#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dcx s GLU 13 N 0.00 4.55 -0.12 0.00 2.12 -1.26 -4.52 118.70 119.47 3dcx s GLU 13 Ca 0.00 1.82 -0.23 0.00 0.36 0.00 0.00 54.97 56.92 3dcx s GLU 13 Cb 0.00 -3.24 -0.03 0.00 0.26 0.00 0.00 34.13 31.12 3dcx s GLU 13 CO 0.00 0.01 0.70 0.08 -0.54 0.00 0.00 175.26 175.51 3dcx s VAL 14 N -0.31 5.01 -0.45 3.70 1.01 -1.26 -5.01 120.40 123.08 3dcx s VAL 14 Ca 0.50 1.40 -0.29 0.00 0.00 0.00 0.00 61.98 63.60 3dcx s VAL 14 Cb -0.32 -4.03 0.02 0.00 0.00 0.00 0.00 36.38 32.06 3dcx s VAL 14 CO 0.37 0.17 1.19 0.21 0.00 0.00 0.00 175.10 177.04 3dcx s ASN 15 N 0.97 6.60 0.18 3.32 3.84 -1.26 -4.90 114.94 123.69 3dcx s ASN 15 Ca 0.35 0.61 0.09 0.00 0.21 0.00 0.00 52.86 54.12 3dcx s ASN 15 Cb -0.17 -2.55 -0.00 0.00 -0.55 0.00 0.00 41.25 37.98 3dcx s ASN 15 CO 0.15 -1.25 1.40 -0.07 -2.79 0.00 0.00 177.10 174.53 3dcx h LEU 16 N 11.31 0.00 -0.42 3.21 3.38 -1.98 -2.06 115.31 128.75 3dcx h LEU 16 Ca -0.24 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 3dcx h LEU 16 Cb 1.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 3dcx h LEU 16 CO 1.11 0.84 0.23 0.44 0.09 0.00 0.00 178.44 181.15 3dcx h ASP 17 N 0.00 0.52 -0.57 -0.43 3.32 -1.99 0.29 116.42 117.55 3dcx h ASP 17 Ca -0.01 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 56.87 3dcx h ASP 17 Cb 1.52 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.92 3dcx h ASP 17 CO 0.11 0.45 0.04 -0.33 -1.72 0.00 0.00 179.24 177.79 3dcx h GLU 18 N 0.54 1.01 -0.29 3.56 5.08 -1.97 -2.91 114.58 119.61 3dcx h GLU 18 Ca 0.15 -0.29 -0.11 0.00 -1.00 0.00 0.00 59.36 58.11 3dcx h GLU 18 Cb 0.05 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 3dcx h GLU 18 CO -0.02 0.97 -0.27 1.25 -1.00 0.00 0.00 179.01 179.94 3dcx h LEU 19 N 0.94 0.59 -1.25 1.33 5.85 -0.91 -1.80 115.31 120.06 3dcx h LEU 19 Ca 0.18 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 3dcx h LEU 19 Cb 0.49 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 3dcx h LEU 19 CO 0.02 0.84 -0.01 0.00 -0.34 0.00 0.00 178.44 178.95 3dcx h ALA 20 N 1.20 1.39 -0.19 1.25 0.00 -0.33 0.10 119.26 122.69 3dcx h ALA 20 Ca 0.07 -0.20 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 3dcx h ALA 20 Cb 0.72 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.38 3dcx h ALA 20 CO 0.06 0.42 -0.68 1.96 0.00 0.00 0.00 179.25 181.01 3dcx h GLN 21 N 0.47 0.80 -0.25 0.00 1.08 -1.27 -0.34 115.11 115.60 3dcx h GLN 21 Ca 0.10 -0.61 -0.02 0.00 -1.45 0.00 0.00 58.65 56.67 3dcx h GLN 21 Cb 0.33 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.86 3dcx h GLN 21 CO 0.01 1.22 0.07 0.93 -0.95 0.00 0.00 178.83 180.11 3dcx h GLU 22 N 0.54 0.39 0.00 1.46 5.08 -1.00 -3.26 114.58 117.79 3dcx h GLU 22 Ca -0.03 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3dcx h GLU 22 Cb 1.31 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.51 3dcx h GLU 22 CO 0.14 0.47 -0.29 1.28 -1.00 0.00 0.00 179.01 179.62 3dcx n LEU 23 N -4.74 0.50 -0.25 1.33 4.77 -0.01 -4.46 117.00 114.13 3dcx n LEU 23 Ca -0.03 0.32 0.05 0.00 -0.03 0.00 0.00 56.01 56.32 3dcx n LEU 23 Cb 0.16 -0.31 0.15 0.00 -2.33 0.00 0.00 43.42 41.09 3dcx n LEU 23 CO 0.36 -0.03 0.81 1.23 -1.33 0.00 0.00 177.39 178.44 3dcx h GLY 24 N 4.75 0.81 1.80 -0.72 0.00 -1.10 -0.71 103.07 107.91 3dcx h GLY 24 Ca 0.00 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.46 3dcx h GLY 24 CO 0.00 -0.28 0.09 -2.55 0.00 0.00 0.00 176.54 173.79 3dcx h PRO 25 N 0.09 0.00 -2.42 4.80 0.11 -1.82 -3.45 132.00 129.32 3dcx h PRO 25 Ca 0.40 0.00 -0.70 0.00 0.11 0.00 0.00 66.00 65.81 3dcx h PRO 25 Cb 0.70 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.46 3dcx h PRO 25 CO -0.67 0.00 0.13 0.44 -0.21 0.00 0.00 178.00 177.69 3dcx n ILE 26 N -3.38 4.17 -4.26 4.15 -5.35 -0.28 -5.17 119.36 109.25 3dcx n ILE 26 Ca -0.02 -5.67 -0.27 0.00 -0.27 0.00 0.00 62.75 56.52 3dcx n ILE 26 Cb 0.17 -1.81 -0.09 0.00 -1.74 0.00 0.00 39.64 36.17 3dcx n ILE 26 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3dcx s GLY 28 N -2.28 1.74 0.54 3.28 0.00 -1.26 -5.17 107.32 104.16 3dcx s GLY 28 Ca 0.39 -1.42 0.32 0.00 0.00 0.00 0.00 44.72 44.02 3dcx s GLY 28 CO -0.03 -1.43 2.01 -0.55 0.00 0.00 0.00 173.10 173.09 3dcx h ASP 29 N 2.91 0.00 -0.57 1.64 3.32 -2.02 -1.91 116.42 119.80 3dcx h ASP 29 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3dcx h ASP 29 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3dcx h ASP 29 CO 0.55 0.06 0.00 0.59 -1.72 0.00 0.00 179.24 178.72 3dcx n ASN 30 N -3.22 4.15 -4.81 6.45 5.03 -1.26 -5.00 115.26 116.61 3dcx n ASN 30 Ca -0.00 -2.33 -0.36 0.00 0.87 0.00 0.00 54.58 52.76 3dcx n ASN 30 Cb 0.29 -0.49 -0.07 0.00 -1.02 0.00 0.00 39.78 38.50 3dcx n ASN 30 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3dcx s GLU 31 N -1.61 3.33 0.06 3.52 2.12 -0.72 -5.02 118.70 120.38 3dcx s GLU 31 Ca 0.44 -0.22 0.04 0.00 0.36 0.00 0.00 54.97 55.60 3dcx s GLU 31 Cb 0.27 -3.08 -0.03 0.00 0.26 0.00 0.00 34.13 31.56 3dcx s GLU 31 CO 0.23 0.74 -0.12 -0.65 -0.54 0.00 0.00 175.26 174.91 3dcx s GLN 32 N -0.93 0.75 0.26 4.30 -0.21 -1.26 -4.78 119.66 117.78 3dcx s GLN 32 Ca 0.14 -0.88 -0.29 0.00 0.02 0.00 0.00 55.36 54.35 3dcx s GLN 32 Cb -0.12 -0.70 -0.09 0.00 1.00 0.00 0.00 33.01 33.10 3dcx s GLN 32 CO 0.03 0.15 1.23 -0.51 -2.12 0.00 0.00 175.29 174.08 3dcx s LEU 33 N -1.63 4.46 -0.14 2.90 1.43 -1.26 -1.52 118.68 122.92 3dcx s LEU 33 Ca -0.04 2.42 -0.12 0.00 -1.03 0.00 0.00 54.13 55.37 3dcx s LEU 33 Cb -0.10 -3.63 -0.06 0.00 0.03 0.00 0.00 46.19 42.44 3dcx s LEU 33 CO 0.02 -0.40 -0.25 0.00 0.23 0.00 0.00 176.35 175.94 3dcx n ALA 34 N 1.68 1.57 -3.12 4.21 0.00 0.39 -4.88 120.51 120.37 3dcx n ALA 34 Ca 0.02 -0.68 -0.12 0.00 0.00 0.00 0.00 53.44 52.66 3dcx n ALA 34 Cb 0.43 0.15 -0.07 0.00 0.00 0.00 0.00 19.45 19.97 3dcx n ALA 34 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dcx s LEU 35 N -7.42 0.63 0.00 0.00 1.43 -0.97 -5.02 118.68 107.34 3dcx s LEU 35 Ca -0.24 -0.05 -0.10 0.00 -1.03 0.00 0.00 54.13 52.72 3dcx s LEU 35 Cb 0.06 1.54 0.01 0.00 0.03 0.00 0.00 46.19 47.83 3dcx s LEU 35 CO 0.33 -0.61 0.19 0.00 0.23 0.00 0.00 176.35 176.48 3dcx s ALA 36 N -2.32 -0.45 -0.03 4.21 0.00 -1.26 -0.46 121.76 121.44 3dcx s ALA 36 Ca -0.06 -0.02 0.02 0.00 0.00 0.00 0.00 51.96 51.89 3dcx s ALA 36 Cb -0.01 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.23 3dcx s ALA 36 CO -0.02 -0.23 -0.06 0.71 0.00 0.00 0.00 175.76 176.16 3dcx s TYR 37 N -1.45 0.77 0.10 0.00 1.51 -0.37 -4.61 117.35 113.29 3dcx s TYR 37 Ca -0.14 -0.20 -0.25 0.00 -1.01 0.00 0.00 57.07 55.47 3dcx s TYR 37 Cb -0.07 -0.61 -0.06 0.00 -0.11 0.00 0.00 41.96 41.11 3dcx s TYR 37 CO 0.02 -0.13 0.78 1.03 -1.11 0.00 0.00 175.55 176.14 3dcx s ARG 38 N 0.51 4.53 -0.40 -0.62 0.52 -1.26 -0.98 118.95 121.26 3dcx s ARG 38 Ca -0.07 1.12 0.02 0.00 -0.52 0.00 0.00 55.73 56.28 3dcx s ARG 38 Cb -0.11 -3.32 0.12 0.00 0.52 0.00 0.00 34.95 32.16 3dcx s ARG 38 CO 0.00 0.40 0.17 0.08 0.02 0.00 0.00 175.30 175.97 3dcx s VAL 39 N -0.50 1.51 0.00 3.52 1.01 0.45 -4.78 120.40 121.61 3dcx s VAL 39 Ca 0.38 -2.27 0.00 0.00 0.00 0.00 0.00 61.98 60.09 3dcx s VAL 39 Cb -0.22 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.08 3dcx s VAL 39 CO 0.25 -0.78 0.00 -0.38 0.00 0.00 0.00 175.10 174.19 3dcx n ILE 40 N 3.98 0.00 1.02 2.22 5.41 -1.26 -0.81 119.36 129.92 3dcx n ILE 40 Ca 0.04 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.90 3dcx n ILE 40 Cb 0.37 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.31 3dcx n ILE 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 3dcx n ARG 41 N 0.00 0.93 0.00 0.38 1.74 -1.26 -5.17 116.66 113.28 3dcx n ARG 41 Ca 0.00 -0.75 0.00 0.00 -0.77 0.00 0.00 57.85 56.33 3dcx n ARG 41 Cb 0.00 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 3dcx n ARG 41 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3dcx n ASP 42 N -0.38 0.00 -3.64 0.55 8.00 0.01 -4.35 116.55 116.74 3dcx n ASP 42 Ca 0.08 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.37 3dcx n ASP 42 Cb 0.43 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 41.36 3dcx n ASP 42 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dcx s PHE 44 N 2.17 0.07 -0.22 1.24 0.40 -0.15 -0.41 117.98 121.08 3dcx s PHE 44 Ca 0.00 0.10 -0.03 0.00 -0.60 0.00 0.00 56.93 56.39 3dcx s PHE 44 Cb 0.00 -0.53 -0.00 0.00 0.51 0.00 0.00 43.02 43.00 3dcx s PHE 44 CO 0.00 -0.32 -0.05 0.08 0.70 0.00 0.00 175.22 175.63 3dcx s VAL 45 N 2.18 3.25 -0.30 -0.44 1.01 0.56 -1.24 120.40 125.42 3dcx s VAL 45 Ca 0.04 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.34 3dcx s VAL 45 Cb -0.13 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 3dcx s VAL 45 CO -0.06 0.41 0.18 -0.36 0.00 0.00 0.00 175.10 175.27 3dcx s PHE 46 N 1.45 3.19 0.49 5.22 0.40 0.39 -0.34 117.98 128.79 3dcx s PHE 46 Ca 0.05 -0.19 0.08 0.00 -0.60 0.00 0.00 56.93 56.27 3dcx s PHE 46 Cb -0.14 -2.38 0.08 0.00 0.51 0.00 0.00 43.02 41.08 3dcx s PHE 46 CO -0.04 -0.30 0.64 0.25 0.70 0.00 0.00 175.22 176.47 3dcx n THR 47 N 5.04 0.00 0.48 0.64 -2.24 0.64 -0.46 114.28 118.38 3dcx n THR 47 Ca -0.14 -1.65 0.10 0.00 -2.27 0.00 0.00 64.05 60.10 3dcx n THR 47 Cb 0.51 -0.55 0.43 0.00 -2.10 0.00 0.00 70.33 68.62 3dcx n THR 47 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3dcx n ASN 48 N -2.38 0.41 -0.00 3.42 6.94 -0.58 -3.98 115.26 119.08 3dcx n ASN 48 Ca 0.12 0.59 -0.00 0.00 -0.02 0.00 0.00 54.58 55.27 3dcx n ASN 48 Cb 0.51 -0.68 -0.01 0.00 -2.36 0.00 0.00 39.78 37.23 3dcx n ASN 48 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3dcx n LYS 49 N -1.94 2.77 -3.62 -3.83 4.76 -1.26 -5.04 118.16 110.00 3dcx n LYS 49 Ca 0.03 -0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.34 3dcx n LYS 49 Cb 0.23 -1.03 -0.05 0.00 -1.84 0.00 0.00 35.03 32.33 3dcx n LYS 49 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 3dcx s ARG 50 N -2.05 1.02 -0.16 1.97 1.70 -1.26 -3.11 118.95 117.06 3dcx s ARG 50 Ca -0.01 -0.45 -0.22 0.00 -0.47 0.00 0.00 55.73 54.59 3dcx s ARG 50 Cb 0.01 0.46 -0.03 0.00 -0.57 0.00 0.00 34.95 34.81 3dcx s ARG 50 CO 0.05 -0.38 0.66 -1.17 -1.08 0.00 0.00 175.30 173.39 3dcx s LEU 51 N -2.30 4.20 -0.27 -1.89 2.96 -0.65 -0.26 118.68 120.47 3dcx s LEU 51 Ca -0.02 0.96 -0.07 0.00 -0.22 0.00 0.00 54.13 54.78 3dcx s LEU 51 Cb 0.00 -2.97 -0.01 0.00 0.50 0.00 0.00 46.19 43.71 3dcx s LEU 51 CO -0.06 -0.24 0.07 -0.63 -1.32 0.00 0.00 176.35 174.18 3dcx s ILE 52 N 1.60 4.16 -0.38 6.68 1.01 0.54 -0.23 121.20 134.58 3dcx s ILE 52 Ca 0.32 -0.38 -0.19 0.00 0.00 0.00 0.00 60.65 60.39 3dcx s ILE 52 Cb -0.16 -3.02 0.01 0.00 0.01 0.00 0.00 42.46 39.29 3dcx s ILE 52 CO 0.12 0.24 0.58 -0.76 0.00 0.00 0.00 174.94 175.12 3dcx s LEU 53 N 1.57 4.40 -0.31 2.97 1.43 -0.36 -0.32 118.68 128.06 3dcx s LEU 53 Ca 0.05 -0.11 -0.10 0.00 -1.03 0.00 0.00 54.13 52.94 3dcx s LEU 53 Cb -0.16 -2.67 -0.01 0.00 0.03 0.00 0.00 46.19 43.39 3dcx s LEU 53 CO 0.03 -0.60 0.17 -0.63 0.23 0.00 0.00 176.35 175.55 3dcx s ILE 54 N 2.58 4.74 -0.17 -0.59 1.01 -1.26 -1.16 121.20 126.35 3dcx s ILE 54 Ca 0.21 -0.36 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 3dcx s ILE 54 Cb -0.15 -3.41 -0.01 0.00 0.01 0.00 0.00 42.46 38.90 3dcx s ILE 54 CO 0.15 0.07 -0.08 -1.81 0.00 0.00 0.00 174.94 173.26 3dcx s ASP 55 N 1.64 4.24 0.06 3.58 1.11 -0.29 -4.42 116.67 122.59 3dcx s ASP 55 Ca 0.05 -0.32 0.08 0.00 0.18 0.00 0.00 52.55 52.54 3dcx s ASP 55 Cb -0.17 -1.68 -0.03 0.00 1.07 0.00 0.00 42.92 42.11 3dcx s ASP 55 CO 0.07 0.10 -0.22 -0.54 1.18 0.00 0.00 175.17 175.76 3dcx s LYS 56 N 0.76 1.38 0.17 8.23 1.02 -1.26 -1.03 119.74 129.01 3dcx s LYS 56 Ca -0.04 -1.03 0.23 0.00 0.02 0.00 0.00 55.97 55.16 3dcx s LYS 56 Cb -0.15 -1.56 0.21 0.00 -0.52 0.00 0.00 37.83 35.82 3dcx s LYS 56 CO 0.02 0.39 1.24 1.96 -0.92 0.00 0.00 175.35 178.03 3dcx h GLN 57 N 4.64 0.00 0.00 1.68 4.20 -1.77 -3.44 115.11 120.42 3dcx h GLN 57 Ca -0.44 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.27 3dcx h GLN 57 Cb 1.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.94 3dcx h GLN 57 CO 0.43 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 179.00 3dcx n GLY 58 N 1.26 2.90 0.31 3.46 0.00 -1.25 0.10 105.19 111.97 3dcx n GLY 58 Ca 0.02 0.29 0.19 0.00 0.00 0.00 0.00 46.02 46.52 3dcx n GLY 58 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3dcx h VAL 59 N 0.00 0.07 0.00 1.61 -1.51 -2.01 -2.85 116.25 111.56 3dcx h VAL 59 Ca 0.00 -0.27 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 3dcx h VAL 59 Cb 0.00 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.41 3dcx h VAL 59 CO 0.00 0.01 -0.55 0.35 -1.23 0.00 0.00 177.57 176.15 3dcx n THR 60 N -3.15 0.34 -3.73 7.19 -2.24 0.11 -5.00 114.28 107.79 3dcx n THR 60 Ca -0.01 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 3dcx n THR 60 Cb 0.19 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 3dcx n THR 60 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dcx n GLY 61 N 1.35 0.81 0.07 3.38 0.00 -1.08 -5.01 105.19 104.72 3dcx n GLY 61 Ca 0.04 -0.88 0.03 0.00 0.00 0.00 0.00 46.02 45.21 3dcx n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dcx n LYS 62 N -0.06 0.65 -1.76 1.61 4.01 -1.26 -3.78 118.16 117.56 3dcx n LYS 62 Ca 0.00 0.02 -0.41 0.00 -0.51 0.00 0.00 58.31 57.40 3dcx n LYS 62 Cb 0.04 -1.65 -0.01 0.00 -0.51 0.00 0.00 35.03 32.90 3dcx n LYS 62 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 3dcx n LYS 63 N -2.62 2.71 -4.31 1.97 2.85 -1.26 -4.91 118.16 112.59 3dcx n LYS 63 Ca -0.12 0.96 -0.19 0.00 -1.05 0.00 0.00 58.31 57.91 3dcx n LYS 63 Cb 0.79 -2.72 -0.15 0.00 -0.65 0.00 0.00 35.03 32.29 3dcx n LYS 63 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3dcx s VAL 64 N -0.48 0.67 -0.07 0.58 1.01 -1.26 -2.87 120.40 117.98 3dcx s VAL 64 Ca 0.59 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.29 3dcx s VAL 64 Cb -0.48 -0.60 0.01 0.00 0.00 0.00 0.00 36.38 35.31 3dcx s VAL 64 CO 0.55 0.21 -0.15 -0.55 0.00 0.00 0.00 175.10 175.16 3dcx s SER 65 N 0.17 2.07 -0.34 3.32 0.15 -0.20 -4.99 113.70 113.88 3dcx s SER 65 Ca -0.02 -0.36 -0.03 0.00 0.70 0.00 0.00 55.95 56.24 3dcx s SER 65 Cb -0.07 -0.95 0.06 0.00 -1.71 0.00 0.00 66.02 63.35 3dcx s SER 65 CO 0.00 0.06 0.07 -0.31 1.20 0.00 0.00 173.24 174.26 3dcx s TYR 66 N 0.60 3.36 -0.32 3.44 1.51 -1.26 -1.14 117.35 123.54 3dcx s TYR 66 Ca -0.15 -1.96 -0.06 0.00 -1.01 0.00 0.00 57.07 53.88 3dcx s TYR 66 Cb -0.16 -2.45 0.03 0.00 -0.11 0.00 0.00 41.96 39.27 3dcx s TYR 66 CO 0.05 -0.84 0.09 -1.58 -1.11 0.00 0.00 175.55 172.15 3dcx s HIS 67 N 1.24 3.22 -0.25 2.71 2.46 -0.31 -4.97 115.29 119.38 3dcx s HIS 67 Ca -0.01 -1.32 -0.14 0.00 0.47 0.00 0.00 55.06 54.06 3dcx s HIS 67 Cb -0.20 -2.25 -0.04 0.00 -0.13 0.00 0.00 32.58 29.95 3dcx s HIS 67 CO -0.01 -0.69 0.34 -1.12 -2.47 0.00 0.00 174.74 170.78 3dcx s SER 68 N 1.42 6.26 -0.36 9.88 0.01 -1.26 -1.22 113.70 128.42 3dcx s SER 68 Ca -0.01 0.29 0.04 0.00 1.31 0.00 0.00 55.95 57.58 3dcx s SER 68 Cb -0.19 -2.19 0.10 0.00 0.21 0.00 0.00 66.02 63.95 3dcx s SER 68 CO 0.02 -0.12 0.08 -0.69 0.41 0.00 0.00 173.24 172.94 3dcx s VAL 69 N 1.75 2.23 0.42 3.43 1.01 0.68 -4.99 120.40 124.93 3dcx s VAL 69 Ca 0.14 -2.42 -0.26 0.00 0.00 0.00 0.00 61.98 59.44 3dcx s VAL 69 Cb -0.15 -2.64 -0.09 0.00 0.00 0.00 0.00 36.38 33.49 3dcx s VAL 69 CO 0.09 -0.63 1.41 -2.84 0.00 0.00 0.00 175.10 173.13 3dcx s PRO 70 N 0.79 3.88 0.42 2.72 0.02 -1.26 -1.64 135.00 139.92 3dcx s PRO 70 Ca 0.12 2.39 0.09 0.00 0.02 0.00 0.00 61.00 63.62 3dcx s PRO 70 Cb -0.20 -2.77 0.91 0.00 0.02 0.00 0.00 34.50 32.46 3dcx s PRO 70 CO -0.08 -0.65 2.05 1.88 -0.33 0.00 0.00 177.00 179.87 3dcx h TYR 71 N 2.61 0.41 -0.41 6.54 0.05 -1.88 -1.36 116.97 122.93 3dcx h TYR 71 Ca -0.50 0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.35 3dcx h TYR 71 Cb 1.25 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.84 3dcx h TYR 71 CO 0.52 0.29 0.28 1.57 -1.05 0.00 0.00 178.16 179.77 3dcx h LYS 72 N 0.43 0.21 0.00 4.88 2.10 -1.89 -2.65 116.57 119.64 3dcx h LYS 72 Ca 0.11 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 3dcx h LYS 72 Cb 0.01 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.29 3dcx h LYS 72 CO -0.02 0.14 0.00 0.00 -2.00 0.00 0.00 179.45 177.57 3dcx n ALA 73 N -2.55 2.12 -2.40 0.07 0.00 -0.51 -4.66 120.51 112.57 3dcx n ALA 73 Ca 0.06 -0.05 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 3dcx n ALA 73 Cb 0.33 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.34 3dcx n ALA 73 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3dcx s ILE 74 N -3.06 3.86 -0.13 0.00 1.01 -1.00 0.39 121.20 122.27 3dcx s ILE 74 Ca 0.11 0.80 -0.27 0.00 0.00 0.00 0.00 60.65 61.29 3dcx s ILE 74 Cb 0.15 -4.38 -0.26 0.00 0.01 0.00 0.00 42.46 37.97 3dcx s ILE 74 CO 0.48 -1.03 0.73 0.74 0.00 0.00 0.00 174.94 175.87 3dcx h THR 75 N 6.39 1.66 -3.18 2.92 2.02 -1.08 -3.48 112.91 118.17 3dcx h THR 75 Ca -0.27 -2.36 0.03 0.00 0.77 0.00 0.00 66.41 64.58 3dcx h THR 75 Cb 1.09 3.25 -0.06 0.00 -1.74 0.00 0.00 68.15 70.69 3dcx h THR 75 CO 1.14 0.60 0.14 -1.38 0.37 0.00 0.00 175.52 176.40 3dcx s HIS 76 N -2.27 -0.03 0.09 3.16 -3.43 -1.22 -5.03 115.29 106.56 3dcx s HIS 76 Ca -0.19 -0.41 -0.21 0.00 -0.80 0.00 0.00 55.06 53.45 3dcx s HIS 76 Cb -0.01 0.58 0.05 0.00 -1.43 0.00 0.00 32.58 31.76 3dcx s HIS 76 CO 0.70 -1.19 0.51 -0.59 -2.00 0.00 0.00 174.74 172.17 3dcx s PHE 77 N -3.88 -0.40 -0.11 0.38 -0.71 -1.26 -1.20 117.98 110.80 3dcx s PHE 77 Ca 0.14 0.31 -0.10 0.00 -1.04 0.00 0.00 56.93 56.25 3dcx s PHE 77 Cb -0.05 0.36 0.03 0.00 -1.21 0.00 0.00 43.02 42.16 3dcx s PHE 77 CO 0.08 -0.70 0.28 -2.00 -1.34 0.00 0.00 175.22 171.55 3dcx s GLU 78 N -3.01 0.33 -0.13 1.99 2.12 -0.38 -5.00 118.70 114.62 3dcx s GLU 78 Ca -0.02 0.41 0.03 0.00 0.36 0.00 0.00 54.97 55.74 3dcx s GLU 78 Cb -0.00 0.15 0.01 0.00 0.26 0.00 0.00 34.13 34.55 3dcx s GLU 78 CO -0.06 -0.05 -0.22 0.08 -0.54 0.00 0.00 175.26 174.47 3dcx s VAL 79 N 0.22 2.02 -0.12 3.70 1.01 -1.26 -0.45 120.40 125.52 3dcx s VAL 79 Ca -0.01 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.03 3dcx s VAL 79 Cb -0.02 -1.79 -0.00 0.00 0.00 0.00 0.00 36.38 34.57 3dcx s VAL 79 CO -0.00 0.54 -0.19 -0.70 0.00 0.00 0.00 175.10 174.75 3dcx s GLU 80 N 0.78 3.17 -0.01 2.72 2.12 -0.10 -4.98 118.70 122.40 3dcx s GLU 80 Ca -0.08 -0.80 0.01 0.00 0.36 0.00 0.00 54.97 54.45 3dcx s GLU 80 Cb -0.16 -2.45 -0.04 0.00 0.26 0.00 0.00 34.13 31.74 3dcx s GLU 80 CO -0.01 0.15 0.01 0.95 -0.54 0.00 0.00 175.26 175.82 3dcx s THR 81 N 0.46 4.26 0.25 -1.70 -4.23 -1.26 -0.42 115.64 113.00 3dcx s THR 81 Ca -0.14 -0.55 -0.31 0.00 -1.18 0.00 0.00 61.69 59.52 3dcx s THR 81 Cb -0.17 -2.90 -0.13 0.00 1.34 0.00 0.00 72.50 70.64 3dcx s THR 81 CO 0.06 0.38 1.45 0.00 -0.54 0.00 0.00 174.62 175.97 3dcx n ALA 82 N 1.40 1.47 0.16 3.99 0.00 0.46 -4.91 120.51 123.07 3dcx n ALA 82 Ca -0.14 0.40 -0.08 0.00 0.00 0.00 0.00 53.44 53.61 3dcx n ALA 82 Cb 0.53 -2.32 0.06 0.00 0.00 0.00 0.00 19.45 17.71 3dcx n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dcx n GLY 83 N 2.13 2.90 3.23 0.00 0.00 -1.26 -4.81 105.19 107.39 3dcx n GLY 83 Ca 0.11 -0.40 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 3dcx n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dcx s THR 84 N -1.13 1.14 0.55 2.61 -4.23 -1.26 -5.05 115.64 108.26 3dcx s THR 84 Ca 0.19 -1.92 0.32 0.00 -1.18 0.00 0.00 61.69 59.11 3dcx s THR 84 Cb 0.16 -1.69 0.49 0.00 1.34 0.00 0.00 72.50 72.79 3dcx s THR 84 CO 0.03 -0.66 1.86 2.19 -0.54 0.00 0.00 174.62 177.51 3dcx h PHE 85 N 3.06 0.00 0.00 3.99 -5.15 -2.06 -3.41 116.94 113.37 3dcx h PHE 85 Ca -0.37 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.40 3dcx h PHE 85 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.36 3dcx h PHE 85 CO 0.65 0.00 0.00 -0.40 -2.00 0.00 0.00 178.31 176.56 3dcx n ASP 86 N -4.16 0.00 0.00 -0.68 5.75 -1.26 -5.14 116.55 111.06 3dcx n ASP 86 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.97 3dcx n ASP 86 Cb 1.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.09 3dcx n ASP 86 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3dcx n ASP 88 N 0.00 0.00 -4.40 -1.12 8.00 -1.26 -4.18 116.55 113.58 3dcx n ASP 88 Ca 0.00 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.30 3dcx n ASP 88 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 3dcx n ASP 88 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dcx s ALA 89 N -2.00 2.22 -0.03 2.24 0.00 -0.13 -0.41 121.76 123.66 3dcx s ALA 89 Ca 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 51.96 50.12 3dcx s ALA 89 Cb 0.00 0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.33 3dcx s ALA 89 CO 0.00 -0.08 -0.00 -2.00 0.00 0.00 0.00 175.76 173.68 3dcx s GLU 90 N -3.73 0.30 -0.20 0.00 2.12 0.45 -0.13 118.70 117.50 3dcx s GLU 90 Ca 0.28 0.06 -0.09 0.00 0.36 0.00 0.00 54.97 55.58 3dcx s GLU 90 Cb 0.03 -0.47 -0.05 0.00 0.26 0.00 0.00 34.13 33.91 3dcx s GLU 90 CO 0.11 -0.12 0.12 -1.17 -0.54 0.00 0.00 175.26 173.65 3dcx s LEU 91 N 0.95 4.11 -0.18 2.70 2.96 -0.28 -0.92 118.68 128.01 3dcx s LEU 91 Ca -0.10 0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 53.98 3dcx s LEU 91 Cb -0.13 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.49 3dcx s LEU 91 CO -0.02 0.17 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.54 3dcx s LYS 92 N 0.44 3.31 -0.20 1.98 1.02 0.40 -0.44 119.74 126.25 3dcx s LYS 92 Ca 0.07 -0.68 -0.04 0.00 0.02 0.00 0.00 55.97 55.34 3dcx s LYS 92 Cb -0.12 -2.80 -0.01 0.00 -0.52 0.00 0.00 37.83 34.38 3dcx s LYS 92 CO -0.01 -0.06 -0.04 -0.51 -0.92 0.00 0.00 175.35 173.81 3dcx s LEU 93 N 1.07 2.99 -0.18 3.17 1.43 0.82 -1.25 118.68 126.74 3dcx s LEU 93 Ca 0.00 -0.32 -0.16 0.00 -1.03 0.00 0.00 54.13 52.62 3dcx s LEU 93 Cb -0.15 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 3dcx s LEU 93 CO -0.02 0.03 0.39 0.26 0.23 0.00 0.00 176.35 177.24 3dcx s TRP 94 N 1.16 3.42 -0.04 0.29 0.51 -0.34 -0.37 118.94 123.57 3dcx s TRP 94 Ca 0.02 0.66 0.04 0.00 -2.12 0.00 0.00 56.10 54.70 3dcx s TRP 94 Cb -0.14 -2.49 -0.03 0.00 -0.81 0.00 0.00 33.47 30.00 3dcx s TRP 94 CO -0.00 0.07 -0.13 0.42 -0.51 0.00 0.00 176.95 176.80 3dcx s ILE 95 N 1.01 3.16 0.08 2.03 1.01 -1.26 -0.52 121.20 126.70 3dcx s ILE 95 Ca 0.20 -0.75 -0.36 0.00 0.00 0.00 0.00 60.65 59.74 3dcx s ILE 95 Cb -0.14 -2.27 -0.16 0.00 0.01 0.00 0.00 42.46 39.91 3dcx s ILE 95 CO 0.07 0.55 1.46 -0.24 0.00 0.00 0.00 174.94 176.78 3dcx n SER 96 N 2.15 2.22 0.00 3.58 2.88 0.16 -1.59 113.62 123.02 3dcx n SER 96 Ca -0.17 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 3dcx n SER 96 Cb 0.52 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.71 3dcx n SER 96 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dcx n GLY 97 N 2.97 1.82 3.40 0.46 0.00 -1.26 -5.06 105.19 107.53 3dcx n GLY 97 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3dcx n GLY 97 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dcx s GLN 98 N -0.58 3.30 0.33 1.61 1.11 -0.62 -5.02 119.66 119.79 3dcx s GLN 98 Ca 0.00 -0.66 0.18 0.00 0.01 0.00 0.00 55.36 54.88 3dcx s GLN 98 Cb 0.00 -2.63 0.30 0.00 -1.01 0.00 0.00 33.01 29.67 3dcx s GLN 98 CO 0.00 0.28 1.56 1.57 0.01 0.00 0.00 175.29 178.70 3dcx h LYS 99 N 6.50 0.00 -5.59 2.91 2.10 -1.97 -3.39 116.57 117.13 3dcx h LYS 99 Ca -0.29 0.00 -0.62 0.00 -2.00 0.00 0.00 60.65 57.74 3dcx h LYS 99 Cb 1.20 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.45 3dcx h LYS 99 CO 0.56 0.41 -0.37 -0.51 -2.00 0.00 0.00 179.45 177.53 3dcx s ASP 100 N -6.39 6.45 0.49 7.07 1.01 -1.26 -5.05 116.67 118.99 3dcx s ASP 100 Ca 0.03 0.53 -0.19 0.00 0.71 0.00 0.00 52.55 53.63 3dcx s ASP 100 Cb 0.08 -2.15 -0.08 0.00 1.01 0.00 0.00 42.92 41.78 3dcx s ASP 100 CO 0.71 0.23 1.01 -2.16 0.21 0.00 0.00 175.17 175.18 3dcx s PRO 101 N -0.22 3.84 0.02 8.23 0.04 -1.26 -4.76 135.00 140.89 3dcx s PRO 101 Ca 0.16 1.23 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 3dcx s PRO 101 Cb -0.13 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 3dcx s PRO 101 CO 0.05 -0.38 1.08 -1.17 0.04 0.00 0.00 177.00 176.62 3dcx s LEU 102 N -3.64 4.36 -0.07 -3.56 2.96 0.50 -4.87 118.68 114.36 3dcx s LEU 102 Ca 0.64 1.82 0.05 0.00 -0.22 0.00 0.00 54.13 56.42 3dcx s LEU 102 Cb -0.14 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 42.97 3dcx s LEU 102 CO 0.22 -0.36 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.96 3dcx s VAL 103 N 1.09 1.98 -0.07 1.68 1.01 -1.26 -0.12 120.40 124.71 3dcx s VAL 103 Ca 0.55 -1.01 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 3dcx s VAL 103 Cb -0.25 -1.68 0.02 0.00 0.00 0.00 0.00 36.38 34.47 3dcx s VAL 103 CO 0.28 0.55 -0.03 -0.75 0.00 0.00 0.00 175.10 175.15 3dcx s LYS 104 N -0.02 0.89 0.04 2.72 2.47 0.42 -5.00 119.74 121.26 3dcx s LYS 104 Ca -0.07 -0.06 -0.30 0.00 -1.56 0.00 0.00 55.97 53.98 3dcx s LYS 104 Cb -0.14 -1.04 -0.05 0.00 -1.46 0.00 0.00 37.83 35.13 3dcx s LYS 104 CO 0.05 -0.20 1.24 -2.00 0.16 0.00 0.00 175.35 174.59 3dcx s GLU 105 N 1.47 4.39 -0.52 4.03 2.12 -1.26 -1.13 118.70 127.80 3dcx s GLU 105 Ca -0.02 1.80 0.01 0.00 0.36 0.00 0.00 54.97 57.12 3dcx s GLU 105 Cb -0.13 -3.40 0.13 0.00 0.26 0.00 0.00 34.13 30.99 3dcx s GLU 105 CO -0.03 -0.34 0.28 -0.51 -0.54 0.00 0.00 175.26 174.12 3dcx s LEU 106 N 1.40 4.78 0.63 2.70 1.43 0.81 -4.95 118.68 125.49 3dcx s LEU 106 Ca 0.59 -2.73 -0.12 0.00 -1.03 0.00 0.00 54.13 50.84 3dcx s LEU 106 Cb -0.29 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 3dcx s LEU 106 CO 0.28 -0.33 1.04 -0.54 0.23 0.00 0.00 176.35 177.03 3dcx s LYS 107 N 0.11 3.34 -0.02 1.70 1.02 -1.26 -0.95 119.74 123.68 3dcx s LYS 107 Ca 0.15 0.91 -0.39 0.00 0.02 0.00 0.00 55.97 56.66 3dcx s LYS 107 Cb -0.23 -2.05 -0.19 0.00 -0.52 0.00 0.00 37.83 34.84 3dcx s LYS 107 CO -0.03 -0.77 1.05 1.17 -0.92 0.00 0.00 175.35 175.85 3dcx n LYS 108 N -2.69 0.00 0.00 1.68 4.81 -1.26 -1.04 118.16 119.66 3dcx n LYS 108 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 3dcx n LYS 108 Cb 0.54 -1.45 0.00 0.00 0.02 0.00 0.00 35.03 34.14 3dcx n LYS 108 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dcx n GLY 109 N 1.53 2.32 3.77 3.14 0.00 -1.26 -5.07 105.19 109.61 3dcx n GLY 109 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 3dcx n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dcx s THR 110 N -2.35 2.89 -1.32 2.61 2.01 -0.21 -4.91 115.64 114.36 3dcx s THR 110 Ca 0.00 0.75 -0.17 0.00 0.31 0.00 0.00 61.69 62.57 3dcx s THR 110 Cb 0.00 -3.42 0.05 0.00 0.01 0.00 0.00 72.50 69.14 3dcx s THR 110 CO 0.00 0.07 1.87 -0.67 -0.69 0.00 0.00 174.62 175.20 3dcx n ASP 111 N -0.07 4.51 -0.15 3.53 2.03 -1.26 -4.76 116.55 120.39 3dcx n ASP 111 Ca 0.05 -2.88 -0.09 0.00 0.52 0.00 0.00 54.79 52.38 3dcx n ASP 111 Cb 0.46 -1.71 -0.01 0.00 -0.72 0.00 0.00 41.12 39.14 3dcx n ASP 111 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 3dcx h VAL 112 N 5.21 1.23 -0.23 5.18 2.07 -1.94 -1.71 116.25 126.07 3dcx h VAL 112 Ca 0.46 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 3dcx h VAL 112 Cb 0.82 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3dcx h VAL 112 CO 1.56 0.28 0.09 0.58 0.02 0.00 0.00 177.57 180.10 3dcx h VAL 113 N 0.55 1.17 -0.62 2.57 2.07 -2.00 -2.51 116.25 117.48 3dcx h VAL 113 Ca 0.13 -0.51 0.08 0.00 0.82 0.00 0.00 66.70 67.22 3dcx h VAL 113 Cb 0.31 1.08 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 3dcx h VAL 113 CO 0.00 0.17 0.29 1.23 0.02 0.00 0.00 177.57 179.28 3dcx h GLY 114 N 0.21 0.89 1.05 2.17 0.00 -1.93 -1.06 103.07 104.41 3dcx h GLY 114 Ca 0.08 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.16 3dcx h GLY 114 CO -0.01 0.06 0.18 -2.22 0.00 0.00 0.00 176.54 174.56 3dcx h ILE 115 N 0.52 1.26 -0.38 2.60 2.04 -1.23 -1.68 117.51 120.63 3dcx h ILE 115 Ca 0.30 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 3dcx h ILE 115 Cb 0.29 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 3dcx h ILE 115 CO -0.24 0.36 0.14 1.56 0.00 0.00 0.00 178.15 179.97 3dcx h GLN 116 N 1.03 0.58 -0.76 2.37 4.20 -0.99 -0.91 115.11 120.63 3dcx h GLN 116 Ca 0.22 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.77 3dcx h GLN 116 Cb 0.35 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 3dcx h GLN 116 CO -0.00 0.57 0.28 -0.22 -0.67 0.00 0.00 178.83 178.79 3dcx h LYS 117 N 0.47 1.15 -0.36 1.46 3.64 -1.10 -1.58 116.57 120.24 3dcx h LYS 117 Ca 0.12 -0.22 -0.16 0.00 -1.27 0.00 0.00 60.65 59.13 3dcx h LYS 117 Cb 0.22 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 3dcx h LYS 117 CO -0.01 0.95 -0.40 1.15 -2.27 0.00 0.00 179.45 178.86 3dcx h THR 118 N 1.11 1.27 -0.67 1.00 2.02 -1.19 0.11 112.91 116.57 3dcx h THR 118 Ca 0.25 -1.58 0.04 0.00 0.77 0.00 0.00 66.41 65.89 3dcx h THR 118 Cb 0.24 1.44 -0.05 0.00 -1.74 0.00 0.00 68.15 68.04 3dcx h THR 118 CO -0.02 0.53 0.40 0.40 0.37 0.00 0.00 175.52 177.20 3dcx h ILE 119 N 0.72 1.04 0.14 3.11 2.04 -1.06 -1.36 117.51 122.15 3dcx h ILE 119 Ca 0.05 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 3dcx h ILE 119 Cb 1.00 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.29 3dcx h ILE 119 CO 0.10 0.14 -0.08 0.00 0.00 0.00 0.00 178.15 178.31 3dcx h ALA 120 N 1.31 -0.20 -0.77 1.87 0.00 -0.96 -0.30 119.26 120.20 3dcx h ALA 120 Ca 0.28 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.17 3dcx h ALA 120 Cb 0.09 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3dcx h ALA 120 CO -0.14 -0.62 0.51 -0.91 0.00 0.00 0.00 179.25 178.10 3dcx h ASN 121 N -0.21 0.86 0.62 0.00 2.35 -0.52 -2.42 115.58 116.27 3dcx h ASN 121 Ca -0.02 -0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.59 3dcx h ASN 121 Cb 0.17 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 3dcx h ASN 121 CO 0.02 0.61 -1.47 0.49 -1.65 0.00 0.00 177.43 175.43 3dcx n PHE 122 N -4.43 0.79 -0.01 1.19 3.72 -0.54 -4.54 117.46 113.64 3dcx n PHE 122 Ca 0.09 0.25 0.06 0.00 -0.05 0.00 0.00 57.45 57.80 3dcx n PHE 122 Cb 0.06 -0.99 -0.11 0.00 -0.94 0.00 0.00 39.48 37.50 3dcx n PHE 122 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3dcx n SER 123 N -2.76 1.67 -0.55 4.37 3.41 -0.13 -4.88 113.62 114.76 3dcx n SER 123 Ca -0.09 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.66 3dcx n SER 123 Cb 0.77 1.58 0.47 0.00 -0.26 0.00 0.00 64.21 66.77 3dcx n SER 123 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06