#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 6.76 0.12 1.61 1.04 -1.26 -4.89 113.70 117.08 2cqx s SER 2 Ca 0.00 2.55 -0.33 0.00 0.48 0.00 0.00 55.95 58.65 2cqx s SER 2 Cb 0.00 -2.62 -0.18 0.00 0.10 0.00 0.00 66.02 63.32 2cqx s SER 2 CO 0.00 -0.62 0.80 -1.20 0.98 0.00 0.00 173.24 173.20 2cqx n SER 3 N 2.44 -0.53 0.00 7.02 7.64 -1.26 -4.25 113.62 124.68 2cqx n SER 3 Ca 0.06 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.09 2cqx n SER 3 Cb 0.41 -0.96 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 2cqx n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cqx n GLY 4 N 1.78 3.38 3.34 0.23 0.00 -1.26 -4.90 105.19 107.77 2cqx n GLY 4 Ca 0.18 -0.11 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 7.82 -4.98 -4.37 1.61 2.88 -1.26 -4.93 113.62 110.38 2cqx n SER 5 Ca 0.00 -0.51 -0.32 0.00 -1.33 0.00 0.00 58.87 56.71 2cqx n SER 5 Cb 0.00 -4.62 -0.15 0.00 -0.75 0.00 0.00 64.21 58.70 2cqx n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2cqx s SER 6 N -3.53 3.68 0.00 -3.46 1.04 -1.26 -4.99 113.70 105.18 2cqx s SER 6 Ca 0.40 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2cqx s SER 6 Cb -0.18 -1.10 0.00 0.00 0.10 0.00 0.00 66.02 64.85 2cqx s SER 6 CO 0.66 0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.74 2cqx n GLY 7 N 2.93 6.61 3.14 7.32 0.00 -1.26 -5.17 105.19 118.77 2cqx n GLY 7 Ca -0.18 -2.05 -0.12 0.00 0.00 0.00 0.00 46.02 43.68 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 -0.26 -0.05 -1.13 -0.02 0.00 -1.26 -4.92 107.32 99.69 2cqx s GLY 8 Ca 0.00 0.13 -0.00 0.00 0.00 0.00 0.00 44.72 44.84 2cqx s GLY 8 CO 0.00 -0.02 0.94 1.39 0.00 0.00 0.00 173.10 175.42 2cqx n ILE 9 N 1.69 -5.94 -3.94 0.90 2.08 -1.26 -5.00 119.36 107.89 2cqx n ILE 9 Ca -0.21 -0.54 -0.35 0.00 0.56 0.00 0.00 62.75 62.22 2cqx n ILE 9 Cb 0.56 -4.99 -0.14 0.00 -0.75 0.00 0.00 39.64 34.32 2cqx n ILE 9 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2cqx s LYS 10 N -5.22 3.40 -0.06 0.38 -0.14 -1.26 -5.00 119.74 111.84 2cqx s LYS 10 Ca 0.03 -0.62 -0.24 0.00 -1.36 0.00 0.00 55.97 53.79 2cqx s LYS 10 Cb -0.00 -3.01 -0.27 0.00 -1.68 0.00 0.00 37.83 32.87 2cqx s LYS 10 CO 0.69 -0.18 0.93 0.22 -0.76 0.00 0.00 175.35 176.26 2cqx h ASP 11 N 8.05 0.30 -3.36 2.83 3.58 -2.05 -3.46 116.42 122.31 2cqx h ASP 11 Ca -0.41 -0.89 -0.66 0.00 0.42 0.00 0.00 57.03 55.49 2cqx h ASP 11 Cb 1.16 -0.09 -0.13 0.00 1.72 0.00 0.00 39.33 41.99 2cqx h ASP 11 CO 0.60 1.16 -0.65 -0.94 -2.88 0.00 0.00 179.24 176.53 2cqx s SER 12 N -6.58 5.08 -0.44 2.28 1.04 -1.26 -5.06 113.70 108.76 2cqx s SER 12 Ca -0.15 -0.08 -0.28 0.00 0.48 0.00 0.00 55.95 55.92 2cqx s SER 12 Cb 0.00 -1.28 -0.01 0.00 0.10 0.00 0.00 66.02 64.83 2cqx s SER 12 CO 0.77 0.23 1.75 -2.16 0.98 0.00 0.00 173.24 174.82 2cqx s PRO 13 N -1.88 3.14 -0.06 4.02 0.04 -1.26 -4.89 135.00 134.11 2cqx s PRO 13 Ca 0.22 1.07 -0.18 0.00 0.04 0.00 0.00 61.00 62.14 2cqx s PRO 13 Cb -0.12 -4.23 -0.14 0.00 0.04 0.00 0.00 34.50 30.05 2cqx s PRO 13 CO 0.14 -2.10 0.72 0.28 0.04 0.00 0.00 177.00 176.08 2cqx h VAL 14 N 6.77 0.72 -4.13 -0.36 2.07 -1.98 -3.45 116.25 115.89 2cqx h VAL 14 Ca -0.30 -1.16 -0.50 0.00 0.82 0.00 0.00 66.70 65.56 2cqx h VAL 14 Cb 1.16 1.25 0.09 0.00 -1.52 0.00 0.00 31.29 32.26 2cqx h VAL 14 CO 1.10 0.20 0.41 0.20 0.02 0.00 0.00 177.57 179.50 2cqx s ASN 15 N -5.48 5.46 0.09 0.57 0.01 -1.26 -5.06 114.94 109.28 2cqx s ASN 15 Ca -0.11 2.11 0.09 0.00 -0.71 0.00 0.00 52.86 54.24 2cqx s ASN 15 Cb 0.00 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 39.06 2cqx s ASN 15 CO 0.41 -1.39 -0.22 -1.59 -1.51 0.00 0.00 177.10 172.79 2cqx s LYS 16 N -3.61 1.26 -0.12 -0.60 0.00 -1.26 -5.06 119.74 110.35 2cqx s LYS 16 Ca 0.71 -1.16 -0.25 0.00 0.00 0.00 0.00 55.97 55.27 2cqx s LYS 16 Cb -0.23 -1.54 -0.22 0.00 0.00 0.00 0.00 37.83 35.85 2cqx s LYS 16 CO 0.33 0.37 0.74 -0.39 0.00 0.00 0.00 175.35 176.40 2cqx h VAL 17 N 4.10 1.49 -2.57 1.79 -1.51 -2.01 -3.44 116.25 114.11 2cqx h VAL 17 Ca -0.46 -1.99 0.07 0.00 -1.23 0.00 0.00 66.70 63.09 2cqx h VAL 17 Cb 1.17 2.75 -0.13 0.00 -2.13 0.00 0.00 31.29 32.95 2cqx h VAL 17 CO 0.40 0.48 0.38 -1.61 -1.23 0.00 0.00 177.57 176.00 2cqx s GLU 18 N -2.44 1.06 0.00 5.19 0.41 -1.26 -4.88 118.70 116.79 2cqx s GLU 18 Ca -0.16 -0.43 0.10 0.00 -0.41 0.00 0.00 54.97 54.07 2cqx s GLU 18 Cb -0.02 0.46 0.62 0.00 -1.78 0.00 0.00 34.13 33.41 2cqx s GLU 18 CO 0.60 -0.47 1.05 -0.35 -0.49 0.00 0.00 175.26 175.60 2cqx n PRO 19 N -0.32 0.49 -0.21 0.39 -0.04 -1.26 -3.27 135.00 130.78 2cqx n PRO 19 Ca -0.11 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.34 2cqx n PRO 19 Cb 0.63 -1.33 0.06 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 2.43 -0.33 3.54 5.03 -1.26 -4.42 115.26 119.43 2cqx n ASN 20 Ca 0.08 -2.24 0.25 0.00 0.87 0.00 0.00 54.58 53.54 2cqx n ASN 20 Cb 0.04 -0.55 0.49 0.00 -1.02 0.00 0.00 39.78 38.73 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 0.57 0.34 -1.08 6.41 3.58 -2.01 0.12 116.42 124.35 2cqx h ASP 21 Ca 0.05 0.22 0.37 0.00 0.42 0.00 0.00 57.03 58.09 2cqx h ASP 21 Cb 1.03 0.22 -0.10 0.00 1.72 0.00 0.00 39.33 42.20 2cqx h ASP 21 CO 0.15 -0.26 0.70 0.41 -2.88 0.00 0.00 179.24 177.36 2cqx n THR 22 N -5.17 -0.17 -0.06 2.25 -1.04 -1.26 0.23 114.28 109.06 2cqx n THR 22 Ca 0.32 1.33 -0.12 0.00 -2.04 0.00 0.00 64.05 63.55 2cqx n THR 22 Cb 1.05 -2.18 -0.05 0.00 -1.82 0.00 0.00 70.33 67.32 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 0.30 -1.06 -4.42 4.07 -1.13 -2.97 115.31 110.10 2cqx h LEU 23 Ca 0.67 -0.30 0.39 0.00 0.08 0.00 0.00 57.88 58.72 2cqx h LEU 23 Cb 2.20 -0.08 -0.13 0.00 1.08 0.00 0.00 40.66 43.72 2cqx h LEU 23 CO -0.32 0.53 0.65 1.21 -1.08 0.00 0.00 178.44 179.43 2cqx n GLU 24 N -4.73 -0.04 0.03 1.13 2.13 0.64 -0.31 120.64 119.49 2cqx n GLU 24 Ca -0.05 1.12 -0.02 0.00 0.66 0.00 0.00 57.16 58.87 2cqx n GLU 24 Cb 0.21 -2.12 -0.01 0.00 0.27 0.00 0.00 31.44 29.79 2cqx n GLU 24 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2cqx h LYS 25 N 0.00 -0.10 -1.19 5.31 3.64 -1.57 -3.31 116.57 119.35 2cqx h LYS 25 Ca 0.75 0.01 0.40 0.00 -1.27 0.00 0.00 60.65 60.53 2cqx h LYS 25 Cb 2.25 0.02 -0.14 0.00 -0.41 0.00 0.00 32.23 33.95 2cqx h LYS 25 CO -0.50 -0.06 0.74 -0.24 -2.27 0.00 0.00 179.45 177.12 2cqx h VAL 26 N -0.30 0.17 -0.62 2.00 3.04 -1.07 0.73 116.25 120.20 2cqx h VAL 26 Ca -0.01 -0.05 0.12 0.00 -1.01 0.00 0.00 66.70 65.75 2cqx h VAL 26 Cb 0.08 0.01 -0.09 0.00 -2.01 0.00 0.00 31.29 29.28 2cqx h VAL 26 CO 0.02 0.03 0.11 0.15 -1.01 0.00 0.00 177.57 176.86 2cqx h PHE 27 N 0.14 0.16 -0.36 3.17 3.04 -0.72 0.40 116.94 122.78 2cqx h PHE 27 Ca 0.79 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.78 2cqx h PHE 27 Cb 2.28 0.02 0.00 0.00 2.56 0.00 0.00 35.95 40.81 2cqx h PHE 27 CO -0.01 -0.07 0.00 1.55 -2.02 0.00 0.00 178.31 177.77 2cqx n VAL 28 N -5.16 0.71 -0.12 1.41 3.14 0.15 -0.59 118.33 117.86 2cqx n VAL 28 Ca 0.10 -0.85 -0.25 0.00 -2.96 0.00 0.00 64.34 60.38 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 0.93 1.77 -0.07 6.55 2.88 0.21 -4.86 113.62 121.03 2cqx n SER 29 Ca 0.14 0.24 -0.13 0.00 -1.33 0.00 0.00 58.87 57.80 2cqx n SER 29 Cb 0.47 -0.67 -0.05 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 -3.97 0.72 -3.63 2.46 0.24 0.12 -5.00 118.33 109.28 2cqx n VAL 30 Ca -0.47 -0.21 -0.05 0.00 -2.04 0.00 0.00 64.34 61.57 2cqx n VAL 30 Cb 0.85 -1.48 -0.06 0.00 -1.47 0.00 0.00 33.84 31.68 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 -2.24 0.00 0.11 3.34 -1.32 -0.25 -5.04 115.64 110.23 2cqx s THR 31 Ca -0.18 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.21 2cqx s THR 31 Cb 0.06 -1.00 -0.19 0.00 -1.51 0.00 0.00 72.50 69.87 2cqx s THR 31 CO 0.25 0.00 1.28 0.07 -2.21 0.00 0.00 174.62 174.01 2cqx h LYS 32 N 2.92 0.58 -3.26 7.08 2.10 -1.08 -3.28 116.57 121.63 2cqx h LYS 32 Ca -0.20 -0.58 -0.67 0.00 -2.00 0.00 0.00 60.65 57.20 2cqx h LYS 32 Cb 1.18 0.15 -0.38 0.00 -0.90 0.00 0.00 32.23 32.29 2cqx h LYS 32 CO 0.20 1.20 -0.34 0.71 -2.00 0.00 0.00 179.45 179.22 2cqx s TYR 33 N -3.40 3.68 0.91 0.07 1.51 -1.26 -4.88 117.35 113.98 2cqx s TYR 33 Ca -0.08 -3.13 -0.12 0.00 -1.01 0.00 0.00 57.07 52.74 2cqx s TYR 33 Cb 0.08 -3.01 0.14 0.00 -0.11 0.00 0.00 41.96 39.06 2cqx s TYR 33 CO 0.89 -0.67 1.09 -1.25 -1.11 0.00 0.00 175.55 174.50 2cqx s PRO 34 N -1.19 1.11 0.35 -1.71 0.04 -1.26 -5.08 135.00 127.26 2cqx s PRO 34 Ca 0.25 0.77 0.09 0.00 0.04 0.00 0.00 61.00 62.15 2cqx s PRO 34 Cb -0.09 -1.80 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 2cqx s PRO 34 CO -0.12 -2.33 -0.00 -0.51 0.04 0.00 0.00 177.00 174.07 2cqx s ASP 35 N -3.42 4.07 0.21 6.66 1.11 -1.26 -4.97 116.67 119.06 2cqx s ASP 35 Ca 0.64 -1.06 -0.16 0.00 0.18 0.00 0.00 52.55 52.15 2cqx s ASP 35 Cb -0.18 -0.48 0.21 0.00 1.07 0.00 0.00 42.92 43.54 2cqx s ASP 35 CO 0.57 -0.26 1.39 1.21 1.18 0.00 0.00 175.17 179.26 2cqx n GLU 36 N -0.93 -0.21 -0.28 8.23 2.13 -1.26 -0.04 120.64 128.28 2cqx n GLU 36 Ca -0.04 1.38 0.01 0.00 0.66 0.00 0.00 57.16 59.16 2cqx n GLU 36 Cb 0.63 -2.04 0.05 0.00 0.27 0.00 0.00 31.44 30.35 2cqx n GLU 36 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2cqx n LYS 37 N -5.31 -0.14 -0.01 5.31 5.02 -1.26 -0.06 118.16 121.70 2cqx n LYS 37 Ca 0.09 1.14 -0.13 0.00 -2.02 0.00 0.00 58.31 57.39 2cqx n LYS 37 Cb 0.36 -1.69 -0.10 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 -0.04 -1.04 1.97 2.43 -0.85 -3.21 114.38 113.65 2cqx h ARG 38 Ca 0.28 0.00 0.33 0.00 -0.81 0.00 0.00 59.98 59.79 2cqx h ARG 38 Cb 0.47 0.01 -0.14 0.00 -0.42 0.00 0.00 29.97 29.88 2cqx h ARG 38 CO -0.74 0.52 0.61 -0.07 -1.51 0.00 0.00 179.97 178.77 2cqx h LEU 39 N -0.62 0.48 -0.89 3.80 -0.00 0.41 0.18 115.31 118.67 2cqx h LEU 39 Ca -0.00 0.18 0.23 0.00 -0.00 0.00 0.00 57.88 58.28 2cqx h LEU 39 Cb 0.57 0.13 -0.16 0.00 -0.00 0.00 0.00 40.66 41.21 2cqx h LEU 39 CO 0.01 -0.13 0.06 0.11 -0.00 0.00 0.00 178.44 178.49 2cqx h LYS 40 N 0.30 0.08 0.16 1.13 1.79 -0.59 0.15 116.57 119.59 2cqx h LYS 40 Ca 0.74 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 59.19 2cqx h LYS 40 Cb 1.77 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.40 2cqx h LYS 40 CO -0.57 0.05 -0.08 0.78 -1.08 0.00 0.00 179.45 178.56 2cqx h GLY 41 N 0.08 -0.22 -0.81 3.86 0.00 -0.81 -3.21 103.07 101.95 2cqx h GLY 41 Ca 0.53 0.08 0.38 0.00 0.00 0.00 0.00 47.33 48.32 2cqx h GLY 41 CO -0.78 -0.08 0.59 1.41 0.00 0.00 0.00 176.54 177.68 2cqx h LEU 42 N -0.29 0.40 -0.96 3.11 3.38 -1.48 0.39 115.31 119.86 2cqx h LEU 42 Ca -0.02 0.22 0.31 0.00 0.09 0.00 0.00 57.88 58.47 2cqx h LEU 42 Cb 0.16 0.20 -0.16 0.00 0.09 0.00 0.00 40.66 40.95 2cqx h LEU 42 CO 0.04 -0.28 0.35 -1.28 0.09 0.00 0.00 178.44 177.35 2cqx h SER 43 N 0.15 0.11 0.05 -0.43 0.87 -0.72 0.61 113.55 114.19 2cqx h SER 43 Ca 0.80 0.23 -0.21 0.00 -1.23 0.00 0.00 61.79 61.38 2cqx h SER 43 Cb 2.05 0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 64.27 2cqx h SER 43 CO -0.66 -0.26 -1.08 0.50 -0.53 0.00 0.00 176.83 174.80 2cqx h LYS 44 N 0.14 0.11 -0.66 2.24 3.11 -0.34 0.61 116.57 121.78 2cqx h LYS 44 Ca 0.68 -0.19 0.10 0.00 -2.81 0.00 0.00 60.65 58.43 2cqx h LYS 44 Cb 1.56 0.07 -0.12 0.00 -1.00 0.00 0.00 32.23 32.74 2cqx h LYS 44 CO -0.73 1.09 -0.42 0.37 -2.81 0.00 0.00 179.45 176.96 2cqx h GLN 45 N -0.68 -0.16 -0.63 1.90 4.15 -0.68 0.11 115.11 119.11 2cqx h GLN 45 Ca -0.26 0.01 -0.17 0.00 0.77 0.00 0.00 58.65 59.01 2cqx h GLN 45 Cb 1.45 0.04 -0.10 0.00 0.21 0.00 0.00 27.48 29.08 2cqx h GLN 45 CO -0.05 -0.11 0.18 1.28 -1.93 0.00 0.00 178.83 178.21 2cqx n LEU 46 N -5.41 5.64 -4.08 -2.39 4.77 0.08 -4.93 117.00 110.67 2cqx n LEU 46 Ca 0.03 -3.22 -0.32 0.00 -0.03 0.00 0.00 56.01 52.48 2cqx n LEU 46 Cb 0.35 -0.71 -0.08 0.00 -2.33 0.00 0.00 43.42 40.66 2cqx n LEU 46 CO -0.03 0.81 -0.27 -0.67 -1.33 0.00 0.00 177.39 175.90 2cqx n ASP 47 N -0.21 -0.41 -3.98 -1.43 2.03 0.37 -4.89 116.55 108.03 2cqx n ASP 47 Ca 0.37 -1.08 -0.19 0.00 0.52 0.00 0.00 54.79 54.41 2cqx n ASP 47 Cb 1.28 -1.36 -0.00 0.00 -0.72 0.00 0.00 41.12 40.32 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 -3.80 -0.68 -4.49 -0.67 7.02 0.21 -4.96 117.44 110.08 2cqx n TRP 48 Ca -0.08 -1.65 -0.32 0.00 -1.02 0.00 0.00 57.50 54.42 2cqx n TRP 48 Cb 0.49 -0.31 -0.11 0.00 -2.42 0.00 0.00 31.31 28.96 2cqx n TRP 48 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2cqx s SER 49 N -3.24 4.56 0.50 -0.99 0.15 -1.26 -4.48 113.70 108.93 2cqx s SER 49 Ca 0.20 -0.16 0.31 0.00 0.70 0.00 0.00 55.95 57.00 2cqx s SER 49 Cb -0.02 -1.05 1.42 0.00 -1.71 0.00 0.00 66.02 64.67 2cqx s SER 49 CO 0.12 0.29 1.79 1.62 1.20 0.00 0.00 173.24 178.26 2cqx h VAL 50 N 3.80 0.42 0.10 4.45 3.04 -1.94 0.14 116.25 126.27 2cqx h VAL 50 Ca -0.48 -0.04 -0.14 0.00 -1.01 0.00 0.00 66.70 65.03 2cqx h VAL 50 Cb 1.17 0.30 0.01 0.00 -2.01 0.00 0.00 31.29 30.76 2cqx h VAL 50 CO 0.53 0.02 -0.63 0.08 -1.01 0.00 0.00 177.57 176.56 2cqx h ARG 51 N 0.11 0.21 0.16 4.17 0.11 -1.99 -3.14 114.38 114.02 2cqx h ARG 51 Ca 0.59 -0.37 0.00 0.00 0.10 0.00 0.00 59.98 60.30 2cqx h ARG 51 Cb 2.07 0.14 -0.01 0.00 1.11 0.00 0.00 29.97 33.28 2cqx h ARG 51 CO -0.11 1.18 -0.14 -0.22 0.10 0.00 0.00 179.97 180.77 2cqx h LYS 52 N -0.54 -0.31 0.06 0.08 3.64 -1.31 -3.02 116.57 115.17 2cqx h LYS 52 Ca -0.11 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2cqx h LYS 52 Cb 1.47 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 33.31 2cqx h LYS 52 CO 0.10 -0.21 -0.40 0.82 -2.27 0.00 0.00 179.45 177.49 2cqx h ILE 53 N -0.32 0.18 -0.90 2.00 2.04 -0.98 -2.24 117.51 117.28 2cqx h ILE 53 Ca -0.00 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.03 2cqx h ILE 53 Cb 0.30 0.18 -0.16 0.00 -0.74 0.00 0.00 36.82 36.40 2cqx h ILE 53 CO -0.03 0.00 -0.26 0.00 0.00 0.00 0.00 178.15 177.87 2cqx n GLN 54 N -5.45 -0.11 -0.26 2.37 1.13 -1.17 0.13 117.38 114.03 2cqx n GLN 54 Ca -0.06 1.40 0.06 0.00 -1.94 0.00 0.00 57.00 56.45 2cqx n GLN 54 Cb 0.37 -2.09 0.20 0.00 0.11 0.00 0.00 30.24 28.83 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 0.38 -0.45 0.05 0.00 7.01 0.12 -2.23 115.95 120.83 2cqx h TRP 56 Ca 0.43 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.47 2cqx h TRP 56 Cb 0.69 0.21 -0.05 0.00 -2.10 0.00 0.00 29.16 27.91 2cqx h TRP 56 CO -0.19 -0.25 -0.41 0.74 -2.79 0.00 0.00 178.44 175.54 2cqx h PHE 57 N -0.26 -1.16 -0.61 2.65 0.04 -0.97 -2.18 116.94 114.45 2cqx h PHE 57 Ca 0.07 0.03 0.10 0.00 2.80 0.00 0.00 57.97 60.97 2cqx h PHE 57 Cb 0.36 0.50 -0.11 0.00 2.20 0.00 0.00 35.95 38.90 2cqx h PHE 57 CO -0.25 -0.50 -0.40 0.00 -0.60 0.00 0.00 178.31 176.56 2cqx h ARG 58 N -0.60 -0.18 -0.83 1.51 3.08 -1.19 0.18 114.38 116.35 2cqx h ARG 58 Ca 0.04 0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.28 2cqx h ARG 58 Cb 0.65 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 30.63 2cqx h ARG 58 CO -0.28 -0.12 0.32 1.25 -1.07 0.00 0.00 179.97 180.06 2cqx h HIS 59 N -0.19 0.53 -0.15 3.04 2.76 -0.98 -1.45 115.15 118.71 2cqx h HIS 59 Ca 0.21 0.04 0.05 0.00 -2.20 0.00 0.00 60.37 58.46 2cqx h HIS 59 Cb 0.56 -0.11 -0.07 0.00 1.55 0.00 0.00 27.41 29.35 2cqx h HIS 59 CO -0.70 -0.02 -0.33 -0.09 -1.30 0.00 0.00 177.93 175.49 2cqx h ARG 60 N 0.39 -0.38 -0.99 5.26 9.65 -0.04 0.90 114.38 129.17 2cqx h ARG 60 Ca 0.49 0.03 0.33 0.00 -1.10 0.00 0.00 59.98 59.72 2cqx h ARG 60 Cb 0.85 0.09 -0.18 0.00 -1.39 0.00 0.00 29.97 29.34 2cqx h ARG 60 CO -0.49 -0.26 0.27 0.00 2.80 0.00 0.00 179.97 182.29 2cqx h ARG 61 N -0.40 0.03 0.05 0.20 2.47 -0.94 0.27 114.38 116.05 2cqx h ARG 61 Ca 0.10 -0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.81 2cqx h ARG 61 Cb 0.55 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 2cqx h ARG 61 CO -0.37 0.02 -0.02 -0.91 0.56 0.00 0.00 179.97 179.25 2cqx h ASN 62 N 0.03 -0.05 -1.05 7.04 2.35 -1.20 -3.28 115.58 119.41 2cqx h ASN 62 Ca 0.70 -0.62 0.28 0.00 -0.55 0.00 0.00 56.30 56.12 2cqx h ASN 62 Cb 1.66 0.01 -0.11 0.00 0.05 0.00 0.00 38.32 39.94 2cqx h ASN 62 CO -0.84 0.67 0.66 -0.61 -1.65 0.00 0.00 177.43 175.67 2cqx h GLN 63 N -0.86 0.39 -0.73 0.81 5.75 0.14 0.25 115.11 120.86 2cqx h GLN 63 Ca -0.01 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.52 2cqx h GLN 63 Cb 0.67 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 29.08 2cqx h GLN 63 CO 0.01 0.26 0.44 0.22 -2.65 0.00 0.00 178.83 177.11 2cqx h ASP 64 N 0.41 0.69 -3.47 -0.69 1.82 -0.64 -3.40 116.42 111.14 2cqx h ASP 64 Ca 0.63 0.02 -0.60 0.00 -0.39 0.00 0.00 57.03 56.68 2cqx h ASP 64 Cb 1.54 -0.13 -0.12 0.00 0.68 0.00 0.00 39.33 41.31 2cqx h ASP 64 CO -0.36 0.45 -0.25 -0.75 -1.61 0.00 0.00 179.24 176.73 2cqx s LYS 65 N -6.09 4.18 0.18 0.28 2.36 0.87 -5.06 119.74 116.45 2cqx s LYS 65 Ca -0.13 0.14 -0.30 0.00 -2.55 0.00 0.00 55.97 53.13 2cqx s LYS 65 Cb 0.16 -3.52 -0.08 0.00 -1.05 0.00 0.00 37.83 33.34 2cqx s LYS 65 CO 0.77 0.01 1.31 -1.25 1.55 0.00 0.00 175.35 177.74 2cqx s PRO 66 N 1.17 4.38 -1.13 4.03 0.04 -1.26 -4.88 135.00 137.35 2cqx s PRO 66 Ca 0.18 2.04 -0.21 0.00 0.04 0.00 0.00 61.00 63.04 2cqx s PRO 66 Cb -0.14 -3.21 0.01 0.00 0.04 0.00 0.00 34.50 31.20 2cqx s PRO 66 CO 0.07 -0.27 1.73 -1.54 0.04 0.00 0.00 177.00 177.03 2cqx s SER 67 N 0.46 6.10 -0.08 6.66 1.04 -1.26 -4.89 113.70 121.73 2cqx s SER 67 Ca 0.58 -1.72 -0.19 0.00 0.48 0.00 0.00 55.95 55.09 2cqx s SER 67 Cb -0.36 -2.58 0.04 0.00 0.10 0.00 0.00 66.02 63.23 2cqx s SER 67 CO 0.37 -1.91 0.46 -0.83 0.98 0.00 0.00 173.24 172.31 2cqx s GLY 68 N 5.51 -0.33 -0.59 7.32 0.00 -1.26 -5.11 107.32 112.86 2cqx s GLY 68 Ca 0.57 0.93 -0.27 0.00 0.00 0.00 0.00 44.72 45.96 2cqx s GLY 68 CO 0.03 0.70 1.85 2.56 0.00 0.00 0.00 173.10 178.24 2cqx s PRO 69 N -0.70 2.68 0.30 2.90 0.04 -1.26 -4.92 135.00 134.05 2cqx s PRO 69 Ca -0.08 0.66 -0.12 0.00 0.04 0.00 0.00 61.00 61.51 2cqx s PRO 69 Cb -0.03 -4.37 0.01 0.00 0.04 0.00 0.00 34.50 30.15 2cqx s PRO 69 CO 0.04 -2.66 0.56 -1.12 0.04 0.00 0.00 177.00 173.86 2cqx s SER 70 N 7.91 0.16 -0.41 6.66 0.01 -1.26 -5.13 113.70 121.63 2cqx s SER 70 Ca 0.68 -1.07 -0.15 0.00 1.31 0.00 0.00 55.95 56.72 2cqx s SER 70 Cb -0.13 0.67 0.02 0.00 0.21 0.00 0.00 66.02 66.79 2cqx s SER 70 CO 0.22 -1.30 0.29 -0.55 0.41 0.00 0.00 173.24 172.31 2cqx s SER 71 N -3.07 6.08 0.00 2.44 0.15 -1.26 -5.26 113.70 112.79 2cqx s SER 71 Ca 0.22 -0.91 0.31 0.00 0.70 0.00 0.00 55.95 56.27 2cqx s SER 71 Cb -0.02 -2.15 1.88 0.00 -1.71 0.00 0.00 66.02 64.02 2cqx s SER 71 CO 0.12 -0.45 2.20 0.61 1.20 0.00 0.00 173.24 176.92