#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 4.76 -0.66 1.61 0.15 -1.26 -5.04 113.70 113.26 2cqx s SER 2 Ca 0.00 0.72 -0.00 0.00 0.70 0.00 0.00 55.95 57.37 2cqx s SER 2 Cb 0.00 -1.32 0.17 0.00 -1.71 0.00 0.00 66.02 63.15 2cqx s SER 2 CO 0.00 -1.71 0.47 -0.44 1.20 0.00 0.00 173.24 172.76 2cqx s SER 3 N -4.52 5.10 0.00 5.45 0.01 -1.26 -4.73 113.70 113.75 2cqx s SER 3 Ca 0.61 -3.17 0.00 0.00 1.31 0.00 0.00 55.95 54.70 2cqx s SER 3 Cb -0.11 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.33 2cqx s SER 3 CO 0.48 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.47 2cqx n GLY 4 N 3.01 3.24 3.67 3.44 0.00 -1.26 -5.09 105.19 112.20 2cqx n GLY 4 Ca 0.11 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 2cqx n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqx s SER 5 N 0.00 6.89 -0.22 1.61 1.04 -1.26 -4.97 113.70 116.78 2cqx s SER 5 Ca 0.00 1.90 -0.29 0.00 0.48 0.00 0.00 55.95 58.04 2cqx s SER 5 Cb 0.00 -2.54 0.15 0.00 0.10 0.00 0.00 66.02 63.73 2cqx s SER 5 CO 0.00 -0.76 1.15 -0.94 0.98 0.00 0.00 173.24 173.68 2cqx s SER 6 N 2.14 -0.24 -0.09 7.02 1.04 -1.26 -4.73 113.70 117.58 2cqx s SER 6 Ca 0.60 0.30 -0.06 0.00 0.48 0.00 0.00 55.95 57.27 2cqx s SER 6 Cb -0.26 0.24 0.03 0.00 0.10 0.00 0.00 66.02 66.13 2cqx s SER 6 CO 0.21 -0.20 0.23 -0.83 0.98 0.00 0.00 173.24 173.63 2cqx s GLY 7 N -0.89 -0.15 -0.30 7.32 0.00 -1.26 -5.14 107.32 106.89 2cqx s GLY 7 Ca 0.03 0.81 -0.16 0.00 0.00 0.00 0.00 44.72 45.39 2cqx s GLY 7 CO -0.03 0.89 1.26 -0.32 0.00 0.00 0.00 173.10 174.90 2cqx s GLY 8 N 0.69 0.60 -0.80 0.20 0.00 -1.26 -5.10 107.32 101.65 2cqx s GLY 8 Ca -0.05 3.83 -0.15 0.00 0.00 0.00 0.00 44.72 48.35 2cqx s GLY 8 CO -0.04 2.83 0.77 -0.42 0.00 0.00 0.00 173.10 176.25 2cqx s ILE 9 N 1.14 5.46 -0.16 0.90 1.01 -1.26 -5.02 121.20 123.27 2cqx s ILE 9 Ca -0.07 -2.24 -0.00 0.00 0.00 0.00 0.00 60.65 58.33 2cqx s ILE 9 Cb -0.02 -4.49 -0.00 0.00 0.01 0.00 0.00 42.46 37.96 2cqx s ILE 9 CO -0.10 -1.06 -0.14 -0.54 0.00 0.00 0.00 174.94 173.10 2cqx s LYS 10 N 0.63 3.25 -0.81 2.79 3.01 -1.26 -5.07 119.74 122.29 2cqx s LYS 10 Ca 0.18 -0.73 -0.25 0.00 -1.01 0.00 0.00 55.97 54.16 2cqx s LYS 10 Cb -0.12 -2.68 0.04 0.00 -1.01 0.00 0.00 37.83 34.06 2cqx s LYS 10 CO -0.07 -0.00 1.29 0.34 0.51 0.00 0.00 175.35 177.41 2cqx s ASP 11 N 0.88 6.26 -0.11 2.83 2.15 -1.26 -4.95 116.67 122.46 2cqx s ASP 11 Ca -0.04 -0.80 -0.18 0.00 0.43 0.00 0.00 52.55 51.97 2cqx s ASP 11 Cb -0.15 -2.54 0.04 0.00 -0.30 0.00 0.00 42.92 39.97 2cqx s ASP 11 CO -0.01 -1.70 0.46 -0.44 -0.17 0.00 0.00 175.17 173.31 2cqx s SER 12 N 4.03 -0.43 -0.76 -0.34 0.01 -1.26 -5.10 113.70 109.85 2cqx s SER 12 Ca 0.36 0.68 -0.26 0.00 1.31 0.00 0.00 55.95 58.05 2cqx s SER 12 Cb -0.07 0.72 -0.03 0.00 0.21 0.00 0.00 66.02 66.85 2cqx s SER 12 CO 0.08 -0.30 1.90 -2.16 0.41 0.00 0.00 173.24 173.17 2cqx s PRO 13 N -0.39 2.59 0.42 12.44 0.04 -1.26 -4.95 135.00 143.89 2cqx s PRO 13 Ca -0.05 0.15 -0.26 0.00 0.04 0.00 0.00 61.00 60.88 2cqx s PRO 13 Cb -0.03 -4.73 -0.10 0.00 0.04 0.00 0.00 34.50 29.68 2cqx s PRO 13 CO 0.03 -3.06 1.35 1.33 0.04 0.00 0.00 177.00 176.69 2cqx n VAL 14 N 7.54 2.54 -0.11 -0.36 0.24 -1.26 -4.95 118.33 121.97 2cqx n VAL 14 Ca 0.30 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.34 61.88 2cqx n VAL 14 Cb 0.49 -1.70 -0.10 0.00 -1.47 0.00 0.00 33.84 31.07 2cqx n VAL 14 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2cqx n ASN 15 N 0.14 1.89 -4.06 -1.34 3.02 -1.26 -4.82 115.26 108.83 2cqx n ASN 15 Ca 0.05 0.41 -0.33 0.00 -0.03 0.00 0.00 54.58 54.69 2cqx n ASN 15 Cb 0.40 -0.91 -0.14 0.00 -0.61 0.00 0.00 39.78 38.52 2cqx n ASN 15 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2cqx s LYS 16 N -2.42 1.68 0.04 3.52 0.00 -1.26 -5.01 119.74 116.29 2cqx s LYS 16 Ca -0.31 -1.84 -0.08 0.00 0.00 0.00 0.00 55.97 53.74 2cqx s LYS 16 Cb 0.08 -3.33 -0.02 0.00 0.00 0.00 0.00 37.83 34.57 2cqx s LYS 16 CO 0.53 -0.97 0.83 1.55 0.00 0.00 0.00 175.35 177.28 2cqx n VAL 17 N 4.37 -0.17 -3.75 1.79 3.14 -1.26 -4.73 118.33 117.72 2cqx n VAL 17 Ca 0.01 1.27 -0.10 0.00 -2.96 0.00 0.00 64.34 62.56 2cqx n VAL 17 Cb 0.42 -1.63 -0.05 0.00 -1.06 0.00 0.00 33.84 31.52 2cqx n VAL 17 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2cqx s GLU 18 N -3.87 1.18 0.00 1.45 2.02 -1.26 -5.02 118.70 113.20 2cqx s GLU 18 Ca -0.03 -0.87 0.10 0.00 0.02 0.00 0.00 54.97 54.19 2cqx s GLU 18 Cb 0.03 0.46 0.58 0.00 0.10 0.00 0.00 34.13 35.30 2cqx s GLU 18 CO 0.16 -0.47 1.02 -0.35 0.02 0.00 0.00 175.26 175.65 2cqx n PRO 19 N -0.25 0.49 -0.31 0.39 -0.04 -1.26 -3.28 135.00 130.74 2cqx n PRO 19 Ca -0.12 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.31 2cqx n PRO 19 Cb 0.63 -1.31 0.08 0.00 -0.04 0.00 0.00 33.50 32.86 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 -0.81 2.85 -0.32 3.54 5.03 -1.26 -4.45 115.26 119.84 2cqx n ASN 20 Ca 0.07 -2.38 0.21 0.00 0.87 0.00 0.00 54.58 53.35 2cqx n ASN 20 Cb 0.03 -0.58 0.42 0.00 -1.02 0.00 0.00 39.78 38.63 2cqx n ASN 20 CO 0.00 0.00 0.00 -0.78 -1.83 0.00 0.00 177.26 174.65 2cqx h ASP 21 N 0.66 0.28 -0.99 6.41 3.58 -2.01 0.55 116.42 124.90 2cqx h ASP 21 Ca 0.10 0.20 0.34 0.00 0.42 0.00 0.00 57.03 58.10 2cqx h ASP 21 Cb 1.28 0.21 -0.10 0.00 1.72 0.00 0.00 39.33 42.44 2cqx h ASP 21 CO 0.24 -0.18 0.64 0.41 -2.88 0.00 0.00 179.24 177.47 2cqx n THR 22 N -5.15 -0.17 -0.01 2.25 -1.04 -1.26 0.23 114.28 109.12 2cqx n THR 22 Ca 0.29 1.27 -0.12 0.00 -2.04 0.00 0.00 64.05 63.45 2cqx n THR 22 Cb 0.91 -2.09 -0.08 0.00 -1.82 0.00 0.00 70.33 67.25 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 0.10 -1.30 -4.42 4.07 -1.27 -2.93 115.31 109.56 2cqx h LEU 23 Ca 0.63 -0.29 0.40 0.00 0.08 0.00 0.00 57.88 58.70 2cqx h LEU 23 Cb 2.04 -0.03 -0.08 0.00 1.08 0.00 0.00 40.66 43.67 2cqx h LEU 23 CO -0.32 0.36 0.90 1.21 -1.08 0.00 0.00 178.44 179.51 2cqx n GLU 24 N -4.88 -0.01 -0.01 1.13 2.13 0.61 -0.30 120.64 119.31 2cqx n GLU 24 Ca -0.07 0.87 -0.00 0.00 0.66 0.00 0.00 57.16 58.62 2cqx n GLU 24 Cb 0.18 -1.88 -0.00 0.00 0.27 0.00 0.00 31.44 30.01 2cqx n GLU 24 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2cqx h LYS 25 N 0.00 -0.01 -1.15 5.31 1.57 -1.57 -3.33 116.57 117.39 2cqx h LYS 25 Ca 0.69 0.00 0.36 0.00 -1.87 0.00 0.00 60.65 59.84 2cqx h LYS 25 Cb 2.55 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 34.73 2cqx h LYS 25 CO -0.16 -0.01 0.72 -0.24 -0.57 0.00 0.00 179.45 179.19 2cqx h VAL 26 N -0.22 0.26 -0.63 0.50 3.04 -0.91 0.76 116.25 119.05 2cqx h VAL 26 Ca -0.00 -0.08 0.12 0.00 -1.01 0.00 0.00 66.70 65.74 2cqx h VAL 26 Cb 0.01 0.02 -0.09 0.00 -2.01 0.00 0.00 31.29 29.21 2cqx h VAL 26 CO 0.00 0.04 0.12 0.15 -1.01 0.00 0.00 177.57 176.87 2cqx h PHE 27 N 0.22 0.18 -0.36 3.17 3.04 -0.73 0.34 116.94 122.80 2cqx h PHE 27 Ca 0.74 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.73 2cqx h PHE 27 Cb 2.06 0.02 0.00 0.00 2.56 0.00 0.00 35.95 40.58 2cqx h PHE 27 CO -0.01 -0.06 0.00 1.55 -2.02 0.00 0.00 178.31 177.78 2cqx n VAL 28 N -5.15 0.71 -0.12 1.41 3.14 0.11 -0.08 118.33 118.34 2cqx n VAL 28 Ca 0.10 -0.86 -0.25 0.00 -2.96 0.00 0.00 64.34 60.37 2cqx n VAL 28 Cb 0.35 0.74 -0.09 0.00 -1.06 0.00 0.00 33.84 33.78 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 0.95 1.83 -0.07 6.55 2.88 0.22 -4.84 113.62 121.14 2cqx n SER 29 Ca 0.15 0.24 -0.13 0.00 -1.33 0.00 0.00 58.87 57.79 2cqx n SER 29 Cb 0.48 -0.68 -0.06 0.00 -0.75 0.00 0.00 64.21 63.20 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 -3.97 0.82 -3.63 2.46 0.24 0.11 -5.00 118.33 109.35 2cqx n VAL 30 Ca -0.48 -0.26 -0.05 0.00 -2.04 0.00 0.00 64.34 61.51 2cqx n VAL 30 Cb 0.86 -1.34 -0.06 0.00 -1.47 0.00 0.00 33.84 31.84 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 -2.28 0.00 0.12 3.34 -1.32 -0.53 -5.04 115.64 109.93 2cqx s THR 31 Ca -0.20 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.27 2cqx s THR 31 Cb 0.06 -1.00 -0.21 0.00 -1.51 0.00 0.00 72.50 69.85 2cqx s THR 31 CO 0.30 0.00 1.27 0.11 -2.21 0.00 0.00 174.62 174.09 2cqx h LYS 32 N 3.04 0.27 -3.30 7.08 1.57 -0.73 -3.30 116.57 121.19 2cqx h LYS 32 Ca -0.22 -0.35 -0.68 0.00 -1.87 0.00 0.00 60.65 57.53 2cqx h LYS 32 Cb 1.19 0.11 -0.37 0.00 0.08 0.00 0.00 32.23 33.24 2cqx h LYS 32 CO 0.19 1.09 -0.25 0.71 -0.57 0.00 0.00 179.45 180.61 2cqx s TYR 33 N -3.01 3.74 0.89 -1.35 1.51 -1.26 -4.91 117.35 112.96 2cqx s TYR 33 Ca -0.04 -3.07 -0.11 0.00 -1.01 0.00 0.00 57.07 52.84 2cqx s TYR 33 Cb 0.09 -3.10 0.12 0.00 -0.11 0.00 0.00 41.96 38.96 2cqx s TYR 33 CO 0.86 -0.71 1.09 -1.25 -1.11 0.00 0.00 175.55 174.43 2cqx s PRO 34 N -1.18 1.31 0.39 -1.71 0.04 -1.26 -5.08 135.00 127.51 2cqx s PRO 34 Ca 0.25 0.84 0.07 0.00 0.04 0.00 0.00 61.00 62.20 2cqx s PRO 34 Cb -0.09 -1.81 -0.08 0.00 0.04 0.00 0.00 34.50 32.56 2cqx s PRO 34 CO -0.12 -2.21 0.01 -0.51 0.04 0.00 0.00 177.00 174.21 2cqx s ASP 35 N -3.41 3.63 0.24 6.66 1.11 -1.26 -4.99 116.67 118.65 2cqx s ASP 35 Ca 0.63 -1.35 -0.11 0.00 0.18 0.00 0.00 52.55 51.90 2cqx s ASP 35 Cb -0.18 -0.35 0.34 0.00 1.07 0.00 0.00 42.92 43.80 2cqx s ASP 35 CO 0.57 -0.45 1.44 1.21 1.18 0.00 0.00 175.17 179.12 2cqx n GLU 36 N -0.91 -0.14 -0.32 8.23 4.07 -1.26 -0.50 120.64 129.81 2cqx n GLU 36 Ca -0.05 1.43 -0.06 0.00 -0.06 0.00 0.00 57.16 58.43 2cqx n GLU 36 Cb 0.67 -2.13 -0.04 0.00 -0.06 0.00 0.00 31.44 29.88 2cqx n GLU 36 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2cqx n LYS 37 N -5.44 -0.29 0.05 5.31 5.02 -1.26 -0.38 118.16 121.17 2cqx n LYS 37 Ca 0.12 1.20 -0.13 0.00 -2.02 0.00 0.00 58.31 57.49 2cqx n LYS 37 Cb 0.42 -1.78 -0.09 0.00 -0.02 0.00 0.00 35.03 33.57 2cqx n LYS 37 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2cqx h ARG 38 N 0.00 -0.12 -1.15 1.97 2.43 -1.19 -3.05 114.38 113.27 2cqx h ARG 38 Ca 0.18 0.01 0.39 0.00 -0.81 0.00 0.00 59.98 59.75 2cqx h ARG 38 Cb 0.38 0.03 -0.14 0.00 -0.42 0.00 0.00 29.97 29.82 2cqx h ARG 38 CO -0.76 0.23 0.70 -0.07 -1.51 0.00 0.00 179.97 178.57 2cqx h LEU 39 N -0.48 0.35 -0.65 3.80 -0.00 -0.00 0.35 115.31 118.67 2cqx h LEU 39 Ca -0.01 0.17 0.14 0.00 -0.00 0.00 0.00 57.88 58.18 2cqx h LEU 39 Cb 0.40 0.15 -0.11 0.00 -0.00 0.00 0.00 40.66 41.10 2cqx h LEU 39 CO 0.02 -0.20 0.00 0.11 -0.00 0.00 0.00 178.44 178.38 2cqx h LYS 40 N 0.16 0.11 0.49 1.13 1.79 -0.59 0.24 116.57 119.90 2cqx h LYS 40 Ca 0.79 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 59.23 2cqx h LYS 40 Cb 2.19 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 32.82 2cqx h LYS 40 CO -0.53 0.08 -0.23 0.78 -1.08 0.00 0.00 179.45 178.46 2cqx h GLY 41 N 0.12 -0.68 -0.39 3.86 0.00 -0.44 -3.14 103.07 102.40 2cqx h GLY 41 Ca 0.35 0.25 0.32 0.00 0.00 0.00 0.00 47.33 48.25 2cqx h GLY 41 CO -0.56 -0.25 0.76 1.41 0.00 0.00 0.00 176.54 177.90 2cqx h LEU 42 N -0.87 0.28 -0.84 3.11 3.38 -1.41 0.29 115.31 119.25 2cqx h LEU 42 Ca -0.07 0.07 0.14 0.00 0.09 0.00 0.00 57.88 58.11 2cqx h LEU 42 Cb 0.50 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.19 2cqx h LEU 42 CO 0.11 0.02 0.44 -1.28 0.09 0.00 0.00 178.44 177.81 2cqx h SER 43 N 0.23 0.54 0.09 -0.43 0.87 -0.47 -0.16 113.55 114.23 2cqx h SER 43 Ca 0.63 0.09 -0.27 0.00 -1.23 0.00 0.00 61.79 61.00 2cqx h SER 43 Cb 1.93 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.88 2cqx h SER 43 CO -0.23 0.24 -1.41 0.11 -0.53 0.00 0.00 176.83 175.00 2cqx h LYS 44 N 0.64 0.20 -0.35 2.24 1.57 -0.55 0.73 116.57 121.05 2cqx h LYS 44 Ca 0.45 -0.34 0.07 0.00 -1.87 0.00 0.00 60.65 58.96 2cqx h LYS 44 Cb 0.61 0.13 -0.09 0.00 0.08 0.00 0.00 32.23 32.96 2cqx h LYS 44 CO -0.35 1.16 -0.36 0.37 -0.57 0.00 0.00 179.45 179.71 2cqx h GLN 45 N -0.39 -0.29 -0.81 3.15 4.15 -0.79 -0.75 115.11 119.38 2cqx h GLN 45 Ca -0.32 0.02 -0.36 0.00 0.77 0.00 0.00 58.65 58.77 2cqx h GLN 45 Cb 1.70 0.07 -0.21 0.00 0.21 0.00 0.00 27.48 29.24 2cqx h GLN 45 CO 0.02 -0.19 0.42 1.28 -1.93 0.00 0.00 178.83 178.42 2cqx n LEU 46 N -5.42 6.14 -3.86 -2.39 4.77 -0.09 -4.92 117.00 111.23 2cqx n LEU 46 Ca -0.00 -3.48 -0.29 0.00 -0.03 0.00 0.00 56.01 52.21 2cqx n LEU 46 Cb 0.34 -0.78 -0.07 0.00 -2.33 0.00 0.00 43.42 40.59 2cqx n LEU 46 CO 0.07 0.98 -0.23 -0.67 -1.33 0.00 0.00 177.39 176.21 2cqx n ASP 47 N -0.78 -0.45 -3.90 -1.43 2.03 -0.29 -4.88 116.55 106.86 2cqx n ASP 47 Ca 0.49 -0.97 -0.18 0.00 0.52 0.00 0.00 54.79 54.65 2cqx n ASP 47 Cb 1.48 -1.22 -0.00 0.00 -0.72 0.00 0.00 41.12 40.66 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 -3.46 -0.76 -4.38 -0.67 7.02 0.25 -4.97 117.44 110.47 2cqx n TRP 48 Ca -0.06 -1.58 -0.33 0.00 -1.02 0.00 0.00 57.50 54.51 2cqx n TRP 48 Cb 0.43 -0.30 -0.10 0.00 -2.42 0.00 0.00 31.31 28.93 2cqx n TRP 48 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 2cqx s SER 49 N -3.15 4.93 0.47 -0.99 0.01 -1.26 -4.47 113.70 109.25 2cqx s SER 49 Ca 0.19 -0.04 0.32 0.00 1.31 0.00 0.00 55.95 57.73 2cqx s SER 49 Cb -0.02 -1.25 1.42 0.00 0.21 0.00 0.00 66.02 66.38 2cqx s SER 49 CO 0.12 0.30 1.71 1.62 0.41 0.00 0.00 173.24 177.40 2cqx h VAL 50 N 3.74 0.30 0.00 3.43 3.04 -1.93 0.40 116.25 125.23 2cqx h VAL 50 Ca -0.49 -0.05 -0.03 0.00 -1.01 0.00 0.00 66.70 65.12 2cqx h VAL 50 Cb 1.17 0.15 -0.01 0.00 -2.01 0.00 0.00 31.29 30.60 2cqx h VAL 50 CO 0.55 0.02 -0.23 0.03 -1.01 0.00 0.00 177.57 176.94 2cqx h ARG 51 N 0.13 0.00 -0.92 4.17 -0.00 -1.97 -3.10 114.38 112.69 2cqx h ARG 51 Ca 0.70 0.00 0.24 0.00 -0.50 0.00 0.00 59.98 60.42 2cqx h ARG 51 Cb 2.36 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 32.20 2cqx h ARG 51 CO -0.21 0.63 0.41 -0.22 0.00 0.00 0.00 179.97 180.58 2cqx h LYS 52 N -1.00 0.37 0.24 0.04 3.64 -1.56 -0.94 116.57 117.36 2cqx h LYS 52 Ca -0.05 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2cqx h LYS 52 Cb 0.72 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 2cqx h LYS 52 CO -0.03 0.24 -0.12 0.82 -2.27 0.00 0.00 179.45 178.10 2cqx h ILE 53 N 0.38 0.82 -0.90 2.00 2.04 -1.12 -3.17 117.51 117.56 2cqx h ILE 53 Ca 0.59 -0.51 0.17 0.00 1.00 0.00 0.00 64.86 66.10 2cqx h ILE 53 Cb 1.15 1.12 -0.17 0.00 -0.74 0.00 0.00 36.82 38.18 2cqx h ILE 53 CO -0.55 0.11 -0.26 1.56 0.00 0.00 0.00 178.15 179.01 2cqx h GLN 54 N -0.59 -0.01 -0.83 2.37 1.08 -1.10 0.64 115.11 116.66 2cqx h GLN 54 Ca -0.03 0.00 0.16 0.00 -1.45 0.00 0.00 58.65 57.33 2cqx h GLN 54 Cb 0.43 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 27.76 2cqx h GLN 54 CO 0.05 -0.01 0.40 0.00 -0.95 0.00 0.00 178.83 178.32 2cqx h TRP 56 N 0.54 -0.04 -0.62 0.00 7.01 0.29 -1.21 115.95 121.92 2cqx h TRP 56 Ca 0.47 0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.58 2cqx h TRP 56 Cb 0.71 0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.77 2cqx h TRP 56 CO -0.12 -0.03 0.42 0.74 -2.79 0.00 0.00 178.44 176.66 2cqx h PHE 57 N 0.01 0.44 -0.25 2.65 0.04 -0.76 0.49 116.94 119.57 2cqx h PHE 57 Ca 0.04 0.01 -0.15 0.00 2.80 0.00 0.00 57.97 60.68 2cqx h PHE 57 Cb 0.06 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.07 2cqx h PHE 57 CO -0.14 0.21 -0.43 0.00 -0.60 0.00 0.00 178.31 177.35 2cqx h ARG 58 N 0.41 0.72 -0.41 1.51 3.08 -0.66 -3.23 114.38 115.80 2cqx h ARG 58 Ca 0.29 -0.45 -0.10 0.00 0.07 0.00 0.00 59.98 59.79 2cqx h ARG 58 Cb 0.58 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 2cqx h ARG 58 CO -0.08 1.07 -0.12 1.25 -1.07 0.00 0.00 179.97 181.02 2cqx h HIS 59 N 0.45 0.92 -0.49 3.04 2.76 -0.12 -3.28 115.15 118.43 2cqx h HIS 59 Ca 0.02 -0.21 0.05 0.00 -2.20 0.00 0.00 60.37 58.03 2cqx h HIS 59 Cb 1.03 -0.22 -0.07 0.00 1.55 0.00 0.00 27.41 29.70 2cqx h HIS 59 CO 0.08 0.94 -0.42 -0.09 -1.30 0.00 0.00 177.93 177.15 2cqx h ARG 60 N 0.63 -0.15 -0.81 5.26 9.65 -0.97 -1.12 114.38 126.87 2cqx h ARG 60 Ca 0.10 0.01 0.09 0.00 -1.10 0.00 0.00 59.98 59.08 2cqx h ARG 60 Cb 0.66 0.03 -0.11 0.00 -1.39 0.00 0.00 29.97 29.17 2cqx h ARG 60 CO 0.05 -0.10 -0.44 0.54 2.80 0.00 0.00 179.97 182.82 2cqx n ARG 61 N -4.64 -0.31 -0.23 0.20 1.74 -1.23 0.23 116.66 112.41 2cqx n ARG 61 Ca -0.01 1.23 0.12 0.00 -0.77 0.00 0.00 57.85 58.42 2cqx n ARG 61 Cb 0.22 -1.81 0.41 0.00 -1.02 0.00 0.00 32.46 30.26 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 0.59 0.72 0.55 -0.73 -1.37 0.17 115.58 115.51 2cqx h ASN 62 Ca 0.17 0.03 -0.08 0.00 1.87 0.00 0.00 56.30 58.29 2cqx h ASN 62 Cb 0.37 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 38.86 2cqx h ASN 62 CO -0.77 0.31 -0.38 -0.61 -0.37 0.00 0.00 177.43 175.62 2cqx h GLN 63 N 0.63 0.00 -1.53 6.67 4.15 0.37 -3.10 115.11 122.31 2cqx h GLN 63 Ca 0.41 0.00 -0.47 0.00 0.77 0.00 0.00 58.65 59.36 2cqx h GLN 63 Cb 0.70 0.00 -0.19 0.00 0.21 0.00 0.00 27.48 28.20 2cqx h GLN 63 CO -0.17 0.38 0.56 -3.47 -1.93 0.00 0.00 178.83 174.19 2cqx n ASP 64 N -3.64 6.83 -3.81 -0.69 2.03 0.60 -4.88 116.55 112.99 2cqx n ASP 64 Ca -0.01 -3.31 -0.12 0.00 0.52 0.00 0.00 54.79 51.87 2cqx n ASP 64 Cb 0.48 -1.08 -0.10 0.00 -0.72 0.00 0.00 41.12 39.70 2cqx n ASP 64 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2cqx s LYS 65 N -2.40 0.46 0.00 -0.67 -0.14 -1.17 -4.99 119.74 110.83 2cqx s LYS 65 Ca 0.46 -0.07 0.12 0.00 -1.36 0.00 0.00 55.97 55.12 2cqx s LYS 65 Cb 0.35 0.20 0.71 0.00 -1.68 0.00 0.00 37.83 37.41 2cqx s LYS 65 CO -0.08 -0.10 1.14 -0.35 -0.76 0.00 0.00 175.35 175.20 2cqx n PRO 66 N 1.96 0.49 -1.13 -1.68 -0.04 -1.26 -4.88 135.00 128.45 2cqx n PRO 66 Ca -0.19 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.83 2cqx n PRO 66 Cb 0.57 -1.38 -0.06 0.00 -0.04 0.00 0.00 33.50 32.58 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 -0.88 0.13 0.00 3.54 2.88 -1.26 -4.88 113.62 113.15 2cqx n SER 67 Ca 0.09 0.86 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 2cqx n SER 67 Cb 0.04 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 62.83 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 1.39 -1.72 0.00 0.46 0.00 -1.26 -5.01 105.19 99.05 2cqx n GLY 68 Ca 0.16 0.91 0.08 0.00 0.00 0.00 0.00 46.02 47.17 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 0.00 0.45 -4.13 1.61 -0.04 -1.26 -4.85 135.00 126.78 2cqx n PRO 69 Ca 0.00 0.02 -0.32 0.00 -0.04 0.00 0.00 63.50 63.16 2cqx n PRO 69 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2cqx n PRO 69 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2cqx n SER 70 N -1.03 -2.15 -4.65 3.54 7.64 -1.26 -4.82 113.62 110.89 2cqx n SER 70 Ca 0.11 -1.01 -0.45 0.00 1.01 0.00 0.00 58.87 58.52 2cqx n SER 70 Cb 0.06 -2.85 -0.03 0.00 -1.01 0.00 0.00 64.21 60.39 2cqx n SER 70 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2cqx n SER 71 N -2.79 2.44 0.00 6.43 3.41 -1.26 -5.36 113.62 116.49 2cqx n SER 71 Ca -0.08 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.68 2cqx n SER 71 Cb 0.57 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.13 2cqx n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49