#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqx s SER 2 N 0.00 4.10 0.07 1.61 0.15 -1.26 -5.07 113.70 113.30 2cqx s SER 2 Ca 0.00 1.16 -0.26 0.00 0.70 0.00 0.00 55.95 57.54 2cqx s SER 2 Cb 0.00 -1.82 0.09 0.00 -1.71 0.00 0.00 66.02 62.58 2cqx s SER 2 CO 0.00 -2.20 1.17 -0.94 1.20 0.00 0.00 173.24 172.47 2cqx s SER 3 N -3.97 -0.02 -0.04 5.45 1.04 -1.26 -5.19 113.70 109.71 2cqx s SER 3 Ca 0.62 -0.38 -0.30 0.00 0.48 0.00 0.00 55.95 56.36 2cqx s SER 3 Cb -0.14 0.31 0.11 0.00 0.10 0.00 0.00 66.02 66.39 2cqx s SER 3 CO 0.54 -0.60 1.03 -0.83 0.98 0.00 0.00 173.24 174.36 2cqx s GLY 4 N -3.45 -0.38 0.11 7.32 0.00 -1.26 -5.19 107.32 104.48 2cqx s GLY 4 Ca 0.23 1.02 -0.11 0.00 0.00 0.00 0.00 44.72 45.86 2cqx s GLY 4 CO 0.01 0.32 0.25 -0.45 0.00 0.00 0.00 173.10 173.24 2cqx s SER 5 N -2.51 0.03 0.29 1.64 0.15 -1.26 -5.18 113.70 106.85 2cqx s SER 5 Ca 0.08 -0.60 -0.20 0.00 0.70 0.00 0.00 55.95 55.93 2cqx s SER 5 Cb -0.00 0.38 0.02 0.00 -1.71 0.00 0.00 66.02 64.71 2cqx s SER 5 CO -0.06 -0.78 0.72 -0.44 1.20 0.00 0.00 173.24 173.88 2cqx s SER 6 N -2.86 -0.23 0.17 5.45 0.01 -1.26 -5.19 113.70 109.79 2cqx s SER 6 Ca 0.06 -0.66 -0.11 0.00 1.31 0.00 0.00 55.95 56.55 2cqx s SER 6 Cb 0.04 0.73 -0.00 0.00 0.21 0.00 0.00 66.02 67.00 2cqx s SER 6 CO -0.10 -1.37 0.33 -0.83 0.41 0.00 0.00 173.24 171.68 2cqx s GLY 7 N -2.94 0.36 0.00 3.44 0.00 -1.26 -5.17 107.32 101.75 2cqx s GLY 7 Ca 0.12 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.09 2cqx s GLY 7 CO 0.07 -0.72 0.00 0.61 0.00 0.00 0.00 173.10 173.06 2cqx n GLY 8 N -0.24 -1.40 3.33 0.20 0.00 -1.26 -5.16 105.19 100.67 2cqx n GLY 8 Ca -0.08 -1.17 -0.23 0.00 0.00 0.00 0.00 46.02 44.54 2cqx n GLY 8 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2cqx s ILE 9 N -2.98 1.86 0.42 -0.61 -4.36 -1.26 -5.16 121.20 109.12 2cqx s ILE 9 Ca 0.00 -1.82 0.03 0.00 -0.26 0.00 0.00 60.65 58.60 2cqx s ILE 9 Cb 0.00 -1.80 -0.03 0.00 1.25 0.00 0.00 42.46 41.88 2cqx s ILE 9 CO 0.00 -0.21 0.07 -1.59 0.24 0.00 0.00 174.94 173.44 2cqx s LYS 10 N -2.52 1.96 0.07 0.37 0.00 -1.26 -5.15 119.74 113.21 2cqx s LYS 10 Ca 0.14 -2.19 -0.08 0.00 0.00 0.00 0.00 55.97 53.84 2cqx s LYS 10 Cb -0.07 -1.03 -0.05 0.00 0.00 0.00 0.00 37.83 36.68 2cqx s LYS 10 CO 0.06 -0.35 0.36 0.34 0.00 0.00 0.00 175.35 175.76 2cqx s ASP 11 N -3.67 6.57 -0.25 0.03 -1.08 -1.26 -5.06 116.67 111.96 2cqx s ASP 11 Ca 0.22 0.69 -0.27 0.00 -0.52 0.00 0.00 52.55 52.66 2cqx s ASP 11 Cb 0.04 -2.14 0.01 0.00 -1.46 0.00 0.00 42.92 39.37 2cqx s ASP 11 CO 0.12 0.18 0.97 -0.94 0.52 0.00 0.00 175.17 176.01 2cqx s SER 12 N -1.85 6.98 0.28 -0.34 1.04 -1.26 -5.02 113.70 113.53 2cqx s SER 12 Ca 0.33 1.21 -0.29 0.00 0.48 0.00 0.00 55.95 57.67 2cqx s SER 12 Cb -0.13 -2.50 -0.10 0.00 0.10 0.00 0.00 66.02 63.39 2cqx s SER 12 CO 0.19 -0.64 1.25 -2.16 0.98 0.00 0.00 173.24 172.85 2cqx s PRO 13 N 3.13 4.45 0.48 4.02 0.04 -1.26 -4.93 135.00 140.93 2cqx s PRO 13 Ca 0.41 2.05 0.20 0.00 0.04 0.00 0.00 61.00 63.70 2cqx s PRO 13 Cb -0.15 -3.14 1.20 0.00 0.04 0.00 0.00 34.50 32.45 2cqx s PRO 13 CO 0.08 -0.09 2.02 -0.39 0.04 0.00 0.00 177.00 178.66 2cqx h VAL 14 N 3.26 0.88 -4.17 -0.36 -1.51 -2.06 -3.44 116.25 108.86 2cqx h VAL 14 Ca -0.47 -0.61 -0.27 0.00 -1.23 0.00 0.00 66.70 64.11 2cqx h VAL 14 Cb 1.22 1.35 0.07 0.00 -2.13 0.00 0.00 31.29 31.80 2cqx h VAL 14 CO 0.69 0.16 0.13 0.59 -1.23 0.00 0.00 177.57 177.91 2cqx n ASN 15 N -4.00 0.58 -4.72 4.19 3.02 -1.26 -5.05 115.26 108.02 2cqx n ASN 15 Ca -0.02 -1.57 -0.41 0.00 -0.03 0.00 0.00 54.58 52.55 2cqx n ASN 15 Cb 0.25 -0.46 -0.04 0.00 -0.61 0.00 0.00 39.78 38.92 2cqx n ASN 15 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2cqx s LYS 16 N -4.26 4.57 0.27 3.52 -0.14 -1.26 -4.95 119.74 117.49 2cqx s LYS 16 Ca 0.42 1.27 -0.03 0.00 -1.36 0.00 0.00 55.97 56.27 2cqx s LYS 16 Cb -0.02 -3.42 0.57 0.00 -1.68 0.00 0.00 37.83 33.29 2cqx s LYS 16 CO 0.28 0.11 1.61 -0.39 -0.76 0.00 0.00 175.35 176.20 2cqx h VAL 17 N 4.45 0.22 -1.79 3.17 -1.51 -1.97 -3.44 116.25 115.38 2cqx h VAL 17 Ca -0.42 -0.03 0.22 0.00 -1.23 0.00 0.00 66.70 65.24 2cqx h VAL 17 Cb 1.21 0.13 -0.16 0.00 -2.13 0.00 0.00 31.29 30.34 2cqx h VAL 17 CO 0.73 0.02 0.69 -1.61 -1.23 0.00 0.00 177.57 176.17 2cqx s GLU 18 N -6.06 0.55 0.00 5.19 2.02 -1.26 -5.00 118.70 114.14 2cqx s GLU 18 Ca -0.13 -0.24 0.07 0.00 0.02 0.00 0.00 54.97 54.69 2cqx s GLU 18 Cb 0.25 0.23 0.42 0.00 0.10 0.00 0.00 34.13 35.14 2cqx s GLU 18 CO 0.77 -0.25 0.88 -0.35 0.02 0.00 0.00 175.26 176.33 2cqx n PRO 19 N -0.23 0.49 -0.12 0.39 -0.04 -1.26 -3.27 135.00 130.95 2cqx n PRO 19 Ca -0.04 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.43 2cqx n PRO 19 Cb 0.60 -1.23 0.05 0.00 -0.04 0.00 0.00 33.50 32.89 2cqx n PRO 19 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2cqx n ASN 20 N -0.73 1.61 -0.35 3.54 5.03 -1.26 -4.36 115.26 118.74 2cqx n ASN 20 Ca 0.05 -2.12 0.30 0.00 0.87 0.00 0.00 54.58 53.68 2cqx n ASN 20 Cb 0.02 -0.52 0.56 0.00 -1.02 0.00 0.00 39.78 38.83 2cqx n ASN 20 CO 0.00 0.00 0.00 -2.24 -1.83 0.00 0.00 177.26 173.19 2cqx h ASP 21 N 0.52 0.37 -1.51 6.41 2.03 -2.01 0.18 116.42 122.42 2cqx h ASP 21 Ca 0.00 0.22 0.45 0.00 -0.73 0.00 0.00 57.03 56.96 2cqx h ASP 21 Cb 0.69 0.20 -0.07 0.00 -0.83 0.00 0.00 39.33 39.32 2cqx h ASP 21 CO 0.06 -0.29 1.07 0.41 -1.03 0.00 0.00 179.24 179.47 2cqx n THR 22 N -5.09 -0.03 -0.01 1.15 -1.04 -1.26 0.18 114.28 108.18 2cqx n THR 22 Ca 0.36 1.22 -0.13 0.00 -2.04 0.00 0.00 64.05 63.46 2cqx n THR 22 Cb 1.21 -2.02 -0.10 0.00 -1.82 0.00 0.00 70.33 67.60 2cqx n THR 22 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2cqx h LEU 23 N 0.00 -0.03 -0.76 -4.42 4.07 -1.02 -3.23 115.31 109.92 2cqx h LEU 23 Ca 0.74 -0.55 0.30 0.00 0.08 0.00 0.00 57.88 58.45 2cqx h LEU 23 Cb 2.90 0.01 -0.14 0.00 1.08 0.00 0.00 40.66 44.52 2cqx h LEU 23 CO -0.06 0.55 0.33 1.21 -1.08 0.00 0.00 178.44 179.39 2cqx n GLU 24 N -4.83 -0.05 0.07 1.13 4.07 0.47 -0.66 120.64 120.84 2cqx n GLU 24 Ca -0.09 1.07 -0.03 0.00 -0.06 0.00 0.00 57.16 58.05 2cqx n GLU 24 Cb 0.29 -1.87 -0.01 0.00 -0.06 0.00 0.00 31.44 29.79 2cqx n GLU 24 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2cqx h LYS 25 N 0.00 -0.18 -1.21 5.31 1.57 -1.57 -3.11 116.57 117.38 2cqx h LYS 25 Ca 0.61 0.01 0.36 0.00 -1.87 0.00 0.00 60.65 59.77 2cqx h LYS 25 Cb 1.56 0.04 -0.11 0.00 0.08 0.00 0.00 32.23 33.80 2cqx h LYS 25 CO -0.61 -0.12 0.78 -0.24 -0.57 0.00 0.00 179.45 178.70 2cqx h VAL 26 N -0.22 0.30 -0.54 0.50 3.04 -0.96 0.87 116.25 119.23 2cqx h VAL 26 Ca -0.02 -0.07 0.09 0.00 -1.01 0.00 0.00 66.70 65.70 2cqx h VAL 26 Cb 0.14 0.08 -0.08 0.00 -2.01 0.00 0.00 31.29 29.42 2cqx h VAL 26 CO 0.03 0.04 0.11 0.15 -1.01 0.00 0.00 177.57 176.89 2cqx h PHE 27 N 0.20 0.18 -0.37 3.17 3.57 -0.85 0.30 116.94 123.15 2cqx h PHE 27 Ca 0.72 0.03 0.00 0.00 3.53 0.00 0.00 57.97 62.25 2cqx h PHE 27 Cb 2.14 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.88 2cqx h PHE 27 CO -0.00 -0.01 0.00 1.55 -2.23 0.00 0.00 178.31 177.61 2cqx n VAL 28 N -5.11 0.71 -0.12 1.41 3.14 0.93 -1.17 118.33 118.12 2cqx n VAL 28 Ca 0.07 -0.86 -0.24 0.00 -2.96 0.00 0.00 64.34 60.35 2cqx n VAL 28 Cb 0.27 0.74 -0.09 0.00 -1.06 0.00 0.00 33.84 33.70 2cqx n VAL 28 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2cqx n SER 29 N 0.97 1.82 -0.07 6.55 2.88 0.26 -4.85 113.62 121.17 2cqx n SER 29 Ca 0.15 0.22 -0.14 0.00 -1.33 0.00 0.00 58.87 57.77 2cqx n SER 29 Cb 0.48 -0.65 -0.05 0.00 -0.75 0.00 0.00 64.21 63.23 2cqx n SER 29 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2cqx n VAL 30 N -3.92 0.77 -3.62 2.46 0.24 0.93 -5.00 118.33 110.19 2cqx n VAL 30 Ca -0.47 -0.22 -0.04 0.00 -2.04 0.00 0.00 64.34 61.57 2cqx n VAL 30 Cb 0.86 -1.50 -0.04 0.00 -1.47 0.00 0.00 33.84 31.68 2cqx n VAL 30 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2cqx s THR 31 N -2.26 0.00 0.13 3.34 -1.32 -0.37 -5.04 115.64 110.12 2cqx s THR 31 Ca -0.19 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.20 2cqx s THR 31 Cb 0.07 -1.00 -0.14 0.00 -1.51 0.00 0.00 72.50 69.92 2cqx s THR 31 CO 0.26 0.00 1.35 0.11 -2.21 0.00 0.00 174.62 174.13 2cqx h LYS 32 N 2.23 0.66 -3.53 7.08 1.57 -1.38 -3.28 116.57 119.91 2cqx h LYS 32 Ca -0.11 -0.54 -0.69 0.00 -1.87 0.00 0.00 60.65 57.44 2cqx h LYS 32 Cb 1.18 0.11 -0.36 0.00 0.08 0.00 0.00 32.23 33.24 2cqx h LYS 32 CO 0.24 1.16 -0.39 0.71 -0.57 0.00 0.00 179.45 180.60 2cqx s TYR 33 N -3.71 3.37 0.96 -1.35 1.51 -1.26 -4.88 117.35 112.00 2cqx s TYR 33 Ca -0.09 -2.79 -0.12 0.00 -1.01 0.00 0.00 57.07 53.06 2cqx s TYR 33 Cb 0.09 -3.15 0.17 0.00 -0.11 0.00 0.00 41.96 38.96 2cqx s TYR 33 CO 0.88 -0.82 1.09 -1.25 -1.11 0.00 0.00 175.55 174.34 2cqx s PRO 34 N -0.15 0.72 0.31 -1.71 0.04 -1.26 -5.08 135.00 127.88 2cqx s PRO 34 Ca 0.17 0.62 0.10 0.00 0.04 0.00 0.00 61.00 61.94 2cqx s PRO 34 Cb -0.21 -1.76 -0.06 0.00 0.04 0.00 0.00 34.50 32.51 2cqx s PRO 34 CO -0.03 -2.56 -0.11 0.34 0.04 0.00 0.00 177.00 174.69 2cqx s ASP 35 N -3.45 3.83 0.34 6.66 2.15 -1.26 -4.96 116.67 119.98 2cqx s ASP 35 Ca 0.65 -1.06 0.12 0.00 0.43 0.00 0.00 52.55 52.69 2cqx s ASP 35 Cb -0.18 -0.41 1.05 0.00 -0.30 0.00 0.00 42.92 43.09 2cqx s ASP 35 CO 0.57 -0.11 1.60 -0.08 -0.17 0.00 0.00 175.17 176.99 2cqx h GLU 36 N 2.06 0.10 -0.75 4.34 4.81 -1.98 0.58 114.58 123.74 2cqx h GLU 36 Ca -0.42 -0.01 0.17 0.00 -0.13 0.00 0.00 59.36 58.98 2cqx h GLU 36 Cb 1.25 -0.02 -0.12 0.00 0.63 0.00 0.00 28.75 30.50 2cqx h GLU 36 CO 0.65 0.06 0.16 0.87 -0.73 0.00 0.00 179.01 180.02 2cqx h LYS 37 N 0.10 0.23 0.14 1.92 1.79 -2.00 0.22 116.57 118.97 2cqx h LYS 37 Ca 0.72 -0.01 -0.20 0.00 -2.18 0.00 0.00 60.65 58.98 2cqx h LYS 37 Cb 1.71 -0.05 0.02 0.00 -1.58 0.00 0.00 32.23 32.33 2cqx h LYS 37 CO -0.76 0.15 -0.86 -0.09 -1.08 0.00 0.00 179.45 176.81 2cqx h ARG 38 N 0.24 0.33 -0.88 3.15 2.43 -0.31 -3.30 114.38 116.04 2cqx h ARG 38 Ca 0.43 -0.55 0.19 0.00 -0.81 0.00 0.00 59.98 59.24 2cqx h ARG 38 Cb 0.75 0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 30.44 2cqx h ARG 38 CO -0.55 1.26 0.58 -0.07 -1.51 0.00 0.00 179.97 179.68 2cqx h LEU 39 N -0.31 0.46 -1.72 3.80 -0.00 -0.28 0.13 115.31 117.39 2cqx h LEU 39 Ca -0.15 0.04 0.19 0.00 -0.00 0.00 0.00 57.88 57.96 2cqx h LEU 39 Cb 1.67 -0.05 -0.05 0.00 -0.00 0.00 0.00 40.66 42.24 2cqx h LEU 39 CO 0.16 0.20 0.54 0.11 -0.00 0.00 0.00 178.44 179.45 2cqx h LYS 40 N 0.47 0.25 0.26 1.13 1.79 -0.67 0.26 116.57 120.05 2cqx h LYS 40 Ca 0.46 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.90 2cqx h LYS 40 Cb 1.04 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 2cqx h LYS 40 CO -0.18 0.16 -0.12 0.78 -1.08 0.00 0.00 179.45 179.01 2cqx h GLY 41 N 0.25 -0.36 0.21 3.86 0.00 -0.91 -3.33 103.07 102.79 2cqx h GLY 41 Ca 0.39 0.14 0.16 0.00 0.00 0.00 0.00 47.33 48.02 2cqx h GLY 41 CO -0.09 -0.13 0.55 1.41 0.00 0.00 0.00 176.54 178.28 2cqx h LEU 42 N -1.00 0.72 -0.99 3.11 3.38 -1.47 -1.13 115.31 117.94 2cqx h LEU 42 Ca -0.04 0.09 0.32 0.00 0.09 0.00 0.00 57.88 58.34 2cqx h LEU 42 Cb 0.27 -0.04 -0.18 0.00 0.09 0.00 0.00 40.66 40.80 2cqx h LEU 42 CO 0.06 0.29 0.21 -1.28 0.09 0.00 0.00 178.44 177.81 2cqx h SER 43 N 0.75 -0.18 0.16 -0.43 0.87 -1.06 0.18 113.55 113.84 2cqx h SER 43 Ca 0.53 0.27 -0.30 0.00 -1.23 0.00 0.00 61.79 61.05 2cqx h SER 43 Cb 0.75 0.40 0.01 0.00 -0.44 0.00 0.00 62.40 63.12 2cqx h SER 43 CO -0.36 -0.37 -1.51 0.50 -0.53 0.00 0.00 176.83 174.57 2cqx h LYS 44 N 0.02 0.34 -0.16 2.24 3.64 -1.36 0.78 116.57 122.06 2cqx h LYS 44 Ca 0.68 -0.57 0.03 0.00 -1.27 0.00 0.00 60.65 59.51 2cqx h LYS 44 Cb 1.55 0.21 -0.06 0.00 -0.41 0.00 0.00 32.23 33.52 2cqx h LYS 44 CO -0.85 1.27 -0.48 0.37 -2.27 0.00 0.00 179.45 177.49 2cqx h GLN 45 N -0.11 -0.47 -0.96 1.90 4.15 -0.02 -1.30 115.11 118.30 2cqx h GLN 45 Ca -0.30 0.03 -0.42 0.00 0.77 0.00 0.00 58.65 58.72 2cqx h GLN 45 Cb 1.92 0.11 -0.25 0.00 0.21 0.00 0.00 27.48 29.46 2cqx h GLN 45 CO 0.13 -0.31 0.54 1.28 -1.93 0.00 0.00 178.83 178.54 2cqx n LEU 46 N -5.08 6.29 -4.19 -2.39 4.77 0.02 -4.90 117.00 111.53 2cqx n LEU 46 Ca -0.05 -3.34 -0.38 0.00 -0.03 0.00 0.00 56.01 52.21 2cqx n LEU 46 Cb 0.33 -0.79 -0.07 0.00 -2.33 0.00 0.00 43.42 40.55 2cqx n LEU 46 CO 0.06 0.96 -0.14 -0.67 -1.33 0.00 0.00 177.39 176.27 2cqx n ASP 47 N -0.84 -1.62 -3.43 -1.43 2.03 -0.49 -4.88 116.55 105.89 2cqx n ASP 47 Ca 0.51 -1.09 -0.12 0.00 0.52 0.00 0.00 54.79 54.62 2cqx n ASP 47 Cb 1.52 -1.42 0.01 0.00 -0.72 0.00 0.00 41.12 40.52 2cqx n ASP 47 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 2cqx n TRP 48 N -3.65 -1.67 -4.44 -0.67 7.02 0.27 -4.96 117.44 109.33 2cqx n TRP 48 Ca 0.11 -1.11 -0.30 0.00 -1.02 0.00 0.00 57.50 55.17 2cqx n TRP 48 Cb 0.40 -0.24 -0.11 0.00 -2.42 0.00 0.00 31.31 28.93 2cqx n TRP 48 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2cqx s SER 49 N -2.67 4.07 0.34 -0.99 0.15 -1.26 -4.41 113.70 108.93 2cqx s SER 49 Ca 0.21 -0.41 0.14 0.00 0.70 0.00 0.00 55.95 56.59 2cqx s SER 49 Cb -0.02 -0.71 1.08 0.00 -1.71 0.00 0.00 66.02 64.66 2cqx s SER 49 CO 0.13 0.22 1.66 1.62 1.20 0.00 0.00 173.24 178.08 2cqx h VAL 50 N 3.66 0.30 0.03 4.45 3.04 -1.93 0.15 116.25 125.95 2cqx h VAL 50 Ca -0.49 -0.11 -0.00 0.00 -1.01 0.00 0.00 66.70 65.09 2cqx h VAL 50 Cb 1.16 -0.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.39 2cqx h VAL 50 CO 0.49 0.06 -0.02 0.08 -1.01 0.00 0.00 177.57 177.17 2cqx h ARG 51 N 0.32 -0.04 -0.53 4.17 0.11 -1.98 -3.03 114.38 113.41 2cqx h ARG 51 Ca 0.73 0.00 0.11 0.00 0.10 0.00 0.00 59.98 60.92 2cqx h ARG 51 Cb 1.66 0.01 -0.10 0.00 1.11 0.00 0.00 29.97 32.64 2cqx h ARG 51 CO -0.61 0.65 -0.14 -0.22 0.10 0.00 0.00 179.97 179.75 2cqx h LYS 52 N -0.84 -0.01 0.48 0.08 3.64 -1.50 -2.25 116.57 116.17 2cqx h LYS 52 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2cqx h LYS 52 Cb 0.71 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 2cqx h LYS 52 CO 0.01 -0.01 -0.44 0.82 -2.27 0.00 0.00 179.45 177.56 2cqx h ILE 53 N -0.01 0.12 -0.99 2.00 2.04 -0.89 -2.48 117.51 117.30 2cqx h ILE 53 Ca 0.25 0.00 0.29 0.00 1.00 0.00 0.00 64.86 66.40 2cqx h ILE 53 Cb 0.39 0.12 -0.18 0.00 -0.74 0.00 0.00 36.82 36.41 2cqx h ILE 53 CO -0.55 0.00 0.09 1.56 0.00 0.00 0.00 178.15 179.25 2cqx h GLN 54 N -0.92 0.01 -0.63 2.37 4.20 -1.29 0.75 115.11 119.61 2cqx h GLN 54 Ca -0.05 -0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.76 2cqx h GLN 54 Cb 0.80 -0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.50 2cqx h GLN 54 CO -0.04 0.01 0.22 0.00 -0.67 0.00 0.00 178.83 178.34 2cqx h TRP 56 N 0.39 0.93 0.67 0.00 7.01 0.62 -2.33 115.95 123.24 2cqx h TRP 56 Ca 0.32 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.32 2cqx h TRP 56 Cb 0.43 -0.30 -0.00 0.00 -2.10 0.00 0.00 29.16 27.18 2cqx h TRP 56 CO -0.18 0.51 -0.39 0.74 -2.79 0.00 0.00 178.44 176.33 2cqx h PHE 57 N 0.95 -1.03 -0.44 2.65 -1.00 -0.82 -2.51 116.94 114.74 2cqx h PHE 57 Ca 0.33 -0.01 0.09 0.00 2.81 0.00 0.00 57.97 61.18 2cqx h PHE 57 Cb 0.06 0.36 -0.10 0.00 3.61 0.00 0.00 35.95 39.89 2cqx h PHE 57 CO -0.03 -0.60 -0.33 0.00 -1.61 0.00 0.00 178.31 175.74 2cqx h ARG 58 N -0.99 -0.22 -0.92 1.51 3.08 -1.21 0.38 114.38 116.01 2cqx h ARG 58 Ca -0.09 0.02 0.26 0.00 0.07 0.00 0.00 59.98 60.24 2cqx h ARG 58 Cb 0.79 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.85 2cqx h ARG 58 CO 0.10 -0.15 0.65 1.25 -1.07 0.00 0.00 179.97 180.75 2cqx h HIS 59 N -0.23 0.10 0.44 3.04 2.76 -1.32 -2.32 115.15 117.62 2cqx h HIS 59 Ca 0.19 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.34 2cqx h HIS 59 Cb 0.54 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.47 2cqx h HIS 59 CO -0.56 0.02 -0.21 -0.09 -1.30 0.00 0.00 177.93 175.79 2cqx h ARG 60 N 0.07 -0.56 -1.15 5.26 9.65 0.21 0.52 114.38 128.38 2cqx h ARG 60 Ca 0.45 0.04 0.40 0.00 -1.10 0.00 0.00 59.98 59.76 2cqx h ARG 60 Cb 1.67 0.13 -0.11 0.00 -1.39 0.00 0.00 29.97 30.26 2cqx h ARG 60 CO -0.04 -0.38 0.74 0.54 2.80 0.00 0.00 179.97 183.63 2cqx n ARG 61 N -3.87 -0.03 0.10 0.20 1.74 -0.88 0.22 116.66 114.15 2cqx n ARG 61 Ca -0.07 1.03 -0.24 0.00 -0.77 0.00 0.00 57.85 57.80 2cqx n ARG 61 Cb 0.23 -2.03 -0.15 0.00 -1.02 0.00 0.00 32.46 29.48 2cqx n ARG 61 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 2cqx h ASN 62 N 0.00 0.70 0.51 0.55 -1.24 -1.47 -3.33 115.58 111.30 2cqx h ASN 62 Ca 0.73 -0.93 -0.02 0.00 0.71 0.00 0.00 56.30 56.79 2cqx h ASN 62 Cb 2.36 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 41.16 2cqx h ASN 62 CO -0.38 1.72 -0.39 -0.61 -1.29 0.00 0.00 177.43 176.48 2cqx h GLN 63 N 0.06 -0.86 -1.17 6.67 4.15 0.51 -2.12 115.11 122.35 2cqx h GLN 63 Ca -0.29 0.06 0.37 0.00 0.77 0.00 0.00 58.65 59.55 2cqx h GLN 63 Cb 2.08 0.19 -0.13 0.00 0.21 0.00 0.00 27.48 29.84 2cqx h GLN 63 CO 0.21 -0.57 0.73 0.22 -1.93 0.00 0.00 178.83 177.49 2cqx h ASP 64 N -0.89 0.35 -3.40 -0.69 3.58 -1.28 -2.84 116.42 111.26 2cqx h ASP 64 Ca -0.06 0.14 -0.64 0.00 0.42 0.00 0.00 57.03 56.89 2cqx h ASP 64 Cb 0.75 0.11 -0.40 0.00 1.72 0.00 0.00 39.33 41.51 2cqx h ASP 64 CO 0.01 -0.12 -0.48 -0.75 -2.88 0.00 0.00 179.24 175.02 2cqx s LYS 65 N -5.43 2.56 0.00 0.28 2.20 -0.81 -4.90 119.74 113.64 2cqx s LYS 65 Ca -0.08 -3.19 0.15 0.00 -0.36 0.00 0.00 55.97 52.48 2cqx s LYS 65 Cb 0.29 -3.53 0.70 0.00 -1.51 0.00 0.00 37.83 33.78 2cqx s LYS 65 CO 0.81 -1.25 1.43 -0.35 -0.36 0.00 0.00 175.35 175.62 2cqx n PRO 66 N 2.28 0.14 -1.35 4.03 -0.04 -1.07 -4.81 135.00 134.18 2cqx n PRO 66 Ca 0.17 0.18 -0.53 0.00 -0.04 0.00 0.00 63.50 63.28 2cqx n PRO 66 Cb 0.35 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.20 2cqx n PRO 66 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cqx n SER 67 N -1.36 1.06 0.08 3.54 2.88 -1.26 -4.37 113.62 114.19 2cqx n SER 67 Ca 0.06 0.48 0.00 0.00 -1.33 0.00 0.00 58.87 58.08 2cqx n SER 67 Cb 0.13 -1.02 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 2cqx n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqx n GLY 68 N 7.03 -1.83 0.00 0.46 0.00 -1.26 -4.93 105.19 104.66 2cqx n GLY 68 Ca 0.53 0.45 0.07 0.00 0.00 0.00 0.00 46.02 47.07 2cqx n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cqx n PRO 69 N -2.77 0.49 -2.30 1.61 -0.04 -1.26 -4.84 135.00 125.90 2cqx n PRO 69 Ca 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.41 2cqx n PRO 69 Cb 0.00 -1.44 0.02 0.00 -0.04 0.00 0.00 33.50 32.04 2cqx n PRO 69 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cqx n SER 70 N -0.94 -2.34 -4.07 3.54 2.88 -1.26 -5.07 113.62 106.35 2cqx n SER 70 Ca 0.10 -0.18 -0.17 0.00 -1.33 0.00 0.00 58.87 57.29 2cqx n SER 70 Cb 0.05 -1.80 -0.13 0.00 -0.75 0.00 0.00 64.21 61.58 2cqx n SER 70 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cqx s SER 71 N -3.31 1.16 0.00 -3.46 0.15 -1.26 -5.20 113.70 101.78 2cqx s SER 71 Ca 0.03 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.30 2cqx s SER 71 Cb -0.00 -0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.25 2cqx s SER 71 CO 0.20 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.23