#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 -0.30 0.14 1.61 7.64 -1.26 -4.90 113.62 116.55 2cqx n SER 2 Ca 0.00 1.15 -0.08 0.00 1.01 0.00 0.00 58.87 60.95 2cqx n SER 2 Cb 0.00 -0.98 -0.04 0.00 -1.01 0.00 0.00 64.21 62.18 2cqx n SER 2 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2cqx h SER 3 N 2.21 -0.37 -4.10 6.43 0.87 -2.14 -3.50 113.55 112.95 2cqx h SER 3 Ca -0.40 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2cqx h SER 3 Cb 1.42 0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 63.43 2cqx h SER 3 CO 0.62 0.09 -0.73 0.61 -0.53 0.00 0.00 176.83 176.89 2cqx n GLY 4 N 0.59 -3.98 1.81 5.77 0.00 -1.26 -4.84 105.19 103.28 2cqx n GLY 4 Ca -0.06 0.53 -0.10 0.00 0.00 0.00 0.00 46.02 46.39 2cqx n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cqx n SER 5 N 0.69 5.82 -4.46 1.61 2.88 -1.26 -4.86 113.62 114.04 2cqx n SER 5 Ca -0.13 -2.72 -0.30 0.00 -1.33 0.00 0.00 58.87 54.39 2cqx n SER 5 Cb 0.21 -1.16 -0.12 0.00 -0.75 0.00 0.00 64.21 62.38 2cqx n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cqx s SER 6 N 1.23 3.75 -0.01 -3.46 0.15 -1.26 -5.13 113.70 108.97 2cqx s SER 6 Ca 0.27 -0.55 -0.30 0.00 0.70 0.00 0.00 55.95 56.07 2cqx s SER 6 Cb 0.17 -0.51 0.12 0.00 -1.71 0.00 0.00 66.02 64.09 2cqx s SER 6 CO -0.02 0.20 1.26 -0.83 1.20 0.00 0.00 173.24 175.05 2cqx s GLY 7 N -1.89 -0.40 0.00 9.45 0.00 -1.26 -5.19 107.32 108.03 2cqx s GLY 7 Ca 0.16 0.70 0.00 0.00 0.00 0.00 0.00 44.72 45.58 2cqx s GLY 7 CO 0.08 0.13 0.00 0.61 0.00 0.00 0.00 173.10 173.92 2cqx n GLY 8 N -0.47 -0.53 0.07 0.20 0.00 -1.26 -5.03 105.19 98.17 2cqx n GLY 8 Ca -0.08 -0.84 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 2cqx n GLY 8 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2cqx h ILE 9 N 0.00 0.73 -3.36 -0.61 2.04 -2.03 -3.45 117.51 110.82 2cqx h ILE 9 Ca 0.00 -1.64 -0.62 0.00 1.00 0.00 0.00 64.86 63.60 2cqx h ILE 9 Cb 0.00 1.47 -0.17 0.00 -0.74 0.00 0.00 36.82 37.37 2cqx h ILE 9 CO 0.00 0.25 -0.58 -0.75 0.00 0.00 0.00 178.15 177.07 2cqx s LYS 10 N -2.04 3.90 -0.74 2.37 2.47 -1.26 -5.00 119.74 119.45 2cqx s LYS 10 Ca -0.14 -0.38 -0.02 0.00 -1.56 0.00 0.00 55.97 53.88 2cqx s LYS 10 Cb 0.01 -3.21 0.40 0.00 -1.46 0.00 0.00 37.83 33.57 2cqx s LYS 10 CO 0.36 0.19 2.00 -0.25 0.16 0.00 0.00 175.35 177.82 2cqx n ASP 11 N 3.77 7.53 -3.78 1.43 9.92 -1.26 -4.92 116.55 129.24 2cqx n ASP 11 Ca -0.16 -3.81 -0.13 0.00 -0.53 0.00 0.00 54.79 50.16 2cqx n ASP 11 Cb 0.52 -1.00 -0.12 0.00 -0.64 0.00 0.00 41.12 39.88 2cqx n ASP 11 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2cqx s SER 12 N -1.56 -0.24 -1.07 -2.24 0.01 -1.26 -5.08 113.70 102.26 2cqx s SER 12 Ca 0.58 0.47 -0.23 0.00 1.31 0.00 0.00 55.95 58.08 2cqx s SER 12 Cb 0.47 0.44 -0.07 0.00 0.21 0.00 0.00 66.02 67.08 2cqx s SER 12 CO -0.20 -0.10 1.94 -2.16 0.41 0.00 0.00 173.24 173.13 2cqx s PRO 13 N 0.38 2.52 -0.70 12.44 0.04 -1.26 -4.10 135.00 144.32 2cqx s PRO 13 Ca -0.02 -0.82 -0.08 0.00 0.04 0.00 0.00 61.00 60.12 2cqx s PRO 13 Cb -0.04 -5.17 0.08 0.00 0.04 0.00 0.00 34.50 29.41 2cqx s PRO 13 CO -0.02 -3.74 0.22 0.28 0.04 0.00 0.00 177.00 173.78 2cqx n VAL 14 N 7.83 -0.08 -2.95 -0.36 0.31 -1.26 -4.82 118.33 116.99 2cqx n VAL 14 Ca 0.43 0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 64.32 2cqx n VAL 14 Cb 0.47 -0.33 -0.04 0.00 -0.91 0.00 0.00 33.84 33.03 2cqx n VAL 14 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2cqx s ASN 15 N -2.44 6.33 -1.05 4.52 0.01 -1.26 -4.96 114.94 116.09 2cqx s ASN 15 Ca 0.29 -1.46 -0.07 0.00 -0.71 0.00 0.00 52.86 50.91 2cqx s ASN 15 Cb -0.17 -2.38 0.27 0.00 0.41 0.00 0.00 41.25 39.38 2cqx s ASN 15 CO 0.35 -1.23 1.04 0.29 -1.51 0.00 0.00 177.10 176.05 2cqx n LYS 16 N 6.93 3.34 -0.29 -0.60 4.76 -1.26 -4.91 118.16 126.13 2cqx n LYS 16 Ca 0.04 -4.47 0.02 0.00 -2.87 0.00 0.00 58.31 51.02 2cqx n LYS 16 Cb 0.46 -2.51 0.09 0.00 -1.84 0.00 0.00 35.03 31.23 2cqx n LYS 16 CO 0.00 0.00 0.00 -0.39 -1.37 0.00 0.00 177.40 175.64 2cqx h VAL 17 N 3.73 0.15 -2.70 -0.18 -1.51 -2.02 -3.44 116.25 110.29 2cqx h VAL 17 Ca 0.18 0.00 0.05 0.00 -1.23 0.00 0.00 66.70 65.70 2cqx h VAL 17 Cb 0.84 0.15 -0.12 0.00 -2.13 0.00 0.00 31.29 30.03 2cqx h VAL 17 CO 0.99 0.00 0.33 -1.61 -1.23 0.00 0.00 177.57 176.05 2cqx s GLU 18 N -6.19 1.16 0.00 5.19 0.41 -1.26 -5.01 118.70 112.99 2cqx s GLU 18 Ca -0.15 -0.47 0.11 0.00 -0.41 0.00 0.00 54.97 54.05 2cqx s GLU 18 Cb 0.22 0.50 0.63 0.00 -1.78 0.00 0.00 34.13 33.71 2cqx s GLU 18 CO 0.75 -0.51 1.07 -0.35 -0.49 0.00 0.00 175.26 175.73 2cqx n PRO 19 N -0.35 0.49 -0.22 0.39 -0.04 -1.26 -3.28 135.00 130.73 2cqx n PRO 19 Ca -0.12 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.32 2cqx n PRO 19 Cb 0.63 -1.34 0.06 0.00 -0.04 0.00 0.00 33.50 32.81 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 -0.84 2.52 -0.33 3.54 5.03 -1.26 -4.45 115.26 119.47 2cqx n ASN 20 Ca 0.08 -2.26 0.23 0.00 0.87 0.00 0.00 54.58 53.51 2cqx n ASN 20 Cb 0.04 -0.55 0.45 0.00 -1.02 0.00 0.00 39.78 38.69 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 0.55 0.06 -1.08 6.41 2.03 -2.01 0.20 116.42 122.58 2cqx h ASP 21 Ca 0.06 0.25 0.35 0.00 -0.73 0.00 0.00 57.03 56.97 2cqx h ASP 21 Cb 1.07 0.32 -0.09 0.00 -0.83 0.00 0.00 39.33 39.80 2cqx h ASP 21 CO 0.16 -0.34 0.72 0.41 -1.03 0.00 0.00 179.24 179.16 2cqx n THR 22 N -5.30 -0.14 -0.01 1.15 -1.04 -1.26 0.22 114.28 107.91 2cqx n THR 22 Ca 0.31 1.22 -0.13 0.00 -2.04 0.00 0.00 64.05 63.41 2cqx n THR 22 Cb 1.02 -2.01 -0.09 0.00 -1.82 0.00 0.00 70.33 67.43 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 0.04 -0.72 -4.42 4.07 -0.98 -3.10 115.31 110.20 2cqx h LEU 23 Ca 0.63 -0.35 0.29 0.00 0.08 0.00 0.00 57.88 58.53 2cqx h LEU 23 Cb 2.17 -0.01 -0.13 0.00 1.08 0.00 0.00 40.66 43.77 2cqx h LEU 23 CO -0.25 0.38 0.34 1.21 -1.08 0.00 0.00 178.44 179.04 2cqx n GLU 24 N -4.89 -0.05 0.05 1.13 4.07 0.60 -0.21 120.64 121.34 2cqx n GLU 24 Ca -0.08 1.01 -0.02 0.00 -0.06 0.00 0.00 57.16 58.01 2cqx n GLU 24 Cb 0.20 -1.78 -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 -0.13 -1.20 5.31 1.57 -1.59 -3.20 116.57 117.34 2cqx h LYS 25 Ca 0.59 0.01 0.38 0.00 -1.87 0.00 0.00 60.65 59.76 2cqx h LYS 25 Cb 1.52 0.03 -0.12 0.00 0.08 0.00 0.00 32.23 33.74 2cqx h LYS 25 CO -0.57 -0.08 0.76 -0.24 -0.57 0.00 0.00 179.45 178.75 2cqx h VAL 26 N -0.22 0.24 -0.50 0.50 3.04 -0.94 1.15 116.25 119.53 2cqx h VAL 26 Ca -0.01 -0.06 0.08 0.00 -1.01 0.00 0.00 66.70 65.70 2cqx h VAL 26 Cb 0.10 0.04 -0.07 0.00 -2.01 0.00 0.00 31.29 29.35 2cqx h VAL 26 CO 0.02 0.03 0.12 0.15 -1.01 0.00 0.00 177.57 176.88 2cqx h PHE 27 N 0.19 0.19 -0.37 3.17 3.04 -0.63 0.32 116.94 122.85 2cqx h PHE 27 Ca 0.75 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.73 2cqx h PHE 27 Cb 2.19 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 40.69 2cqx h PHE 27 CO -0.01 0.01 0.00 1.55 -2.02 0.00 0.00 178.31 177.85 2cqx n VAL 28 N -5.09 0.70 -0.12 1.41 3.14 0.12 -1.17 118.33 117.32 2cqx n VAL 28 Ca 0.06 -0.85 -0.23 0.00 -2.96 0.00 0.00 64.34 60.36 2cqx n VAL 28 Cb 0.24 0.76 -0.09 0.00 -1.06 0.00 0.00 33.84 33.69 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 0.99 1.80 -0.10 6.55 2.88 0.35 -4.83 113.62 121.27 2cqx n SER 29 Ca 0.15 0.20 -0.18 0.00 -1.33 0.00 0.00 58.87 57.71 2cqx n SER 29 Cb 0.48 -0.62 -0.08 0.00 -0.75 0.00 0.00 64.21 63.25 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 -3.86 1.09 -3.61 2.46 0.24 0.10 -4.99 118.33 109.77 2cqx n VAL 30 Ca -0.45 -0.34 -0.05 0.00 -2.04 0.00 0.00 64.34 61.46 2cqx n VAL 30 Cb 0.85 -1.50 -0.04 0.00 -1.47 0.00 0.00 33.84 31.69 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 -2.37 0.00 0.02 3.34 -1.32 -0.59 -5.05 115.64 109.66 2cqx s THR 31 Ca -0.27 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.12 2cqx s THR 31 Cb 0.09 -1.00 -0.31 0.00 -1.51 0.00 0.00 72.50 69.77 2cqx s THR 31 CO 0.39 0.00 0.93 0.11 -2.21 0.00 0.00 174.62 173.84 2cqx h LYS 32 N 2.18 0.37 -3.30 7.08 1.57 -1.41 -3.30 116.57 119.77 2cqx h LYS 32 Ca -0.11 -0.64 -0.68 0.00 -1.87 0.00 0.00 60.65 57.34 2cqx h LYS 32 Cb 1.17 0.24 -0.37 0.00 0.08 0.00 0.00 32.23 33.35 2cqx h LYS 32 CO 0.25 1.28 -0.26 0.71 -0.57 0.00 0.00 179.45 180.86 2cqx s TYR 33 N -2.61 3.73 1.00 -1.35 1.51 -1.26 -4.93 117.35 113.43 2cqx s TYR 33 Ca -0.09 -3.06 -0.12 0.00 -1.01 0.00 0.00 57.07 52.78 2cqx s TYR 33 Cb 0.06 -3.10 0.19 0.00 -0.11 0.00 0.00 41.96 39.00 2cqx s TYR 33 CO 0.89 -0.71 1.09 -1.25 -1.11 0.00 0.00 175.55 174.47 2cqx s PRO 34 N -1.15 0.39 0.36 -1.71 0.04 -1.26 -5.09 135.00 126.57 2cqx s PRO 34 Ca 0.25 0.51 0.04 0.00 0.04 0.00 0.00 61.00 61.84 2cqx s PRO 34 Cb -0.09 -1.73 -0.06 0.00 0.04 0.00 0.00 34.50 32.66 2cqx s PRO 34 CO -0.12 -2.76 0.06 0.34 0.04 0.00 0.00 177.00 174.57 2cqx s ASP 35 N -3.45 2.70 0.31 6.66 2.15 -1.26 -5.00 116.67 118.78 2cqx s ASP 35 Ca 0.65 -1.44 0.08 0.00 0.43 0.00 0.00 52.55 52.27 2cqx s ASP 35 Cb -0.19 0.01 0.90 0.00 -0.30 0.00 0.00 42.92 43.34 2cqx s ASP 35 CO 0.58 -0.66 1.46 1.21 -0.17 0.00 0.00 175.17 177.59 2cqx n GLU 36 N -0.79 -0.07 -0.28 4.34 2.13 -1.26 0.22 120.64 124.94 2cqx n GLU 36 Ca -0.04 1.36 -0.02 0.00 0.66 0.00 0.00 57.16 59.12 2cqx n GLU 36 Cb 0.66 -2.25 0.04 0.00 0.27 0.00 0.00 31.44 30.16 2cqx n GLU 36 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 2cqx h LYS 37 N 0.00 -0.07 -0.09 5.31 2.10 -2.01 0.11 116.57 121.92 2cqx h LYS 37 Ca 0.64 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 59.24 2cqx h LYS 37 Cb 1.48 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.83 2cqx h LYS 37 CO -0.82 -0.05 -0.18 -0.09 -2.00 0.00 0.00 179.45 176.31 2cqx h ARG 38 N -0.08 0.27 -1.13 0.07 2.43 -0.62 -3.14 114.38 112.18 2cqx h ARG 38 Ca 0.31 -0.18 0.32 0.00 -0.81 0.00 0.00 59.98 59.61 2cqx h ARG 38 Cb 0.58 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 30.06 2cqx h ARG 38 CO -0.82 0.77 0.75 -0.07 -1.51 0.00 0.00 179.97 179.09 2cqx h LEU 39 N -0.19 0.31 0.24 3.80 -0.00 -0.38 -0.33 115.31 118.76 2cqx h LEU 39 Ca 0.00 0.08 0.01 0.00 -0.00 0.00 0.00 57.88 57.97 2cqx h LEU 39 Cb 0.76 0.03 -0.03 0.00 -0.00 0.00 0.00 40.66 41.42 2cqx h LEU 39 CO 0.04 0.02 -0.32 0.11 -0.00 0.00 0.00 178.44 178.29 2cqx h LYS 40 N 0.25 -0.59 0.11 1.13 1.79 -0.78 0.55 116.57 119.02 2cqx h LYS 40 Ca 0.63 0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 59.14 2cqx h LYS 40 Cb 1.88 0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 32.67 2cqx h LYS 40 CO -0.26 -0.39 -0.10 0.78 -1.08 0.00 0.00 179.45 178.40 2cqx h GLY 41 N -0.61 -0.73 -0.54 3.86 0.00 -1.18 -2.99 103.07 100.88 2cqx h GLY 41 Ca 0.00 0.32 0.18 0.00 0.00 0.00 0.00 47.33 47.83 2cqx h GLY 41 CO -0.11 -0.26 -0.09 1.41 0.00 0.00 0.00 176.54 177.49 2cqx h LEU 42 N -0.20 -0.55 -1.37 3.11 3.38 -1.55 0.41 115.31 118.53 2cqx h LEU 42 Ca -0.01 0.23 0.47 0.00 0.09 0.00 0.00 57.88 58.65 2cqx h LEU 42 Cb 0.17 0.43 -0.14 0.00 0.09 0.00 0.00 40.66 41.22 2cqx h LEU 42 CO -0.00 -0.24 0.86 -1.28 0.09 0.00 0.00 178.44 177.87 2cqx h SER 43 N 0.04 0.22 0.06 -0.43 0.87 -0.73 0.27 113.55 113.85 2cqx h SER 43 Ca 0.42 0.16 -0.24 0.00 -1.23 0.00 0.00 61.79 60.89 2cqx h SER 43 Cb 0.72 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.82 2cqx h SER 43 CO -0.77 -0.25 -1.29 0.50 -0.53 0.00 0.00 176.83 174.48 2cqx h LYS 44 N 0.03 0.12 -0.11 2.24 1.63 -0.17 0.69 116.57 121.01 2cqx h LYS 44 Ca 0.87 -0.21 0.03 0.00 -0.85 0.00 0.00 60.65 60.49 2cqx h LYS 44 Cb 2.75 0.08 -0.06 0.00 -0.60 0.00 0.00 32.23 34.40 2cqx h LYS 44 CO -0.47 1.10 -0.48 0.37 -3.45 0.00 0.00 179.45 176.52 2cqx h GLN 45 N -0.61 -0.50 -0.91 1.90 4.15 0.36 -0.42 115.11 119.08 2cqx h GLN 45 Ca -0.31 0.03 -0.19 0.00 0.77 0.00 0.00 58.65 58.95 2cqx h GLN 45 Cb 1.53 0.11 -0.12 0.00 0.21 0.00 0.00 27.48 29.22 2cqx h GLN 45 CO -0.06 -0.34 0.25 1.28 -1.93 0.00 0.00 178.83 178.03 2cqx n LEU 46 N -5.08 4.66 -4.14 -2.39 4.77 -0.08 -4.88 117.00 109.87 2cqx n LEU 46 Ca -0.05 -2.43 -0.36 0.00 -0.03 0.00 0.00 56.01 53.13 2cqx n LEU 46 Cb 0.33 -0.67 -0.07 0.00 -2.33 0.00 0.00 43.42 40.69 2cqx n LEU 46 CO 0.08 0.69 -0.16 0.47 -1.33 0.00 0.00 177.39 177.14 2cqx n ASP 47 N -0.16 -1.36 -4.13 -1.43 9.92 -0.17 -4.88 116.55 114.34 2cqx n ASP 47 Ca 0.28 -1.08 -0.18 0.00 -0.53 0.00 0.00 54.79 53.28 2cqx n ASP 47 Cb 1.05 -1.38 0.02 0.00 -0.64 0.00 0.00 41.12 40.16 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 -3.63 -1.42 -4.22 1.24 7.02 0.24 -4.96 117.44 111.71 2cqx n TRP 48 Ca 0.07 -1.67 -0.30 0.00 -1.02 0.00 0.00 57.50 54.58 2cqx n TRP 48 Cb 0.41 -0.36 -0.10 0.00 -2.42 0.00 0.00 31.31 28.84 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 -3.49 4.48 0.42 -0.99 0.01 -1.26 -4.37 113.70 108.49 2cqx s SER 49 Ca 0.31 -0.36 0.18 0.00 1.31 0.00 0.00 55.95 57.39 2cqx s SER 49 Cb -0.02 -0.89 1.10 0.00 0.21 0.00 0.00 66.02 66.42 2cqx s SER 49 CO 0.20 0.18 1.84 1.62 0.41 0.00 0.00 173.24 177.48 2cqx h VAL 50 N 3.21 0.64 0.16 3.43 3.04 -1.92 0.20 116.25 125.01 2cqx h VAL 50 Ca -0.49 -0.14 -0.29 0.00 -1.01 0.00 0.00 66.70 64.78 2cqx h VAL 50 Cb 1.17 0.21 0.01 0.00 -2.01 0.00 0.00 31.29 30.67 2cqx h VAL 50 CO 0.53 0.07 -1.31 0.08 -1.01 0.00 0.00 177.57 175.93 2cqx h ARG 51 N 0.40 0.34 -0.07 4.17 0.11 -1.97 -3.03 114.38 114.33 2cqx h ARG 51 Ca 0.50 -0.58 -0.01 0.00 0.10 0.00 0.00 59.98 59.99 2cqx h ARG 51 Cb 1.26 0.22 -0.00 0.00 1.11 0.00 0.00 29.97 32.55 2cqx h ARG 51 CO -0.19 1.27 0.01 -0.22 0.10 0.00 0.00 179.97 180.94 2cqx h LYS 52 N 0.09 0.12 0.23 0.08 3.64 -1.31 -3.22 116.57 116.21 2cqx h LYS 52 Ca -0.17 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 2cqx h LYS 52 Cb 2.03 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.83 2cqx h LYS 52 CO 0.22 0.37 -0.16 0.82 -2.27 0.00 0.00 179.45 178.43 2cqx h ILE 53 N -0.15 0.65 -0.85 2.00 2.04 -0.85 -2.78 117.51 117.57 2cqx h ILE 53 Ca 0.02 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.09 2cqx h ILE 53 Cb 0.31 0.65 -0.16 0.00 -0.74 0.00 0.00 36.82 36.88 2cqx h ILE 53 CO 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 178.15 178.08 2cqx n GLN 54 N -5.29 -0.07 -0.25 2.37 1.13 -1.14 0.17 117.38 114.31 2cqx n GLN 54 Ca -0.09 1.30 0.04 0.00 -1.94 0.00 0.00 57.00 56.31 2cqx n GLN 54 Cb 0.20 -2.01 0.17 0.00 0.11 0.00 0.00 30.24 28.71 2cqx n GLN 54 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2cqx h TRP 56 N 0.46 -0.93 -0.74 0.00 7.01 0.17 0.19 115.95 122.12 2cqx h TRP 56 Ca 0.39 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.48 2cqx h TRP 56 Cb 0.55 0.37 -0.05 0.00 -2.10 0.00 0.00 29.16 27.93 2cqx h TRP 56 CO -0.16 -0.47 0.49 0.74 -2.79 0.00 0.00 178.44 176.24 2cqx h PHE 57 N -0.67 0.73 -0.31 2.65 0.04 -1.18 -0.78 116.94 117.42 2cqx h PHE 57 Ca -0.01 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.64 2cqx h PHE 57 Cb 0.63 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 2cqx h PHE 57 CO -0.23 0.36 -0.38 -0.09 -0.60 0.00 0.00 178.31 177.38 2cqx h ARG 58 N 0.70 0.72 0.00 1.51 2.43 -0.40 -2.88 114.38 116.46 2cqx h ARG 58 Ca 0.33 -0.36 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 2cqx h ARG 58 Cb 0.38 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 2cqx h ARG 58 CO -0.12 0.98 -0.44 1.25 -1.51 0.00 0.00 179.97 180.13 2cqx h HIS 59 N 0.60 0.00 0.20 2.20 2.76 0.63 -3.23 115.15 118.31 2cqx h HIS 59 Ca 0.05 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.21 2cqx h HIS 59 Cb 0.92 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.88 2cqx h HIS 59 CO 0.05 0.44 -0.10 0.00 -1.30 0.00 0.00 177.93 177.02 2cqx h ARG 60 N 0.00 -0.26 -0.91 5.26 2.47 -0.99 -0.84 114.38 119.10 2cqx h ARG 60 Ca -0.00 0.02 0.35 0.00 -1.26 0.00 0.00 59.98 59.08 2cqx h ARG 60 Cb 0.88 0.06 -0.17 0.00 -1.65 0.00 0.00 29.97 29.09 2cqx h ARG 60 CO 0.06 -0.17 0.37 0.54 0.56 0.00 0.00 179.97 181.32 2cqx n ARG 61 N -3.01 -0.06 -0.06 0.04 1.74 -1.12 0.15 116.66 114.34 2cqx n ARG 61 Ca -0.03 1.29 -0.14 0.00 -0.77 0.00 0.00 57.85 58.19 2cqx n ARG 61 Cb 0.11 -2.24 -0.06 0.00 -1.02 0.00 0.00 32.46 29.24 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 0.63 0.89 0.55 2.35 -1.57 -3.19 115.58 115.24 2cqx h ASN 62 Ca 0.72 -0.54 -0.04 0.00 -0.55 0.00 0.00 56.30 55.89 2cqx h ASN 62 Cb 1.81 -0.18 0.01 0.00 0.05 0.00 0.00 38.32 40.01 2cqx h ASN 62 CO -0.74 1.05 -0.43 -0.61 -1.65 0.00 0.00 177.43 175.05 2cqx h GLN 63 N 0.24 -1.15 -0.87 0.81 5.75 0.29 -3.07 115.11 117.10 2cqx h GLN 63 Ca 0.01 0.08 0.22 0.00 -0.15 0.00 0.00 58.65 58.81 2cqx h GLN 63 Cb 0.93 0.26 -0.16 0.00 1.07 0.00 0.00 27.48 29.58 2cqx h GLN 63 CO 0.08 -0.77 -0.07 -3.47 -2.65 0.00 0.00 178.83 171.95 2cqx n ASP 64 N -5.56 -0.18 -4.77 -0.69 2.03 0.53 -4.38 116.55 103.53 2cqx n ASP 64 Ca -0.15 1.49 -0.41 0.00 0.52 0.00 0.00 54.79 56.24 2cqx n ASP 64 Cb 0.47 -0.51 -0.00 0.00 -0.72 0.00 0.00 41.12 40.36 2cqx n ASP 64 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2cqx n LYS 65 N -5.33 2.64 0.00 -0.67 4.81 -1.16 -4.87 118.16 113.58 2cqx n LYS 65 Ca 0.18 0.93 0.07 0.00 -0.87 0.00 0.00 58.31 58.62 2cqx n LYS 65 Cb 0.58 -2.65 0.31 0.00 0.02 0.00 0.00 35.03 33.30 2cqx n LYS 65 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2cqx n PRO 66 N 0.44 0.03 -1.30 1.64 -0.04 -1.26 -4.86 135.00 129.64 2cqx n PRO 66 Ca 0.01 0.24 -0.51 0.00 -0.04 0.00 0.00 63.50 63.21 2cqx n PRO 66 Cb 0.39 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.27 2cqx n PRO 66 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2cqx n SER 67 N -1.47 0.66 0.00 3.54 3.41 -1.26 -4.80 113.62 113.69 2cqx n SER 67 Ca 0.04 0.92 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 2cqx n SER 67 Cb 0.16 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 2cqx n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cqx n GLY 68 N 2.54 -1.00 0.16 5.00 0.00 -1.26 -5.04 105.19 105.59 2cqx n GLY 68 Ca 0.22 0.63 0.01 0.00 0.00 0.00 0.00 46.02 46.88 2cqx n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqx h PRO 69 N 0.00 0.00 -6.83 1.61 0.13 -2.04 -3.45 132.00 121.42 2cqx h PRO 69 Ca 0.00 -0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.65 2cqx h PRO 69 Cb 0.00 0.00 0.22 0.00 0.13 0.00 0.00 31.00 31.35 2cqx h PRO 69 CO 0.00 0.49 -0.64 0.45 -0.23 0.00 0.00 178.00 178.07 2cqx n SER 70 N -3.96 -1.95 -3.04 1.44 2.88 -1.26 -5.04 113.62 102.69 2cqx n SER 70 Ca -0.02 0.06 -0.17 0.00 -1.33 0.00 0.00 58.87 57.41 2cqx n SER 70 Cb 0.50 -1.13 -0.07 0.00 -0.75 0.00 0.00 64.21 62.77 2cqx n SER 70 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2cqx n SER 71 N -2.34 -0.73 0.00 -3.46 7.64 -1.26 -5.23 113.62 108.23 2cqx n SER 71 Ca 0.04 -2.99 0.00 0.00 1.01 0.00 0.00 58.87 56.92 2cqx n SER 71 Cb 0.57 1.65 0.00 0.00 -1.01 0.00 0.00 64.21 65.43 2cqx n SER 71 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64