#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dcx n GLY 9 N 0.00 2.22 3.74 -0.02 0.00 -1.26 -5.04 105.19 104.83 3dcx n GLY 9 Ca 0.00 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.93 3dcx n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dcx s ASN 10 N 0.00 5.51 -0.08 1.61 0.01 -1.26 -4.06 114.94 116.67 3dcx s ASN 10 Ca 0.00 0.16 -0.11 0.00 -0.71 0.00 0.00 52.86 52.20 3dcx s ASN 10 Cb 0.00 -1.58 -0.05 0.00 0.41 0.00 0.00 41.25 40.03 3dcx s ASN 10 CO 0.00 0.33 0.26 0.00 -1.51 0.00 0.00 177.10 176.17 3dcx s ALA 11 N -1.04 3.78 -0.13 0.60 0.00 -0.87 -4.73 121.76 119.37 3dcx s ALA 11 Ca 0.18 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 51.64 3dcx s ALA 11 Cb -0.12 -2.17 -0.03 0.00 0.00 0.00 0.00 23.12 20.80 3dcx s ALA 11 CO 0.08 0.50 -0.02 0.00 0.00 0.00 0.00 175.76 176.33 3dcx s ALA 12 N -0.86 3.14 0.29 0.00 0.00 -0.41 -4.51 121.76 119.41 3dcx s ALA 12 Ca 0.18 -0.81 -0.29 0.00 0.00 0.00 0.00 51.96 51.04 3dcx s ALA 12 Cb -0.14 -1.54 -0.10 0.00 0.00 0.00 0.00 23.12 21.35 3dcx s ALA 12 CO 0.07 0.37 1.19 -2.00 0.00 0.00 0.00 175.76 175.40 3dcx s GLU 13 N -0.18 4.51 -0.12 0.00 2.12 -1.26 0.12 118.70 123.89 3dcx s GLU 13 Ca 0.04 1.98 -0.05 0.00 0.36 0.00 0.00 54.97 57.30 3dcx s GLU 13 Cb -0.13 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 3dcx s GLU 13 CO 0.02 0.02 0.06 0.08 -0.54 0.00 0.00 175.26 174.90 3dcx s VAL 14 N -1.02 4.78 0.00 3.70 1.01 -0.27 -4.85 120.40 123.75 3dcx s VAL 14 Ca 0.47 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.09 3dcx s VAL 14 Cb -0.35 -3.07 -0.08 0.00 0.00 0.00 0.00 36.38 32.88 3dcx s VAL 14 CO 0.45 0.57 1.83 0.21 0.00 0.00 0.00 175.10 178.17 3dcx s ASN 15 N -0.61 6.54 0.44 3.32 3.84 -1.26 -4.62 114.94 122.59 3dcx s ASN 15 Ca 0.11 2.49 0.24 0.00 0.21 0.00 0.00 52.86 55.91 3dcx s ASN 15 Cb -0.12 -2.53 0.47 0.00 -0.55 0.00 0.00 41.25 38.52 3dcx s ASN 15 CO 0.02 -1.00 1.65 -0.07 -2.79 0.00 0.00 177.10 174.92 3dcx h LEU 16 N 10.36 0.00 -0.08 3.21 3.38 -1.97 -2.01 115.31 128.20 3dcx h LEU 16 Ca -0.45 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 3dcx h LEU 16 Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 3dcx h LEU 16 CO 0.95 0.05 -0.12 0.44 0.09 0.00 0.00 178.44 179.84 3dcx h ASP 17 N 0.00 0.25 -0.49 -0.43 3.32 -1.99 -1.68 116.42 115.40 3dcx h ASP 17 Ca -0.00 -0.53 -0.09 0.00 0.02 0.00 0.00 57.03 56.43 3dcx h ASP 17 Cb 0.96 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 3dcx h ASP 17 CO 0.01 0.73 -0.05 -0.33 -1.72 0.00 0.00 179.24 177.88 3dcx h GLU 18 N -0.23 0.89 -0.80 3.56 5.08 -1.97 -2.82 114.58 118.30 3dcx h GLU 18 Ca 0.01 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.03 3dcx h GLU 18 Cb 0.68 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 3dcx h GLU 18 CO 0.03 0.95 0.38 1.25 -1.00 0.00 0.00 179.01 180.62 3dcx h LEU 19 N 0.75 1.05 -1.09 1.33 5.85 -1.39 -1.27 115.31 120.54 3dcx h LEU 19 Ca 0.13 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 3dcx h LEU 19 Cb 0.58 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 3dcx h LEU 19 CO 0.03 0.89 0.24 0.00 -0.34 0.00 0.00 178.44 179.26 3dcx h ALA 20 N 1.20 1.28 -0.41 1.25 0.00 -1.26 0.25 119.26 121.57 3dcx h ALA 20 Ca 0.27 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 3dcx h ALA 20 Cb 0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3dcx h ALA 20 CO -0.03 0.53 -0.32 0.37 0.00 0.00 0.00 179.25 179.80 3dcx h GLN 21 N 0.87 0.91 0.03 0.00 -0.00 -1.14 -0.22 115.11 115.57 3dcx h GLN 21 Ca 0.20 -0.44 -0.22 0.00 -0.00 0.00 0.00 58.65 58.20 3dcx h GLN 21 Cb 0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 27.48 27.64 3dcx h GLN 21 CO -0.02 1.09 -1.00 0.93 0.00 0.00 0.00 178.83 179.83 3dcx h GLU 22 N 0.76 0.13 0.00 1.69 5.08 -0.59 -3.28 114.58 118.38 3dcx h GLU 22 Ca 0.08 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3dcx h GLU 22 Cb 0.89 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.21 3dcx h GLU 22 CO 0.08 1.02 -1.00 1.28 -1.00 0.00 0.00 179.01 179.39 3dcx n LEU 23 N -3.51 0.62 -0.33 1.33 4.77 0.81 -4.54 117.00 116.14 3dcx n LEU 23 Ca -0.03 -0.02 0.09 0.00 -0.03 0.00 0.00 56.01 56.01 3dcx n LEU 23 Cb 0.90 -0.10 0.18 0.00 -2.33 0.00 0.00 43.42 42.07 3dcx n LEU 23 CO 0.49 0.05 0.66 0.61 -1.33 0.00 0.00 177.39 177.86 3dcx n GLY 24 N 1.37 -1.45 0.32 -0.72 0.00 -0.09 -0.88 105.19 103.73 3dcx n GLY 24 Ca 0.02 0.96 0.17 0.00 0.00 0.00 0.00 46.02 47.17 3dcx n GLY 24 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dcx h PRO 25 N 0.00 0.00 -2.40 1.61 0.11 -1.82 -3.44 132.00 126.06 3dcx h PRO 25 Ca 0.49 0.00 -0.73 0.00 0.11 0.00 0.00 66.00 65.87 3dcx h PRO 25 Cb 0.85 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 31.63 3dcx h PRO 25 CO -0.93 0.00 0.34 0.44 -0.21 0.00 0.00 178.00 177.64 3dcx n ILE 26 N -3.75 4.67 -4.14 4.15 -6.64 -0.06 -5.15 119.36 108.45 3dcx n ILE 26 Ca -0.01 -5.77 -0.26 0.00 -1.77 0.00 0.00 62.75 54.94 3dcx n ILE 26 Cb 0.21 -1.71 -0.06 0.00 -1.44 0.00 0.00 39.64 36.63 3dcx n ILE 26 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 3dcx s GLY 28 N -2.14 1.71 0.25 3.28 0.00 -1.26 -5.16 107.32 103.99 3dcx s GLY 28 Ca 0.40 -1.30 -0.03 0.00 0.00 0.00 0.00 44.72 43.78 3dcx s GLY 28 CO -0.06 -1.32 1.78 -0.55 0.00 0.00 0.00 173.10 172.96 3dcx h ASP 29 N 2.48 0.57 -0.68 1.64 3.32 -2.01 -2.23 116.42 119.51 3dcx h ASP 29 Ca -0.47 0.07 -0.26 0.00 0.02 0.00 0.00 57.03 56.38 3dcx h ASP 29 Cb 1.20 -0.03 -0.16 0.00 0.22 0.00 0.00 39.33 40.56 3dcx h ASP 29 CO 0.61 0.30 0.28 0.59 -1.72 0.00 0.00 179.24 179.29 3dcx n ASN 30 N -4.82 4.02 -4.85 6.45 3.02 -1.26 -4.99 115.26 112.84 3dcx n ASN 30 Ca 0.14 -3.41 -0.37 0.00 -0.03 0.00 0.00 54.58 50.92 3dcx n ASN 30 Cb 0.34 -0.73 -0.06 0.00 -0.61 0.00 0.00 39.78 38.72 3dcx n ASN 30 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3dcx s GLU 31 N -3.11 3.82 0.05 3.52 2.12 -0.84 -5.02 118.70 119.24 3dcx s GLU 31 Ca 0.52 0.29 0.05 0.00 0.36 0.00 0.00 54.97 56.19 3dcx s GLU 31 Cb 0.43 -3.17 -0.02 0.00 0.26 0.00 0.00 34.13 31.63 3dcx s GLU 31 CO 0.10 0.68 -0.14 -0.65 -0.54 0.00 0.00 175.26 174.71 3dcx s GLN 32 N -1.24 0.86 0.11 4.30 -0.21 -1.26 -4.86 119.66 117.36 3dcx s GLN 32 Ca 0.24 -0.83 -0.26 0.00 0.02 0.00 0.00 55.36 54.54 3dcx s GLN 32 Cb -0.15 -0.86 -0.07 0.00 1.00 0.00 0.00 33.01 32.92 3dcx s GLN 32 CO 0.13 0.20 0.80 -0.51 -2.12 0.00 0.00 175.29 173.79 3dcx s LEU 33 N -1.38 4.52 -0.16 2.90 1.43 -1.26 -0.65 118.68 124.08 3dcx s LEU 33 Ca -0.00 1.59 0.03 0.00 -1.03 0.00 0.00 54.13 54.72 3dcx s LEU 33 Cb -0.09 -3.31 -0.12 0.00 0.03 0.00 0.00 46.19 42.71 3dcx s LEU 33 CO 0.02 0.09 -0.10 0.00 0.23 0.00 0.00 176.35 176.58 3dcx n ALA 34 N 2.26 1.66 -3.63 4.21 0.00 0.80 -4.88 120.51 120.92 3dcx n ALA 34 Ca -0.03 -0.73 -0.10 0.00 0.00 0.00 0.00 53.44 52.58 3dcx n ALA 34 Cb 0.49 0.09 -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 -1.17 0.00 0.00 0.00 177.50 176.33 3dcx s LEU 35 N -5.74 -0.48 -0.13 0.00 2.96 -0.95 -5.02 118.68 109.32 3dcx s LEU 35 Ca -0.19 0.89 -0.12 0.00 -0.22 0.00 0.00 54.13 54.50 3dcx s LEU 35 Cb 0.05 1.95 0.04 0.00 0.50 0.00 0.00 46.19 48.73 3dcx s LEU 35 CO 0.41 -0.18 0.35 0.00 -1.32 0.00 0.00 176.35 175.61 3dcx s ALA 36 N 0.12 -0.87 0.02 5.97 0.00 -1.26 0.48 121.76 126.22 3dcx s ALA 36 Ca 0.02 1.02 0.07 0.00 0.00 0.00 0.00 51.96 53.07 3dcx s ALA 36 Cb -0.05 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.45 3dcx s ALA 36 CO -0.05 -0.17 -0.20 0.71 0.00 0.00 0.00 175.76 176.05 3dcx s TYR 37 N 0.30 1.79 -0.09 0.00 2.02 -0.50 -1.11 117.35 119.77 3dcx s TYR 37 Ca -0.01 -0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 56.31 3dcx s TYR 37 Cb -0.03 -1.10 -0.03 0.00 -0.40 0.00 0.00 41.96 40.40 3dcx s TYR 37 CO -0.01 0.05 -0.02 0.50 -1.57 0.00 0.00 175.55 174.51 3dcx s ARG 38 N -0.93 3.00 -0.30 -0.62 3.52 0.12 -0.93 118.95 122.82 3dcx s ARG 38 Ca 0.07 -0.44 0.02 0.00 -0.13 0.00 0.00 55.73 55.25 3dcx s ARG 38 Cb -0.08 -2.77 0.09 0.00 -1.56 0.00 0.00 34.95 30.63 3dcx s ARG 38 CO 0.01 0.65 0.02 0.08 -0.81 0.00 0.00 175.30 175.26 3dcx s VAL 39 N -0.75 1.65 0.00 7.11 1.01 0.06 -1.28 120.40 128.20 3dcx s VAL 39 Ca 0.12 -1.71 0.00 0.00 0.00 0.00 0.00 61.98 60.39 3dcx s VAL 39 Cb -0.11 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.15 3dcx s VAL 39 CO 0.02 -0.44 0.00 -0.38 0.00 0.00 0.00 175.10 174.30 3dcx n ILE 40 N 4.55 0.00 0.45 2.22 5.41 -1.26 -1.56 119.36 129.18 3dcx n ILE 40 Ca -0.03 0.00 0.10 0.00 1.00 0.00 0.00 62.75 63.82 3dcx n ILE 40 Cb 0.43 0.00 -0.15 0.00 -0.71 0.00 0.00 39.64 39.21 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 0.38 -0.46 0.38 1.74 -1.26 -5.13 116.66 112.31 3dcx n ARG 41 Ca 0.00 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 3dcx n ARG 41 Cb 0.00 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 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 -1.90 0.00 -3.19 0.55 8.00 -0.60 -4.69 116.55 114.71 3dcx n ASP 42 Ca -0.00 -0.94 0.04 0.00 0.71 0.00 0.00 54.79 54.59 3dcx n ASP 42 Cb 0.46 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.54 3dcx n ASP 42 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3dcx s PHE 44 N 0.03 -1.14 -0.15 1.24 2.19 -0.10 -0.76 117.98 119.29 3dcx s PHE 44 Ca 0.00 1.29 -0.01 0.00 0.33 0.00 0.00 56.93 58.54 3dcx s PHE 44 Cb 0.00 0.43 -0.01 0.00 -1.31 0.00 0.00 43.02 42.13 3dcx s PHE 44 CO 0.00 -0.62 -0.12 0.08 1.83 0.00 0.00 175.22 176.39 3dcx s VAL 45 N 2.87 3.02 -0.32 3.12 1.01 0.04 -1.40 120.40 128.74 3dcx s VAL 45 Ca 0.10 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.30 3dcx s VAL 45 Cb -0.13 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.95 3dcx s VAL 45 CO -0.17 0.51 0.21 -0.36 0.00 0.00 0.00 175.10 175.29 3dcx s PHE 46 N 0.58 3.21 0.42 5.22 0.40 0.18 -1.02 117.98 126.97 3dcx s PHE 46 Ca -0.08 -0.21 0.07 0.00 -0.60 0.00 0.00 56.93 56.11 3dcx s PHE 46 Cb -0.16 -2.42 0.07 0.00 0.51 0.00 0.00 43.02 41.02 3dcx s PHE 46 CO 0.03 -0.33 0.57 0.25 0.70 0.00 0.00 175.22 176.44 3dcx n THR 47 N 5.06 0.00 1.68 0.64 -2.24 -0.20 -0.14 114.28 119.08 3dcx n THR 47 Ca -0.13 -1.44 0.15 0.00 -2.27 0.00 0.00 64.05 60.36 3dcx n THR 47 Cb 0.50 -0.60 0.83 0.00 -2.10 0.00 0.00 70.33 68.95 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 -2.46 0.00 0.00 3.42 6.94 0.17 -4.17 115.26 119.17 3dcx n ASN 48 Ca 0.11 -0.63 0.00 0.00 -0.02 0.00 0.00 54.58 54.04 3dcx n ASN 48 Cb 0.44 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.76 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 -1.11 2.12 -3.69 -3.83 4.76 -1.26 -4.97 118.16 110.18 3dcx n LYS 49 Ca 0.19 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.56 3dcx n LYS 49 Cb 0.15 -0.91 -0.02 0.00 -1.84 0.00 0.00 35.03 32.41 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 -1.74 1.35 0.04 1.97 1.70 -1.26 -2.76 118.95 118.26 3dcx s ARG 50 Ca 0.00 -0.68 -0.15 0.00 -0.47 0.00 0.00 55.73 54.43 3dcx s ARG 50 Cb 0.00 0.51 -0.06 0.00 -0.57 0.00 0.00 34.95 34.83 3dcx s ARG 50 CO 0.00 -0.61 0.45 -0.51 -1.08 0.00 0.00 175.30 173.55 3dcx s LEU 51 N -2.83 4.45 -0.22 -1.89 1.43 0.90 -1.03 118.68 119.49 3dcx s LEU 51 Ca 0.09 1.01 -0.03 0.00 -1.03 0.00 0.00 54.13 54.16 3dcx s LEU 51 Cb -0.03 -2.78 -0.00 0.00 0.03 0.00 0.00 46.19 43.41 3dcx s LEU 51 CO -0.01 0.27 -0.05 -0.63 0.23 0.00 0.00 176.35 176.16 3dcx s ILE 52 N -1.17 3.28 -0.32 -0.59 1.01 -0.19 0.19 121.20 123.41 3dcx s ILE 52 Ca 0.28 -0.55 -0.08 0.00 0.00 0.00 0.00 60.65 60.30 3dcx s ILE 52 Cb -0.17 -2.50 0.01 0.00 0.01 0.00 0.00 42.46 39.82 3dcx s ILE 52 CO 0.16 0.41 0.12 -0.76 0.00 0.00 0.00 174.94 174.87 3dcx s LEU 53 N 1.46 4.13 -0.42 2.97 1.43 0.49 -0.78 118.68 127.97 3dcx s LEU 53 Ca 0.05 -0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 52.25 3dcx s LEU 53 Cb -0.14 -1.93 0.06 0.00 0.03 0.00 0.00 46.19 44.21 3dcx s LEU 53 CO -0.04 -0.25 0.29 -0.63 0.23 0.00 0.00 176.35 175.95 3dcx s ILE 54 N 1.52 4.65 -0.14 -0.59 1.01 -1.26 -1.10 121.20 125.29 3dcx s ILE 54 Ca 0.02 -1.13 -0.02 0.00 0.00 0.00 0.00 60.65 59.52 3dcx s ILE 54 Cb -0.18 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 3dcx s ILE 54 CO 0.04 -0.45 -0.09 -0.62 0.00 0.00 0.00 174.94 173.82 3dcx s ASP 55 N 2.09 4.37 -0.05 3.58 2.15 -0.81 -4.38 116.67 123.61 3dcx s ASP 55 Ca 0.03 -0.23 0.03 0.00 0.43 0.00 0.00 52.55 52.82 3dcx s ASP 55 Cb -0.22 -1.65 -0.03 0.00 -0.30 0.00 0.00 42.92 40.72 3dcx s ASP 55 CO 0.05 0.18 -0.14 -0.54 -0.17 0.00 0.00 175.17 174.55 3dcx s LYS 56 N 0.28 2.51 0.17 4.34 1.02 -1.26 -1.06 119.74 125.74 3dcx s LYS 56 Ca -0.07 -0.69 0.05 0.00 0.02 0.00 0.00 55.97 55.29 3dcx s LYS 56 Cb -0.15 -2.39 -0.05 0.00 -0.52 0.00 0.00 37.83 34.73 3dcx s LYS 56 CO 0.04 0.63 -0.11 -0.65 -0.92 0.00 0.00 175.35 174.34 3dcx s GLN 57 N -0.75 1.16 0.00 1.68 -0.21 0.61 -4.93 119.66 117.22 3dcx s GLN 57 Ca 0.12 -1.51 0.00 0.00 0.02 0.00 0.00 55.36 53.99 3dcx s GLN 57 Cb -0.11 -0.78 0.00 0.00 1.00 0.00 0.00 33.01 33.12 3dcx s GLN 57 CO 0.01 0.10 0.00 0.41 -2.12 0.00 0.00 175.29 173.69 3dcx n GLY 58 N -0.27 1.24 0.28 3.09 0.00 -1.26 -2.79 105.19 105.48 3dcx n GLY 58 Ca -0.09 -1.90 -0.04 0.00 0.00 0.00 0.00 46.02 43.99 3dcx n GLY 58 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3dcx h VAL 59 N 0.00 1.13 -0.01 1.61 2.07 -2.02 -2.90 116.25 116.14 3dcx h VAL 59 Ca 0.00 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.20 3dcx h VAL 59 Cb 0.00 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.89 3dcx h VAL 59 CO 0.00 0.17 -0.33 0.35 0.02 0.00 0.00 177.57 177.78 3dcx n THR 60 N -4.62 0.00 -2.31 2.57 -2.24 -1.26 -4.95 114.28 101.47 3dcx n THR 60 Ca 0.08 -0.15 -0.11 0.00 -2.27 0.00 0.00 64.05 61.60 3dcx n THR 60 Cb 0.06 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 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 1.37 -0.07 0.02 3.38 0.00 -1.10 -4.92 105.19 103.88 3dcx n GLY 61 Ca 0.11 -0.39 0.11 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.17 0.22 -2.74 1.61 4.76 -1.19 -4.61 118.16 114.03 3dcx n LYS 62 Ca -0.12 -0.02 -0.42 0.00 -2.87 0.00 0.00 58.31 54.88 3dcx n LYS 62 Cb 0.59 -1.55 -0.04 0.00 -1.84 0.00 0.00 35.03 32.20 3dcx n LYS 62 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3dcx s LYS 63 N -3.15 3.22 -0.07 1.97 1.02 -1.12 -4.97 119.74 116.63 3dcx s LYS 63 Ca 0.04 -0.43 0.05 0.00 0.02 0.00 0.00 55.97 55.65 3dcx s LYS 63 Cb 0.15 -4.16 -0.00 0.00 -0.52 0.00 0.00 37.83 33.30 3dcx s LYS 63 CO 0.82 -1.83 -0.22 0.08 -0.92 0.00 0.00 175.35 173.28 3dcx s VAL 64 N 4.61 1.86 0.01 3.17 1.01 -1.26 -0.29 120.40 129.52 3dcx s VAL 64 Ca 0.30 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.41 3dcx s VAL 64 Cb -0.12 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 3dcx s VAL 64 CO 0.15 0.52 -0.22 -0.94 0.00 0.00 0.00 175.10 174.61 3dcx s SER 65 N 0.11 3.43 -0.32 3.32 1.04 -0.23 -4.99 113.70 116.06 3dcx s SER 65 Ca -0.10 -0.45 -0.01 0.00 0.48 0.00 0.00 55.95 55.87 3dcx s SER 65 Cb -0.15 -0.47 0.06 0.00 0.10 0.00 0.00 66.02 65.56 3dcx s SER 65 CO 0.05 0.29 0.03 -0.31 0.98 0.00 0.00 173.24 174.28 3dcx s TYR 66 N -0.76 3.36 -0.34 5.02 1.51 -1.26 -1.93 117.35 122.95 3dcx s TYR 66 Ca 0.12 -2.08 -0.12 0.00 -1.01 0.00 0.00 57.07 53.97 3dcx s TYR 66 Cb -0.10 -2.34 -0.01 0.00 -0.11 0.00 0.00 41.96 39.40 3dcx s TYR 66 CO 0.02 -0.85 0.22 -1.58 -1.11 0.00 0.00 175.55 172.25 3dcx s HIS 67 N 1.20 3.22 -0.21 2.71 2.46 -0.26 -4.93 115.29 119.47 3dcx s HIS 67 Ca -0.02 -0.40 -0.18 0.00 0.47 0.00 0.00 55.06 54.93 3dcx s HIS 67 Cb -0.20 -2.45 -0.03 0.00 -0.13 0.00 0.00 32.58 29.77 3dcx s HIS 67 CO -0.02 -0.43 0.52 -1.12 -2.47 0.00 0.00 174.74 171.22 3dcx s SER 68 N 1.68 6.55 -0.44 9.88 0.01 -1.26 -0.38 113.70 129.74 3dcx s SER 68 Ca 0.05 0.66 0.00 0.00 1.31 0.00 0.00 55.95 57.97 3dcx s SER 68 Cb -0.18 -2.29 0.12 0.00 0.21 0.00 0.00 66.02 63.88 3dcx s SER 68 CO 0.09 -0.20 0.20 -0.69 0.41 0.00 0.00 173.24 173.05 3dcx s VAL 69 N 1.75 2.93 0.56 3.43 1.01 0.13 -4.97 120.40 125.25 3dcx s VAL 69 Ca 0.24 -2.46 -0.21 0.00 0.00 0.00 0.00 61.98 59.54 3dcx s VAL 69 Cb -0.15 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 3dcx s VAL 69 CO 0.09 -0.71 1.35 -2.84 0.00 0.00 0.00 175.10 173.00 3dcx s PRO 70 N 0.68 3.04 0.46 2.72 0.02 -1.26 -0.07 135.00 140.58 3dcx s PRO 70 Ca 0.12 2.22 0.13 0.00 0.02 0.00 0.00 61.00 63.48 3dcx s PRO 70 Cb -0.22 -2.19 1.03 0.00 0.02 0.00 0.00 34.50 33.14 3dcx s PRO 70 CO -0.05 -1.26 2.05 1.88 -0.33 0.00 0.00 177.00 179.29 3dcx h TYR 71 N 1.31 0.15 0.00 6.54 0.05 -1.83 -1.46 116.97 121.73 3dcx h TYR 71 Ca -0.51 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.27 3dcx h TYR 71 Cb 1.31 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.00 3dcx h TYR 71 CO 0.45 0.18 0.00 0.36 -1.05 0.00 0.00 178.16 178.10 3dcx n LYS 72 N -4.43 0.15 0.04 4.88 2.85 -1.26 -1.44 118.16 118.95 3dcx n LYS 72 Ca -0.01 0.45 0.12 0.00 -1.05 0.00 0.00 58.31 57.82 3dcx n LYS 72 Cb 0.15 -1.82 0.27 0.00 -0.65 0.00 0.00 35.03 32.98 3dcx n LYS 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3dcx n ALA 73 N -1.72 2.96 -2.67 0.58 0.00 -0.55 -4.71 120.51 114.40 3dcx n ALA 73 Ca 0.01 -0.24 -0.42 0.00 0.00 0.00 0.00 53.44 52.79 3dcx n ALA 73 Cb 0.17 -1.22 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 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 -3.09 4.14 -0.07 0.00 1.01 -0.52 -0.78 121.20 121.89 3dcx s ILE 74 Ca 0.09 0.26 0.13 0.00 0.00 0.00 0.00 60.65 61.13 3dcx s ILE 74 Cb 0.15 -4.71 -0.07 0.00 0.01 0.00 0.00 42.46 37.84 3dcx s ILE 74 CO 0.68 -1.43 1.20 0.71 0.00 0.00 0.00 174.94 176.10 3dcx h THR 75 N 6.04 0.99 -2.30 2.92 1.35 -1.57 -3.47 112.91 116.87 3dcx h THR 75 Ca -0.27 -2.51 0.15 0.00 -0.55 0.00 0.00 66.41 63.22 3dcx h THR 75 Cb 1.06 2.44 -0.12 0.00 -1.73 0.00 0.00 68.15 69.81 3dcx h THR 75 CO 1.18 0.57 0.49 -1.38 -0.25 0.00 0.00 175.52 176.13 3dcx s HIS 76 N -2.86 -0.24 0.15 4.73 0.00 -1.25 -5.05 115.29 110.77 3dcx s HIS 76 Ca 0.01 0.02 -0.18 0.00 -3.00 0.00 0.00 55.06 51.91 3dcx s HIS 76 Cb 0.08 0.59 0.04 0.00 -4.00 0.00 0.00 32.58 29.29 3dcx s HIS 76 CO 0.79 -0.68 0.48 -0.59 -1.00 0.00 0.00 174.74 173.74 3dcx s PHE 77 N -3.19 -0.25 -0.07 0.38 -0.71 -1.26 -1.34 117.98 111.55 3dcx s PHE 77 Ca 0.09 -0.05 -0.07 0.00 -1.04 0.00 0.00 56.93 55.85 3dcx s PHE 77 Cb -0.01 0.36 0.02 0.00 -1.21 0.00 0.00 43.02 42.18 3dcx s PHE 77 CO -0.04 -0.80 0.20 -2.00 -1.34 0.00 0.00 175.22 171.24 3dcx s GLU 78 N -3.81 0.27 -0.08 1.99 2.12 -0.28 -4.99 118.70 113.91 3dcx s GLU 78 Ca 0.04 0.20 0.04 0.00 0.36 0.00 0.00 54.97 55.62 3dcx s GLU 78 Cb 0.00 0.13 -0.01 0.00 0.26 0.00 0.00 34.13 34.51 3dcx s GLU 78 CO -0.09 -0.04 -0.22 0.08 -0.54 0.00 0.00 175.26 174.45 3dcx s VAL 79 N -0.08 2.31 -0.13 3.70 1.01 -1.26 -0.62 120.40 125.33 3dcx s VAL 79 Ca -0.02 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.03 3dcx s VAL 79 Cb -0.02 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.49 3dcx s VAL 79 CO 0.01 0.56 -0.20 -0.70 0.00 0.00 0.00 175.10 174.77 3dcx s GLU 80 N -0.01 2.78 0.57 2.72 2.12 -0.46 -4.97 118.70 121.45 3dcx s GLU 80 Ca -0.07 -0.77 -0.17 0.00 0.36 0.00 0.00 54.97 54.32 3dcx s GLU 80 Cb -0.15 -2.26 -0.05 0.00 0.26 0.00 0.00 34.13 31.93 3dcx s GLU 80 CO 0.05 -0.02 1.06 0.95 -0.54 0.00 0.00 175.26 176.76 3dcx s THR 81 N 0.84 3.72 0.38 -1.70 -4.23 -1.26 -0.55 115.64 112.84 3dcx s THR 81 Ca -0.07 0.89 -0.27 0.00 -1.18 0.00 0.00 61.69 61.06 3dcx s THR 81 Cb -0.15 -3.37 -0.09 0.00 1.34 0.00 0.00 72.50 70.22 3dcx s THR 81 CO -0.01 -0.41 1.27 0.00 -0.54 0.00 0.00 174.62 174.93 3dcx s ALA 82 N -2.28 3.30 0.20 3.99 0.00 -1.26 -4.79 121.76 120.91 3dcx s ALA 82 Ca 0.65 1.17 0.08 0.00 0.00 0.00 0.00 51.96 53.87 3dcx s ALA 82 Cb -0.17 -3.46 0.08 0.00 0.00 0.00 0.00 23.12 19.58 3dcx s ALA 82 CO 0.32 -0.70 1.45 0.78 0.00 0.00 0.00 175.76 177.62 3dcx h GLY 83 N 2.88 0.02 -2.50 0.00 0.00 -1.95 -3.48 103.07 98.05 3dcx h GLY 83 Ca -0.49 -0.03 -0.32 0.00 0.00 0.00 0.00 47.33 46.49 3dcx h GLY 83 CO 0.63 0.03 -0.64 -0.51 0.00 0.00 0.00 176.54 176.05 3dcx s THR 84 N -3.19 0.58 0.47 4.70 -4.23 -1.26 -5.04 115.64 107.67 3dcx s THR 84 Ca -0.00 -1.99 0.15 0.00 -1.18 0.00 0.00 61.69 58.66 3dcx s THR 84 Cb 0.11 -2.41 0.21 0.00 1.34 0.00 0.00 72.50 71.75 3dcx s THR 84 CO 0.79 -0.20 2.03 0.15 -0.54 0.00 0.00 174.62 176.86 3dcx h PHE 85 N 2.53 0.00 0.00 3.99 3.57 -2.05 -3.43 116.94 121.55 3dcx h PHE 85 Ca -0.37 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.13 3dcx h PHE 85 Cb 1.23 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.97 3dcx h PHE 85 CO 0.48 0.13 0.00 -0.25 -2.23 0.00 0.00 178.31 176.45 3dcx n ASP 86 N -4.37 1.42 -3.91 0.41 8.00 -1.26 -5.12 116.55 111.72 3dcx n ASP 86 Ca -0.03 -1.12 -0.10 0.00 0.71 0.00 0.00 54.79 54.26 3dcx n ASP 86 Cb 0.20 -0.28 -0.09 0.00 -0.02 0.00 0.00 41.12 40.93 3dcx n ASP 86 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3dcx s ASP 88 N 0.67 0.14 0.71 -2.24 1.01 -1.26 -4.63 116.67 111.07 3dcx s ASP 88 Ca 0.00 -0.48 -0.14 0.00 0.71 0.00 0.00 52.55 52.64 3dcx s ASP 88 Cb 0.00 0.23 0.03 0.00 1.01 0.00 0.00 42.92 44.19 3dcx s ASP 88 CO 0.00 -0.50 1.15 0.00 0.21 0.00 0.00 175.17 176.03 3dcx s ALA 89 N -2.48 2.26 -0.07 5.23 0.00 -1.26 -4.24 121.76 121.19 3dcx s ALA 89 Ca -0.06 0.67 0.05 0.00 0.00 0.00 0.00 51.96 52.62 3dcx s ALA 89 Cb -0.02 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.71 3dcx s ALA 89 CO -0.04 -1.63 -0.24 -2.00 0.00 0.00 0.00 175.76 171.86 3dcx s GLU 90 N -4.10 2.73 -0.20 0.00 2.12 0.28 -0.52 118.70 119.02 3dcx s GLU 90 Ca 0.69 -0.88 -0.06 0.00 0.36 0.00 0.00 54.97 55.09 3dcx s GLU 90 Cb -0.24 -2.24 -0.03 0.00 0.26 0.00 0.00 34.13 31.88 3dcx s GLU 90 CO 0.45 0.33 0.03 -1.17 -0.54 0.00 0.00 175.26 174.35 3dcx s LEU 91 N -0.02 3.43 -0.17 2.70 2.96 0.34 -1.36 118.68 126.56 3dcx s LEU 91 Ca -0.07 -0.12 -0.04 0.00 -0.22 0.00 0.00 54.13 53.68 3dcx s LEU 91 Cb -0.15 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.64 3dcx s LEU 91 CO 0.05 0.08 -0.04 -0.54 -1.32 0.00 0.00 176.35 174.58 3dcx s LYS 92 N 0.90 3.60 -0.16 1.98 1.02 0.21 -0.38 119.74 126.90 3dcx s LYS 92 Ca 0.02 -0.55 0.01 0.00 0.02 0.00 0.00 55.97 55.48 3dcx s LYS 92 Cb -0.14 -2.92 0.02 0.00 -0.52 0.00 0.00 37.83 34.26 3dcx s LYS 92 CO 0.02 0.15 -0.20 -0.51 -0.92 0.00 0.00 175.35 173.89 3dcx s LEU 93 N 0.59 2.14 -0.19 3.17 1.43 -0.05 -1.13 118.68 124.64 3dcx s LEU 93 Ca -0.03 -0.63 -0.17 0.00 -1.03 0.00 0.00 54.13 52.28 3dcx s LEU 93 Cb -0.14 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 3dcx s LEU 93 CO 0.03 0.03 0.43 0.26 0.23 0.00 0.00 176.35 177.32 3dcx s TRP 94 N 1.10 3.39 -0.17 0.29 0.51 -0.45 -0.88 118.94 122.74 3dcx s TRP 94 Ca 0.00 0.67 -0.06 0.00 -2.12 0.00 0.00 56.10 54.59 3dcx s TRP 94 Cb -0.14 -2.55 -0.04 0.00 -0.81 0.00 0.00 33.47 29.93 3dcx s TRP 94 CO -0.08 -0.00 0.03 0.42 -0.51 0.00 0.00 176.95 176.81 3dcx s ILE 95 N 1.28 4.54 -0.18 2.03 1.01 -1.26 -1.55 121.20 127.07 3dcx s ILE 95 Ca 0.21 -0.12 -0.41 0.00 0.00 0.00 0.00 60.65 60.33 3dcx s ILE 95 Cb -0.15 -3.03 -0.17 0.00 0.01 0.00 0.00 42.46 39.12 3dcx s ILE 95 CO 0.08 0.48 1.51 -0.24 0.00 0.00 0.00 174.94 176.77 3dcx n SER 96 N 3.45 1.60 0.00 3.58 2.88 0.04 -0.93 113.62 124.24 3dcx n SER 96 Ca -0.17 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 3dcx n SER 96 Cb 0.52 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 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 3.30 1.69 3.39 0.46 0.00 -1.26 -5.02 105.19 107.75 3dcx n GLY 97 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 3dcx n GLY 97 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dcx s GLN 98 N -0.45 3.37 0.11 1.61 0.74 -0.10 -5.01 119.66 119.93 3dcx s GLN 98 Ca 0.00 -0.67 -0.14 0.00 0.05 0.00 0.00 55.36 54.60 3dcx s GLN 98 Cb 0.00 -3.35 -0.06 0.00 1.10 0.00 0.00 33.01 30.71 3dcx s GLN 98 CO 0.00 -0.32 1.48 -0.22 -0.55 0.00 0.00 175.29 175.68 3dcx h LYS 99 N 8.24 0.74 -6.13 1.67 3.64 -1.95 -3.40 116.57 119.38 3dcx h LYS 99 Ca -0.35 -0.34 -0.59 0.00 -1.27 0.00 0.00 60.65 58.10 3dcx h LYS 99 Cb 1.15 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.91 3dcx h LYS 99 CO 0.60 0.95 -0.13 -0.51 -2.27 0.00 0.00 179.45 178.09 3dcx s ASP 100 N -6.47 6.90 0.55 4.20 1.01 -1.26 -5.03 116.67 116.57 3dcx s ASP 100 Ca -0.12 1.08 -0.18 0.00 0.71 0.00 0.00 52.55 54.04 3dcx s ASP 100 Cb 0.09 -2.29 -0.05 0.00 1.01 0.00 0.00 42.92 41.68 3dcx s ASP 100 CO 0.82 0.28 1.06 -2.16 0.21 0.00 0.00 175.17 175.38 3dcx s PRO 101 N -1.23 3.48 -0.17 8.23 0.04 -1.26 -4.77 135.00 139.32 3dcx s PRO 101 Ca 0.28 1.31 -0.29 0.00 0.04 0.00 0.00 61.00 62.33 3dcx s PRO 101 Cb -0.17 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.30 3dcx s PRO 101 CO 0.16 -0.69 1.27 -1.17 0.04 0.00 0.00 177.00 176.61 3dcx s LEU 102 N -4.08 4.17 -0.20 -3.56 2.96 -0.06 -4.85 118.68 113.07 3dcx s LEU 102 Ca 0.66 1.68 -0.04 0.00 -0.22 0.00 0.00 54.13 56.20 3dcx s LEU 102 Cb -0.17 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.96 3dcx s LEU 102 CO 0.30 -0.78 -0.02 -0.69 -1.32 0.00 0.00 176.35 173.84 3dcx s VAL 103 N 3.54 3.75 -0.04 1.68 1.01 -1.26 -0.87 120.40 128.21 3dcx s VAL 103 Ca 0.55 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.17 3dcx s VAL 103 Cb -0.22 -2.69 0.01 0.00 0.00 0.00 0.00 36.38 33.49 3dcx s VAL 103 CO 0.15 0.44 -0.11 -0.54 0.00 0.00 0.00 175.10 175.04 3dcx s LYS 104 N 1.00 1.36 0.05 2.72 -0.14 0.49 -4.99 119.74 120.22 3dcx s LYS 104 Ca 0.01 -0.38 -0.30 0.00 -1.36 0.00 0.00 55.97 53.94 3dcx s LYS 104 Cb -0.14 -1.19 -0.05 0.00 -1.68 0.00 0.00 37.83 34.76 3dcx s LYS 104 CO 0.01 0.09 1.17 -1.21 -0.76 0.00 0.00 175.35 174.65 3dcx s GLU 105 N 0.40 4.44 -1.25 1.68 2.02 -1.26 -0.51 118.70 124.23 3dcx s GLU 105 Ca -0.08 1.72 -0.16 0.00 0.02 0.00 0.00 54.97 56.47 3dcx s GLU 105 Cb -0.12 -3.37 0.12 0.00 0.10 0.00 0.00 34.13 30.86 3dcx s GLU 105 CO 0.02 -0.24 1.57 -0.51 0.02 0.00 0.00 175.26 176.12 3dcx s LEU 106 N 1.11 4.49 0.69 1.80 1.43 0.32 -4.93 118.68 123.59 3dcx s LEU 106 Ca 0.58 -2.73 -0.16 0.00 -1.03 0.00 0.00 54.13 50.79 3dcx s LEU 106 Cb -0.28 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.47 3dcx s LEU 106 CO 0.29 -0.95 1.19 -0.54 0.23 0.00 0.00 176.35 176.57 3dcx s LYS 107 N 2.80 2.46 0.21 1.70 1.02 -1.26 -4.16 119.74 122.50 3dcx s LYS 107 Ca 0.48 1.70 -0.32 0.00 0.02 0.00 0.00 55.97 57.85 3dcx s LYS 107 Cb 0.00 -1.88 -0.14 0.00 -0.52 0.00 0.00 37.83 35.30 3dcx s LYS 107 CO 0.03 -1.58 1.45 1.63 -0.92 0.00 0.00 175.35 175.97 3dcx n LYS 108 N -2.40 2.01 0.00 1.68 5.02 -1.26 -1.13 118.16 122.07 3dcx n LYS 108 Ca 0.13 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 57.14 3dcx n LYS 108 Cb 0.50 -2.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.11 3dcx n LYS 108 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dcx n GLY 109 N 2.58 2.28 3.86 0.72 0.00 -1.26 -2.06 105.19 111.31 3dcx n GLY 109 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 3dcx n GLY 109 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dcx s THR 110 N -2.53 4.79 -0.98 2.61 -4.23 -0.29 -4.77 115.64 110.25 3dcx s THR 110 Ca 0.00 0.70 -0.22 0.00 -1.18 0.00 0.00 61.69 61.00 3dcx s THR 110 Cb 0.00 -3.63 0.08 0.00 1.34 0.00 0.00 72.50 70.29 3dcx s THR 110 CO 0.00 -0.19 1.33 -0.62 -0.54 0.00 0.00 174.62 174.60 3dcx s ASP 111 N -2.45 6.54 0.16 3.99 -1.08 -1.26 -4.88 116.67 117.69 3dcx s ASP 111 Ca 0.51 -1.64 -0.15 0.00 -0.52 0.00 0.00 52.55 50.74 3dcx s ASP 111 Cb -0.11 -2.51 0.03 0.00 -1.46 0.00 0.00 42.92 38.88 3dcx s ASP 111 CO 0.21 -1.36 1.80 0.58 0.52 0.00 0.00 175.17 176.93 3dcx h VAL 112 N 6.45 1.13 -0.48 1.11 2.07 -1.94 0.26 116.25 124.85 3dcx h VAL 112 Ca 0.18 -0.28 -0.13 0.00 0.82 0.00 0.00 66.70 67.29 3dcx h VAL 112 Cb 1.02 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3dcx h VAL 112 CO 1.31 0.13 -0.20 0.58 0.02 0.00 0.00 177.57 179.41 3dcx h VAL 113 N 0.61 1.27 -0.47 2.57 2.07 -2.00 -2.67 116.25 117.64 3dcx h VAL 113 Ca 0.16 -1.36 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 3dcx h VAL 113 Cb -0.03 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3dcx h VAL 113 CO -0.03 0.47 -0.07 1.23 0.02 0.00 0.00 177.57 179.19 3dcx h GLY 114 N 0.90 0.94 0.14 2.17 0.00 -1.82 0.45 103.07 105.86 3dcx h GLY 114 Ca 0.11 -0.75 0.07 0.00 0.00 0.00 0.00 47.33 46.77 3dcx h GLY 114 CO 0.06 0.68 -0.18 -2.22 0.00 0.00 0.00 176.54 174.89 3dcx h ILE 115 N 0.71 0.48 -0.44 2.60 2.04 -0.53 0.13 117.51 122.51 3dcx h ILE 115 Ca 0.12 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.90 3dcx h ILE 115 Cb 0.60 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3dcx h ILE 115 CO 0.04 0.00 -0.08 1.56 0.00 0.00 0.00 178.15 179.66 3dcx h GLN 116 N -0.13 0.77 -0.46 2.37 4.20 -1.09 -1.87 115.11 118.91 3dcx h GLN 116 Ca 0.17 -0.24 -0.10 0.00 0.06 0.00 0.00 58.65 58.55 3dcx h GLN 116 Cb 0.39 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3dcx h GLN 116 CO -0.42 0.83 -0.09 -0.22 -0.67 0.00 0.00 178.83 178.27 3dcx h LYS 117 N 0.70 0.86 -0.55 1.46 3.64 -0.51 -1.43 116.57 120.75 3dcx h LYS 117 Ca 0.12 -0.32 -0.00 0.00 -1.27 0.00 0.00 60.65 59.18 3dcx h LYS 117 Cb 0.55 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.29 3dcx h LYS 117 CO 0.03 0.96 0.34 1.15 -2.27 0.00 0.00 179.45 179.66 3dcx h THR 118 N 0.70 1.16 -0.72 1.00 2.02 -0.50 0.38 112.91 116.96 3dcx h THR 118 Ca 0.12 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 3dcx h THR 118 Cb 0.63 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 3dcx h THR 118 CO 0.04 0.16 0.28 0.40 0.37 0.00 0.00 175.52 176.78 3dcx h ILE 119 N 0.74 1.25 -0.31 3.11 2.04 -1.22 -0.95 117.51 122.16 3dcx h ILE 119 Ca 0.20 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.22 3dcx h ILE 119 Cb -0.03 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 3dcx h ILE 119 CO -0.04 0.32 0.01 0.00 0.00 0.00 0.00 178.15 178.44 3dcx h ALA 120 N 1.13 0.42 -0.98 1.87 0.00 -0.90 0.29 119.26 121.09 3dcx h ALA 120 Ca 0.24 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 55.00 3dcx h ALA 120 Cb 0.22 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 3dcx h ALA 120 CO -0.02 0.16 0.63 -0.91 0.00 0.00 0.00 179.25 179.10 3dcx h ASN 121 N 0.35 0.98 0.00 0.00 2.35 0.10 -2.98 115.58 116.39 3dcx h ASN 121 Ca 0.09 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 3dcx h ASN 121 Cb 0.42 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.60 3dcx h ASN 121 CO 0.01 0.61 -1.77 0.49 -1.65 0.00 0.00 177.43 175.12 3dcx n PHE 122 N -4.54 0.00 0.60 1.19 3.72 -0.39 -4.59 117.46 113.45 3dcx n PHE 122 Ca 0.16 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.62 3dcx n PHE 122 Cb 0.21 -0.39 -0.04 0.00 -0.94 0.00 0.00 39.48 38.32 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 -2.09 1.01 -0.63 4.37 3.41 1.00 -4.76 113.62 115.92 3dcx n SER 123 Ca -0.02 -1.00 0.08 0.00 -0.26 0.00 0.00 58.87 57.66 3dcx n SER 123 Cb 0.50 0.75 0.07 0.00 -0.26 0.00 0.00 64.21 65.26 3dcx n SER 123 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06