#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bx6 h GLU 13 N 0.00 0.00 0.38 3.69 4.81 -2.06 -3.35 114.58 118.05 1bx6 h GLU 13 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1bx6 h GLU 13 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1bx6 h GLU 13 CO 0.00 0.18 -0.18 0.77 -0.73 0.00 0.00 179.01 179.05 1bx6 h SER 14 N 0.00 -0.44 -0.57 1.04 0.02 -2.07 -3.36 113.55 108.18 1bx6 h SER 14 Ca -0.09 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 60.93 1bx6 h SER 14 Cb 1.35 0.11 -0.08 0.00 0.14 0.00 0.00 62.40 63.92 1bx6 h SER 14 CO 0.03 -0.16 -0.41 1.62 -1.14 0.00 0.00 176.83 176.76 1bx6 h VAL 15 N -0.82 0.00 0.00 2.27 3.04 -2.03 -3.26 116.25 115.45 1bx6 h VAL 15 Ca -0.05 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 1bx6 h VAL 15 Cb 0.39 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.67 1bx6 h VAL 15 CO 0.09 0.00 0.00 2.29 -1.01 0.00 0.00 177.57 178.94 1bx6 n LYS 16 N -4.61 0.00 0.00 4.17 2.85 -1.25 -2.74 118.16 116.57 1bx6 n LYS 16 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1bx6 n LYS 16 Cb 0.21 -0.18 0.00 0.00 -0.65 0.00 0.00 35.03 34.41 1bx6 n LYS 16 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1bx6 n GLU 17 N 0.00 0.00 0.00 -1.58 1.02 -1.25 0.21 120.64 119.03 1bx6 n GLU 17 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1bx6 n GLU 17 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1bx6 n GLU 17 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1bx6 n PHE 18 N -2.80 0.00 0.14 -0.32 7.35 -1.16 -0.62 117.46 120.06 1bx6 n PHE 18 Ca 0.00 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.54 1bx6 n PHE 18 Cb 0.00 -0.38 -0.08 0.00 0.35 0.00 0.00 39.48 39.38 1bx6 n PHE 18 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1bx6 h LEU 19 N 0.00 -1.21 -0.15 -2.13 3.38 0.26 0.53 115.31 115.98 1bx6 h LEU 19 Ca 0.00 0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.11 1bx6 h LEU 19 Cb 0.00 0.45 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1bx6 h LEU 19 CO 0.00 -0.50 -0.09 0.00 0.09 0.00 0.00 178.44 177.94 1bx6 n ALA 20 N -2.81 -0.10 0.06 1.53 0.00 -0.30 0.37 120.51 119.26 1bx6 n ALA 20 Ca -0.08 0.13 -0.12 0.00 0.00 0.00 0.00 53.44 53.37 1bx6 n ALA 20 Cb 0.38 0.06 -0.07 0.00 0.00 0.00 0.00 19.45 19.83 1bx6 n ALA 20 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1bx6 h LYS 21 N 0.00 -0.05 -0.95 0.00 1.57 -0.44 -2.02 116.57 114.67 1bx6 h LYS 21 Ca 0.02 0.00 0.33 0.00 -1.87 0.00 0.00 60.65 59.14 1bx6 h LYS 21 Cb 0.06 0.01 -0.17 0.00 0.08 0.00 0.00 32.23 32.21 1bx6 h LYS 21 CO -0.14 -0.04 0.27 0.00 -0.57 0.00 0.00 179.45 178.97 1bx6 n ALA 22 N -2.13 0.73 0.12 3.86 0.00 1.19 0.10 120.51 124.39 1bx6 n ALA 22 Ca -0.07 0.99 -0.14 0.00 0.00 0.00 0.00 53.44 54.22 1bx6 n ALA 22 Cb 0.06 -0.85 -0.08 0.00 0.00 0.00 0.00 19.45 18.57 1bx6 n ALA 22 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1bx6 h LYS 23 N 0.00 -0.26 -0.34 0.00 3.64 0.20 -3.02 116.57 116.80 1bx6 h LYS 23 Ca 0.69 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 60.12 1bx6 h LYS 23 Cb 1.66 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 33.49 1bx6 h LYS 23 CO -0.81 -0.06 -0.28 0.93 -2.27 0.00 0.00 179.45 176.96 1bx6 h GLU 24 N -0.42 -0.10 0.00 1.90 5.08 0.10 -0.77 114.58 120.38 1bx6 h GLU 24 Ca -0.03 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1bx6 h GLU 24 Cb 0.32 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1bx6 h GLU 24 CO 0.05 -0.06 0.00 -0.25 -1.00 0.00 0.00 179.01 177.74 1bx6 n ASP 25 N -4.05 0.00 -0.01 1.42 9.92 -0.77 -1.64 116.55 121.43 1bx6 n ASP 25 Ca -0.00 0.85 -0.00 0.00 -0.53 0.00 0.00 54.79 55.11 1bx6 n ASP 25 Cb 0.15 -0.40 -0.00 0.00 -0.64 0.00 0.00 41.12 40.23 1bx6 n ASP 25 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1bx6 n PHE 26 N -2.66 -0.01 -0.24 1.24 7.35 -0.41 -1.04 117.46 121.71 1bx6 n PHE 26 Ca 0.00 0.03 0.00 0.00 -0.76 0.00 0.00 57.45 56.72 1bx6 n PHE 26 Cb 0.00 -0.25 0.12 0.00 0.35 0.00 0.00 39.48 39.70 1bx6 n PHE 26 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1bx6 h LEU 27 N 0.00 0.48 -0.10 -2.13 3.38 -0.53 -1.54 115.31 114.86 1bx6 h LEU 27 Ca 0.00 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1bx6 h LEU 27 Cb 0.01 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 1bx6 h LEU 27 CO -0.02 0.29 -0.41 0.50 0.09 0.00 0.00 178.44 178.88 1bx6 h LYS 28 N 0.62 -0.43 -0.37 1.13 3.64 -0.12 0.14 116.57 121.18 1bx6 h LYS 28 Ca 0.33 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 1bx6 h LYS 28 Cb 0.30 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1bx6 h LYS 28 CO -0.24 -0.28 0.00 1.63 -2.27 0.00 0.00 179.45 178.29 1bx6 n LYS 29 N -4.73 0.40 0.00 1.90 4.76 -0.66 -0.90 118.16 118.93 1bx6 n LYS 29 Ca -0.05 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.39 1bx6 n LYS 29 Cb 0.29 -1.18 0.00 0.00 -1.84 0.00 0.00 35.03 32.29 1bx6 n LYS 29 CO 0.00 0.00 0.00 1.87 -1.37 0.00 0.00 177.40 177.90 1bx6 n TRP 30 N 0.24 0.00 -0.06 2.13 -0.00 -0.13 -4.26 117.44 115.35 1bx6 n TRP 30 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.50 57.47 1bx6 n TRP 30 Cb 0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 31.31 31.38 1bx6 n TRP 30 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 1bx6 h GLU 31 N 0.00 0.00 -4.55 5.87 5.08 0.11 -3.42 114.58 117.67 1bx6 h GLU 31 Ca 0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.69 1bx6 h GLU 31 Cb 0.00 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 28.87 1bx6 h GLU 31 CO 0.00 0.12 -0.66 0.95 -1.00 0.00 0.00 179.01 178.42 1bx6 s THR 32 N -1.79 2.63 0.11 1.13 -4.23 -0.89 -5.09 115.64 107.51 1bx6 s THR 32 Ca -0.06 -2.31 0.02 0.00 -1.18 0.00 0.00 61.69 58.16 1bx6 s THR 32 Cb 0.00 -2.88 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 1bx6 s THR 32 CO 0.13 -0.64 0.17 -2.84 -0.54 0.00 0.00 174.62 170.90 1bx6 s PRO 33 N 0.91 3.17 0.06 3.99 0.02 -1.26 -4.51 135.00 137.36 1bx6 s PRO 33 Ca 0.11 -0.63 -0.31 0.00 0.02 0.00 0.00 61.00 60.19 1bx6 s PRO 33 Cb -0.20 -2.85 -0.07 0.00 0.02 0.00 0.00 34.50 31.40 1bx6 s PRO 33 CO -0.06 0.55 1.37 0.45 -0.33 0.00 0.00 177.00 178.98 1bx6 s SER 34 N -2.74 6.87 0.00 2.53 0.15 -1.26 -5.00 113.70 114.24 1bx6 s SER 34 Ca 0.32 2.19 0.00 0.00 0.70 0.00 0.00 55.95 59.16 1bx6 s SER 34 Cb -0.12 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1bx6 s SER 34 CO 0.25 -0.65 0.28 0.00 1.20 0.00 0.00 173.24 174.32 1bx6 n GLN 35 N 4.57 0.00 -4.46 5.44 1.13 -1.26 -4.92 117.38 117.88 1bx6 n GLN 35 Ca 0.12 0.05 -0.23 0.00 -1.94 0.00 0.00 57.00 55.00 1bx6 n GLN 35 Cb 0.43 -0.78 -0.10 0.00 0.11 0.00 0.00 30.24 29.90 1bx6 n GLN 35 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1bx6 s ASN 36 N -2.18 3.15 0.00 1.08 -0.87 -1.26 -4.63 114.94 110.23 1bx6 s ASN 36 Ca 0.00 -1.16 0.00 0.00 -1.57 0.00 0.00 52.86 50.13 1bx6 s ASN 36 Cb 0.00 -0.24 0.00 0.00 -0.02 0.00 0.00 41.25 40.99 1bx6 s ASN 36 CO 0.00 -0.24 0.60 1.07 -2.57 0.00 0.00 177.10 175.96 1bx6 n THR 37 N -0.64 0.00 0.00 1.60 5.66 -0.16 -4.91 114.28 115.83 1bx6 n THR 37 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 1bx6 n THR 37 Cb 0.63 0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.67 1bx6 n THR 37 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1bx6 n ALA 38 N 0.00 0.00 -3.73 1.79 0.00 -1.26 -4.73 120.51 112.58 1bx6 n ALA 38 Ca -0.15 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.12 1bx6 n ALA 38 Cb 0.50 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.79 1bx6 n ALA 38 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1bx6 s GLN 39 N -2.00 0.08 0.00 0.00 -0.21 -1.26 -4.68 119.66 111.59 1bx6 s GLN 39 Ca 0.00 0.19 0.00 0.00 0.02 0.00 0.00 55.36 55.57 1bx6 s GLN 39 Cb 0.00 -0.41 0.00 0.00 1.00 0.00 0.00 33.01 33.60 1bx6 s GLN 39 CO 0.00 -0.20 0.00 -0.11 -2.12 0.00 0.00 175.29 172.86 1bx6 n LEU 40 N 4.46 0.00 -2.45 2.90 -0.00 -1.26 -1.62 117.00 119.02 1bx6 n LEU 40 Ca -0.21 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 55.63 1bx6 n LEU 40 Cb 0.50 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.82 1bx6 n LEU 40 CO 0.18 0.00 1.90 0.47 -0.00 0.00 0.00 177.39 179.94 1bx6 n ASP 41 N -3.17 5.19 -0.19 1.96 8.00 -1.26 -2.10 116.55 124.98 1bx6 n ASP 41 Ca 0.00 -2.35 0.01 0.00 0.71 0.00 0.00 54.79 53.16 1bx6 n ASP 41 Cb 0.00 -1.22 0.01 0.00 -0.02 0.00 0.00 41.12 39.89 1bx6 n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bx6 n GLN 42 N 2.98 0.50 -3.99 -1.24 6.02 -0.64 -5.03 117.38 115.98 1bx6 n GLN 42 Ca 0.44 -1.02 -0.16 0.00 -0.01 0.00 0.00 57.00 56.25 1bx6 n GLN 42 Cb 0.58 -0.67 -0.16 0.00 1.02 0.00 0.00 30.24 31.01 1bx6 n GLN 42 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1bx6 s PHE 43 N -0.43 0.35 -0.14 1.08 0.08 -0.89 -1.04 117.98 116.99 1bx6 s PHE 43 Ca 0.03 -0.04 -0.24 0.00 0.12 0.00 0.00 56.93 56.81 1bx6 s PHE 43 Cb 0.03 -0.37 -0.02 0.00 -0.57 0.00 0.00 43.02 42.09 1bx6 s PHE 43 CO 0.00 -0.10 0.74 -0.51 -0.10 0.00 0.00 175.22 175.26 1bx6 s ASP 44 N 0.67 6.90 -0.05 1.36 1.01 -1.07 -4.92 116.67 120.57 1bx6 s ASP 44 Ca -0.07 1.10 -0.26 0.00 0.71 0.00 0.00 52.55 54.03 1bx6 s ASP 44 Cb -0.10 -2.42 -0.03 0.00 1.01 0.00 0.00 42.92 41.38 1bx6 s ASP 44 CO -0.01 -0.28 0.84 -0.13 0.21 0.00 0.00 175.17 175.79 1bx6 s ARG 45 N 1.67 4.47 -0.24 8.23 0.52 -1.26 -1.80 118.95 130.54 1bx6 s ARG 45 Ca 0.36 1.13 -0.08 0.00 -0.52 0.00 0.00 55.73 56.61 1bx6 s ARG 45 Cb -0.17 -3.47 -0.12 0.00 0.52 0.00 0.00 34.95 31.72 1bx6 s ARG 45 CO 0.14 -0.03 -0.28 -0.89 0.02 0.00 0.00 175.30 174.25 1bx6 n ILE 46 N 3.95 1.33 -3.61 1.52 5.41 0.09 -4.98 119.36 123.07 1bx6 n ILE 46 Ca 0.03 -0.39 -0.04 0.00 1.00 0.00 0.00 62.75 63.34 1bx6 n ILE 46 Cb 0.51 -1.67 -0.03 0.00 -0.71 0.00 0.00 39.64 37.74 1bx6 n ILE 46 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1bx6 s LYS 47 N -2.45 0.27 -0.12 0.38 2.20 -1.23 -4.97 119.74 113.82 1bx6 s LYS 47 Ca -0.33 -0.05 -0.20 0.00 -0.36 0.00 0.00 55.97 55.02 1bx6 s LYS 47 Cb 0.12 0.12 -0.04 0.00 -1.51 0.00 0.00 37.83 36.52 1bx6 s LYS 47 CO 0.46 -0.11 0.59 0.99 -0.36 0.00 0.00 175.35 176.92 1bx6 s THR 48 N -1.97 5.10 -0.08 3.43 2.01 -1.26 -0.69 115.64 122.18 1bx6 s THR 48 Ca 0.08 1.17 0.02 0.00 0.31 0.00 0.00 61.69 63.27 1bx6 s THR 48 Cb -0.01 -3.92 -0.25 0.00 0.01 0.00 0.00 72.50 68.33 1bx6 s THR 48 CO -0.05 0.25 0.51 0.18 -0.69 0.00 0.00 174.62 174.83 1bx6 n LEU 49 N 4.06 1.85 -3.61 4.42 4.77 0.10 -4.40 117.00 124.20 1bx6 n LEU 49 Ca -0.04 0.31 -0.07 0.00 -0.03 0.00 0.00 56.01 56.18 1bx6 n LEU 49 Cb 0.51 -0.55 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 1bx6 n LEU 49 CO 0.45 0.64 0.62 -0.83 -1.33 0.00 0.00 177.39 176.94 1bx6 s GLY 50 N -5.36 -0.38 0.24 -0.72 0.00 -1.19 -4.72 107.32 95.20 1bx6 s GLY 50 Ca -0.14 0.49 0.10 0.00 0.00 0.00 0.00 44.72 45.17 1bx6 s GLY 50 CO 0.80 0.15 -0.18 -0.51 0.00 0.00 0.00 173.10 173.36 1bx6 s THR 51 N -3.38 2.16 0.24 0.90 -4.23 -1.26 -0.60 115.64 109.47 1bx6 s THR 51 Ca 0.07 -2.29 -0.20 0.00 -1.18 0.00 0.00 61.69 58.09 1bx6 s THR 51 Cb -0.02 -2.17 0.03 0.00 1.34 0.00 0.00 72.50 71.68 1bx6 s THR 51 CO -0.04 -0.45 0.65 -0.83 -0.54 0.00 0.00 174.62 173.41 1bx6 s GLY 52 N -3.34 -0.16 0.62 3.99 0.00 -0.17 -4.94 107.32 103.32 1bx6 s GLY 52 Ca 0.26 -0.17 0.04 0.00 0.00 0.00 0.00 44.72 44.84 1bx6 s GLY 52 CO 0.11 -0.09 1.08 1.48 0.00 0.00 0.00 173.10 175.68 1bx6 h SER 53 N 2.04 0.00 0.00 1.64 4.64 -2.02 -0.95 113.55 118.90 1bx6 h SER 53 Ca -0.24 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.04 1bx6 h SER 53 Cb 1.26 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.27 1bx6 h SER 53 CO 0.29 0.00 -0.49 2.22 -0.87 0.00 0.00 176.83 177.98 1bx6 n PHE 54 N -2.46 0.00 -3.05 4.77 -1.74 -1.26 -4.98 117.46 108.74 1bx6 n PHE 54 Ca -0.00 -0.12 0.00 0.00 -0.56 0.00 0.00 57.45 56.76 1bx6 n PHE 54 Cb 0.89 0.02 0.00 0.00 1.52 0.00 0.00 39.48 41.91 1bx6 n PHE 54 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1bx6 n GLY 55 N 0.09 -1.04 3.43 4.97 0.00 -0.36 -0.97 105.19 111.31 1bx6 n GLY 55 Ca -0.01 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 1bx6 n GLY 55 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bx6 s ARG 56 N -0.11 1.19 -0.01 1.61 1.70 -1.11 -1.00 118.95 121.23 1bx6 s ARG 56 Ca 0.00 -0.32 -0.01 0.00 -0.47 0.00 0.00 55.73 54.93 1bx6 s ARG 56 Cb 0.00 0.55 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 1bx6 s ARG 56 CO 0.00 -0.48 0.09 0.08 -1.08 0.00 0.00 175.30 173.91 1bx6 s VAL 57 N -3.12 4.80 0.00 4.99 1.01 0.23 -2.47 120.40 125.84 1bx6 s VAL 57 Ca -0.02 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1bx6 s VAL 57 Cb -0.01 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 1bx6 s VAL 57 CO -0.07 0.35 -0.04 -0.04 0.00 0.00 0.00 175.10 175.30 1bx6 s MET 58 N -1.74 0.28 0.08 2.72 -1.94 -0.15 0.03 119.30 118.58 1bx6 s MET 58 Ca 0.23 -0.22 -0.31 0.00 -1.71 0.00 0.00 55.69 53.68 1bx6 s MET 58 Cb -0.12 -0.21 -0.07 0.00 2.01 0.00 0.00 34.83 36.44 1bx6 s MET 58 CO 0.14 0.05 1.31 -1.17 -0.01 0.00 0.00 175.02 175.34 1bx6 s LEU 59 N -0.35 4.36 0.02 -0.03 2.96 0.13 -0.53 118.68 125.24 1bx6 s LEU 59 Ca -0.01 2.17 0.02 0.00 -0.22 0.00 0.00 54.13 56.08 1bx6 s LEU 59 Cb -0.03 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.07 1bx6 s LEU 59 CO -0.00 -0.58 -0.06 0.68 -1.32 0.00 0.00 176.35 175.07 1bx6 s VAL 60 N 1.24 0.40 -0.25 1.68 -7.23 0.11 -0.73 120.40 115.62 1bx6 s VAL 60 Ca 0.62 -0.62 -0.03 0.00 -1.81 0.00 0.00 61.98 60.14 1bx6 s VAL 60 Cb -0.33 -0.42 0.02 0.00 0.56 0.00 0.00 36.38 36.21 1bx6 s VAL 60 CO 0.29 -0.16 -0.04 -0.75 -0.31 0.00 0.00 175.10 174.13 1bx6 s LYS 61 N -0.84 3.00 -0.42 4.82 2.20 -0.75 0.62 119.74 128.38 1bx6 s LYS 61 Ca -0.05 -0.88 -0.29 0.00 -0.36 0.00 0.00 55.97 54.39 1bx6 s LYS 61 Cb -0.06 -3.03 -0.09 0.00 -1.51 0.00 0.00 37.83 33.15 1bx6 s LYS 61 CO -0.00 -0.35 2.33 1.58 -0.36 0.00 0.00 175.35 178.54 1bx6 n HIS 62 N 4.72 1.56 -0.16 4.03 -0.00 0.53 -2.61 115.22 123.29 1bx6 n HIS 62 Ca -0.17 0.11 -0.03 0.00 -0.00 0.00 0.00 57.72 57.63 1bx6 n HIS 62 Cb 0.48 -2.62 -0.03 0.00 -0.00 0.00 0.00 29.99 27.83 1bx6 n HIS 62 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 1bx6 n LYS 63 N 8.68 -0.15 -0.06 1.57 5.02 -0.21 -1.41 118.16 131.60 1bx6 n LYS 63 Ca 0.39 0.57 -0.05 0.00 -2.02 0.00 0.00 58.31 57.20 1bx6 n LYS 63 Cb 0.39 -0.84 -0.15 0.00 -0.02 0.00 0.00 35.03 34.41 1bx6 n LYS 63 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1bx6 n GLU 64 N -4.48 0.67 -3.20 1.97 2.13 -1.26 -4.65 120.64 111.82 1bx6 n GLU 64 Ca 0.01 0.01 -0.37 0.00 0.66 0.00 0.00 57.16 57.47 1bx6 n GLU 64 Cb 0.11 -1.58 -0.03 0.00 0.27 0.00 0.00 31.44 30.21 1bx6 n GLU 64 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1bx6 n SER 65 N -2.70 5.33 0.00 4.31 7.64 -0.50 -4.96 113.62 122.73 1bx6 n SER 65 Ca -0.24 -3.40 0.00 0.00 1.01 0.00 0.00 58.87 56.25 1bx6 n SER 65 Cb 1.01 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1bx6 n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bx6 n GLY 66 N 1.26 0.00 3.63 0.23 0.00 -0.98 -4.41 105.19 104.91 1bx6 n GLY 66 Ca 0.27 0.00 -0.62 0.00 0.00 0.00 0.00 46.02 45.67 1bx6 n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bx6 n ASN 67 N -0.10 0.83 -4.91 1.61 3.02 -1.26 -4.22 115.26 110.22 1bx6 n ASN 67 Ca 0.00 1.16 -0.28 0.00 -0.03 0.00 0.00 54.58 55.43 1bx6 n ASN 67 Cb 0.00 -0.95 0.06 0.00 -0.61 0.00 0.00 39.78 38.28 1bx6 n ASN 67 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1bx6 s HIS 68 N 1.55 3.11 0.07 3.10 3.76 -1.26 -0.35 115.29 125.27 1bx6 s HIS 68 Ca 0.97 0.74 -0.26 0.00 -0.15 0.00 0.00 55.06 56.36 1bx6 s HIS 68 Cb -1.32 -3.14 0.09 0.00 1.11 0.00 0.00 32.58 29.31 1bx6 s HIS 68 CO 0.67 -1.32 0.74 0.71 -0.85 0.00 0.00 174.74 174.70 1bx6 s TYR 69 N -3.31 -0.45 -0.12 1.40 1.51 0.20 -4.52 117.35 112.06 1bx6 s TYR 69 Ca 0.59 0.31 -0.07 0.00 -1.01 0.00 0.00 57.07 56.89 1bx6 s TYR 69 Cb -0.11 0.54 -0.04 0.00 -0.11 0.00 0.00 41.96 42.24 1bx6 s TYR 69 CO 0.48 -0.69 0.13 0.00 -1.11 0.00 0.00 175.55 174.36 1bx6 s ALA 70 N -3.31 3.84 -0.16 3.71 0.00 0.25 0.05 121.76 126.14 1bx6 s ALA 70 Ca 0.02 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.35 1bx6 s ALA 70 Cb -0.01 -1.96 0.02 0.00 0.00 0.00 0.00 23.12 21.17 1bx6 s ALA 70 CO -0.10 0.59 -0.20 1.41 0.00 0.00 0.00 175.76 177.46 1bx6 s MET 71 N -0.93 2.85 -0.44 0.00 1.75 0.31 0.93 119.30 123.76 1bx6 s MET 71 Ca 0.14 -0.78 -0.21 0.00 -1.25 0.00 0.00 55.69 53.59 1bx6 s MET 71 Cb -0.12 -2.41 0.02 0.00 2.84 0.00 0.00 34.83 35.17 1bx6 s MET 71 CO 0.04 -0.13 0.68 0.21 -0.65 0.00 0.00 175.02 175.16 1bx6 s LYS 72 N 1.13 3.32 -0.21 4.11 2.20 0.72 -0.98 119.74 130.02 1bx6 s LYS 72 Ca -0.00 -0.29 -0.04 0.00 -0.36 0.00 0.00 55.97 55.27 1bx6 s LYS 72 Cb -0.14 -3.94 -0.01 0.00 -1.51 0.00 0.00 37.83 32.22 1bx6 s LYS 72 CO -0.08 -1.03 -0.02 0.42 -0.36 0.00 0.00 175.35 174.27 1bx6 s ILE 73 N 2.94 3.60 -0.03 5.43 1.01 -1.03 0.15 121.20 133.27 1bx6 s ILE 73 Ca 0.24 -0.42 0.07 0.00 0.00 0.00 0.00 60.65 60.54 1bx6 s ILE 73 Cb -0.14 -2.64 -0.02 0.00 0.01 0.00 0.00 42.46 39.68 1bx6 s ILE 73 CO 0.20 0.42 -0.22 -0.76 0.00 0.00 0.00 174.94 174.58 1bx6 s LEU 74 N 1.30 2.25 -0.96 2.97 1.02 -0.26 -2.74 118.68 122.26 1bx6 s LEU 74 Ca 0.04 -0.39 -0.23 0.00 0.02 0.00 0.00 54.13 53.56 1bx6 s LEU 74 Cb -0.14 -1.41 0.05 0.00 0.02 0.00 0.00 46.19 44.71 1bx6 s LEU 74 CO -0.01 0.32 1.39 -0.62 0.02 0.00 0.00 176.35 177.46 1bx6 s ASP 75 N -0.60 6.45 0.18 2.29 -1.08 -0.14 -0.74 116.67 123.02 1bx6 s ASP 75 Ca 0.09 -1.32 -0.06 0.00 -0.52 0.00 0.00 52.55 50.75 1bx6 s ASP 75 Cb -0.11 -2.56 0.29 0.00 -1.46 0.00 0.00 42.92 39.09 1bx6 s ASP 75 CO -0.00 -1.53 1.02 0.29 0.52 0.00 0.00 175.17 175.46 1bx6 n LYS 76 N 8.80 -0.07 0.46 4.34 5.02 0.01 -0.91 118.16 135.82 1bx6 n LYS 76 Ca 0.27 1.02 -0.19 0.00 -2.02 0.00 0.00 58.31 57.39 1bx6 n LYS 76 Cb 0.50 -1.52 -0.09 0.00 -0.02 0.00 0.00 35.03 33.90 1bx6 n LYS 76 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1bx6 h GLN 77 N 0.00 -1.16 -1.09 1.97 4.20 -1.90 -2.24 115.11 114.89 1bx6 h GLN 77 Ca 0.31 0.08 0.32 0.00 0.06 0.00 0.00 58.65 59.42 1bx6 h GLN 77 Cb 0.47 0.26 -0.12 0.00 0.30 0.00 0.00 27.48 28.39 1bx6 h GLN 77 CO -0.67 -0.77 0.67 -0.22 -0.67 0.00 0.00 178.83 177.17 1bx6 h LYS 78 N -1.20 0.31 0.00 1.46 3.64 -1.41 0.89 116.57 120.26 1bx6 h LYS 78 Ca -0.12 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1bx6 h LYS 78 Cb 0.94 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1bx6 h LYS 78 CO 0.17 0.20 0.00 0.28 -2.27 0.00 0.00 179.45 177.84 1bx6 n VAL 79 N -4.81 0.00 -0.37 2.00 0.31 -0.79 -3.36 118.33 111.30 1bx6 n VAL 79 Ca 0.30 0.59 0.33 0.00 -0.01 0.00 0.00 64.34 65.56 1bx6 n VAL 79 Cb 1.03 -1.52 0.57 0.00 -0.91 0.00 0.00 33.84 33.01 1bx6 n VAL 79 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1bx6 n VAL 80 N -0.11 -0.27 0.00 2.52 0.31 -0.87 0.24 118.33 120.14 1bx6 n VAL 80 Ca 0.00 1.66 0.00 0.00 -0.01 0.00 0.00 64.34 65.99 1bx6 n VAL 80 Cb 0.00 -2.71 0.00 0.00 -0.91 0.00 0.00 33.84 30.22 1bx6 n VAL 80 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1bx6 n LYS 81 N -4.64 0.00 -2.73 5.55 3.00 0.30 -2.78 118.16 116.86 1bx6 n LYS 81 Ca 0.35 0.04 -0.05 0.00 -0.00 0.00 0.00 58.31 58.65 1bx6 n LYS 81 Cb 1.30 -1.51 0.03 0.00 0.00 0.00 0.00 35.03 34.86 1bx6 n LYS 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1bx6 n LEU 82 N -0.96 -2.70 0.00 3.14 4.77 0.65 -5.04 117.00 116.86 1bx6 n LEU 82 Ca 0.00 -2.44 0.00 0.00 -0.03 0.00 0.00 56.01 53.54 1bx6 n LEU 82 Cb 0.01 0.71 0.00 0.00 -2.33 0.00 0.00 43.42 41.81 1bx6 n LEU 82 CO 0.00 1.74 0.00 1.17 -1.33 0.00 0.00 177.39 178.97 1bx6 n LYS 83 N 2.47 0.00 -0.14 3.23 4.81 -1.12 -4.53 118.16 122.88 1bx6 n LYS 83 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 1bx6 n LYS 83 Cb 0.61 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.66 1bx6 n LYS 83 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1bx6 n GLN 84 N 0.00 0.21 -0.05 1.64 6.02 -1.26 -4.82 117.38 119.12 1bx6 n GLN 84 Ca 0.00 -0.75 -0.08 0.00 -0.01 0.00 0.00 57.00 56.16 1bx6 n GLN 84 Cb 0.00 -0.55 -0.02 0.00 1.02 0.00 0.00 30.24 30.68 1bx6 n GLN 84 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 1bx6 h ILE 85 N 3.88 0.82 0.01 5.09 2.10 -1.85 0.31 117.51 127.87 1bx6 h ILE 85 Ca 0.00 -0.02 0.00 0.00 1.08 0.00 0.00 64.86 65.93 1bx6 h ILE 85 Cb 1.08 0.77 -0.01 0.00 -1.09 0.00 0.00 36.82 37.58 1bx6 h ILE 85 CO 0.00 0.01 -0.03 -0.33 -1.08 0.00 0.00 178.15 176.72 1bx6 h GLU 86 N 0.04 -0.05 0.16 2.19 4.39 -1.97 -2.22 114.58 117.12 1bx6 h GLU 86 Ca 0.11 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.83 1bx6 h GLU 86 Cb 0.14 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.76 1bx6 h GLU 86 CO -0.20 -0.03 -0.39 0.45 -1.16 0.00 0.00 179.01 177.68 1bx6 h HIS 87 N -0.05 -1.08 -0.80 4.33 3.86 -1.83 -1.06 115.15 118.52 1bx6 h HIS 87 Ca 0.01 0.02 0.19 0.00 -1.16 0.00 0.00 60.37 59.44 1bx6 h HIS 87 Cb 0.07 0.45 -0.14 0.00 1.06 0.00 0.00 27.41 28.85 1bx6 h HIS 87 CO -0.10 -0.50 0.09 1.15 0.86 0.00 0.00 177.93 179.43 1bx6 h THR 88 N -0.65 0.33 -0.17 2.45 2.02 -0.15 -0.39 112.91 116.36 1bx6 h THR 88 Ca 0.02 -0.05 -0.20 0.00 0.77 0.00 0.00 66.41 66.95 1bx6 h THR 88 Cb 0.66 0.17 0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1bx6 h THR 88 CO -0.20 0.03 -0.67 -0.07 0.37 0.00 0.00 175.52 174.97 1bx6 h LEU 89 N 0.15 0.88 -0.02 2.58 3.38 -0.96 -3.27 115.31 118.05 1bx6 h LEU 89 Ca 0.47 -0.61 0.02 0.00 0.09 0.00 0.00 57.88 57.84 1bx6 h LEU 89 Cb 0.87 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1bx6 h LEU 89 CO -0.66 1.35 -0.45 0.78 0.09 0.00 0.00 178.44 179.54 1bx6 h ASN 90 N 0.46 -1.40 -0.35 -0.43 2.35 0.18 0.12 115.58 116.52 1bx6 h ASN 90 Ca -0.04 0.16 0.04 0.00 -0.55 0.00 0.00 56.30 55.91 1bx6 h ASN 90 Cb 1.30 0.53 -0.05 0.00 0.05 0.00 0.00 38.32 40.16 1bx6 h ASN 90 CO 0.14 -0.43 -0.18 1.21 -1.65 0.00 0.00 177.43 176.52 1bx6 n GLU 91 N -4.96 -0.13 -0.06 0.81 2.13 -0.38 0.19 120.64 118.25 1bx6 n GLU 91 Ca -0.06 0.53 -0.13 0.00 0.66 0.00 0.00 57.16 58.16 1bx6 n GLU 91 Cb 0.33 -0.79 -0.07 0.00 0.27 0.00 0.00 31.44 31.18 1bx6 n GLU 91 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1bx6 h LYS 92 N 0.00 0.39 0.00 5.31 3.64 -1.47 -1.71 116.57 122.74 1bx6 h LYS 92 Ca 0.08 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1bx6 h LYS 92 Cb 0.17 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1bx6 h LYS 92 CO -0.34 0.79 0.00 -2.13 -2.27 0.00 0.00 179.45 175.50 1bx6 n ARG 93 N -4.51 0.00 -0.01 1.90 0.63 0.51 -1.53 116.66 113.65 1bx6 n ARG 93 Ca -0.06 0.86 -0.15 0.00 -0.92 0.00 0.00 57.85 57.58 1bx6 n ARG 93 Cb 0.39 -1.46 -0.10 0.00 0.45 0.00 0.00 32.46 31.75 1bx6 n ARG 93 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1bx6 h ILE 94 N 0.00 0.01 -0.96 5.15 2.04 -0.71 -2.57 117.51 120.47 1bx6 h ILE 94 Ca 0.00 0.00 0.39 0.00 1.00 0.00 0.00 64.86 66.25 1bx6 h ILE 94 Cb 0.00 0.01 -0.17 0.00 -0.74 0.00 0.00 36.82 35.92 1bx6 h ILE 94 CO 0.00 0.00 0.47 -0.11 0.00 0.00 0.00 178.15 178.51 1bx6 n LEU 95 N -5.43 0.29 -0.50 1.44 7.94 -0.64 0.15 117.00 120.25 1bx6 n LEU 95 Ca -0.06 1.60 0.11 0.00 -1.11 0.00 0.00 56.01 56.56 1bx6 n LEU 95 Cb 0.38 -0.76 0.08 0.00 0.53 0.00 0.00 43.42 43.64 1bx6 n LEU 95 CO 0.09 -1.77 0.40 0.00 -1.11 0.00 0.00 177.39 174.99 1bx6 n GLN 96 N -5.20 1.27 -0.07 1.96 -0.00 -0.58 -4.34 117.38 110.41 1bx6 n GLN 96 Ca 0.35 -1.01 -0.09 0.00 -0.00 0.00 0.00 57.00 56.25 1bx6 n GLN 96 Cb 1.19 -1.48 -0.06 0.00 -0.00 0.00 0.00 30.24 29.89 1bx6 n GLN 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1bx6 h ALA 97 N 3.94 0.05 -2.19 2.61 0.00 0.18 -3.48 119.26 120.37 1bx6 h ALA 97 Ca 0.00 -0.46 -0.44 0.00 0.00 0.00 0.00 54.91 54.02 1bx6 h ALA 97 Cb 0.74 0.21 0.20 0.00 0.00 0.00 0.00 17.79 18.94 1bx6 h ALA 97 CO 0.00 0.20 0.05 0.14 0.00 0.00 0.00 179.25 179.64 1bx6 s VAL 98 N -2.02 1.97 -0.26 0.00 -7.23 -0.16 -4.47 120.40 108.22 1bx6 s VAL 98 Ca -0.14 0.00 -0.10 0.00 -1.81 0.00 0.00 61.98 59.93 1bx6 s VAL 98 Cb 0.00 -2.18 0.11 0.00 0.56 0.00 0.00 36.38 34.87 1bx6 s VAL 98 CO 0.36 0.00 0.58 0.21 -0.31 0.00 0.00 175.10 175.95 1bx6 s ASN 99 N -2.80 -0.86 -0.30 4.85 3.84 -1.26 -4.99 114.94 113.41 1bx6 s ASN 99 Ca 0.68 1.39 -0.18 0.00 0.21 0.00 0.00 52.86 54.96 1bx6 s ASN 99 Cb -0.23 1.86 0.21 0.00 -0.55 0.00 0.00 41.25 42.54 1bx6 s ASN 99 CO 0.63 -0.22 1.28 0.12 -2.79 0.00 0.00 177.10 176.11 1bx6 s PHE 100 N 2.57 -0.06 0.32 0.43 5.36 -1.26 -5.02 117.98 120.31 1bx6 s PHE 100 Ca -0.06 0.12 0.01 0.00 -0.96 0.00 0.00 56.93 56.03 1bx6 s PHE 100 Cb -0.11 0.04 0.03 0.00 -0.34 0.00 0.00 43.02 42.64 1bx6 s PHE 100 CO -0.17 -0.03 0.78 -1.00 -1.46 0.00 0.00 175.22 173.33 1bx6 h PRO 101 N 6.01 0.00 -0.04 10.12 0.13 -1.99 2.98 132.00 149.22 1bx6 h PRO 101 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1bx6 h PRO 101 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1bx6 h PRO 101 CO 0.15 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.11 1bx6 n PHE 102 N -1.77 0.06 -4.56 1.56 3.72 -1.26 -4.92 117.46 110.28 1bx6 n PHE 102 Ca -0.00 -0.61 -0.34 0.00 -0.05 0.00 0.00 57.45 56.46 1bx6 n PHE 102 Cb 0.73 -0.07 -0.12 0.00 -0.94 0.00 0.00 39.48 39.08 1bx6 n PHE 102 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1bx6 s LEU 103 N -1.41 3.12 0.81 4.37 1.43 1.00 -0.90 118.68 127.10 1bx6 s LEU 103 Ca 0.09 -0.12 -0.15 0.00 -1.03 0.00 0.00 54.13 52.93 1bx6 s LEU 103 Cb 0.07 -1.71 0.01 0.00 0.03 0.00 0.00 46.19 44.59 1bx6 s LEU 103 CO 0.02 0.25 0.60 0.52 0.23 0.00 0.00 176.35 177.97 1bx6 n VAL 104 N 2.98 1.24 -3.67 -1.59 0.31 -1.14 -4.67 118.33 111.79 1bx6 n VAL 104 Ca -0.18 -0.30 -0.37 0.00 -0.01 0.00 0.00 64.34 63.48 1bx6 n VAL 104 Cb 0.53 -0.78 -0.12 0.00 -0.91 0.00 0.00 33.84 32.56 1bx6 n VAL 104 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1bx6 s LYS 105 N -3.28 3.70 -0.26 5.55 1.02 -1.26 -4.94 119.74 120.27 1bx6 s LYS 105 Ca 0.64 -0.47 -0.29 0.00 0.02 0.00 0.00 55.97 55.87 1bx6 s LYS 105 Cb -0.29 -3.50 0.01 0.00 -0.52 0.00 0.00 37.83 33.53 1bx6 s LYS 105 CO 0.60 -0.23 1.04 -1.17 -0.92 0.00 0.00 175.35 174.67 1bx6 s LEU 106 N 1.67 4.04 -0.10 3.17 0.20 -1.26 -2.27 118.68 124.12 1bx6 s LEU 106 Ca 0.06 1.24 0.06 0.00 0.69 0.00 0.00 54.13 56.18 1bx6 s LEU 106 Cb -0.16 -3.52 -0.24 0.00 -0.43 0.00 0.00 46.19 41.84 1bx6 s LEU 106 CO 0.07 -0.74 0.43 -0.62 -0.29 0.00 0.00 176.35 175.20 1bx6 n GLU 107 N 6.50 0.68 -3.56 1.98 -0.58 0.31 -4.98 120.64 120.98 1bx6 n GLU 107 Ca 0.12 0.24 -0.16 0.00 -0.42 0.00 0.00 57.16 56.94 1bx6 n GLU 107 Cb 0.46 -1.71 -0.06 0.00 -0.57 0.00 0.00 31.44 29.56 1bx6 n GLU 107 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1bx6 s PHE 108 N -2.57 -0.66 0.03 -0.32 0.08 -0.95 -5.01 117.98 108.57 1bx6 s PHE 108 Ca -0.13 1.31 0.01 0.00 0.12 0.00 0.00 56.93 58.24 1bx6 s PHE 108 Cb 0.07 0.37 -0.02 0.00 -0.57 0.00 0.00 43.02 42.88 1bx6 s PHE 108 CO 0.79 -0.50 -0.05 -1.54 -0.10 0.00 0.00 175.22 173.81 1bx6 s SER 109 N -0.68 0.58 0.14 1.36 1.04 -1.26 -1.56 113.70 113.31 1bx6 s SER 109 Ca -0.06 -0.42 -0.25 0.00 0.48 0.00 0.00 55.95 55.69 1bx6 s SER 109 Cb -0.02 0.03 0.07 0.00 0.10 0.00 0.00 66.02 66.21 1bx6 s SER 109 CO 0.06 -0.17 1.01 0.72 0.98 0.00 0.00 173.24 175.84 1bx6 s PHE 110 N -1.10 -0.09 0.19 5.02 -0.12 -0.86 -0.99 117.98 120.03 1bx6 s PHE 110 Ca -0.09 -0.20 -0.04 0.00 -0.05 0.00 0.00 56.93 56.55 1bx6 s PHE 110 Cb -0.08 0.64 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 1bx6 s PHE 110 CO -0.00 -0.77 0.20 -1.59 -0.05 0.00 0.00 175.22 173.01 1bx6 s LYS 111 N -3.04 1.22 0.00 1.99 -2.85 -1.26 0.74 119.74 116.54 1bx6 s LYS 111 Ca 0.14 -1.48 0.00 0.00 -1.00 0.00 0.00 55.97 53.63 1bx6 s LYS 111 Cb -0.01 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.08 1bx6 s LYS 111 CO 0.02 -0.42 0.00 -0.40 0.10 0.00 0.00 175.35 174.65 1bx6 n ASP 112 N -0.26 0.00 0.00 0.03 5.68 0.75 -4.96 116.55 117.79 1bx6 n ASP 112 Ca -0.01 -0.13 0.09 0.00 -0.50 0.00 0.00 54.79 54.25 1bx6 n ASP 112 Cb 0.64 0.00 0.47 0.00 -1.14 0.00 0.00 41.12 41.10 1bx6 n ASP 112 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1bx6 n ASN 113 N -0.37 0.00 0.00 -1.12 4.13 -1.26 -4.16 115.26 112.47 1bx6 n ASN 113 Ca 0.00 0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.33 1bx6 n ASN 113 Cb 0.00 -0.31 0.00 0.00 -1.54 0.00 0.00 39.78 37.93 1bx6 n ASN 113 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1bx6 n SER 114 N -1.31 0.77 -4.48 6.41 7.64 -1.26 0.14 113.62 121.53 1bx6 n SER 114 Ca 0.09 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.73 1bx6 n SER 114 Cb 0.16 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.26 1bx6 n SER 114 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1bx6 s ASN 115 N -3.45 3.38 -0.17 6.43 0.01 -1.26 -0.81 114.94 119.07 1bx6 s ASN 115 Ca 0.00 -1.14 -0.07 0.00 -0.71 0.00 0.00 52.86 50.94 1bx6 s ASN 115 Cb 0.00 -0.28 -0.04 0.00 0.41 0.00 0.00 41.25 41.34 1bx6 s ASN 115 CO 0.00 -0.17 0.05 -0.76 -1.51 0.00 0.00 177.10 174.71 1bx6 s LEU 116 N -3.52 3.78 0.08 0.60 2.01 0.08 -0.18 118.68 121.52 1bx6 s LEU 116 Ca 0.30 0.08 0.09 0.00 0.01 0.00 0.00 54.13 54.62 1bx6 s LEU 116 Cb 0.01 -1.94 -0.03 0.00 0.01 0.00 0.00 46.19 44.23 1bx6 s LEU 116 CO 0.14 0.20 -0.25 -0.31 1.01 0.00 0.00 176.35 177.14 1bx6 s TYR 117 N 0.22 2.18 -0.21 0.29 1.51 0.23 -1.10 117.35 120.47 1bx6 s TYR 117 Ca 0.03 -0.40 -0.04 0.00 -1.01 0.00 0.00 57.07 55.66 1bx6 s TYR 117 Cb -0.12 -1.25 0.09 0.00 -0.11 0.00 0.00 41.96 40.57 1bx6 s TYR 117 CO 0.01 0.21 0.17 -1.64 -1.11 0.00 0.00 175.55 173.19 1bx6 s MET 118 N -1.60 0.16 -0.37 -0.62 -1.94 0.12 -2.03 119.30 113.01 1bx6 s MET 118 Ca 0.11 0.01 -0.10 0.00 -1.71 0.00 0.00 55.69 54.00 1bx6 s MET 118 Cb -0.10 -1.37 0.03 0.00 2.01 0.00 0.00 34.83 35.40 1bx6 s MET 118 CO 0.04 -0.72 0.19 0.08 -0.01 0.00 0.00 175.02 174.60 1bx6 s VAL 119 N 2.24 4.41 0.54 -6.03 1.01 -0.60 0.26 120.40 122.22 1bx6 s VAL 119 Ca 0.06 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.11 1bx6 s VAL 119 Cb -0.16 -3.49 0.02 0.00 0.00 0.00 0.00 36.38 32.76 1bx6 s VAL 119 CO -0.15 -0.25 0.26 0.00 0.00 0.00 0.00 175.10 174.96 1bx6 s MET 120 N 1.52 2.23 0.50 2.72 0.23 0.26 -0.53 119.30 126.23 1bx6 s MET 120 Ca 0.01 -2.18 -0.24 0.00 -1.03 0.00 0.00 55.69 52.26 1bx6 s MET 120 Cb -0.20 -1.88 -0.07 0.00 -1.53 0.00 0.00 34.83 31.16 1bx6 s MET 120 CO 0.06 -0.55 1.40 -1.21 -2.03 0.00 0.00 175.02 172.69 1bx6 s GLU 121 N -4.14 3.41 -0.36 3.16 2.02 -0.96 0.88 118.70 122.69 1bx6 s GLU 121 Ca 0.22 2.34 -0.16 0.00 0.02 0.00 0.00 54.97 57.40 1bx6 s GLU 121 Cb -0.01 -2.46 -0.00 0.00 0.10 0.00 0.00 34.13 31.76 1bx6 s GLU 121 CO 0.14 -1.01 0.37 -0.47 0.02 0.00 0.00 175.26 174.31 1bx6 s TYR 122 N -1.25 3.20 -0.71 1.61 5.04 -1.26 -4.23 117.35 119.75 1bx6 s TYR 122 Ca 0.66 -0.14 -0.11 0.00 -2.44 0.00 0.00 57.07 55.04 1bx6 s TYR 122 Cb -0.42 -2.71 0.19 0.00 0.35 0.00 0.00 41.96 39.36 1bx6 s TYR 122 CO 0.52 -0.50 0.61 0.54 -1.34 0.00 0.00 175.55 175.39 1bx6 s VAL 123 N 2.02 4.91 0.54 3.14 0.11 -1.26 -4.95 120.40 124.92 1bx6 s VAL 123 Ca 0.11 -2.46 0.43 0.00 -2.93 0.00 0.00 61.98 57.13 1bx6 s VAL 123 Cb -0.17 -4.10 0.64 0.00 -1.53 0.00 0.00 36.38 31.22 1bx6 s VAL 123 CO 0.12 -0.95 1.69 0.00 -3.33 0.00 0.00 175.10 172.63 1bx6 h ALA 124 N 7.73 3.46 -0.70 1.54 0.00 -1.88 -2.05 119.26 127.35 1bx6 h ALA 124 Ca 0.01 -0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.05 1bx6 h ALA 124 Cb 1.02 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1bx6 h ALA 124 CO 0.78 -1.92 0.49 0.78 0.00 0.00 0.00 179.25 179.37 1bx6 h GLY 125 N 0.01 0.32 0.00 0.00 0.00 -1.76 -3.41 103.07 98.23 1bx6 h GLY 125 Ca 0.76 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 48.01 1bx6 h GLY 125 CO -0.03 0.02 0.00 0.61 0.00 0.00 0.00 176.54 177.14 1bx6 n GLY 126 N -1.60 -1.74 3.93 4.60 0.00 -0.77 -4.62 105.19 104.99 1bx6 n GLY 126 Ca 0.14 -1.59 -0.26 0.00 0.00 0.00 0.00 46.02 44.31 1bx6 n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bx6 s GLU 127 N 0.00 2.16 -0.01 1.61 2.02 -1.26 0.10 118.70 123.33 1bx6 s GLU 127 Ca 0.00 -0.29 0.22 0.00 0.02 0.00 0.00 54.97 54.92 1bx6 s GLU 127 Cb 0.00 -2.18 -0.28 0.00 0.10 0.00 0.00 34.13 31.77 1bx6 s GLU 127 CO 0.00 -1.25 0.60 -0.12 0.02 0.00 0.00 175.26 174.50 1bx6 n MET 128 N -2.92 0.56 -0.29 1.61 0.00 -0.89 -3.92 117.12 111.26 1bx6 n MET 128 Ca 0.08 -0.14 0.15 0.00 -0.00 0.00 0.00 57.70 57.79 1bx6 n MET 128 Cb 0.60 -1.54 0.40 0.00 0.00 0.00 0.00 33.22 32.68 1bx6 n MET 128 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 175.97 176.32 1bx6 h PHE 129 N 0.00 0.81 0.00 1.12 3.04 -1.85 1.44 116.94 121.50 1bx6 h PHE 129 Ca 0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 1bx6 h PHE 129 Cb 0.93 -0.25 0.00 0.00 2.56 0.00 0.00 35.95 39.19 1bx6 h PHE 129 CO 0.00 0.23 0.00 0.43 -2.02 0.00 0.00 178.31 176.95 1bx6 n SER 130 N -4.61 0.00 -0.37 0.41 7.64 -1.25 -0.89 113.62 114.56 1bx6 n SER 130 Ca 0.20 0.68 -0.06 0.00 1.01 0.00 0.00 58.87 60.70 1bx6 n SER 130 Cb 0.58 -0.31 -0.03 0.00 -1.01 0.00 0.00 64.21 63.44 1bx6 n SER 130 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1bx6 h HIS 131 N 0.00 -1.43 -0.35 1.43 3.86 -1.59 1.95 115.15 119.01 1bx6 h HIS 131 Ca 0.00 0.11 0.06 0.00 -1.16 0.00 0.00 60.37 59.39 1bx6 h HIS 131 Cb 0.00 0.76 -0.09 0.00 1.06 0.00 0.00 27.41 29.14 1bx6 h HIS 131 CO 0.11 -0.40 -0.42 1.25 0.86 0.00 0.00 177.93 179.33 1bx6 h LEU 132 N -0.04 -1.39 -1.44 2.43 5.85 0.19 -0.33 115.31 120.58 1bx6 h LEU 132 Ca 0.25 0.21 -0.02 0.00 0.84 0.00 0.00 57.88 59.15 1bx6 h LEU 132 Cb 0.52 0.60 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 1bx6 h LEU 132 CO -0.92 -0.38 -0.10 0.03 -0.34 0.00 0.00 178.44 176.73 1bx6 h ARG 133 N -0.36 0.00 0.17 1.25 2.47 0.26 -0.97 114.38 117.20 1bx6 h ARG 133 Ca 0.13 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.84 1bx6 h ARG 133 Cb 0.59 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.91 1bx6 h ARG 133 CO -0.53 0.10 -0.08 -0.09 0.56 0.00 0.00 179.97 179.93 1bx6 h ARG 134 N 0.00 -0.22 -0.01 0.04 2.43 0.42 -3.34 114.38 113.71 1bx6 h ARG 134 Ca -0.00 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 1bx6 h ARG 134 Cb 0.56 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1bx6 h ARG 134 CO 0.01 0.06 -0.32 0.97 -1.51 0.00 0.00 179.97 179.19 1bx6 h ILE 135 N -1.00 1.23 0.00 1.20 6.09 -1.14 -3.47 117.51 120.42 1bx6 h ILE 135 Ca -0.02 -1.11 0.00 0.00 -1.37 0.00 0.00 64.86 62.35 1bx6 h ILE 135 Cb 0.38 1.59 0.00 0.00 0.47 0.00 0.00 36.82 39.26 1bx6 h ILE 135 CO 0.04 0.32 0.00 0.61 -3.07 0.00 0.00 178.15 176.05 1bx6 n GLY 136 N -0.60 2.94 3.61 8.18 0.00 -0.37 -4.99 105.19 113.97 1bx6 n GLY 136 Ca -0.02 -0.84 -0.04 0.00 0.00 0.00 0.00 46.02 45.12 1bx6 n GLY 136 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1bx6 s ARG 137 N 0.00 0.23 -0.12 1.61 3.03 -1.25 -4.26 118.95 118.18 1bx6 s ARG 137 Ca 0.00 -0.05 -0.04 0.00 2.03 0.00 0.00 55.73 57.67 1bx6 s ARG 137 Cb 0.00 0.11 -0.04 0.00 -1.03 0.00 0.00 34.95 33.99 1bx6 s ARG 137 CO 0.00 -0.09 0.04 -0.06 -1.13 0.00 0.00 175.30 174.05 1bx6 s PHE 138 N -1.95 3.24 0.34 5.89 0.08 -0.32 -5.03 117.98 120.23 1bx6 s PHE 138 Ca 0.09 0.16 -0.29 0.00 0.12 0.00 0.00 56.93 57.01 1bx6 s PHE 138 Cb -0.01 -1.91 -0.11 0.00 -0.57 0.00 0.00 43.02 40.42 1bx6 s PHE 138 CO -0.04 0.37 1.52 -1.54 -0.10 0.00 0.00 175.22 175.43 1bx6 s SER 139 N -0.43 6.36 0.33 1.36 1.04 -1.26 -4.55 113.70 116.55 1bx6 s SER 139 Ca 0.09 3.01 0.13 0.00 0.48 0.00 0.00 55.95 59.65 1bx6 s SER 139 Cb -0.12 -2.66 1.06 0.00 0.10 0.00 0.00 66.02 64.41 1bx6 s SER 139 CO 0.02 -0.88 1.50 -0.62 0.98 0.00 0.00 173.24 174.24 1bx6 n GLU 140 N 1.10 -0.07 0.50 4.02 1.02 -1.26 0.92 120.64 126.88 1bx6 n GLU 140 Ca 0.04 1.37 -0.20 0.00 -0.02 0.00 0.00 57.16 58.34 1bx6 n GLU 140 Cb 0.39 -2.33 -0.10 0.00 -0.02 0.00 0.00 31.44 29.38 1bx6 n GLU 140 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1bx6 h PRO 141 N 0.00 -1.24 -0.80 3.49 0.11 -1.98 1.21 132.00 132.78 1bx6 h PRO 141 Ca 0.72 0.08 0.16 0.00 0.11 0.00 0.00 66.00 67.07 1bx6 h PRO 141 Cb 1.76 0.28 -0.15 0.00 0.11 0.00 0.00 31.00 33.00 1bx6 h PRO 141 CO -0.80 -0.83 -0.23 1.25 -0.21 0.00 0.00 178.00 177.18 1bx6 h HIS 142 N -1.29 -0.53 0.87 0.65 2.76 0.21 0.41 115.15 118.24 1bx6 h HIS 142 Ca -0.13 0.08 -0.04 0.00 -2.20 0.00 0.00 60.37 58.08 1bx6 h HIS 142 Cb 1.00 0.36 0.00 0.00 1.55 0.00 0.00 27.41 30.31 1bx6 h HIS 142 CO -0.02 -0.36 -0.47 0.00 -1.30 0.00 0.00 177.93 175.79 1bx6 h ALA 143 N 1.70 -1.31 -0.92 5.26 0.00 -0.97 -2.55 119.26 120.47 1bx6 h ALA 143 Ca 0.37 -0.26 0.14 0.00 0.00 0.00 0.00 54.91 55.16 1bx6 h ALA 143 Cb 0.59 0.54 -0.15 0.00 0.00 0.00 0.00 17.79 18.78 1bx6 h ALA 143 CO -0.83 -1.24 -0.36 -2.13 0.00 0.00 0.00 179.25 174.69 1bx6 n ARG 144 N -5.45 -0.22 -0.14 0.00 0.63 0.41 -0.25 116.66 111.65 1bx6 n ARG 144 Ca -0.15 1.41 -0.05 0.00 -0.92 0.00 0.00 57.85 58.13 1bx6 n ARG 144 Cb 0.50 -2.09 0.01 0.00 0.45 0.00 0.00 32.46 31.33 1bx6 n ARG 144 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 1bx6 h PHE 145 N 0.00 -0.63 0.00 -0.14 3.57 -0.43 1.03 116.94 120.33 1bx6 h PHE 145 Ca 0.31 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.87 1bx6 h PHE 145 Cb 0.54 0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.63 1bx6 h PHE 145 CO -0.81 -0.32 0.00 0.66 -2.23 0.00 0.00 178.31 175.61 1bx6 n TYR 146 N -5.40 0.00 -0.23 0.41 4.01 0.66 -2.46 117.16 114.14 1bx6 n TYR 146 Ca 0.03 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.80 1bx6 n TYR 146 Cb 0.32 -0.41 0.08 0.00 -0.31 0.00 0.00 39.34 39.02 1bx6 n TYR 146 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bx6 n ALA 147 N -1.81 0.13 -0.31 -0.72 0.00 -0.63 0.38 120.51 117.56 1bx6 n ALA 147 Ca 0.00 0.69 0.11 0.00 0.00 0.00 0.00 53.44 54.24 1bx6 n ALA 147 Cb 0.00 -0.41 0.24 0.00 0.00 0.00 0.00 19.45 19.28 1bx6 n ALA 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bx6 h ALA 148 N 1.23 1.04 0.00 0.00 0.00 0.14 -1.05 119.26 120.63 1bx6 h ALA 148 Ca 0.30 0.30 -0.23 0.00 0.00 0.00 0.00 54.91 55.27 1bx6 h ALA 148 Cb 0.45 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1bx6 h ALA 148 CO -0.65 -0.50 -0.96 -0.56 0.00 0.00 0.00 179.25 176.59 1bx6 h GLN 149 N 0.07 0.43 -0.02 0.00 3.07 0.73 -3.12 115.11 116.26 1bx6 h GLN 149 Ca 0.53 -0.46 0.02 0.00 0.09 0.00 0.00 58.65 58.82 1bx6 h GLN 149 Cb 1.03 0.13 -0.02 0.00 0.08 0.00 0.00 27.48 28.70 1bx6 h GLN 149 CO -0.81 1.12 -0.08 0.82 0.09 0.00 0.00 178.83 179.98 1bx6 h ILE 150 N 0.24 0.80 -0.55 1.86 1.08 -0.61 -2.88 117.51 117.44 1bx6 h ILE 150 Ca -0.08 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.47 1bx6 h ILE 150 Cb 1.59 0.80 -0.10 0.00 -3.07 0.00 0.00 36.82 36.04 1bx6 h ILE 150 CO 0.17 0.00 -0.42 0.58 -0.69 0.00 0.00 178.15 177.78 1bx6 h VAL 151 N -0.12 0.10 -0.43 1.67 2.07 -1.45 -0.10 116.25 117.99 1bx6 h VAL 151 Ca 0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 1bx6 h VAL 151 Cb 0.17 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 29.98 1bx6 h VAL 151 CO -0.10 0.00 0.04 -0.07 0.02 0.00 0.00 177.57 177.46 1bx6 h LEU 152 N -0.24 -0.09 -0.60 2.57 3.38 -1.46 -0.67 115.31 118.19 1bx6 h LEU 152 Ca 0.18 0.09 0.12 0.00 0.09 0.00 0.00 57.88 58.35 1bx6 h LEU 152 Cb 0.56 0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.37 1bx6 h LEU 152 CO -0.67 -0.01 0.10 0.74 0.09 0.00 0.00 178.44 178.69 1bx6 h THR 153 N 0.16 0.60 -0.44 0.22 2.02 -0.86 0.12 112.91 114.72 1bx6 h THR 153 Ca 0.21 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 67.26 1bx6 h THR 153 Cb 0.29 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1bx6 h THR 153 CO -0.32 0.04 0.05 -0.26 0.37 0.00 0.00 175.52 175.40 1bx6 h PHE 154 N 0.22 0.80 -0.37 3.16 -1.00 -0.85 1.13 116.94 120.04 1bx6 h PHE 154 Ca 0.32 -0.12 0.08 0.00 2.81 0.00 0.00 57.97 61.06 1bx6 h PHE 154 Cb 0.49 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.82 1bx6 h PHE 154 CO -0.28 0.77 0.26 1.49 -1.61 0.00 0.00 178.31 178.94 1bx6 h GLU 155 N 0.60 0.13 0.03 1.51 4.81 0.06 1.29 114.58 123.00 1bx6 h GLU 155 Ca 0.13 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1bx6 h GLU 155 Cb 0.42 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1bx6 h GLU 155 CO 0.01 0.08 -0.01 -0.92 -0.73 0.00 0.00 179.01 177.44 1bx6 h TYR 156 N 0.13 -0.04 -0.49 0.92 5.03 0.17 -3.21 116.97 119.49 1bx6 h TYR 156 Ca 0.17 -0.00 0.10 0.00 2.58 0.00 0.00 58.73 61.58 1bx6 h TYR 156 Cb 0.51 0.01 -0.09 0.00 1.55 0.00 0.00 36.73 38.71 1bx6 h TYR 156 CO -0.00 0.35 -0.12 -0.07 -1.32 0.00 0.00 178.16 177.00 1bx6 h LEU 157 N -0.99 -0.44 -0.82 2.82 3.38 0.25 -0.12 115.31 119.39 1bx6 h LEU 157 Ca -0.00 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1bx6 h LEU 157 Cb 0.40 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1bx6 h LEU 157 CO 0.01 -0.16 0.00 0.45 0.09 0.00 0.00 178.44 178.83 1bx6 h HIS 158 N 0.01 0.00 -0.44 1.13 3.86 0.15 -2.24 115.15 117.62 1bx6 h HIS 158 Ca 0.24 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.40 1bx6 h HIS 158 Cb 0.36 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.81 1bx6 h HIS 158 CO -0.41 0.00 0.07 1.03 0.86 0.00 0.00 177.93 179.48 1bx6 h SER 159 N 0.00 0.63 -0.93 2.45 0.87 -1.00 -2.98 113.55 112.58 1bx6 h SER 159 Ca 0.00 -0.11 -0.54 0.00 -1.23 0.00 0.00 61.79 59.90 1bx6 h SER 159 Cb 0.34 -0.16 -0.29 0.00 -0.44 0.00 0.00 62.40 61.85 1bx6 h SER 159 CO 0.00 0.66 0.61 0.18 -0.53 0.00 0.00 176.83 177.75 1bx6 n LEU 160 N -4.28 6.78 -3.01 2.23 4.32 -1.02 -4.91 117.00 117.10 1bx6 n LEU 160 Ca 0.03 -3.90 -0.20 0.00 -0.02 0.00 0.00 56.01 51.92 1bx6 n LEU 160 Cb 0.23 -0.85 0.00 0.00 -1.62 0.00 0.00 43.42 41.18 1bx6 n LEU 160 CO 0.39 1.25 -0.07 0.47 -1.22 0.00 0.00 177.39 178.22 1bx6 n ASP 161 N -1.05 -4.25 -4.61 -1.43 8.00 -1.13 -4.89 116.55 107.19 1bx6 n ASP 161 Ca 0.58 -0.19 -0.34 0.00 0.71 0.00 0.00 54.79 55.55 1bx6 n ASP 161 Cb 1.25 -3.52 -0.10 0.00 -0.02 0.00 0.00 41.12 38.72 1bx6 n ASP 161 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1bx6 s LEU 162 N -6.25 3.50 -0.26 0.64 1.43 -0.87 -0.84 118.68 116.03 1bx6 s LEU 162 Ca 0.26 0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.42 1bx6 s LEU 162 Cb -0.13 -1.83 0.06 0.00 0.03 0.00 0.00 46.19 44.32 1bx6 s LEU 162 CO 0.31 0.27 -0.11 -0.51 0.23 0.00 0.00 176.35 176.55 1bx6 s ILE 163 N -0.25 2.10 0.10 -0.59 2.07 -0.80 -3.60 121.20 120.23 1bx6 s ILE 163 Ca 0.06 -1.58 -0.22 0.00 -1.41 0.00 0.00 60.65 57.49 1bx6 s ILE 163 Cb -0.12 -2.22 -0.13 0.00 0.13 0.00 0.00 42.46 40.12 1bx6 s ILE 163 CO 0.02 -0.02 1.73 0.22 -1.91 0.00 0.00 174.94 174.98 1bx6 h TYR 164 N 7.79 0.08 0.00 3.50 5.03 -1.94 -2.96 116.97 128.47 1bx6 h TYR 164 Ca -0.20 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.12 1bx6 h TYR 164 Cb 1.05 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 39.30 1bx6 h TYR 164 CO 0.62 0.07 0.00 0.54 -1.32 0.00 0.00 178.16 178.07 1bx6 n ARG 165 N -5.03 -0.10 -2.82 1.82 1.74 -1.26 -3.48 116.66 107.52 1bx6 n ARG 165 Ca -0.06 0.03 -0.12 0.00 -0.77 0.00 0.00 57.85 56.93 1bx6 n ARG 165 Cb 0.04 -3.98 0.01 0.00 -1.02 0.00 0.00 32.46 27.51 1bx6 n ARG 165 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1bx6 n ASP 166 N -0.05 1.26 -4.59 0.55 2.03 -1.26 -4.67 116.55 109.82 1bx6 n ASP 166 Ca 0.00 -2.80 -0.42 0.00 0.52 0.00 0.00 54.79 52.09 1bx6 n ASP 166 Cb 0.03 -0.56 -0.06 0.00 -0.72 0.00 0.00 41.12 39.81 1bx6 n ASP 166 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1bx6 s LEU 167 N -2.91 4.19 0.24 -2.67 2.96 -1.26 -4.86 118.68 114.37 1bx6 s LEU 167 Ca 0.31 0.31 -0.20 0.00 -0.22 0.00 0.00 54.13 54.33 1bx6 s LEU 167 Cb 0.43 -2.85 0.03 0.00 0.50 0.00 0.00 46.19 44.29 1bx6 s LEU 167 CO 0.00 -0.58 0.65 -1.59 -1.32 0.00 0.00 176.35 173.52 1bx6 s LYS 168 N 2.75 1.62 0.25 1.98 -2.85 -1.26 -4.93 119.74 117.30 1bx6 s LYS 168 Ca 0.26 -0.91 -0.01 0.00 -1.00 0.00 0.00 55.97 54.32 1bx6 s LYS 168 Cb -0.14 0.58 0.29 0.00 -2.06 0.00 0.00 37.83 36.50 1bx6 s LYS 168 CO 0.14 -0.72 1.67 -1.35 0.10 0.00 0.00 175.35 175.18 1bx6 h PRO 169 N 2.05 0.60 0.00 1.78 0.11 -1.96 -2.51 132.00 132.08 1bx6 h PRO 169 Ca -0.24 -0.25 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1bx6 h PRO 169 Cb 1.26 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1bx6 h PRO 169 CO 0.29 0.81 -0.01 0.93 -0.21 0.00 0.00 178.00 179.81 1bx6 h GLU 170 N 0.53 0.00 -0.44 1.05 3.07 -1.97 -1.67 114.58 115.16 1bx6 h GLU 170 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1bx6 h GLU 170 Cb 0.73 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.64 1bx6 h GLU 170 CO 0.06 0.01 0.00 0.09 -1.40 0.00 0.00 179.01 177.77 1bx6 n ASN 171 N -3.36 2.19 -4.16 1.42 4.13 -0.94 -4.79 115.26 109.75 1bx6 n ASN 171 Ca -0.03 -2.07 -0.33 0.00 1.68 0.00 0.00 54.58 53.83 1bx6 n ASN 171 Cb 0.10 -0.30 -0.16 0.00 -1.54 0.00 0.00 39.78 37.88 1bx6 n ASN 171 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1bx6 s LEU 172 N -1.06 2.24 -0.19 3.41 1.02 -0.63 -1.21 118.68 122.26 1bx6 s LEU 172 Ca 0.25 -0.60 -0.07 0.00 0.02 0.00 0.00 54.13 53.73 1bx6 s LEU 172 Cb 0.14 -1.51 -0.04 0.00 0.02 0.00 0.00 46.19 44.80 1bx6 s LEU 172 CO 0.15 0.02 0.06 -0.76 0.02 0.00 0.00 176.35 175.84 1bx6 s LEU 173 N 1.19 3.77 -0.87 1.79 1.43 0.11 -2.10 118.68 123.99 1bx6 s LEU 173 Ca 0.02 0.05 -0.25 0.00 -1.03 0.00 0.00 54.13 52.92 1bx6 s LEU 173 Cb -0.14 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.15 1bx6 s LEU 173 CO -0.09 0.15 1.53 -0.63 0.23 0.00 0.00 176.35 177.54 1bx6 s ILE 174 N 0.49 3.72 1.07 -0.59 1.01 0.12 -0.95 121.20 126.06 1bx6 s ILE 174 Ca 0.03 -0.23 -0.23 0.00 0.00 0.00 0.00 60.65 60.22 1bx6 s ILE 174 Cb -0.13 -4.72 -0.03 0.00 0.01 0.00 0.00 42.46 37.60 1bx6 s ILE 174 CO 0.01 -1.64 -0.69 -0.90 0.00 0.00 0.00 174.94 171.73 1bx6 n ASP 175 N 10.31 -2.65 0.27 3.58 5.68 0.92 -2.62 116.55 132.05 1bx6 n ASP 175 Ca 0.24 -0.08 0.18 0.00 -0.50 0.00 0.00 54.79 54.63 1bx6 n ASP 175 Cb 0.50 -0.75 0.95 0.00 -1.14 0.00 0.00 41.12 40.68 1bx6 n ASP 175 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1bx6 h GLN 176 N -1.62 0.00 -0.07 0.11 7.50 -1.92 -2.71 115.11 116.40 1bx6 h GLN 176 Ca -0.47 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.68 1bx6 h GLN 176 Cb 1.37 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.90 1bx6 h GLN 176 CO 0.31 0.00 0.00 1.04 -1.50 0.00 0.00 178.83 178.68 1bx6 n GLN 177 N -2.81 1.73 0.00 1.46 6.02 -1.26 -4.72 117.38 117.80 1bx6 n GLN 177 Ca -0.02 -1.70 0.00 0.00 -0.01 0.00 0.00 57.00 55.27 1bx6 n GLN 177 Cb 0.10 -1.37 0.00 0.00 1.02 0.00 0.00 30.24 29.99 1bx6 n GLN 177 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bx6 n GLY 178 N 1.08 1.49 3.74 1.08 0.00 -1.02 -4.49 105.19 107.07 1bx6 n GLY 178 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1bx6 n GLY 178 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bx6 s TYR 179 N -2.30 3.68 0.63 1.61 1.51 -1.26 -4.79 117.35 116.42 1bx6 s TYR 179 Ca 0.00 1.37 -0.13 0.00 -1.01 0.00 0.00 57.07 57.30 1bx6 s TYR 179 Cb 0.00 -2.80 -0.02 0.00 -0.11 0.00 0.00 41.96 39.03 1bx6 s TYR 179 CO 0.00 0.22 1.04 0.96 -1.11 0.00 0.00 175.55 176.66 1bx6 s ILE 180 N 0.23 4.13 -0.04 2.71 -4.36 -1.26 -0.05 121.20 122.56 1bx6 s ILE 180 Ca 0.38 0.83 -0.02 0.00 -0.26 0.00 0.00 60.65 61.58 1bx6 s ILE 180 Cb -0.19 -3.51 0.03 0.00 1.25 0.00 0.00 42.46 40.04 1bx6 s ILE 180 CO 0.21 -0.77 0.06 -1.58 0.24 0.00 0.00 174.94 173.10 1bx6 s GLN 181 N -4.64 -0.06 0.02 0.37 2.00 -0.13 -4.73 119.66 112.50 1bx6 s GLN 181 Ca 0.59 0.35 -0.25 0.00 -2.00 0.00 0.00 55.36 54.05 1bx6 s GLN 181 Cb -0.14 -0.43 -0.05 0.00 0.80 0.00 0.00 33.01 33.20 1bx6 s GLN 181 CO 0.46 -0.29 0.78 0.08 -0.50 0.00 0.00 175.29 175.82 1bx6 s VAL 182 N 1.93 4.80 0.13 1.34 1.01 -0.08 0.04 120.40 129.58 1bx6 s VAL 182 Ca 0.02 1.66 0.05 0.00 0.00 0.00 0.00 61.98 63.70 1bx6 s VAL 182 Cb -0.12 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 1bx6 s VAL 182 CO -0.03 0.32 -0.11 0.28 0.00 0.00 0.00 175.10 175.55 1bx6 s THR 183 N 0.24 1.16 -0.01 3.92 -1.32 -0.35 -2.87 115.64 116.41 1bx6 s THR 183 Ca 0.40 -1.90 -0.00 0.00 -1.21 0.00 0.00 61.69 58.98 1bx6 s THR 183 Cb -0.20 -1.67 0.00 0.00 -1.51 0.00 0.00 72.50 69.12 1bx6 s THR 183 CO 0.23 -0.64 0.00 -0.67 -2.21 0.00 0.00 174.62 171.33 1bx6 n ASP 184 N 0.12 -2.16 -1.15 8.08 -0.08 -1.26 -4.80 116.55 115.31 1bx6 n ASP 184 Ca -0.13 0.05 0.10 0.00 -1.51 0.00 0.00 54.79 53.30 1bx6 n ASP 184 Cb 0.59 -1.14 0.27 0.00 2.34 0.00 0.00 41.12 43.19 1bx6 n ASP 184 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1bx6 n PHE 185 N 0.03 0.82 0.00 -0.67 3.01 -1.26 -4.66 117.46 114.72 1bx6 n PHE 185 Ca -0.00 -0.41 0.00 0.00 1.01 0.00 0.00 57.45 58.05 1bx6 n PHE 185 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1bx6 n PHE 185 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bx6 n GLY 186 N 1.49 -3.42 0.36 1.37 0.00 -1.26 -2.15 105.19 101.58 1bx6 n GLY 186 Ca 0.21 0.59 0.18 0.00 0.00 0.00 0.00 46.02 47.00 1bx6 n GLY 186 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1bx6 h PHE 187 N 0.00 0.00 -1.98 1.61 -1.00 -1.87 -3.43 116.94 110.26 1bx6 h PHE 187 Ca 0.00 0.00 -0.27 0.00 2.81 0.00 0.00 57.97 60.51 1bx6 h PHE 187 Cb 0.00 0.00 0.15 0.00 3.61 0.00 0.00 35.95 39.71 1bx6 h PHE 187 CO -0.14 0.00 -0.51 0.00 -1.61 0.00 0.00 178.31 176.05 1bx6 n ALA 188 N -2.17 -1.49 -3.64 2.45 0.00 -0.92 -4.86 120.51 109.88 1bx6 n ALA 188 Ca 0.03 -1.09 -0.04 0.00 0.00 0.00 0.00 53.44 52.34 1bx6 n ALA 188 Cb 0.51 -0.97 -0.07 0.00 0.00 0.00 0.00 19.45 18.92 1bx6 n ALA 188 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1bx6 s LYS 189 N -3.41 0.26 -0.34 0.00 2.20 -1.12 -5.00 119.74 112.34 1bx6 s LYS 189 Ca 0.39 0.35 -0.06 0.00 -0.36 0.00 0.00 55.97 56.30 1bx6 s LYS 189 Cb -0.06 0.11 0.05 0.00 -1.51 0.00 0.00 37.83 36.41 1bx6 s LYS 189 CO 0.40 -0.04 0.10 0.50 -0.36 0.00 0.00 175.35 175.95 1bx6 s ARG 190 N 0.47 2.56 0.23 4.03 3.52 -1.26 -1.91 118.95 126.58 1bx6 s ARG 190 Ca 0.01 -1.24 -0.03 0.00 -0.13 0.00 0.00 55.73 54.35 1bx6 s ARG 190 Cb -0.04 -3.43 -0.03 0.00 -1.56 0.00 0.00 34.95 29.88 1bx6 s ARG 190 CO -0.12 -0.69 0.23 0.14 -0.81 0.00 0.00 175.30 174.06 1bx6 s VAL 191 N 1.37 0.00 -0.10 7.11 -7.23 -0.02 -4.99 120.40 116.54 1bx6 s VAL 191 Ca -0.02 -1.86 0.01 0.00 -1.81 0.00 0.00 61.98 58.30 1bx6 s VAL 191 Cb -0.20 -2.45 0.02 0.00 0.56 0.00 0.00 36.38 34.31 1bx6 s VAL 191 CO 0.02 0.00 -0.10 -0.75 -0.31 0.00 0.00 175.10 173.96 1bx6 s LYS 192 N -4.01 1.70 0.96 4.82 2.47 -1.26 -4.54 119.74 119.88 1bx6 s LYS 192 Ca 0.35 -0.36 0.00 0.00 -1.56 0.00 0.00 55.97 54.41 1bx6 s LYS 192 Cb 0.05 -1.59 0.00 0.00 -1.46 0.00 0.00 37.83 34.83 1bx6 s LYS 192 CO 0.13 -0.15 0.00 0.41 0.16 0.00 0.00 175.35 175.90 1bx6 n GLY 193 N 4.48 -1.05 3.88 5.54 0.00 -1.26 -4.96 105.19 111.82 1bx6 n GLY 193 Ca -0.17 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 43.90 1bx6 n GLY 193 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bx6 s ARG 194 N 0.00 3.76 0.28 1.61 0.52 -1.26 -4.72 118.95 119.13 1bx6 s ARG 194 Ca 0.00 0.44 0.06 0.00 -0.52 0.00 0.00 55.73 55.72 1bx6 s ARG 194 Cb 0.00 -2.39 -0.06 0.00 0.52 0.00 0.00 34.95 33.02 1bx6 s ARG 194 CO 0.00 -0.05 -0.06 0.99 0.02 0.00 0.00 175.30 176.20 1bx6 s THR 195 N -2.40 1.62 -0.66 0.02 2.01 0.55 -4.91 115.64 111.87 1bx6 s THR 195 Ca 0.51 -2.12 0.05 0.00 0.31 0.00 0.00 61.69 60.44 1bx6 s THR 195 Cb -0.10 -2.44 0.18 0.00 0.01 0.00 0.00 72.50 70.15 1bx6 s THR 195 CO 0.33 -0.30 0.52 0.79 -0.69 0.00 0.00 174.62 175.26 1bx6 n TRP 196 N -0.57 2.75 -3.56 4.92 8.01 -1.26 -1.69 117.44 126.03 1bx6 n TRP 196 Ca -0.05 -4.16 -0.27 0.00 -1.31 0.00 0.00 57.50 51.71 1bx6 n TRP 196 Cb 0.63 -0.51 -0.11 0.00 -2.01 0.00 0.00 31.31 29.32 1bx6 n TRP 196 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.69 176.57 1bx6 n LEU 198 N 1.87 0.78 -4.81 -0.99 0.00 -1.26 -4.87 117.00 107.72 1bx6 n LEU 198 Ca 0.23 -4.68 -0.37 0.00 0.00 0.00 0.00 56.01 51.18 1bx6 n LEU 198 Cb 0.38 0.09 -0.06 0.00 0.00 0.00 0.00 43.42 43.82 1bx6 n LEU 198 CO 0.27 1.83 -0.02 0.00 0.00 0.00 0.00 177.39 179.47 1bx6 n GLY 200 N 2.44 2.24 3.27 0.00 0.00 -1.26 -5.00 105.19 106.87 1bx6 n GLY 200 Ca -0.15 -1.83 -0.35 0.00 0.00 0.00 0.00 46.02 43.69 1bx6 n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bx6 s THR 201 N -1.55 3.24 0.00 2.61 2.01 -1.26 -5.07 115.64 115.61 1bx6 s THR 201 Ca 0.00 -0.71 0.00 0.00 0.31 0.00 0.00 61.69 61.29 1bx6 s THR 201 Cb 0.00 -2.55 0.00 0.00 0.01 0.00 0.00 72.50 69.96 1bx6 s THR 201 CO 0.00 0.31 0.19 -2.65 -0.69 0.00 0.00 174.62 171.79 1bx6 n PRO 202 N 4.76 0.00 -0.42 4.92 -0.02 -1.26 -0.95 135.00 142.03 1bx6 n PRO 202 Ca -0.17 0.19 0.32 0.00 -2.02 0.00 0.00 63.50 61.82 1bx6 n PRO 202 Cb 0.49 -0.34 0.50 0.00 -0.02 0.00 0.00 33.50 34.13 1bx6 n PRO 202 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1bx6 n GLU 203 N -1.16 -0.01 -0.33 -0.52 1.02 -1.26 -0.08 120.64 118.31 1bx6 n GLU 203 Ca 0.00 0.71 0.08 0.00 -0.02 0.00 0.00 57.16 57.94 1bx6 n GLU 203 Cb 0.00 -1.59 0.22 0.00 -0.02 0.00 0.00 31.44 30.05 1bx6 n GLU 203 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1bx6 n TYR 204 N -3.38 0.66 -3.42 -0.32 4.02 -0.12 -4.65 117.16 109.96 1bx6 n TYR 204 Ca 0.28 -0.87 -0.38 0.00 -0.01 0.00 0.00 57.90 56.92 1bx6 n TYR 204 Cb 1.22 -0.25 -0.07 0.00 -0.02 0.00 0.00 39.34 40.22 1bx6 n TYR 204 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1bx6 s LEU 205 N -2.66 4.21 1.10 7.72 1.43 0.88 -4.58 118.68 126.78 1bx6 s LEU 205 Ca 0.37 0.58 -0.18 0.00 -1.03 0.00 0.00 54.13 53.87 1bx6 s LEU 205 Cb 0.30 -2.51 0.12 0.00 0.03 0.00 0.00 46.19 44.13 1bx6 s LEU 205 CO 0.08 -0.01 0.03 0.00 0.23 0.00 0.00 176.35 176.68 1bx6 n ALA 206 N 4.03 -3.45 0.14 4.21 0.00 -1.26 -4.86 120.51 119.32 1bx6 n ALA 206 Ca -0.09 -1.27 0.11 0.00 0.00 0.00 0.00 53.44 52.19 1bx6 n ALA 206 Cb 0.51 -1.32 -0.05 0.00 0.00 0.00 0.00 19.45 18.60 1bx6 n ALA 206 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bx6 n PRO 207 N -1.93 0.58 -0.13 0.00 -0.02 -1.26 -3.76 135.00 128.47 1bx6 n PRO 207 Ca 0.02 0.01 -0.07 0.00 -2.02 0.00 0.00 63.50 61.44 1bx6 n PRO 207 Cb 0.56 -1.70 -0.01 0.00 -0.02 0.00 0.00 33.50 32.33 1bx6 n PRO 207 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1bx6 h GLU 208 N 0.00 -0.23 0.13 -0.52 3.07 -1.90 -1.52 114.58 113.61 1bx6 h GLU 208 Ca 0.00 0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1bx6 h GLU 208 Cb 0.96 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.91 1bx6 h GLU 208 CO 0.00 -0.15 -0.19 0.82 -1.40 0.00 0.00 179.01 178.08 1bx6 h ILE 209 N -0.24 0.00 -0.48 3.13 2.04 -1.93 -1.77 117.51 118.28 1bx6 h ILE 209 Ca 0.18 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.09 1bx6 h ILE 209 Cb 0.54 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.56 1bx6 h ILE 209 CO -0.57 0.00 -0.28 -0.38 0.00 0.00 0.00 178.15 176.92 1bx6 n ILE 210 N -3.52 -0.32 0.05 -0.67 5.41 -1.07 0.11 119.36 119.35 1bx6 n ILE 210 Ca -0.04 1.89 0.03 0.00 1.00 0.00 0.00 62.75 65.63 1bx6 n ILE 210 Cb 0.17 -2.41 0.14 0.00 -0.71 0.00 0.00 39.64 36.82 1bx6 n ILE 210 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1bx6 n LEU 211 N -4.07 0.13 -2.82 1.39 4.77 -0.60 -4.86 117.00 110.94 1bx6 n LEU 211 Ca 0.01 0.46 -0.02 0.00 -0.03 0.00 0.00 56.01 56.43 1bx6 n LEU 211 Cb 0.12 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1bx6 n LEU 211 CO -0.08 -0.50 -0.42 -1.54 -1.33 0.00 0.00 177.39 173.52 1bx6 n SER 212 N -1.61 -7.79 0.00 -1.43 3.41 0.31 -5.02 113.62 101.50 1bx6 n SER 212 Ca -0.00 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.76 1bx6 n SER 212 Cb 0.15 -4.76 0.00 0.00 -0.26 0.00 0.00 64.21 59.34 1bx6 n SER 212 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1bx6 n LYS 213 N 0.64 1.95 0.00 4.33 5.02 -1.17 -5.03 118.16 123.90 1bx6 n LYS 213 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1bx6 n LYS 213 Cb 0.14 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.56 1bx6 n LYS 213 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bx6 n GLY 214 N 0.84 0.57 3.91 0.72 0.00 -1.26 -5.02 105.19 104.96 1bx6 n GLY 214 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 1bx6 n GLY 214 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bx6 s TYR 215 N 0.00 1.41 0.15 1.61 -0.85 -0.68 -4.59 117.35 114.40 1bx6 s TYR 215 Ca 0.00 0.29 -0.02 0.00 -0.52 0.00 0.00 57.07 56.82 1bx6 s TYR 215 Cb 0.00 -4.13 0.01 0.00 0.38 0.00 0.00 41.96 38.22 1bx6 s TYR 215 CO 0.00 -2.80 0.22 0.27 -1.52 0.00 0.00 175.55 171.72 1bx6 n ASN 216 N -3.87 -0.63 -0.66 -0.18 0.23 -1.26 -0.33 115.26 108.55 1bx6 n ASN 216 Ca 0.16 -1.74 0.51 0.00 -0.53 0.00 0.00 54.58 52.98 1bx6 n ASN 216 Cb 0.59 1.14 0.79 0.00 -2.08 0.00 0.00 39.78 40.22 1bx6 n ASN 216 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 1bx6 h LYS 217 N 0.00 0.00 -0.57 -3.83 2.10 -1.93 -1.82 116.57 110.52 1bx6 h LYS 217 Ca -0.11 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.59 1bx6 h LYS 217 Cb 0.48 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.74 1bx6 h LYS 217 CO 0.15 0.00 -0.34 0.00 -2.00 0.00 0.00 179.45 177.27 1bx6 n ALA 218 N -2.86 -0.37 -0.28 0.07 0.00 -1.26 -1.50 120.51 114.31 1bx6 n ALA 218 Ca 0.42 0.49 0.26 0.00 0.00 0.00 0.00 53.44 54.61 1bx6 n ALA 218 Cb 1.98 0.13 0.40 0.00 0.00 0.00 0.00 19.45 21.95 1bx6 n ALA 218 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bx6 n VAL 219 N -4.29 0.00 -0.03 0.00 0.31 -0.68 0.75 118.33 114.39 1bx6 n VAL 219 Ca 0.01 0.92 -0.13 0.00 -0.01 0.00 0.00 64.34 65.14 1bx6 n VAL 219 Cb 0.15 -1.60 -0.08 0.00 -0.91 0.00 0.00 33.84 31.39 1bx6 n VAL 219 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1bx6 h ASP 220 N 0.00 0.14 -0.15 4.52 3.32 -1.50 -2.84 116.42 119.92 1bx6 h ASP 220 Ca 0.46 -0.41 0.02 0.00 0.02 0.00 0.00 57.03 57.12 1bx6 h ASP 220 Cb 2.24 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 41.72 1bx6 h ASP 220 CO -0.00 0.53 -0.00 -0.50 -1.72 0.00 0.00 179.24 177.54 1bx6 h TRP 221 N -0.24 -0.01 0.01 4.55 4.06 0.19 -0.72 115.95 123.80 1bx6 h TRP 221 Ca 0.02 0.01 0.03 0.00 2.06 0.00 0.00 58.89 61.01 1bx6 h TRP 221 Cb 0.47 0.03 -0.04 0.00 -1.00 0.00 0.00 29.16 28.62 1bx6 h TRP 221 CO 0.07 -0.02 -0.25 2.35 -3.56 0.00 0.00 178.44 177.03 1bx6 h TRP 222 N 0.05 -0.67 -1.06 0.49 2.91 -1.65 0.24 115.95 116.25 1bx6 h TRP 222 Ca 0.07 0.02 0.29 0.00 1.13 0.00 0.00 58.89 60.40 1bx6 h TRP 222 Cb 0.08 0.30 -0.07 0.00 -0.51 0.00 0.00 29.16 28.96 1bx6 h TRP 222 CO -0.15 -0.34 0.72 0.00 -1.03 0.00 0.00 178.44 177.64 1bx6 h ALA 223 N 0.42 2.58 -0.03 2.65 0.00 -1.13 0.61 119.26 124.37 1bx6 h ALA 223 Ca 0.06 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1bx6 h ALA 223 Cb 0.47 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1bx6 h ALA 223 CO -0.21 -0.95 -0.28 1.25 0.00 0.00 0.00 179.25 179.06 1bx6 h LEU 224 N 0.22 0.04 -0.01 0.00 5.85 0.92 0.26 115.31 122.60 1bx6 h LEU 224 Ca 0.56 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.27 1bx6 h LEU 224 Cb 1.76 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.78 1bx6 h LEU 224 CO -0.17 0.33 -0.01 1.23 -0.34 0.00 0.00 178.44 179.48 1bx6 h GLY 225 N 0.89 0.02 2.00 3.75 0.00 0.13 0.18 103.07 110.03 1bx6 h GLY 225 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.25 1bx6 h GLY 225 CO 0.04 0.02 -0.30 -0.24 0.00 0.00 0.00 176.54 176.06 1bx6 h VAL 226 N -0.45 1.19 0.42 4.60 3.04 -1.11 0.39 116.25 124.33 1bx6 h VAL 226 Ca 0.00 -1.02 -0.02 0.00 -1.01 0.00 0.00 66.70 64.65 1bx6 h VAL 226 Cb 0.48 1.56 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 1bx6 h VAL 226 CO 0.00 0.29 -0.20 0.25 -1.01 0.00 0.00 177.57 176.90 1bx6 h LEU 227 N 0.00 -0.48 -0.35 3.16 5.85 -0.24 0.31 115.31 123.56 1bx6 h LEU 227 Ca -0.00 -0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.69 1bx6 h LEU 227 Cb 0.53 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.61 1bx6 h LEU 227 CO 0.04 -0.06 -0.12 0.40 -0.34 0.00 0.00 178.44 178.35 1bx6 h ILE 228 N -1.00 0.57 -0.44 4.05 2.04 -0.47 0.87 117.51 123.13 1bx6 h ILE 228 Ca -0.06 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.89 1bx6 h ILE 228 Cb 0.55 0.57 -0.09 0.00 -0.74 0.00 0.00 36.82 37.11 1bx6 h ILE 228 CO 0.09 0.00 -0.21 0.22 0.00 0.00 0.00 178.15 178.26 1bx6 h TYR 229 N -0.05 -0.52 -0.24 1.37 5.03 -0.18 0.56 116.97 122.94 1bx6 h TYR 229 Ca 0.17 0.05 -0.04 0.00 2.58 0.00 0.00 58.73 61.49 1bx6 h TYR 229 Cb 0.32 0.29 -0.01 0.00 1.55 0.00 0.00 36.73 38.88 1bx6 h TYR 229 CO -0.35 -0.29 -0.02 1.49 -1.32 0.00 0.00 178.16 177.67 1bx6 h GLU 230 N -0.12 0.44 -0.48 1.82 4.81 0.13 0.28 114.58 121.47 1bx6 h GLU 230 Ca 0.21 -0.15 0.14 0.00 -0.13 0.00 0.00 59.36 59.43 1bx6 h GLU 230 Cb 0.44 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1bx6 h GLU 230 CO -0.51 0.63 0.40 0.52 -0.73 0.00 0.00 179.01 179.32 1bx6 h MET 231 N 0.20 0.00 0.00 1.92 2.86 0.16 -1.05 114.93 119.02 1bx6 h MET 231 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1bx6 h MET 231 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1bx6 h MET 231 CO 0.02 0.00 -1.78 0.00 1.06 0.00 0.00 176.91 176.21 1bx6 n ALA 232 N -2.52 3.04 0.48 6.32 0.00 0.10 -1.18 120.51 126.75 1bx6 n ALA 232 Ca 0.09 -0.50 0.07 0.00 0.00 0.00 0.00 53.44 53.10 1bx6 n ALA 232 Cb 0.60 -0.70 -0.09 0.00 0.00 0.00 0.00 19.45 19.26 1bx6 n ALA 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bx6 n ALA 233 N -2.09 3.48 -0.21 0.00 0.00 0.92 -4.59 120.51 118.01 1bx6 n ALA 233 Ca -0.03 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1bx6 n ALA 233 Cb 0.50 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.43 1bx6 n ALA 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bx6 n GLY 234 N 1.43 0.83 3.50 0.00 0.00 -0.43 -4.94 105.19 105.58 1bx6 n GLY 234 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 1bx6 n GLY 234 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bx6 s TYR 235 N -2.57 0.81 0.21 1.61 1.13 -1.24 -4.98 117.35 112.33 1bx6 s TYR 235 Ca 0.00 -1.10 -0.03 0.00 -1.41 0.00 0.00 57.07 54.53 1bx6 s TYR 235 Cb 0.00 -0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.80 1bx6 s TYR 235 CO 0.00 -1.05 0.43 -1.25 -2.51 0.00 0.00 175.55 171.17 1bx6 s PRO 236 N -3.46 3.59 0.13 -3.49 0.04 -1.26 -3.52 135.00 127.02 1bx6 s PRO 236 Ca 0.28 -0.16 -0.29 0.00 0.04 0.00 0.00 61.00 60.87 1bx6 s PRO 236 Cb 0.00 -2.78 -0.06 0.00 0.04 0.00 0.00 34.50 31.70 1bx6 s PRO 236 CO 0.15 0.37 1.59 -1.35 0.04 0.00 0.00 177.00 177.80 1bx6 h PRO 237 N 2.16 -0.49 -4.80 0.56 0.11 -1.89 -3.38 132.00 124.26 1bx6 h PRO 237 Ca -0.47 0.03 -0.68 0.00 0.11 0.00 0.00 66.00 64.99 1bx6 h PRO 237 Cb 1.18 0.11 -0.26 0.00 0.11 0.00 0.00 31.00 32.14 1bx6 h PRO 237 CO 0.69 -0.33 -0.62 -0.06 -0.21 0.00 0.00 178.00 177.47 1bx6 s PHE 238 N -5.92 3.15 -0.06 0.65 0.40 -1.26 -4.88 117.98 110.06 1bx6 s PHE 238 Ca -0.16 -1.03 -0.03 0.00 -0.60 0.00 0.00 56.93 55.12 1bx6 s PHE 238 Cb 0.09 -2.25 0.04 0.00 0.51 0.00 0.00 43.02 41.41 1bx6 s PHE 238 CO 0.64 -0.59 0.13 0.12 0.70 0.00 0.00 175.22 176.23 1bx6 s PHE 239 N 1.49 -0.15 0.28 0.36 2.19 -1.26 -4.67 117.98 116.23 1bx6 s PHE 239 Ca 0.02 0.45 -0.01 0.00 0.33 0.00 0.00 56.93 57.72 1bx6 s PHE 239 Cb -0.17 -0.10 0.01 0.00 -1.31 0.00 0.00 43.02 41.45 1bx6 s PHE 239 CO 0.02 -0.16 0.39 0.00 1.83 0.00 0.00 175.22 177.30 1bx6 n ALA 240 N 4.17 -0.23 0.06 11.12 0.00 -1.26 -4.92 120.51 129.45 1bx6 n ALA 240 Ca -0.26 -1.33 -0.22 0.00 0.00 0.00 0.00 53.44 51.63 1bx6 n ALA 240 Cb 0.52 1.07 -0.15 0.00 0.00 0.00 0.00 19.45 20.89 1bx6 n ALA 240 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1bx6 h ASP 241 N 1.60 0.56 -3.14 0.00 1.82 -2.00 -3.45 116.42 111.81 1bx6 h ASP 241 Ca -0.22 -0.91 -0.67 0.00 -0.39 0.00 0.00 57.03 54.84 1bx6 h ASP 241 Cb 0.96 -0.18 -0.34 0.00 0.68 0.00 0.00 39.33 40.45 1bx6 h ASP 241 CO 0.30 1.65 -0.85 -1.10 -1.61 0.00 0.00 179.24 177.62 1bx6 s GLN 242 N -2.52 3.03 0.42 0.28 -1.52 -1.26 -4.98 119.66 113.11 1bx6 s GLN 242 Ca -0.16 -0.82 0.38 0.00 -1.95 0.00 0.00 55.36 52.81 1bx6 s GLN 242 Cb 0.04 -2.55 1.31 0.00 -0.22 0.00 0.00 33.01 31.59 1bx6 s GLN 242 CO 0.84 -0.13 1.19 -0.35 -0.25 0.00 0.00 175.29 176.59 1bx6 n PRO 243 N 4.41 -0.00 -0.17 2.91 -0.05 -1.26 0.31 135.00 141.14 1bx6 n PRO 243 Ca -0.20 0.83 -0.11 0.00 -0.05 0.00 0.00 63.50 63.97 1bx6 n PRO 243 Cb 0.51 -1.90 0.01 0.00 -0.05 0.00 0.00 33.50 32.06 1bx6 n PRO 243 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 175.50 176.42 1bx6 h ILE 244 N 0.00 1.27 -0.01 0.52 6.09 -1.99 -2.82 117.51 120.57 1bx6 h ILE 244 Ca 0.71 -1.28 -0.09 0.00 -1.37 0.00 0.00 64.86 62.83 1bx6 h ILE 244 Cb 2.83 1.03 -0.01 0.00 0.47 0.00 0.00 36.82 41.14 1bx6 h ILE 244 CO -0.03 0.45 -0.42 1.56 -3.07 0.00 0.00 178.15 176.63 1bx6 h GLN 245 N 0.86 0.03 -0.32 2.19 7.50 0.45 -2.66 115.11 123.15 1bx6 h GLN 245 Ca 0.13 -0.01 -0.09 0.00 0.50 0.00 0.00 58.65 59.18 1bx6 h GLN 245 Cb 0.69 -0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.21 1bx6 h GLN 245 CO 0.05 0.45 -0.17 0.82 -1.50 0.00 0.00 178.83 178.48 1bx6 h ILE 246 N 0.03 1.25 -0.50 2.54 2.04 -1.50 -2.74 117.51 118.62 1bx6 h ILE 246 Ca -0.00 -1.16 -0.08 0.00 1.00 0.00 0.00 64.86 64.62 1bx6 h ILE 246 Cb 0.76 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 1bx6 h ILE 246 CO 0.06 0.38 -0.03 1.88 0.00 0.00 0.00 178.15 180.44 1bx6 h TYR 247 N 0.52 0.93 -0.39 1.37 0.05 -1.21 0.80 116.97 119.04 1bx6 h TYR 247 Ca 0.09 -0.15 0.04 0.00 0.05 0.00 0.00 58.73 58.76 1bx6 h TYR 247 Cb 0.59 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 38.06 1bx6 h TYR 247 CO 0.02 0.86 0.26 1.49 -1.05 0.00 0.00 178.16 179.75 1bx6 h GLU 248 N 0.79 0.38 0.03 4.88 4.81 -1.41 -2.48 114.58 121.58 1bx6 h GLU 248 Ca 0.15 -0.02 -0.37 0.00 -0.13 0.00 0.00 59.36 58.98 1bx6 h GLU 248 Cb 0.51 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 1bx6 h GLU 248 CO 0.03 0.25 -2.14 0.36 -0.73 0.00 0.00 179.01 176.78 1bx6 n LYS 249 N -4.48 0.64 -0.37 1.92 2.85 -1.02 -2.68 118.16 115.03 1bx6 n LYS 249 Ca 0.04 0.30 -0.12 0.00 -1.05 0.00 0.00 58.31 57.48 1bx6 n LYS 249 Cb 0.18 -1.60 -0.10 0.00 -0.65 0.00 0.00 35.03 32.85 1bx6 n LYS 249 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 177.40 178.17 1bx6 h ILE 250 N -0.48 0.00 -0.51 0.58 2.04 -0.83 0.81 117.51 119.12 1bx6 h ILE 250 Ca -0.53 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.43 1bx6 h ILE 250 Cb 1.73 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 1bx6 h ILE 250 CO -0.17 0.00 0.35 1.62 0.00 0.00 0.00 178.15 179.95 1bx6 h VAL 251 N -0.07 0.86 0.06 1.67 3.04 -1.63 -2.33 116.25 117.86 1bx6 h VAL 251 Ca 0.14 -0.09 -0.26 0.00 -1.01 0.00 0.00 66.70 65.49 1bx6 h VAL 251 Cb 0.45 0.59 0.01 0.00 -2.01 0.00 0.00 31.29 30.33 1bx6 h VAL 251 CO -0.88 0.05 -1.10 0.77 -1.01 0.00 0.00 177.57 175.40 1bx6 h SER 252 N 0.25 0.62 -0.13 3.17 4.64 0.65 -3.48 113.55 119.27 1bx6 h SER 252 Ca 0.24 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1bx6 h SER 252 Cb 0.61 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1bx6 h SER 252 CO -0.05 1.38 0.00 0.61 -0.87 0.00 0.00 176.83 177.90 1bx6 n GLY 253 N 1.21 0.85 2.24 -0.77 0.00 0.96 -4.98 105.19 104.70 1bx6 n GLY 253 Ca -0.09 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 1bx6 n GLY 253 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bx6 n LYS 254 N -0.89 3.22 -2.32 1.61 0.00 -1.25 -4.93 118.16 113.62 1bx6 n LYS 254 Ca 0.00 -1.95 -0.43 0.00 0.00 0.00 0.00 58.31 55.94 1bx6 n LYS 254 Cb 0.36 -2.53 -0.02 0.00 0.00 0.00 0.00 35.03 32.84 1bx6 n LYS 254 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1bx6 s VAL 255 N 1.41 4.09 -0.28 3.15 1.01 -1.26 -5.00 120.40 123.52 1bx6 s VAL 255 Ca 0.68 1.32 -0.04 0.00 0.00 0.00 0.00 61.98 63.93 1bx6 s VAL 255 Cb 0.23 -3.87 0.02 0.00 0.00 0.00 0.00 36.38 32.76 1bx6 s VAL 255 CO -0.05 -0.14 0.02 -0.60 0.00 0.00 0.00 175.10 174.33 1bx6 s ARG 256 N 3.70 2.91 0.11 2.72 3.52 -1.26 -5.10 118.95 125.55 1bx6 s ARG 256 Ca 0.60 -0.95 -0.10 0.00 -0.13 0.00 0.00 55.73 55.14 1bx6 s ARG 256 Cb -0.24 -3.21 -0.06 0.00 -1.56 0.00 0.00 34.95 29.87 1bx6 s ARG 256 CO 0.19 -0.45 0.44 -0.06 -0.81 0.00 0.00 175.30 174.60 1bx6 s PHE 257 N 1.41 3.56 0.28 5.12 0.40 -1.26 -5.06 117.98 122.43 1bx6 s PHE 257 Ca 0.01 0.82 -0.29 0.00 -0.60 0.00 0.00 56.93 56.87 1bx6 s PHE 257 Cb -0.17 -2.19 -0.09 0.00 0.51 0.00 0.00 43.02 41.07 1bx6 s PHE 257 CO -0.00 0.47 1.04 -1.25 0.70 0.00 0.00 175.22 176.17 1bx6 s PRO 258 N -2.07 4.65 0.46 0.24 0.04 -1.26 -4.91 135.00 132.15 1bx6 s PRO 258 Ca 0.36 1.65 0.28 0.00 0.04 0.00 0.00 61.00 63.33 1bx6 s PRO 258 Cb -0.14 -3.12 1.35 0.00 0.04 0.00 0.00 34.50 32.63 1bx6 s PRO 258 CO 0.19 0.27 1.74 0.77 0.04 0.00 0.00 177.00 180.00 1bx6 h SER 259 N 3.73 0.24 0.00 6.66 0.02 -2.01 0.00 113.55 122.19 1bx6 h SER 259 Ca -0.46 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1bx6 h SER 259 Cb 1.21 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1bx6 h SER 259 CO 0.67 -0.01 0.00 0.00 -1.14 0.00 0.00 176.83 176.35 1bx6 n HIS 260 N -4.47 0.00 -2.80 3.45 1.44 -1.26 -4.76 115.22 106.82 1bx6 n HIS 260 Ca 0.29 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.58 1bx6 n HIS 260 Cb 1.18 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 31.26 1bx6 n HIS 260 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1bx6 s PHE 261 N -2.00 3.52 1.10 -1.40 0.40 -0.02 -5.02 117.98 114.56 1bx6 s PHE 261 Ca 0.12 1.47 -0.18 0.00 -0.60 0.00 0.00 56.93 57.74 1bx6 s PHE 261 Cb 0.06 -3.08 0.11 0.00 0.51 0.00 0.00 43.02 40.62 1bx6 s PHE 261 CO 0.09 -0.16 0.01 -1.13 0.70 0.00 0.00 175.22 174.74 1bx6 n SER 262 N 4.74 -2.63 0.04 1.36 3.41 -1.26 -4.71 113.62 114.57 1bx6 n SER 262 Ca 0.06 -0.22 0.02 0.00 -0.26 0.00 0.00 58.87 58.47 1bx6 n SER 262 Cb 0.49 -0.87 -0.07 0.00 -0.26 0.00 0.00 64.21 63.50 1bx6 n SER 262 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1bx6 n SER 263 N -1.39 0.83 0.44 4.04 7.64 -1.26 -2.14 113.62 121.79 1bx6 n SER 263 Ca 0.02 0.36 -0.19 0.00 1.01 0.00 0.00 58.87 60.07 1bx6 n SER 263 Cb 0.56 0.24 -0.09 0.00 -1.01 0.00 0.00 64.21 63.91 1bx6 n SER 263 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1bx6 h ASP 264 N 0.00 -0.95 -0.57 6.43 5.19 -2.00 -1.26 116.42 123.26 1bx6 h ASP 264 Ca -0.14 0.03 0.06 0.00 -0.62 0.00 0.00 57.03 56.35 1bx6 h ASP 264 Cb 1.50 0.25 -0.08 0.00 0.18 0.00 0.00 39.33 41.17 1bx6 h ASP 264 CO 0.04 -0.65 -0.46 0.25 -3.12 0.00 0.00 179.24 175.30 1bx6 h LEU 265 N -1.18 -1.61 -1.77 1.55 5.85 -1.91 0.83 115.31 117.06 1bx6 h LEU 265 Ca -0.11 0.23 0.12 0.00 0.84 0.00 0.00 57.88 58.96 1bx6 h LEU 265 Cb 0.87 0.69 -0.02 0.00 0.37 0.00 0.00 40.66 42.57 1bx6 h LEU 265 CO 0.19 -0.25 0.57 0.11 -0.34 0.00 0.00 178.44 178.72 1bx6 h LYS 266 N -0.15 0.00 0.11 1.25 1.57 -1.37 -1.73 116.57 116.25 1bx6 h LYS 266 Ca 0.09 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1bx6 h LYS 266 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1bx6 h LYS 266 CO -0.62 0.00 -0.06 0.22 -0.57 0.00 0.00 179.45 178.43 1bx6 h ASP 267 N 0.00 -0.13 -0.78 0.86 3.58 0.19 -3.13 116.42 117.01 1bx6 h ASP 267 Ca 0.20 -0.40 0.18 0.00 0.42 0.00 0.00 57.03 57.43 1bx6 h ASP 267 Cb 1.34 0.03 -0.14 0.00 1.72 0.00 0.00 39.33 42.28 1bx6 h ASP 267 CO -0.00 0.49 -0.01 0.25 -2.88 0.00 0.00 179.24 177.09 1bx6 h LEU 268 N -0.91 -0.39 -0.94 2.28 5.85 -0.35 0.82 115.31 121.67 1bx6 h LEU 268 Ca -0.02 0.21 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 1bx6 h LEU 268 Cb 0.52 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 1bx6 h LEU 268 CO 0.03 -0.20 -0.35 -0.07 -0.34 0.00 0.00 178.44 177.50 1bx6 h LEU 269 N 0.09 0.35 -1.97 2.25 3.38 -1.63 0.68 115.31 118.44 1bx6 h LEU 269 Ca 0.43 -0.13 0.21 0.00 0.09 0.00 0.00 57.88 58.47 1bx6 h LEU 269 Cb 0.76 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 1bx6 h LEU 269 CO -0.70 0.68 0.57 0.03 0.09 0.00 0.00 178.44 179.11 1bx6 h ARG 270 N 0.29 0.00 0.00 1.13 3.08 -0.78 0.53 114.38 118.63 1bx6 h ARG 270 Ca 0.03 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.89 1bx6 h ARG 270 Cb 0.76 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 1bx6 h ARG 270 CO 0.06 0.00 -1.35 0.09 -1.07 0.00 0.00 179.97 177.70 1bx6 n ASN 271 N -4.12 1.88 -0.12 7.04 4.13 -0.66 -4.16 115.26 119.25 1bx6 n ASN 271 Ca 0.15 0.44 -0.05 0.00 1.68 0.00 0.00 54.58 56.80 1bx6 n ASN 271 Cb 0.84 -0.87 0.02 0.00 -1.54 0.00 0.00 39.78 38.23 1bx6 n ASN 271 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1bx6 h LEU 272 N -1.00 -0.26 -3.57 3.41 3.38 -0.30 0.38 115.31 117.35 1bx6 h LEU 272 Ca -0.29 0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 1bx6 h LEU 272 Cb 1.14 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 42.06 1bx6 h LEU 272 CO -0.18 -0.09 -0.14 0.18 0.09 0.00 0.00 178.44 178.31 1bx6 n LEU 273 N -5.25 4.74 -4.55 1.67 4.32 0.18 -4.32 117.00 113.79 1bx6 n LEU 273 Ca 0.02 -2.50 -0.42 0.00 -0.02 0.00 0.00 56.01 53.09 1bx6 n LEU 273 Cb 0.21 -1.13 -0.07 0.00 -1.62 0.00 0.00 43.42 40.81 1bx6 n LEU 273 CO 0.18 1.16 0.39 -1.58 -1.22 0.00 0.00 177.39 176.32 1bx6 s GLN 274 N 0.67 3.52 0.62 3.23 2.00 0.13 -4.89 119.66 124.95 1bx6 s GLN 274 Ca 0.28 -0.11 0.36 0.00 -2.00 0.00 0.00 55.36 53.89 1bx6 s GLN 274 Cb 0.13 -3.87 2.08 0.00 0.80 0.00 0.00 33.01 32.16 1bx6 s GLN 274 CO 0.00 -0.85 2.30 0.28 -0.50 0.00 0.00 175.29 176.52 1bx6 h VAL 275 N 5.76 0.29 -3.62 1.34 2.07 -1.86 -3.39 116.25 116.84 1bx6 h VAL 275 Ca -0.26 -0.02 -0.69 0.00 0.82 0.00 0.00 66.70 66.55 1bx6 h VAL 275 Cb 1.10 1.02 -0.26 0.00 -1.52 0.00 0.00 31.29 31.63 1bx6 h VAL 275 CO 0.86 0.00 -0.58 -0.62 0.02 0.00 0.00 177.57 177.25 1bx6 s ASP 276 N -5.72 5.37 0.59 0.57 -1.08 -1.26 -4.89 116.67 110.25 1bx6 s ASP 276 Ca -0.05 -0.86 0.30 0.00 -0.52 0.00 0.00 52.55 51.42 1bx6 s ASP 276 Cb 0.14 -1.93 1.81 0.00 -1.46 0.00 0.00 42.92 41.49 1bx6 s ASP 276 CO 0.49 -0.27 2.24 0.17 0.52 0.00 0.00 175.17 178.31 1bx6 h LEU 277 N 8.29 0.00 -0.15 -1.34 8.10 -1.92 0.62 115.31 128.91 1bx6 h LEU 277 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.71 1bx6 h LEU 277 Cb 1.11 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.33 1bx6 h LEU 277 CO 0.62 0.00 0.00 0.35 -4.11 0.00 0.00 178.44 175.30 1bx6 n THR 278 N -3.83 0.56 -0.10 0.15 -2.24 -1.26 -3.33 114.28 104.22 1bx6 n THR 278 Ca -0.02 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.55 1bx6 n THR 278 Cb 0.11 -0.73 -0.12 0.00 -2.10 0.00 0.00 70.33 67.50 1bx6 n THR 278 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1bx6 n LYS 279 N -2.04 0.78 -1.68 -0.78 4.01 0.11 -4.71 118.16 113.85 1bx6 n LYS 279 Ca 0.05 0.08 -0.44 0.00 -0.51 0.00 0.00 58.31 57.49 1bx6 n LYS 279 Cb 0.35 -1.45 -0.02 0.00 -0.51 0.00 0.00 35.03 33.39 1bx6 n LYS 279 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1bx6 n ARG 280 N -2.97 2.03 -0.33 1.97 0.63 0.18 -4.79 116.66 113.39 1bx6 n ARG 280 Ca -0.36 0.72 -0.26 0.00 -0.92 0.00 0.00 57.85 57.03 1bx6 n ARG 280 Cb 0.99 -2.34 0.25 0.00 0.45 0.00 0.00 32.46 31.81 1bx6 n ARG 280 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1bx6 n PHE 281 N 1.32 -3.27 0.00 -0.14 3.01 -1.26 -2.54 117.46 114.59 1bx6 n PHE 281 Ca 0.09 -0.54 0.00 0.00 1.01 0.00 0.00 57.45 58.01 1bx6 n PHE 281 Cb 0.33 -1.37 0.00 0.00 -0.01 0.00 0.00 39.48 38.43 1bx6 n PHE 281 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bx6 n GLY 282 N 2.04 0.00 0.23 1.37 0.00 -1.26 -4.21 105.19 103.36 1bx6 n GLY 282 Ca 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 1bx6 n GLY 282 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bx6 n ASN 283 N 0.00 2.46 -3.64 1.61 4.05 -1.16 -4.44 115.26 114.14 1bx6 n ASN 283 Ca 0.00 0.00 -0.24 0.00 0.45 0.00 0.00 54.58 54.79 1bx6 n ASN 283 Cb 0.00 -0.22 0.20 0.00 1.23 0.00 0.00 39.78 40.99 1bx6 n ASN 283 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1bx6 n LEU 284 N -3.03 -1.22 0.02 1.20 4.77 -1.05 -4.72 117.00 112.97 1bx6 n LEU 284 Ca -0.20 -0.48 -0.10 0.00 -0.03 0.00 0.00 56.01 55.19 1bx6 n LEU 284 Cb 0.69 -0.89 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 1bx6 n LEU 284 CO 0.08 -3.63 0.80 0.50 -1.33 0.00 0.00 177.39 173.81 1bx6 h LYS 285 N -2.90 -0.13 0.00 3.23 3.64 -1.94 -0.33 116.57 118.15 1bx6 h LYS 285 Ca -0.35 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 1bx6 h LYS 285 Cb 1.04 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1bx6 h LYS 285 CO 0.23 -0.08 0.00 -1.71 -2.27 0.00 0.00 179.45 175.62 1bx6 n ASN 286 N -5.23 0.00 0.00 4.20 4.05 -1.26 -4.95 115.26 112.07 1bx6 n ASN 286 Ca -0.04 -0.73 0.00 0.00 0.45 0.00 0.00 54.58 54.25 1bx6 n ASN 286 Cb 0.16 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.17 1bx6 n ASN 286 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1bx6 n GLY 287 N 0.32 2.28 0.33 8.20 0.00 -0.14 -2.42 105.19 113.76 1bx6 n GLY 287 Ca 0.14 -0.28 0.20 0.00 0.00 0.00 0.00 46.02 46.09 1bx6 n GLY 287 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1bx6 n VAL 288 N 0.00 -0.41 -0.36 1.61 3.14 -1.26 -0.25 118.33 120.79 1bx6 n VAL 288 Ca 0.00 2.11 0.29 0.00 -2.96 0.00 0.00 64.34 63.78 1bx6 n VAL 288 Cb 0.00 -3.20 0.60 0.00 -1.06 0.00 0.00 33.84 30.18 1bx6 n VAL 288 CO 0.00 0.00 0.00 0.78 -6.46 0.00 0.00 176.83 171.15 1bx6 h ASN 289 N 0.00 0.30 -0.62 6.55 2.35 -1.90 0.65 115.58 122.92 1bx6 h ASN 289 Ca 0.68 0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 56.50 1bx6 h ASN 289 Cb 1.57 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 39.94 1bx6 h ASN 289 CO -0.87 0.01 0.38 0.44 -1.65 0.00 0.00 177.43 175.73 1bx6 h ASP 290 N 0.24 0.74 0.32 5.81 3.32 -0.76 -0.42 116.42 125.66 1bx6 h ASP 290 Ca 0.65 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.62 1bx6 h ASP 290 Cb 1.95 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 41.31 1bx6 h ASP 290 CO -0.26 0.57 -0.15 0.40 -1.72 0.00 0.00 179.24 178.08 1bx6 h ILE 291 N 0.83 0.00 -1.23 0.35 2.04 -1.09 -0.72 117.51 117.69 1bx6 h ILE 291 Ca 0.22 -0.50 0.44 0.00 1.00 0.00 0.00 64.86 66.02 1bx6 h ILE 291 Cb -0.03 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 35.90 1bx6 h ILE 291 CO -0.04 0.00 0.76 0.11 0.00 0.00 0.00 178.15 178.97 1bx6 h LYS 292 N -0.93 0.04 0.00 2.37 1.57 -1.18 -1.91 116.57 116.53 1bx6 h LYS 292 Ca -0.04 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1bx6 h LYS 292 Cb 0.33 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1bx6 h LYS 292 CO 0.07 0.03 0.00 0.09 -0.57 0.00 0.00 179.45 179.07 1bx6 n ASN 293 N -4.91 0.00 0.00 0.86 3.02 -0.17 -4.74 115.26 109.33 1bx6 n ASN 293 Ca 0.38 0.55 0.00 0.00 -0.03 0.00 0.00 54.58 55.49 1bx6 n ASN 293 Cb 1.42 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 40.11 1bx6 n ASN 293 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1bx6 n HIS 294 N -1.93 0.00 0.11 3.10 -0.00 -0.28 -4.34 115.22 111.89 1bx6 n HIS 294 Ca 0.00 0.00 -0.15 0.00 0.46 0.00 0.00 57.72 58.03 1bx6 n HIS 294 Cb 0.00 0.00 -0.09 0.00 -0.12 0.00 0.00 29.99 29.78 1bx6 n HIS 294 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 1bx6 h LYS 295 N 0.00 -0.68 -0.48 1.57 1.57 -1.90 -0.71 116.57 115.95 1bx6 h LYS 295 Ca 0.00 0.05 0.14 0.00 -1.87 0.00 0.00 60.65 58.96 1bx6 h LYS 295 Cb 0.00 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1bx6 h LYS 295 CO 0.00 -0.45 0.58 1.87 -0.57 0.00 0.00 179.45 180.88 1bx6 n TRP 296 N -5.21 0.00 -0.61 -1.35 -0.00 -1.26 0.41 117.44 109.43 1bx6 n TRP 296 Ca -0.08 0.00 0.09 0.00 -0.00 0.00 0.00 57.50 57.51 1bx6 n TRP 296 Cb 0.38 -0.12 0.34 0.00 -0.00 0.00 0.00 31.31 31.91 1bx6 n TRP 296 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 1bx6 n PHE 297 N -2.19 1.39 0.04 5.87 3.72 -0.27 -4.65 117.46 121.37 1bx6 n PHE 297 Ca 0.11 -0.61 -0.11 0.00 -0.05 0.00 0.00 57.45 56.79 1bx6 n PHE 297 Cb 0.73 -0.22 -0.04 0.00 -0.94 0.00 0.00 39.48 39.00 1bx6 n PHE 297 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bx6 h ALA 298 N 3.91 -0.24 0.00 4.37 0.00 0.81 -2.36 119.26 125.74 1bx6 h ALA 298 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1bx6 h ALA 298 Cb 1.40 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1bx6 h ALA 298 CO 0.21 -0.70 0.00 1.79 0.00 0.00 0.00 179.25 180.55 1bx6 h THR 299 N -0.32 0.00 -3.34 0.00 1.35 -1.82 -3.43 112.91 105.34 1bx6 h THR 299 Ca 0.07 -0.07 -0.55 0.00 -0.55 0.00 0.00 66.41 65.31 1bx6 h THR 299 Cb 0.41 0.94 -0.03 0.00 -1.73 0.00 0.00 68.15 67.75 1bx6 h THR 299 CO -0.22 0.00 0.46 -0.89 -0.25 0.00 0.00 175.52 174.62 1bx6 s THR 300 N -3.92 4.83 -1.04 6.82 2.01 -0.89 -4.98 115.64 118.48 1bx6 s THR 300 Ca -0.03 2.04 -0.03 0.00 0.31 0.00 0.00 61.69 63.98 1bx6 s THR 300 Cb 0.11 -4.31 0.24 0.00 0.01 0.00 0.00 72.50 68.55 1bx6 s THR 300 CO 0.38 0.09 2.10 -0.67 -0.69 0.00 0.00 174.62 175.83 1bx6 n ASP 301 N 4.41 7.51 0.00 3.53 2.03 -1.26 -4.93 116.55 127.84 1bx6 n ASP 301 Ca 0.07 -3.51 0.00 0.00 0.52 0.00 0.00 54.79 51.87 1bx6 n ASP 301 Cb 0.50 -1.22 0.00 0.00 -0.72 0.00 0.00 41.12 39.68 1bx6 n ASP 301 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 1bx6 n TRP 302 N 0.47 0.00 -0.24 -0.67 7.02 -1.26 0.26 117.44 123.02 1bx6 n TRP 302 Ca 0.53 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.95 1bx6 n TRP 302 Cb 0.28 -0.22 0.09 0.00 -2.42 0.00 0.00 31.31 29.03 1bx6 n TRP 302 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1bx6 h ILE 303 N 0.00 1.26 0.00 -0.99 1.08 -1.99 -1.44 117.51 115.42 1bx6 h ILE 303 Ca 0.00 -0.90 -0.05 0.00 -0.39 0.00 0.00 64.86 63.52 1bx6 h ILE 303 Cb 0.00 0.49 -0.01 0.00 -3.07 0.00 0.00 36.82 34.24 1bx6 h ILE 303 CO 0.00 0.35 -0.25 0.00 -0.69 0.00 0.00 178.15 177.57 1bx6 h ALA 304 N 1.17 1.04 0.00 1.87 0.00 0.32 -2.85 119.26 120.81 1bx6 h ALA 304 Ca 0.23 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bx6 h ALA 304 Cb 0.31 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1bx6 h ALA 304 CO -0.01 0.31 -0.00 0.82 0.00 0.00 0.00 179.25 180.37 1bx6 h ILE 305 N 0.00 1.64 -0.06 0.00 2.04 -1.41 0.62 117.51 120.34 1bx6 h ILE 305 Ca -0.00 -2.02 0.02 0.00 1.00 0.00 0.00 64.86 63.86 1bx6 h ILE 305 Cb 0.74 2.99 -0.00 0.00 -0.74 0.00 0.00 36.82 39.81 1bx6 h ILE 305 CO 0.03 0.52 0.18 0.22 0.00 0.00 0.00 178.15 179.10 1bx6 h TYR 306 N -0.88 0.00 -0.29 1.37 3.20 -1.21 0.60 116.97 119.76 1bx6 h TYR 306 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1bx6 h TYR 306 Cb 0.85 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.12 1bx6 h TYR 306 CO 0.23 0.00 0.00 1.04 -1.64 0.00 0.00 178.16 177.79 1bx6 n GLN 307 N -3.25 2.38 -3.42 1.82 6.02 -1.08 -4.90 117.38 114.95 1bx6 n GLN 307 Ca -0.01 -1.88 -0.13 0.00 -0.01 0.00 0.00 57.00 54.97 1bx6 n GLN 307 Cb 0.26 -1.27 0.01 0.00 1.02 0.00 0.00 30.24 30.26 1bx6 n GLN 307 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1bx6 n ARG 308 N 0.58 -1.41 -0.08 -1.09 1.74 0.21 -4.90 116.66 111.70 1bx6 n ARG 308 Ca 0.11 1.09 -0.10 0.00 -0.77 0.00 0.00 57.85 58.18 1bx6 n ARG 308 Cb 0.40 -4.22 -0.09 0.00 -1.02 0.00 0.00 32.46 27.53 1bx6 n ARG 308 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1bx6 n LYS 309 N -2.37 1.05 -1.81 5.56 5.02 0.21 -5.00 118.16 120.82 1bx6 n LYS 309 Ca -0.14 0.05 -0.39 0.00 -2.02 0.00 0.00 58.31 55.81 1bx6 n LYS 309 Cb 0.59 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 34.27 1bx6 n LYS 309 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1bx6 s VAL 310 N -2.34 2.10 -0.36 -0.18 1.01 -1.24 -4.96 120.40 114.43 1bx6 s VAL 310 Ca -0.16 0.09 -0.25 0.00 0.00 0.00 0.00 61.98 61.66 1bx6 s VAL 310 Cb 0.05 -3.05 0.01 0.00 0.00 0.00 0.00 36.38 33.39 1bx6 s VAL 310 CO 0.48 0.01 0.87 -0.70 0.00 0.00 0.00 175.10 175.76 1bx6 s GLU 311 N -2.59 3.83 0.53 2.72 -6.30 -1.26 -4.99 118.70 110.65 1bx6 s GLU 311 Ca 0.64 0.51 -0.22 0.00 -2.50 0.00 0.00 54.97 53.40 1bx6 s GLU 311 Cb -0.42 -3.79 -0.05 0.00 0.00 0.00 0.00 34.13 29.86 1bx6 s GLU 311 CO 0.53 -0.88 1.32 0.00 0.02 0.00 0.00 175.26 176.25 1bx6 s ALA 312 N 3.29 2.84 0.13 6.30 0.00 -1.26 -4.92 121.76 128.15 1bx6 s ALA 312 Ca 0.35 1.25 -0.20 0.00 0.00 0.00 0.00 51.96 53.36 1bx6 s ALA 312 Cb -0.13 -3.53 -0.01 0.00 0.00 0.00 0.00 23.12 19.45 1bx6 s ALA 312 CO 0.17 -1.23 1.69 -1.35 0.00 0.00 0.00 175.76 175.05 1bx6 h PRO 313 N 1.56 -0.03 -4.52 0.00 0.11 -1.92 -3.43 132.00 123.77 1bx6 h PRO 313 Ca -0.51 0.00 -0.41 0.00 0.11 0.00 0.00 66.00 65.20 1bx6 h PRO 313 Cb 1.29 0.01 -0.30 0.00 0.11 0.00 0.00 31.00 32.10 1bx6 h PRO 313 CO 0.58 -0.02 -0.78 0.12 -0.21 0.00 0.00 178.00 177.69 1bx6 s PHE 314 N -6.20 0.84 -0.22 0.65 5.36 -1.26 -5.11 117.98 112.03 1bx6 s PHE 314 Ca -0.14 -0.19 0.02 0.00 -0.96 0.00 0.00 56.93 55.66 1bx6 s PHE 314 Cb 0.11 -0.60 0.05 0.00 -0.34 0.00 0.00 43.02 42.24 1bx6 s PHE 314 CO 0.69 -0.08 -0.13 0.42 -1.46 0.00 0.00 175.22 174.66 1bx6 s ILE 315 N 0.14 2.01 0.62 3.12 1.01 -1.26 -4.03 121.20 122.82 1bx6 s ILE 315 Ca -0.02 -1.30 -0.17 0.00 0.00 0.00 0.00 60.65 59.16 1bx6 s ILE 315 Cb -0.07 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1bx6 s ILE 315 CO 0.00 0.17 1.17 -2.16 0.00 0.00 0.00 174.94 174.11 1bx6 s PRO 316 N 1.22 2.85 0.16 2.79 0.05 -1.26 -4.95 135.00 135.86 1bx6 s PRO 316 Ca -0.03 1.66 -0.30 0.00 0.05 0.00 0.00 61.00 62.38 1bx6 s PRO 316 Cb -0.17 -1.93 -0.07 0.00 0.05 0.00 0.00 34.50 32.38 1bx6 s PRO 316 CO -0.08 -1.26 0.97 0.21 0.05 0.00 0.00 177.00 176.89 1bx6 s LYS 317 N -3.62 4.74 -0.10 4.56 2.47 -1.26 -5.01 119.74 121.52 1bx6 s LYS 317 Ca 0.73 1.50 -0.03 0.00 -1.56 0.00 0.00 55.97 56.60 1bx6 s LYS 317 Cb -0.26 -3.34 0.05 0.00 -1.46 0.00 0.00 37.83 32.82 1bx6 s LYS 317 CO 0.36 0.29 0.08 -0.06 0.16 0.00 0.00 175.35 176.18 1bx6 s PHE 318 N -0.39 0.10 0.35 4.03 0.08 -1.26 -4.89 117.98 115.99 1bx6 s PHE 318 Ca 0.45 0.03 0.06 0.00 0.12 0.00 0.00 56.93 57.59 1bx6 s PHE 318 Cb -0.25 -0.56 0.64 0.00 -0.57 0.00 0.00 43.02 42.29 1bx6 s PHE 318 CO 0.31 -0.34 1.87 0.87 -0.10 0.00 0.00 175.22 177.83 1bx6 h LYS 319 N 8.42 0.42 0.00 0.44 1.57 -1.96 -3.49 116.57 121.98 1bx6 h LYS 319 Ca -0.13 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1bx6 h LYS 319 Cb 1.13 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1bx6 h LYS 319 CO 0.21 0.51 0.00 0.41 -0.57 0.00 0.00 179.45 180.01 1bx6 n GLY 320 N -0.82 -2.81 3.49 3.86 0.00 -1.26 -5.00 105.19 102.64 1bx6 n GLY 320 Ca 0.01 -1.31 -0.54 0.00 0.00 0.00 0.00 46.02 44.17 1bx6 n GLY 320 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bx6 n PRO 321 N -0.91 0.90 0.00 1.61 -0.01 -1.26 0.12 135.00 135.45 1bx6 n PRO 321 Ca 0.00 0.28 0.00 0.00 -0.01 0.00 0.00 63.50 63.77 1bx6 n PRO 321 Cb 0.00 -2.18 0.00 0.00 -0.01 0.00 0.00 33.50 31.31 1bx6 n PRO 321 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1bx6 n GLY 322 N 6.05 0.30 3.44 -1.23 0.00 -1.26 -5.05 105.19 107.44 1bx6 n GLY 322 Ca 0.40 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.94 1bx6 n GLY 322 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bx6 n ASP 323 N 0.00 -0.72 0.00 1.61 2.03 0.33 -4.87 116.55 114.93 1bx6 n ASP 323 Ca 0.00 1.14 0.00 0.00 0.52 0.00 0.00 54.79 56.45 1bx6 n ASP 323 Cb 0.00 -1.01 0.00 0.00 -0.72 0.00 0.00 41.12 39.39 1bx6 n ASP 323 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1bx6 n THR 324 N 0.10 0.08 -0.23 5.18 -1.04 -1.26 -4.85 114.28 112.27 1bx6 n THR 324 Ca 0.16 -0.18 0.03 0.00 -2.04 0.00 0.00 64.05 62.03 1bx6 n THR 324 Cb 0.26 1.47 0.13 0.00 -1.82 0.00 0.00 70.33 70.36 1bx6 n THR 324 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1bx6 h SER 325 N 0.00 -0.31 0.00 8.00 4.64 -1.89 -1.94 113.55 122.05 1bx6 h SER 325 Ca 0.00 0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1bx6 h SER 325 Cb 0.52 0.31 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1bx6 h SER 325 CO 0.00 -0.14 0.00 0.59 -0.87 0.00 0.00 176.83 176.41 1bx6 n ASN 326 N -5.31 0.00 -4.45 4.97 3.02 -1.26 -4.64 115.26 107.58 1bx6 n ASN 326 Ca 0.11 -0.16 -0.31 0.00 -0.03 0.00 0.00 54.58 54.19 1bx6 n ASN 326 Cb 0.41 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.45 1bx6 n ASN 326 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1bx6 s PHE 327 N -2.00 2.58 1.05 3.10 0.08 -0.73 -4.36 117.98 117.70 1bx6 s PHE 327 Ca 0.05 -0.24 -0.12 0.00 0.12 0.00 0.00 56.93 56.74 1bx6 s PHE 327 Cb 0.02 -1.52 0.22 0.00 -0.57 0.00 0.00 43.02 41.18 1bx6 s PHE 327 CO 0.04 0.21 1.07 0.34 -0.10 0.00 0.00 175.22 176.78 1bx6 s ASP 328 N -1.16 2.13 -0.20 1.36 2.15 -1.26 -5.01 116.67 114.68 1bx6 s ASP 328 Ca 0.13 1.29 -0.12 0.00 0.43 0.00 0.00 52.55 54.28 1bx6 s ASP 328 Cb -0.10 -1.99 -0.05 0.00 -0.30 0.00 0.00 42.92 40.48 1bx6 s ASP 328 CO 0.03 -3.45 0.23 -1.81 -0.17 0.00 0.00 175.17 170.01 1bx6 s ASP 329 N -3.18 6.29 0.13 -0.34 1.01 -1.26 -4.86 116.67 114.45 1bx6 s ASP 329 Ca 0.66 0.33 0.11 0.00 0.71 0.00 0.00 52.55 54.36 1bx6 s ASP 329 Cb -0.20 -2.15 -0.04 0.00 1.01 0.00 0.00 42.92 41.54 1bx6 s ASP 329 CO 0.60 0.08 -0.26 -0.31 0.21 0.00 0.00 175.17 175.49 1bx6 s TYR 330 N 0.75 2.23 -0.35 4.23 2.02 -1.26 -5.10 117.35 119.86 1bx6 s TYR 330 Ca 0.12 -0.39 -0.29 0.00 -0.37 0.00 0.00 57.07 56.15 1bx6 s TYR 330 Cb -0.13 -1.20 0.00 0.00 -0.40 0.00 0.00 41.96 40.23 1bx6 s TYR 330 CO 0.03 0.33 1.39 -2.00 -1.57 0.00 0.00 175.55 173.73 1bx6 s GLU 331 N -2.07 3.72 0.18 -0.62 2.12 -1.26 -4.82 118.70 115.95 1bx6 s GLU 331 Ca 0.13 1.11 -0.11 0.00 0.36 0.00 0.00 54.97 56.46 1bx6 s GLU 331 Cb -0.10 -3.97 -0.07 0.00 0.26 0.00 0.00 34.13 30.25 1bx6 s GLU 331 CO 0.06 -1.38 0.54 -1.83 -0.54 0.00 0.00 175.26 172.11 1bx6 s GLU 332 N 4.62 3.87 0.05 4.30 -1.05 -1.26 -5.06 118.70 124.18 1bx6 s GLU 332 Ca 0.60 0.35 0.05 0.00 -0.15 0.00 0.00 54.97 55.82 1bx6 s GLU 332 Cb -0.16 -2.79 -0.02 0.00 -0.44 0.00 0.00 34.13 30.72 1bx6 s GLU 332 CO 0.29 0.40 -0.14 -1.21 0.95 0.00 0.00 175.26 175.55 1bx6 s GLU 333 N -2.40 0.91 0.77 -4.83 2.02 -1.26 -5.14 118.70 108.78 1bx6 s GLU 333 Ca 0.42 -0.83 -0.12 0.00 0.02 0.00 0.00 54.97 54.46 1bx6 s GLU 333 Cb -0.13 -0.93 0.06 0.00 0.10 0.00 0.00 34.13 33.23 1bx6 s GLU 333 CO 0.20 0.22 1.14 -1.83 0.02 0.00 0.00 175.26 175.01 1bx6 s GLU 334 N -1.34 2.04 -0.41 1.61 -1.05 -1.26 -4.97 118.70 113.33 1bx6 s GLU 334 Ca 0.01 1.46 -0.25 0.00 -0.15 0.00 0.00 54.97 56.04 1bx6 s GLU 334 Cb -0.09 -1.85 0.02 0.00 -0.44 0.00 0.00 34.13 31.77 1bx6 s GLU 334 CO 0.02 -1.85 0.88 0.42 0.95 0.00 0.00 175.26 175.68 1bx6 s ILE 335 N -2.48 4.58 -0.03 1.83 1.09 -1.26 -5.05 121.20 119.88 1bx6 s ILE 335 Ca 0.67 0.90 -0.21 0.00 -1.10 0.00 0.00 60.65 60.92 1bx6 s ILE 335 Cb -0.22 -4.34 -0.05 0.00 -1.06 0.00 0.00 42.46 36.79 1bx6 s ILE 335 CO 0.51 -0.63 0.60 0.00 -0.10 0.00 0.00 174.94 175.32 1bx6 s ARG 336 N 3.47 4.35 -0.06 2.79 1.70 -1.26 -5.22 118.95 124.72 1bx6 s ARG 336 Ca 0.36 0.73 0.03 0.00 -0.47 0.00 0.00 55.73 56.37 1bx6 s ARG 336 Cb -0.12 -3.38 0.01 0.00 -0.57 0.00 0.00 34.95 30.89 1bx6 s ARG 336 CO 0.21 0.27 -0.14 0.08 -1.08 0.00 0.00 175.30 174.64 1bx6 s VAL 337 N 0.13 1.27 -0.17 4.99 1.01 -1.26 -4.84 120.40 121.53 1bx6 s VAL 337 Ca 0.32 -0.59 0.17 0.00 0.00 0.00 0.00 61.98 61.88 1bx6 s VAL 337 Cb -0.18 -1.13 0.45 0.00 0.00 0.00 0.00 36.38 35.52 1bx6 s VAL 337 CO 0.16 0.38 1.18 2.30 0.00 0.00 0.00 175.10 179.12 1bx6 n ILE 339 N 3.52 1.43 -3.12 2.22 -5.35 -1.26 -4.96 119.36 111.84 1bx6 n ILE 339 Ca -0.21 -2.72 0.05 0.00 -0.27 0.00 0.00 62.75 59.61 1bx6 n ILE 339 Cb 0.52 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.69 1bx6 n ILE 339 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1bx6 s ASN 340 N -3.07 -0.52 0.00 7.28 6.03 -1.26 -5.15 114.94 118.25 1bx6 s ASN 340 Ca 0.37 0.04 -0.01 0.00 -1.03 0.00 0.00 52.86 52.23 1bx6 s ASN 340 Cb 0.37 1.28 -0.00 0.00 -3.03 0.00 0.00 41.25 39.87 1bx6 s ASN 340 CO -0.07 -0.09 0.01 1.21 -2.03 0.00 0.00 177.10 176.13 1bx6 n GLU 341 N 5.03 0.00 -5.07 3.55 2.13 -1.26 -4.93 120.64 120.09 1bx6 n GLU 341 Ca 0.09 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.59 1bx6 n GLU 341 Cb 0.58 -0.02 -0.15 0.00 0.27 0.00 0.00 31.44 32.11 1bx6 n GLU 341 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1bx6 s LYS 342 N -0.01 2.80 -0.74 5.31 -0.14 0.38 -4.72 119.74 122.61 1bx6 s LYS 342 Ca 0.01 -0.81 -0.18 0.00 -1.36 0.00 0.00 55.97 53.64 1bx6 s LYS 342 Cb -0.02 -2.33 0.03 0.00 -1.68 0.00 0.00 37.83 33.82 1bx6 s LYS 342 CO 0.01 0.37 0.34 0.00 -0.76 0.00 0.00 175.35 175.31 1bx6 h GLY 344 N -0.34 0.00 0.37 0.00 0.00 -1.93 -3.30 103.07 97.88 1bx6 h GLY 344 Ca -0.42 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 1bx6 h GLY 344 CO 0.32 0.00 -0.13 1.70 0.00 0.00 0.00 176.54 178.44 1bx6 h LYS 345 N 0.00 -0.34 0.00 4.80 1.63 -2.00 -3.30 116.57 117.37 1bx6 h LYS 345 Ca 0.00 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 1bx6 h LYS 345 Cb 0.79 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.49 1bx6 h LYS 345 CO 0.00 -0.03 0.20 0.39 -3.45 0.00 0.00 179.45 176.56 1bx6 n GLU 346 N -5.01 0.03 -2.56 1.90 4.71 -1.24 -2.09 120.64 116.38 1bx6 n GLU 346 Ca -0.07 0.39 -0.12 0.00 -0.01 0.00 0.00 57.16 57.35 1bx6 n GLU 346 Cb 0.23 -1.79 0.03 0.00 -1.01 0.00 0.00 31.44 28.90 1bx6 n GLU 346 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1bx6 n PHE 347 N -1.53 1.89 0.18 -0.32 3.01 -1.24 -4.82 117.46 114.62 1bx6 n PHE 347 Ca -0.00 -2.46 0.02 0.00 1.01 0.00 0.00 57.45 56.02 1bx6 n PHE 347 Cb 0.21 -0.27 0.33 0.00 -0.01 0.00 0.00 39.48 39.74 1bx6 n PHE 347 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1bx6 h THR 348 N 3.74 1.23 0.01 4.37 2.02 -1.53 -3.27 112.91 119.50 1bx6 h THR 348 Ca 0.05 -1.48 -0.04 0.00 0.77 0.00 0.00 66.41 65.71 1bx6 h THR 348 Cb 1.26 1.81 -0.00 0.00 -1.74 0.00 0.00 68.15 69.48 1bx6 h THR 348 CO 0.49 0.41 -0.21 -0.33 0.37 0.00 0.00 175.52 176.25 1bx6 h GLU 349 N 0.00 0.03 0.00 6.66 5.08 -1.88 -3.52 114.58 120.95 1bx6 h GLU 349 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1bx6 h GLU 349 Cb 0.78 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1bx6 h GLU 349 CO 0.05 1.02 0.00 0.34 -1.00 0.00 0.00 179.01 179.43