#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rq6 n GLY 2 N 0.00 1.74 0.26 3.03 0.00 -1.26 -4.89 105.19 104.07 1rq6 n GLY 2 Ca 0.00 -0.98 0.10 0.00 0.00 0.00 0.00 46.02 45.14 1rq6 n GLY 2 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1rq6 h ASN 3 N 1.27 0.00 1.37 1.61 -1.07 -2.11 -0.73 115.58 115.91 1rq6 h ASN 3 Ca -0.17 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 56.15 1rq6 h ASN 3 Cb 1.69 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.93 1rq6 h ASN 3 CO 0.12 0.09 -0.65 -0.29 0.07 0.00 0.00 177.43 176.76 1rq6 h ILE 4 N 0.00 0.21 -2.91 6.14 6.09 -2.09 -3.42 117.51 121.54 1rq6 h ILE 4 Ca -0.00 -1.34 -0.71 0.00 -1.37 0.00 0.00 64.86 61.44 1rq6 h ILE 4 Cb 0.18 1.89 -0.20 0.00 0.47 0.00 0.00 36.82 39.16 1rq6 h ILE 4 CO 0.01 0.12 0.32 -0.13 -3.07 0.00 0.00 178.15 175.40 1rq6 s ARG 5 N -3.19 3.27 0.00 2.19 0.52 -0.28 -4.30 118.95 117.17 1rq6 s ARG 5 Ca 0.02 -1.57 0.00 0.00 -0.52 0.00 0.00 55.73 53.67 1rq6 s ARG 5 Cb 0.08 -4.44 0.00 0.00 0.52 0.00 0.00 34.95 31.10 1rq6 s ARG 5 CO 0.75 -1.58 0.00 -2.37 0.02 0.00 0.00 175.30 172.11 1rq6 n THR 6 N 5.31 0.00 1.62 0.02 5.66 -1.26 -4.92 114.28 120.70 1rq6 n THR 6 Ca 0.03 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.08 1rq6 n THR 6 Cb 0.45 0.00 0.30 0.00 -1.55 0.00 0.00 70.33 69.53 1rq6 n THR 6 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1rq6 n SER 7 N 0.00 0.00 -0.18 1.09 7.64 -1.26 -3.92 113.62 116.99 1rq6 n SER 7 Ca 0.00 -1.30 -0.08 0.00 1.01 0.00 0.00 58.87 58.50 1rq6 n SER 7 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 1rq6 n SER 7 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1rq6 h PHE 8 N 0.00 0.79 -0.17 1.43 -1.00 -1.93 0.38 116.94 116.44 1rq6 h PHE 8 Ca 0.00 -0.07 0.01 0.00 2.81 0.00 0.00 57.97 60.72 1rq6 h PHE 8 Cb 0.00 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.32 1rq6 h PHE 8 CO 0.00 0.67 0.10 0.28 -1.61 0.00 0.00 178.31 177.75 1rq6 h VAL 9 N 0.68 1.01 -0.06 -0.55 2.07 -2.01 -1.27 116.25 116.13 1rq6 h VAL 9 Ca 0.16 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.57 1rq6 h VAL 9 Cb 0.24 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1rq6 h VAL 9 CO -0.01 0.04 -0.17 0.50 0.02 0.00 0.00 177.57 177.95 1rq6 h LYS 10 N 0.20 0.09 0.26 1.57 3.64 -1.73 -2.19 116.57 118.41 1rq6 h LYS 10 Ca 0.07 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1rq6 h LYS 10 Cb -0.00 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1rq6 h LYS 10 CO -0.04 0.27 -0.12 -0.09 -2.27 0.00 0.00 179.45 177.20 1rq6 h ARG 11 N 0.09 -0.33 -0.62 1.90 9.65 0.36 -0.74 114.38 124.69 1rq6 h ARG 11 Ca 0.02 0.02 0.04 0.00 -1.10 0.00 0.00 59.98 58.96 1rq6 h ARG 11 Cb 0.36 0.08 -0.05 0.00 -1.39 0.00 0.00 29.97 28.97 1rq6 h ARG 11 CO 0.02 -0.11 0.35 0.82 2.80 0.00 0.00 179.97 183.86 1rq6 h ILE 12 N -0.50 1.01 -0.06 1.20 2.04 -0.96 0.19 117.51 120.43 1rq6 h ILE 12 Ca -0.04 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1rq6 h ILE 12 Cb 0.38 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1rq6 h ILE 12 CO 0.06 0.12 0.01 0.00 0.00 0.00 0.00 178.15 178.34 1rq6 h ALA 13 N 1.30 0.08 -0.39 1.87 0.00 -1.38 -1.00 119.26 119.74 1rq6 h ALA 13 Ca 0.26 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1rq6 h ALA 13 Cb 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1rq6 h ALA 13 CO -0.15 -0.29 0.06 -0.22 0.00 0.00 0.00 179.25 178.65 1rq6 h LYS 14 N -0.13 0.65 -0.78 0.00 3.64 -0.82 -2.69 116.57 116.45 1rq6 h LYS 14 Ca 0.02 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.19 1rq6 h LYS 14 Cb 0.25 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 1rq6 h LYS 14 CO 0.00 0.70 0.36 1.49 -2.27 0.00 0.00 179.45 179.74 1rq6 h GLU 15 N 0.50 1.12 -0.38 1.90 4.81 -0.61 0.41 114.58 122.32 1rq6 h GLU 15 Ca 0.12 -0.16 0.05 0.00 -0.13 0.00 0.00 59.36 59.24 1rq6 h GLU 15 Cb 0.37 -0.20 -0.05 0.00 0.63 0.00 0.00 28.75 29.50 1rq6 h GLU 15 CO 0.01 0.87 0.10 1.98 -0.73 0.00 0.00 179.01 181.24 1rq6 h MET 16 N 1.11 0.23 0.03 1.92 4.05 -0.94 -2.29 114.93 119.04 1rq6 h MET 16 Ca 0.27 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.67 1rq6 h MET 16 Cb 0.13 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 30.87 1rq6 h MET 16 CO -0.03 0.15 -0.01 0.82 0.23 0.00 0.00 176.91 178.07 1rq6 h ILE 17 N 0.24 1.35 0.00 1.77 2.04 -1.15 -3.37 117.51 118.39 1rq6 h ILE 17 Ca 0.18 -1.76 -0.01 0.00 1.00 0.00 0.00 64.86 64.26 1rq6 h ILE 17 Cb 0.19 2.44 -0.00 0.00 -0.74 0.00 0.00 36.82 38.71 1rq6 h ILE 17 CO -0.21 0.42 -0.05 -0.08 0.00 0.00 0.00 178.15 178.22 1rq6 h GLU 18 N -0.88 0.00 0.00 2.37 4.81 -0.15 0.59 114.58 121.31 1rq6 h GLU 18 Ca -0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1rq6 h GLU 18 Cb 0.71 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.09 1rq6 h GLU 18 CO 0.01 0.05 -0.02 1.79 -0.73 0.00 0.00 179.01 180.11 1rq6 h THR 19 N 0.00 0.31 -2.29 0.32 1.35 -1.58 -3.31 112.91 107.72 1rq6 h THR 19 Ca -0.00 -0.11 -0.48 0.00 -0.55 0.00 0.00 66.41 65.27 1rq6 h THR 19 Cb 0.14 1.08 -0.35 0.00 -1.73 0.00 0.00 68.15 67.28 1rq6 h THR 19 CO 0.01 0.02 -0.78 -1.38 -0.25 0.00 0.00 175.52 173.14 1rq6 s HIS 20 N -4.33 0.25 0.90 4.73 -3.43 0.20 -5.15 115.29 108.45 1rq6 s HIS 20 Ca -0.04 -1.26 -0.11 0.00 -0.80 0.00 0.00 55.06 52.85 1rq6 s HIS 20 Cb 0.14 -0.68 0.13 0.00 -1.43 0.00 0.00 32.58 30.74 1rq6 s HIS 20 CO 0.50 -0.89 1.09 -1.25 -2.00 0.00 0.00 174.74 172.19 1rq6 s PRO 21 N 1.24 1.25 0.00 -0.38 0.04 -1.23 -4.57 135.00 131.33 1rq6 s PRO 21 Ca 0.18 1.03 0.00 0.00 0.04 0.00 0.00 61.00 62.24 1rq6 s PRO 21 Cb -0.19 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1rq6 s PRO 21 CO -0.01 -2.31 0.00 0.41 0.04 0.00 0.00 177.00 175.13 1rq6 n GLY 22 N -0.74 2.88 7.00 0.56 0.00 -1.26 -5.09 105.19 108.54 1rq6 n GLY 22 Ca 0.08 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1rq6 n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rq6 n LYS 23 N 0.00 0.00 0.00 1.61 5.02 -1.26 -4.98 118.16 118.55 1rq6 n LYS 23 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1rq6 n LYS 23 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1rq6 n LYS 23 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1rq6 n PHE 24 N 0.00 -1.71 -3.65 2.13 7.35 -1.26 -5.15 117.46 115.17 1rq6 n PHE 24 Ca 0.00 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.59 1rq6 n PHE 24 Cb 0.00 0.36 -0.04 0.00 0.35 0.00 0.00 39.48 40.15 1rq6 n PHE 24 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1rq6 s THR 25 N -0.73 0.06 -1.30 -2.13 2.01 -1.26 -5.06 115.64 107.23 1rq6 s THR 25 Ca 0.00 -0.60 -0.16 0.00 0.31 0.00 0.00 61.69 61.24 1rq6 s THR 25 Cb 0.00 -1.23 0.00 0.00 0.01 0.00 0.00 72.50 71.28 1rq6 s THR 25 CO 0.00 -0.28 2.10 -0.90 -0.69 0.00 0.00 174.62 174.86 1rq6 n ASP 26 N -0.25 3.73 -4.12 3.53 5.75 -1.26 -4.59 116.55 119.34 1rq6 n ASP 26 Ca -0.15 -2.82 -0.10 0.00 -0.01 0.00 0.00 54.79 51.71 1rq6 n ASP 26 Cb 0.64 -1.57 -0.10 0.00 -1.03 0.00 0.00 41.12 39.05 1rq6 n ASP 26 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1rq6 s ASP 27 N 3.77 0.87 0.50 -1.12 2.15 -1.26 -5.04 116.67 116.53 1rq6 s ASP 27 Ca 0.50 -0.88 0.19 0.00 0.43 0.00 0.00 52.55 52.80 1rq6 s ASP 27 Cb 0.12 0.11 1.27 0.00 -0.30 0.00 0.00 42.92 44.12 1rq6 s ASP 27 CO -0.02 -0.43 2.09 -0.26 -0.17 0.00 0.00 175.17 176.37 1rq6 h PHE 28 N 3.43 0.00 -0.47 -5.34 0.04 -1.99 -1.44 116.94 111.18 1rq6 h PHE 28 Ca -0.35 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.42 1rq6 h PHE 28 Cb 1.17 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.30 1rq6 h PHE 28 CO 0.59 0.09 0.29 0.22 -0.60 0.00 0.00 178.31 178.91 1rq6 h ASP 29 N 0.00 0.55 0.11 2.17 3.58 -1.96 -1.63 116.42 119.24 1rq6 h ASP 29 Ca -0.00 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.40 1rq6 h ASP 29 Cb 0.18 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.10 1rq6 h ASP 29 CO 0.01 0.43 -0.05 0.74 -2.88 0.00 0.00 179.24 177.49 1rq6 h THR 30 N 0.62 1.04 0.00 2.25 2.02 -1.52 -2.70 112.91 114.63 1rq6 h THR 30 Ca 0.17 -0.63 -0.05 0.00 0.77 0.00 0.00 66.41 66.66 1rq6 h THR 30 Cb -0.03 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1rq6 h THR 30 CO -0.03 0.15 -0.24 -0.55 0.37 0.00 0.00 175.52 175.22 1rq6 h ASN 31 N -0.45 0.00 -0.07 4.18 -1.07 -1.50 -2.04 115.58 114.62 1rq6 h ASN 31 Ca -0.02 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 56.35 1rq6 h ASN 31 Cb 0.37 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.61 1rq6 h ASN 31 CO 0.03 0.24 0.05 0.50 0.07 0.00 0.00 177.43 178.31 1rq6 h LYS 32 N 0.00 0.10 -0.38 4.14 3.64 -1.17 -1.20 116.57 121.70 1rq6 h LYS 32 Ca -0.00 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 1rq6 h LYS 32 Cb 0.45 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 1rq6 h LYS 32 CO 0.03 0.11 0.04 0.87 -2.27 0.00 0.00 179.45 178.23 1rq6 h LYS 33 N 0.07 0.58 -0.27 1.90 1.57 -1.10 -1.39 116.57 117.92 1rq6 h LYS 33 Ca 0.03 -0.11 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 1rq6 h LYS 33 Cb 0.03 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1rq6 h LYS 33 CO -0.01 0.57 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.26 1rq6 h LEU 34 N 0.56 0.58 0.05 2.94 3.38 -1.03 -3.04 115.31 118.75 1rq6 h LEU 34 Ca 0.12 -0.40 -0.18 0.00 0.09 0.00 0.00 57.88 57.51 1rq6 h LEU 34 Cb 0.30 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 40.90 1rq6 h LEU 34 CO 0.01 0.85 -0.74 0.58 0.09 0.00 0.00 178.44 179.23 1rq6 h VAL 35 N 0.31 1.43 -0.01 1.22 2.07 -1.05 -3.18 116.25 117.03 1rq6 h VAL 35 Ca 0.06 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.34 1rq6 h VAL 35 Cb 0.63 2.76 -0.00 0.00 -1.52 0.00 0.00 31.29 33.15 1rq6 h VAL 35 CO 0.04 0.65 0.03 -0.33 0.02 0.00 0.00 177.57 177.98 1rq6 h GLU 36 N -0.12 0.00 -0.65 1.57 3.07 -1.35 -1.78 114.58 115.33 1rq6 h GLU 36 Ca -0.11 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.67 1rq6 h GLU 36 Cb 1.47 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.36 1rq6 h GLU 36 CO 0.14 0.00 0.06 1.49 -1.40 0.00 0.00 179.01 179.30 1rq6 h GLU 37 N 0.00 1.10 0.00 2.33 4.57 -1.51 -3.41 114.58 117.66 1rq6 h GLU 37 Ca 0.00 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1rq6 h GLU 37 Cb 0.06 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.53 1rq6 h GLU 37 CO -0.00 1.03 -0.60 1.19 -1.18 0.00 0.00 179.01 179.45 1rq6 n PHE 38 N -4.19 -0.14 -1.44 0.92 3.01 -1.06 -5.01 117.46 109.55 1rq6 n PHE 38 Ca 0.04 0.02 -0.52 0.00 1.01 0.00 0.00 57.45 58.00 1rq6 n PHE 38 Cb 0.32 0.12 -0.08 0.00 -0.01 0.00 0.00 39.48 39.84 1rq6 n PHE 38 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1rq6 n SER 39 N -3.01 2.00 -0.03 4.37 2.88 -0.69 -4.76 113.62 114.37 1rq6 n SER 39 Ca 0.00 0.51 0.01 0.00 -1.33 0.00 0.00 58.87 58.06 1rq6 n SER 39 Cb 0.30 -1.21 0.02 0.00 -0.75 0.00 0.00 64.21 62.57 1rq6 n SER 39 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1rq6 n THR 40 N 6.88 0.91 -0.72 2.46 5.66 -1.26 -4.71 114.28 123.50 1rq6 n THR 40 Ca 0.42 -0.96 0.00 0.00 -3.05 0.00 0.00 64.05 60.46 1rq6 n THR 40 Cb 0.19 0.49 0.00 0.00 -1.55 0.00 0.00 70.33 69.46 1rq6 n THR 40 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 1rq6 n VAL 41 N -0.52 0.00 -1.41 1.08 3.14 -1.26 -4.87 118.33 114.49 1rq6 n VAL 41 Ca 0.02 0.00 -0.51 0.00 -2.96 0.00 0.00 64.34 60.89 1rq6 n VAL 41 Cb 0.36 -1.80 -0.09 0.00 -1.06 0.00 0.00 33.84 31.25 1rq6 n VAL 41 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1rq6 n SER 42 N -0.97 1.60 0.03 6.55 7.64 -1.26 -4.82 113.62 122.40 1rq6 n SER 42 Ca 0.00 0.39 -0.22 0.00 1.01 0.00 0.00 58.87 60.05 1rq6 n SER 42 Cb 0.00 -1.16 -0.14 0.00 -1.01 0.00 0.00 64.21 61.90 1rq6 n SER 42 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1rq6 h THR 43 N 7.21 0.78 0.00 0.44 2.02 -1.97 -3.25 112.91 118.15 1rq6 h THR 43 Ca -0.20 -2.41 0.00 0.00 0.77 0.00 0.00 66.41 64.57 1rq6 h THR 43 Cb 1.34 2.62 0.00 0.00 -1.74 0.00 0.00 68.15 70.37 1rq6 h THR 43 CO 1.09 0.86 0.00 0.29 0.37 0.00 0.00 175.52 178.13 1rq6 n LYS 44 N -3.58 0.00 0.00 6.66 4.76 -1.26 -2.80 118.16 121.95 1rq6 n LYS 44 Ca -0.29 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.23 1rq6 n LYS 44 Cb 1.04 -0.18 0.00 0.00 -1.84 0.00 0.00 35.03 34.06 1rq6 n LYS 44 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1rq6 n HIS 45 N -0.41 0.00 -0.06 2.13 8.25 -1.26 -4.63 115.22 119.23 1rq6 n HIS 45 Ca 0.00 -0.09 -0.15 0.00 -0.26 0.00 0.00 57.72 57.22 1rq6 n HIS 45 Cb 0.00 -0.01 -0.06 0.00 1.12 0.00 0.00 29.99 31.04 1rq6 n HIS 45 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1rq6 h LEU 46 N 0.00 0.74 -0.82 2.41 5.85 -1.74 -2.54 115.31 119.21 1rq6 h LEU 46 Ca 0.00 -0.56 -0.09 0.00 0.84 0.00 0.00 57.88 58.07 1rq6 h LEU 46 Cb 0.40 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1rq6 h LEU 46 CO 0.00 1.17 -0.13 -0.09 -0.34 0.00 0.00 178.44 179.04 1rq6 h ARG 47 N 0.35 0.75 -0.97 1.25 2.43 -1.55 -2.78 114.38 113.86 1rq6 h ARG 47 Ca 0.00 -0.25 -0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1rq6 h ARG 47 Cb 1.05 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.50 1rq6 h ARG 47 CO 0.10 0.85 0.60 -0.91 -1.51 0.00 0.00 179.97 179.10 1rq6 h ASN 48 N 0.67 1.15 -0.24 -3.80 4.21 -1.69 0.18 115.58 116.06 1rq6 h ASN 48 Ca 0.11 -0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.56 1rq6 h ASN 48 Cb 0.61 -0.29 -0.01 0.00 -1.12 0.00 0.00 38.32 37.51 1rq6 h ASN 48 CO 0.04 0.87 0.12 0.50 -1.29 0.00 0.00 177.43 177.67 1rq6 h LYS 49 N 1.33 0.34 -0.75 0.81 1.63 -1.27 -1.81 116.57 116.85 1rq6 h LYS 49 Ca 0.35 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 60.09 1rq6 h LYS 49 Cb -0.09 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 31.44 1rq6 h LYS 49 CO -0.07 0.34 0.41 0.82 -3.45 0.00 0.00 179.45 177.50 1rq6 h ILE 50 N 0.26 1.23 -0.74 2.00 2.04 -1.14 -2.44 117.51 118.72 1rq6 h ILE 50 Ca 0.08 -0.58 0.02 0.00 1.00 0.00 0.00 64.86 65.39 1rq6 h ILE 50 Cb 0.11 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.38 1rq6 h ILE 50 CO -0.01 0.25 0.49 0.00 0.00 0.00 0.00 178.15 178.88 1rq6 h ALA 51 N 1.21 1.52 -0.46 1.87 0.00 -0.37 -0.56 119.26 122.48 1rq6 h ALA 51 Ca 0.27 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 1rq6 h ALA 51 Cb 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1rq6 h ALA 51 CO -0.04 0.42 -0.05 0.78 0.00 0.00 0.00 179.25 180.36 1rq6 h GLY 52 N 0.95 0.84 1.97 0.00 0.00 -0.86 -2.23 103.07 103.74 1rq6 h GLY 52 Ca 0.29 -0.59 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 1rq6 h GLY 52 CO -0.07 0.55 -0.42 -1.82 0.00 0.00 0.00 176.54 174.77 1rq6 h TYR 53 N 0.72 0.04 0.03 5.60 3.20 -0.90 -2.71 116.97 122.95 1rq6 h TYR 53 Ca 0.13 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 1rq6 h TYR 53 Cb 0.51 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.77 1rq6 h TYR 53 CO 0.03 0.45 -0.01 0.82 -1.64 0.00 0.00 178.16 177.80 1rq6 h ILE 54 N 0.03 0.98 -0.32 1.81 1.08 -0.57 -0.59 117.51 119.94 1rq6 h ILE 54 Ca -0.00 -0.03 0.01 0.00 -0.39 0.00 0.00 64.86 64.44 1rq6 h ILE 54 Cb 0.76 1.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.50 1rq6 h ILE 54 CO 0.06 0.01 0.21 0.74 -0.69 0.00 0.00 178.15 178.48 1rq6 h THR 55 N -0.06 1.07 -0.10 -0.27 2.02 -1.28 0.04 112.91 114.33 1rq6 h THR 55 Ca -0.00 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1rq6 h THR 55 Cb 0.05 0.62 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1rq6 h THR 55 CO 0.01 0.07 0.02 0.03 0.37 0.00 0.00 175.52 176.03 1rq6 h ARG 56 N 0.41 0.15 0.00 6.66 3.08 -1.12 -2.18 114.38 121.38 1rq6 h ARG 56 Ca 0.12 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.07 1rq6 h ARG 56 Cb -0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1rq6 h ARG 56 CO -0.03 0.33 -0.31 0.97 -1.07 0.00 0.00 179.97 179.86 1rq6 h ILE 57 N -0.05 0.91 -0.15 2.04 2.10 -0.27 -1.45 117.51 120.64 1rq6 h ILE 57 Ca 0.03 -1.20 -0.02 0.00 1.08 0.00 0.00 64.86 64.75 1rq6 h ILE 57 Cb 0.24 1.71 -0.01 0.00 -1.09 0.00 0.00 36.82 37.68 1rq6 h ILE 57 CO 0.00 0.30 0.03 0.40 -1.08 0.00 0.00 178.15 177.80 1rq6 h ILE 58 N 0.00 1.22 0.00 2.19 2.04 -0.92 -2.30 117.51 119.74 1rq6 h ILE 58 Ca -0.00 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1rq6 h ILE 58 Cb 0.69 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 1rq6 h ILE 58 CO 0.04 0.21 0.00 0.77 0.00 0.00 0.00 178.15 179.17 1rq6 h SER 59 N 0.04 0.00 0.49 1.72 4.64 -0.89 -1.07 113.55 118.48 1rq6 h SER 59 Ca 0.05 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.16 1rq6 h SER 59 Cb 0.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 1rq6 h SER 59 CO 0.00 0.00 -0.90 -0.61 -0.87 0.00 0.00 176.83 174.45 1rq6 h GLN 60 N 0.00 0.28 0.01 4.77 4.15 -0.75 -3.29 115.11 120.28 1rq6 h GLN 60 Ca 0.00 -0.30 -0.12 0.00 0.77 0.00 0.00 58.65 59.00 1rq6 h GLN 60 Cb 0.26 0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.05 1rq6 h GLN 60 CO 0.00 1.01 -0.49 0.37 -1.93 0.00 0.00 178.83 177.79 1rq6 h GLN 61 N 0.15 0.31 -0.01 1.69 4.15 -0.79 -3.51 115.11 117.11 1rq6 h GLN 61 Ca -0.06 -0.35 0.00 0.00 0.77 0.00 0.00 58.65 59.01 1rq6 h GLN 61 Cb 1.53 0.10 0.00 0.00 0.21 0.00 0.00 27.48 29.33 1rq6 h GLN 61 CO 0.14 1.05 0.00 1.17 -1.93 0.00 0.00 178.83 179.27