0.27 0.00 0.70 0.00 0.00 55.95 58.67 1bs0 s SER 83 Cb -0.27 -2.54 1.45 0.00 -1.71 0.00 0.00 66.02 62.96 1bs0 s SER 83 CO 0.03 -0.46 1.99 -0.37 1.20 0.00 0.00 173.24 175.62 1bs0 h VAL 84 N 1.64 0.63 -0.13 4.45 -1.51 -1.99 -1.17 116.25 118.17 1bs0 h VAL 84 Ca -0.49 0.00 -0.17 0.00 -1.23 0.00 0.00 66.70 64.82 1bs0 h VAL 84 Cb 1.19 0.72 -0.01 0.00 -2.13 0.00 0.00 31.29 31.06 1bs0 h VAL 84 CO 0.61 0.00 -0.63 0.58 -1.23 0.00 0.00 177.57 176.90 1bs0 h VAL 85 N 0.00 1.35 -0.38 7.19 2.07 -1.94 -1.87 116.25 122.68 1bs0 h VAL 85 Ca 0.23 -1.95 -0.05 0.00 0.82 0.00 0.00 66.70 65.75 1bs0 h VAL 85 Cb 0.99 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 1bs0 h VAL 85 CO -0.00 0.59 0.02 0.45 0.02 0.00 0.00 177.57 178.66 1bs0 h HIS 86 N 0.34 0.71 -0.57 1.57 -0.00 -1.61 -1.76 115.15 113.83 1bs0 h HIS 86 Ca -0.01 -0.11 0.00 0.00 -0.00 0.00 0.00 60.37 60.25 1bs0 h HIS 86 Cb 1.18 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 28.37 1bs0 h HIS 86 CO 0.04 0.73 0.37 0.37 -0.00 0.00 0.00 177.93 179.44 1bs0 h GLN 87 N 0.48 0.76 -0.51 2.45 4.15 -1.28 -0.28 115.11 120.88 1bs0 h GLN 87 Ca 0.11 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.44 1bs0 h GLN 87 Cb 0.43 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 1bs0 h GLN 87 CO 0.01 0.51 0.17 0.00 -1.93 0.00 0.00 178.83 177.60 1bs0 h ALA 88 N 1.20 0.67 -0.60 3.38 0.00 -1.29 -0.83 119.26 121.79 1bs0 h ALA 88 Ca 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1bs0 h ALA 88 Cb -0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1bs0 h ALA 88 CO -0.04 0.32 0.38 1.25 0.00 0.00 0.00 179.25 181.16 1bs0 h LEU 89 N 0.70 0.70 -0.24 0.00 6.46 -1.13 0.19 115.31 121.98 1bs0 h LEU 89 Ca 0.17 -0.03 0.04 0.00 -0.12 0.00 0.00 57.88 57.93 1bs0 h LEU 89 Cb 0.26 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 39.98 1bs0 h LEU 89 CO -0.01 0.52 0.03 -0.33 -0.62 0.00 0.00 178.44 178.03 1bs0 h GLU 90 N 0.81 0.11 -0.53 1.25 5.08 -0.66 -0.13 114.58 120.50 1bs0 h GLU 90 Ca 0.22 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.61 1bs0 h GLU 90 Cb -0.07 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1bs0 h GLU 90 CO -0.04 0.07 0.28 0.93 -1.00 0.00 0.00 179.01 179.25 1bs0 h GLU 91 N 0.11 0.53 -0.40 2.33 5.08 -1.01 -1.51 114.58 119.72 1bs0 h GLU 91 Ca 0.11 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1bs0 h GLU 91 Cb 0.12 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1bs0 h GLU 91 CO -0.16 0.35 0.05 0.93 -1.00 0.00 0.00 179.01 179.18 1bs0 h GLU 92 N 0.55 0.67 -0.80 2.33 5.08 -0.54 -1.12 114.58 120.74 1bs0 h GLU 92 Ca 0.23 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1bs0 h GLU 92 Cb 0.12 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1bs0 h GLU 92 CO -0.15 0.73 0.52 -0.07 -1.00 0.00 0.00 179.01 179.04 1bs0 h LEU 93 N 0.51 0.93 -0.44 1.33 3.38 -0.85 -0.68 115.31 119.49 1bs0 h LEU 93 Ca 0.12 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1bs0 h LEU 93 Cb 0.39 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1bs0 h LEU 93 CO 0.01 0.68 0.12 0.00 0.09 0.00 0.00 178.44 179.35 1bs0 h ALA 94 N 1.29 0.58 -0.73 1.53 0.00 -1.12 -1.16 119.26 119.65 1bs0 h ALA 94 Ca 0.29 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1bs0 h ALA 94 Cb -0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1bs0 h ALA 94 CO -0.06 0.24 0.35 1.49 0.00 0.00 0.00 179.25 181.27 1bs0 h GLU 95 N 0.57 1.05 -0.09 0.00 4.22 -1.06 -0.37 114.58 118.90 1bs0 h GLU 95 Ca 0.14 -0.16 -0.00 0.00 0.08 0.00 0.00 59.36 59.42 1bs0 h GLU 95 Cb 0.29 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1bs0 h GLU 95 CO -0.00 0.83 0.05 2.35 -2.18 0.00 0.00 179.01 180.05 1bs0 h TRP 96 N 1.02 0.13 -0.00 0.92 7.01 -0.83 -3.23 115.95 120.98 1bs0 h TRP 96 Ca 0.25 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.25 1bs0 h TRP 96 Cb 0.12 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.14 1bs0 h TRP 96 CO 0.01 0.18 -0.44 1.28 -2.79 0.00 0.00 178.44 176.67 1bs0 n LEU 97 N -4.97 0.45 0.00 0.65 4.77 -0.46 -4.97 117.00 112.47 1bs0 n LEU 97 Ca -0.06 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1bs0 n LEU 97 Cb 0.08 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1bs0 n LEU 97 CO 0.34 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1bs0 n GLY 98 N 1.50 0.97 3.59 -0.72 0.00 -0.21 -5.01 105.19 105.31 1bs0 n GLY 98 Ca 0.06 -0.43 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 1bs0 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bs0 s TYR 99 N -2.00 2.60 0.25 1.61 1.51 -0.84 -5.04 117.35 115.44 1bs0 s TYR 99 Ca 0.00 -0.24 0.08 0.00 -1.01 0.00 0.00 57.07 55.90 1bs0 s TYR 99 Cb 0.00 -1.18 0.28 0.00 -0.11 0.00 0.00 41.96 40.95 1bs0 s TYR 99 CO 0.00 0.61 1.57 0.77 -1.11 0.00 0.00 175.55 177.39 1bs0 h SER 100 N 2.23 0.11 -4.91 2.29 0.02 -1.84 -3.40 113.55 108.05 1bs0 h SER 100 Ca -0.44 -0.07 -0.16 0.00 -0.84 0.00 0.00 61.79 60.28 1bs0 h SER 100 Cb 1.24 -0.03 -0.21 0.00 0.14 0.00 0.00 62.40 63.54 1bs0 h SER 100 CO 0.59 0.72 -0.61 -0.13 -1.14 0.00 0.00 176.83 176.25 1bs0 s ARG 101 N -3.61 0.37 -0.02 3.45 1.81 -0.24 -4.89 118.95 115.82 1bs0 s ARG 101 Ca -0.02 -0.48 0.05 0.00 -1.72 0.00 0.00 55.73 53.55 1bs0 s ARG 101 Cb 0.12 0.14 -0.01 0.00 -0.45 0.00 0.00 34.95 34.75 1bs0 s ARG 101 CO 0.78 -0.07 -0.16 0.00 -0.68 0.00 0.00 175.30 175.16 1bs0 s ALA 102 N -1.35 1.37 -0.10 2.13 0.00 -1.26 -0.50 121.76 122.06 1bs0 s ALA 102 Ca -0.15 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.15 1bs0 s ALA 102 Cb -0.08 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.68 1bs0 s ALA 102 CO 0.00 0.33 -0.21 -0.51 0.00 0.00 0.00 175.76 175.37 1bs0 s LEU 103 N -0.33 1.97 0.29 0.00 1.43 -0.27 -4.81 118.68 116.96 1bs0 s LEU 103 Ca 0.05 -0.50 -0.24 0.00 -1.03 0.00 0.00 54.13 52.41 1bs0 s LEU 103 Cb -0.07 -1.27 -0.09 0.00 0.03 0.00 0.00 46.19 44.79 1bs0 s LEU 103 CO -0.00 0.11 0.86 -0.76 0.23 0.00 0.00 176.35 176.79 1bs0 s LEU 104 N 0.51 4.34 0.21 1.79 1.43 -1.26 -1.02 118.68 124.67 1bs0 s LEU 104 Ca -0.16 1.68 0.03 0.00 -1.03 0.00 0.00 54.13 54.65 1bs0 s LEU 104 Cb -0.17 -3.86 -0.05 0.00 0.03 0.00 0.00 46.19 42.14 1bs0 s LEU 104 CO 0.06 -0.03 0.00 -0.36 0.23 0.00 0.00 176.35 176.25 1bs0 s PHE 105 N -1.59 1.41 -0.60 0.29 0.40 -0.03 -4.95 117.98 112.91 1bs0 s PHE 105 Ca 0.48 -0.97 0.25 0.00 -0.60 0.00 0.00 56.93 56.08 1bs0 s PHE 105 Cb -0.18 -0.81 0.60 0.00 0.51 0.00 0.00 43.02 43.15 1bs0 s PHE 105 CO 0.23 -0.12 1.70 0.97 0.70 0.00 0.00 175.22 178.70 1bs0 h ILE 106 N 2.56 0.00 -2.44 0.64 6.09 -1.91 -1.97 117.51 120.49 1bs0 h ILE 106 Ca -0.38 -0.71 0.15 0.00 -1.37 0.00 0.00 64.86 62.55 1bs0 h ILE 106 Cb 1.22 1.71 -0.09 0.00 0.47 0.00 0.00 36.82 40.12 1bs0 h ILE 106 CO 0.63 0.00 0.44 -0.94 -3.07 0.00 0.00 178.15 175.22 1bs0 s SER 107 N -5.27 -0.23 0.11 2.19 1.04 -1.26 -3.42 113.70 106.85 1bs0 s SER 107 Ca 0.09 -0.35 -0.17 0.00 0.48 0.00 0.00 55.95 55.99 1bs0 s SER 107 Cb 0.09 0.51 -0.05 0.00 0.10 0.00 0.00 66.02 66.67 1bs0 s SER 107 CO 0.63 -0.92 1.59 1.23 0.98 0.00 0.00 173.24 176.75 1bs0 h GLY 108 N 2.00 0.55 0.29 7.32 0.00 -1.91 -1.08 103.07 110.24 1bs0 h GLY 108 Ca -0.24 -0.35 0.10 0.00 0.00 0.00 0.00 47.33 46.84 1bs0 h GLY 108 CO 0.26 0.33 0.11 0.74 0.00 0.00 0.00 176.54 177.99 1bs0 h PHE 109 N 0.35 0.18 -0.54 5.60 -1.00 -1.97 -0.71 116.94 118.85 1bs0 h PHE 109 Ca 0.10 0.03 -0.05 0.00 2.81 0.00 0.00 57.97 60.86 1bs0 h PHE 109 Cb 0.32 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.85 1bs0 h PHE 109 CO 0.02 -0.01 0.14 0.00 -1.61 0.00 0.00 178.31 176.85 1bs0 h ALA 110 N 1.42 0.71 0.42 2.45 0.00 -1.88 -1.46 119.26 120.93 1bs0 h ALA 110 Ca 0.28 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1bs0 h ALA 110 Cb 0.39 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1bs0 h ALA 110 CO -0.36 0.40 -0.20 0.00 0.00 0.00 0.00 179.25 179.09 1bs0 h ALA 111 N 1.02 -0.57 -0.68 0.00 0.00 -0.77 -0.88 119.26 117.37 1bs0 h ALA 111 Ca 0.17 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1bs0 h ALA 111 Cb 0.32 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 1bs0 h ALA 111 CO -0.00 -0.75 0.34 -0.91 0.00 0.00 0.00 179.25 177.93 1bs0 h ASN 112 N -0.71 0.46 -0.09 0.00 2.35 -1.16 -0.98 115.58 115.45 1bs0 h ASN 112 Ca -0.06 0.05 -0.16 0.00 -0.55 0.00 0.00 56.30 55.59 1bs0 h ASN 112 Cb 0.51 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1bs0 h ASN 112 CO 0.10 0.27 -0.50 -0.61 -1.65 0.00 0.00 177.43 175.04 1bs0 h GLN 113 N 0.60 0.66 -0.20 0.81 5.75 -1.25 -2.34 115.11 119.14 1bs0 h GLN 113 Ca 0.33 -0.39 -0.11 0.00 -0.15 0.00 0.00 58.65 58.33 1bs0 h GLN 113 Cb 0.32 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.89 1bs0 h GLN 113 CO -0.25 1.00 -0.35 0.00 -2.65 0.00 0.00 178.83 176.59 1bs0 h ALA 114 N 0.93 1.02 -0.13 3.38 0.00 -0.44 0.73 119.26 124.74 1bs0 h ALA 114 Ca 0.02 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 1bs0 h ALA 114 Cb 1.05 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1bs0 h ALA 114 CO 0.10 0.60 -0.10 0.28 0.00 0.00 0.00 179.25 180.13 1bs0 h VAL 115 N 0.37 1.34 -0.44 0.00 2.07 -1.15 -2.14 116.25 116.30 1bs0 h VAL 115 Ca 0.04 -1.20 -0.13 0.00 0.82 0.00 0.00 66.70 66.23 1bs0 h VAL 115 Cb 0.79 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 1bs0 h VAL 115 CO 0.06 0.35 -0.24 0.40 0.02 0.00 0.00 177.57 178.16 1bs0 h ILE 116 N -0.07 1.27 -0.62 4.57 2.04 -1.35 -0.32 117.51 123.04 1bs0 h ILE 116 Ca 0.03 -1.40 -0.07 0.00 1.00 0.00 0.00 64.86 64.42 1bs0 h ILE 116 Cb 0.59 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 1bs0 h ILE 116 CO 0.03 0.47 0.11 0.00 0.00 0.00 0.00 178.15 178.76 1bs0 h ALA 117 N 0.93 1.03 0.01 1.87 0.00 -0.90 -1.71 119.26 120.50 1bs0 h ALA 117 Ca 0.10 -0.25 -0.21 0.00 0.00 0.00 0.00 54.91 54.54 1bs0 h ALA 117 Cb 0.80 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1bs0 h ALA 117 CO 0.07 0.62 -0.93 0.00 0.00 0.00 0.00 179.25 179.01 1bs0 h ALA 118 N 1.17 0.43 0.00 0.00 0.00 -1.10 -3.38 119.26 116.39 1bs0 h ALA 118 Ca 0.19 -0.73 -0.17 0.00 0.00 0.00 0.00 54.91 54.20 1bs0 h ALA 118 Cb 0.40 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1bs0 h ALA 118 CO 0.01 0.88 -2.07 -1.33 0.00 0.00 0.00 179.25 176.75 1bs0 n MET 119 N -3.68 0.67 -3.96 0.00 2.81 -0.15 -4.95 117.12 107.85 1bs0 n MET 119 Ca -0.05 -0.07 -0.35 0.00 -1.81 0.00 0.00 57.70 55.42 1bs0 n MET 119 Cb 0.83 -1.56 -0.08 0.00 -0.71 0.00 0.00 33.22 31.70 1bs0 n MET 119 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1bs0 s MET 120 N -3.04 3.75 0.53 0.03 1.00 -0.65 -5.07 119.30 115.85 1bs0 s MET 120 Ca -0.08 -0.27 0.07 0.00 0.00 0.00 0.00 55.69 55.41 1bs0 s MET 120 Cb 0.10 -3.19 0.05 0.00 0.00 0.00 0.00 34.83 31.78 1bs0 s MET 120 CO 0.86 0.47 0.55 0.00 0.00 0.00 0.00 175.02 176.91 1bs0 s ALA 121 N -0.17 4.49 0.54 3.03 0.00 -1.26 -4.70 121.76 123.68 1bs0 s ALA 121 Ca 0.09 -1.69 0.19 0.00 0.00 0.00 0.00 51.96 50.55 1bs0 s ALA 121 Cb -0.12 -1.07 1.40 0.00 0.00 0.00 0.00 23.12 23.33 1bs0 s ALA 121 CO 0.01 -0.56 2.17 1.57 0.00 0.00 0.00 175.76 178.95 1bs0 h LYS 122 N 0.57 0.00 0.00 0.00 2.10 -1.95 -1.11 116.57 116.18 1bs0 h LYS 122 Ca -0.35 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.27 1bs0 h LYS 122 Cb 1.29 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1bs0 h LYS 122 CO 0.51 0.00 -0.13 0.93 -2.00 0.00 0.00 179.45 178.75 1bs0 h GLU 123 N 0.00 0.00 -7.26 0.07 3.07 -1.93 -3.36 114.58 105.17 1bs0 h GLU 123 Ca 0.00 0.00 -0.45 0.00 -0.50 0.00 0.00 59.36 58.41 1bs0 h GLU 123 Cb 0.02 0.00 0.09 0.00 -0.84 0.00 0.00 28.75 28.01 1bs0 h GLU 123 CO -0.00 0.13 0.19 -0.51 -1.40 0.00 0.00 179.01 177.42 1bs0 s ASP 124 N -6.03 4.58 -0.04 1.42 1.01 -0.42 -1.65 116.67 115.54 1bs0 s ASP 124 Ca 0.02 0.20 0.03 0.00 0.71 0.00 0.00 52.55 53.51 1bs0 s ASP 124 Cb 0.09 -0.76 0.00 0.00 1.01 0.00 0.00 42.92 43.27 1bs0 s ASP 124 CO 0.61 -1.73 -0.12 -0.60 0.21 0.00 0.00 175.17 173.54 1bs0 s ARG 125 N -5.24 1.39 -0.20 8.23 3.52 -0.66 -1.34 118.95 124.66 1bs0 s ARG 125 Ca 0.63 -0.43 -0.08 0.00 -0.13 0.00 0.00 55.73 55.72 1bs0 s ARG 125 Cb -0.09 -1.22 -0.04 0.00 -1.56 0.00 0.00 34.95 32.04 1bs0 s ARG 125 CO 0.45 0.14 0.08 0.42 -0.81 0.00 0.00 175.30 175.58 1bs0 s ILE 126 N 0.24 4.91 -0.41 4.11 1.01 0.18 -1.34 121.20 129.90 1bs0 s ILE 126 Ca -0.06 0.01 -0.10 0.00 0.00 0.00 0.00 60.65 60.50 1bs0 s ILE 126 Cb -0.11 -3.23 0.07 0.00 0.01 0.00 0.00 42.46 39.20 1bs0 s ILE 126 CO 0.02 0.44 0.26 0.00 0.00 0.00 0.00 174.94 175.66 1bs0 s ALA 127 N 0.52 3.31 -0.04 9.38 0.00 -0.30 -0.51 121.76 134.13 1bs0 s ALA 127 Ca 0.04 -2.05 0.07 0.00 0.00 0.00 0.00 51.96 50.02 1bs0 s ALA 127 Cb -0.12 -2.68 -0.02 0.00 0.00 0.00 0.00 23.12 20.29 1bs0 s ALA 127 CO 0.01 -1.60 -0.24 0.00 0.00 0.00 0.00 175.76 173.93 1bs0 s ALA 128 N 1.48 2.25 0.27 0.00 0.00 -0.35 -1.36 121.76 124.04 1bs0 s ALA 128 Ca 0.03 -1.07 -0.30 0.00 0.00 0.00 0.00 51.96 50.61 1bs0 s ALA 128 Cb -0.22 -0.66 -0.12 0.00 0.00 0.00 0.00 23.12 22.11 1bs0 s ALA 128 CO 0.04 0.49 1.51 -3.47 0.00 0.00 0.00 175.76 174.33 1bs0 n ASP 129 N 2.60 3.35 0.26 0.00 -0.08 -1.09 -1.09 116.55 120.50 1bs0 n ASP 129 Ca -0.17 1.15 0.10 0.00 -1.51 0.00 0.00 54.79 54.36 1bs0 n ASP 129 Cb 0.51 -1.52 0.69 0.00 2.34 0.00 0.00 41.12 43.15 1bs0 n ASP 129 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1bs0 h ARG 130 N 4.47 0.00 -0.62 -0.67 2.43 -1.30 -1.64 114.38 117.05 1bs0 h ARG 130 Ca -0.46 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.70 1bs0 h ARG 130 Cb 1.25 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1bs0 h ARG 130 CO 0.77 0.05 0.01 1.28 -1.51 0.00 0.00 179.97 180.57 1bs0 n LEU 131 N -4.22 5.47 -4.70 3.80 4.77 -1.26 -4.98 117.00 115.87 1bs0 n LEU 131 Ca -0.03 -2.78 -0.40 0.00 -0.03 0.00 0.00 56.01 52.78 1bs0 n LEU 131 Cb 0.13 -0.68 0.03 0.00 -2.33 0.00 0.00 43.42 40.57 1bs0 n LEU 131 CO 0.32 0.61 0.87 -1.20 -1.33 0.00 0.00 177.39 176.67 1bs0 n SER 132 N 0.56 2.36 -4.81 -1.43 7.64 -0.62 -4.80 113.62 112.52 1bs0 n SER 132 Ca 0.26 1.02 -0.29 0.00 1.01 0.00 0.00 58.87 60.87 1bs0 n SER 132 Cb 1.15 -1.51 0.11 0.00 -1.01 0.00 0.00 64.21 62.94 1bs0 n SER 132 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 1bs0 s HIS 133 N -1.28 2.73 0.33 1.43 -3.43 -1.26 -4.65 115.29 109.16 1bs0 s HIS 133 Ca 0.67 0.95 0.02 0.00 -0.80 0.00 0.00 55.06 55.90 1bs0 s HIS 133 Cb -0.46 -3.29 0.57 0.00 -1.43 0.00 0.00 32.58 27.97 1bs0 s HIS 133 CO 0.53 -2.02 1.94 0.00 -2.00 0.00 0.00 174.74 173.19 1bs0 h ALA 134 N -1.25 1.43 -0.78 -1.38 0.00 -1.98 -1.17 119.26 114.13 1bs0 h ALA 134 Ca -0.48 -0.11 0.18 0.00 0.00 0.00 0.00 54.91 54.50 1bs0 h ALA 134 Cb 1.31 -0.23 -0.12 0.00 0.00 0.00 0.00 17.79 18.75 1bs0 h ALA 134 CO 0.62 0.45 0.17 1.03 0.00 0.00 0.00 179.25 181.52 1bs0 h SER 135 N 0.78 -0.05 0.00 0.00 0.87 -1.96 0.30 113.55 113.50 1bs0 h SER 135 Ca 0.20 0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.90 1bs0 h SER 135 Cb 0.08 0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1bs0 h SER 135 CO -0.03 -0.09 -0.17 0.25 -0.53 0.00 0.00 176.83 176.26 1bs0 h LEU 136 N 0.23 0.00 -0.69 2.23 6.46 -1.73 -3.28 115.31 118.53 1bs0 h LEU 136 Ca 0.45 -0.35 0.05 0.00 -0.12 0.00 0.00 57.88 57.92 1bs0 h LEU 136 Cb 0.82 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.70 1bs0 h LEU 136 CO -0.57 0.77 0.40 -0.07 -0.62 0.00 0.00 178.44 178.35 1bs0 h LEU 137 N -1.00 0.62 -0.76 2.25 3.38 -1.07 -0.98 115.31 117.74 1bs0 h LEU 137 Ca -0.03 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1bs0 h LEU 137 Cb 0.48 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1bs0 h LEU 137 CO -0.02 0.41 0.47 -0.33 0.09 0.00 0.00 178.44 179.07 1bs0 h GLU 138 N 0.76 1.03 -0.86 1.13 4.39 -0.58 0.24 114.58 120.69 1bs0 h GLU 138 Ca 0.30 -0.09 0.07 0.00 0.34 0.00 0.00 59.36 59.98 1bs0 h GLU 138 Cb 0.13 -0.22 -0.06 0.00 -0.10 0.00 0.00 28.75 28.50 1bs0 h GLU 138 CO -0.16 0.71 0.53 0.00 -1.16 0.00 0.00 179.01 178.93 1bs0 h ALA 139 N 1.25 1.18 0.00 3.43 0.00 -1.31 -1.42 119.26 122.40 1bs0 h ALA 139 Ca 0.27 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 1bs0 h ALA 139 Cb -0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1bs0 h ALA 139 CO -0.05 0.26 -0.63 0.00 0.00 0.00 0.00 179.25 178.83 1bs0 h ALA 140 N 1.41 0.88 -0.13 0.00 0.00 -0.00 -3.18 119.26 118.24 1bs0 h ALA 140 Ca 0.38 -0.57 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1bs0 h ALA 140 Cb 0.20 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1bs0 h ALA 140 CO -0.18 0.78 -0.06 1.03 0.00 0.00 0.00 179.25 180.82 1bs0 h SER 141 N 0.00 0.28 0.00 0.00 0.87 -0.18 -3.28 113.55 111.24 1bs0 h SER 141 Ca -0.01 -0.41 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1bs0 h SER 141 Cb 1.17 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1bs0 h SER 141 CO 0.08 0.63 0.00 0.18 -0.53 0.00 0.00 176.83 177.19 1bs0 n LEU 142 N -4.68 1.09 -4.80 2.23 4.77 -0.57 -4.79 117.00 110.24 1bs0 n LEU 142 Ca -0.06 -0.55 -0.27 0.00 -0.03 0.00 0.00 56.01 55.10 1bs0 n LEU 142 Cb 0.28 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.83 1bs0 n LEU 142 CO 0.37 0.26 -0.22 -0.55 -1.33 0.00 0.00 177.39 175.92 1bs0 s SER 143 N 0.04 5.58 0.04 -1.43 0.15 -1.23 -5.01 113.70 111.84 1bs0 s SER 143 Ca 0.00 -0.08 0.28 0.00 0.70 0.00 0.00 55.95 56.86 1bs0 s SER 143 Cb 0.00 -1.49 1.11 0.00 -1.71 0.00 0.00 66.02 63.93 1bs0 s SER 143 CO 0.00 0.09 1.86 -0.81 1.20 0.00 0.00 173.24 175.59 1bs0 n PRO 144 N -0.16 0.05 -0.84 5.44 -0.04 -1.26 -4.82 135.00 133.36 1bs0 n PRO 144 Ca -0.08 0.04 -0.29 0.00 -0.04 0.00 0.00 63.50 63.12 1bs0 n PRO 144 Cb 0.54 -1.56 0.19 0.00 -0.04 0.00 0.00 33.50 32.64 1bs0 n PRO 144 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1bs0 s SER 145 N -3.29 2.24 -0.16 3.54 1.04 -1.22 -4.27 113.70 111.57 1bs0 s SER 145 Ca 0.13 1.59 -0.29 0.00 0.48 0.00 0.00 55.95 57.85 1bs0 s SER 145 Cb 0.18 -2.25 -0.00 0.00 0.10 0.00 0.00 66.02 64.04 1bs0 s SER 145 CO 0.55 -3.43 1.07 -1.58 0.98 0.00 0.00 173.24 170.84 1bs0 s GLN 146 N -4.70 4.32 -0.23 4.02 0.74 -0.45 -4.91 119.66 118.46 1bs0 s GLN 146 Ca 0.66 1.44 -0.09 0.00 0.05 0.00 0.00 55.36 57.42 1bs0 s GLN 146 Cb -0.22 -3.61 -0.04 0.00 1.10 0.00 0.00 33.01 30.24 1bs0 s GLN 146 CO 0.60 -0.52 0.12 -1.17 -0.55 0.00 0.00 175.29 173.77 1bs0 s LEU 147 N 2.75 3.87 -0.10 3.68 2.96 -1.26 0.52 118.68 131.10 1bs0 s LEU 147 Ca 0.48 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.42 1bs0 s LEU 147 Cb -0.18 -2.03 0.01 0.00 0.50 0.00 0.00 46.19 44.50 1bs0 s LEU 147 CO 0.12 0.06 -0.14 -0.13 -1.32 0.00 0.00 176.35 174.94 1bs0 s ARG 148 N 1.08 2.06 0.24 1.98 1.81 0.33 -4.96 118.95 121.48 1bs0 s ARG 148 Ca 0.06 -0.51 -0.10 0.00 -1.72 0.00 0.00 55.73 53.46 1bs0 s ARG 148 Cb -0.14 -1.74 -0.07 0.00 -0.45 0.00 0.00 34.95 32.54 1bs0 s ARG 148 CO 0.04 -0.04 0.56 1.03 -0.68 0.00 0.00 175.30 176.22 1bs0 s ARG 149 N 0.91 3.81 0.13 3.54 0.52 -1.26 -1.21 118.95 125.38 1bs0 s ARG 149 Ca -0.09 0.29 0.10 0.00 -0.52 0.00 0.00 55.73 55.52 1bs0 s ARG 149 Cb -0.15 -2.63 -0.04 0.00 0.52 0.00 0.00 34.95 32.65 1bs0 s ARG 149 CO 0.00 0.30 -0.23 -0.59 0.02 0.00 0.00 175.30 174.81 1bs0 s PHE 150 N -1.84 2.42 0.42 -0.53 -0.71 -0.25 -4.87 117.98 112.63 1bs0 s PHE 150 Ca 0.48 -0.32 -0.24 0.00 -1.04 0.00 0.00 56.93 55.81 1bs0 s PHE 150 Cb -0.11 -1.29 -0.11 0.00 -1.21 0.00 0.00 43.02 40.30 1bs0 s PHE 150 CO 0.21 0.37 0.87 0.00 -1.34 0.00 0.00 175.22 175.33 1bs0 n ALA 151 N 0.82 -0.35 -1.59 1.99 0.00 -1.26 -0.91 120.51 119.21 1bs0 n ALA 151 Ca -0.17 0.21 -0.55 0.00 0.00 0.00 0.00 53.44 52.93 1bs0 n ALA 151 Cb 0.53 -1.99 -0.07 0.00 0.00 0.00 0.00 19.45 17.92 1bs0 n ALA 151 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1bs0 n HIS 152 N -0.64 1.87 -1.56 0.00 -0.00 -1.26 -1.28 115.22 112.35 1bs0 n HIS 152 Ca 0.10 0.41 -0.19 0.00 0.46 0.00 0.00 57.72 58.50 1bs0 n HIS 152 Cb 0.39 -2.49 -0.08 0.00 -0.12 0.00 0.00 29.99 27.69 1bs0 n HIS 152 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 1bs0 n ASN 153 N 7.20 -5.14 -4.37 0.26 3.02 -1.26 -4.91 115.26 110.05 1bs0 n ASN 153 Ca 0.33 0.48 -0.45 0.00 -0.03 0.00 0.00 54.58 54.91 1bs0 n ASN 153 Cb 0.17 -4.56 -0.04 0.00 -0.61 0.00 0.00 39.78 34.74 1bs0 n ASN 153 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1bs0 s ASP 154 N -2.65 6.41 0.43 6.41 -1.08 -0.40 -4.87 116.67 120.93 1bs0 s ASP 154 Ca 0.00 -1.91 0.22 0.00 -0.52 0.00 0.00 52.55 50.34 1bs0 s ASP 154 Cb 0.00 -2.29 0.97 0.00 -1.46 0.00 0.00 42.92 40.15 1bs0 s ASP 154 CO 0.00 -0.94 1.87 0.58 0.52 0.00 0.00 175.17 177.20 1bs0 h VAL 155 N 5.61 0.77 -0.28 1.11 2.07 -1.91 -1.93 116.25 121.69 1bs0 h VAL 155 Ca -0.11 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.29 1bs0 h VAL 155 Cb 1.07 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 1bs0 h VAL 155 CO 1.01 0.26 0.06 0.74 0.02 0.00 0.00 177.57 179.65 1bs0 h THR 156 N 0.00 1.22 -0.53 2.57 2.02 -1.98 -0.92 112.91 115.29 1bs0 h THR 156 Ca -0.00 -0.76 -0.01 0.00 0.77 0.00 0.00 66.41 66.41 1bs0 h THR 156 Cb 0.66 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 1bs0 h THR 156 CO 0.03 0.25 0.29 0.45 0.37 0.00 0.00 175.52 176.91 1bs0 h HIS 157 N 0.29 0.73 -0.07 3.16 3.86 -1.83 -2.07 115.15 119.21 1bs0 h HIS 157 Ca 0.09 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1bs0 h HIS 157 Cb 0.32 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.55 1bs0 h HIS 157 CO 0.02 0.54 0.03 1.25 0.86 0.00 0.00 177.93 180.63 1bs0 h LEU 158 N 0.71 0.10 -0.85 2.43 5.85 -1.35 -1.29 115.31 120.92 1bs0 h LEU 158 Ca 0.19 -0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.88 1bs0 h LEU 158 Cb 0.05 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 40.98 1bs0 h LEU 158 CO -0.03 0.20 0.49 0.00 -0.34 0.00 0.00 178.44 178.76 1bs0 h ALA 159 N 0.90 1.22 -0.07 1.25 0.00 -1.02 0.90 119.26 122.44 1bs0 h ALA 159 Ca 0.03 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1bs0 h ALA 159 Cb 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1bs0 h ALA 159 CO -0.00 0.11 -0.11 0.00 0.00 0.00 0.00 179.25 179.24 1bs0 h ARG 160 N 0.81 -0.15 -0.20 0.00 3.08 -1.11 -0.43 114.38 116.38 1bs0 h ARG 160 Ca 0.41 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.53 1bs0 h ARG 160 Cb 0.39 0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.40 1bs0 h ARG 160 CO -0.25 -0.10 -0.33 -0.07 -1.07 0.00 0.00 179.97 178.14 1bs0 h LEU 161 N -0.16 -1.06 -1.45 3.04 4.07 -0.30 -2.72 115.31 116.72 1bs0 h LEU 161 Ca 0.07 0.16 -0.05 0.00 0.08 0.00 0.00 57.88 58.14 1bs0 h LEU 161 Cb 0.25 0.46 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 1bs0 h LEU 161 CO -0.17 -0.36 -0.22 -0.07 -1.08 0.00 0.00 178.44 176.55 1bs0 h LEU 162 N -0.37 0.00 -0.58 1.67 3.38 -0.15 -2.38 115.31 116.88 1bs0 h LEU 162 Ca 0.11 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 1bs0 h LEU 162 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1bs0 h LEU 162 CO -0.41 0.22 -0.31 0.00 0.09 0.00 0.00 178.44 178.03 1bs0 h ALA 163 N 1.78 0.89 -2.75 1.53 0.00 -0.81 -3.45 119.26 116.46 1bs0 h ALA 163 Ca -0.00 -0.28 -0.53 0.00 0.00 0.00 0.00 54.91 54.09 1bs0 h ALA 163 Cb 0.58 -0.05 0.08 0.00 0.00 0.00 0.00 17.79 18.40 1bs0 h ALA 163 CO 0.03 0.39 0.90 0.45 0.00 0.00 0.00 179.25 181.02 1bs0 n SER 164 N -3.30 3.88 -4.62 0.00 2.88 -0.90 -4.89 113.62 106.66 1bs0 n SER 164 Ca 0.01 1.13 -0.49 0.00 -1.33 0.00 0.00 58.87 58.19 1bs0 n SER 164 Cb 0.56 -1.59 -0.05 0.00 -0.75 0.00 0.00 64.21 62.38 1bs0 n SER 164 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1bs0 n PRO 165 N 2.48 1.58 -5.18 -1.46 -0.02 -1.26 -5.00 135.00 126.14 1bs0 n PRO 165 Ca 0.10 0.57 -0.31 0.00 -2.02 0.00 0.00 63.50 61.84 1bs0 n PRO 165 Cb 0.36 -2.26 -0.16 0.00 -0.02 0.00 0.00 33.50 31.42 1bs0 n PRO 165 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bs0 n PRO 167 N 3.07 0.06 0.00 0.00 -0.04 -1.25 -4.86 135.00 131.97 1bs0 n PRO 167 Ca -0.18 0.21 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1bs0 n PRO 167 Cb 0.52 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 1bs0 n PRO 167 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bs0 n GLY 168 N 0.51 5.48 3.96 0.55 0.00 -0.66 -4.90 105.19 110.14 1bs0 n GLY 168 Ca 0.04 -1.20 -0.20 0.00 0.00 0.00 0.00 46.02 44.66 1bs0 n GLY 168 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bs0 s GLN 169 N 4.32 3.25 -0.07 1.61 -1.52 -1.26 -4.90 119.66 121.08 1bs0 s GLN 169 Ca 0.00 -0.90 0.04 0.00 -1.95 0.00 0.00 55.36 52.54 1bs0 s GLN 169 Cb 0.00 -2.82 -0.02 0.00 -0.22 0.00 0.00 33.01 29.95 1bs0 s GLN 169 CO 0.00 0.27 -0.18 -0.65 -0.25 0.00 0.00 175.29 174.49 1bs0 s GLN 170 N -4.04 2.74 -0.18 2.91 -0.21 -1.26 -1.65 119.66 117.97 1bs0 s GLN 170 Ca 0.38 -0.77 -0.01 0.00 0.02 0.00 0.00 55.36 54.98 1bs0 s GLN 170 Cb -0.09 -2.36 -0.00 0.00 1.00 0.00 0.00 33.01 31.55 1bs0 s GLN 170 CO 0.29 0.43 -0.11 1.41 -2.12 0.00 0.00 175.29 175.19 1bs0 s MET 171 N -0.25 3.28 -0.06 2.91 -2.45 -0.45 -2.10 119.30 120.17 1bs0 s MET 171 Ca 0.00 -0.70 -0.21 0.00 -1.25 0.00 0.00 55.69 53.53 1bs0 s MET 171 Cb -0.13 -2.77 -0.04 0.00 1.25 0.00 0.00 34.83 33.14 1bs0 s MET 171 CO 0.03 -0.06 0.61 0.08 1.05 0.00 0.00 175.02 176.73 1bs0 s VAL 172 N 1.04 5.05 -0.03 10.11 1.01 -0.41 -1.15 120.40 136.01 1bs0 s VAL 172 Ca -0.01 1.26 0.06 0.00 0.00 0.00 0.00 61.98 63.29 1bs0 s VAL 172 Cb -0.15 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.27 1bs0 s VAL 172 CO -0.02 0.32 -0.20 0.68 0.00 0.00 0.00 175.10 175.87 1bs0 s VAL 173 N 0.48 1.64 0.30 2.92 -7.23 -0.46 -0.09 120.40 117.95 1bs0 s VAL 173 Ca 0.33 -0.86 -0.15 0.00 -1.81 0.00 0.00 61.98 59.49 1bs0 s VAL 173 Cb -0.17 -1.38 0.02 0.00 0.56 0.00 0.00 36.38 35.41 1bs0 s VAL 173 CO 0.16 0.46 0.63 0.28 -0.31 0.00 0.00 175.10 176.32 1bs0 s THR 174 N -0.25 0.00 0.14 5.32 -1.32 -0.78 -2.67 115.64 116.08 1bs0 s THR 174 Ca 0.02 -1.20 0.03 0.00 -1.21 0.00 0.00 61.69 59.33 1bs0 s THR 174 Cb -0.10 -2.33 -0.04 0.00 -1.51 0.00 0.00 72.50 68.52 1bs0 s THR 174 CO 0.01 0.00 0.21 -1.61 -2.21 0.00 0.00 174.62 171.02 1bs0 s GLU 175 N -3.51 3.21 -0.01 7.08 2.02 -1.26 -1.18 118.70 125.05 1bs0 s GLU 175 Ca 0.18 -0.68 -0.21 0.00 0.02 0.00 0.00 54.97 54.28 1bs0 s GLU 175 Cb -0.03 -2.85 -0.24 0.00 0.10 0.00 0.00 34.13 31.10 1bs0 s GLU 175 CO 0.10 0.52 1.06 0.78 0.02 0.00 0.00 175.26 177.75 1bs0 h GLY 176 N 2.46 0.40 -5.77 -1.39 0.00 -1.25 -3.37 103.07 94.15 1bs0 h GLY 176 Ca -0.48 -0.73 -0.64 0.00 0.00 0.00 0.00 47.33 45.49 1bs0 h GLY 176 CO 0.67 0.64 -0.86 0.14 0.00 0.00 0.00 176.54 177.14 1bs0 s VAL 177 N -3.10 1.83 0.07 4.60 1.01 -1.26 -2.47 120.40 121.08 1bs0 s VAL 177 Ca -0.14 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.69 1bs0 s VAL 177 Cb 0.03 -1.63 -0.06 0.00 0.00 0.00 0.00 36.38 34.72 1bs0 s VAL 177 CO 0.81 0.51 1.15 -0.36 0.00 0.00 0.00 175.10 177.21 1bs0 s PHE 178 N 0.82 3.50 0.43 5.22 0.40 0.10 -4.47 117.98 123.98 1bs0 s PHE 178 Ca -0.08 1.41 0.14 0.00 -0.60 0.00 0.00 56.93 57.79 1bs0 s PHE 178 Cb -0.16 -3.35 1.02 0.00 0.51 0.00 0.00 43.02 41.04 1bs0 s PHE 178 CO -0.00 -0.98 1.97 0.77 0.70 0.00 0.00 175.22 177.67 1bs0 h SER 179 N 6.51 0.39 0.00 1.36 0.02 -1.91 -1.39 113.55 118.54 1bs0 h SER 179 Ca -0.42 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1bs0 h SER 179 Cb 1.21 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1bs0 h SER 179 CO 0.79 0.23 0.00 0.80 -1.14 0.00 0.00 176.83 177.51 1bs0 n MET 180 N -4.47 0.00 0.00 3.45 0.00 -1.26 -4.40 117.12 110.44 1bs0 n MET 180 Ca 0.11 0.00 0.13 0.00 0.00 0.00 0.00 57.70 57.94 1bs0 n MET 180 Cb 0.39 -0.72 0.45 0.00 0.00 0.00 0.00 33.22 33.34 1bs0 n MET 180 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1bs0 n ASP 181 N -0.30 0.63 -0.18 6.12 9.92 -1.25 -4.86 116.55 126.63 1bs0 n ASP 181 Ca 0.00 -0.52 -0.02 0.00 -0.53 0.00 0.00 54.79 53.72 1bs0 n ASP 181 Cb 0.00 0.03 -0.01 0.00 -0.64 0.00 0.00 41.12 40.50 1bs0 n ASP 181 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bs0 n GLY 182 N 1.37 0.49 3.90 0.44 0.00 -0.52 -4.54 105.19 106.33 1bs0 n GLY 182 Ca 0.11 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 1bs0 n GLY 182 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1bs0 s ASP 183 N -2.24 6.33 0.22 1.61 -4.77 -1.26 -4.06 116.67 112.51 1bs0 s ASP 183 Ca 0.00 1.01 -0.14 0.00 -3.30 0.00 0.00 52.55 50.12 1bs0 s ASP 183 Cb 0.00 -2.28 -0.08 0.00 -1.09 0.00 0.00 42.92 39.47 1bs0 s ASP 183 CO 0.00 -0.55 0.62 -0.44 0.70 0.00 0.00 175.17 175.50 1bs0 s SER 184 N -3.85 6.79 0.32 2.11 0.01 -1.26 -0.72 113.70 117.09 1bs0 s SER 184 Ca 0.49 1.13 -0.18 0.00 1.31 0.00 0.00 55.95 58.70 1bs0 s SER 184 Cb -0.10 -2.31 -0.09 0.00 0.21 0.00 0.00 66.02 63.73 1bs0 s SER 184 CO 0.42 -0.03 0.78 0.00 0.41 0.00 0.00 173.24 174.82 1bs0 s ALA 185 N -1.70 3.29 -1.32 1.44 0.00 -1.03 -4.96 121.76 117.48 1bs0 s ALA 185 Ca 0.45 0.16 -0.17 0.00 0.00 0.00 0.00 51.96 52.41 1bs0 s ALA 185 Cb -0.13 -2.87 0.08 0.00 0.00 0.00 0.00 23.12 20.20 1bs0 s ALA 185 CO 0.20 0.29 1.80 -0.35 0.00 0.00 0.00 175.76 177.70 1bs0 n PRO 186 N -0.09 3.17 -0.25 0.00 -0.04 -1.26 -4.78 135.00 131.74 1bs0 n PRO 186 Ca 0.03 -3.22 -0.05 0.00 -0.04 0.00 0.00 63.50 60.21 1bs0 n PRO 186 Cb 0.53 -3.40 0.05 0.00 -0.04 0.00 0.00 33.50 30.64 1bs0 n PRO 186 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1bs0 h LEU 187 N 11.66 0.81 -0.36 1.53 3.38 -1.95 -1.67 115.31 128.70 1bs0 h LEU 187 Ca 0.46 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.40 1bs0 h LEU 187 Cb 0.82 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1bs0 h LEU 187 CO 1.52 0.59 0.21 0.00 0.09 0.00 0.00 178.44 180.85 1bs0 h ALA 188 N 1.25 0.46 -0.48 1.53 0.00 -1.86 0.55 119.26 120.71 1bs0 h ALA 188 Ca 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1bs0 h ALA 188 Cb -0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1bs0 h ALA 188 CO -0.05 -0.04 0.31 0.93 0.00 0.00 0.00 179.25 180.40 1bs0 h GLU 189 N 0.46 0.63 -0.26 0.00 5.08 -1.88 -1.75 114.58 116.86 1bs0 h GLU 189 Ca 0.13 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1bs0 h GLU 189 Cb 0.02 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1bs0 h GLU 189 CO -0.02 0.43 0.16 0.82 -1.00 0.00 0.00 179.01 179.40 1bs0 h ILE 190 N 0.65 1.09 -0.53 3.13 2.04 -0.89 -1.67 117.51 121.33 1bs0 h ILE 190 Ca 0.17 -0.22 0.09 0.00 1.00 0.00 0.00 64.86 65.91 1bs0 h ILE 190 Cb -0.06 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1bs0 h ILE 190 CO -0.04 0.09 0.36 -0.61 0.00 0.00 0.00 178.15 177.95 1bs0 h GLN 191 N 0.34 0.33 -0.05 2.37 4.15 0.36 -0.95 115.11 121.66 1bs0 h GLN 191 Ca 0.10 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.47 1bs0 h GLN 191 Cb 0.01 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.62 1bs0 h GLN 191 CO -0.02 0.22 -0.08 0.37 -1.93 0.00 0.00 178.83 177.38 1bs0 h GLN 192 N 0.34 0.14 0.00 1.69 4.15 -0.45 -2.38 115.11 118.59 1bs0 h GLN 192 Ca 0.24 -0.09 -0.09 0.00 0.77 0.00 0.00 58.65 59.49 1bs0 h GLN 192 Cb 0.52 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.21 1bs0 h GLN 192 CO -0.06 0.66 -0.41 -0.39 -1.93 0.00 0.00 178.83 176.69 1bs0 h VAL 193 N -0.36 1.02 -0.09 2.39 -1.51 -0.82 -2.03 116.25 114.84 1bs0 h VAL 193 Ca 0.00 -1.59 -0.17 0.00 -1.23 0.00 0.00 66.70 63.71 1bs0 h VAL 193 Cb 0.65 1.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.74 1bs0 h VAL 193 CO 0.02 0.41 -0.68 0.71 -1.23 0.00 0.00 177.57 176.80 1bs0 h THR 194 N 0.00 1.37 -0.60 7.19 1.35 -1.20 -2.79 112.91 118.23 1bs0 h THR 194 Ca -0.00 -2.06 -0.01 0.00 -0.55 0.00 0.00 66.41 63.79 1bs0 h THR 194 Cb 0.90 2.04 -0.03 0.00 -1.73 0.00 0.00 68.15 69.33 1bs0 h THR 194 CO 0.05 0.62 0.35 1.56 -0.25 0.00 0.00 175.52 177.86 1bs0 h GLN 195 N 0.28 0.83 -0.00 4.72 4.20 -1.23 0.42 115.11 124.32 1bs0 h GLN 195 Ca -0.02 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1bs0 h GLN 195 Cb 1.23 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 1bs0 h GLN 195 CO 0.12 0.60 0.02 0.37 -0.67 0.00 0.00 178.83 179.27 1bs0 h GLN 196 N 0.82 0.00 -0.09 1.46 4.15 -1.26 -1.89 115.11 118.29 1bs0 h GLN 196 Ca 0.21 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.63 1bs0 h GLN 196 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1bs0 h GLN 196 CO -0.04 0.00 0.00 0.72 -1.93 0.00 0.00 178.83 177.58 1bs0 n HIS 197 N -3.18 0.27 -2.73 3.99 8.25 -0.89 -4.96 115.22 115.97 1bs0 n HIS 197 Ca -0.03 -0.85 -0.19 0.00 -0.26 0.00 0.00 57.72 56.39 1bs0 n HIS 197 Cb 0.09 -0.17 0.02 0.00 1.12 0.00 0.00 29.99 31.05 1bs0 n HIS 197 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1bs0 n ASN 198 N -0.91 -5.40 -4.86 0.41 3.02 -0.71 -4.94 115.26 101.88 1bs0 n ASN 198 Ca 0.14 -0.17 -0.22 0.00 -0.03 0.00 0.00 54.58 54.30 1bs0 n ASN 198 Cb 0.62 -4.31 0.07 0.00 -0.61 0.00 0.00 39.78 35.55 1bs0 n ASN 198 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1bs0 s GLY 199 N -2.57 1.79 0.16 7.41 0.00 0.14 -4.71 107.32 109.54 1bs0 s GLY 199 Ca 0.18 -1.65 0.09 0.00 0.00 0.00 0.00 44.72 43.33 1bs0 s GLY 199 CO 0.22 -1.23 -0.11 -0.98 0.00 0.00 0.00 173.10 171.00 1bs0 s TRP 200 N -2.88 2.63 -0.09 1.90 0.52 -0.89 -4.46 118.94 115.66 1bs0 s TRP 200 Ca 0.62 -0.22 0.02 0.00 0.02 0.00 0.00 56.10 56.54 1bs0 s TRP 200 Cb -0.07 -1.32 -0.02 0.00 -1.15 0.00 0.00 33.47 30.91 1bs0 s TRP 200 CO 0.41 0.48 -0.16 -1.17 0.02 0.00 0.00 176.95 176.53 1bs0 s LEU 201 N -2.64 2.59 -0.18 2.99 2.96 -1.26 -1.29 118.68 121.85 1bs0 s LEU 201 Ca 0.23 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1bs0 s LEU 201 Cb -0.09 -1.55 0.03 0.00 0.50 0.00 0.00 46.19 45.08 1bs0 s LEU 201 CO 0.14 0.23 -0.17 -0.32 -1.32 0.00 0.00 176.35 174.91 1bs0 s MET 202 N -0.04 2.67 -0.11 1.98 -2.45 0.87 -1.88 119.30 120.33 1bs0 s MET 202 Ca -0.04 -0.83 0.01 0.00 -1.25 0.00 0.00 55.69 53.58 1bs0 s MET 202 Cb -0.14 -2.49 -0.02 0.00 1.25 0.00 0.00 34.83 33.43 1bs0 s MET 202 CO 0.04 -0.28 -0.14 0.08 1.05 0.00 0.00 175.02 175.77 1bs0 s VAL 203 N 1.32 2.98 -0.32 10.11 1.01 -0.88 -1.87 120.40 132.75 1bs0 s VAL 203 Ca 0.03 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 1bs0 s VAL 203 Cb -0.14 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 1bs0 s VAL 203 CO -0.11 0.54 0.32 -0.62 0.00 0.00 0.00 175.10 175.23 1bs0 s ASP 204 N 0.13 6.15 -0.40 3.32 -1.08 -0.33 -1.17 116.67 123.29 1bs0 s ASP 204 Ca -0.07 -0.14 0.05 0.00 -0.52 0.00 0.00 52.55 51.86 1bs0 s ASP 204 Cb -0.15 -2.18 0.47 0.00 -1.46 0.00 0.00 42.92 39.60 1bs0 s ASP 204 CO 0.05 -0.25 1.50 -0.67 0.52 0.00 0.00 175.17 176.32 1bs0 n ASP 205 N 5.28 5.22 -0.34 -0.34 2.03 -0.07 -0.67 116.55 127.66 1bs0 n ASP 205 Ca -0.10 -3.77 0.15 0.00 0.52 0.00 0.00 54.79 51.59 1bs0 n ASP 205 Cb 0.50 -0.59 0.35 0.00 -0.72 0.00 0.00 41.12 40.66 1bs0 n ASP 205 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bs0 h ALA 206 N 1.87 1.67 -0.00 -1.67 0.00 -1.88 -0.41 119.26 118.84 1bs0 h ALA 206 Ca 0.41 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1bs0 h ALA 206 Cb 1.36 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1bs0 h ALA 206 CO 0.93 -0.23 -0.68 0.72 0.00 0.00 0.00 179.25 179.99 1bs0 n HIS 207 N -4.89 0.00 -0.02 0.00 8.25 -1.26 -4.11 115.22 113.18 1bs0 n HIS 207 Ca 0.25 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.76 1bs0 n HIS 207 Cb 0.68 -0.09 -0.12 0.00 1.12 0.00 0.00 29.99 31.57 1bs0 n HIS 207 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bs0 n GLY 208 N 1.47 -0.74 3.75 -1.41 0.00 -0.97 -4.87 105.19 102.42 1bs0 n GLY 208 Ca 0.06 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1bs0 n GLY 208 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1bs0 s THR 209 N -3.00 3.00 0.00 2.61 -1.32 -0.20 -1.34 115.64 115.39 1bs0 s THR 209 Ca -0.06 0.87 0.00 0.00 -1.21 0.00 0.00 61.69 61.29 1bs0 s THR 209 Cb 0.09 -3.56 0.00 0.00 -1.51 0.00 0.00 72.50 67.53 1bs0 s THR 209 CO 0.66 0.15 0.00 0.61 -2.21 0.00 0.00 174.62 173.84 1bs0 n GLY 210 N 1.94 3.00 0.07 6.08 0.00 0.58 -4.45 105.19 112.40 1bs0 n GLY 210 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 1bs0 n GLY 210 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bs0 n VAL 211 N -2.00 0.95 -4.24 1.61 0.31 -0.45 -4.47 118.33 110.04 1bs0 n VAL 211 Ca 0.00 -0.65 -0.16 0.00 -0.01 0.00 0.00 64.34 63.51 1bs0 n VAL 211 Cb 0.00 -0.45 -0.11 0.00 -0.91 0.00 0.00 33.84 32.37 1bs0 n VAL 211 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1bs0 s ILE 212 N -2.54 1.23 0.00 2.52 -4.36 -1.16 -4.86 121.20 112.03 1bs0 s ILE 212 Ca -0.08 -1.82 0.00 0.00 -0.26 0.00 0.00 60.65 58.49 1bs0 s ILE 212 Cb 0.06 -1.61 0.00 0.00 1.25 0.00 0.00 42.46 42.16 1bs0 s ILE 212 CO 0.69 -0.55 0.00 0.61 0.24 0.00 0.00 174.94 175.93 1bs0 n GLY 213 N 0.29 -1.62 3.66 6.27 0.00 -1.26 -3.14 105.19 109.38 1bs0 n GLY 213 Ca -0.14 -1.55 -0.50 0.00 0.00 0.00 0.00 46.02 43.83 1bs0 n GLY 213 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bs0 n GLU 214 N -1.65 1.72 -1.70 1.61 2.13 -1.26 -0.57 120.64 120.92 1bs0 n GLU 214 Ca 0.00 0.63 -0.19 0.00 0.66 0.00 0.00 57.16 58.25 1bs0 n GLU 214 Cb 0.00 -2.37 -0.07 0.00 0.27 0.00 0.00 31.44 29.27 1bs0 n GLU 214 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1bs0 n GLN 215 N 4.45 -1.48 -1.26 5.31 6.02 -1.26 -1.59 117.38 127.55 1bs0 n GLN 215 Ca 0.21 1.09 -0.09 0.00 -0.01 0.00 0.00 57.00 58.20 1bs0 n GLN 215 Cb 0.23 -5.50 -0.04 0.00 1.02 0.00 0.00 30.24 25.96 1bs0 n GLN 215 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bs0 n GLY 216 N -0.46 1.06 3.45 1.08 0.00 0.26 -4.38 105.19 106.20 1bs0 n GLY 216 Ca -0.20 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.07 1bs0 n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bs0 s ARG 217 N -2.62 -1.56 0.00 1.61 0.52 -0.62 -0.31 118.95 115.97 1bs0 s ARG 217 Ca 0.00 0.46 0.00 0.00 -0.52 0.00 0.00 55.73 55.67 1bs0 s ARG 217 Cb 0.00 -1.51 0.00 0.00 0.52 0.00 0.00 34.95 33.96 1bs0 s ARG 217 CO 0.00 -4.05 0.00 0.41 0.02 0.00 0.00 175.30 171.68 1bs0 n GLY 218 N 0.64 -2.85 0.35 -3.53 0.00 -1.26 -4.35 105.19 94.18 1bs0 n GLY 218 Ca 0.07 -1.34 0.10 0.00 0.00 0.00 0.00 46.02 44.84 1bs0 n GLY 218 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1bs0 h SER 219 N -0.91 0.43 -0.02 1.61 0.02 -1.83 -2.58 113.55 110.26 1bs0 h SER 219 Ca 0.00 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1bs0 h SER 219 Cb 0.00 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.46 1bs0 h SER 219 CO 0.00 0.27 -0.05 0.00 -1.14 0.00 0.00 176.83 175.90 1bs0 h TRP 221 N -0.51 -0.79 -0.93 0.00 2.91 -1.73 -0.60 115.95 114.30 1bs0 h TRP 221 Ca -0.00 0.03 0.26 0.00 1.13 0.00 0.00 58.89 60.31 1bs0 h TRP 221 Cb 0.67 0.36 -0.14 0.00 -0.51 0.00 0.00 29.16 29.53 1bs0 h TRP 221 CO 0.13 -0.38 0.39 1.25 -1.03 0.00 0.00 178.44 178.80 1bs0 h LEU 222 N -0.40 0.25 -3.25 0.65 5.85 -1.48 0.46 115.31 117.38 1bs0 h LEU 222 Ca 0.08 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1bs0 h LEU 222 Cb 0.52 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.74 1bs0 h LEU 222 CO -0.29 -0.12 0.00 0.00 -0.34 0.00 0.00 178.44 177.69 1bs0 n GLN 223 N -5.13 4.20 -3.88 1.25 6.02 -0.68 -4.95 117.38 114.21 1bs0 n GLN 223 Ca 0.25 -2.93 -0.26 0.00 -0.01 0.00 0.00 57.00 54.05 1bs0 n GLN 223 Cb 0.79 -2.05 0.01 0.00 1.02 0.00 0.00 30.24 30.00 1bs0 n GLN 223 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1bs0 n LYS 224 N 0.90 -4.26 -4.48 -1.09 4.01 0.16 -4.71 118.16 108.69 1bs0 n LYS 224 Ca 0.26 0.51 -0.21 0.00 -0.51 0.00 0.00 58.31 58.37 1bs0 n LYS 224 Cb 1.01 -4.98 -0.14 0.00 -0.51 0.00 0.00 35.03 30.41 1bs0 n LYS 224 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1bs0 s VAL 225 N -3.69 1.04 -0.42 -0.18 1.01 -0.41 -5.01 120.40 112.74 1bs0 s VAL 225 Ca 0.18 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.45 1bs0 s VAL 225 Cb -0.09 -0.90 0.12 0.00 0.00 0.00 0.00 36.38 35.50 1bs0 s VAL 225 CO 0.85 0.16 0.18 -0.75 0.00 0.00 0.00 175.10 175.54 1bs0 s LYS 226 N -0.66 1.48 0.75 2.72 2.20 -1.26 -4.27 119.74 120.71 1bs0 s LYS 226 Ca 0.03 -2.05 -0.14 0.00 -0.36 0.00 0.00 55.97 53.46 1bs0 s LYS 226 Cb -0.06 -2.83 0.05 0.00 -1.51 0.00 0.00 37.83 33.48 1bs0 s LYS 226 CO 0.00 -1.06 1.17 -1.25 -0.36 0.00 0.00 175.35 173.85 1bs0 s PRO 227 N 0.45 2.08 0.27 4.03 0.04 -1.26 -4.90 135.00 135.72 1bs0 s PRO 227 Ca 0.15 1.61 -0.00 0.00 0.04 0.00 0.00 61.00 62.80 1bs0 s PRO 227 Cb -0.23 -1.84 0.53 0.00 0.04 0.00 0.00 34.50 33.00 1bs0 s PRO 227 CO -0.05 -1.85 1.81 0.93 0.04 0.00 0.00 177.00 177.88 1bs0 h GLU 228 N -0.57 0.83 -5.10 4.56 3.07 -1.86 -3.41 114.58 112.11 1bs0 h GLU 228 Ca -0.46 -0.05 -0.61 0.00 -0.50 0.00 0.00 59.36 57.73 1bs0 h GLU 228 Cb 1.28 -0.19 -0.33 0.00 -0.84 0.00 0.00 28.75 28.67 1bs0 h GLU 228 CO 0.49 0.55 -0.85 -0.51 -1.40 0.00 0.00 179.01 177.29 1bs0 s LEU 229 N -10.27 1.92 -0.08 1.33 1.43 -0.79 -4.49 118.68 107.73 1bs0 s LEU 229 Ca -0.12 -0.45 0.04 0.00 -1.03 0.00 0.00 54.13 52.57 1bs0 s LEU 229 Cb 0.22 -1.17 0.00 0.00 0.03 0.00 0.00 46.19 45.27 1bs0 s LEU 229 CO 0.80 0.12 -0.20 -0.22 0.23 0.00 0.00 176.35 177.08 1bs0 s LEU 230 N 0.40 1.93 -0.21 1.79 2.96 -0.73 -2.07 118.68 122.75 1bs0 s LEU 230 Ca -0.15 -0.46 -0.06 0.00 -0.22 0.00 0.00 54.13 53.24 1bs0 s LEU 230 Cb -0.16 -1.19 -0.03 0.00 0.50 0.00 0.00 46.19 45.31 1bs0 s LEU 230 CO 0.06 0.12 0.02 -0.69 -1.32 0.00 0.00 176.35 174.54 1bs0 s VAL 231 N 0.42 4.06 0.03 1.68 1.01 -0.31 0.20 120.40 127.49 1bs0 s VAL 231 Ca -0.16 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 61.61 1bs0 s VAL 231 Cb -0.17 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 1bs0 s VAL 231 CO 0.07 0.41 -0.19 0.68 0.00 0.00 0.00 175.10 176.08 1bs0 s VAL 232 N 1.07 2.74 0.17 2.92 -7.23 -0.42 -0.90 120.40 118.75 1bs0 s VAL 232 Ca 0.03 -1.15 0.08 0.00 -1.81 0.00 0.00 61.98 59.13 1bs0 s VAL 232 Cb -0.14 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1bs0 s VAL 232 CO 0.02 0.37 -0.17 0.42 -0.31 0.00 0.00 175.10 175.43 1bs0 s THR 233 N -0.88 1.76 0.00 5.32 -4.23 -1.26 -0.67 115.64 115.67 1bs0 s THR 233 Ca 0.14 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 1bs0 s THR 233 Cb -0.10 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 71.88 1bs0 s THR 233 CO 0.04 -0.38 0.87 0.49 -0.54 0.00 0.00 174.62 175.10 1bs0 n PHE 234 N 0.16 0.00 1.69 3.99 3.72 -0.03 -4.54 117.46 122.46 1bs0 n PHE 234 Ca -0.12 -0.38 0.14 0.00 -0.05 0.00 0.00 57.45 57.04 1bs0 n PHE 234 Cb 0.58 -0.04 0.65 0.00 -0.94 0.00 0.00 39.48 39.73 1bs0 n PHE 234 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bs0 n GLY 235 N -0.38 -0.42 0.00 1.37 0.00 -1.26 -0.94 105.19 103.57 1bs0 n GLY 235 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1bs0 n GLY 235 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bs0 n LYS 236 N -0.32 0.00 -0.04 1.61 5.02 -1.26 -4.71 118.16 118.46 1bs0 n LYS 236 Ca 0.20 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.62 1bs0 n LYS 236 Cb 0.23 0.00 0.54 0.00 -0.02 0.00 0.00 35.03 35.79 1bs0 n LYS 236 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1bs0 h GLY 237 N 0.00 0.43 2.00 0.72 0.00 -1.77 -1.81 103.07 102.64 1bs0 h GLY 237 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1bs0 h GLY 237 CO 0.00 0.08 0.00 0.74 0.00 0.00 0.00 176.54 177.36 1bs0 h PHE 238 N 0.31 0.00 -0.38 5.60 -1.00 -1.81 -3.39 116.94 116.27 1bs0 h PHE 238 Ca 0.25 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.90 1bs0 h PHE 238 Cb 0.56 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.08 1bs0 h PHE 238 CO -0.00 0.00 -0.12 0.41 -1.61 0.00 0.00 178.31 176.99 1bs0 n GLY 239 N 0.48 0.74 0.00 -1.45 0.00 -0.68 -4.71 105.19 99.57 1bs0 n GLY 239 Ca 0.03 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1bs0 n GLY 239 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bs0 n VAL 240 N -3.00 0.00 -3.59 1.61 0.31 -0.11 -4.14 118.33 109.41 1bs0 n VAL 240 Ca -0.06 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.20 1bs0 n VAL 240 Cb 0.25 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.14 1bs0 n VAL 240 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1bs0 s SER 241 N 1.00 -0.25 0.00 4.52 0.15 -0.97 -4.14 113.70 114.01 1bs0 s SER 241 Ca 0.00 0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.85 1bs0 s SER 241 Cb 0.00 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 1bs0 s SER 241 CO 0.00 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.77 1bs0 n GLY 242 N 0.41 -0.98 3.80 9.45 0.00 -1.22 -4.68 105.19 111.97 1bs0 n GLY 242 Ca -0.06 -2.19 -0.06 0.00 0.00 0.00 0.00 46.02 43.72 1bs0 n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bs0 s ALA 243 N -1.81 -1.43 -0.00 4.61 0.00 -0.74 -0.85 121.76 121.53 1bs0 s ALA 243 Ca 0.00 -0.08 -0.14 0.00 0.00 0.00 0.00 51.96 51.74 1bs0 s ALA 243 Cb 0.00 0.75 0.02 0.00 0.00 0.00 0.00 23.12 23.89 1bs0 s ALA 243 CO 0.00 -1.03 0.30 0.00 0.00 0.00 0.00 175.76 175.03 1bs0 s ALA 244 N -3.63 -0.73 -0.21 0.00 0.00 0.15 -0.86 121.76 116.49 1bs0 s ALA 244 Ca 0.11 0.23 -0.07 0.00 0.00 0.00 0.00 51.96 52.24 1bs0 s ALA 244 Cb -0.04 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 1bs0 s ALA 244 CO 0.04 -0.28 0.05 0.08 0.00 0.00 0.00 175.76 175.65 1bs0 s VAL 245 N -1.55 4.42 -0.17 0.00 1.01 -0.19 -1.30 120.40 122.62 1bs0 s VAL 245 Ca -0.12 -0.15 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 1bs0 s VAL 245 Cb -0.05 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 1bs0 s VAL 245 CO 0.03 0.41 0.11 -0.76 0.00 0.00 0.00 175.10 174.89 1bs0 s LEU 246 N 0.97 4.14 0.00 3.92 2.01 0.13 -1.12 118.68 128.73 1bs0 s LEU 246 Ca 0.03 0.26 -0.15 0.00 0.01 0.00 0.00 54.13 54.28 1bs0 s LEU 246 Cb -0.14 -2.05 0.06 0.00 0.01 0.00 0.00 46.19 44.07 1bs0 s LEU 246 CO 0.03 0.25 0.77 0.00 1.01 0.00 0.00 176.35 178.40 1bs0 s SER 248 N -2.91 4.09 0.16 0.00 1.04 -1.26 -1.08 113.70 113.74 1bs0 s SER 248 Ca 0.16 0.37 -0.15 0.00 0.48 0.00 0.00 55.95 56.81 1bs0 s SER 248 Cb -0.03 -0.74 0.03 0.00 0.10 0.00 0.00 66.02 65.37 1bs0 s SER 248 CO 0.08 -2.10 1.80 0.28 0.98 0.00 0.00 173.24 174.28 1bs0 h SER 249 N -1.07 0.52 -0.04 7.02 0.02 -1.96 -0.72 113.55 117.33 1bs0 h SER 249 Ca -0.44 -0.04 -0.24 0.00 -0.84 0.00 0.00 61.79 60.24 1bs0 h SER 249 Cb 1.29 -0.13 0.01 0.00 0.14 0.00 0.00 62.40 63.71 1bs0 h SER 249 CO 0.52 0.41 -0.87 0.71 -1.14 0.00 0.00 176.83 176.45 1bs0 h THR 250 N 0.59 1.29 -0.73 -2.27 1.35 -1.99 -2.34 112.91 108.81 1bs0 h THR 250 Ca 0.16 -2.10 -0.05 0.00 -0.55 0.00 0.00 66.41 63.87 1bs0 h THR 250 Cb -0.03 2.14 -0.03 0.00 -1.73 0.00 0.00 68.15 68.50 1bs0 h THR 250 CO -0.03 0.66 0.27 0.58 -0.25 0.00 0.00 175.52 176.75 1bs0 h VAL 251 N 0.46 1.26 -0.71 6.82 2.07 -1.93 0.85 116.25 125.06 1bs0 h VAL 251 Ca -0.08 -0.83 -0.07 0.00 0.82 0.00 0.00 66.70 66.55 1bs0 h VAL 251 Cb 1.51 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1bs0 h VAL 251 CO 0.17 0.33 0.18 0.00 0.02 0.00 0.00 177.57 178.28 1bs0 h ALA 252 N 1.13 0.98 -0.82 1.67 0.00 -1.09 0.23 119.26 121.36 1bs0 h ALA 252 Ca 0.24 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1bs0 h ALA 252 Cb 0.24 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1bs0 h ALA 252 CO -0.02 0.66 0.36 -0.44 0.00 0.00 0.00 179.25 179.82 1bs0 h ASP 253 N 1.07 1.10 -0.49 0.00 3.32 -1.13 0.58 116.42 120.88 1bs0 h ASP 253 Ca 0.22 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1bs0 h ASP 253 Cb 0.36 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1bs0 h ASP 253 CO 0.00 0.95 0.23 0.22 -1.72 0.00 0.00 179.24 178.92 1bs0 h TYR 254 N 1.18 0.72 -0.40 4.55 5.03 -0.27 -2.21 116.97 125.56 1bs0 h TYR 254 Ca 0.28 -0.04 -0.14 0.00 2.58 0.00 0.00 58.73 61.41 1bs0 h TYR 254 Cb 0.17 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.22 1bs0 h TYR 254 CO 0.02 0.57 -0.31 -0.07 -1.32 0.00 0.00 178.16 177.05 1bs0 h LEU 255 N 0.65 0.93 -1.68 2.82 3.38 -0.54 -0.08 115.31 120.79 1bs0 h LEU 255 Ca 0.17 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1bs0 h LEU 255 Cb 0.13 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1bs0 h LEU 255 CO -0.02 1.16 -0.13 -0.07 0.09 0.00 0.00 178.44 179.47 1bs0 h LEU 256 N 0.75 0.00 0.00 1.67 3.38 -0.82 0.91 115.31 121.20 1bs0 h LEU 256 Ca 0.08 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.77 1bs0 h LEU 256 Cb 0.87 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.57 1bs0 h LEU 256 CO 0.08 0.13 -1.68 0.00 0.09 0.00 0.00 178.44 177.05 1bs0 n GLN 257 N -3.43 0.63 -0.00 1.13 1.13 -0.84 -4.69 117.38 111.31 1bs0 n GLN 257 Ca -0.01 0.29 0.00 0.00 -1.94 0.00 0.00 57.00 55.35 1bs0 n GLN 257 Cb 0.30 -1.80 -0.00 0.00 0.11 0.00 0.00 30.24 28.85 1bs0 n GLN 257 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1bs0 n PHE 258 N -3.03 0.00 -2.92 1.08 3.72 -0.09 -4.95 117.46 111.27 1bs0 n PHE 258 Ca -0.16 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.81 1bs0 n PHE 258 Cb 1.03 -0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 39.52 1bs0 n PHE 258 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bs0 s ALA 259 N -1.89 3.20 0.49 4.37 0.00 0.29 -4.86 121.76 123.37 1bs0 s ALA 259 Ca -0.00 -1.56 0.15 0.00 0.00 0.00 0.00 51.96 50.55 1bs0 s ALA 259 Cb 0.00 -3.68 1.17 0.00 0.00 0.00 0.00 23.12 20.61 1bs0 s ALA 259 CO 0.03 -2.42 2.11 0.00 0.00 0.00 0.00 175.76 175.47 1bs0 h ARG 260 N 9.32 0.05 0.00 0.00 3.08 -1.91 0.45 114.38 125.36 1bs0 h ARG 260 Ca -0.27 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.74 1bs0 h ARG 260 Cb 1.08 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 1bs0 h ARG 260 CO 1.09 0.08 -0.16 0.45 -1.07 0.00 0.00 179.97 180.35 1bs0 h HIS 261 N 0.05 0.00 0.02 3.04 3.86 -1.92 -1.42 115.15 118.78 1bs0 h HIS 261 Ca 0.01 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.87 1bs0 h HIS 261 Cb 0.07 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.48 1bs0 h HIS 261 CO 0.00 0.16 -2.13 -0.11 0.86 0.00 0.00 177.93 176.71 1bs0 n LEU 262 N -3.54 1.21 0.03 2.43 7.94 0.02 -3.80 117.00 121.29 1bs0 n LEU 262 Ca -0.01 0.14 -0.19 0.00 -1.11 0.00 0.00 56.01 54.83 1bs0 n LEU 262 Cb 0.31 -0.11 -0.10 0.00 0.53 0.00 0.00 43.42 44.05 1bs0 n LEU 262 CO 0.31 0.60 0.13 0.40 -1.11 0.00 0.00 177.39 177.73 1bs0 h ILE 263 N 0.01 1.31 -0.01 1.96 2.04 -1.01 -3.38 117.51 118.43 1bs0 h ILE 263 Ca -0.45 -2.18 0.00 0.00 1.00 0.00 0.00 64.86 63.23 1bs0 h ILE 263 Cb 2.08 2.39 0.00 0.00 -0.74 0.00 0.00 36.82 40.55 1bs0 h ILE 263 CO 0.03 0.67 -0.15 -1.22 0.00 0.00 0.00 178.15 177.48 1bs0 n TYR 264 N -3.95 0.00 -2.15 1.37 4.01 -0.55 -4.08 117.16 111.81 1bs0 n TYR 264 Ca -0.11 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.31 1bs0 n TYR 264 Cb 0.82 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.84 1bs0 n TYR 264 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1bs0 s SER 265 N -1.26 6.23 0.11 7.72 1.04 -1.25 -4.82 113.70 121.47 1bs0 s SER 265 Ca 0.10 1.62 -0.30 0.00 0.48 0.00 0.00 55.95 57.84 1bs0 s SER 265 Cb 0.09 -2.51 -0.07 0.00 0.10 0.00 0.00 66.02 63.63 1bs0 s SER 265 CO 0.23 -0.86 1.23 -0.89 0.98 0.00 0.00 173.24 173.93 1bs0 s THR 266 N -2.70 3.75 0.67 2.02 2.01 -1.26 -4.05 115.64 116.07 1bs0 s THR 266 Ca 0.59 1.32 -0.13 0.00 0.31 0.00 0.00 61.69 63.79 1bs0 s THR 266 Cb -0.12 -3.85 -0.00 0.00 0.01 0.00 0.00 72.50 68.54 1bs0 s THR 266 CO 0.38 0.14 1.08 -0.94 -0.69 0.00 0.00 174.62 174.59 1bs0 s SER 267 N 0.75 5.30 0.66 3.53 1.04 0.00 -4.90 113.70 120.09 1bs0 s SER 267 Ca 0.58 1.81 -0.16 0.00 0.48 0.00 0.00 55.95 58.66 1bs0 s SER 267 Cb -0.32 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.28 1bs0 s SER 267 CO 0.32 -1.50 1.15 0.00 0.98 0.00 0.00 173.24 174.19 1bs0 s MET 268 N -4.47 2.67 0.12 4.02 0.23 -1.26 -4.51 119.30 116.10 1bs0 s MET 268 Ca 0.63 1.56 -0.35 0.00 -1.03 0.00 0.00 55.69 56.49 1bs0 s MET 268 Cb -0.17 -1.92 -0.16 0.00 -1.53 0.00 0.00 34.83 31.05 1bs0 s MET 268 CO 0.46 -1.39 1.35 -2.30 -2.03 0.00 0.00 175.02 171.12 1bs0 n PRO 269 N -2.33 1.36 -0.34 3.16 -0.02 -1.26 -4.63 135.00 130.93 1bs0 n PRO 269 Ca 0.12 0.49 0.22 0.00 -2.02 0.00 0.00 63.50 62.31 1bs0 n PRO 269 Cb 0.51 -2.13 0.48 0.00 -0.02 0.00 0.00 33.50 32.34 1bs0 n PRO 269 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1bs0 h PRO 270 N 4.58 0.41 -0.38 0.52 0.11 -1.89 -0.32 132.00 135.03 1bs0 h PRO 270 Ca -0.46 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 1bs0 h PRO 270 Cb 1.32 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1bs0 h PRO 270 CO 0.78 0.27 0.03 0.00 -0.21 0.00 0.00 178.00 178.87 1bs0 h ALA 271 N 1.67 1.34 -0.48 -0.75 0.00 -1.83 0.70 119.26 119.91 1bs0 h ALA 271 Ca 0.64 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 1bs0 h ALA 271 Cb 1.53 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 1bs0 h ALA 271 CO -0.39 0.46 0.19 0.37 0.00 0.00 0.00 179.25 179.88 1bs0 h GLN 272 N 0.57 0.71 -0.50 0.00 4.15 -1.40 -0.92 115.11 117.72 1bs0 h GLN 272 Ca 0.12 -0.13 -0.05 0.00 0.77 0.00 0.00 58.65 59.37 1bs0 h GLN 272 Cb 0.32 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 1bs0 h GLN 272 CO 0.01 0.64 0.13 0.00 -1.93 0.00 0.00 178.83 177.67 1bs0 h ALA 273 N 1.04 1.28 -0.62 3.38 0.00 -0.65 -0.94 119.26 122.75 1bs0 h ALA 273 Ca 0.16 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1bs0 h ALA 273 Cb 0.19 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1bs0 h ALA 273 CO -0.01 0.51 0.05 1.96 0.00 0.00 0.00 179.25 181.76 1bs0 h GLN 274 N 0.74 1.06 -0.55 0.00 1.08 -0.59 -0.35 115.11 116.50 1bs0 h GLN 274 Ca 0.17 -0.31 0.02 0.00 -1.45 0.00 0.00 58.65 57.08 1bs0 h GLN 274 Cb 0.27 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.55 1bs0 h GLN 274 CO -0.00 1.01 0.33 0.00 -0.95 0.00 0.00 178.83 179.22 1bs0 h ALA 275 N 1.01 0.70 -0.80 3.87 0.00 -0.75 -0.76 119.26 122.53 1bs0 h ALA 275 Ca 0.18 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1bs0 h ALA 275 Cb 0.50 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1bs0 h ALA 275 CO 0.02 0.05 0.52 -0.07 0.00 0.00 0.00 179.25 179.78 1bs0 h LEU 276 N 0.66 0.93 -0.67 0.00 3.38 -0.91 0.15 115.31 118.86 1bs0 h LEU 276 Ca 0.22 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 1bs0 h LEU 276 Cb 0.01 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1bs0 h LEU 276 CO -0.09 0.68 0.01 0.03 0.09 0.00 0.00 178.44 179.16 1bs0 h ARG 277 N 1.09 1.04 -0.31 1.13 3.08 -0.69 -0.07 114.38 119.65 1bs0 h ARG 277 Ca 0.29 -0.32 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1bs0 h ARG 277 Cb -0.11 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 1bs0 h ARG 277 CO -0.06 1.01 -0.01 0.00 -1.07 0.00 0.00 179.97 179.84 1bs0 h ALA 278 N 1.04 0.42 -0.47 0.04 0.00 -0.80 -1.37 119.26 118.12 1bs0 h ALA 278 Ca 0.17 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1bs0 h ALA 278 Cb 0.54 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1bs0 h ALA 278 CO 0.03 0.18 0.17 1.03 0.00 0.00 0.00 179.25 180.67 1bs0 h SER 279 N 0.35 0.19 -0.73 0.00 0.87 -0.57 -1.48 113.55 112.18 1bs0 h SER 279 Ca 0.09 0.05 0.05 0.00 -1.23 0.00 0.00 61.79 60.75 1bs0 h SER 279 Cb 0.45 0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.39 1bs0 h SER 279 CO 0.02 0.14 0.44 0.25 -0.53 0.00 0.00 176.83 177.15 1bs0 h LEU 280 N 0.35 0.70 -0.09 2.23 6.46 -0.87 -0.29 115.31 123.80 1bs0 h LEU 280 Ca 0.22 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 58.01 1bs0 h LEU 280 Cb 0.22 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 1bs0 h LEU 280 CO -0.22 0.46 -0.02 0.00 -0.62 0.00 0.00 178.44 178.04 1bs0 h ALA 281 N 1.34 0.06 -0.60 1.25 0.00 -0.57 -0.58 119.26 120.15 1bs0 h ALA 281 Ca 0.31 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.29 1bs0 h ALA 281 Cb 0.11 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1bs0 h ALA 281 CO -0.15 -0.49 0.35 0.28 0.00 0.00 0.00 179.25 179.24 1bs0 h VAL 282 N -0.00 1.02 -0.33 0.00 2.07 -0.92 -1.72 116.25 116.37 1bs0 h VAL 282 Ca 0.04 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1bs0 h VAL 282 Cb 0.07 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 1bs0 h VAL 282 CO -0.09 0.12 0.19 0.40 0.02 0.00 0.00 177.57 178.21 1bs0 h ILE 283 N 0.67 1.10 0.00 4.57 2.04 -0.38 -1.76 117.51 123.76 1bs0 h ILE 283 Ca 0.25 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1bs0 h ILE 283 Cb 0.08 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1bs0 h ILE 283 CO -0.13 0.11 -0.54 0.03 0.00 0.00 0.00 178.15 177.62 1bs0 h ARG 284 N 0.45 0.00 -7.64 2.37 3.08 -0.60 -3.40 114.38 108.64 1bs0 h ARG 284 Ca 0.12 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.73 1bs0 h ARG 284 Cb 0.01 0.00 0.16 0.00 0.08 0.00 0.00 29.97 30.21 1bs0 h ARG 284 CO -0.02 0.00 0.33 -1.54 -1.07 0.00 0.00 179.97 177.67 1bs0 s SER 285 N -5.26 2.83 0.41 7.04 1.04 -0.70 -4.85 113.70 114.21 1bs0 s SER 285 Ca 0.04 0.54 0.07 0.00 0.48 0.00 0.00 55.95 57.08 1bs0 s SER 285 Cb 0.09 -0.77 0.85 0.00 0.10 0.00 0.00 66.02 66.30 1bs0 s SER 285 CO 0.72 -2.93 2.04 0.44 0.98 0.00 0.00 173.24 174.49 1bs0 h ASP 286 N -1.77 0.44 -0.76 7.02 3.32 -1.91 -1.62 116.42 121.14 1bs0 h ASP 286 Ca -0.46 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.53 1bs0 h ASP 286 Cb 1.28 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 1bs0 h ASP 286 CO 0.45 0.35 0.31 -0.08 -1.72 0.00 0.00 179.24 178.54 1bs0 h GLU 287 N 0.51 1.14 -0.54 3.56 4.81 -1.93 -0.51 114.58 121.62 1bs0 h GLU 287 Ca 0.13 -0.20 0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1bs0 h GLU 287 Cb -0.01 -0.19 -0.07 0.00 0.63 0.00 0.00 28.75 29.11 1bs0 h GLU 287 CO -0.02 0.92 0.13 0.78 -0.73 0.00 0.00 179.01 180.09 1bs0 h GLY 288 N 1.14 0.69 1.03 1.92 0.00 -0.81 0.11 103.07 107.15 1bs0 h GLY 288 Ca 0.26 -0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 1bs0 h GLY 288 CO -0.02 -0.06 0.46 -0.55 0.00 0.00 0.00 176.54 176.36 1bs0 h ASP 289 N 0.28 1.09 -0.49 0.19 3.32 -0.70 -1.37 116.42 118.74 1bs0 h ASP 289 Ca 0.27 -0.11 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 1bs0 h ASP 289 Cb 0.37 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1bs0 h ASP 289 CO -0.33 0.88 -0.04 0.00 -1.72 0.00 0.00 179.24 178.03 1bs0 h ALA 290 N 1.25 0.93 -0.36 3.45 0.00 -0.38 0.05 119.26 124.20 1bs0 h ALA 290 Ca 0.30 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1bs0 h ALA 290 Cb 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1bs0 h ALA 290 CO -0.05 0.63 -0.32 0.00 0.00 0.00 0.00 179.25 179.52 1bs0 h ARG 291 N 0.85 0.81 -0.46 0.00 3.08 -0.54 0.82 114.38 118.94 1bs0 h ARG 291 Ca 0.15 -0.38 -0.09 0.00 0.07 0.00 0.00 59.98 59.73 1bs0 h ARG 291 Cb 0.56 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 1bs0 h ARG 291 CO 0.03 1.01 -0.07 0.00 -1.07 0.00 0.00 179.97 179.88 1bs0 h ARG 292 N 0.68 0.80 -0.53 0.04 3.08 -0.87 -1.30 114.38 116.27 1bs0 h ARG 292 Ca 0.07 -0.25 -0.10 0.00 0.07 0.00 0.00 59.98 59.77 1bs0 h ARG 292 Cb 0.87 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.82 1bs0 h ARG 292 CO 0.08 0.85 -0.06 1.49 -1.07 0.00 0.00 179.97 181.25 1bs0 h GLU 293 N 0.74 0.98 -0.52 0.04 4.57 -0.73 -1.94 114.58 117.72 1bs0 h GLU 293 Ca 0.13 -0.35 0.02 0.00 -1.18 0.00 0.00 59.36 57.99 1bs0 h GLU 293 Cb 0.54 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.03 1bs0 h GLU 293 CO 0.03 1.02 0.31 -0.22 -1.18 0.00 0.00 179.01 178.97 1bs0 h LYS 294 N 0.85 0.60 -0.41 1.92 3.64 -0.61 -1.93 116.57 120.63 1bs0 h LYS 294 Ca 0.14 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1bs0 h LYS 294 Cb 0.62 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 1bs0 h LYS 294 CO 0.04 0.40 0.24 1.25 -2.27 0.00 0.00 179.45 179.10 1bs0 h LEU 295 N 0.62 0.37 -1.14 5.20 6.46 -1.06 -0.98 115.31 124.78 1bs0 h LEU 295 Ca 0.21 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.97 1bs0 h LEU 295 Cb 0.02 -0.07 -0.04 0.00 -0.73 0.00 0.00 40.66 39.84 1bs0 h LEU 295 CO -0.09 0.27 0.48 0.00 -0.62 0.00 0.00 178.44 178.48 1bs0 h ALA 296 N 1.19 1.36 -0.72 1.25 0.00 -1.13 -0.91 119.26 120.30 1bs0 h ALA 296 Ca 0.17 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1bs0 h ALA 296 Cb 0.03 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1bs0 h ALA 296 CO -0.09 0.56 0.25 0.00 0.00 0.00 0.00 179.25 179.97 1bs0 h ALA 297 N 1.44 1.07 -0.39 0.00 0.00 -0.87 -1.39 119.26 119.12 1bs0 h ALA 297 Ca 0.28 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1bs0 h ALA 297 Cb -0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1bs0 h ALA 297 CO -0.05 0.64 -0.30 -0.07 0.00 0.00 0.00 179.25 179.47 1bs0 h LEU 298 N 1.06 0.93 -0.16 0.00 3.38 -0.50 0.12 115.31 120.15 1bs0 h LEU 298 Ca 0.24 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1bs0 h LEU 298 Cb 0.27 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1bs0 h LEU 298 CO -0.01 1.18 0.10 0.40 0.09 0.00 0.00 178.44 180.20 1bs0 h ILE 299 N 0.70 1.05 -0.54 1.22 2.04 -1.03 -1.11 117.51 119.84 1bs0 h ILE 299 Ca 0.07 -0.11 0.11 0.00 1.00 0.00 0.00 64.86 65.93 1bs0 h ILE 299 Cb 0.88 0.85 -0.09 0.00 -0.74 0.00 0.00 36.82 37.72 1bs0 h ILE 299 CO 0.08 0.05 0.02 0.74 0.00 0.00 0.00 178.15 179.04 1bs0 h THR 300 N 0.20 0.58 -0.76 -0.27 2.02 -1.10 -0.04 112.91 113.54 1bs0 h THR 300 Ca 0.06 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1bs0 h THR 300 Cb -0.00 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 66.81 1bs0 h THR 300 CO -0.01 0.02 0.42 -0.09 0.37 0.00 0.00 175.52 176.23 1bs0 h ARG 301 N 0.14 1.06 0.08 6.66 2.43 -0.39 -1.35 114.38 123.00 1bs0 h ARG 301 Ca 0.28 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1bs0 h ARG 301 Cb 0.43 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1bs0 h ARG 301 CO -0.44 0.78 -0.04 0.35 -1.51 0.00 0.00 179.97 179.11 1bs0 h PHE 302 N 1.05 -0.10 -0.49 2.20 3.57 -0.72 -1.88 116.94 120.56 1bs0 h PHE 302 Ca 0.27 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 1bs0 h PHE 302 Cb 0.03 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 1bs0 h PHE 302 CO -0.00 0.13 0.09 0.00 -2.23 0.00 0.00 178.31 176.30 1bs0 h ARG 303 N -0.32 0.76 -0.60 1.11 3.08 -0.92 -1.68 114.38 115.81 1bs0 h ARG 303 Ca -0.01 -0.16 -0.10 0.00 0.07 0.00 0.00 59.98 59.79 1bs0 h ARG 303 Cb 0.28 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1bs0 h ARG 303 CO 0.02 0.70 -0.00 0.00 -1.07 0.00 0.00 179.97 179.62 1bs0 h ALA 304 N 1.38 0.86 0.00 0.04 0.00 -1.21 -2.94 119.26 117.39 1bs0 h ALA 304 Ca 0.16 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1bs0 h ALA 304 Cb 0.31 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1bs0 h ALA 304 CO 0.00 0.66 -0.21 0.78 0.00 0.00 0.00 179.25 180.48 1bs0 h GLY 305 N 0.99 0.00 2.00 0.00 0.00 -0.46 -2.73 103.07 102.87 1bs0 h GLY 305 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1bs0 h GLY 305 CO 0.03 0.00 0.00 -2.08 0.00 0.00 0.00 176.54 174.49 1bs0 h VAL 306 N 0.00 0.00 -0.73 4.60 2.07 -1.26 -3.22 116.25 117.72 1bs0 h VAL 306 Ca -0.00 -0.68 0.08 0.00 0.82 0.00 0.00 66.70 66.91 1bs0 h VAL 306 Cb 0.60 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.97 1bs0 h VAL 306 CO 0.03 0.00 0.48 1.56 0.02 0.00 0.00 177.57 179.66 1bs0 h GLN 307 N 0.00 0.69 -0.62 1.57 4.20 -1.44 -0.90 115.11 118.60 1bs0 h GLN 307 Ca 0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1bs0 h GLN 307 Cb 0.75 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1bs0 h GLN 307 CO 0.00 0.45 0.00 -0.25 -0.67 0.00 0.00 178.83 178.36 1bs0 n ASP 308 N -4.49 3.33 -4.44 1.46 8.00 -1.21 -4.92 116.55 114.28 1bs0 n ASP 308 Ca 0.11 -2.33 -0.26 0.00 0.71 0.00 0.00 54.79 53.02 1bs0 n ASP 308 Cb 0.27 -0.49 -0.11 0.00 -0.02 0.00 0.00 41.12 40.78 1bs0 n ASP 308 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1bs0 s LEU 309 N -1.41 2.48 -0.67 0.64 1.43 -0.35 -5.02 118.68 115.78 1bs0 s LEU 309 Ca 0.33 -0.90 -0.07 0.00 -1.03 0.00 0.00 54.13 52.45 1bs0 s LEU 309 Cb 0.22 -1.16 -0.18 0.00 0.03 0.00 0.00 46.19 45.09 1bs0 s LEU 309 CO 0.15 0.10 3.21 -0.81 0.23 0.00 0.00 176.35 179.23 1bs0 n PRO 310 N 0.06 2.60 -4.16 1.29 -0.04 -1.26 -4.78 135.00 128.70 1bs0 n PRO 310 Ca -0.11 -1.45 -0.10 0.00 -0.04 0.00 0.00 63.50 61.80 1bs0 n PRO 310 Cb 0.57 -2.31 -0.10 0.00 -0.04 0.00 0.00 33.50 31.62 1bs0 n PRO 310 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1bs0 s PHE 311 N 1.63 0.84 0.24 0.54 0.08 -1.26 -4.97 117.98 115.08 1bs0 s PHE 311 Ca 0.65 -1.07 0.11 0.00 0.12 0.00 0.00 56.93 56.74 1bs0 s PHE 311 Cb 0.25 -0.51 -0.05 0.00 -0.57 0.00 0.00 43.02 42.14 1bs0 s PHE 311 CO -0.02 -0.33 -0.14 0.95 -0.10 0.00 0.00 175.22 175.57 1bs0 s THR 312 N -3.83 2.81 0.17 0.64 -4.23 -0.82 -4.94 115.64 105.44 1bs0 s THR 312 Ca 0.16 -2.09 0.06 0.00 -1.18 0.00 0.00 61.69 58.64 1bs0 s THR 312 Cb 0.07 -2.45 -0.04 0.00 1.34 0.00 0.00 72.50 71.42 1bs0 s THR 312 CO -0.03 -0.29 0.12 -0.76 -0.54 0.00 0.00 174.62 173.12 1bs0 s LEU 313 N -3.27 3.71 0.56 4.79 1.43 -1.26 0.20 118.68 124.83 1bs0 s LEU 313 Ca 0.28 -0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1bs0 s LEU 313 Cb -0.07 -2.32 0.03 0.00 0.03 0.00 0.00 46.19 43.86 1bs0 s LEU 313 CO 0.15 0.06 0.80 0.00 0.23 0.00 0.00 176.35 177.59 1bs0 s ALA 314 N -1.78 3.74 -1.20 4.21 0.00 -1.25 -4.92 121.76 120.56 1bs0 s ALA 314 Ca 0.30 -1.20 -0.19 0.00 0.00 0.00 0.00 51.96 50.88 1bs0 s ALA 314 Cb -0.10 -2.19 -0.03 0.00 0.00 0.00 0.00 23.12 20.81 1bs0 s ALA 314 CO 0.23 -0.77 1.96 -3.47 0.00 0.00 0.00 175.76 173.71 1bs0 n ASP 315 N -2.40 3.68 -4.02 0.00 2.03 -1.26 -4.90 116.55 109.68 1bs0 n ASP 315 Ca 0.07 -2.79 -0.19 0.00 0.52 0.00 0.00 54.79 52.40 1bs0 n ASP 315 Cb 0.59 -1.57 -0.15 0.00 -0.72 0.00 0.00 41.12 39.28 1bs0 n ASP 315 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1bs0 s SER 316 N 4.58 1.04 -0.00 1.67 0.15 -1.26 -4.17 113.70 115.72 1bs0 s SER 316 Ca 0.56 -0.16 0.03 0.00 0.70 0.00 0.00 55.95 57.07 1bs0 s SER 316 Cb 0.08 -0.12 0.08 0.00 -1.71 0.00 0.00 66.02 64.35 1bs0 s SER 316 CO 0.05 0.11 1.06 0.00 1.20 0.00 0.00 173.24 175.67 1bs0 s SER 318 N -1.02 5.48 0.66 0.00 0.15 -1.26 -4.94 113.70 112.78 1bs0 s SER 318 Ca 0.06 0.82 0.38 0.00 0.70 0.00 0.00 55.95 57.91 1bs0 s SER 318 Cb 0.03 -1.72 2.07 0.00 -1.71 0.00 0.00 66.02 64.68 1bs0 s SER 318 CO 0.04 -1.19 2.16 0.00 1.20 0.00 0.00 173.24 175.45 1bs0 h ALA 319 N -0.36 1.15 -1.97 5.45 0.00 -1.91 -3.40 119.26 118.22 1bs0 h ALA 319 Ca -0.45 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 53.87 1bs0 h ALA 319 Cb 1.26 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 1bs0 h ALA 319 CO 0.62 -0.15 0.65 0.42 0.00 0.00 0.00 179.25 180.78 1bs0 s ILE 320 N -4.12 4.51 -0.55 0.00 1.01 -1.26 -1.57 121.20 119.22 1bs0 s ILE 320 Ca -0.04 1.12 0.04 0.00 0.00 0.00 0.00 60.65 61.77 1bs0 s ILE 320 Cb 0.11 -4.39 0.17 0.00 0.01 0.00 0.00 42.46 38.36 1bs0 s ILE 320 CO 0.35 -0.66 0.41 -1.10 0.00 0.00 0.00 174.94 173.94 1bs0 s GLN 321 N 3.66 1.63 0.26 2.79 -1.52 0.06 -4.48 119.66 122.05 1bs0 s GLN 321 Ca 0.39 -2.68 -0.30 0.00 -1.95 0.00 0.00 55.36 50.82 1bs0 s GLN 321 Cb -0.11 -2.35 -0.14 0.00 -0.22 0.00 0.00 33.01 30.20 1bs0 s GLN 321 CO 0.22 -1.34 1.30 -2.30 -0.25 0.00 0.00 175.29 172.92 1bs0 n PRO 322 N 2.44 1.85 -3.71 2.91 -0.02 -1.26 -3.74 135.00 133.47 1bs0 n PRO 322 Ca 0.25 0.66 -0.39 0.00 -2.02 0.00 0.00 63.50 62.00 1bs0 n PRO 322 Cb 0.42 -2.24 -0.12 0.00 -0.02 0.00 0.00 33.50 31.54 1bs0 n PRO 322 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1bs0 s LEU 323 N 0.00 4.49 -0.14 2.45 2.96 -0.33 -3.84 118.68 124.28 1bs0 s LEU 323 Ca 0.65 -1.16 -0.28 0.00 -0.22 0.00 0.00 54.13 53.13 1bs0 s LEU 323 Cb -0.67 -1.91 -0.01 0.00 0.50 0.00 0.00 46.19 44.10 1bs0 s LEU 323 CO 0.54 -0.36 0.94 -0.63 -1.32 0.00 0.00 176.35 175.52 1bs0 s ILE 324 N 1.43 4.81 -0.24 6.68 -1.09 0.13 -1.39 121.20 131.54 1bs0 s ILE 324 Ca -0.00 1.88 -0.01 0.00 -2.23 0.00 0.00 60.65 60.29 1bs0 s ILE 324 Cb -0.20 -4.24 -0.14 0.00 -1.58 0.00 0.00 42.46 36.29 1bs0 s ILE 324 CO 0.03 -0.01 -0.23 0.52 -1.23 0.00 0.00 174.94 174.03 1bs0 n VAL 325 N 4.70 1.35 0.00 2.92 0.31 0.62 -1.95 118.33 126.28 1bs0 n VAL 325 Ca 0.07 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 1bs0 n VAL 325 Cb 0.48 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 1bs0 n VAL 325 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bs0 n GLY 326 N 2.20 1.79 3.73 2.92 0.00 -0.13 -4.95 105.19 110.74 1bs0 n GLY 326 Ca -0.43 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.44 1bs0 n GLY 326 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bs0 s ASP 327 N -4.00 7.04 0.08 1.61 -1.08 -1.26 -2.64 116.67 116.43 1bs0 s ASP 327 Ca 0.00 2.21 -0.23 0.00 -0.52 0.00 0.00 52.55 54.01 1bs0 s ASP 327 Cb 0.00 -2.60 -0.14 0.00 -1.46 0.00 0.00 42.92 38.72 1bs0 s ASP 327 CO 0.00 -0.43 1.70 0.78 0.52 0.00 0.00 175.17 177.73 1bs0 h ASN 328 N 5.74 0.04 -0.55 -0.34 2.35 -1.95 -1.53 115.58 119.33 1bs0 h ASN 328 Ca -0.44 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.21 1bs0 h ASN 328 Cb 1.21 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 39.55 1bs0 h ASN 328 CO 0.77 0.08 0.16 0.28 -1.65 0.00 0.00 177.43 177.08 1bs0 h SER 329 N -0.00 0.81 -0.60 5.81 0.02 -2.00 -1.45 113.55 116.13 1bs0 h SER 329 Ca 0.01 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 60.79 1bs0 h SER 329 Cb 0.05 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 62.33 1bs0 h SER 329 CO -0.00 0.81 0.34 -0.09 -1.14 0.00 0.00 176.83 176.75 1bs0 h ARG 330 N 0.77 0.63 -0.15 3.45 9.65 -1.94 -0.40 114.38 126.39 1bs0 h ARG 330 Ca 0.18 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 59.00 1bs0 h ARG 330 Cb 0.30 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.73 1bs0 h ARG 330 CO -0.00 0.42 0.01 0.00 2.80 0.00 0.00 179.97 183.20 1bs0 h ALA 331 N 1.30 0.20 -0.13 2.80 0.00 -0.89 0.18 119.26 122.71 1bs0 h ALA 331 Ca 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1bs0 h ALA 331 Cb 0.12 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1bs0 h ALA 331 CO -0.15 -0.12 0.08 -0.07 0.00 0.00 0.00 179.25 178.99 1bs0 h LEU 332 N 0.01 0.13 -1.27 0.00 -0.00 -1.18 -0.11 115.31 112.89 1bs0 h LEU 332 Ca 0.04 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.96 1bs0 h LEU 332 Cb 0.34 -0.03 -0.04 0.00 -0.00 0.00 0.00 40.66 40.93 1bs0 h LEU 332 CO 0.01 0.09 0.51 1.56 -0.00 0.00 0.00 178.44 180.61 1bs0 h GLN 333 N 0.16 0.93 -0.30 1.13 4.20 -0.99 -1.67 115.11 118.57 1bs0 h GLN 333 Ca 0.05 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1bs0 h GLN 333 Cb -0.01 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.55 1bs0 h GLN 333 CO -0.02 0.61 0.16 1.25 -0.67 0.00 0.00 178.83 180.16 1bs0 h LEU 334 N 0.96 0.37 -0.77 1.46 5.85 -0.08 -1.77 115.31 121.33 1bs0 h LEU 334 Ca 0.31 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 1bs0 h LEU 334 Cb 0.04 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1bs0 h LEU 334 CO -0.09 0.36 0.38 0.00 -0.34 0.00 0.00 178.44 178.74 1bs0 h ALA 335 N 1.03 0.99 -0.56 1.25 0.00 -0.58 -0.70 119.26 120.69 1bs0 h ALA 335 Ca 0.10 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1bs0 h ALA 335 Cb 0.07 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 1bs0 h ALA 335 CO -0.02 0.55 0.34 0.93 0.00 0.00 0.00 179.25 181.05 1bs0 h GLU 336 N 1.08 0.64 -0.64 0.00 5.08 -1.24 -0.86 114.58 118.64 1bs0 h GLU 336 Ca 0.26 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.50 1bs0 h GLU 336 Cb 0.11 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1bs0 h GLU 336 CO -0.03 0.43 0.08 -0.22 -1.00 0.00 0.00 179.01 178.26 1bs0 h LYS 337 N 0.66 1.08 -0.65 2.33 1.63 -1.09 -0.53 116.57 120.00 1bs0 h LYS 337 Ca 0.23 -0.30 -0.07 0.00 -0.85 0.00 0.00 60.65 59.65 1bs0 h LYS 337 Cb 0.03 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 31.52 1bs0 h LYS 337 CO -0.10 1.01 0.12 -0.07 -3.45 0.00 0.00 179.45 176.95 1bs0 h LEU 338 N 0.99 1.02 -0.32 5.20 3.38 -0.84 -1.58 115.31 123.17 1bs0 h LEU 338 Ca 0.19 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1bs0 h LEU 338 Cb 0.47 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1bs0 h LEU 338 CO 0.02 1.01 0.16 0.03 0.09 0.00 0.00 178.44 179.75 1bs0 h ARG 339 N 0.98 0.45 -0.55 1.13 3.08 -0.92 0.14 114.38 118.69 1bs0 h ARG 339 Ca 0.20 -0.06 0.15 0.00 0.07 0.00 0.00 59.98 60.34 1bs0 h ARG 339 Cb 0.42 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 1bs0 h ARG 339 CO 0.01 0.40 0.39 1.96 -1.07 0.00 0.00 179.97 181.66 1bs0 h GLN 340 N 0.39 0.08 -0.59 0.04 4.20 -0.83 -1.04 115.11 117.37 1bs0 h GLN 340 Ca 0.11 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1bs0 h GLN 340 Cb 0.09 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1bs0 h GLN 340 CO -0.02 0.05 0.00 1.04 -0.67 0.00 0.00 178.83 179.24 1bs0 n GLN 341 N -4.40 2.57 -0.09 1.46 1.13 -0.62 -4.94 117.38 112.48 1bs0 n GLN 341 Ca 0.10 -2.41 0.00 0.00 -1.94 0.00 0.00 57.00 52.75 1bs0 n GLN 341 Cb 0.57 -1.53 0.00 0.00 0.11 0.00 0.00 30.24 29.39 1bs0 n GLN 341 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bs0 n GLY 342 N 1.57 0.95 3.16 1.08 0.00 -0.39 -5.04 105.19 106.52 1bs0 n GLY 342 Ca 0.22 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1bs0 n GLY 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bs0 s TRP 344 N 1.25 2.93 0.16 0.00 -0.11 0.15 -2.63 118.94 120.69 1bs0 s TRP 344 Ca -0.04 0.16 0.04 0.00 1.22 0.00 0.00 56.10 57.48 1bs0 s TRP 344 Cb -0.18 -3.84 -0.05 0.00 -1.50 0.00 0.00 33.47 27.90 1bs0 s TRP 344 CO -0.04 -1.11 -0.07 0.14 -4.62 0.00 0.00 176.95 171.26 1bs0 s VAL 345 N 3.55 1.10 0.03 5.86 -7.23 -1.26 -1.62 120.40 120.83 1bs0 s VAL 345 Ca 0.31 -2.05 0.04 0.00 -1.81 0.00 0.00 61.98 58.48 1bs0 s VAL 345 Cb -0.12 -1.96 -0.02 0.00 0.56 0.00 0.00 36.38 34.84 1bs0 s VAL 345 CO 0.23 -0.65 -0.12 0.42 -0.31 0.00 0.00 175.10 174.66 1bs0 s THR 346 N -3.37 0.97 0.02 5.32 -4.23 -1.26 -4.91 115.64 108.17 1bs0 s THR 346 Ca 0.19 -0.90 -0.06 0.00 -1.18 0.00 0.00 61.69 59.74 1bs0 s THR 346 Cb 0.03 -0.89 -0.05 0.00 1.34 0.00 0.00 72.50 72.94 1bs0 s THR 346 CO 0.02 -0.01 0.27 0.00 -0.54 0.00 0.00 174.62 174.37 1bs0 s ALA 347 N -0.80 3.85 -0.01 3.99 0.00 -1.26 -1.74 121.76 125.78 1bs0 s ALA 347 Ca 0.01 -0.58 0.05 0.00 0.00 0.00 0.00 51.96 51.44 1bs0 s ALA 347 Cb -0.07 -2.07 -0.01 0.00 0.00 0.00 0.00 23.12 20.97 1bs0 s ALA 347 CO 0.01 0.65 -0.17 0.42 0.00 0.00 0.00 175.76 176.67 1bs0 s ILE 348 N -1.32 1.32 0.17 0.00 1.01 0.51 -4.93 121.20 117.97 1bs0 s ILE 348 Ca 0.28 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 1bs0 s ILE 348 Cb -0.13 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.20 1bs0 s ILE 348 CO 0.17 0.36 0.10 0.00 0.00 0.00 0.00 174.94 175.57 1bs0 s ARG 349 N -0.42 1.08 0.62 2.79 1.70 -1.26 -0.72 118.95 122.73 1bs0 s ARG 349 Ca 0.06 -1.55 -0.17 0.00 -0.47 0.00 0.00 55.73 53.60 1bs0 s ARG 349 Cb -0.07 0.25 -0.10 0.00 -0.57 0.00 0.00 34.95 34.47 1bs0 s ARG 349 CO -0.01 -0.33 0.24 -2.30 -1.08 0.00 0.00 175.30 171.82 1bs0 n PRO 350 N -0.19 0.27 -0.59 3.89 -0.02 -1.25 -1.86 135.00 135.25 1bs0 n PRO 350 Ca -0.01 0.11 0.05 0.00 -2.02 0.00 0.00 63.50 61.63 1bs0 n PRO 350 Cb 0.65 -1.47 0.27 0.00 -0.02 0.00 0.00 33.50 32.94 1bs0 n PRO 350 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1bs0 n PRO 351 N 0.43 3.56 0.22 0.52 -0.04 -1.26 -4.84 135.00 133.60 1bs0 n PRO 351 Ca 0.09 -2.14 0.07 0.00 -0.04 0.00 0.00 63.50 61.48 1bs0 n PRO 351 Cb 0.49 -1.98 0.52 0.00 -0.04 0.00 0.00 33.50 32.48 1bs0 n PRO 351 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1bs0 h THR 352 N 2.77 0.96 -3.01 0.52 2.02 -1.74 -3.43 112.91 111.00 1bs0 h THR 352 Ca 0.00 -0.88 -0.53 0.00 0.77 0.00 0.00 66.41 65.77 1bs0 h THR 352 Cb 1.45 1.50 -0.16 0.00 -1.74 0.00 0.00 68.15 69.20 1bs0 h THR 352 CO 0.31 0.23 -0.77 0.68 0.37 0.00 0.00 175.52 176.34 1bs0 s VAL 353 N -4.26 1.97 0.78 3.16 -7.23 -1.24 -5.04 120.40 108.54 1bs0 s VAL 353 Ca -0.03 -2.08 -0.15 0.00 -1.81 0.00 0.00 61.98 57.92 1bs0 s VAL 353 Cb 0.14 -2.00 0.03 0.00 0.56 0.00 0.00 36.38 35.11 1bs0 s VAL 353 CO 0.67 -0.37 0.90 -2.65 -0.31 0.00 0.00 175.10 173.33 1bs0 n PRO 354 N -0.02 0.24 -1.71 4.82 -0.02 -1.26 -3.81 135.00 133.24 1bs0 n PRO 354 Ca -0.11 0.14 -0.43 0.00 -2.02 0.00 0.00 63.50 61.09 1bs0 n PRO 354 Cb 0.58 -2.18 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 1bs0 n PRO 354 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bs0 n ALA 355 N -2.91 1.93 -1.15 3.55 0.00 -1.26 -1.86 120.51 118.80 1bs0 n ALA 355 Ca 0.12 0.39 -0.05 0.00 0.00 0.00 0.00 53.44 53.89 1bs0 n ALA 355 Cb 0.50 -2.38 -0.02 0.00 0.00 0.00 0.00 19.45 17.55 1bs0 n ALA 355 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bs0 n GLY 356 N 2.10 0.78 0.64 0.00 0.00 -1.26 -4.88 105.19 102.57 1bs0 n GLY 356 Ca 0.10 -0.60 0.06 0.00 0.00 0.00 0.00 46.02 45.58 1bs0 n GLY 356 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1bs0 n THR 357 N -2.78 1.50 -1.52 2.61 5.66 -0.78 -4.37 114.28 114.60 1bs0 n THR 357 Ca -0.05 -2.28 -0.48 0.00 -3.05 0.00 0.00 64.05 58.18 1bs0 n THR 357 Cb 0.20 0.07 -0.03 0.00 -1.55 0.00 0.00 70.33 69.02 1bs0 n THR 357 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1bs0 n ALA 358 N -0.78 -1.56 -3.23 1.79 0.00 -1.08 -4.72 120.51 110.93 1bs0 n ALA 358 Ca 0.14 0.45 -0.09 0.00 0.00 0.00 0.00 53.44 53.93 1bs0 n ALA 358 Cb 0.77 -1.86 -0.04 0.00 0.00 0.00 0.00 19.45 18.31 1bs0 n ALA 358 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1bs0 s ARG 359 N -0.91 1.41 -0.11 0.00 1.70 0.10 -0.28 118.95 120.87 1bs0 s ARG 359 Ca 0.67 -1.00 -0.21 0.00 -0.47 0.00 0.00 55.73 54.72 1bs0 s ARG 359 Cb -0.87 0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 33.97 1bs0 s ARG 359 CO 0.56 -0.59 0.61 -0.51 -1.08 0.00 0.00 175.30 174.29 1bs0 s LEU 360 N -2.92 4.27 -0.66 -1.89 1.43 -0.48 -0.36 118.68 118.07 1bs0 s LEU 360 Ca 0.13 0.99 -0.15 0.00 -1.03 0.00 0.00 54.13 54.07 1bs0 s LEU 360 Cb -0.01 -2.91 0.17 0.00 0.03 0.00 0.00 46.19 43.47 1bs0 s LEU 360 CO 0.01 -0.10 0.61 -0.60 0.23 0.00 0.00 176.35 176.50 1bs0 s ARG 361 N 0.93 3.24 0.12 1.70 3.52 -0.71 -1.18 118.95 126.57 1bs0 s ARG 361 Ca 0.32 -2.01 -0.17 0.00 -0.13 0.00 0.00 55.73 53.73 1bs0 s ARG 361 Cb -0.16 -4.35 -0.07 0.00 -1.56 0.00 0.00 34.95 28.80 1bs0 s ARG 361 CO 0.14 -1.32 0.58 -0.51 -0.81 0.00 0.00 175.30 173.38 1bs0 s LEU 362 N 1.03 4.43 0.04 -0.88 1.43 -1.25 -4.54 118.68 118.94 1bs0 s LEU 362 Ca 0.09 1.21 0.06 0.00 -1.03 0.00 0.00 54.13 54.46 1bs0 s LEU 362 Cb -0.22 -3.15 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 1bs0 s LEU 362 CO -0.02 0.17 -0.17 0.42 0.23 0.00 0.00 176.35 176.98 1bs0 s THR 363 N -1.31 1.34 0.21 5.49 -4.23 -0.58 -0.76 115.64 115.80 1bs0 s THR 363 Ca 0.35 -1.06 0.08 0.00 -1.18 0.00 0.00 61.69 59.88 1bs0 s THR 363 Cb -0.17 -1.18 -0.04 0.00 1.34 0.00 0.00 72.50 72.44 1bs0 s THR 363 CO 0.19 0.10 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.61 1bs0 s LEU 364 N -1.11 3.23 0.12 4.79 1.43 -0.61 -4.35 118.68 122.18 1bs0 s LEU 364 Ca 0.04 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1bs0 s LEU 364 Cb -0.08 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 1bs0 s LEU 364 CO 0.01 0.05 -0.00 0.42 0.23 0.00 0.00 176.35 177.07 1bs0 s THR 365 N -1.96 0.41 -0.98 5.49 -4.23 -1.26 -4.71 115.64 108.40 1bs0 s THR 365 Ca 0.29 -1.91 0.13 0.00 -1.18 0.00 0.00 61.69 59.02 1bs0 s THR 365 Cb -0.08 -1.88 0.11 0.00 1.34 0.00 0.00 72.50 71.99 1bs0 s THR 365 CO 0.19 -0.66 1.43 0.00 -0.54 0.00 0.00 174.62 175.03 1bs0 n ALA 366 N -0.08 1.60 0.50 3.99 0.00 0.28 -1.61 120.51 125.19 1bs0 n ALA 366 Ca -0.09 -0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.44 1bs0 n ALA 366 Cb 0.62 -1.22 0.32 0.00 0.00 0.00 0.00 19.45 19.17 1bs0 n ALA 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bs0 h ALA 367 N 2.44 0.96 -2.37 0.00 0.00 -1.83 -3.46 119.26 115.00 1bs0 h ALA 367 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1bs0 h ALA 367 Cb 0.23 0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.14 1bs0 h ALA 367 CO 0.00 0.00 0.31 -1.01 0.00 0.00 0.00 179.25 178.55 1bs0 s HIS 368 N -3.14 2.64 0.36 0.00 4.02 -0.64 -4.70 115.29 113.84 1bs0 s HIS 368 Ca 0.09 1.25 0.08 0.00 1.02 0.00 0.00 55.06 57.50 1bs0 s HIS 368 Cb 0.10 -3.11 -0.07 0.00 -1.02 0.00 0.00 32.58 28.48 1bs0 s HIS 368 CO 0.63 -1.96 -0.05 -1.21 1.02 0.00 0.00 174.74 173.17 1bs0 s GLU 369 N -5.04 1.85 0.22 1.40 0.41 -1.26 -5.00 118.70 111.28 1bs0 s GLU 369 Ca 0.62 -1.99 -0.09 0.00 -0.41 0.00 0.00 54.97 53.09 1bs0 s GLU 369 Cb -0.16 -1.65 0.18 0.00 -1.78 0.00 0.00 34.13 30.73 1bs0 s GLU 369 CO 0.55 0.06 1.87 0.52 -0.49 0.00 0.00 175.26 177.78 1bs0 h MET 370 N 1.95 1.10 0.00 1.61 2.86 -1.99 -0.81 114.93 119.64 1bs0 h MET 370 Ca -0.43 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 1bs0 h MET 370 Cb 1.25 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1bs0 h MET 370 CO 0.74 0.76 0.00 -0.56 1.06 0.00 0.00 176.91 178.91 1bs0 h GLN 371 N 1.12 0.00 -0.20 1.72 -0.00 -1.99 -1.57 115.11 114.19 1bs0 h GLN 371 Ca 0.30 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 58.78 1bs0 h GLN 371 Cb -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.41 1bs0 h GLN 371 CO -0.06 0.00 -0.51 -0.44 -0.00 0.00 0.00 178.83 177.82 1bs0 h ASP 372 N 0.00 0.80 -0.69 0.06 3.32 -1.55 -1.03 116.42 117.34 1bs0 h ASP 372 Ca 0.00 -0.57 -0.07 0.00 0.02 0.00 0.00 57.03 56.41 1bs0 h ASP 372 Cb 0.25 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1bs0 h ASP 372 CO 0.00 1.23 0.18 0.40 -1.72 0.00 0.00 179.24 179.33 1bs0 h ILE 373 N 0.42 1.26 -0.33 0.35 1.08 -1.22 -1.45 117.51 117.61 1bs0 h ILE 373 Ca -0.01 -0.95 -0.06 0.00 -0.39 0.00 0.00 64.86 63.45 1bs0 h ILE 373 Cb 1.13 0.53 -0.02 0.00 -3.07 0.00 0.00 36.82 35.39 1bs0 h ILE 373 CO 0.11 0.37 -0.06 0.44 -0.69 0.00 0.00 178.15 178.31 1bs0 h ASP 374 N 1.05 0.52 -0.30 1.72 3.32 -1.22 -1.22 116.42 120.29 1bs0 h ASP 374 Ca 0.22 -0.12 -0.11 0.00 0.02 0.00 0.00 57.03 57.05 1bs0 h ASP 374 Cb 0.35 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1bs0 h ASP 374 CO 0.00 0.63 -0.23 -0.09 -1.72 0.00 0.00 179.24 177.83 1bs0 h ARG 375 N 0.51 0.69 -0.04 3.56 9.65 -0.80 -1.20 114.38 126.74 1bs0 h ARG 375 Ca 0.10 -0.34 0.03 0.00 -1.10 0.00 0.00 59.98 58.67 1bs0 h ARG 375 Cb 0.43 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.97 1bs0 h ARG 375 CO 0.02 0.95 -0.14 1.25 2.80 0.00 0.00 179.97 184.85 1bs0 h LEU 376 N 0.44 -0.41 -0.90 3.80 5.85 -1.00 -1.96 115.31 121.12 1bs0 h LEU 376 Ca 0.06 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.89 1bs0 h LEU 376 Cb 0.79 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.94 1bs0 h LEU 376 CO 0.06 -0.19 0.58 -0.07 -0.34 0.00 0.00 178.44 178.48 1bs0 h LEU 377 N -0.21 0.94 -0.51 2.25 3.38 -1.13 -0.37 115.31 119.66 1bs0 h LEU 377 Ca 0.06 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1bs0 h LEU 377 Cb 0.29 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1bs0 h LEU 377 CO -0.17 0.62 -0.05 -0.08 0.09 0.00 0.00 178.44 178.86 1bs0 h GLU 378 N 1.09 0.93 -0.33 1.13 4.81 -0.89 -0.69 114.58 120.63 1bs0 h GLU 378 Ca 0.37 -0.32 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1bs0 h GLU 378 Cb 0.08 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1bs0 h GLU 378 CO -0.14 0.98 -0.08 0.28 -0.73 0.00 0.00 179.01 179.31 1bs0 h VAL 379 N 0.79 1.23 0.00 0.32 2.07 -1.07 -1.63 116.25 117.96 1bs0 h VAL 379 Ca 0.14 -0.98 -0.08 0.00 0.82 0.00 0.00 66.70 66.60 1bs0 h VAL 379 Cb 0.59 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1bs0 h VAL 379 CO 0.04 0.33 -0.38 -0.07 0.02 0.00 0.00 177.57 177.50 1bs0 h LEU 380 N 0.52 0.00 -0.09 2.57 3.38 -0.42 -2.75 115.31 118.52 1bs0 h LEU 380 Ca 0.10 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 1bs0 h LEU 380 Cb 0.46 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1bs0 h LEU 380 CO 0.02 0.38 -0.50 -0.74 0.09 0.00 0.00 178.44 177.70 1bs0 h HIS 381 N 0.00 0.68 0.00 1.13 2.76 -0.67 -0.55 115.15 118.50 1bs0 h HIS 381 Ca -0.00 -0.30 0.00 0.00 -2.20 0.00 0.00 60.37 57.86 1bs0 h HIS 381 Cb 0.76 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.61 1bs0 h HIS 381 CO 0.00 1.08 0.00 0.41 -1.30 0.00 0.00 177.93 178.12 1bs0 n GLY 382 N 0.73 -0.97 0.00 5.26 0.00 -0.66 -3.44 105.19 106.12 1bs0 n GLY 382 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1bs0 n GLY 382 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bs0 n ASN 383 N -1.14 0.07 0.00 1.61 3.02 -1.05 -5.08 115.26 112.69 1bs0 n ASN 383 Ca 0.16 -0.34 0.12 0.00 -0.03 0.00 0.00 54.58 54.49 1bs0 n ASN 383 Cb 0.14 0.26 0.74 0.00 -0.61 0.00 0.00 39.78 40.32 1bs0 n ASN 383 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25