#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 -0.17 0.00 3.03 0.00 -1.26 -4.97 105.19 101.83 1rq6 n GLY 2 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1rq6 n GLY 2 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rq6 n ASN 3 N -0.19 0.00 -4.67 1.61 6.94 -1.26 -4.92 115.26 112.77 1rq6 n ASN 3 Ca 0.04 0.00 -0.49 0.00 -0.02 0.00 0.00 54.58 54.11 1rq6 n ASN 3 Cb 0.22 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.59 1rq6 n ASN 3 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1rq6 n ILE 4 N -0.10 0.23 -3.84 1.53 -5.35 -1.26 -4.96 119.36 105.61 1rq6 n ILE 4 Ca 0.00 -0.04 -0.11 0.00 -0.27 0.00 0.00 62.75 62.33 1rq6 n ILE 4 Cb 0.00 -1.52 -0.09 0.00 -1.74 0.00 0.00 39.64 36.30 1rq6 n ILE 4 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1rq6 s ARG 5 N 2.23 0.63 -1.19 6.28 3.52 -1.26 -4.77 118.95 124.38 1rq6 s ARG 5 Ca 0.87 -0.48 0.00 0.00 -0.13 0.00 0.00 55.73 55.98 1rq6 s ARG 5 Cb -0.77 0.27 0.00 0.00 -1.56 0.00 0.00 34.95 32.89 1rq6 s ARG 5 CO 0.47 -0.17 0.00 2.41 -0.81 0.00 0.00 175.30 177.20 1rq6 n THR 6 N 1.01 -0.58 0.25 4.11 -1.04 -1.26 -4.87 114.28 111.90 1rq6 n THR 6 Ca -0.20 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 61.84 1rq6 n THR 6 Cb 0.57 -2.05 0.14 0.00 -1.82 0.00 0.00 70.33 67.18 1rq6 n THR 6 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1rq6 n SER 7 N -0.55 0.00 -0.22 8.00 7.64 -1.26 -2.21 113.62 125.02 1rq6 n SER 7 Ca -0.16 0.38 0.05 0.00 1.01 0.00 0.00 58.87 60.15 1rq6 n SER 7 Cb 0.60 -0.42 0.30 0.00 -1.01 0.00 0.00 64.21 63.69 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 0.88 -0.58 1.43 0.04 -2.01 -1.72 116.94 114.99 1rq6 h PHE 8 Ca 0.00 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.73 1rq6 h PHE 8 Cb 0.09 -0.29 -0.03 0.00 2.20 0.00 0.00 35.95 37.92 1rq6 h PHE 8 CO 0.00 0.48 0.11 0.28 -0.60 0.00 0.00 178.31 178.58 1rq6 h VAL 9 N 0.89 1.24 -0.32 -0.55 2.07 -1.85 -1.71 116.25 116.01 1rq6 h VAL 9 Ca 0.33 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1rq6 h VAL 9 Cb 0.17 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1rq6 h VAL 9 CO -0.11 0.34 0.21 0.50 0.02 0.00 0.00 177.57 178.54 1rq6 h LYS 10 N 0.87 0.43 -0.58 1.57 3.64 -1.51 0.13 116.57 121.12 1rq6 h LYS 10 Ca 0.18 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.48 1rq6 h LYS 10 Cb 0.36 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 1rq6 h LYS 10 CO 0.01 0.28 0.14 -0.09 -2.27 0.00 0.00 179.45 177.52 1rq6 h ARG 11 N 0.44 0.94 -0.47 1.90 2.43 -1.23 0.01 114.38 118.39 1rq6 h ARG 11 Ca 0.12 -0.23 -0.03 0.00 -0.81 0.00 0.00 59.98 59.03 1rq6 h ARG 11 Cb -0.05 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1rq6 h ARG 11 CO -0.03 0.87 0.18 0.82 -1.51 0.00 0.00 179.97 180.30 1rq6 h ILE 12 N 0.84 1.21 -0.42 1.20 2.04 -0.99 -1.32 117.51 120.08 1rq6 h ILE 12 Ca 0.18 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.34 1rq6 h ILE 12 Cb 0.35 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1rq6 h ILE 12 CO 0.00 0.24 0.09 0.00 0.00 0.00 0.00 178.15 178.48 1rq6 h ALA 13 N 1.03 0.55 -0.08 1.87 0.00 -0.55 -0.23 119.26 121.84 1rq6 h ALA 13 Ca 0.15 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1rq6 h ALA 13 Cb 0.21 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1rq6 h ALA 13 CO -0.01 0.25 -0.01 -0.22 0.00 0.00 0.00 179.25 179.26 1rq6 h LYS 14 N 0.54 0.02 0.00 0.00 3.64 -0.83 0.10 116.57 120.04 1rq6 h LYS 14 Ca 0.13 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 1rq6 h LYS 14 Cb 0.34 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1rq6 h LYS 14 CO 0.00 0.01 -0.28 1.49 -2.27 0.00 0.00 179.45 178.41 1rq6 h GLU 15 N 0.02 0.00 -0.34 1.90 4.81 -1.18 -2.13 114.58 117.66 1rq6 h GLU 15 Ca 0.04 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.10 1rq6 h GLU 15 Cb 0.05 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 1rq6 h GLU 15 CO -0.07 0.28 -0.45 1.98 -0.73 0.00 0.00 179.01 180.01 1rq6 h MET 16 N 0.00 0.90 -0.05 1.92 4.05 -0.31 -3.33 114.93 118.11 1rq6 h MET 16 Ca -0.00 -0.51 -0.20 0.00 -0.28 0.00 0.00 59.70 58.71 1rq6 h MET 16 Cb 0.62 0.04 0.01 0.00 -0.80 0.00 0.00 31.60 31.47 1rq6 h MET 16 CO 0.04 1.16 -0.74 0.82 0.23 0.00 0.00 176.91 178.41 1rq6 h ILE 17 N 0.72 1.34 0.00 1.77 2.04 -0.50 -3.31 117.51 119.56 1rq6 h ILE 17 Ca 0.04 -2.05 0.00 0.00 1.00 0.00 0.00 64.86 63.85 1rq6 h ILE 17 Cb 1.05 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 1rq6 h ILE 17 CO 0.11 0.62 0.00 -1.84 0.00 0.00 0.00 178.15 177.04 1rq6 n GLU 18 N -4.07 0.00 0.10 2.37 0.28 -0.85 -1.88 120.64 116.60 1rq6 n GLU 18 Ca -0.10 0.37 -0.02 0.00 -0.16 0.00 0.00 57.16 57.25 1rq6 n GLU 18 Cb 0.73 -1.51 -0.05 0.00 1.43 0.00 0.00 31.44 32.05 1rq6 n GLU 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1rq6 h THR 19 N 0.00 1.28 -3.16 3.84 1.03 -1.71 -3.41 112.91 110.78 1rq6 h THR 19 Ca 0.00 -2.82 -0.60 0.00 -0.01 0.00 0.00 66.41 62.99 1rq6 h THR 19 Cb 0.13 2.63 -0.40 0.00 -1.07 0.00 0.00 68.15 69.44 1rq6 h THR 19 CO 0.00 0.73 -0.75 -1.00 -0.01 0.00 0.00 175.52 174.49 1rq6 s HIS 20 N -2.83 1.95 -0.38 0.00 3.76 -0.79 -4.99 115.29 112.01 1rq6 s HIS 20 Ca 0.02 -2.01 -0.01 0.00 -0.15 0.00 0.00 55.06 52.91 1rq6 s HIS 20 Cb 0.09 -1.86 0.26 0.00 1.11 0.00 0.00 32.58 32.17 1rq6 s HIS 20 CO 0.78 -0.86 2.03 -0.35 -0.85 0.00 0.00 174.74 175.49 1rq6 n PRO 21 N 4.49 1.97 -0.02 8.40 -0.04 -1.26 -4.63 135.00 143.91 1rq6 n PRO 21 Ca 0.01 -1.88 -0.07 0.00 -0.04 0.00 0.00 63.50 61.53 1rq6 n PRO 21 Cb 0.40 -1.74 -0.06 0.00 -0.04 0.00 0.00 33.50 32.07 1rq6 n PRO 21 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1rq6 h GLY 22 N 2.44 -0.09 -2.90 0.55 0.00 -1.94 -3.47 103.07 97.66 1rq6 h GLY 22 Ca 0.35 0.03 -0.63 0.00 0.00 0.00 0.00 47.33 47.08 1rq6 h GLY 22 CO 0.91 -0.03 -0.77 0.54 0.00 0.00 0.00 176.54 177.19 1rq6 s LYS 23 N -2.26 1.74 -0.39 4.80 1.02 -1.26 -5.10 119.74 118.28 1rq6 s LYS 23 Ca -0.09 -1.54 0.03 0.00 0.02 0.00 0.00 55.97 54.40 1rq6 s LYS 23 Cb -0.01 -1.91 0.16 0.00 -0.52 0.00 0.00 37.83 35.55 1rq6 s LYS 23 CO 0.31 0.38 0.38 0.12 -0.92 0.00 0.00 175.35 175.62 1rq6 s PHE 24 N -1.98 0.01 0.17 3.18 5.36 -1.26 -4.99 117.98 118.48 1rq6 s PHE 24 Ca 0.25 -1.24 -0.18 0.00 -0.96 0.00 0.00 56.93 54.80 1rq6 s PHE 24 Cb -0.07 -0.51 0.04 0.00 -0.34 0.00 0.00 43.02 42.13 1rq6 s PHE 24 CO 0.13 -0.95 0.51 0.99 -1.46 0.00 0.00 175.22 174.44 1rq6 s THR 25 N 1.02 0.03 0.00 0.12 2.01 -1.26 -5.01 115.64 112.55 1rq6 s THR 25 Ca 0.22 -0.62 0.00 0.00 0.31 0.00 0.00 61.69 61.60 1rq6 s THR 25 Cb -0.11 -1.40 0.00 0.00 0.01 0.00 0.00 72.50 71.00 1rq6 s THR 25 CO -0.06 -0.15 0.89 -0.90 -0.69 0.00 0.00 174.62 173.71 1rq6 n ASP 26 N -0.32 2.64 -4.89 3.53 5.68 -1.26 -4.83 116.55 117.09 1rq6 n ASP 26 Ca -0.12 -1.71 -0.34 0.00 -0.50 0.00 0.00 54.79 52.12 1rq6 n ASP 26 Cb 0.63 -0.45 -0.05 0.00 -1.14 0.00 0.00 41.12 40.11 1rq6 n ASP 26 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1rq6 s ASP 27 N 1.07 6.43 0.37 -1.12 2.15 -1.26 -5.01 116.67 119.29 1rq6 s ASP 27 Ca 0.00 0.46 0.19 0.00 0.43 0.00 0.00 52.55 53.63 1rq6 s ASP 27 Cb 0.00 -2.05 0.55 0.00 -0.30 0.00 0.00 42.92 41.12 1rq6 s ASP 27 CO 0.00 0.28 1.66 -0.26 -0.17 0.00 0.00 175.17 176.68 1rq6 h PHE 28 N 4.05 0.00 -0.25 -5.34 0.04 -2.00 -2.57 116.94 110.87 1rq6 h PHE 28 Ca -0.50 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.19 1rq6 h PHE 28 Cb 1.20 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.33 1rq6 h PHE 28 CO 0.69 0.36 -0.17 0.22 -0.60 0.00 0.00 178.31 178.80 1rq6 h ASP 29 N 0.00 0.42 0.45 2.17 3.58 -1.96 -2.43 116.42 118.65 1rq6 h ASP 29 Ca -0.00 -0.12 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 1rq6 h ASP 29 Cb 1.01 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.92 1rq6 h ASP 29 CO 0.05 0.62 -0.50 0.74 -2.88 0.00 0.00 179.24 177.26 1rq6 h THR 30 N 0.40 0.02 0.00 2.25 2.02 -1.79 -0.62 112.91 115.19 1rq6 h THR 30 Ca 0.07 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 1rq6 h THR 30 Cb 0.54 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1rq6 h THR 30 CO 0.03 0.00 -0.21 -0.55 0.37 0.00 0.00 175.52 175.17 1rq6 h ASN 31 N -0.97 0.00 -0.51 4.18 -1.07 -1.59 -2.02 115.58 113.60 1rq6 h ASN 31 Ca -0.05 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 56.27 1rq6 h ASN 31 Cb 0.85 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 37.08 1rq6 h ASN 31 CO -0.09 0.21 0.15 0.50 0.07 0.00 0.00 177.43 178.26 1rq6 h LYS 32 N 0.00 0.81 -0.20 4.14 3.64 -0.97 0.31 116.57 124.30 1rq6 h LYS 32 Ca -0.00 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.13 1rq6 h LYS 32 Cb 0.42 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1rq6 h LYS 32 CO 0.03 0.76 -0.15 0.87 -2.27 0.00 0.00 179.45 178.68 1rq6 h LYS 33 N 0.71 0.34 -0.17 1.90 1.79 -0.40 0.35 116.57 121.08 1rq6 h LYS 33 Ca 0.16 -0.09 -0.14 0.00 -2.18 0.00 0.00 60.65 58.41 1rq6 h LYS 33 Cb 0.30 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1rq6 h LYS 33 CO -0.00 0.49 -0.43 -0.07 -1.08 0.00 0.00 179.45 178.36 1rq6 h LEU 34 N 0.31 0.67 -1.00 2.94 4.07 -1.08 -3.13 115.31 118.09 1rq6 h LEU 34 Ca 0.06 -0.58 0.00 0.00 0.08 0.00 0.00 57.88 57.44 1rq6 h LEU 34 Cb 0.46 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.01 1rq6 h LEU 34 CO 0.03 1.12 0.00 0.58 -1.08 0.00 0.00 178.44 179.09 1rq6 h VAL 35 N 0.24 0.00 -0.97 1.22 2.07 -0.64 -3.05 116.25 115.13 1rq6 h VAL 35 Ca -0.01 -0.55 0.11 0.00 0.82 0.00 0.00 66.70 67.07 1rq6 h VAL 35 Cb 1.04 1.51 -0.08 0.00 -1.52 0.00 0.00 31.29 32.24 1rq6 h VAL 35 CO 0.09 0.00 0.61 -0.08 0.02 0.00 0.00 177.57 178.22 1rq6 h GLU 36 N 0.00 0.92 0.02 1.57 4.22 -0.87 -0.98 114.58 119.46 1rq6 h GLU 36 Ca 0.00 -0.06 -0.22 0.00 0.08 0.00 0.00 59.36 59.16 1rq6 h GLU 36 Cb 0.59 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1rq6 h GLU 36 CO 0.00 0.61 -0.96 1.49 -2.18 0.00 0.00 179.01 177.96 1rq6 h GLU 37 N 0.95 0.33 -4.00 1.92 4.57 -1.67 -3.50 114.58 113.18 1rq6 h GLU 37 Ca 0.47 -0.38 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1rq6 h GLU 37 Cb 0.47 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 1rq6 h GLU 37 CO -0.23 1.08 -0.41 1.97 -1.18 0.00 0.00 179.01 180.24 1rq6 n PHE 38 N -3.69 -2.09 0.15 0.92 1.16 -0.37 -4.88 117.46 108.66 1rq6 n PHE 38 Ca -0.06 1.25 -0.00 0.00 -1.87 0.00 0.00 57.45 56.76 1rq6 n PHE 38 Cb 0.85 -2.04 0.21 0.00 -1.61 0.00 0.00 39.48 36.89 1rq6 n PHE 38 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1rq6 h SER 39 N 3.91 0.00 -1.24 5.98 0.87 -1.86 -3.47 113.55 117.73 1rq6 h SER 39 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1rq6 h SER 39 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1rq6 h SER 39 CO 0.00 0.57 0.00 1.07 -0.53 0.00 0.00 176.83 177.94 1rq6 n THR 40 N -3.86 0.00 -0.77 2.23 5.66 -1.26 -5.06 114.28 111.22 1rq6 n THR 40 Ca -0.01 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.68 1rq6 n THR 40 Cb 0.57 0.00 0.26 0.00 -1.55 0.00 0.00 70.33 69.61 1rq6 n THR 40 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1rq6 s VAL 41 N -2.60 1.44 -0.24 1.08 -7.23 -1.26 -5.03 120.40 106.56 1rq6 s VAL 41 Ca 0.00 0.00 -0.16 0.00 -1.81 0.00 0.00 61.98 60.01 1rq6 s VAL 41 Cb 0.00 -2.30 -0.13 0.00 0.56 0.00 0.00 36.38 34.51 1rq6 s VAL 41 CO 0.00 0.00 -0.19 -1.20 -0.31 0.00 0.00 175.10 173.40 1rq6 n SER 42 N -5.14 1.92 -0.98 4.85 7.64 -1.26 -4.93 113.62 115.72 1rq6 n SER 42 Ca 0.13 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.39 1rq6 n SER 42 Cb 0.60 -0.85 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 1rq6 n SER 42 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1rq6 n THR 43 N -4.35 -3.62 -0.29 0.44 -1.04 -1.26 -1.97 114.28 102.19 1rq6 n THR 43 Ca -0.40 1.46 -0.08 0.00 -2.04 0.00 0.00 64.05 62.99 1rq6 n THR 43 Cb 0.74 -2.12 -0.07 0.00 -1.82 0.00 0.00 70.33 67.07 1rq6 n THR 43 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1rq6 n LYS 44 N -0.60 -0.30 -0.06 -2.82 4.76 -1.26 -1.38 118.16 116.50 1rq6 n LYS 44 Ca 0.00 1.05 0.06 0.00 -2.87 0.00 0.00 58.31 56.55 1rq6 n LYS 44 Cb 0.00 -1.54 0.09 0.00 -1.84 0.00 0.00 35.03 31.74 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 -4.84 0.00 -0.02 2.13 8.25 -1.26 -4.69 115.22 114.79 1rq6 n HIS 45 Ca 0.01 -0.80 -0.13 0.00 -0.26 0.00 0.00 57.72 56.54 1rq6 n HIS 45 Cb 0.18 -0.11 -0.14 0.00 1.12 0.00 0.00 29.99 31.04 1rq6 n HIS 45 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1rq6 n LEU 46 N -1.08 1.52 -0.15 2.41 7.94 -0.48 -3.82 117.00 123.33 1rq6 n LEU 46 Ca 0.10 0.31 -0.03 0.00 -1.11 0.00 0.00 56.01 55.28 1rq6 n LEU 46 Cb 0.51 -0.30 0.06 0.00 0.53 0.00 0.00 43.42 44.22 1rq6 n LEU 46 CO 0.01 0.57 0.95 -0.09 -1.11 0.00 0.00 177.39 177.72 1rq6 h ARG 47 N 0.03 0.31 -0.09 1.96 9.65 -1.30 0.24 114.38 125.17 1rq6 h ARG 47 Ca -0.35 -0.02 -0.11 0.00 -1.10 0.00 0.00 59.98 58.40 1rq6 h ARG 47 Cb 2.03 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 30.53 1rq6 h ARG 47 CO 0.08 0.21 -0.45 -0.91 2.80 0.00 0.00 179.97 181.70 1rq6 h ASN 48 N 0.32 0.21 -0.22 -3.80 2.35 -1.88 -2.24 115.58 110.33 1rq6 h ASN 48 Ca 0.23 -0.09 -0.08 0.00 -0.55 0.00 0.00 56.30 55.80 1rq6 h ASN 48 Cb 0.26 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 1rq6 h ASN 48 CO -0.25 0.64 -0.19 0.50 -1.65 0.00 0.00 177.43 176.47 1rq6 h LYS 49 N 0.17 0.51 -0.44 0.81 3.11 -1.34 -2.07 116.57 117.32 1rq6 h LYS 49 Ca 0.01 -0.26 0.00 0.00 -2.81 0.00 0.00 60.65 57.59 1rq6 h LYS 49 Cb 0.86 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 32.07 1rq6 h LYS 49 CO 0.07 0.84 0.28 0.82 -2.81 0.00 0.00 179.45 178.65 1rq6 h ILE 50 N 0.20 1.12 -0.47 2.00 1.08 -0.47 0.13 117.51 121.10 1rq6 h ILE 50 Ca 0.04 -0.23 0.03 0.00 -0.39 0.00 0.00 64.86 64.31 1rq6 h ILE 50 Cb 0.74 0.49 -0.04 0.00 -3.07 0.00 0.00 36.82 34.94 1rq6 h ILE 50 CO 0.05 0.12 0.26 0.00 -0.69 0.00 0.00 178.15 177.88 1rq6 h ALA 51 N 1.15 0.59 -0.62 1.87 0.00 -1.39 -1.02 119.26 119.85 1rq6 h ALA 51 Ca 0.16 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1rq6 h ALA 51 Cb -0.05 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1rq6 h ALA 51 CO -0.03 -0.08 0.29 0.78 0.00 0.00 0.00 179.25 180.21 1rq6 h GLY 52 N 0.51 0.96 0.77 0.00 0.00 -0.95 -2.65 103.07 101.70 1rq6 h GLY 52 Ca 0.20 -0.49 0.06 0.00 0.00 0.00 0.00 47.33 47.10 1rq6 h GLY 52 CO -0.12 0.46 0.63 -1.82 0.00 0.00 0.00 176.54 175.70 1rq6 h TYR 53 N 0.85 1.18 0.16 5.60 3.20 -0.12 -0.11 116.97 127.73 1rq6 h TYR 53 Ca 0.21 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.12 1rq6 h TYR 53 Cb 0.13 -0.39 -0.03 0.00 1.54 0.00 0.00 36.73 37.99 1rq6 h TYR 53 CO 0.00 0.63 -0.25 0.82 -1.64 0.00 0.00 178.16 177.72 1rq6 h ILE 54 N 1.17 0.46 -0.51 1.81 2.04 -0.86 -1.24 117.51 120.37 1rq6 h ILE 54 Ca 0.42 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.25 1rq6 h ILE 54 Cb 0.13 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1rq6 h ILE 54 CO -0.16 0.00 0.23 0.71 0.00 0.00 0.00 178.15 178.93 1rq6 h THR 55 N -0.48 1.18 -0.69 -0.27 1.35 -1.17 -2.46 112.91 110.37 1rq6 h THR 55 Ca 0.02 -0.53 -0.03 0.00 -0.55 0.00 0.00 66.41 65.32 1rq6 h THR 55 Cb 0.48 0.54 -0.03 0.00 -1.73 0.00 0.00 68.15 67.41 1rq6 h THR 55 CO -0.11 0.21 0.33 0.03 -0.25 0.00 0.00 175.52 175.73 1rq6 h ARG 56 N 0.72 1.01 -0.44 4.72 2.47 -0.58 -1.80 114.38 120.49 1rq6 h ARG 56 Ca 0.18 -0.15 0.02 0.00 -1.26 0.00 0.00 59.98 58.77 1rq6 h ARG 56 Cb 0.11 -0.18 -0.03 0.00 -1.65 0.00 0.00 29.97 28.22 1rq6 h ARG 56 CO -0.02 0.80 0.25 0.82 0.56 0.00 0.00 179.97 182.38 1rq6 h ILE 57 N 0.97 1.03 -0.19 2.04 2.04 -0.78 0.14 117.51 122.76 1rq6 h ILE 57 Ca 0.24 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.95 1rq6 h ILE 57 Cb 0.13 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 1rq6 h ILE 57 CO -0.03 0.09 0.03 0.40 0.00 0.00 0.00 178.15 178.65 1rq6 h ILE 58 N 0.51 0.91 -0.45 -0.67 2.04 -1.15 -1.08 117.51 117.62 1rq6 h ILE 58 Ca 0.18 -0.04 -0.08 0.00 1.00 0.00 0.00 64.86 65.92 1rq6 h ILE 58 Cb 0.03 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 1rq6 h ILE 58 CO -0.09 0.02 -0.06 0.28 0.00 0.00 0.00 178.15 178.30 1rq6 h SER 59 N 0.11 0.75 0.84 1.72 0.02 -1.07 -2.97 113.55 112.94 1rq6 h SER 59 Ca 0.09 -0.20 -0.07 0.00 -0.84 0.00 0.00 61.79 60.77 1rq6 h SER 59 Cb 0.09 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1rq6 h SER 59 CO -0.12 0.85 -0.32 -0.61 -1.14 0.00 0.00 176.83 175.49 1rq6 h GLN 60 N 0.71 0.00 0.00 3.45 5.75 -0.19 -2.42 115.11 122.41 1rq6 h GLN 60 Ca 0.13 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 1rq6 h GLN 60 Cb 0.52 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.07 1rq6 h GLN 60 CO 0.03 0.32 0.00 1.96 -2.65 0.00 0.00 178.83 178.49 1rq6 h GLN 61 N 0.00 0.00 -0.02 1.69 4.20 -1.04 -3.51 115.11 116.43 1rq6 h GLN 61 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1rq6 h GLN 61 Cb 0.83 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.61 1rq6 h GLN 61 CO 0.04 0.00 0.00 1.17 -0.67 0.00 0.00 178.83 179.37