#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 0.70 0.81 1.61 1.04 -1.26 -5.16 113.70 111.45 2cqx s SER 2 Ca 0.00 0.08 -0.12 0.00 0.48 0.00 0.00 55.95 56.39 2cqx s SER 2 Cb 0.00 0.80 0.08 0.00 0.10 0.00 0.00 66.02 67.00 2cqx s SER 2 CO 0.00 -0.31 1.13 -0.94 0.98 0.00 0.00 173.24 174.11 2cqx s SER 3 N 2.45 4.45 0.10 7.02 1.04 -1.26 -5.08 113.70 122.43 2cqx s SER 3 Ca 0.09 1.01 -0.26 0.00 0.48 0.00 0.00 55.95 57.28 2cqx s SER 3 Cb -0.15 -1.64 0.09 0.00 0.10 0.00 0.00 66.02 64.41 2cqx s SER 3 CO -0.14 -1.96 1.11 -0.83 0.98 0.00 0.00 173.24 172.40 2cqx s GLY 4 N -4.25 -0.13 -1.29 7.32 0.00 -1.26 -5.00 107.32 102.71 2cqx s GLY 4 Ca 0.61 0.06 -0.06 0.00 0.00 0.00 0.00 44.72 45.33 2cqx s GLY 4 CO 0.52 1.75 1.12 1.44 0.00 0.00 0.00 173.10 177.92 2cqx n SER 5 N -0.85 -5.13 -0.03 1.64 7.64 -1.26 -4.93 113.62 110.71 2cqx n SER 5 Ca -0.04 -0.55 -0.20 0.00 1.01 0.00 0.00 58.87 59.08 2cqx n SER 5 Cb 0.60 -5.00 -0.13 0.00 -1.01 0.00 0.00 64.21 58.68 2cqx n SER 5 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2cqx h SER 6 N -2.45 0.25 -3.13 6.43 4.64 -2.02 -3.46 113.55 113.80 2cqx h SER 6 Ca -0.57 -0.81 -0.64 0.00 -0.47 0.00 0.00 61.79 59.30 2cqx h SER 6 Cb 1.36 -0.08 -0.13 0.00 -0.31 0.00 0.00 62.40 63.23 2cqx h SER 6 CO 0.53 1.48 -0.55 -0.83 -0.87 0.00 0.00 176.83 176.60 2cqx s GLY 7 N -4.80 1.97 0.21 -0.77 0.00 -1.26 -5.09 107.32 97.58 2cqx s GLY 7 Ca -0.21 -0.73 -0.09 0.00 0.00 0.00 0.00 44.72 43.69 2cqx s GLY 7 CO 0.72 -0.17 0.35 -0.32 0.00 0.00 0.00 173.10 173.68 2cqx s GLY 8 N -0.24 0.69 0.10 0.20 0.00 -1.26 -5.12 107.32 101.69 2cqx s GLY 8 Ca 0.08 -1.03 -0.36 0.00 0.00 0.00 0.00 44.72 43.41 2cqx s GLY 8 CO 0.01 -0.84 1.40 1.39 0.00 0.00 0.00 173.10 175.06 2cqx n ILE 9 N -0.31 0.01 -2.09 0.90 2.08 -1.26 -4.88 119.36 113.81 2cqx n ILE 9 Ca -0.03 -0.00 -0.42 0.00 0.56 0.00 0.00 62.75 62.87 2cqx n ILE 9 Cb 0.63 -0.98 -0.03 0.00 -0.75 0.00 0.00 39.64 38.52 2cqx n ILE 9 CO 0.00 0.00 0.00 -1.59 0.56 0.00 0.00 176.55 175.52 2cqx s LYS 10 N 0.63 4.31 -0.03 0.38 -2.85 -1.26 -4.94 119.74 115.97 2cqx s LYS 10 Ca 0.83 2.20 -0.07 0.00 -1.00 0.00 0.00 55.97 57.93 2cqx s LYS 10 Cb -0.90 -3.16 -0.02 0.00 -2.06 0.00 0.00 37.83 31.68 2cqx s LYS 10 CO 0.45 -0.40 -0.14 -3.47 0.10 0.00 0.00 175.35 171.89 2cqx n ASP 11 N 2.91 1.23 -4.77 0.03 -0.08 -1.26 -5.03 116.55 109.57 2cqx n ASP 11 Ca 0.08 0.19 -0.35 0.00 -1.51 0.00 0.00 54.79 53.20 2cqx n ASP 11 Cb 0.41 -0.48 0.01 0.00 2.34 0.00 0.00 41.12 43.40 2cqx n ASP 11 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2cqx s SER 12 N -5.66 5.57 0.82 1.67 1.04 -1.26 -5.02 113.70 110.85 2cqx s SER 12 Ca -0.12 2.17 -0.11 0.00 0.48 0.00 0.00 55.95 58.38 2cqx s SER 12 Cb 0.02 -2.58 0.08 0.00 0.10 0.00 0.00 66.02 63.64 2cqx s SER 12 CO 0.17 -1.33 1.09 -2.16 0.98 0.00 0.00 173.24 172.00 2cqx s PRO 13 N -3.42 1.89 0.45 4.02 0.04 -1.26 -4.97 135.00 131.75 2cqx s PRO 13 Ca 0.72 1.04 -0.25 0.00 0.04 0.00 0.00 61.00 62.56 2cqx s PRO 13 Cb -0.24 -1.86 -0.09 0.00 0.04 0.00 0.00 34.50 32.35 2cqx s PRO 13 CO 0.30 -1.86 1.28 1.33 0.04 0.00 0.00 177.00 178.08 2cqx n VAL 14 N -3.66 2.78 -4.45 -0.36 0.24 -1.26 -5.00 118.33 106.63 2cqx n VAL 14 Ca 0.08 -0.50 -0.35 0.00 -2.04 0.00 0.00 64.34 61.54 2cqx n VAL 14 Cb 0.54 -1.58 -0.10 0.00 -1.47 0.00 0.00 33.84 31.23 2cqx n VAL 14 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2cqx s ASN 15 N -0.61 5.06 -0.48 -1.34 0.01 -1.26 -5.08 114.94 111.24 2cqx s ASN 15 Ca 0.63 0.09 -0.10 0.00 -0.71 0.00 0.00 52.86 52.78 2cqx s ASN 15 Cb -0.49 -1.39 0.12 0.00 0.41 0.00 0.00 41.25 39.91 2cqx s ASN 15 CO 0.56 0.37 0.36 -0.54 -1.51 0.00 0.00 177.10 176.34 2cqx s LYS 16 N -0.85 2.51 0.15 -0.60 1.02 -1.26 -4.96 119.74 115.75 2cqx s LYS 16 Ca 0.13 -1.77 -0.22 0.00 0.02 0.00 0.00 55.97 54.13 2cqx s LYS 16 Cb -0.11 -3.96 0.03 0.00 -0.52 0.00 0.00 37.83 33.28 2cqx s LYS 16 CO 0.02 -1.21 1.63 -0.39 -0.92 0.00 0.00 175.35 174.48 2cqx h VAL 17 N 6.11 0.39 -3.19 3.17 -1.51 -2.03 -3.45 116.25 115.74 2cqx h VAL 17 Ca -0.22 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.23 2cqx h VAL 17 Cb 1.07 0.39 -0.11 0.00 -2.13 0.00 0.00 31.29 30.51 2cqx h VAL 17 CO 0.87 0.00 0.08 -1.61 -1.23 0.00 0.00 177.57 175.69 2cqx s GLU 18 N -6.08 1.30 0.00 5.19 2.02 -1.26 -5.02 118.70 114.85 2cqx s GLU 18 Ca -0.15 -0.70 0.10 0.00 0.02 0.00 0.00 54.97 54.25 2cqx s GLU 18 Cb 0.12 0.54 0.62 0.00 0.10 0.00 0.00 34.13 35.51 2cqx s GLU 18 CO 0.68 -0.55 1.05 -0.35 0.02 0.00 0.00 175.26 176.11 2cqx n PRO 19 N -0.34 0.49 -0.24 0.39 -0.04 -1.26 -3.36 135.00 130.64 2cqx n PRO 19 Ca -0.13 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.29 2cqx n PRO 19 Cb 0.63 -1.33 0.05 0.00 -0.04 0.00 0.00 33.50 32.82 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 -0.83 2.84 -0.32 3.54 5.03 -1.26 -4.43 115.26 119.83 2cqx n ASN 20 Ca 0.08 -2.30 0.18 0.00 0.87 0.00 0.00 54.58 53.40 2cqx n ASN 20 Cb 0.04 -0.56 0.38 0.00 -1.02 0.00 0.00 39.78 38.61 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 0.39 0.42 -1.22 6.41 3.58 -2.02 -0.01 116.42 123.97 2cqx h ASP 21 Ca 0.10 0.17 0.38 0.00 0.42 0.00 0.00 57.03 58.10 2cqx h ASP 21 Cb 1.24 0.14 -0.08 0.00 1.72 0.00 0.00 39.33 42.35 2cqx h ASP 21 CO 0.20 -0.05 0.84 0.41 -2.88 0.00 0.00 179.24 177.76 2cqx n THR 22 N -5.04 -0.09 -0.01 2.25 -1.04 -1.26 0.21 114.28 109.30 2cqx n THR 22 Ca 0.27 1.19 -0.13 0.00 -2.04 0.00 0.00 64.05 63.34 2cqx n THR 22 Cb 0.80 -1.96 -0.10 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 -0.01 -1.10 -4.42 4.07 -1.37 -3.11 115.31 109.37 2cqx h LEU 23 Ca 0.66 -0.45 0.37 0.00 0.08 0.00 0.00 57.88 58.54 2cqx h LEU 23 Cb 2.41 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 44.05 2cqx h LEU 23 CO -0.17 0.45 0.72 1.21 -1.08 0.00 0.00 178.44 179.57 2cqx n GLU 24 N -4.88 -0.02 0.01 1.13 0.00 0.56 -0.32 120.64 117.12 2cqx n GLU 24 Ca -0.08 0.92 -0.01 0.00 0.00 0.00 0.00 57.16 57.98 2cqx n GLU 24 Cb 0.24 -1.85 -0.00 0.00 0.00 0.00 0.00 31.44 29.83 2cqx n GLU 24 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2cqx h LYS 25 N 0.00 -0.06 -1.13 5.31 3.64 -1.58 -3.32 116.57 119.42 2cqx h LYS 25 Ca 0.66 0.00 0.36 0.00 -1.27 0.00 0.00 60.65 60.41 2cqx h LYS 25 Cb 2.22 0.01 -0.13 0.00 -0.41 0.00 0.00 32.23 33.92 2cqx h LYS 25 CO -0.30 -0.04 0.70 -0.24 -2.27 0.00 0.00 179.45 177.30 2cqx h VAL 26 N -0.34 0.25 -0.66 2.00 3.04 -0.83 0.70 116.25 120.40 2cqx h VAL 26 Ca -0.01 -0.08 0.13 0.00 -1.01 0.00 0.00 66.70 65.74 2cqx h VAL 26 Cb 0.05 0.01 -0.10 0.00 -2.01 0.00 0.00 31.29 29.24 2cqx h VAL 26 CO 0.01 0.04 0.13 0.15 -1.01 0.00 0.00 177.57 176.89 2cqx h PHE 27 N 0.22 0.20 -0.36 3.17 3.04 -0.75 0.37 116.94 122.83 2cqx h PHE 27 Ca 0.75 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.74 2cqx h PHE 27 Cb 2.03 0.01 0.00 0.00 2.56 0.00 0.00 35.95 40.55 2cqx h PHE 27 CO -0.01 -0.07 0.00 1.55 -2.02 0.00 0.00 178.31 177.76 2cqx n VAL 28 N -5.16 0.70 -0.12 1.41 3.14 0.11 0.20 118.33 118.61 2cqx n VAL 28 Ca 0.11 -0.85 -0.25 0.00 -2.96 0.00 0.00 64.34 60.39 2cqx n VAL 28 Cb 0.38 0.75 -0.09 0.00 -1.06 0.00 0.00 33.84 33.82 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 1.82 -0.08 6.55 2.88 0.20 -4.83 113.62 121.11 2cqx n SER 29 Ca 0.15 0.24 -0.13 0.00 -1.33 0.00 0.00 58.87 57.80 2cqx n SER 29 Cb 0.47 -0.69 -0.07 0.00 -0.75 0.00 0.00 64.21 63.18 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 -3.99 0.87 -3.64 2.46 0.24 0.12 -5.00 118.33 109.39 2cqx n VAL 30 Ca -0.48 -0.29 -0.05 0.00 -2.04 0.00 0.00 64.34 61.47 2cqx n VAL 30 Cb 0.86 -1.28 -0.06 0.00 -1.47 0.00 0.00 33.84 31.89 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 -2.30 0.00 0.11 3.34 -1.32 -0.58 -5.04 115.64 109.85 2cqx s THR 31 Ca -0.21 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.20 2cqx s THR 31 Cb 0.06 -1.00 -0.19 0.00 -1.51 0.00 0.00 72.50 69.86 2cqx s THR 31 CO 0.32 0.00 1.27 0.11 -2.21 0.00 0.00 174.62 174.12 2cqx h LYS 32 N 3.17 0.51 -3.19 7.08 1.57 -0.49 -3.30 116.57 121.92 2cqx h LYS 32 Ca -0.23 -0.54 -0.66 0.00 -1.87 0.00 0.00 60.65 57.35 2cqx h LYS 32 Cb 1.19 0.15 -0.39 0.00 0.08 0.00 0.00 32.23 33.26 2cqx h LYS 32 CO 0.18 1.17 -0.36 0.71 -0.57 0.00 0.00 179.45 180.58 2cqx s TYR 33 N -3.31 3.72 1.05 -1.35 1.51 -1.26 -4.90 117.35 112.80 2cqx s TYR 33 Ca -0.07 -3.21 -0.14 0.00 -1.01 0.00 0.00 57.07 52.65 2cqx s TYR 33 Cb 0.08 -2.95 0.21 0.00 -0.11 0.00 0.00 41.96 39.20 2cqx s TYR 33 CO 0.88 -0.63 1.10 -1.25 -1.11 0.00 0.00 175.55 174.54 2cqx s PRO 34 N -1.40 0.03 0.31 -1.71 0.04 -1.26 -5.09 135.00 125.92 2cqx s PRO 34 Ca 0.26 0.38 0.07 0.00 0.04 0.00 0.00 61.00 61.75 2cqx s PRO 34 Cb -0.06 -1.70 -0.06 0.00 0.04 0.00 0.00 34.50 32.72 2cqx s PRO 34 CO -0.15 -2.97 -0.04 -0.51 0.04 0.00 0.00 177.00 173.37 2cqx s ASP 35 N -3.53 2.98 0.26 6.66 1.11 -1.26 -5.01 116.67 117.88 2cqx s ASP 35 Ca 0.67 -1.24 0.01 0.00 0.18 0.00 0.00 52.55 52.16 2cqx s ASP 35 Cb -0.17 -0.21 0.62 0.00 1.07 0.00 0.00 42.92 44.23 2cqx s ASP 35 CO 0.57 -0.37 1.33 1.21 1.18 0.00 0.00 175.17 179.09 2cqx n GLU 36 N -0.68 -0.07 -0.36 8.23 2.13 -1.26 0.28 120.64 128.92 2cqx n GLU 36 Ca -0.05 1.27 -0.02 0.00 0.66 0.00 0.00 57.16 59.03 2cqx n GLU 36 Cb 0.64 -2.01 0.04 0.00 0.27 0.00 0.00 31.44 30.38 2cqx n GLU 36 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2cqx h LYS 37 N 0.00 -0.02 -0.10 5.31 1.57 -2.01 0.13 116.57 121.45 2cqx h LYS 37 Ca 0.50 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.26 2cqx h LYS 37 Cb 1.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 2cqx h LYS 37 CO -0.80 -0.01 -0.02 -0.09 -0.57 0.00 0.00 179.45 177.95 2cqx h ARG 38 N -0.02 0.19 -1.11 3.15 2.43 -0.57 -2.98 114.38 115.47 2cqx h ARG 38 Ca 0.33 -0.07 0.31 0.00 -0.81 0.00 0.00 59.98 59.74 2cqx h ARG 38 Cb 0.59 -0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.03 2cqx h ARG 38 CO -0.95 0.50 0.72 -0.07 -1.51 0.00 0.00 179.97 178.66 2cqx h LEU 39 N -0.13 0.36 -1.20 3.80 -0.00 -0.44 0.27 115.31 117.98 2cqx h LEU 39 Ca 0.03 0.09 0.26 0.00 -0.00 0.00 0.00 57.88 58.26 2cqx h LEU 39 Cb 0.42 0.03 -0.11 0.00 -0.00 0.00 0.00 40.66 41.01 2cqx h LEU 39 CO 0.01 0.02 0.64 0.11 -0.00 0.00 0.00 178.44 179.22 2cqx h LYS 40 N 0.29 0.45 0.14 1.13 1.79 -0.70 0.11 116.57 119.79 2cqx h LYS 40 Ca 0.64 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 59.07 2cqx h LYS 40 Cb 1.80 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 32.35 2cqx h LYS 40 CO -0.29 0.30 -0.07 0.78 -1.08 0.00 0.00 179.45 179.09 2cqx h GLY 41 N 0.47 -0.19 -0.54 3.86 0.00 -0.61 -3.32 103.07 102.73 2cqx h GLY 41 Ca 0.63 0.07 0.34 0.00 0.00 0.00 0.00 47.33 48.37 2cqx h GLY 41 CO -0.39 -0.07 0.78 1.41 0.00 0.00 0.00 176.54 178.27 2cqx h LEU 42 N -0.67 0.29 -0.73 3.11 3.38 -1.47 0.17 115.31 119.40 2cqx h LEU 42 Ca -0.02 0.08 0.16 0.00 0.09 0.00 0.00 57.88 58.19 2cqx h LEU 42 Cb 0.14 0.05 -0.11 0.00 0.09 0.00 0.00 40.66 40.83 2cqx h LEU 42 CO 0.03 -0.02 0.16 -1.28 0.09 0.00 0.00 178.44 177.42 2cqx h SER 43 N 0.22 -0.03 0.03 -0.43 0.87 -0.87 0.44 113.55 113.78 2cqx h SER 43 Ca 0.67 0.15 -0.06 0.00 -1.23 0.00 0.00 61.79 61.32 2cqx h SER 43 Cb 2.04 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 64.22 2cqx h SER 43 CO -0.28 -0.05 -0.30 0.11 -0.53 0.00 0.00 176.83 175.78 2cqx h LYS 44 N 0.25 0.06 -0.62 2.24 1.79 -0.81 0.85 116.57 120.33 2cqx h LYS 44 Ca 0.41 -0.10 0.10 0.00 -2.18 0.00 0.00 60.65 58.87 2cqx h LYS 44 Cb 0.71 0.04 -0.11 0.00 -1.58 0.00 0.00 32.23 31.28 2cqx h LYS 44 CO -0.52 1.05 -0.40 0.37 -1.08 0.00 0.00 179.45 178.87 2cqx h GLN 45 N -0.87 -0.18 -0.64 3.15 4.15 -0.94 0.10 115.11 119.88 2cqx h GLN 45 Ca -0.07 0.01 -0.16 0.00 0.77 0.00 0.00 58.65 59.20 2cqx h GLN 45 Cb 1.17 0.04 -0.10 0.00 0.21 0.00 0.00 27.48 28.80 2cqx h GLN 45 CO 0.01 -0.12 0.19 1.28 -1.93 0.00 0.00 178.83 178.26 2cqx n LEU 46 N -5.42 5.70 -3.85 -2.39 4.77 0.11 -4.94 117.00 110.98 2cqx n LEU 46 Ca 0.03 -3.20 -0.25 0.00 -0.03 0.00 0.00 56.01 52.56 2cqx n LEU 46 Cb 0.35 -0.71 -0.07 0.00 -2.33 0.00 0.00 43.42 40.66 2cqx n LEU 46 CO -0.02 0.80 -0.30 -0.67 -1.33 0.00 0.00 177.39 175.87 2cqx n ASP 47 N -0.16 0.21 -4.69 -1.43 2.03 0.35 -4.89 116.55 107.97 2cqx n ASP 47 Ca 0.37 -0.96 -0.26 0.00 0.52 0.00 0.00 54.79 54.46 2cqx n ASP 47 Cb 1.29 -1.20 -0.01 0.00 -0.72 0.00 0.00 41.12 40.49 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 -3.57 -0.42 -4.27 -0.67 7.02 0.28 -4.97 117.44 110.85 2cqx n TRP 48 Ca -0.17 -2.24 -0.34 0.00 -1.02 0.00 0.00 57.50 53.73 2cqx n TRP 48 Cb 0.48 -0.42 -0.11 0.00 -2.42 0.00 0.00 31.31 28.85 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 -4.03 5.17 0.39 -0.99 0.01 -1.26 -4.53 113.70 108.46 2cqx s SER 49 Ca 0.26 0.00 0.31 0.00 1.31 0.00 0.00 55.95 57.83 2cqx s SER 49 Cb -0.02 -1.77 1.30 0.00 0.21 0.00 0.00 66.02 65.73 2cqx s SER 49 CO 0.17 0.22 1.31 0.55 0.41 0.00 0.00 173.24 175.89 2cqx n VAL 50 N 3.21 -0.16 0.02 3.43 3.14 -1.26 0.33 118.33 127.04 2cqx n VAL 50 Ca -0.17 1.45 -0.07 0.00 -2.96 0.00 0.00 64.34 62.59 2cqx n VAL 50 Cb 0.53 -2.38 -0.05 0.00 -1.06 0.00 0.00 33.84 30.87 2cqx n VAL 50 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 2cqx h ARG 51 N 0.00 -0.15 -0.75 1.45 -0.00 -1.99 -2.72 114.38 110.22 2cqx h ARG 51 Ca 0.75 0.01 0.17 0.00 -0.50 0.00 0.00 59.98 60.41 2cqx h ARG 51 Cb 2.57 0.03 -0.13 0.00 0.00 0.00 0.00 29.97 32.44 2cqx h ARG 51 CO -0.30 0.17 0.05 -0.22 0.00 0.00 0.00 179.97 179.67 2cqx h LYS 52 N -0.99 0.13 0.73 0.04 3.64 -0.52 -1.87 116.57 117.74 2cqx h LYS 52 Ca -0.02 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2cqx h LYS 52 Cb 0.38 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2cqx h LYS 52 CO 0.03 0.09 -0.35 0.82 -2.27 0.00 0.00 179.45 177.76 2cqx h ILE 53 N 0.14 0.22 -0.83 2.00 2.04 -1.24 -2.88 117.51 116.96 2cqx h ILE 53 Ca 0.42 -0.12 0.33 0.00 1.00 0.00 0.00 64.86 66.49 2cqx h ILE 53 Cb 0.75 0.25 -0.15 0.00 -0.74 0.00 0.00 36.82 36.93 2cqx h ILE 53 CO -0.63 0.01 0.38 0.00 0.00 0.00 0.00 178.15 177.91 2cqx n GLN 54 N -5.48 -0.05 -0.18 2.37 6.02 -0.74 0.22 117.38 119.54 2cqx n GLN 54 Ca -0.14 1.17 -0.07 0.00 -0.01 0.00 0.00 57.00 57.95 2cqx n GLN 54 Cb 0.40 -2.05 0.02 0.00 1.02 0.00 0.00 30.24 29.63 2cqx n GLN 54 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2cqx h TRP 56 N 0.71 0.38 0.79 0.00 7.01 0.28 -1.64 115.95 123.49 2cqx h TRP 56 Ca 0.18 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.17 2cqx h TRP 56 Cb 0.08 -0.10 0.00 0.00 -2.10 0.00 0.00 29.16 27.05 2cqx h TRP 56 CO -0.01 0.16 -0.43 0.74 -2.79 0.00 0.00 178.44 176.11 2cqx h PHE 57 N 0.42 -1.13 -1.03 2.65 0.04 -1.22 -1.83 116.94 114.83 2cqx h PHE 57 Ca 0.23 -0.02 0.27 0.00 2.80 0.00 0.00 57.97 61.25 2cqx h PHE 57 Cb 0.20 0.39 -0.12 0.00 2.20 0.00 0.00 35.95 38.63 2cqx h PHE 57 CO -0.13 -0.67 0.63 -0.09 -0.60 0.00 0.00 178.31 177.45 2cqx h ARG 58 N -1.13 0.46 -0.63 1.51 2.43 -1.25 0.30 114.38 116.07 2cqx h ARG 58 Ca -0.11 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.96 2cqx h ARG 58 Cb 0.89 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.31 2cqx h ARG 58 CO 0.14 0.31 0.10 1.25 -1.51 0.00 0.00 179.97 180.26 2cqx h HIS 59 N 0.48 1.10 -0.46 2.20 2.76 -0.91 -3.02 115.15 117.30 2cqx h HIS 59 Ca 0.64 -0.15 0.08 0.00 -2.20 0.00 0.00 60.37 58.73 2cqx h HIS 59 Cb 1.42 -0.30 -0.06 0.00 1.55 0.00 0.00 27.41 30.01 2cqx h HIS 59 CO -0.01 0.94 0.09 -0.09 -1.30 0.00 0.00 177.93 177.56 2cqx h ARG 60 N 0.95 0.21 -0.24 5.26 9.65 0.43 -1.17 114.38 129.46 2cqx h ARG 60 Ca 0.19 -0.01 0.05 0.00 -1.10 0.00 0.00 59.98 59.10 2cqx h ARG 60 Cb 0.43 -0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 28.89 2cqx h ARG 60 CO 0.01 0.14 -0.48 0.00 2.80 0.00 0.00 179.97 182.44 2cqx h ARG 61 N 0.22 -0.45 0.12 0.20 2.47 -1.36 0.18 114.38 115.75 2cqx h ARG 61 Ca 0.23 0.03 0.01 0.00 -1.26 0.00 0.00 59.98 58.99 2cqx h ARG 61 Cb 0.29 0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 28.69 2cqx h ARG 61 CO -0.30 -0.30 -0.20 -0.91 0.56 0.00 0.00 179.97 178.82 2cqx h ASN 62 N -0.47 -0.54 -0.74 7.04 2.35 -1.50 0.45 115.58 122.17 2cqx h ASN 62 Ca 0.08 0.06 0.16 0.00 -0.55 0.00 0.00 56.30 56.05 2cqx h ASN 62 Cb 0.63 0.20 -0.11 0.00 0.05 0.00 0.00 38.32 39.10 2cqx h ASN 62 CO -0.48 -0.28 0.19 -0.61 -1.65 0.00 0.00 177.43 174.60 2cqx h GLN 63 N -0.38 0.27 -0.24 0.81 5.75 -0.65 -0.27 115.11 120.40 2cqx h GLN 63 Ca 0.02 -0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.47 2cqx h GLN 63 Cb 0.39 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 2cqx h GLN 63 CO -0.10 0.18 -0.01 -0.44 -2.65 0.00 0.00 178.83 175.81 2cqx h ASP 64 N 0.28 0.42 -3.17 -0.69 5.19 -0.18 -3.36 116.42 114.90 2cqx h ASP 64 Ca 0.42 -0.32 -0.63 0.00 -0.62 0.00 0.00 57.03 55.89 2cqx h ASP 64 Cb 0.72 -0.11 -0.42 0.00 0.18 0.00 0.00 39.33 39.70 2cqx h ASP 64 CO -0.51 0.63 -0.55 -0.54 -3.12 0.00 0.00 179.24 175.15 2cqx s LYS 65 N -4.96 2.48 0.36 3.56 1.02 0.11 -5.09 119.74 117.22 2cqx s LYS 65 Ca -0.14 -3.32 -0.27 0.00 0.02 0.00 0.00 55.97 52.26 2cqx s LYS 65 Cb 0.07 -3.45 -0.09 0.00 -0.52 0.00 0.00 37.83 33.84 2cqx s LYS 65 CO 0.74 -1.28 1.21 -1.25 -0.92 0.00 0.00 175.35 173.85 2cqx s PRO 66 N -1.41 4.26 -0.04 -1.68 0.04 -0.26 -4.58 135.00 131.33 2cqx s PRO 66 Ca 0.25 1.97 -0.02 0.00 0.04 0.00 0.00 61.00 63.23 2cqx s PRO 66 Cb -0.06 -2.90 0.03 0.00 0.04 0.00 0.00 34.50 31.61 2cqx s PRO 66 CO -0.16 -0.19 0.10 -1.12 0.04 0.00 0.00 177.00 175.68 2cqx s SER 67 N -0.86 -0.06 0.00 6.66 0.01 -1.26 -5.06 113.70 113.13 2cqx s SER 67 Ca 0.52 0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.98 2cqx s SER 67 Cb -0.34 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.02 2cqx s SER 67 CO 0.44 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.60 2cqx n GLY 68 N 3.82 0.25 3.77 3.44 0.00 -1.26 -5.14 105.19 110.05 2cqx n GLY 68 Ca -0.22 0.09 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 2cqx n GLY 68 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cqx s PRO 69 N 0.00 4.04 0.07 1.61 0.04 -1.26 -5.01 135.00 134.49 2cqx s PRO 69 Ca 0.00 1.89 -0.24 0.00 0.04 0.00 0.00 61.00 62.68 2cqx s PRO 69 Cb 0.00 -2.69 -0.06 0.00 0.04 0.00 0.00 34.50 31.79 2cqx s PRO 69 CO 0.00 -0.34 0.75 0.45 0.04 0.00 0.00 177.00 177.89 2cqx s SER 70 N -1.08 7.23 -0.65 6.66 0.15 -1.26 -4.97 113.70 119.78 2cqx s SER 70 Ca 0.57 1.46 -0.01 0.00 0.70 0.00 0.00 55.95 58.67 2cqx s SER 70 Cb -0.32 -2.46 0.43 0.00 -1.71 0.00 0.00 66.02 61.96 2cqx s SER 70 CO 0.40 0.08 1.92 -1.20 1.20 0.00 0.00 173.24 175.64 2cqx n SER 71 N 2.48 7.30 0.00 5.45 7.64 -1.26 -5.01 113.62 130.22 2cqx n SER 71 Ca -0.04 -3.79 0.02 0.00 1.01 0.00 0.00 58.87 56.07 2cqx n SER 71 Cb 0.50 -0.91 0.14 0.00 -1.01 0.00 0.00 64.21 62.92 2cqx n SER 71 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64