#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmq n SER 17 N 0.00 -3.45 -2.91 3.54 2.88 -1.26 -5.06 113.62 107.36 1xmq n SER 17 Ca 0.00 -0.11 -0.14 0.00 -1.33 0.00 0.00 58.87 57.29 1xmq n SER 17 Cb 0.00 -2.00 0.01 0.00 -0.75 0.00 0.00 64.21 61.47 1xmq n SER 17 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1xmq n ARG 18 N -1.61 0.80 -0.00 -1.46 5.12 -1.26 -5.00 116.66 113.24 1xmq n ARG 18 Ca -0.01 -2.32 -0.02 0.00 -1.93 0.00 0.00 57.85 53.57 1xmq n ARG 18 Cb 0.52 -1.36 -0.01 0.00 -1.16 0.00 0.00 32.46 30.45 1xmq n ARG 18 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1xmq n LYS 19 N 1.35 0.11 0.00 5.56 4.01 -1.26 -5.08 118.16 122.85 1xmq n LYS 19 Ca 0.13 0.04 0.00 0.00 -0.51 0.00 0.00 58.31 57.98 1xmq n LYS 19 Cb 0.61 -0.55 0.00 0.00 -0.51 0.00 0.00 35.03 34.58 1xmq n LYS 19 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1xmq n ALA 20 N -3.25 0.00 -1.04 7.82 0.00 -1.26 -5.13 120.51 117.66 1xmq n ALA 20 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 1xmq n ALA 20 Cb 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.50 1xmq n ALA 20 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xmq n LYS 21 N 0.00 0.00 0.13 0.00 4.01 -1.26 -4.60 118.16 116.45 1xmq n LYS 21 Ca 0.00 0.00 0.04 0.00 -0.51 0.00 0.00 58.31 57.84 1xmq n LYS 21 Cb 0.00 -0.93 0.23 0.00 -0.51 0.00 0.00 35.03 33.82 1xmq n LYS 21 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1xmq n VAL 22 N 2.02 0.56 0.09 -0.18 0.31 -0.43 0.20 118.33 120.90 1xmq n VAL 22 Ca 0.17 0.70 -0.20 0.00 -0.01 0.00 0.00 64.34 65.00 1xmq n VAL 22 Cb -0.01 -1.70 -0.15 0.00 -0.91 0.00 0.00 33.84 31.07 1xmq n VAL 22 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1xmq h LYS 23 N 0.00 0.34 0.06 5.55 3.64 -1.76 -3.36 116.57 121.04 1xmq h LYS 23 Ca 0.00 -0.59 -0.00 0.00 -1.27 0.00 0.00 60.65 58.79 1xmq h LYS 23 Cb 0.75 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1xmq h LYS 23 CO 0.00 1.24 -0.03 0.00 -2.27 0.00 0.00 179.45 178.39 1xmq h ALA 24 N 0.36 -0.08 0.00 5.00 0.00 -0.55 -3.25 119.26 120.74 1xmq h ALA 24 Ca -0.25 -0.18 -0.58 0.00 0.00 0.00 0.00 54.91 53.90 1xmq h ALA 24 Cb 2.06 0.03 0.02 0.00 0.00 0.00 0.00 17.79 19.90 1xmq h ALA 24 CO 0.20 -0.37 3.13 2.41 0.00 0.00 0.00 179.25 184.61 1xmq n THR 25 N -4.96 3.23 0.00 0.00 -1.04 -1.10 -4.67 114.28 105.74 1xmq n THR 25 Ca -0.08 -2.16 0.00 0.00 -2.04 0.00 0.00 64.05 59.77 1xmq n THR 25 Cb 0.20 -2.42 0.00 0.00 -1.82 0.00 0.00 70.33 66.29 1xmq n THR 25 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1xmq n LEU 26 N 4.74 0.00 0.00 -4.42 7.94 -1.23 -4.93 117.00 119.10 1xmq n LEU 26 Ca 0.59 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.49 1xmq n LEU 26 Cb 0.25 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.20 1xmq n LEU 26 CO 0.84 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.73 1xmq n GLY 27 N -0.40 2.49 3.76 -3.96 0.00 -1.26 -4.96 105.19 100.85 1xmq n GLY 27 Ca 0.00 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 1xmq n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xmq s GLU 28 N 4.58 4.47 0.00 1.61 8.01 -1.26 -5.05 118.70 131.07 1xmq s GLU 28 Ca 0.00 1.03 -0.28 0.00 0.01 0.00 0.00 54.97 55.73 1xmq s GLU 28 Cb 0.00 -3.33 0.07 0.00 -4.31 0.00 0.00 34.13 26.56 1xmq s GLU 28 CO 0.00 0.39 0.63 -0.59 0.01 0.00 0.00 175.26 175.70 1xmq s PHE 29 N -0.42 -0.59 -0.72 1.61 -0.12 -1.26 -5.11 117.98 111.36 1xmq s PHE 29 Ca 0.36 0.87 -0.22 0.00 -0.05 0.00 0.00 56.93 57.89 1xmq s PHE 29 Cb -0.21 0.41 0.08 0.00 -0.63 0.00 0.00 43.02 42.68 1xmq s PHE 29 CO 0.23 -0.65 1.00 0.34 -0.05 0.00 0.00 175.22 176.09 1xmq s ASP 30 N -1.58 6.28 0.38 1.98 2.15 -1.26 -4.90 116.67 119.72 1xmq s ASP 30 Ca -0.08 -1.25 0.18 0.00 0.43 0.00 0.00 52.55 51.83 1xmq s ASP 30 Cb -0.00 -2.41 1.10 0.00 -0.30 0.00 0.00 42.92 41.30 1xmq s ASP 30 CO 0.04 -1.35 1.72 -0.07 -0.17 0.00 0.00 175.17 175.34 1xmq h LEU 31 N 11.15 0.48 0.00 -1.34 3.38 -1.99 0.17 115.31 127.15 1xmq h LEU 31 Ca -0.18 0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1xmq h LEU 31 Cb 1.06 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1xmq h LEU 31 CO 1.17 0.01 0.00 -1.14 0.09 0.00 0.00 178.44 178.57 1xmq n ARG 32 N -4.77 0.20 -2.67 1.13 0.63 -1.26 -4.64 116.66 105.28 1xmq n ARG 32 Ca 0.29 0.13 -0.42 0.00 -0.92 0.00 0.00 57.85 56.93 1xmq n ARG 32 Cb 0.95 -1.50 -0.03 0.00 0.45 0.00 0.00 32.46 32.33 1xmq n ARG 32 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1xmq s ASP 33 N -2.67 6.21 0.00 6.15 2.15 0.58 -4.89 116.67 124.19 1xmq s ASP 33 Ca 0.15 -0.56 0.16 0.00 0.43 0.00 0.00 52.55 52.74 1xmq s ASP 33 Cb 0.12 -2.51 0.96 0.00 -0.30 0.00 0.00 42.92 41.20 1xmq s ASP 33 CO 0.29 -1.63 1.62 0.00 -0.17 0.00 0.00 175.17 175.28 1xmq n TYR 34 N 8.62 0.00 0.38 -5.34 0.18 -1.26 -3.48 117.16 116.26 1xmq n TYR 34 Ca 0.01 -0.00 0.05 0.00 1.88 0.00 0.00 57.90 59.85 1xmq n TYR 34 Cb 0.48 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.37 1xmq n TYR 34 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1xmq n ARG 35 N -0.74 2.43 -1.02 -3.48 1.74 -1.26 -4.26 116.66 110.07 1xmq n ARG 35 Ca 0.12 -0.03 -0.31 0.00 -0.77 0.00 0.00 57.85 56.86 1xmq n ARG 35 Cb 0.06 -1.10 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 1xmq n ARG 35 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1xmq n ASN 36 N -1.45 5.03 -0.10 0.55 4.05 -1.23 -4.72 115.26 117.39 1xmq n ASN 36 Ca 0.01 -2.49 -0.10 0.00 0.45 0.00 0.00 54.58 52.46 1xmq n ASN 36 Cb 0.21 -1.23 -0.04 0.00 1.23 0.00 0.00 39.78 39.95 1xmq n ASN 36 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 177.26 174.79 1xmq h VAL 37 N 3.62 0.15 -1.77 3.44 2.07 -1.89 -1.35 116.25 120.52 1xmq h VAL 37 Ca 0.56 0.00 0.51 0.00 0.82 0.00 0.00 66.70 68.59 1xmq h VAL 37 Cb 0.33 0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 30.18 1xmq h VAL 37 CO 1.65 0.00 1.28 1.05 0.02 0.00 0.00 177.57 181.58 1xmq h GLU 38 N -0.33 0.00 0.00 1.57 9.09 -1.97 0.76 114.58 123.70 1xmq h GLU 38 Ca 0.14 0.00 -0.38 0.00 0.05 0.00 0.00 59.36 59.17 1xmq h GLU 38 Cb 0.58 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 27.61 1xmq h GLU 38 CO -0.53 0.00 -2.43 1.55 0.05 0.00 0.00 179.01 177.65 1xmq n VAL 39 N -3.99 1.43 -0.29 -1.06 3.14 -0.65 -4.43 118.33 112.48 1xmq n VAL 39 Ca 0.40 -0.68 -0.06 0.00 -2.96 0.00 0.00 64.34 61.04 1xmq n VAL 39 Cb 1.82 -1.02 0.06 0.00 -1.06 0.00 0.00 33.84 33.65 1xmq n VAL 39 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1xmq h LEU 40 N 0.00 1.08 -1.22 6.55 3.38 0.03 -2.21 115.31 122.93 1xmq h LEU 40 Ca -0.56 -0.17 0.27 0.00 0.09 0.00 0.00 57.88 57.51 1xmq h LEU 40 Cb 2.03 -0.28 -0.11 0.00 0.09 0.00 0.00 40.66 42.39 1xmq h LEU 40 CO -0.04 0.95 0.65 0.11 0.09 0.00 0.00 178.44 180.20 1xmq h LYS 41 N 1.15 0.43 -0.40 1.13 1.57 -1.16 0.47 116.57 119.76 1xmq h LYS 41 Ca 0.27 -0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.13 1xmq h LYS 41 Cb 0.20 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1xmq h LYS 41 CO -0.02 0.28 0.40 0.00 -0.57 0.00 0.00 179.45 179.54 1xmq h ARG 42 N 0.44 0.00 -0.40 3.15 2.47 -1.62 -1.00 114.38 117.42 1xmq h ARG 42 Ca 0.63 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.35 1xmq h ARG 42 Cb 1.47 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.79 1xmq h ARG 42 CO -0.38 0.00 0.00 1.19 0.56 0.00 0.00 179.97 181.34 1xmq n PHE 43 N -3.82 0.54 -4.25 3.04 3.01 0.16 -4.91 117.46 111.23 1xmq n PHE 43 Ca 0.07 -0.27 -0.27 0.00 1.01 0.00 0.00 57.45 57.99 1xmq n PHE 43 Cb 0.57 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.96 1xmq n PHE 43 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1xmq s LEU 44 N -1.08 3.11 0.00 4.37 1.43 -0.38 -1.24 118.68 124.89 1xmq s LEU 44 Ca 0.30 -0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 52.85 1xmq s LEU 44 Cb 0.16 -1.79 0.08 0.00 0.03 0.00 0.00 46.19 44.67 1xmq s LEU 44 CO 0.21 0.11 0.48 -1.54 0.23 0.00 0.00 176.35 175.84 1xmq n SER 45 N 0.06 -0.06 -0.13 2.29 3.41 -0.56 -4.89 113.62 113.74 1xmq n SER 45 Ca -0.11 -1.15 0.12 0.00 -0.26 0.00 0.00 58.87 57.48 1xmq n SER 45 Cb 0.55 -0.37 0.48 0.00 -0.26 0.00 0.00 64.21 64.60 1xmq n SER 45 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1xmq h GLU 46 N 0.00 0.45 -6.19 4.33 3.07 -1.99 -3.39 114.58 110.86 1xmq h GLU 46 Ca -0.16 -0.03 -0.46 0.00 -0.50 0.00 0.00 59.36 58.21 1xmq h GLU 46 Cb 0.44 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 1xmq h GLU 46 CO 0.11 0.30 -0.44 0.99 -1.40 0.00 0.00 179.01 178.58 1xmq s THR 47 N -5.44 5.22 -0.28 1.13 2.01 -1.26 -4.74 115.64 112.28 1xmq s THR 47 Ca -0.08 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 60.91 1xmq s THR 47 Cb 0.20 -3.84 0.00 0.00 0.01 0.00 0.00 72.50 68.88 1xmq s THR 47 CO 0.76 -0.33 0.20 0.61 -0.69 0.00 0.00 174.62 175.17 1xmq n GLY 48 N -1.39 0.43 3.81 4.40 0.00 -1.26 -4.74 105.19 106.45 1xmq n GLY 48 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 1xmq n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xmq s LYS 49 N 0.28 4.24 -0.06 1.61 1.02 -1.26 -4.40 119.74 121.17 1xmq s LYS 49 Ca 0.00 0.81 -0.30 0.00 0.02 0.00 0.00 55.97 56.50 1xmq s LYS 49 Cb 0.00 -3.10 -0.05 0.00 -0.52 0.00 0.00 37.83 34.17 1xmq s LYS 49 CO 0.00 0.54 1.48 0.42 -0.92 0.00 0.00 175.35 176.87 1xmq s ILE 50 N -1.28 3.78 0.52 2.17 1.01 -1.26 -1.50 121.20 124.63 1xmq s ILE 50 Ca 0.35 1.02 -0.23 0.00 0.00 0.00 0.00 60.65 61.79 1xmq s ILE 50 Cb -0.19 -3.66 -0.06 0.00 0.01 0.00 0.00 42.46 38.57 1xmq s ILE 50 CO 0.21 -0.06 1.38 -0.76 0.00 0.00 0.00 174.94 175.71 1xmq s LEU 51 N 3.40 3.93 0.95 2.97 1.43 -0.37 -4.93 118.68 126.06 1xmq s LEU 51 Ca 0.66 2.82 -0.11 0.00 -1.03 0.00 0.00 54.13 56.47 1xmq s LEU 51 Cb -0.30 -4.17 0.16 0.00 0.03 0.00 0.00 46.19 41.91 1xmq s LEU 51 CO 0.25 -1.46 1.09 -2.84 0.23 0.00 0.00 176.35 173.62 1xmq s PRO 52 N -2.77 0.82 0.28 1.29 0.02 -1.26 -4.73 135.00 128.65 1xmq s PRO 52 Ca 0.68 0.95 0.07 0.00 0.02 0.00 0.00 61.00 62.72 1xmq s PRO 52 Cb -0.42 -1.75 0.41 0.00 0.02 0.00 0.00 34.50 32.77 1xmq s PRO 52 CO 0.51 -2.58 1.67 0.00 -0.33 0.00 0.00 177.00 176.26 1xmq h ARG 53 N -1.80 0.21 -0.03 5.54 3.08 -1.94 -1.22 114.38 118.22 1xmq h ARG 53 Ca -0.51 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.43 1xmq h ARG 53 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 1xmq h ARG 53 CO 0.52 0.64 0.00 2.89 -1.07 0.00 0.00 179.97 182.94 1xmq n ARG 54 N -3.98 0.29 0.00 0.04 -4.01 -1.26 -1.42 116.66 106.33 1xmq n ARG 54 Ca -0.02 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.79 1xmq n ARG 54 Cb 0.52 -1.01 0.00 0.00 -3.04 0.00 0.00 32.46 28.92 1xmq n ARG 54 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 1xmq n ARG 55 N -0.41 0.01 0.05 2.89 5.12 -0.91 -4.79 116.66 118.61 1xmq n ARG 55 Ca 0.00 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 56.05 1xmq n ARG 55 Cb 0.01 -0.59 0.50 0.00 -1.16 0.00 0.00 32.46 31.21 1xmq n ARG 55 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1xmq n THR 56 N -1.68 0.41 -0.96 0.55 -2.24 -0.51 -1.32 114.28 108.54 1xmq n THR 56 Ca 0.00 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1xmq n THR 56 Cb 0.09 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 1xmq n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xmq n GLY 57 N 1.08 0.03 0.92 3.38 0.00 -0.50 -2.60 105.19 107.50 1xmq n GLY 57 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.01 1xmq n GLY 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xmq n LEU 58 N 0.00 0.00 -4.54 0.99 4.77 -1.26 -4.85 117.00 112.12 1xmq n LEU 58 Ca 0.00 -0.34 -0.26 0.00 -0.03 0.00 0.00 56.01 55.38 1xmq n LEU 58 Cb 0.43 -0.24 -0.11 0.00 -2.33 0.00 0.00 43.42 41.17 1xmq n LEU 58 CO 0.00 -0.79 -0.38 -0.94 -1.33 0.00 0.00 177.39 173.96 1xmq s SER 59 N -2.17 3.62 0.05 -1.43 1.04 -1.26 -4.89 113.70 108.65 1xmq s SER 59 Ca 0.18 -1.21 -0.10 0.00 0.48 0.00 0.00 55.95 55.30 1xmq s SER 59 Cb -0.01 -0.33 -0.03 0.00 0.10 0.00 0.00 66.02 65.76 1xmq s SER 59 CO 0.13 -0.24 1.18 1.23 0.98 0.00 0.00 173.24 176.52 1xmq h GLY 60 N 2.03 -2.02 0.39 7.32 0.00 -1.99 0.51 103.07 109.32 1xmq h GLY 60 Ca -0.42 1.00 0.11 0.00 0.00 0.00 0.00 47.33 48.02 1xmq h GLY 60 CO 0.71 -0.66 0.40 1.70 0.00 0.00 0.00 176.54 178.69 1xmq h LYS 61 N -0.03 0.62 0.49 4.80 3.64 -1.99 -1.30 116.57 122.80 1xmq h LYS 61 Ca 0.05 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1xmq h LYS 61 Cb 0.15 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1xmq h LYS 61 CO -0.28 0.41 -0.23 0.93 -2.27 0.00 0.00 179.45 178.01 1xmq h GLU 62 N 0.64 -0.63 -0.95 1.90 5.08 -1.62 -3.01 114.58 115.99 1xmq h GLU 62 Ca 0.40 0.04 0.27 0.00 -1.00 0.00 0.00 59.36 59.07 1xmq h GLU 62 Cb 0.46 0.14 -0.17 0.00 0.50 0.00 0.00 28.75 29.68 1xmq h GLU 62 CO -0.30 -0.42 0.13 0.37 -1.00 0.00 0.00 179.01 177.79 1xmq h GLN 63 N -0.82 0.05 -0.70 2.33 5.75 0.12 0.54 115.11 122.39 1xmq h GLN 63 Ca -0.07 -0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.46 1xmq h GLN 63 Cb 0.50 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.00 1xmq h GLN 63 CO 0.11 0.04 0.46 -0.09 -2.65 0.00 0.00 178.83 176.70 1xmq h ARG 64 N 0.05 0.83 0.10 1.69 2.43 -1.25 -1.05 114.38 117.19 1xmq h ARG 64 Ca 0.61 -0.05 -0.26 0.00 -0.81 0.00 0.00 59.98 59.47 1xmq h ARG 64 Cb 1.29 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1xmq h ARG 64 CO -0.83 0.55 -1.16 0.82 -1.51 0.00 0.00 179.97 177.83 1xmq h ILE 65 N 0.86 1.48 0.39 1.20 2.04 0.13 -3.10 117.51 120.51 1xmq h ILE 65 Ca 0.28 -2.91 -0.01 0.00 1.00 0.00 0.00 64.86 63.21 1xmq h ILE 65 Cb 0.04 2.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 1xmq h ILE 65 CO -0.08 0.85 -0.33 0.25 0.00 0.00 0.00 178.15 178.84 1xmq h LEU 66 N 0.11 -0.90 -0.93 1.44 5.85 -0.19 -1.05 115.31 119.64 1xmq h LEU 66 Ca -0.12 0.07 0.26 0.00 0.84 0.00 0.00 57.88 58.93 1xmq h LEU 66 Cb 1.87 0.29 -0.16 0.00 0.37 0.00 0.00 40.66 43.02 1xmq h LEU 66 CO 0.19 -0.46 0.12 0.00 -0.34 0.00 0.00 178.44 177.95 1xmq h ALA 67 N -1.26 1.22 -0.83 1.25 0.00 -1.33 0.79 119.26 119.10 1xmq h ALA 67 Ca -0.05 0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1xmq h ALA 67 Cb 0.60 0.48 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 1xmq h ALA 67 CO -0.01 -0.55 0.41 -0.22 0.00 0.00 0.00 179.25 178.88 1xmq h LYS 68 N 0.08 1.18 0.20 0.00 1.63 -1.37 -2.15 116.57 116.13 1xmq h LYS 68 Ca 0.58 -0.16 -0.01 0.00 -0.85 0.00 0.00 60.65 60.21 1xmq h LYS 68 Cb 1.21 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 32.62 1xmq h LYS 68 CO -0.81 0.89 -0.10 1.15 -3.45 0.00 0.00 179.45 177.14 1xmq h THR 69 N 1.17 0.80 -0.71 1.00 2.02 0.18 -2.87 112.91 114.50 1xmq h THR 69 Ca 0.29 -0.99 0.13 0.00 0.77 0.00 0.00 66.41 66.61 1xmq h THR 69 Cb 0.09 1.29 -0.13 0.00 -1.74 0.00 0.00 68.15 67.66 1xmq h THR 69 CO -0.04 0.19 -0.28 0.40 0.37 0.00 0.00 175.52 176.16 1xmq h ILE 70 N -0.83 0.18 -0.93 3.11 2.04 -0.90 0.53 117.51 120.71 1xmq h ILE 70 Ca -0.03 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.97 1xmq h ILE 70 Cb 0.52 0.18 -0.08 0.00 -0.74 0.00 0.00 36.82 36.70 1xmq h ILE 70 CO 0.05 0.00 0.60 0.11 0.00 0.00 0.00 178.15 178.90 1xmq h LYS 71 N -0.08 0.77 -0.52 2.37 1.57 -1.43 0.07 116.57 119.32 1xmq h LYS 71 Ca 0.30 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.92 1xmq h LYS 71 Cb 0.56 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1xmq h LYS 71 CO -0.76 0.51 -0.13 0.00 -0.57 0.00 0.00 179.45 178.50 1xmq h ARG 72 N 0.79 1.00 0.00 3.15 3.08 0.21 -2.59 114.38 120.03 1xmq h ARG 72 Ca 0.47 -0.39 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 1xmq h ARG 72 Cb 0.65 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 1xmq h ARG 72 CO -0.23 1.07 -0.31 0.00 -1.07 0.00 0.00 179.97 179.42 1xmq h ALA 73 N 0.90 1.47 -0.06 0.04 0.00 0.65 -2.75 119.26 119.51 1xmq h ALA 73 Ca 0.13 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1xmq h ALA 73 Cb 0.70 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1xmq h ALA 73 CO 0.05 0.39 -0.03 0.00 0.00 0.00 0.00 179.25 179.67 1xmq h ARG 74 N 0.00 0.13 -1.01 0.00 3.08 -0.68 -1.07 114.38 114.82 1xmq h ARG 74 Ca -0.00 -0.05 0.10 0.00 0.07 0.00 0.00 59.98 60.09 1xmq h ARG 74 Cb 0.56 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.52 1xmq h ARG 74 CO 0.04 0.49 0.64 0.82 -1.07 0.00 0.00 179.97 180.90 1xmq h ILE 75 N -0.24 1.00 -0.62 2.04 2.04 -1.33 -0.54 117.51 119.86 1xmq h ILE 75 Ca 0.01 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.45 1xmq h ILE 75 Cb 0.45 -0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.32 1xmq h ILE 75 CO 0.01 0.20 0.19 -0.07 0.00 0.00 0.00 178.15 178.48 1xmq h LEU 76 N 1.08 0.87 0.00 1.44 3.38 -1.41 -3.47 115.31 117.21 1xmq h LEU 76 Ca 0.47 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1xmq h LEU 76 Cb 0.34 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1xmq h LEU 76 CO -0.22 0.82 0.00 0.61 0.09 0.00 0.00 178.44 179.74 1xmq n GLY 77 N -0.87 1.16 0.13 0.83 0.00 -0.21 -5.01 105.19 101.22 1xmq n GLY 77 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.09 1xmq n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xmq h LEU 78 N 0.00 0.00 -8.76 0.99 3.38 -1.42 -3.47 115.31 106.03 1xmq h LEU 78 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 1xmq h LEU 78 Cb 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.59 1xmq h LEU 78 CO 0.00 0.51 -0.75 -0.76 0.09 0.00 0.00 178.44 177.53 1xmq s LEU 79 N -6.35 2.49 0.55 1.67 1.43 -1.13 -4.97 118.68 112.36 1xmq s LEU 79 Ca 0.03 -0.93 -0.06 0.00 -1.03 0.00 0.00 54.13 52.14 1xmq s LEU 79 Cb 0.08 -0.62 -0.02 0.00 0.03 0.00 0.00 46.19 45.66 1xmq s LEU 79 CO 0.76 -0.16 0.87 -2.16 0.23 0.00 0.00 176.35 175.89 1xmq s PRO 80 N -3.22 3.30 -0.19 1.29 0.04 -1.26 -4.40 135.00 130.56 1xmq s PRO 80 Ca 0.17 0.21 0.18 0.00 0.04 0.00 0.00 61.00 61.60 1xmq s PRO 80 Cb -0.02 -2.28 -0.25 0.00 0.04 0.00 0.00 34.50 31.98 1xmq s PRO 80 CO 0.05 -0.46 0.10 1.19 0.04 0.00 0.00 177.00 177.92 1xmq n PHE 81 N -2.47 0.02 -3.62 0.56 3.01 -1.26 -4.84 117.46 108.86 1xmq n PHE 81 Ca 0.03 0.01 -0.16 0.00 1.01 0.00 0.00 57.45 58.34 1xmq n PHE 81 Cb 0.56 -0.98 -0.07 0.00 -0.01 0.00 0.00 39.48 38.98 1xmq n PHE 81 CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 1xmq s THR 82 N -2.54 0.01 0.28 4.37 -1.32 -1.26 -4.44 115.64 110.74 1xmq s THR 82 Ca -0.10 -0.09 0.07 0.00 -1.21 0.00 0.00 61.69 60.37 1xmq s THR 82 Cb 0.06 -0.88 -0.06 0.00 -1.51 0.00 0.00 72.50 70.12 1xmq s THR 82 CO 0.83 -0.05 -0.07 -1.61 -2.21 0.00 0.00 174.62 171.52 1xmq s GLU 83 N -0.66 1.58 -0.12 7.08 0.41 -1.26 -4.50 118.70 121.22 1xmq s GLU 83 Ca -0.07 -1.80 -0.18 0.00 -0.41 0.00 0.00 54.97 52.50 1xmq s GLU 83 Cb -0.03 -1.22 -0.04 0.00 -1.78 0.00 0.00 34.13 31.06 1xmq s GLU 83 CO 0.06 0.06 0.49 0.15 -0.49 0.00 0.00 175.26 175.53 1xmq s LYS 84 N -3.71 4.33 -0.08 1.61 1.02 -1.26 -4.62 119.74 117.04 1xmq s LYS 84 Ca 0.30 0.47 -0.30 0.00 0.02 0.00 0.00 55.97 56.46 1xmq s LYS 84 Cb 0.03 -3.45 -0.05 0.00 -0.52 0.00 0.00 37.83 33.85 1xmq s LYS 84 CO 0.12 0.13 1.60 -1.17 -0.92 0.00 0.00 175.35 175.11 1xmq s LEU 85 N 0.72 4.28 -0.26 3.17 2.96 -1.26 -4.89 118.68 123.40 1xmq s LEU 85 Ca 0.26 2.12 -0.08 0.00 -0.22 0.00 0.00 54.13 56.22 1xmq s LEU 85 Cb -0.15 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 1xmq s LEU 85 CO 0.11 -0.92 0.10 -0.69 -1.32 0.00 0.00 176.35 173.62 1xmq s VAL 86 N 4.04 4.52 -5.00 1.68 1.01 -1.26 -4.97 120.40 120.41 1xmq s VAL 86 Ca 0.71 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.55 1xmq s VAL 86 Cb -0.31 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1xmq s VAL 86 CO 0.27 0.29 0.00 0.54 0.00 0.00 0.00 175.10 176.21 1xmq n ARG 87 N 4.95 0.00 -0.45 2.72 5.12 -1.26 -5.19 116.66 122.55 1xmq n ARG 87 Ca -0.16 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.76 1xmq n ARG 87 Cb 0.51 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.81 1xmq n ARG 87 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87