#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d21 n ASN 25 N 0.00 2.88 -4.60 1.61 4.13 -1.26 -4.78 115.26 113.24 3d21 n ASN 25 Ca 0.00 -1.91 -0.36 0.00 1.68 0.00 0.00 54.58 53.99 3d21 n ASN 25 Cb 0.00 -0.14 -0.10 0.00 -1.54 0.00 0.00 39.78 37.99 3d21 n ASN 25 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3d21 s VAL 26 N -1.71 4.99 -0.19 2.41 1.01 -1.26 -4.17 120.40 121.47 3d21 s VAL 26 Ca 0.35 0.05 -0.07 0.00 0.00 0.00 0.00 61.98 62.31 3d21 s VAL 26 Cb 0.21 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 3d21 s VAL 26 CO 0.30 0.36 0.05 -1.00 0.00 0.00 0.00 175.10 174.81 3d21 s HIS 27 N 1.12 3.18 -0.16 5.22 3.76 -0.46 -4.98 115.29 122.96 3d21 s HIS 27 Ca 0.06 -0.08 -0.22 0.00 -0.15 0.00 0.00 55.06 54.67 3d21 s HIS 27 Cb -0.14 -2.10 -0.03 0.00 1.11 0.00 0.00 32.58 31.43 3d21 s HIS 27 CO 0.04 0.02 0.66 -1.17 -0.85 0.00 0.00 174.74 173.45 3d21 s LEU 28 N 0.63 4.19 -0.21 0.89 2.96 -1.26 -0.58 118.68 125.30 3d21 s LEU 28 Ca 0.02 0.95 -0.07 0.00 -0.22 0.00 0.00 54.13 54.81 3d21 s LEU 28 Cb -0.13 -2.96 -0.04 0.00 0.50 0.00 0.00 46.19 43.56 3d21 s LEU 28 CO 0.02 -0.24 0.07 -0.63 -1.32 0.00 0.00 176.35 174.24 3d21 s ILE 29 N 1.65 4.58 0.00 6.68 -1.09 -0.23 -4.93 121.20 127.86 3d21 s ILE 29 Ca 0.32 -0.10 0.00 0.00 -2.23 0.00 0.00 60.65 58.64 3d21 s ILE 29 Cb -0.16 -3.10 0.00 0.00 -1.58 0.00 0.00 42.46 37.62 3d21 s ILE 29 CO 0.12 0.40 0.00 0.35 -1.23 0.00 0.00 174.94 174.58 3d21 n THR 30 N 4.15 0.00 -4.47 2.92 -2.24 -1.26 -2.85 114.28 110.53 3d21 n THR 30 Ca -0.16 -0.06 -0.21 0.00 -2.27 0.00 0.00 64.05 61.35 3d21 n THR 30 Cb 0.52 0.49 -0.14 0.00 -2.10 0.00 0.00 70.33 69.10 3d21 n THR 30 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3d21 s THR 31 N -1.43 1.02 0.37 4.28 -1.32 -1.26 -4.62 115.64 112.68 3d21 s THR 31 Ca 0.00 -0.71 0.14 0.00 -1.21 0.00 0.00 61.69 59.91 3d21 s THR 31 Cb 0.00 -0.88 0.36 0.00 -1.51 0.00 0.00 72.50 70.47 3d21 s THR 31 CO 0.00 0.16 1.79 0.50 -2.21 0.00 0.00 174.62 174.87 3d21 h LYS 32 N 5.48 0.51 -0.53 7.08 3.11 -1.99 -0.35 116.57 129.88 3d21 h LYS 32 Ca -0.35 -0.03 -0.07 0.00 -2.81 0.00 0.00 60.65 57.39 3d21 h LYS 32 Cb 1.17 -0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 32.27 3d21 h LYS 32 CO 0.47 0.34 0.06 1.49 -2.81 0.00 0.00 179.45 179.00 3d21 h GLU 33 N 0.52 0.89 -0.30 1.90 4.57 -1.98 -1.97 114.58 118.21 3d21 h GLU 33 Ca 0.56 -0.25 -0.10 0.00 -1.18 0.00 0.00 59.36 58.38 3d21 h GLU 33 Cb 1.21 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 3d21 h GLU 33 CO -0.30 0.88 -0.22 -0.09 -1.18 0.00 0.00 179.01 178.10 3d21 h ARG 34 N 0.77 0.67 -0.51 1.92 2.43 -1.52 0.32 114.38 118.46 3d21 h ARG 34 Ca 0.16 -0.33 0.08 0.00 -0.81 0.00 0.00 59.98 59.08 3d21 h ARG 34 Cb 0.44 -0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 29.89 3d21 h ARG 34 CO 0.01 0.93 -0.42 2.35 -1.51 0.00 0.00 179.97 181.33 3d21 h TRP 35 N 0.42 -1.24 0.00 2.20 2.91 -1.27 -1.19 115.95 117.77 3d21 h TRP 35 Ca 0.06 0.08 -0.02 0.00 1.13 0.00 0.00 58.89 60.14 3d21 h TRP 35 Cb 0.78 0.61 -0.00 0.00 -0.51 0.00 0.00 29.16 30.04 3d21 h TRP 35 CO 0.07 -0.43 -0.07 -0.44 -1.03 0.00 0.00 178.44 176.54 3d21 h ASP 36 N -0.26 0.00 0.28 2.65 3.32 -1.08 -1.19 116.42 120.14 3d21 h ASP 36 Ca 0.17 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 3d21 h ASP 36 Cb 0.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.12 3d21 h ASP 36 CO -0.64 0.07 -0.13 -0.61 -1.72 0.00 0.00 179.24 176.21 3d21 h GLN 37 N 0.00 -0.36 -0.74 3.56 4.15 -0.42 -2.79 115.11 118.50 3d21 h GLN 37 Ca -0.00 0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.51 3d21 h GLN 37 Cb 0.13 0.08 -0.06 0.00 0.21 0.00 0.00 27.48 27.85 3d21 h GLN 37 CO 0.01 -0.06 0.43 0.87 -1.93 0.00 0.00 178.83 178.15 3d21 h LYS 38 N -0.98 0.76 -0.74 1.69 1.79 -1.03 0.55 116.57 118.60 3d21 h LYS 38 Ca -0.04 -0.05 0.04 0.00 -2.18 0.00 0.00 60.65 58.42 3d21 h LYS 38 Cb 0.47 -0.17 -0.05 0.00 -1.58 0.00 0.00 32.23 30.90 3d21 h LYS 38 CO 0.06 0.50 0.46 -0.07 -1.08 0.00 0.00 179.45 179.32 3d21 h LEU 39 N 0.78 0.74 -0.17 2.94 3.38 -1.36 -1.39 115.31 120.22 3d21 h LEU 39 Ca 0.33 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.30 3d21 h LEU 39 Cb 0.19 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3d21 h LEU 39 CO -0.18 0.50 0.11 0.28 0.09 0.00 0.00 178.44 179.24 3d21 h SER 40 N 0.88 0.20 -0.87 -0.43 0.02 -0.73 -1.68 113.55 110.95 3d21 h SER 40 Ca 0.31 -0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.31 3d21 h SER 40 Cb 0.06 -0.05 -0.07 0.00 0.14 0.00 0.00 62.40 62.48 3d21 h SER 40 CO -0.13 0.17 0.52 -0.33 -1.14 0.00 0.00 176.83 175.92 3d21 h GLU 41 N 0.22 0.88 -0.22 3.45 5.08 -0.93 0.15 114.58 123.21 3d21 h GLU 41 Ca 0.06 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 3d21 h GLU 41 Cb -0.00 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 3d21 h GLU 41 CO -0.01 0.58 -0.13 0.00 -1.00 0.00 0.00 179.01 178.45 3d21 h ALA 42 N 1.44 0.31 0.46 3.43 0.00 -0.99 -1.00 119.26 122.91 3d21 h ALA 42 Ca 0.40 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3d21 h ALA 42 Cb 0.29 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3d21 h ALA 42 CO -0.21 0.18 -0.48 1.03 0.00 0.00 0.00 179.25 179.77 3d21 h SER 43 N 0.17 -1.32 -0.56 0.00 0.87 -1.07 0.35 113.55 112.00 3d21 h SER 43 Ca 0.04 0.11 0.08 0.00 -1.23 0.00 0.00 61.79 60.80 3d21 h SER 43 Cb 0.65 0.44 -0.09 0.00 -0.44 0.00 0.00 62.40 62.96 3d21 h SER 43 CO 0.04 -0.63 -0.23 0.54 -0.53 0.00 0.00 176.83 176.01 3d21 n ARG 44 N -5.55 -0.14 -0.52 2.24 1.74 0.49 -0.31 116.66 114.62 3d21 n ARG 44 Ca -0.11 0.86 0.09 0.00 -0.77 0.00 0.00 57.85 57.91 3d21 n ARG 44 Cb 0.45 -1.28 0.32 0.00 -1.02 0.00 0.00 32.46 30.92 3d21 n ARG 44 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3d21 n ASP 45 N -4.81 4.17 -3.19 0.55 8.00 -0.39 -4.94 116.55 115.95 3d21 n ASP 45 Ca 0.05 -2.33 -0.22 0.00 0.71 0.00 0.00 54.79 52.99 3d21 n ASP 45 Cb 0.22 -0.53 0.01 0.00 -0.02 0.00 0.00 41.12 40.80 3d21 n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d21 n GLY 46 N 1.13 -0.50 3.83 0.44 0.00 0.58 -4.98 105.19 105.70 3d21 n GLY 46 Ca 0.23 0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.98 3d21 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d21 s LYS 47 N -5.85 4.01 0.09 1.61 1.02 0.94 -5.01 119.74 116.55 3d21 s LYS 47 Ca 0.35 0.52 -0.30 0.00 0.02 0.00 0.00 55.97 56.56 3d21 s LYS 47 Cb -0.17 -3.11 -0.05 0.00 -0.52 0.00 0.00 37.83 33.98 3d21 s LYS 47 CO 0.43 0.59 1.01 0.42 -0.92 0.00 0.00 175.35 176.88 3d21 s ILE 48 N -1.25 4.44 -0.17 2.17 1.01 -1.25 -4.36 121.20 121.80 3d21 s ILE 48 Ca 0.31 1.93 -0.18 0.00 0.00 0.00 0.00 60.65 62.71 3d21 s ILE 48 Cb -0.17 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 3d21 s ILE 48 CO 0.17 0.25 0.48 -0.69 0.00 0.00 0.00 174.94 175.15 3d21 s VAL 49 N 0.34 5.16 -0.36 2.92 1.01 -0.40 -1.14 120.40 127.93 3d21 s VAL 49 Ca 0.50 0.89 -0.15 0.00 0.00 0.00 0.00 61.98 63.23 3d21 s VAL 49 Cb -0.24 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 3d21 s VAL 49 CO 0.30 0.24 0.32 -0.22 0.00 0.00 0.00 175.10 175.75 3d21 s LEU 50 N 1.22 4.59 -0.21 3.92 0.20 0.59 -0.41 118.68 128.57 3d21 s LEU 50 Ca 0.23 -0.42 -0.06 0.00 0.69 0.00 0.00 54.13 54.58 3d21 s LEU 50 Cb -0.15 -2.26 -0.03 0.00 -0.43 0.00 0.00 46.19 43.32 3d21 s LEU 50 CO 0.09 -0.34 0.02 0.00 -0.29 0.00 0.00 176.35 175.83 3d21 s ALA 51 N 1.90 3.09 -0.40 5.97 0.00 0.15 0.12 121.76 132.58 3d21 s ALA 51 Ca 0.09 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 3d21 s ALA 51 Cb -0.17 -1.86 0.07 0.00 0.00 0.00 0.00 23.12 21.16 3d21 s ALA 51 CO 0.11 -0.21 0.23 1.21 0.00 0.00 0.00 175.76 177.11 3d21 s ASN 52 N 1.10 5.57 -0.42 0.00 2.47 -0.49 -0.63 114.94 122.53 3d21 s ASN 52 Ca 0.03 -1.47 -0.19 0.00 0.42 0.00 0.00 52.86 51.65 3d21 s ASN 52 Cb -0.14 -1.96 0.02 0.00 -1.45 0.00 0.00 41.25 37.72 3d21 s ASN 52 CO 0.02 -0.50 0.55 -0.36 -3.72 0.00 0.00 177.10 173.09 3d21 s PHE 53 N 1.41 3.12 0.22 0.43 0.08 0.89 0.17 117.98 124.30 3d21 s PHE 53 Ca 0.03 -0.17 0.01 0.00 0.12 0.00 0.00 56.93 56.92 3d21 s PHE 53 Cb -0.22 -3.13 -0.00 0.00 -0.57 0.00 0.00 43.02 39.09 3d21 s PHE 53 CO 0.02 -0.78 0.27 -1.13 -0.10 0.00 0.00 175.22 173.50 3d21 n SER 54 N 5.95 -0.73 -4.04 1.36 3.41 0.10 -0.54 113.62 119.14 3d21 n SER 54 Ca -0.04 -2.29 -0.13 0.00 -0.26 0.00 0.00 58.87 56.15 3d21 n SER 54 Cb 0.48 1.44 -0.12 0.00 -0.26 0.00 0.00 64.21 65.75 3d21 n SER 54 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d21 s ALA 55 N -2.53 0.52 0.13 7.33 0.00 -1.26 -0.48 121.76 125.46 3d21 s ALA 55 Ca 0.21 -0.65 -0.13 0.00 0.00 0.00 0.00 51.96 51.38 3d21 s ALA 55 Cb 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 3d21 s ALA 55 CO 0.15 -0.00 1.51 0.00 0.00 0.00 0.00 175.76 177.42 3d21 h ARG 56 N 4.80 0.79 -1.10 0.00 3.08 -1.99 -3.20 114.38 116.76 3d21 h ARG 56 Ca -0.34 -0.33 -0.68 0.00 0.07 0.00 0.00 59.98 58.69 3d21 h ARG 56 Cb 1.20 -0.03 -0.29 0.00 0.08 0.00 0.00 29.97 30.93 3d21 h ARG 56 CO 0.42 0.95 0.81 0.91 -1.07 0.00 0.00 179.97 182.00 3d21 n TRP 57 N -4.29 3.19 -4.30 3.04 8.01 -1.26 -4.83 117.44 117.00 3d21 n TRP 57 Ca -0.02 -2.92 -0.33 0.00 -1.31 0.00 0.00 57.50 52.92 3d21 n TRP 57 Cb 0.40 -1.37 -0.16 0.00 -2.01 0.00 0.00 31.31 28.17 3d21 n TRP 57 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3d21 h GLY 59 N 7.68 -0.75 1.85 0.00 0.00 -1.90 -0.95 103.07 109.01 3d21 h GLY 59 Ca -0.39 0.28 0.01 0.00 0.00 0.00 0.00 47.33 47.22 3d21 h GLY 59 CO 0.60 -0.27 0.07 -2.55 0.00 0.00 0.00 176.54 174.39 3d21 h PRO 60 N -1.12 0.00 -0.11 4.80 0.11 -1.97 -0.84 132.00 132.88 3d21 h PRO 60 Ca -0.07 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.83 3d21 h PRO 60 Cb 0.60 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.72 3d21 h PRO 60 CO 0.12 0.00 -0.74 0.00 -0.21 0.00 0.00 178.00 177.17 3d21 h LYS 62 N 0.38 0.11 -1.07 0.00 1.57 -0.99 -2.22 116.57 114.34 3d21 h LYS 62 Ca -0.06 -0.02 0.30 0.00 -1.87 0.00 0.00 60.65 59.00 3d21 h LYS 62 Cb 1.39 -0.02 -0.12 0.00 0.08 0.00 0.00 32.23 33.56 3d21 h LYS 62 CO 0.15 0.24 0.66 0.37 -0.57 0.00 0.00 179.45 180.31 3d21 h GLN 63 N -0.04 0.36 -0.01 3.15 4.15 -1.15 -2.43 115.11 119.13 3d21 h GLN 63 Ca 0.03 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3d21 h GLN 63 Cb 0.17 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.78 3d21 h GLN 63 CO -0.00 0.24 -0.34 1.51 -1.93 0.00 0.00 178.83 178.30 3d21 n ILE 64 N -4.77 0.00 -0.21 2.39 3.06 -1.17 -4.66 119.36 114.00 3d21 n ILE 64 Ca 0.29 -0.33 -0.06 0.00 -2.50 0.00 0.00 62.75 60.15 3d21 n ILE 64 Cb 0.96 1.23 0.03 0.00 0.54 0.00 0.00 39.64 42.41 3d21 n ILE 64 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3d21 h ALA 65 N 3.21 0.76 -0.15 1.51 0.00 -0.88 -1.35 119.26 122.36 3d21 h ALA 65 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3d21 h ALA 65 Cb 0.63 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3d21 h ALA 65 CO 0.00 0.24 0.04 -1.35 0.00 0.00 0.00 179.25 178.17 3d21 h PRO 66 N 0.80 0.23 -1.07 0.00 0.11 -1.83 -2.48 132.00 127.76 3d21 h PRO 66 Ca 0.21 -0.05 0.29 0.00 0.11 0.00 0.00 66.00 66.56 3d21 h PRO 66 Cb -0.02 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 30.98 3d21 h PRO 66 CO -0.04 0.38 0.71 -0.92 -0.21 0.00 0.00 178.00 177.93 3d21 h TYR 67 N 0.04 0.47 0.05 0.65 3.20 -1.81 -0.59 116.97 118.98 3d21 h TYR 67 Ca 0.05 0.02 -0.25 0.00 3.14 0.00 0.00 58.73 61.68 3d21 h TYR 67 Cb 0.25 -0.13 0.01 0.00 1.54 0.00 0.00 36.73 38.39 3d21 h TYR 67 CO 0.01 0.04 -1.07 -0.92 -1.64 0.00 0.00 178.16 174.58 3d21 h TYR 68 N 0.27 0.62 -0.20 -3.82 3.20 -1.03 0.17 116.97 116.18 3d21 h TYR 68 Ca 0.58 -0.38 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 3d21 h TYR 68 Cb 1.72 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.92 3d21 h TYR 68 CO -0.00 1.23 -0.05 0.82 -1.64 0.00 0.00 178.16 178.52 3d21 h ILE 69 N 0.19 1.28 0.29 1.81 2.04 -0.85 -0.56 117.51 121.70 3d21 h ILE 69 Ca -0.11 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.73 3d21 h ILE 69 Cb 1.73 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 39.34 3d21 h ILE 69 CO 0.18 0.31 -0.31 -0.08 0.00 0.00 0.00 178.15 178.25 3d21 h GLU 70 N 0.11 -0.61 -0.93 2.37 4.81 -1.00 0.23 114.58 119.56 3d21 h GLU 70 Ca 0.05 0.04 0.27 0.00 -0.13 0.00 0.00 59.36 59.59 3d21 h GLU 70 Cb 0.49 0.14 -0.14 0.00 0.63 0.00 0.00 28.75 29.87 3d21 h GLU 70 CO 0.02 -0.41 0.37 -0.07 -0.73 0.00 0.00 179.01 178.20 3d21 h LEU 71 N -0.63 0.22 -1.80 1.64 3.38 -0.67 -0.40 115.31 117.04 3d21 h LEU 71 Ca -0.01 0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 3d21 h LEU 71 Cb 0.59 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 3d21 h LEU 71 CO -0.08 -0.14 -0.15 0.77 0.09 0.00 0.00 178.44 178.94 3d21 h SER 72 N 0.27 0.00 0.25 -0.43 4.64 0.72 -2.27 113.55 116.73 3d21 h SER 72 Ca 0.63 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.74 3d21 h SER 72 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 3d21 h SER 72 CO -0.63 0.15 -0.84 -0.33 -0.87 0.00 0.00 176.83 174.30 3d21 h GLU 73 N 0.00 0.45 0.00 4.77 4.39 -0.54 -3.33 114.58 120.32 3d21 h GLU 73 Ca -0.00 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.28 3d21 h GLU 73 Cb 0.38 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 3d21 h GLU 73 CO 0.02 1.07 -0.27 0.09 -1.16 0.00 0.00 179.01 178.76 3d21 n ASN 74 N -3.80 0.67 -3.25 1.42 5.03 -0.89 -4.47 115.26 109.97 3d21 n ASN 74 Ca -0.06 0.34 -0.25 0.00 0.87 0.00 0.00 54.58 55.48 3d21 n ASN 74 Cb 0.78 -0.33 -0.07 0.00 -1.02 0.00 0.00 39.78 39.13 3d21 n ASN 74 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3d21 n TYR 75 N -2.08 0.71 0.27 3.10 4.01 -0.98 -4.96 117.16 117.24 3d21 n TYR 75 Ca 0.05 -3.72 0.13 0.00 -0.16 0.00 0.00 57.90 54.20 3d21 n TYR 75 Cb 0.42 -0.41 0.71 0.00 -0.31 0.00 0.00 39.34 39.75 3d21 n TYR 75 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3d21 h PRO 76 N 4.04 0.00 -0.07 -0.72 0.13 -1.78 -2.49 132.00 131.10 3d21 h PRO 76 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3d21 h PRO 76 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3d21 h PRO 76 CO 0.56 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.20 3d21 n SER 77 N -2.62 1.17 -4.61 1.44 3.41 -1.26 -4.71 113.62 106.45 3d21 n SER 77 Ca -0.02 -1.51 -0.34 0.00 -0.26 0.00 0.00 58.87 56.74 3d21 n SER 77 Cb 0.30 -0.04 -0.10 0.00 -0.26 0.00 0.00 64.21 64.11 3d21 n SER 77 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3d21 s LEU 78 N -1.77 3.63 -0.39 1.04 1.43 -0.94 -3.75 118.68 117.93 3d21 s LEU 78 Ca 0.36 0.04 -0.27 0.00 -1.03 0.00 0.00 54.13 53.23 3d21 s LEU 78 Cb 0.19 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.53 3d21 s LEU 78 CO 0.29 0.21 0.99 -0.32 0.23 0.00 0.00 176.35 177.75 3d21 s MET 79 N 0.15 3.82 -0.39 1.70 -2.45 -0.29 -4.93 119.30 116.91 3d21 s MET 79 Ca 0.03 0.61 -0.23 0.00 -1.25 0.00 0.00 55.69 54.84 3d21 s MET 79 Cb -0.13 -3.82 0.01 0.00 1.25 0.00 0.00 34.83 32.14 3d21 s MET 79 CO 0.01 -1.05 0.80 -0.06 1.05 0.00 0.00 175.02 175.77 3d21 s PHE 80 N 3.71 3.07 0.15 4.11 0.40 -1.26 -0.30 117.98 127.85 3d21 s PHE 80 Ca 0.41 0.44 0.08 0.00 -0.60 0.00 0.00 56.93 57.26 3d21 s PHE 80 Cb -0.11 -3.52 -0.04 0.00 0.51 0.00 0.00 43.02 39.86 3d21 s PHE 80 CO 0.21 -0.83 -0.09 -0.51 0.70 0.00 0.00 175.22 174.71 3d21 s LEU 81 N 3.20 3.04 -0.15 -0.37 1.43 0.12 -1.36 118.68 124.60 3d21 s LEU 81 Ca 0.31 -0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 52.94 3d21 s LEU 81 Cb -0.13 -1.77 -0.01 0.00 0.03 0.00 0.00 46.19 44.31 3d21 s LEU 81 CO 0.19 0.13 -0.14 -0.69 0.23 0.00 0.00 176.35 176.07 3d21 s VAL 82 N -1.49 2.83 -0.16 -1.59 1.01 0.25 -1.40 120.40 119.85 3d21 s VAL 82 Ca 0.24 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 3d21 s VAL 82 Cb -0.10 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 3d21 s VAL 82 CO 0.15 0.51 -0.06 -0.63 0.00 0.00 0.00 175.10 175.07 3d21 s ILE 83 N 0.66 3.58 -0.52 2.22 1.09 0.46 -1.07 121.20 127.61 3d21 s ILE 83 Ca -0.07 -0.46 -0.23 0.00 -1.10 0.00 0.00 60.65 58.78 3d21 s ILE 83 Cb -0.16 -2.57 0.04 0.00 -1.06 0.00 0.00 42.46 38.72 3d21 s ILE 83 CO 0.02 0.48 0.87 -0.62 -0.10 0.00 0.00 174.94 175.59 3d21 s ASP 84 N 0.61 6.34 0.19 3.58 -1.08 -1.13 0.02 116.67 125.20 3d21 s ASP 84 Ca -0.04 -0.38 -0.00 0.00 -0.52 0.00 0.00 52.55 51.61 3d21 s ASP 84 Cb -0.15 -2.41 0.10 0.00 -1.46 0.00 0.00 42.92 39.01 3d21 s ASP 84 CO 0.03 -1.12 1.46 -0.37 0.52 0.00 0.00 175.17 175.69 3d21 h VAL 85 N 5.99 1.38 -0.26 1.11 -1.51 -1.10 -1.17 116.25 120.69 3d21 h VAL 85 Ca -0.26 -2.09 0.06 0.00 -1.23 0.00 0.00 66.70 63.17 3d21 h VAL 85 Cb 1.08 2.07 -0.06 0.00 -2.13 0.00 0.00 31.29 32.25 3d21 h VAL 85 CO 1.05 0.63 -0.10 0.44 -1.23 0.00 0.00 177.57 178.36 3d21 h ASP 86 N 0.26 -0.34 0.61 4.19 3.32 -1.91 -2.73 116.42 119.82 3d21 h ASP 86 Ca -0.02 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 3d21 h ASP 86 Cb 1.25 0.20 0.00 0.00 0.22 0.00 0.00 39.33 41.01 3d21 h ASP 86 CO 0.12 -0.13 -0.30 -0.08 -1.72 0.00 0.00 179.24 177.12 3d21 h GLU 87 N -0.05 -0.80 -2.93 3.56 4.57 -1.94 -3.34 114.58 113.65 3d21 h GLU 87 Ca 0.13 0.05 -0.72 0.00 -1.18 0.00 0.00 59.36 57.65 3d21 h GLU 87 Cb 0.25 0.18 -0.07 0.00 -0.16 0.00 0.00 28.75 28.95 3d21 h GLU 87 CO -0.30 -0.54 2.87 1.28 -1.18 0.00 0.00 179.01 181.15 3d21 n LEU 88 N -4.27 8.05 0.04 1.64 4.77 -0.45 -4.78 117.00 121.99 3d21 n LEU 88 Ca -0.10 -4.65 -0.05 0.00 -0.03 0.00 0.00 56.01 51.18 3d21 n LEU 88 Cb 0.33 -1.46 0.16 0.00 -2.33 0.00 0.00 43.42 40.13 3d21 n LEU 88 CO 0.25 1.93 0.63 -1.28 -1.33 0.00 0.00 177.39 177.59 3d21 h SER 89 N 4.95 0.44 0.09 -1.43 0.87 -1.62 -0.24 113.55 116.60 3d21 h SER 89 Ca 0.71 -0.19 -0.19 0.00 -1.23 0.00 0.00 61.79 60.90 3d21 h SER 89 Cb 0.35 -0.12 0.02 0.00 -0.44 0.00 0.00 62.40 62.21 3d21 h SER 89 CO 1.62 0.79 -0.81 0.44 -0.53 0.00 0.00 176.83 178.34 3d21 h ASP 90 N 0.35 0.56 -0.92 6.23 3.45 -1.88 -2.48 116.42 121.74 3d21 h ASP 90 Ca 0.03 -0.86 -0.01 0.00 0.43 0.00 0.00 57.03 56.62 3d21 h ASP 90 Cb 0.84 -0.18 -0.04 0.00 -0.56 0.00 0.00 39.33 39.39 3d21 h ASP 90 CO 0.07 1.36 0.54 0.15 -1.57 0.00 0.00 179.24 179.79 3d21 h PHE 91 N -0.17 1.24 -0.52 4.55 3.57 -1.92 -1.84 116.94 121.86 3d21 h PHE 91 Ca -0.13 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.35 3d21 h PHE 91 Cb 1.56 -0.40 -0.02 0.00 2.79 0.00 0.00 35.95 39.88 3d21 h PHE 91 CO 0.16 0.83 0.27 0.77 -2.23 0.00 0.00 178.31 178.12 3d21 h SER 92 N 1.28 0.66 -0.69 0.41 0.02 -1.10 -1.89 113.55 112.23 3d21 h SER 92 Ca 0.33 -0.11 0.01 0.00 -0.84 0.00 0.00 61.79 61.18 3d21 h SER 92 Cb -0.02 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 3d21 h SER 92 CO -0.06 0.57 0.46 0.00 -1.14 0.00 0.00 176.83 176.66 3d21 h ALA 93 N 1.11 0.87 -0.22 3.77 0.00 -1.20 0.41 119.26 124.00 3d21 h ALA 93 Ca 0.18 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.10 3d21 h ALA 93 Cb 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3d21 h ALA 93 CO -0.03 0.30 0.18 0.66 0.00 0.00 0.00 179.25 180.36 3d21 h SER 94 N 0.93 0.00 -0.67 0.00 4.64 -0.75 0.45 113.55 118.15 3d21 h SER 94 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3d21 h SER 94 Cb -0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 3d21 h SER 94 CO -0.05 0.00 0.00 0.79 -0.87 0.00 0.00 176.83 176.70 3d21 n TRP 95 N -4.16 1.18 -3.76 4.77 7.02 -0.02 -4.93 117.44 117.54 3d21 n TRP 95 Ca 0.02 -0.52 -0.22 0.00 -1.02 0.00 0.00 57.50 55.76 3d21 n TRP 95 Cb 0.32 -0.11 0.02 0.00 -2.42 0.00 0.00 31.31 29.12 3d21 n TRP 95 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 3d21 n GLU 96 N 1.36 -4.58 -2.33 -0.99 1.02 0.16 -4.89 120.64 110.38 3d21 n GLU 96 Ca 0.24 0.58 -0.42 0.00 -0.02 0.00 0.00 57.16 57.53 3d21 n GLU 96 Cb 0.72 -5.05 -0.03 0.00 -0.02 0.00 0.00 31.44 27.07 3d21 n GLU 96 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3d21 s ILE 97 N -3.73 4.00 -0.52 -3.67 -1.09 -0.55 -4.86 121.20 110.78 3d21 s ILE 97 Ca 0.01 1.33 0.07 0.00 -2.23 0.00 0.00 60.65 59.83 3d21 s ILE 97 Cb -0.01 -3.85 -0.03 0.00 -1.58 0.00 0.00 42.46 36.99 3d21 s ILE 97 CO 0.83 -0.03 0.43 0.29 -1.23 0.00 0.00 174.94 175.23 3d21 n LYS 98 N 5.61 3.18 -3.53 2.79 4.76 -1.26 -4.85 118.16 124.86 3d21 n LYS 98 Ca 0.13 -0.32 -0.09 0.00 -2.87 0.00 0.00 58.31 55.15 3d21 n LYS 98 Cb 0.45 -0.92 -0.03 0.00 -1.84 0.00 0.00 35.03 32.68 3d21 n LYS 98 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3d21 s ALA 99 N -1.27 -1.86 -0.03 7.82 0.00 -1.26 -5.17 121.76 119.99 3d21 s ALA 99 Ca 0.05 1.23 0.06 0.00 0.00 0.00 0.00 51.96 53.29 3d21 s ALA 99 Cb 0.05 0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 3d21 s ALA 99 CO 0.21 -0.55 -0.21 0.95 0.00 0.00 0.00 175.76 176.16 3d21 s THR 100 N -2.38 1.65 0.44 0.00 -4.23 -1.26 -3.64 115.64 106.22 3d21 s THR 100 Ca 0.02 -0.88 -0.21 0.00 -1.18 0.00 0.00 61.69 59.45 3d21 s THR 100 Cb -0.01 -1.38 -0.11 0.00 1.34 0.00 0.00 72.50 72.34 3d21 s THR 100 CO -0.05 0.47 0.96 -2.16 -0.54 0.00 0.00 174.62 173.30 3d21 s PRO 101 N -0.36 4.17 -0.10 3.99 0.04 -1.26 -4.74 135.00 136.75 3d21 s PRO 101 Ca 0.05 1.14 0.04 0.00 0.04 0.00 0.00 61.00 62.27 3d21 s PRO 101 Cb -0.09 -2.17 -0.00 0.00 0.04 0.00 0.00 34.50 32.28 3d21 s PRO 101 CO 0.00 -0.08 -0.23 0.99 0.04 0.00 0.00 177.00 177.72 3d21 s THR 102 N -2.17 2.13 -0.20 1.26 2.01 0.30 -1.55 115.64 117.42 3d21 s THR 102 Ca 0.63 -1.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.55 3d21 s THR 102 Cb -0.10 -1.81 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 3d21 s THR 102 CO 0.14 0.56 0.08 -0.36 -0.69 0.00 0.00 174.62 174.35 3d21 s PHE 103 N 0.32 3.25 -0.04 4.92 0.08 0.13 -0.08 117.98 126.56 3d21 s PHE 103 Ca -0.18 0.05 0.06 0.00 0.12 0.00 0.00 56.93 56.98 3d21 s PHE 103 Cb -0.18 -2.13 -0.02 0.00 -0.57 0.00 0.00 43.02 40.12 3d21 s PHE 103 CO 0.09 0.09 -0.20 -0.06 -0.10 0.00 0.00 175.22 175.03 3d21 s PHE 104 N 0.63 2.52 -0.28 0.36 0.08 0.19 -0.92 117.98 120.57 3d21 s PHE 104 Ca 0.04 -0.34 -0.12 0.00 0.12 0.00 0.00 56.93 56.63 3d21 s PHE 104 Cb -0.13 -1.58 -0.05 0.00 -0.57 0.00 0.00 43.02 40.70 3d21 s PHE 104 CO 0.01 0.04 0.22 -0.06 -0.10 0.00 0.00 175.22 175.34 3d21 s PHE 105 N -0.59 3.22 -0.15 0.36 0.08 -0.62 -0.68 117.98 119.61 3d21 s PHE 105 Ca 0.09 0.14 0.01 0.00 0.12 0.00 0.00 56.93 57.28 3d21 s PHE 105 Cb -0.11 -2.42 -0.00 0.00 -0.57 0.00 0.00 43.02 39.92 3d21 s PHE 105 CO 0.00 -0.19 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.26 3d21 s LEU 106 N 1.81 2.44 -0.19 -0.37 1.43 0.45 0.50 118.68 124.75 3d21 s LEU 106 Ca 0.08 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.69 3d21 s LEU 106 Cb -0.16 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 3d21 s LEU 106 CO 0.11 0.10 -0.08 -0.60 0.23 0.00 0.00 176.35 176.11 3d21 s ARG 107 N 0.71 3.35 -1.38 1.70 3.52 0.13 -1.27 118.95 125.70 3d21 s ARG 107 Ca -0.07 -0.65 -0.13 0.00 -0.13 0.00 0.00 55.73 54.74 3d21 s ARG 107 Cb -0.16 -2.88 0.11 0.00 -1.56 0.00 0.00 34.95 30.46 3d21 s ARG 107 CO 0.01 -0.09 0.57 -0.25 -0.81 0.00 0.00 175.30 174.74 3d21 n ASP 108 N 4.45 -3.31 0.00 -2.12 8.00 -1.26 -1.25 116.55 121.06 3d21 n ASP 108 Ca -0.18 -0.60 0.00 0.00 0.71 0.00 0.00 54.79 54.72 3d21 n ASP 108 Cb 0.51 -2.75 0.00 0.00 -0.02 0.00 0.00 41.12 38.87 3d21 n ASP 108 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d21 n GLY 109 N -1.20 0.61 3.50 0.44 0.00 -1.26 -5.02 105.19 102.26 3d21 n GLY 109 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3d21 n GLY 109 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d21 s GLN 110 N -0.15 2.12 -0.11 1.61 -0.21 -0.38 -5.04 119.66 117.50 3d21 s GLN 110 Ca 0.00 -0.97 -0.25 0.00 0.02 0.00 0.00 55.36 54.16 3d21 s GLN 110 Cb 0.00 -2.24 -0.03 0.00 1.00 0.00 0.00 33.01 31.74 3d21 s GLN 110 CO 0.00 0.54 0.77 -0.65 -2.12 0.00 0.00 175.29 173.83 3d21 s GLN 111 N -1.61 4.38 -0.08 2.91 -0.21 -1.26 -0.70 119.66 123.09 3d21 s GLN 111 Ca 0.16 0.96 0.20 0.00 0.02 0.00 0.00 55.36 56.71 3d21 s GLN 111 Cb -0.11 -3.51 -0.28 0.00 1.00 0.00 0.00 33.01 30.12 3d21 s GLN 111 CO 0.07 -0.11 0.36 0.28 -2.12 0.00 0.00 175.29 173.77 3d21 n VAL 112 N 4.21 0.65 -3.79 1.09 0.31 0.18 -4.96 118.33 116.02 3d21 n VAL 112 Ca 0.02 -0.66 -0.02 0.00 -0.01 0.00 0.00 64.34 63.67 3d21 n VAL 112 Cb 0.50 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 3d21 n VAL 112 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3d21 s ASP 113 N -5.02 -0.08 -0.20 4.52 -1.08 -1.11 -4.99 116.67 108.72 3d21 s ASP 113 Ca -0.08 -0.44 -0.28 0.00 -0.52 0.00 0.00 52.55 51.23 3d21 s ASP 113 Cb 0.10 0.41 0.11 0.00 -1.46 0.00 0.00 42.92 42.09 3d21 s ASP 113 CO 0.87 -0.79 0.93 -0.75 0.52 0.00 0.00 175.17 175.94 3d21 s LYS 114 N -2.68 0.67 -0.12 4.34 2.20 -1.26 -1.59 119.74 121.30 3d21 s LYS 114 Ca 0.17 0.42 -0.04 0.00 -0.36 0.00 0.00 55.97 56.15 3d21 s LYS 114 Cb -0.01 0.32 0.06 0.00 -1.51 0.00 0.00 37.83 36.69 3d21 s LYS 114 CO 0.02 -0.16 0.22 -1.17 -0.36 0.00 0.00 175.35 173.90 3d21 s LEU 115 N -0.49 -0.19 -0.19 5.43 0.20 -0.09 -5.00 118.68 118.34 3d21 s LEU 115 Ca -0.01 0.37 -0.16 0.00 0.69 0.00 0.00 54.13 55.02 3d21 s LEU 115 Cb -0.02 0.49 -0.04 0.00 -0.43 0.00 0.00 46.19 46.18 3d21 s LEU 115 CO 0.00 -0.26 0.39 0.54 -0.29 0.00 0.00 176.35 176.74 3d21 s VAL 116 N 2.36 5.21 0.00 1.68 0.11 -1.26 0.20 120.40 128.69 3d21 s VAL 116 Ca 0.03 0.71 0.00 0.00 -2.93 0.00 0.00 61.98 59.79 3d21 s VAL 116 Cb -0.13 -3.73 0.00 0.00 -1.53 0.00 0.00 36.38 31.00 3d21 s VAL 116 CO -0.08 0.27 0.00 0.61 -3.33 0.00 0.00 175.10 172.57 3d21 n GLY 117 N 3.82 2.39 2.46 6.54 0.00 -0.59 -4.78 105.19 115.03 3d21 n GLY 117 Ca -0.09 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.00 3d21 n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d21 n ALA 118 N 1.52 3.77 -2.99 4.61 0.00 -1.26 -4.84 120.51 121.31 3d21 n ALA 118 Ca 0.00 -1.22 -0.44 0.00 0.00 0.00 0.00 53.44 51.78 3d21 n ALA 118 Cb 0.00 -2.57 -0.04 0.00 0.00 0.00 0.00 19.45 16.84 3d21 n ALA 118 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3d21 s ASN 119 N 3.07 6.33 0.11 0.00 3.84 -1.26 -4.95 114.94 122.07 3d21 s ASN 119 Ca 0.32 -1.51 -0.31 0.00 0.21 0.00 0.00 52.86 51.56 3d21 s ASN 119 Cb 0.12 -2.36 -0.11 0.00 -0.55 0.00 0.00 41.25 38.34 3d21 s ASN 119 CO -0.01 -1.19 1.59 0.11 -2.79 0.00 0.00 177.10 174.81 3d21 h LYS 120 N 9.15 -0.67 -0.53 0.43 1.57 -2.00 -1.41 116.57 123.11 3d21 h LYS 120 Ca -0.15 0.05 0.11 0.00 -1.87 0.00 0.00 60.65 58.78 3d21 h LYS 120 Cb 1.06 0.15 -0.09 0.00 0.08 0.00 0.00 32.23 33.43 3d21 h LYS 120 CO 1.11 -0.45 -0.04 -1.35 -0.57 0.00 0.00 179.45 178.15 3d21 h PRO 121 N -0.69 0.07 -0.57 3.15 0.11 -1.99 -1.80 132.00 130.28 3d21 h PRO 121 Ca 0.01 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 3d21 h PRO 121 Cb 0.69 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.76 3d21 h PRO 121 CO -0.19 0.05 0.19 1.49 -0.21 0.00 0.00 178.00 179.33 3d21 h GLU 122 N 0.07 0.88 0.14 1.05 4.57 -1.97 0.95 114.58 120.27 3d21 h GLU 122 Ca 0.27 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 3d21 h GLU 122 Cb 0.41 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.87 3d21 h GLU 122 CO -0.48 0.78 -0.07 1.25 -1.18 0.00 0.00 179.01 179.31 3d21 h LEU 123 N 0.79 -0.16 -0.35 1.64 5.85 -0.96 -1.15 115.31 120.98 3d21 h LEU 123 Ca 0.19 -0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.83 3d21 h LEU 123 Cb 0.26 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 3d21 h LEU 123 CO -0.01 0.04 0.03 -0.74 -0.34 0.00 0.00 178.44 177.42 3d21 h HIS 124 N -0.36 0.04 -0.73 1.25 2.76 -1.33 0.24 115.15 117.02 3d21 h HIS 124 Ca -0.02 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.24 3d21 h HIS 124 Cb 0.28 0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.24 3d21 h HIS 124 CO -0.02 -0.03 0.48 -0.22 -1.30 0.00 0.00 177.93 176.84 3d21 h LYS 125 N 0.13 0.76 -0.23 5.26 3.64 -0.69 -0.78 116.57 124.65 3d21 h LYS 125 Ca 0.17 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.34 3d21 h LYS 125 Cb 0.22 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3d21 h LYS 125 CO -0.26 0.50 -0.51 0.87 -2.27 0.00 0.00 179.45 177.78 3d21 h LYS 126 N 0.78 0.64 -0.40 1.90 1.57 -0.70 -2.08 116.57 118.28 3d21 h LYS 126 Ca 0.31 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 3d21 h LYS 126 Cb 0.24 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 3d21 h LYS 126 CO -0.10 1.00 0.20 0.82 -0.57 0.00 0.00 179.45 180.80 3d21 h ILE 127 N 0.50 1.17 -0.24 1.86 2.04 -0.15 -2.45 117.51 120.25 3d21 h ILE 127 Ca 0.02 -0.47 0.05 0.00 1.00 0.00 0.00 64.86 65.46 3d21 h ILE 127 Cb 1.07 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 3d21 h ILE 127 CO 0.10 0.18 -0.10 0.74 0.00 0.00 0.00 178.15 179.08 3d21 h THR 128 N 0.51 0.68 -0.01 -0.27 2.02 -1.08 -1.06 112.91 113.70 3d21 h THR 128 Ca 0.14 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.32 3d21 h THR 128 Cb 0.11 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.20 3d21 h THR 128 CO -0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.88 3d21 h ALA 129 N 1.15 0.02 0.00 6.16 0.00 -1.36 -2.62 119.26 122.61 3d21 h ALA 129 Ca 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3d21 h ALA 129 Cb 0.24 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3d21 h ALA 129 CO -0.28 -0.38 -0.04 0.82 0.00 0.00 0.00 179.25 179.38 3d21 h ILE 130 N -0.18 0.82 0.19 0.00 2.04 -1.42 -3.18 117.51 115.77 3d21 h ILE 130 Ca 0.00 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 3d21 h ILE 130 Cb 0.21 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 3d21 h ILE 130 CO -0.00 0.04 -0.09 0.25 0.00 0.00 0.00 178.15 178.35 3d21 h LEU 131 N 0.00 -0.22 -0.46 1.44 5.85 -0.83 -3.16 115.31 117.93 3d21 h LEU 131 Ca -0.00 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.58 3d21 h LEU 131 Cb 0.08 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 3d21 h LEU 131 CO 0.01 0.32 0.13 -0.78 -0.34 0.00 0.00 178.44 177.77 3d21 h ASP 132 N -0.99 0.08 0.00 1.25 1.82 -1.58 -3.37 116.42 113.63 3d21 h ASP 132 Ca -0.03 0.07 -0.08 0.00 -0.39 0.00 0.00 57.03 56.60 3d21 h ASP 132 Cb 0.42 0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.49 3d21 h ASP 132 CO 0.04 0.08 -0.72 0.28 -1.61 0.00 0.00 179.24 177.31 3d21 h SER 133 N 0.28 0.00 0.00 2.28 0.02 -1.67 -3.53 113.55 110.93 3d21 h SER 133 Ca 0.22 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3d21 h SER 133 Cb 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 3d21 h SER 133 CO -0.26 0.99 0.00 0.18 -1.14 0.00 0.00 176.83 176.60