#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 5.74 0.74 1.61 0.15 -1.26 -5.08 113.70 115.60 2cqx s SER 2 Ca 0.00 -1.67 -0.08 0.00 0.70 0.00 0.00 55.95 54.89 2cqx s SER 2 Cb 0.00 -2.03 0.07 0.00 -1.71 0.00 0.00 66.02 62.35 2cqx s SER 2 CO 0.00 -0.63 1.07 -0.55 1.20 0.00 0.00 173.24 174.33 2cqx s SER 3 N 2.48 4.68 0.00 5.45 0.15 -1.26 -5.06 113.70 120.14 2cqx s SER 3 Ca 0.04 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.25 2cqx s SER 3 Cb -0.25 -1.14 0.00 0.00 -1.71 0.00 0.00 66.02 62.92 2cqx s SER 3 CO 0.01 -1.72 0.00 0.61 1.20 0.00 0.00 173.24 173.34 2cqx n GLY 4 N -3.06 -0.01 3.58 9.45 0.00 -1.26 -5.05 105.19 108.84 2cqx n GLY 4 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2cqx n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqx s SER 5 N -1.11 6.54 -0.13 1.61 0.01 -1.26 -5.04 113.70 114.32 2cqx s SER 5 Ca 0.00 0.32 -0.01 0.00 1.31 0.00 0.00 55.95 57.57 2cqx s SER 5 Cb 0.00 -2.40 -0.02 0.00 0.21 0.00 0.00 66.02 63.81 2cqx s SER 5 CO 0.00 -0.75 -0.08 -0.94 0.41 0.00 0.00 173.24 171.88 2cqx s SER 6 N 1.86 4.44 0.00 2.44 1.04 -1.26 -5.02 113.70 117.20 2cqx s SER 6 Ca 0.31 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.55 2cqx s SER 6 Cb -0.13 -1.57 0.00 0.00 0.10 0.00 0.00 66.02 64.42 2cqx s SER 6 CO 0.17 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.21 2cqx n GLY 7 N 3.24 -1.73 2.62 7.32 0.00 -1.26 -4.86 105.19 110.52 2cqx n GLY 7 Ca -0.18 -2.02 -0.29 0.00 0.00 0.00 0.00 46.02 43.54 2cqx n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cqx s GLY 8 N -0.04 1.59 0.28 -0.02 0.00 -1.26 -4.93 107.32 102.94 2cqx s GLY 8 Ca 0.00 -2.60 0.26 0.00 0.00 0.00 0.00 44.72 42.38 2cqx s GLY 8 CO 0.00 1.71 1.76 0.16 0.00 0.00 0.00 173.10 176.72 2cqx h ILE 9 N 4.96 0.00 -4.01 0.90 3.07 -2.01 -3.44 117.51 116.98 2cqx h ILE 9 Ca 0.08 -0.43 -0.38 0.00 1.55 0.00 0.00 64.86 65.68 2cqx h ILE 9 Cb 0.91 1.33 -0.26 0.00 -0.27 0.00 0.00 36.82 38.53 2cqx h ILE 9 CO 0.45 0.00 -0.77 -0.54 -1.05 0.00 0.00 178.15 176.24 2cqx s LYS 10 N -3.25 0.74 -0.79 0.16 -0.14 -1.26 -5.06 119.74 110.14 2cqx s LYS 10 Ca 0.07 -0.57 -0.26 0.00 -1.36 0.00 0.00 55.97 53.86 2cqx s LYS 10 Cb 0.10 -0.69 -0.14 0.00 -1.68 0.00 0.00 37.83 35.41 2cqx s LYS 10 CO 0.52 0.17 2.41 -0.25 -0.76 0.00 0.00 175.35 177.45 2cqx n ASP 11 N 2.22 1.75 -4.51 2.83 9.92 -1.26 -4.88 116.55 122.61 2cqx n ASP 11 Ca -0.17 -1.47 -0.42 0.00 -0.53 0.00 0.00 54.79 52.19 2cqx n ASP 11 Cb 0.56 -1.64 0.00 0.00 -0.64 0.00 0.00 41.12 39.40 2cqx n ASP 11 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2cqx n SER 12 N 18.50 -0.11 -4.70 -2.24 7.64 -1.26 -4.94 113.62 126.50 2cqx n SER 12 Ca 0.47 0.98 -0.29 0.00 1.01 0.00 0.00 58.87 61.04 2cqx n SER 12 Cb 0.42 -1.19 0.15 0.00 -1.01 0.00 0.00 64.21 62.59 2cqx n SER 12 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2cqx s PRO 13 N -1.66 0.95 -0.06 1.43 0.04 -1.26 -4.92 135.00 129.52 2cqx s PRO 13 Ca 0.63 0.71 -0.29 0.00 0.04 0.00 0.00 61.00 62.09 2cqx s PRO 13 Cb -0.62 -1.78 -0.07 0.00 0.04 0.00 0.00 34.50 32.07 2cqx s PRO 13 CO 0.58 -2.43 1.94 0.14 0.04 0.00 0.00 177.00 177.27 2cqx s VAL 14 N -2.94 3.17 0.35 -0.36 -7.23 -1.26 -4.96 120.40 107.16 2cqx s VAL 14 Ca 0.64 0.20 0.07 0.00 -1.81 0.00 0.00 61.98 61.07 2cqx s VAL 14 Cb -0.18 -3.15 -0.03 0.00 0.56 0.00 0.00 36.38 33.58 2cqx s VAL 14 CO 0.57 -0.04 0.25 0.20 -0.31 0.00 0.00 175.10 175.77 2cqx s ASN 15 N 5.08 1.91 -0.30 4.85 0.01 -1.26 -5.14 114.94 120.10 2cqx s ASN 15 Ca 0.87 -1.75 -0.06 0.00 -0.71 0.00 0.00 52.86 51.21 2cqx s ASN 15 Cb -0.37 0.56 0.02 0.00 0.41 0.00 0.00 41.25 41.87 2cqx s ASN 15 CO 0.37 -1.05 0.06 -0.54 -1.51 0.00 0.00 177.10 174.44 2cqx s LYS 16 N -3.49 2.86 0.21 -0.60 1.02 -1.26 -4.99 119.74 113.49 2cqx s LYS 16 Ca 0.37 -1.00 -0.10 0.00 0.02 0.00 0.00 55.97 55.26 2cqx s LYS 16 Cb 0.02 -3.33 0.30 0.00 -0.52 0.00 0.00 37.83 34.31 2cqx s LYS 16 CO 0.25 -0.52 1.28 1.33 -0.92 0.00 0.00 175.35 176.78 2cqx n VAL 17 N 4.80 -0.39 -3.50 3.17 0.24 -1.26 -4.69 118.33 116.70 2cqx n VAL 17 Ca -0.14 1.91 -0.10 0.00 -2.04 0.00 0.00 64.34 63.97 2cqx n VAL 17 Cb 0.46 -2.59 -0.02 0.00 -1.47 0.00 0.00 33.84 30.23 2cqx n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2cqx s GLU 18 N -5.92 1.15 0.00 7.34 0.41 -1.26 -5.01 118.70 115.40 2cqx s GLU 18 Ca -0.12 -0.46 0.11 0.00 -0.41 0.00 0.00 54.97 54.09 2cqx s GLU 18 Cb 0.20 0.51 0.65 0.00 -1.78 0.00 0.00 34.13 33.70 2cqx s GLU 18 CO 0.62 -0.51 1.08 -0.35 -0.49 0.00 0.00 175.26 175.61 2cqx n PRO 19 N -0.34 0.49 -0.26 0.39 -0.04 -1.26 -3.34 135.00 130.63 2cqx n PRO 19 Ca -0.12 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.30 2cqx n PRO 19 Cb 0.63 -1.35 0.06 0.00 -0.04 0.00 0.00 33.50 32.80 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 -0.85 2.86 -0.37 3.54 5.03 -1.26 -4.45 115.26 119.76 2cqx n ASN 20 Ca 0.08 -2.32 0.29 0.00 0.87 0.00 0.00 54.58 53.50 2cqx n ASN 20 Cb 0.04 -0.57 0.56 0.00 -1.02 0.00 0.00 39.78 38.79 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 0.42 0.39 -1.52 6.41 1.82 -2.01 0.15 116.42 122.08 2cqx h ASP 21 Ca 0.10 0.17 0.47 0.00 -0.39 0.00 0.00 57.03 57.39 2cqx h ASP 21 Cb 1.26 0.14 -0.09 0.00 0.68 0.00 0.00 39.33 41.32 2cqx h ASP 21 CO 0.21 -0.18 1.06 0.41 -1.61 0.00 0.00 179.24 179.13 2cqx n THR 22 N -4.93 -0.09 -0.05 2.25 -1.04 -1.26 0.19 114.28 109.36 2cqx n THR 22 Ca 0.34 1.40 -0.13 0.00 -2.04 0.00 0.00 64.05 63.63 2cqx n THR 22 Cb 1.17 -2.32 -0.07 0.00 -1.82 0.00 0.00 70.33 67.29 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 0.29 -0.84 -4.42 4.07 -1.08 -3.15 115.31 110.18 2cqx h LEU 23 Ca 0.80 -0.44 0.32 0.00 0.08 0.00 0.00 57.88 58.63 2cqx h LEU 23 Cb 2.97 -0.08 -0.15 0.00 1.08 0.00 0.00 40.66 44.48 2cqx h LEU 23 CO -0.16 0.67 0.34 1.21 -1.08 0.00 0.00 178.44 179.41 2cqx n GLU 24 N -4.65 -0.05 0.05 1.13 0.00 0.51 -0.21 120.64 117.41 2cqx n GLU 24 Ca -0.06 1.18 -0.02 0.00 0.00 0.00 0.00 57.16 58.25 2cqx n GLU 24 Cb 0.31 -2.05 -0.01 0.00 0.00 0.00 0.00 31.44 29.69 2cqx n GLU 24 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 2cqx h LYS 25 N 0.00 -0.14 -1.20 5.31 1.57 -1.59 -3.21 116.57 117.32 2cqx h LYS 25 Ca 0.66 0.01 0.38 0.00 -1.87 0.00 0.00 60.65 59.82 2cqx h LYS 25 Cb 1.66 0.03 -0.12 0.00 0.08 0.00 0.00 32.23 33.88 2cqx h LYS 25 CO -0.68 -0.09 0.76 -0.24 -0.57 0.00 0.00 179.45 178.63 2cqx h VAL 26 N -0.21 0.24 -0.56 0.50 3.04 -1.13 0.87 116.25 119.00 2cqx h VAL 26 Ca -0.01 -0.06 0.10 0.00 -1.01 0.00 0.00 66.70 65.72 2cqx h VAL 26 Cb 0.11 0.04 -0.08 0.00 -2.01 0.00 0.00 31.29 29.35 2cqx h VAL 26 CO 0.02 0.03 0.10 0.15 -1.01 0.00 0.00 177.57 176.87 2cqx h PHE 27 N 0.19 0.15 -0.36 3.17 3.04 -0.60 0.32 116.94 122.84 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 2.18 0.02 0.00 0.00 2.56 0.00 0.00 35.95 40.71 2cqx h PHE 27 CO -0.01 -0.04 0.00 1.55 -2.02 0.00 0.00 178.31 177.79 2cqx n VAL 28 N -5.15 0.70 -0.12 1.41 3.14 0.11 -0.66 118.33 117.76 2cqx n VAL 28 Ca 0.08 -0.85 -0.25 0.00 -2.96 0.00 0.00 64.34 60.36 2cqx n VAL 28 Cb 0.30 0.75 -0.09 0.00 -1.06 0.00 0.00 33.84 33.74 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 0.96 1.83 -0.07 6.55 2.88 0.26 -4.85 113.62 121.18 2cqx n SER 29 Ca 0.15 0.23 -0.13 0.00 -1.33 0.00 0.00 58.87 57.78 2cqx n SER 29 Cb 0.48 -0.67 -0.06 0.00 -0.75 0.00 0.00 64.21 63.21 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 -3.95 0.79 -3.63 2.46 0.24 0.99 -5.00 118.33 110.24 2cqx n VAL 30 Ca -0.48 -0.24 -0.05 0.00 -2.04 0.00 0.00 64.34 61.54 2cqx n VAL 30 Cb 0.86 -1.43 -0.05 0.00 -1.47 0.00 0.00 33.84 31.75 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 -2.27 0.00 0.17 3.34 -1.32 -0.42 -5.04 115.64 110.11 2cqx s THR 31 Ca -0.20 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.30 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 0.28 0.00 1.40 0.11 -2.21 0.00 0.00 174.62 174.19 2cqx h LYS 32 N 2.66 0.22 -3.17 7.08 1.57 -1.13 -3.29 116.57 120.51 2cqx h LYS 32 Ca -0.17 -0.23 -0.63 0.00 -1.87 0.00 0.00 60.65 57.75 2cqx h LYS 32 Cb 1.18 0.06 -0.42 0.00 0.08 0.00 0.00 32.23 33.14 2cqx h LYS 32 CO 0.22 0.94 -0.59 0.71 -0.57 0.00 0.00 179.45 180.16 2cqx s TYR 33 N -3.29 3.43 1.02 -1.35 1.51 -1.26 -4.90 117.35 112.50 2cqx s TYR 33 Ca -0.03 -3.28 -0.13 0.00 -1.01 0.00 0.00 57.07 52.62 2cqx s TYR 33 Cb 0.10 -2.73 0.20 0.00 -0.11 0.00 0.00 41.96 39.43 2cqx s TYR 33 CO 0.83 -0.61 1.09 -1.25 -1.11 0.00 0.00 175.55 174.50 2cqx s PRO 34 N -1.09 0.26 0.29 -1.71 0.04 -1.26 -5.08 135.00 126.45 2cqx s PRO 34 Ca 0.22 0.46 0.11 0.00 0.04 0.00 0.00 61.00 61.84 2cqx s PRO 34 Cb -0.11 -1.72 -0.05 0.00 0.04 0.00 0.00 34.50 32.66 2cqx s PRO 34 CO -0.11 -2.84 -0.17 -0.51 0.04 0.00 0.00 177.00 173.41 2cqx s ASP 35 N -3.47 3.70 0.17 6.66 1.11 -1.26 -5.00 116.67 118.59 2cqx s ASP 35 Ca 0.66 -1.01 -0.16 0.00 0.18 0.00 0.00 52.55 52.22 2cqx s ASP 35 Cb -0.18 -0.36 0.15 0.00 1.07 0.00 0.00 42.92 43.59 2cqx s ASP 35 CO 0.58 0.01 1.23 1.21 1.18 0.00 0.00 175.17 179.38 2cqx n GLU 36 N -0.67 -0.22 -0.25 8.23 4.07 -1.26 0.71 120.64 131.26 2cqx n GLU 36 Ca -0.05 1.22 0.10 0.00 -0.06 0.00 0.00 57.16 58.37 2cqx n GLU 36 Cb 0.60 -1.81 0.20 0.00 -0.06 0.00 0.00 31.44 30.37 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 -5.14 -0.06 -0.01 5.31 5.02 -1.26 0.11 118.16 122.13 2cqx n LYS 37 Ca 0.07 1.06 -0.16 0.00 -2.02 0.00 0.00 58.31 57.26 2cqx n LYS 37 Cb 0.30 -1.68 -0.11 0.00 -0.02 0.00 0.00 35.03 33.52 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 0.27 -1.09 1.97 2.43 -0.12 -3.26 114.38 114.59 2cqx h ARG 38 Ca 0.42 -0.29 0.30 0.00 -0.81 0.00 0.00 59.98 59.60 2cqx h ARG 38 Cb 0.84 0.08 -0.11 0.00 -0.42 0.00 0.00 29.97 30.37 2cqx h ARG 38 CO -0.67 1.00 0.69 -0.07 -1.51 0.00 0.00 179.97 179.41 2cqx h LEU 39 N -0.34 0.43 -0.92 3.80 -0.00 0.14 0.18 115.31 118.60 2cqx h LEU 39 Ca -0.05 0.10 0.24 0.00 -0.00 0.00 0.00 57.88 58.17 2cqx h LEU 39 Cb 1.13 0.04 -0.13 0.00 -0.00 0.00 0.00 40.66 41.71 2cqx h LEU 39 CO 0.08 0.02 0.42 0.11 -0.00 0.00 0.00 178.44 179.07 2cqx h LYS 40 N 0.34 0.37 0.24 1.13 1.57 -1.04 0.18 116.57 119.36 2cqx h LYS 40 Ca 0.65 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.40 2cqx h LYS 40 Cb 1.70 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.93 2cqx h LYS 40 CO -0.35 0.24 -0.11 0.78 -0.57 0.00 0.00 179.45 179.44 2cqx h GLY 41 N 0.38 -0.33 -0.43 3.86 0.00 -0.83 -3.29 103.07 102.43 2cqx h GLY 41 Ca 0.59 0.12 0.25 0.00 0.00 0.00 0.00 47.33 48.30 2cqx h GLY 41 CO -0.55 -0.12 0.33 1.41 0.00 0.00 0.00 176.54 177.60 2cqx h LEU 42 N -0.52 0.15 -0.97 3.11 3.38 -1.49 0.16 115.31 119.14 2cqx h LEU 42 Ca -0.03 0.19 0.30 0.00 0.09 0.00 0.00 57.88 58.43 2cqx h LEU 42 Cb 0.24 0.22 -0.17 0.00 0.09 0.00 0.00 40.66 41.04 2cqx h LEU 42 CO 0.05 -0.13 0.22 -1.28 0.09 0.00 0.00 178.44 177.39 2cqx h SER 43 N 0.26 -0.14 0.05 -0.43 0.87 -0.73 0.54 113.55 113.97 2cqx h SER 43 Ca 0.59 0.25 -0.16 0.00 -1.23 0.00 0.00 61.79 61.24 2cqx h SER 43 Cb 1.22 0.37 -0.01 0.00 -0.44 0.00 0.00 62.40 63.54 2cqx h SER 43 CO -0.63 -0.33 -0.83 0.50 -0.53 0.00 0.00 176.83 175.01 2cqx h LYS 44 N 0.06 0.11 -0.61 2.24 3.11 -0.82 1.10 116.57 121.77 2cqx h LYS 44 Ca 0.66 -0.19 0.06 0.00 -2.81 0.00 0.00 60.65 58.37 2cqx h LYS 44 Cb 1.48 0.07 -0.10 0.00 -1.00 0.00 0.00 32.23 32.68 2cqx h LYS 44 CO -0.82 1.09 -0.57 0.37 -2.81 0.00 0.00 179.45 176.72 2cqx h GLN 45 N -0.71 -0.25 -0.95 1.90 4.15 -0.12 0.11 115.11 119.25 2cqx h GLN 45 Ca -0.19 0.02 -0.42 0.00 0.77 0.00 0.00 58.65 58.83 2cqx h GLN 45 Cb 1.39 0.06 -0.25 0.00 0.21 0.00 0.00 27.48 28.89 2cqx h GLN 45 CO -0.01 -0.17 0.53 1.28 -1.93 0.00 0.00 178.83 178.52 2cqx n LEU 46 N -5.33 6.32 -4.02 -2.39 4.77 0.02 -4.90 117.00 111.46 2cqx n LEU 46 Ca -0.02 -3.35 -0.34 0.00 -0.03 0.00 0.00 56.01 52.27 2cqx n LEU 46 Cb 0.31 -0.80 -0.07 0.00 -2.33 0.00 0.00 43.42 40.54 2cqx n LEU 46 CO -0.05 0.95 -0.17 -0.67 -1.33 0.00 0.00 177.39 176.12 2cqx n ASP 47 N -0.81 -1.15 -3.78 -1.43 -0.08 0.40 -4.88 116.55 104.82 2cqx n ASP 47 Ca 0.51 -1.04 -0.15 0.00 -1.51 0.00 0.00 54.79 52.60 2cqx n ASP 47 Cb 1.53 -1.32 0.01 0.00 2.34 0.00 0.00 41.12 43.67 2cqx n ASP 47 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11 2cqx n TRP 48 N -3.53 -1.25 -5.09 -0.67 7.02 0.38 -4.96 117.44 109.34 2cqx n TRP 48 Ca 0.04 -1.43 -0.32 0.00 -1.02 0.00 0.00 57.50 54.77 2cqx n TRP 48 Cb 0.41 -0.29 -0.15 0.00 -2.42 0.00 0.00 31.31 28.86 2cqx n TRP 48 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2cqx s SER 49 N -3.06 3.55 0.45 -0.99 1.04 -1.26 -4.38 113.70 109.05 2cqx s SER 49 Ca 0.23 -0.33 0.35 0.00 0.48 0.00 0.00 55.95 56.68 2cqx s SER 49 Cb -0.02 -0.62 1.51 0.00 0.10 0.00 0.00 66.02 66.99 2cqx s SER 49 CO 0.15 0.33 1.53 0.55 0.98 0.00 0.00 173.24 176.78 2cqx n VAL 50 N 2.40 -0.20 0.10 5.02 3.14 -1.26 -0.06 118.33 127.47 2cqx n VAL 50 Ca -0.17 1.72 -0.09 0.00 -2.96 0.00 0.00 64.34 62.84 2cqx n VAL 50 Cb 0.52 -2.82 -0.06 0.00 -1.06 0.00 0.00 33.84 30.41 2cqx n VAL 50 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 2cqx h ARG 51 N 0.00 -0.32 -0.43 1.45 2.43 -1.98 -2.62 114.38 112.90 2cqx h ARG 51 Ca 0.88 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 60.15 2cqx h ARG 51 Cb 2.96 0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 32.50 2cqx h ARG 51 CO -0.38 -0.01 -0.05 -0.22 -1.51 0.00 0.00 179.97 177.80 2cqx h LYS 52 N -0.97 0.06 -0.36 0.20 3.64 -0.87 -1.70 116.57 116.55 2cqx h LYS 52 Ca -0.03 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 2cqx h LYS 52 Cb 0.46 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.22 2cqx h LYS 52 CO 0.06 0.04 0.07 0.82 -2.27 0.00 0.00 179.45 178.17 2cqx h ILE 53 N 0.06 0.82 -0.74 2.00 2.04 -1.05 -2.02 117.51 118.62 2cqx h ILE 53 Ca 0.21 -0.07 0.13 0.00 1.00 0.00 0.00 64.86 66.13 2cqx h ILE 53 Cb 0.32 0.61 -0.09 0.00 -0.74 0.00 0.00 36.82 36.92 2cqx h ILE 53 CO -0.40 0.04 0.31 1.56 0.00 0.00 0.00 178.15 179.66 2cqx h GLN 54 N 0.20 0.47 0.00 2.37 1.08 -0.93 0.34 115.11 118.64 2cqx h GLN 54 Ca 0.17 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.34 2cqx h GLN 54 Cb 0.20 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.52 2cqx h GLN 54 CO -0.22 0.31 -0.01 0.00 -0.95 0.00 0.00 178.83 177.95 2cqx h TRP 56 N 0.00 0.00 0.10 0.00 7.01 -0.08 -2.66 115.95 120.31 2cqx h TRP 56 Ca -0.00 0.00 -0.29 0.00 2.11 0.00 0.00 58.89 60.71 2cqx h TRP 56 Cb 0.06 0.00 0.03 0.00 -2.10 0.00 0.00 29.16 27.14 2cqx h TRP 56 CO 0.00 0.90 -1.20 0.74 -2.79 0.00 0.00 178.44 176.09 2cqx h PHE 57 N 0.00 0.96 -0.07 2.65 -1.00 -0.83 -3.03 116.94 115.62 2cqx h PHE 57 Ca -0.01 -0.59 -0.02 0.00 2.81 0.00 0.00 57.97 60.16 2cqx h PHE 57 Cb 1.60 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 41.08 2cqx h PHE 57 CO 0.00 1.43 -0.02 0.07 -1.61 0.00 0.00 178.31 178.19 2cqx h ARG 58 N 0.28 0.14 0.00 1.51 0.11 -1.48 -2.82 114.38 112.12 2cqx h ARG 58 Ca -0.17 -0.05 -0.00 0.00 0.10 0.00 0.00 59.98 59.85 2cqx h ARG 58 Cb 1.87 -0.01 -0.00 0.00 1.11 0.00 0.00 29.97 32.94 2cqx h ARG 58 CO 0.23 0.47 -0.01 1.25 0.10 0.00 0.00 179.97 182.01 2cqx h HIS 59 N -0.20 0.00 0.13 4.08 2.76 -1.59 -3.09 115.15 117.24 2cqx h HIS 59 Ca 0.02 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2cqx h HIS 59 Cb 0.42 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.38 2cqx h HIS 59 CO 0.05 0.01 -0.06 0.00 -1.30 0.00 0.00 177.93 176.63 2cqx h ARG 60 N 0.00 -0.17 -0.84 5.26 2.47 -1.37 -1.24 114.38 118.49 2cqx h ARG 60 Ca -0.00 0.01 0.35 0.00 -1.26 0.00 0.00 59.98 59.08 2cqx h ARG 60 Cb 0.02 0.04 -0.15 0.00 -1.65 0.00 0.00 29.97 28.23 2cqx h ARG 60 CO 0.00 -0.11 0.46 0.54 0.56 0.00 0.00 179.97 181.42 2cqx n ARG 61 N -2.65 -0.05 -0.03 0.04 1.74 -1.17 0.22 116.66 114.75 2cqx n ARG 61 Ca -0.02 1.13 -0.16 0.00 -0.77 0.00 0.00 57.85 58.03 2cqx n ARG 61 Cb 0.07 -2.03 -0.08 0.00 -1.02 0.00 0.00 32.46 29.40 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 0.67 0.41 0.55 -0.26 -1.56 -3.26 115.58 112.13 2cqx h ASN 62 Ca 0.70 -0.62 -0.02 0.00 -0.56 0.00 0.00 56.30 55.80 2cqx h ASN 62 Cb 1.87 -0.20 0.00 0.00 -1.06 0.00 0.00 38.32 38.94 2cqx h ASN 62 CO -0.62 1.18 -0.20 -0.61 -1.06 0.00 0.00 177.43 176.13 2cqx h GLN 63 N 0.21 -0.53 -0.80 0.81 -0.00 0.39 -3.16 115.11 112.02 2cqx h GLN 63 Ca -0.03 0.04 0.27 0.00 -0.00 0.00 0.00 58.65 58.93 2cqx h GLN 63 Cb 1.14 0.12 -0.15 0.00 0.00 0.00 0.00 27.48 28.59 2cqx h GLN 63 CO 0.11 -0.22 0.20 -3.47 0.00 0.00 0.00 178.83 175.45 2cqx n ASP 64 N -5.19 0.07 -4.81 -0.69 2.03 0.13 -4.19 116.55 103.90 2cqx n ASP 64 Ca -0.10 1.35 -0.37 0.00 0.52 0.00 0.00 54.79 56.19 2cqx n ASP 64 Cb 0.29 -0.56 -0.06 0.00 -0.72 0.00 0.00 41.12 40.06 2cqx n ASP 64 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2cqx s LYS 65 N -5.52 4.29 0.63 -0.67 2.20 -1.20 -5.06 119.74 114.42 2cqx s LYS 65 Ca -0.09 0.87 -0.16 0.00 -0.36 0.00 0.00 55.97 56.23 2cqx s LYS 65 Cb 0.25 -3.07 -0.01 0.00 -1.51 0.00 0.00 37.83 33.49 2cqx s LYS 65 CO 0.63 0.51 1.11 -1.25 -0.36 0.00 0.00 175.35 175.99 2cqx s PRO 66 N -1.56 2.93 0.39 4.03 0.04 -1.26 -4.92 135.00 134.66 2cqx s PRO 66 Ca 0.37 1.44 -0.06 0.00 0.04 0.00 0.00 61.00 62.79 2cqx s PRO 66 Cb -0.19 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 2cqx s PRO 66 CO 0.22 -1.15 0.69 -1.54 0.04 0.00 0.00 177.00 175.26 2cqx s SER 67 N -2.40 6.39 0.00 6.66 1.04 -1.26 -4.93 113.70 119.20 2cqx s SER 67 Ca 0.68 0.87 0.00 0.00 0.48 0.00 0.00 55.95 57.98 2cqx s SER 67 Cb -0.21 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 63.69 2cqx s SER 67 CO 0.38 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 174.82 2cqx n GLY 68 N -1.58 -2.56 3.67 7.32 0.00 -1.26 -5.16 105.19 105.62 2cqx n GLY 68 Ca -0.00 0.82 -0.29 0.00 0.00 0.00 0.00 46.02 46.55 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 0.34 -0.10 1.61 0.04 -1.26 -5.06 135.00 130.57 2cqx s PRO 69 Ca 0.00 0.50 0.01 0.00 0.04 0.00 0.00 61.00 61.55 2cqx s PRO 69 Cb 0.00 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.79 2cqx s PRO 69 CO 0.00 -2.79 -0.14 -1.12 0.04 0.00 0.00 177.00 172.99 2cqx s SER 70 N -3.45 3.93 -0.04 6.66 0.01 -1.26 -5.11 113.70 114.45 2cqx s SER 70 Ca 0.65 -0.30 -0.25 0.00 1.31 0.00 0.00 55.95 57.36 2cqx s SER 70 Cb -0.19 -1.33 -0.04 0.00 0.21 0.00 0.00 66.02 64.67 2cqx s SER 70 CO 0.58 0.22 0.76 -0.44 0.41 0.00 0.00 173.24 174.77 2cqx s SER 71 N -0.01 7.09 0.00 2.44 0.01 -1.26 -5.34 113.70 116.63 2cqx s SER 71 Ca -0.04 1.31 0.00 0.00 1.31 0.00 0.00 55.95 58.53 2cqx s SER 71 Cb -0.14 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2cqx s SER 71 CO 0.04 -0.11 0.37 0.61 0.41 0.00 0.00 173.24 174.56