#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqx n SER 2 N 0.00 -3.83 -4.74 1.61 7.64 -1.26 -4.97 113.62 108.07 2cqx n SER 2 Ca 0.00 -0.83 -0.32 0.00 1.01 0.00 0.00 58.87 58.73 2cqx n SER 2 Cb 0.00 -3.72 -0.08 0.00 -1.01 0.00 0.00 64.21 59.40 2cqx n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2cqx s SER 3 N -3.52 4.09 -0.08 6.43 0.15 -1.26 -5.15 113.70 114.36 2cqx s SER 3 Ca 0.54 -1.61 -0.03 0.00 0.70 0.00 0.00 55.95 55.55 2cqx s SER 3 Cb -0.27 0.37 0.05 0.00 -1.71 0.00 0.00 66.02 64.45 2cqx s SER 3 CO 0.84 -0.79 0.15 -0.83 1.20 0.00 0.00 173.24 173.82 2cqx s GLY 4 N -3.85 0.06 0.01 9.45 0.00 -1.26 -5.14 107.32 106.59 2cqx s GLY 4 Ca 0.10 0.53 0.01 0.00 0.00 0.00 0.00 44.72 45.36 2cqx s GLY 4 CO 0.05 1.64 -0.04 -0.56 0.00 0.00 0.00 173.10 174.19 2cqx s SER 5 N 2.27 0.46 0.30 1.64 0.01 -1.26 -5.16 113.70 111.96 2cqx s SER 5 Ca 0.03 -0.26 0.02 0.00 1.31 0.00 0.00 55.95 57.05 2cqx s SER 5 Cb -0.12 0.01 -0.02 0.00 0.21 0.00 0.00 66.02 66.09 2cqx s SER 5 CO -0.05 -0.09 0.30 -0.44 0.41 0.00 0.00 173.24 173.36 2cqx s SER 6 N -0.72 1.07 0.00 2.44 0.01 -1.26 -4.58 113.70 110.66 2cqx s SER 6 Ca -0.05 -1.57 0.00 0.00 1.31 0.00 0.00 55.95 55.64 2cqx s SER 6 Cb -0.05 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.72 2cqx s SER 6 CO -0.00 -1.07 0.00 0.61 0.41 0.00 0.00 173.24 173.19 2cqx n GLY 7 N -0.52 2.08 1.28 3.44 0.00 -1.26 -5.02 105.19 105.20 2cqx n GLY 7 Ca 0.04 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2cqx n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqx n GLY 8 N 0.00 -1.08 3.15 -0.02 0.00 -1.26 -5.02 105.19 100.95 2cqx n GLY 8 Ca 0.00 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 2cqx n GLY 8 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cqx s ILE 9 N -0.59 4.38 0.26 -0.61 1.01 -1.26 -5.04 121.20 119.34 2cqx s ILE 9 Ca 0.00 -3.32 0.04 0.00 0.00 0.00 0.00 60.65 57.38 2cqx s ILE 9 Cb 0.00 -3.75 -0.06 0.00 0.01 0.00 0.00 42.46 38.66 2cqx s ILE 9 CO 0.00 -1.01 -0.01 -0.75 0.00 0.00 0.00 174.94 173.18 2cqx s LYS 10 N -0.66 1.46 -0.28 2.79 2.20 -1.26 -5.15 119.74 118.83 2cqx s LYS 10 Ca 0.22 -1.75 -0.06 0.00 -0.36 0.00 0.00 55.97 54.02 2cqx s LYS 10 Cb -0.13 -0.82 0.15 0.00 -1.51 0.00 0.00 37.83 35.52 2cqx s LYS 10 CO -0.08 -0.08 0.58 0.16 -0.36 0.00 0.00 175.35 175.57 2cqx s ASP 11 N -3.38 -1.02 -0.02 1.43 -4.77 -1.26 -5.16 116.67 102.49 2cqx s ASP 11 Ca 0.30 1.15 -0.19 0.00 -3.30 0.00 0.00 52.55 50.50 2cqx s ASP 11 Cb 0.06 2.05 0.04 0.00 -1.09 0.00 0.00 42.92 43.97 2cqx s ASP 11 CO 0.11 -0.24 0.42 -0.44 0.70 0.00 0.00 175.17 175.71 2cqx s SER 12 N 2.82 -0.32 1.09 2.11 0.01 -1.26 -5.18 113.70 112.98 2cqx s SER 12 Ca 0.06 0.24 -0.08 0.00 1.31 0.00 0.00 55.95 57.48 2cqx s SER 12 Cb -0.13 0.38 0.11 0.00 0.21 0.00 0.00 66.02 66.59 2cqx s SER 12 CO -0.19 -0.51 0.41 -0.81 0.41 0.00 0.00 173.24 172.55 2cqx n PRO 13 N 1.09 -1.81 -1.30 12.44 -0.04 -1.26 -4.96 135.00 139.17 2cqx n PRO 13 Ca -0.21 -0.65 -0.25 0.00 -0.04 0.00 0.00 63.50 62.35 2cqx n PRO 13 Cb 0.57 -0.61 0.12 0.00 -0.04 0.00 0.00 33.50 33.54 2cqx n PRO 13 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2cqx n VAL 14 N -3.39 3.19 -1.67 0.52 0.24 -1.26 -5.01 118.33 110.96 2cqx n VAL 14 Ca 0.06 -2.75 -0.47 0.00 -2.04 0.00 0.00 64.34 59.13 2cqx n VAL 14 Cb 0.22 -0.80 -0.05 0.00 -1.47 0.00 0.00 33.84 31.74 2cqx n VAL 14 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2cqx n ASN 15 N -1.00 3.51 -4.73 -1.34 6.94 -1.26 -4.94 115.26 112.44 2cqx n ASN 15 Ca 0.55 0.92 -0.38 0.00 -0.02 0.00 0.00 54.58 55.65 2cqx n ASN 15 Cb 1.07 -1.39 -0.06 0.00 -2.36 0.00 0.00 39.78 37.04 2cqx n ASN 15 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 2cqx s LYS 16 N 4.30 4.32 0.22 -3.83 -2.85 -1.26 -4.98 119.74 115.66 2cqx s LYS 16 Ca 0.93 0.42 -0.09 0.00 -1.00 0.00 0.00 55.97 56.24 2cqx s LYS 16 Cb -0.65 -3.42 0.33 0.00 -2.06 0.00 0.00 37.83 32.02 2cqx s LYS 16 CO 0.50 0.19 1.70 -0.39 0.10 0.00 0.00 175.35 177.45 2cqx h VAL 17 N 4.66 0.62 -1.81 1.79 -1.51 -2.03 -3.46 116.25 114.52 2cqx h VAL 17 Ca -0.42 -0.09 0.21 0.00 -1.23 0.00 0.00 66.70 65.17 2cqx h VAL 17 Cb 1.18 0.32 -0.16 0.00 -2.13 0.00 0.00 31.29 30.51 2cqx h VAL 17 CO 0.75 0.05 0.68 -1.61 -1.23 0.00 0.00 177.57 176.21 2cqx s GLU 18 N -6.09 0.57 0.00 5.19 2.02 -1.26 -5.00 118.70 114.12 2cqx s GLU 18 Ca -0.13 -0.24 0.10 0.00 0.02 0.00 0.00 54.97 54.72 2cqx s GLU 18 Cb 0.19 0.24 0.60 0.00 0.10 0.00 0.00 34.13 35.26 2cqx s GLU 18 CO 0.74 -0.25 1.04 -0.35 0.02 0.00 0.00 175.26 176.46 2cqx n PRO 19 N -0.24 0.49 -0.50 0.39 -0.04 -1.26 -2.92 135.00 130.92 2cqx n PRO 19 Ca -0.04 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.44 2cqx n PRO 19 Cb 0.60 -1.32 0.21 0.00 -0.04 0.00 0.00 33.50 32.95 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 -0.82 3.55 -0.48 3.54 5.03 -1.26 -4.47 115.26 120.35 2cqx n ASN 20 Ca 0.08 -2.53 0.40 0.00 0.87 0.00 0.00 54.58 53.39 2cqx n ASN 20 Cb 0.03 -0.61 0.71 0.00 -1.02 0.00 0.00 39.78 38.89 2cqx n ASN 20 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 2cqx h ASP 21 N 2.03 0.15 -1.72 6.41 5.19 -1.98 0.19 116.42 126.69 2cqx h ASP 21 Ca 0.03 0.07 0.52 0.00 -0.62 0.00 0.00 57.03 57.02 2cqx h ASP 21 Cb 1.36 0.06 -0.09 0.00 0.18 0.00 0.00 39.33 40.83 2cqx h ASP 21 CO 0.29 -0.07 1.21 0.74 -3.12 0.00 0.00 179.24 178.29 2cqx h THR 22 N 0.07 0.07 -0.45 0.35 2.02 -1.91 1.49 112.91 114.54 2cqx h THR 22 Ca 0.78 -0.01 -0.14 0.00 0.77 0.00 0.00 66.41 67.82 2cqx h THR 22 Cb 2.75 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 2cqx h THR 22 CO -0.21 0.00 -0.27 -0.07 0.37 0.00 0.00 175.52 175.34 2cqx h LEU 23 N 0.02 1.01 -1.22 2.58 4.07 -1.00 -3.05 115.31 117.72 2cqx h LEU 23 Ca 0.88 -0.42 0.39 0.00 0.08 0.00 0.00 57.88 58.81 2cqx h LEU 23 Cb 3.32 -0.28 -0.14 0.00 1.08 0.00 0.00 40.66 44.64 2cqx h LEU 23 CO -0.14 1.21 0.70 -0.08 -1.08 0.00 0.00 178.44 179.06 2cqx h GLU 24 N 0.81 0.16 0.09 1.13 4.22 0.19 0.17 114.58 121.35 2cqx h GLU 24 Ca 0.09 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.52 2cqx h GLU 24 Cb 0.85 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2cqx h GLU 24 CO 0.08 0.10 -0.04 0.87 -2.18 0.00 0.00 179.01 177.84 2cqx h LYS 25 N 0.16 -0.12 -1.04 1.92 1.57 -1.59 -3.26 116.57 114.21 2cqx h LYS 25 Ca 0.79 0.01 0.35 0.00 -1.87 0.00 0.00 60.65 59.92 2cqx h LYS 25 Cb 2.19 0.03 -0.15 0.00 0.08 0.00 0.00 32.23 34.37 2cqx h LYS 25 CO -0.52 -0.08 0.60 -0.24 -0.57 0.00 0.00 179.45 178.64 2cqx h VAL 26 N -0.22 0.23 -0.70 0.50 3.04 -1.40 0.83 116.25 118.53 2cqx h VAL 26 Ca -0.01 -0.08 0.15 0.00 -1.01 0.00 0.00 66.70 65.74 2cqx h VAL 26 Cb 0.09 -0.03 -0.11 0.00 -2.01 0.00 0.00 31.29 29.24 2cqx h VAL 26 CO 0.02 0.04 0.11 0.15 -1.01 0.00 0.00 177.57 176.89 2cqx h PHE 27 N 0.24 0.16 -0.35 3.17 3.04 -0.76 0.39 116.94 122.83 2cqx h PHE 27 Ca 0.76 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.75 2cqx h PHE 27 Cb 1.88 0.04 0.00 0.00 2.56 0.00 0.00 35.95 40.43 2cqx h PHE 27 CO -0.01 -0.12 0.00 1.55 -2.02 0.00 0.00 178.31 177.72 2cqx n VAL 28 N -5.20 0.72 -0.12 1.41 3.14 0.12 -0.77 118.33 117.63 2cqx n VAL 28 Ca 0.12 -0.86 -0.26 0.00 -2.96 0.00 0.00 64.34 60.38 2cqx n VAL 28 Cb 0.42 0.73 -0.09 0.00 -1.06 0.00 0.00 33.84 33.84 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 0.88 1.80 -0.08 6.55 2.88 0.25 -4.85 113.62 121.05 2cqx n SER 29 Ca 0.14 0.26 -0.17 0.00 -1.33 0.00 0.00 58.87 57.77 2cqx n SER 29 Cb 0.46 -0.70 -0.06 0.00 -0.75 0.00 0.00 64.21 63.16 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 -4.02 0.94 -3.60 2.46 0.24 0.12 -5.00 118.33 109.47 2cqx n VAL 30 Ca -0.48 -0.27 -0.09 0.00 -2.04 0.00 0.00 64.34 61.46 2cqx n VAL 30 Cb 0.86 -1.58 -0.05 0.00 -1.47 0.00 0.00 33.84 31.59 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 -2.32 0.00 0.07 3.34 -1.32 -0.63 -5.05 115.64 109.73 2cqx s THR 31 Ca -0.23 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.09 2cqx s THR 31 Cb 0.08 -1.00 -0.19 0.00 -1.51 0.00 0.00 72.50 69.89 2cqx s THR 31 CO 0.32 0.00 1.24 0.11 -2.21 0.00 0.00 174.62 174.07 2cqx h LYS 32 N 2.79 0.64 -3.90 7.08 1.79 -1.20 -3.29 116.57 120.49 2cqx h LYS 32 Ca -0.19 -0.56 -0.70 0.00 -2.18 0.00 0.00 60.65 57.01 2cqx h LYS 32 Cb 1.17 0.13 -0.34 0.00 -1.58 0.00 0.00 32.23 31.61 2cqx h LYS 32 CO 0.26 1.18 -0.39 0.71 -1.08 0.00 0.00 179.45 180.13 2cqx s TYR 33 N -3.60 3.48 0.76 -1.35 1.51 -1.26 -4.87 117.35 112.02 2cqx s TYR 33 Ca -0.11 -2.52 -0.11 0.00 -1.01 0.00 0.00 57.07 53.31 2cqx s TYR 33 Cb 0.07 -3.27 0.05 0.00 -0.11 0.00 0.00 41.96 38.70 2cqx s TYR 33 CO 0.87 -0.90 1.09 -1.25 -1.11 0.00 0.00 175.55 174.26 2cqx s PRO 34 N 0.39 2.30 0.31 -1.71 0.04 -1.26 -5.07 135.00 129.99 2cqx s PRO 34 Ca 0.14 1.18 0.09 0.00 0.04 0.00 0.00 61.00 62.45 2cqx s PRO 34 Cb -0.21 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 2cqx s PRO 34 CO -0.04 -1.62 0.04 -0.51 0.04 0.00 0.00 177.00 174.92 2cqx s ASP 35 N -3.33 4.49 0.10 6.66 1.01 -1.26 -4.95 116.67 119.38 2cqx s ASP 35 Ca 0.62 -0.77 -0.19 0.00 0.71 0.00 0.00 52.55 52.91 2cqx s ASP 35 Cb -0.17 -0.72 -0.04 0.00 1.01 0.00 0.00 42.92 42.99 2cqx s ASP 35 CO 0.55 -0.15 1.05 1.21 0.21 0.00 0.00 175.17 178.04 2cqx n GLU 36 N -0.99 -0.27 -0.26 8.23 2.13 -1.26 0.12 120.64 128.34 2cqx n GLU 36 Ca -0.05 1.03 0.12 0.00 0.66 0.00 0.00 57.16 58.93 2cqx n GLU 36 Cb 0.60 -1.52 0.24 0.00 0.27 0.00 0.00 31.44 31.04 2cqx n GLU 36 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2cqx n LYS 37 N -4.57 -0.06 -0.04 5.31 -0.00 -1.26 0.16 118.16 117.70 2cqx n LYS 37 Ca 0.01 1.14 -0.15 0.00 -0.00 0.00 0.00 58.31 59.31 2cqx n LYS 37 Cb 0.16 -1.83 -0.08 0.00 -0.00 0.00 0.00 35.03 33.28 2cqx n LYS 37 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 2cqx h ARG 38 N 0.00 0.49 -0.67 -1.58 2.43 0.52 -3.25 114.38 112.32 2cqx h ARG 38 Ca 0.48 -0.35 0.13 0.00 -0.81 0.00 0.00 59.98 59.42 2cqx h ARG 38 Cb 1.02 0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 30.54 2cqx h ARG 38 CO -0.71 0.97 0.21 -0.07 -1.51 0.00 0.00 179.97 178.87 2cqx h LEU 39 N 0.10 0.14 -0.72 3.80 -0.00 0.26 -0.98 115.31 117.92 2cqx h LEU 39 Ca -0.01 0.11 0.16 0.00 -0.00 0.00 0.00 57.88 58.14 2cqx h LEU 39 Cb 1.00 0.12 -0.11 0.00 -0.00 0.00 0.00 40.66 41.67 2cqx h LEU 39 CO 0.08 0.06 0.12 0.11 -0.00 0.00 0.00 178.44 178.81 2cqx h LYS 40 N 0.35 0.21 0.23 1.13 1.57 -1.04 0.23 116.57 119.24 2cqx h LYS 40 Ca 0.36 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.12 2cqx h LYS 40 Cb 0.54 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2cqx h LYS 40 CO -0.40 0.14 -0.11 0.78 -0.57 0.00 0.00 179.45 179.29 2cqx h GLY 41 N 0.21 -0.32 -0.21 3.86 0.00 -1.27 -3.07 103.07 102.28 2cqx h GLY 41 Ca 0.40 0.12 0.27 0.00 0.00 0.00 0.00 47.33 48.12 2cqx h GLY 41 CO -0.54 -0.12 0.65 1.41 0.00 0.00 0.00 176.54 177.95 2cqx h LEU 42 N -0.32 0.52 -1.04 3.11 3.38 -1.29 0.27 115.31 119.93 2cqx h LEU 42 Ca -0.03 0.11 0.21 0.00 0.09 0.00 0.00 57.88 58.25 2cqx h LEU 42 Cb 0.23 0.03 -0.11 0.00 0.09 0.00 0.00 40.66 40.90 2cqx h LEU 42 CO 0.05 0.07 0.61 -1.28 0.09 0.00 0.00 178.44 177.98 2cqx h SER 43 N 0.44 0.73 0.02 -0.43 0.87 -0.45 0.57 113.55 115.29 2cqx h SER 43 Ca 0.63 0.10 -0.12 0.00 -1.23 0.00 0.00 61.79 61.18 2cqx h SER 43 Cb 1.48 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 63.40 2cqx h SER 43 CO -0.38 0.22 -0.62 0.50 -0.53 0.00 0.00 176.83 176.02 2cqx h LYS 44 N 0.69 0.04 -0.62 2.24 1.63 -0.44 1.42 116.57 121.53 2cqx h LYS 44 Ca 0.59 -0.06 0.12 0.00 -0.85 0.00 0.00 60.65 60.45 2cqx h LYS 44 Cb 1.02 0.02 -0.12 0.00 -0.60 0.00 0.00 32.23 32.55 2cqx h LYS 44 CO -0.39 1.03 -0.18 0.37 -3.45 0.00 0.00 179.45 176.82 2cqx h GLN 45 N -0.90 -0.03 -0.50 1.90 4.15 -0.78 0.79 115.11 119.73 2cqx h GLN 45 Ca -0.16 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.21 2cqx h GLN 45 Cb 1.21 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.88 2cqx h GLN 45 CO -0.06 -0.02 0.05 1.28 -1.93 0.00 0.00 178.83 178.15 2cqx n LEU 46 N -5.43 5.19 -4.35 -2.39 4.77 0.15 -4.94 117.00 110.00 2cqx n LEU 46 Ca 0.07 -3.06 -0.36 0.00 -0.03 0.00 0.00 56.01 52.63 2cqx n LEU 46 Cb 0.33 -0.65 -0.08 0.00 -2.33 0.00 0.00 43.42 40.68 2cqx n LEU 46 CO 0.04 0.70 -0.28 0.47 -1.33 0.00 0.00 177.39 176.99 2cqx n ASP 47 N 0.04 -0.61 -3.43 -1.43 9.92 0.27 -4.91 116.55 116.41 2cqx n ASP 47 Ca 0.29 -1.21 -0.11 0.00 -0.53 0.00 0.00 54.79 53.22 2cqx n ASP 47 Cb 1.14 -1.53 0.02 0.00 -0.64 0.00 0.00 41.12 40.11 2cqx n ASP 47 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 2cqx n TRP 48 N -4.14 -1.76 -4.87 1.24 7.02 0.48 -4.95 117.44 110.45 2cqx n TRP 48 Ca -0.07 -1.11 -0.33 0.00 -1.02 0.00 0.00 57.50 54.97 2cqx n TRP 48 Cb 0.53 -0.25 -0.13 0.00 -2.42 0.00 0.00 31.31 29.04 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 -2.69 4.02 0.58 -0.99 0.01 -1.26 -4.54 113.70 108.83 2cqx s SER 49 Ca 0.22 -0.22 0.43 0.00 1.31 0.00 0.00 55.95 57.68 2cqx s SER 49 Cb -0.02 -1.01 1.47 0.00 0.21 0.00 0.00 66.02 66.67 2cqx s SER 49 CO 0.14 0.31 1.48 1.62 0.41 0.00 0.00 173.24 177.20 2cqx h VAL 50 N 4.58 0.00 0.05 3.43 3.04 -1.94 0.22 116.25 125.64 2cqx h VAL 50 Ca -0.42 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.27 2cqx h VAL 50 Cb 1.17 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.45 2cqx h VAL 50 CO 0.51 0.00 -0.03 0.03 -1.01 0.00 0.00 177.57 177.08 2cqx h ARG 51 N 0.00 -0.07 -0.61 4.17 2.47 -1.98 -3.18 114.38 115.18 2cqx h ARG 51 Ca 0.79 0.00 0.13 0.00 -1.26 0.00 0.00 59.98 59.65 2cqx h ARG 51 Cb 3.51 0.02 -0.10 0.00 -1.65 0.00 0.00 29.97 31.75 2cqx h ARG 51 CO -0.01 0.03 -0.01 -0.22 0.56 0.00 0.00 179.97 180.33 2cqx h LYS 52 N -1.01 0.10 -0.93 0.04 3.64 -1.04 0.78 116.57 118.15 2cqx h LYS 52 Ca -0.01 -0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.50 2cqx h LYS 52 Cb 0.14 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 31.84 2cqx h LYS 52 CO 0.01 0.07 0.55 0.82 -2.27 0.00 0.00 179.45 178.63 2cqx h ILE 53 N 0.11 0.82 -0.37 2.00 2.04 -1.29 0.17 117.51 120.98 2cqx h ILE 53 Ca 0.32 -0.28 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 2cqx h ILE 53 Cb 0.51 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 2cqx h ILE 53 CO -0.53 0.15 -0.08 1.56 0.00 0.00 0.00 178.15 179.25 2cqx h GLN 54 N 0.81 0.63 0.00 2.37 4.20 -0.85 -2.26 115.11 120.01 2cqx h GLN 54 Ca 0.49 -0.18 -0.06 0.00 0.06 0.00 0.00 58.65 58.96 2cqx h GLN 54 Cb 0.60 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 2cqx h GLN 54 CO -0.31 0.71 -0.28 0.00 -0.67 0.00 0.00 178.83 178.27 2cqx h TRP 56 N 0.00 0.13 -0.81 0.00 7.01 -0.82 -3.01 115.95 118.45 2cqx h TRP 56 Ca -0.00 -0.07 0.05 0.00 2.11 0.00 0.00 58.89 60.97 2cqx h TRP 56 Cb 0.59 -0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.59 2cqx h TRP 56 CO 0.00 0.89 0.53 0.74 -2.79 0.00 0.00 178.44 177.81 2cqx h PHE 57 N -0.67 0.93 -0.44 2.65 0.04 -1.36 -1.48 116.94 116.61 2cqx h PHE 57 Ca -0.02 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 2cqx h PHE 57 Cb 0.94 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 38.76 2cqx h PHE 57 CO 0.20 0.52 0.14 -0.09 -0.60 0.00 0.00 178.31 178.48 2cqx h ARG 58 N 0.94 0.68 -0.45 1.51 2.43 -1.51 -3.01 114.38 114.98 2cqx h ARG 58 Ca 0.33 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2cqx h ARG 58 Cb 0.13 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2cqx h ARG 58 CO -0.11 0.66 0.18 1.25 -1.51 0.00 0.00 179.97 180.44 2cqx h HIS 59 N 0.57 0.68 -0.24 2.20 2.76 -1.24 -3.24 115.15 116.64 2cqx h HIS 59 Ca 0.14 -0.05 0.02 0.00 -2.20 0.00 0.00 60.37 58.28 2cqx h HIS 59 Cb 0.26 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.98 2cqx h HIS 59 CO 0.01 0.58 -0.20 -0.09 -1.30 0.00 0.00 177.93 176.94 2cqx h ARG 60 N 0.58 -0.07 -0.87 5.26 9.65 -1.16 0.20 114.38 127.98 2cqx h ARG 60 Ca 0.15 0.00 0.23 0.00 -1.10 0.00 0.00 59.98 59.27 2cqx h ARG 60 Cb 0.19 0.02 -0.16 0.00 -1.39 0.00 0.00 29.97 28.62 2cqx h ARG 60 CO -0.01 -0.05 -0.01 0.54 2.80 0.00 0.00 179.97 183.24 2cqx n ARG 61 N -3.69 -0.07 -0.09 0.20 1.74 -1.21 0.23 116.66 113.77 2cqx n ARG 61 Ca -0.00 1.31 -0.08 0.00 -0.77 0.00 0.00 57.85 58.31 2cqx n ARG 61 Cb 0.10 -2.07 0.09 0.00 -1.02 0.00 0.00 32.46 29.57 2cqx n ARG 61 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2cqx h ASN 62 N 0.00 0.79 0.25 0.55 2.35 -0.94 -2.71 115.58 115.86 2cqx h ASN 62 Ca 0.52 -0.28 -0.04 0.00 -0.55 0.00 0.00 56.30 55.95 2cqx h ASN 62 Cb 1.04 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.19 2cqx h ASN 62 CO -0.83 0.98 -0.17 -0.61 -1.65 0.00 0.00 177.43 175.15 2cqx h GLN 63 N 0.68 0.00 -1.82 0.81 4.15 0.57 -2.87 115.11 116.63 2cqx h GLN 63 Ca 0.10 0.00 -0.27 0.00 0.77 0.00 0.00 58.65 59.24 2cqx h GLN 63 Cb 0.72 0.00 -0.11 0.00 0.21 0.00 0.00 27.48 28.30 2cqx h GLN 63 CO 0.06 0.17 0.18 -3.47 -1.93 0.00 0.00 178.83 173.84 2cqx n ASP 64 N -4.08 6.02 -4.04 -0.69 -0.08 -0.04 -4.98 116.55 108.67 2cqx n ASP 64 Ca -0.02 -2.86 -0.41 0.00 -1.51 0.00 0.00 54.79 49.99 2cqx n ASP 64 Cb 0.25 -1.18 -0.01 0.00 2.34 0.00 0.00 41.12 42.52 2cqx n ASP 64 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2cqx n LYS 65 N 1.09 0.00 -2.24 -0.67 4.76 -1.09 -4.84 118.16 115.16 2cqx n LYS 65 Ca 0.30 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.33 2cqx n LYS 65 Cb 0.61 -0.93 -0.03 0.00 -1.84 0.00 0.00 35.03 32.84 2cqx n LYS 65 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2cqx s PRO 66 N -0.93 4.45 0.73 1.97 0.04 -1.26 -5.00 135.00 135.00 2cqx s PRO 66 Ca 0.57 2.06 -0.15 0.00 0.04 0.00 0.00 61.00 63.51 2cqx s PRO 66 Cb -0.69 -3.14 0.04 0.00 0.04 0.00 0.00 34.50 30.76 2cqx s PRO 66 CO 0.56 -0.09 1.20 -1.54 0.04 0.00 0.00 177.00 177.18 2cqx s SER 67 N -0.38 4.21 0.00 6.66 1.04 -1.26 -4.95 113.70 119.02 2cqx s SER 67 Ca 0.50 2.34 0.00 0.00 0.48 0.00 0.00 55.95 59.26 2cqx s SER 67 Cb -0.37 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.17 2cqx s SER 67 CO 0.46 -2.25 0.00 0.61 0.98 0.00 0.00 173.24 173.04 2cqx n GLY 68 N 0.35 -0.18 0.00 7.32 0.00 -1.26 -5.01 105.19 106.41 2cqx n GLY 68 Ca 0.13 0.27 0.07 0.00 0.00 0.00 0.00 46.02 46.49 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 0.16 -3.20 1.61 -0.04 -1.26 -4.36 135.00 127.91 2cqx n PRO 69 Ca 0.00 0.17 -0.46 0.00 -0.04 0.00 0.00 63.50 63.17 2cqx n PRO 69 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 2cqx n PRO 69 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2cqx s SER 70 N -2.67 6.71 0.15 3.54 0.01 -1.26 -4.83 113.70 115.35 2cqx s SER 70 Ca 0.12 -2.47 -0.12 0.00 1.31 0.00 0.00 55.95 54.79 2cqx s SER 70 Cb 0.10 -2.27 0.01 0.00 0.21 0.00 0.00 66.02 64.07 2cqx s SER 70 CO 0.23 -0.73 0.35 -0.55 0.41 0.00 0.00 173.24 172.94 2cqx s SER 71 N 2.65 -0.07 0.00 2.44 0.15 -1.26 -5.13 113.70 112.48 2cqx s SER 71 Ca 0.22 -0.63 0.00 0.00 0.70 0.00 0.00 55.95 56.24 2cqx s SER 71 Cb -0.09 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 2cqx s SER 71 CO -0.09 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.07