#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bqz n LYS 2 N 0.00 0.58 0.00 0.00 4.81 -1.26 -5.15 118.16 117.14 1bqz n LYS 2 Ca 0.00 -1.60 0.00 0.00 -0.87 0.00 0.00 58.31 55.84 1bqz n LYS 2 Cb 0.00 -1.18 0.00 0.00 0.02 0.00 0.00 35.03 33.87 1bqz n LYS 2 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1bqz n GLN 3 N 2.05 3.70 -3.29 1.64 10.64 -1.26 -5.12 117.38 125.73 1bqz n GLN 3 Ca 0.11 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.20 1bqz n GLN 3 Cb 0.62 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.95 1bqz n GLN 3 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.06 175.39 1bqz s ASP 4 N -0.25 0.23 0.20 2.61 1.47 -1.26 -5.02 116.67 114.65 1bqz s ASP 4 Ca 0.00 -0.30 -0.17 0.00 1.18 0.00 0.00 52.55 53.25 1bqz s ASP 4 Cb 0.00 1.18 0.19 0.00 -0.34 0.00 0.00 42.92 43.94 1bqz s ASP 4 CO 0.00 -0.35 1.60 1.88 0.68 0.00 0.00 175.17 178.98 1bqz h TYR 5 N 8.15 -0.70 -1.29 2.11 -1.99 -1.95 2.63 116.97 123.93 1bqz h TYR 5 Ca -0.09 0.07 0.37 0.00 2.00 0.00 0.00 58.73 61.08 1bqz h TYR 5 Cb 1.13 0.40 -0.07 0.00 2.00 0.00 0.00 36.73 40.19 1bqz h TYR 5 CO 0.26 -0.35 0.90 1.88 -0.00 0.00 0.00 178.16 180.85 1bqz h TYR 6 N -0.10 0.17 0.02 4.88 0.05 -1.87 2.02 116.97 122.15 1bqz h TYR 6 Ca 0.27 0.01 -0.29 0.00 0.05 0.00 0.00 58.73 58.77 1bqz h TYR 6 Cb 0.54 -0.05 -0.04 0.00 1.01 0.00 0.00 36.73 38.19 1bqz h TYR 6 CO -0.61 -0.01 -1.64 1.49 -1.05 0.00 0.00 178.16 176.34 1bqz h GLU 7 N 0.08 0.05 -0.72 4.88 4.57 0.38 1.06 114.58 124.88 1bqz h GLU 7 Ca 0.65 -0.09 0.13 0.00 -1.18 0.00 0.00 59.36 58.87 1bqz h GLU 7 Cb 2.39 0.03 -0.09 0.00 -0.16 0.00 0.00 28.75 30.92 1bqz h GLU 7 CO -0.10 0.69 0.28 0.82 -1.18 0.00 0.00 179.01 179.52 1bqz h ILE 8 N 0.01 0.69 -0.24 2.32 2.04 1.58 0.86 117.51 124.77 1bqz h ILE 8 Ca -0.26 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.45 1bqz h ILE 8 Cb 1.99 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1bqz h ILE 8 CO 0.09 0.08 0.00 0.18 0.00 0.00 0.00 178.15 178.50 1bqz n LEU 9 N -5.00 1.51 -0.30 1.44 4.32 -0.31 -4.85 117.00 113.80 1bqz n LEU 9 Ca 0.13 -0.75 -0.04 0.00 -0.02 0.00 0.00 56.01 55.32 1bqz n LEU 9 Cb 0.37 -0.22 -0.02 0.00 -1.62 0.00 0.00 43.42 41.94 1bqz n LEU 9 CO 0.19 0.34 -0.04 0.61 -1.22 0.00 0.00 177.39 177.28 1bqz n GLY 10 N 0.81 0.65 4.02 -0.72 0.00 0.30 -4.13 105.19 106.11 1bqz n GLY 10 Ca 0.08 -0.36 -0.20 0.00 0.00 0.00 0.00 46.02 45.55 1bqz n GLY 10 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bqz s VAL 11 N -1.97 2.22 0.29 1.61 -7.23 0.36 -4.92 120.40 110.77 1bqz s VAL 11 Ca 0.00 -1.05 -0.11 0.00 -1.81 0.00 0.00 61.98 59.01 1bqz s VAL 11 Cb 0.00 -2.27 -0.07 0.00 0.56 0.00 0.00 36.38 34.59 1bqz s VAL 11 CO 0.00 0.00 0.65 -0.55 -0.31 0.00 0.00 175.10 174.89 1bqz s SER 12 N -4.58 6.64 0.64 4.85 0.15 -1.24 -3.17 113.70 116.98 1bqz s SER 12 Ca 0.58 1.05 0.26 0.00 0.70 0.00 0.00 55.95 58.54 1bqz s SER 12 Cb -0.06 -2.28 1.44 0.00 -1.71 0.00 0.00 66.02 63.41 1bqz s SER 12 CO 0.36 -0.18 1.80 0.07 1.20 0.00 0.00 173.24 176.49 1bqz h LYS 13 N 2.15 0.00 -0.66 5.44 2.10 -1.96 2.19 116.57 125.83 1bqz h LYS 13 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1bqz h LYS 13 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1bqz h LYS 13 CO 0.67 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.37 1bqz n THR 14 N -2.79 1.00 0.00 0.07 -2.24 -1.26 -4.02 114.28 105.04 1bqz n THR 14 Ca -0.02 -1.00 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 1bqz n THR 14 Cb 0.42 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 1bqz n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bqz n ALA 15 N 1.44 0.00 -2.18 6.98 0.00 0.74 -5.04 120.51 122.46 1bqz n ALA 15 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1bqz n ALA 15 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1bqz n ALA 15 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1bqz n GLU 16 N 0.00 0.00 0.00 0.00 1.02 -1.26 -4.99 120.64 115.41 1bqz n GLU 16 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1bqz n GLU 16 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1bqz n GLU 16 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1bqz n GLU 17 N 0.00 0.00 -0.32 3.49 2.13 -1.26 -3.89 120.64 120.78 1bqz n GLU 17 Ca 0.00 0.02 0.04 0.00 0.66 0.00 0.00 57.16 57.88 1bqz n GLU 17 Cb 0.00 -0.28 0.10 0.00 0.27 0.00 0.00 31.44 31.54 1bqz n GLU 17 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1bqz n ARG 18 N -1.12 -0.11 0.28 5.31 1.85 -1.26 0.28 116.66 121.88 1bqz n ARG 18 Ca 0.00 1.37 0.16 0.00 -1.00 0.00 0.00 57.85 58.38 1bqz n ARG 18 Cb 0.00 -2.05 0.78 0.00 -1.05 0.00 0.00 32.46 30.14 1bqz n ARG 18 CO 0.00 0.00 0.00 1.05 -0.01 0.00 0.00 177.63 178.67 1bqz h GLU 19 N 0.00 0.00 0.09 2.89 9.09 -1.98 2.20 114.58 126.87 1bqz h GLU 19 Ca 0.40 0.00 -0.27 0.00 0.05 0.00 0.00 59.36 59.54 1bqz h GLU 19 Cb 0.62 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.71 1bqz h GLU 19 CO -0.90 0.07 -1.42 0.97 0.05 0.00 0.00 179.01 177.78 1bqz h ILE 20 N 0.00 0.98 -0.15 -1.06 6.09 0.38 -3.28 117.51 120.46 1bqz h ILE 20 Ca -0.00 -2.35 -0.14 0.00 -1.37 0.00 0.00 64.86 60.99 1bqz h ILE 20 Cb 0.39 2.62 -0.01 0.00 0.47 0.00 0.00 36.82 40.29 1bqz h ILE 20 CO 0.01 0.66 -0.52 0.08 -3.07 0.00 0.00 178.15 175.31 1bqz h ARG 21 N -0.40 0.43 -0.84 2.19 -0.00 0.12 -2.99 114.38 112.91 1bqz h ARG 21 Ca -0.32 -0.26 0.21 0.00 -0.00 0.00 0.00 59.98 59.61 1bqz h ARG 21 Cb 1.69 0.02 -0.14 0.00 -0.00 0.00 0.00 29.97 31.55 1bqz h ARG 21 CO 0.01 0.85 0.15 -0.22 -0.00 0.00 0.00 179.97 180.76 1bqz h LYS 22 N 0.34 0.16 -0.07 0.08 1.63 0.35 0.59 116.57 119.66 1bqz h LYS 22 Ca 0.01 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1bqz h LYS 22 Cb 1.03 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.62 1bqz h LYS 22 CO 0.09 0.11 0.03 0.00 -3.45 0.00 0.00 179.45 176.23 1bqz h ALA 23 N 1.76 0.09 0.00 5.00 0.00 -1.58 3.06 119.26 127.59 1bqz h ALA 23 Ca 0.50 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 1bqz h ALA 23 Cb 0.97 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1bqz h ALA 23 CO -0.67 -0.32 -0.12 -0.92 0.00 0.00 0.00 179.25 177.23 1bqz h TYR 24 N -0.05 0.00 0.11 0.00 3.20 -1.19 1.97 116.97 121.01 1bqz h TYR 24 Ca 0.02 0.00 -0.36 0.00 3.14 0.00 0.00 58.73 61.53 1bqz h TYR 24 Cb 0.18 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1bqz h TYR 24 CO -0.01 0.12 -2.02 1.17 -1.64 0.00 0.00 178.16 175.77 1bqz n LYS 25 N -3.32 0.74 0.00 1.82 0.00 0.19 -2.97 118.16 114.63 1bqz n LYS 25 Ca -0.00 0.25 -0.12 0.00 0.00 0.00 0.00 58.31 58.44 1bqz n LYS 25 Cb 0.33 -1.70 -0.14 0.00 0.00 0.00 0.00 35.03 33.52 1bqz n LYS 25 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.40 177.47 1bqz h ARG 26 N 0.06 0.08 0.13 1.64 0.11 0.58 -2.87 114.38 114.11 1bqz h ARG 26 Ca -0.43 -0.14 -0.28 0.00 0.10 0.00 0.00 59.98 59.22 1bqz h ARG 26 Cb 2.03 0.05 0.00 0.00 1.11 0.00 0.00 29.97 33.16 1bqz h ARG 26 CO 0.07 0.76 -1.32 1.37 0.10 0.00 0.00 179.97 180.95 1bqz h LEU 27 N 0.02 0.44 -0.02 0.08 8.10 0.31 -3.15 115.31 121.09 1bqz h LEU 27 Ca -0.28 -0.49 -0.20 0.00 0.11 0.00 0.00 57.88 57.02 1bqz h LEU 27 Cb 1.99 -0.14 0.02 0.00 -0.44 0.00 0.00 40.66 42.09 1bqz h LEU 27 CO 0.10 1.39 -0.78 0.00 -4.11 0.00 0.00 178.44 175.04 1bqz h ALA 28 N 0.54 0.12 -0.28 0.17 0.00 -1.49 0.28 119.26 118.62 1bqz h ALA 28 Ca -0.16 -0.62 0.08 0.00 0.00 0.00 0.00 54.91 54.21 1bqz h ALA 28 Cb 1.99 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.81 1bqz h ALA 28 CO 0.20 0.51 0.23 0.00 0.00 0.00 0.00 179.25 180.18 1bqz h MET 29 N 0.16 0.00 0.00 0.00 -0.00 -1.62 1.02 114.93 114.49 1bqz h MET 29 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.61 1bqz h MET 29 Cb 1.46 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.06 1bqz h MET 29 CO 0.15 0.00 -0.79 0.87 -0.00 0.00 0.00 176.91 177.14 1bqz h LYS 30 N 0.00 0.00 -0.37 -0.10 1.57 -1.43 -3.33 116.57 112.91 1bqz h LYS 30 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1bqz h LYS 30 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 1bqz h LYS 30 CO -0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 1bqz n TYR 31 N -2.26 0.56 0.00 -1.35 4.02 0.24 -4.80 117.16 113.56 1bqz n TYR 31 Ca 0.02 -0.53 0.00 0.00 -0.01 0.00 0.00 57.90 57.38 1bqz n TYR 31 Cb 0.47 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.74 1bqz n TYR 31 CO 0.00 0.00 0.00 -2.39 -1.01 0.00 0.00 176.86 173.46 1bqz n HIS 32 N 0.53 -0.44 -0.31 -0.72 1.44 0.29 -3.96 115.22 112.04 1bqz n HIS 32 Ca 0.14 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.82 1bqz n HIS 32 Cb 0.49 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.56 1bqz n HIS 32 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1bqz n PRO 33 N 0.00 0.63 -0.08 -1.40 -0.04 -1.26 -3.13 135.00 129.72 1bqz n PRO 33 Ca 0.00 -0.24 -0.22 0.00 -0.04 0.00 0.00 63.50 63.00 1bqz n PRO 33 Cb 0.00 -1.54 -0.12 0.00 -0.04 0.00 0.00 33.50 31.79 1bqz n PRO 33 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1bqz n ASP 34 N 2.42 2.00 0.00 3.54 2.03 -1.26 -4.72 116.55 120.55 1bqz n ASP 34 Ca 0.10 0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.62 1bqz n ASP 34 Cb 0.30 -0.78 0.00 0.00 -0.72 0.00 0.00 41.12 39.91 1bqz n ASP 34 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1bqz n ARG 35 N -3.81 2.04 0.06 -0.67 -4.01 -1.21 -4.77 116.66 104.29 1bqz n ARG 35 Ca -0.39 0.00 0.21 0.00 -1.04 0.00 0.00 57.85 56.63 1bqz n ARG 35 Cb 0.91 -0.63 0.65 0.00 -3.04 0.00 0.00 32.46 30.36 1bqz n ARG 35 CO 0.00 0.00 0.00 -0.91 -3.04 0.00 0.00 177.63 173.68 1bqz h ASN 36 N 0.00 0.00 0.00 2.89 4.21 -1.67 1.45 115.58 122.46 1bqz h ASN 36 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1bqz h ASN 36 Cb 0.18 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 1bqz h ASN 36 CO 0.00 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.14 1bqz n GLN 37 N -3.43 0.98 -0.00 0.81 1.13 -1.26 -2.99 117.38 112.61 1bqz n GLN 37 Ca 0.10 0.00 0.03 0.00 -1.94 0.00 0.00 57.00 55.19 1bqz n GLN 37 Cb 0.82 -1.28 -0.04 0.00 0.11 0.00 0.00 30.24 29.85 1bqz n GLN 37 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bqz n GLY 38 N 0.76 0.14 3.38 1.08 0.00 0.50 -4.97 105.19 106.07 1bqz n GLY 38 Ca 0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 1bqz n GLY 38 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bqz s ASP 39 N -2.02 -0.85 0.08 1.61 1.11 -1.16 -5.01 116.67 110.42 1bqz s ASP 39 Ca 0.01 1.16 0.16 0.00 0.18 0.00 0.00 52.55 54.05 1bqz s ASP 39 Cb 0.05 1.93 -0.13 0.00 1.07 0.00 0.00 42.92 45.85 1bqz s ASP 39 CO 0.28 -0.24 0.90 0.11 1.18 0.00 0.00 175.17 177.40 1bqz h LYS 40 N 8.06 0.00 -1.63 8.23 6.56 -1.93 -3.31 116.57 132.54 1bqz h LYS 40 Ca -0.19 0.00 0.47 0.00 -1.06 0.00 0.00 60.65 59.88 1bqz h LYS 40 Cb 1.12 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 32.71 1bqz h LYS 40 CO 0.16 0.37 1.20 1.05 -2.06 0.00 0.00 179.45 180.17 1bqz h GLU 41 N 0.00 0.00 0.00 3.15 4.11 -1.95 2.82 114.58 122.71 1bqz h GLU 41 Ca -0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.28 1bqz h GLU 41 Cb 1.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.87 1bqz h GLU 41 CO 0.06 0.00 -0.61 0.00 0.07 0.00 0.00 179.01 178.52 1bqz h ALA 42 N 1.13 0.62 -0.98 1.06 0.00 -1.97 -3.37 119.26 115.75 1bqz h ALA 42 Ca 0.78 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.86 1bqz h ALA 42 Cb 3.17 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 20.79 1bqz h ALA 42 CO -0.01 0.00 -0.31 -1.91 0.00 0.00 0.00 179.25 177.02 1bqz n GLU 43 N -2.28 -0.16 0.15 0.00 2.13 0.94 -1.00 120.64 120.42 1bqz n GLU 43 Ca 0.03 1.52 -0.14 0.00 0.66 0.00 0.00 57.16 59.23 1bqz n GLU 43 Cb 0.46 -2.26 -0.06 0.00 0.27 0.00 0.00 31.44 29.86 1bqz n GLU 43 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1bqz h ALA 44 N 1.66 -0.54 -0.75 4.31 0.00 -1.73 0.39 119.26 122.60 1bqz h ALA 44 Ca 0.41 -0.07 0.22 0.00 0.00 0.00 0.00 54.91 55.47 1bqz h ALA 44 Cb 0.65 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1bqz h ALA 44 CO -0.99 -0.85 0.84 -0.22 0.00 0.00 0.00 179.25 178.03 1bqz h LYS 45 N -0.55 0.00 -0.05 0.00 3.64 -1.33 2.23 116.57 120.50 1bqz h LYS 45 Ca 0.01 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 1bqz h LYS 45 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1bqz h LYS 45 CO -0.13 0.00 -0.20 0.74 -2.27 0.00 0.00 179.45 177.59 1bqz h PHE 46 N 0.00 0.31 0.00 1.91 0.04 -0.71 -3.06 116.94 115.42 1bqz h PHE 46 Ca 0.36 -0.13 -0.13 0.00 2.80 0.00 0.00 57.97 60.87 1bqz h PHE 46 Cb 2.03 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 40.11 1bqz h PHE 46 CO 0.00 0.83 -1.03 1.57 -0.60 0.00 0.00 178.31 179.08 1bqz h LYS 47 N -0.30 0.00 -0.99 1.51 -0.00 -0.16 -3.20 116.57 113.43 1bqz h LYS 47 Ca -0.01 0.00 0.25 0.00 -0.00 0.00 0.00 60.65 60.89 1bqz h LYS 47 Cb 0.84 0.00 -0.08 0.00 -0.00 0.00 0.00 32.23 33.00 1bqz h LYS 47 CO 0.04 0.35 0.66 0.93 -0.00 0.00 0.00 179.45 181.43 1bqz h GLU 48 N 0.00 0.33 -0.46 0.07 4.39 0.34 1.37 114.58 120.62 1bqz h GLU 48 Ca -0.09 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.55 1bqz h GLU 48 Cb 1.47 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 30.02 1bqz h GLU 48 CO 0.05 0.22 0.11 0.82 -1.16 0.00 0.00 179.01 179.05 1bqz h ILE 49 N 0.34 1.24 -0.82 3.13 2.04 -1.52 -2.07 117.51 119.84 1bqz h ILE 49 Ca 0.53 -0.82 0.16 0.00 1.00 0.00 0.00 64.86 65.73 1bqz h ILE 49 Cb 1.46 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 38.36 1bqz h ILE 49 CO -0.20 0.29 0.54 0.50 0.00 0.00 0.00 178.15 179.28 1bqz h LYS 50 N 0.62 0.46 -0.74 2.37 3.64 0.17 0.18 116.57 123.27 1bqz h LYS 50 Ca 0.15 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1bqz h LYS 50 Cb 0.32 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 1bqz h LYS 50 CO 0.00 0.30 0.46 1.49 -2.27 0.00 0.00 179.45 179.44 1bqz h GLU 51 N 0.47 0.98 -1.55 1.90 4.81 -0.62 -1.63 114.58 118.94 1bqz h GLU 51 Ca 0.41 -0.07 0.46 0.00 -0.13 0.00 0.00 59.36 60.03 1bqz h GLU 51 Cb 0.90 -0.21 -0.09 0.00 0.63 0.00 0.00 28.75 29.98 1bqz h GLU 51 CO -0.15 0.67 1.09 0.00 -0.73 0.00 0.00 179.01 179.89 1bqz h ALA 52 N 1.50 3.29 -0.53 2.92 0.00 -0.61 2.03 119.26 127.87 1bqz h ALA 52 Ca 0.27 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1bqz h ALA 52 Cb -0.07 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1bqz h ALA 52 CO -0.05 -1.81 0.32 1.88 0.00 0.00 0.00 179.25 179.58 1bqz h TYR 53 N 0.04 0.68 0.00 0.00 0.05 -1.41 0.70 116.97 117.04 1bqz h TYR 53 Ca 0.80 0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.59 1bqz h TYR 53 Cb 2.96 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 40.48 1bqz h TYR 53 CO -0.00 0.46 0.00 0.93 -1.05 0.00 0.00 178.16 178.49 1bqz h GLU 54 N 0.72 0.00 0.00 4.88 5.08 0.31 0.12 114.58 125.69 1bqz h GLU 54 Ca 0.19 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.41 1bqz h GLU 54 Cb -0.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1bqz h GLU 54 CO -0.04 0.00 -1.38 0.28 -1.00 0.00 0.00 179.01 176.87 1bqz n VAL 55 N -2.51 1.39 0.48 3.13 0.31 0.21 -4.73 118.33 116.62 1bqz n VAL 55 Ca -0.02 -0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.43 1bqz n VAL 55 Cb 0.06 -2.08 0.12 0.00 -0.91 0.00 0.00 33.84 31.04 1bqz n VAL 55 CO 0.00 0.00 0.00 0.17 -1.32 0.00 0.00 176.83 175.68 1bqz h LEU 56 N -0.84 0.00 -3.40 7.52 -0.00 -0.52 0.28 115.31 118.35 1bqz h LEU 56 Ca -0.22 -0.19 -0.37 0.00 -0.00 0.00 0.00 57.88 57.10 1bqz h LEU 56 Cb 1.09 0.00 -0.19 0.00 -0.00 0.00 0.00 40.66 41.56 1bqz h LEU 56 CO -0.13 0.10 0.47 0.35 -0.00 0.00 0.00 178.44 179.22 1bqz n THR 57 N -2.20 2.64 -3.57 0.15 -2.24 0.39 -4.51 114.28 104.94 1bqz n THR 57 Ca 0.03 -1.52 -0.10 0.00 -2.27 0.00 0.00 64.05 60.18 1bqz n THR 57 Cb 0.46 -0.90 -0.10 0.00 -2.10 0.00 0.00 70.33 67.69 1bqz n THR 57 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1bqz s ASP 58 N -0.44 0.08 0.30 3.42 1.11 -1.26 -4.94 116.67 114.95 1bqz s ASP 58 Ca 0.38 0.64 -0.02 0.00 0.18 0.00 0.00 52.55 53.73 1bqz s ASP 58 Cb 0.31 1.10 0.65 0.00 1.07 0.00 0.00 42.92 46.05 1bqz s ASP 58 CO 0.04 -0.26 1.56 -1.20 1.18 0.00 0.00 175.17 176.49 1bqz n SER 59 N 5.37 -0.20 0.07 0.27 7.64 -1.26 0.16 113.62 125.67 1bqz n SER 59 Ca -0.06 1.70 -0.04 0.00 1.01 0.00 0.00 58.87 61.47 1bqz n SER 59 Cb 0.50 -0.58 0.16 0.00 -1.01 0.00 0.00 64.21 63.27 1bqz n SER 59 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 1bqz h GLN 60 N 0.00 0.32 0.09 1.43 3.07 -1.96 0.28 115.11 118.35 1bqz h GLN 60 Ca 0.56 -0.18 -0.28 0.00 0.09 0.00 0.00 58.65 58.84 1bqz h GLN 60 Cb 1.06 0.01 0.02 0.00 0.08 0.00 0.00 27.48 28.65 1bqz h GLN 60 CO -0.97 0.74 -1.19 0.87 0.09 0.00 0.00 178.83 178.37 1bqz h LYS 61 N 0.26 0.57 0.00 0.06 1.79 0.14 -2.35 116.57 117.04 1bqz h LYS 61 Ca 0.01 -0.74 0.00 0.00 -2.18 0.00 0.00 60.65 57.75 1bqz h LYS 61 Cb 0.95 0.24 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1bqz h LYS 61 CO 0.08 1.32 -0.15 0.07 -1.08 0.00 0.00 179.45 179.69 1bqz h ARG 62 N 0.26 0.00 0.00 3.15 0.11 0.54 -3.15 114.38 115.29 1bqz h ARG 62 Ca -0.16 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.87 1bqz h ARG 62 Cb 1.85 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.93 1bqz h ARG 62 CO 0.22 0.00 -0.93 0.00 0.10 0.00 0.00 179.97 179.36 1bqz h ALA 63 N 2.31 0.62 -0.05 0.08 0.00 -0.95 -2.74 119.26 118.52 1bqz h ALA 63 Ca 0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 54.91 54.43 1bqz h ALA 63 Cb 0.85 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.71 1bqz h ALA 63 CO 0.00 0.28 -0.88 0.00 0.00 0.00 0.00 179.25 178.65 1bqz h ALA 64 N 1.81 0.34 0.06 0.00 0.00 -1.38 -3.12 119.26 116.97 1bqz h ALA 64 Ca -0.04 -0.66 -0.07 0.00 0.00 0.00 0.00 54.91 54.13 1bqz h ALA 64 Cb 1.18 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1bqz h ALA 64 CO 0.02 0.74 -0.32 1.88 0.00 0.00 0.00 179.25 181.57 1bqz h TYR 65 N 0.35 0.22 0.00 0.00 -1.99 -1.65 -3.07 116.97 110.84 1bqz h TYR 65 Ca -0.07 -0.16 0.00 0.00 2.00 0.00 0.00 58.73 60.50 1bqz h TYR 65 Cb 1.51 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 40.23 1bqz h TYR 65 CO 0.07 1.12 0.16 0.38 -0.00 0.00 0.00 178.16 179.90 1bqz h ASP 66 N -0.75 0.00 -0.16 3.88 2.03 -1.59 0.58 116.42 120.40 1bqz h ASP 66 Ca -0.06 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.24 1bqz h ASP 66 Cb 1.26 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 1bqz h ASP 66 CO 0.06 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.27 1bqz n GLN 67 N -2.26 2.35 -2.70 4.15 6.02 -1.18 -4.94 117.38 118.82 1bqz n GLN 67 Ca -0.01 -1.99 -0.18 0.00 -0.01 0.00 0.00 57.00 54.80 1bqz n GLN 67 Cb 0.19 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.97 1bqz n GLN 67 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1bqz n TYR 68 N 1.32 -1.49 0.00 1.08 4.02 0.20 -4.27 117.16 118.02 1bqz n TYR 68 Ca 0.16 0.19 0.00 0.00 -0.01 0.00 0.00 57.90 58.24 1bqz n TYR 68 Cb 0.59 -3.47 0.00 0.00 -0.02 0.00 0.00 39.34 36.44 1bqz n TYR 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1bqz n GLY 69 N -1.07 1.53 0.00 2.72 0.00 -1.16 -4.55 105.19 102.66 1bqz n GLY 69 Ca -0.14 -1.97 0.09 0.00 0.00 0.00 0.00 46.02 44.00 1bqz n GLY 69 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1bqz n HIS 70 N 1.95 0.00 -0.13 1.61 1.44 -1.26 -3.45 115.22 115.38 1bqz n HIS 70 Ca 0.00 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.59 1bqz n HIS 70 Cb 0.00 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.10 1bqz n HIS 70 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1bqz h ALA 71 N 3.39 0.62 -0.10 1.59 0.00 -1.80 -1.55 119.26 121.41 1bqz h ALA 71 Ca 0.00 -0.44 0.03 0.00 0.00 0.00 0.00 54.91 54.50 1bqz h ALA 71 Cb 0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1bqz h ALA 71 CO 0.00 0.68 0.47 0.00 0.00 0.00 0.00 179.25 180.40 1bqz h ALA 72 N 0.82 1.60 0.00 0.00 0.00 -1.74 0.22 119.26 120.17 1bqz h ALA 72 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1bqz h ALA 72 Cb 0.93 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1bqz h ALA 72 CO 0.09 -0.52 -0.09 1.19 0.00 0.00 0.00 179.25 179.92 1bqz n PHE 73 N -2.98 0.00 -4.27 0.00 3.72 -0.99 -5.11 117.46 107.82 1bqz n PHE 73 Ca 0.01 -0.62 0.00 0.00 -0.05 0.00 0.00 57.45 56.79 1bqz n PHE 73 Cb 0.54 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 1bqz n PHE 73 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1bqz n GLU 74 N -0.84 0.00 -1.18 -1.08 -0.58 0.78 -3.25 120.64 114.48 1bqz n GLU 74 Ca 0.08 0.00 -0.20 0.00 -0.42 0.00 0.00 57.16 56.62 1bqz n GLU 74 Cb 0.54 0.00 0.21 0.00 -0.57 0.00 0.00 31.44 31.62 1bqz n GLU 74 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1bqz n GLN 75 N 0.00 2.56 0.00 3.49 1.13 -1.26 -4.54 117.38 118.75 1bqz n GLN 75 Ca 0.00 -3.03 0.00 0.00 -1.94 0.00 0.00 57.00 52.03 1bqz n GLN 75 Cb 0.00 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.17 1bqz n GLN 75 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bqz n GLY 76 N -0.94 -0.53 0.00 1.08 0.00 -1.20 -5.23 105.19 98.37 1bqz n GLY 76 Ca 0.56 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1bqz n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93