#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dxk s ARG 10 N 0.00 3.97 0.00 0.00 0.52 -1.26 -4.65 118.95 117.53 3dxk s ARG 10 Ca 0.00 0.37 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 3dxk s ARG 10 Cb 0.00 -3.26 0.00 0.00 0.52 0.00 0.00 34.95 32.21 3dxk s ARG 10 CO 0.00 0.60 0.00 1.97 0.02 0.00 0.00 175.30 177.89 3dxk n PHE 11 N 2.16 0.00 1.23 -0.53 1.16 -1.26 -4.92 117.46 115.30 3dxk n PHE 11 Ca -0.13 0.00 0.13 0.00 -1.87 0.00 0.00 57.45 55.58 3dxk n PHE 11 Cb 0.52 0.00 0.38 0.00 -1.61 0.00 0.00 39.48 38.78 3dxk n PHE 11 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3dxk n ARG 12 N 0.00 0.74 0.19 3.97 1.74 -1.26 -3.69 116.66 118.35 3dxk n ARG 12 Ca 0.00 -0.42 0.07 0.00 -0.77 0.00 0.00 57.85 56.73 3dxk n ARG 12 Cb 0.00 -1.49 0.24 0.00 -1.02 0.00 0.00 32.46 30.19 3dxk n ARG 12 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3dxk h LYS 13 N 1.04 0.00 -5.57 5.56 1.57 -1.93 -3.43 116.57 113.80 3dxk h LYS 13 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 3dxk h LYS 13 Cb 0.49 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.70 3dxk h LYS 13 CO 0.00 0.30 0.11 0.54 -0.57 0.00 0.00 179.45 179.83 3dxk s VAL 14 N -3.31 5.02 -1.32 0.50 0.11 -1.24 -4.98 120.40 115.18 3dxk s VAL 14 Ca 0.03 1.12 -0.17 0.00 -2.93 0.00 0.00 61.98 60.02 3dxk s VAL 14 Cb 0.08 -3.92 0.05 0.00 -1.53 0.00 0.00 36.38 31.06 3dxk s VAL 14 CO 0.68 0.08 1.86 -0.67 -3.33 0.00 0.00 175.10 173.73 3dxk n ASP 15 N 5.32 4.56 -0.38 3.54 2.03 -1.26 -4.83 116.55 125.52 3dxk n ASP 15 Ca -0.02 -2.89 0.30 0.00 0.52 0.00 0.00 54.79 52.71 3dxk n ASP 15 Cb 0.49 -1.72 0.58 0.00 -0.72 0.00 0.00 41.12 39.76 3dxk n ASP 15 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 3dxk h VAL 16 N 5.23 0.31 -0.47 5.18 2.07 -1.95 -0.89 116.25 125.73 3dxk h VAL 16 Ca 0.46 -0.08 0.14 0.00 0.82 0.00 0.00 66.70 68.04 3dxk h VAL 16 Cb 0.82 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3dxk h VAL 16 CO 1.55 0.04 0.38 1.23 0.02 0.00 0.00 177.57 180.80 3dxk h GLY 17 N 0.23 0.00 2.00 2.17 0.00 -1.99 -1.06 103.07 104.42 3dxk h GLY 17 Ca 0.71 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.04 3dxk h GLY 17 CO -0.37 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.35 3dxk n GLU 18 N -4.14 0.00 -0.62 4.80 -0.58 -0.34 -1.59 120.64 118.18 3dxk n GLU 18 Ca 0.08 0.46 0.06 0.00 -0.42 0.00 0.00 57.16 57.34 3dxk n GLU 18 Cb 0.58 -1.51 0.12 0.00 -0.57 0.00 0.00 31.44 30.06 3dxk n GLU 18 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3dxk n TYR 19 N -1.52 0.00 -2.93 -0.32 4.02 -0.40 -5.03 117.16 110.98 3dxk n TYR 19 Ca 0.01 -0.95 -0.42 0.00 -0.01 0.00 0.00 57.90 56.53 3dxk n TYR 19 Cb 0.03 -0.17 -0.05 0.00 -0.02 0.00 0.00 39.34 39.13 3dxk n TYR 19 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 3dxk s ASP 20 N -2.57 6.69 -1.26 7.72 -1.08 -0.62 -4.97 116.67 120.57 3dxk s ASP 20 Ca 0.30 0.71 -0.16 0.00 -0.52 0.00 0.00 52.55 52.89 3dxk s ASP 20 Cb 0.30 -2.41 0.12 0.00 -1.46 0.00 0.00 42.92 39.46 3dxk s ASP 20 CO -0.05 -0.61 1.62 1.21 0.52 0.00 0.00 175.17 177.86 3dxk n GLU 21 N 6.20 3.28 0.00 4.34 0.00 -1.26 -2.33 120.64 130.87 3dxk n GLU 21 Ca 0.04 -3.53 0.00 0.00 0.00 0.00 0.00 57.16 53.67 3dxk n GLU 21 Cb 0.48 -3.27 0.00 0.00 0.00 0.00 0.00 31.44 28.65 3dxk n GLU 21 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3dxk n ASN 22 N 6.93 0.00 -3.61 4.31 3.02 -1.26 -5.12 115.26 119.53 3dxk n ASN 22 Ca 0.43 -0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.87 3dxk n ASN 22 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 3dxk n ASN 22 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3dxk n LYS 23 N 0.00 1.34 -4.18 3.52 4.81 -0.99 -5.07 118.16 117.59 3dxk n LYS 23 Ca 0.00 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.28 3dxk n LYS 23 Cb 0.03 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 34.97 3dxk n LYS 23 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 3dxk s PHE 24 N 0.00 1.13 -0.15 5.64 5.36 -1.26 -5.15 117.98 123.54 3dxk s PHE 24 Ca 0.00 -0.58 -0.09 0.00 -0.96 0.00 0.00 56.93 55.29 3dxk s PHE 24 Cb 0.00 -0.62 0.05 0.00 -0.34 0.00 0.00 43.02 42.12 3dxk s PHE 24 CO 0.00 0.03 0.38 0.08 -1.46 0.00 0.00 175.22 174.25 3dxk s VAL 25 N -2.05 -0.02 0.00 3.12 1.01 -1.26 -5.20 120.40 115.99 3dxk s VAL 25 Ca 0.03 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.10 3dxk s VAL 25 Cb -0.05 -0.55 0.00 0.00 0.00 0.00 0.00 36.38 35.77 3dxk s VAL 25 CO 0.01 0.03 0.00 0.47 0.00 0.00 0.00 175.10 175.62 3dxk n ASP 26 N 3.98 0.00 0.00 3.32 8.00 -1.26 -5.29 116.55 125.30 3dxk n ASP 26 Ca -0.22 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.28 3dxk n ASP 26 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 3dxk n ASP 26 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dxk n GLY 36 N 1.78 5.42 1.62 0.44 0.00 -1.26 -5.25 105.19 107.94 3dxk n GLY 36 Ca 0.00 -1.28 -0.13 0.00 0.00 0.00 0.00 46.02 44.62 3dxk n GLY 36 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dxk n PRO 37 N 0.00 -1.03 -3.24 1.61 -0.02 -1.25 -4.79 135.00 126.29 3dxk n PRO 37 Ca 0.00 -0.85 -0.43 0.00 -2.02 0.00 0.00 63.50 60.20 3dxk n PRO 37 Cb 0.00 -0.63 -0.07 0.00 -0.02 0.00 0.00 33.50 32.77 3dxk n PRO 37 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3dxk s ASP 38 N -3.00 6.22 0.26 2.55 -1.08 -1.26 -4.94 116.67 115.42 3dxk s ASP 38 Ca 0.32 -0.76 -0.02 0.00 -0.52 0.00 0.00 52.55 51.57 3dxk s ASP 38 Cb -0.02 -2.26 0.44 0.00 -1.46 0.00 0.00 42.92 39.63 3dxk s ASP 38 CO 0.23 -0.73 1.84 -0.08 0.52 0.00 0.00 175.17 176.95 3dxk h GLU 39 N 8.85 0.92 -0.22 4.34 4.22 -1.98 -1.86 114.58 128.86 3dxk h GLU 39 Ca -0.27 -0.06 -0.19 0.00 0.08 0.00 0.00 59.36 58.93 3dxk h GLU 39 Cb 1.10 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.15 3dxk h GLU 39 CO 0.88 0.61 -0.62 0.78 -2.18 0.00 0.00 179.01 178.48 3dxk h GLY 40 N 0.95 0.82 1.45 1.92 0.00 -1.99 -2.05 103.07 104.18 3dxk h GLY 40 Ca 0.44 -1.02 -0.02 0.00 0.00 0.00 0.00 47.33 46.72 3dxk h GLY 40 CO -0.23 0.92 0.22 -2.09 0.00 0.00 0.00 176.54 175.36 3dxk h GLU 41 N 0.56 0.71 0.01 4.80 4.81 -1.85 0.19 114.58 123.81 3dxk h GLU 41 Ca -0.01 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 3dxk h GLU 41 Cb 1.22 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.46 3dxk h GLU 41 CO 0.13 0.57 -0.01 0.28 -0.73 0.00 0.00 179.01 179.25 3dxk h VAL 42 N 0.71 1.39 -1.00 0.32 2.07 -1.29 -2.99 116.25 115.46 3dxk h VAL 42 Ca 0.18 -1.25 0.10 0.00 0.82 0.00 0.00 66.70 66.54 3dxk h VAL 42 Cb 0.10 2.24 -0.08 0.00 -1.52 0.00 0.00 31.29 32.03 3dxk h VAL 42 CO -0.02 0.32 0.63 0.44 0.02 0.00 0.00 177.57 178.96 3dxk h ASP 43 N -0.56 0.95 -0.50 0.57 3.45 -1.00 -0.50 116.42 118.83 3dxk h ASP 43 Ca -0.00 0.04 0.07 0.00 0.43 0.00 0.00 57.03 57.56 3dxk h ASP 43 Cb 0.54 -0.16 -0.06 0.00 -0.56 0.00 0.00 39.33 39.10 3dxk h ASP 43 CO 0.00 0.54 0.17 -1.28 -1.57 0.00 0.00 179.24 177.10 3dxk h SER 44 N 1.04 0.17 0.75 6.45 0.87 -0.58 -0.05 113.55 122.20 3dxk h SER 44 Ca 0.48 0.06 -0.19 0.00 -1.23 0.00 0.00 61.79 60.91 3dxk h SER 44 Cb 0.39 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 3dxk h SER 44 CO -0.24 0.12 -0.86 0.00 -0.53 0.00 0.00 176.83 175.32 3dxk h LEU 46 N 0.04 1.03 -0.72 0.00 3.38 -0.58 -0.54 115.31 117.91 3dxk h LEU 46 Ca -0.02 -0.37 -0.14 0.00 0.09 0.00 0.00 57.88 57.44 3dxk h LEU 46 Cb 1.51 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 3dxk h LEU 46 CO 0.12 1.16 -0.56 0.03 0.09 0.00 0.00 178.44 179.28 3dxk h ARG 47 N 0.89 0.22 -0.00 1.13 3.08 -1.07 -2.92 114.38 115.71 3dxk h ARG 47 Ca 0.13 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3dxk h ARG 47 Cb 0.72 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.78 3dxk h ARG 47 CO 0.05 0.72 -0.01 1.04 -1.07 0.00 0.00 179.97 180.71 3dxk n GLN 48 N -3.90 0.66 -0.98 0.04 6.02 -1.14 -4.89 117.38 113.19 3dxk n GLN 48 Ca -0.02 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 3dxk n GLN 48 Cb 0.59 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.35 3dxk n GLN 48 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dxk n GLY 49 N 1.19 0.93 3.55 1.08 0.00 -1.00 -4.96 105.19 105.98 3dxk n GLY 49 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3dxk n GLY 49 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dxk s ASN 50 N -2.86 6.61 -0.04 1.61 0.01 -0.24 -4.85 114.94 115.18 3dxk s ASN 50 Ca 0.00 -1.80 -0.22 0.00 -0.71 0.00 0.00 52.86 50.13 3dxk s ASN 50 Cb 0.00 -2.55 -0.16 0.00 0.41 0.00 0.00 41.25 38.95 3dxk s ASN 50 CO 0.00 -1.36 0.97 0.24 -1.51 0.00 0.00 177.10 175.43 3dxk h MET 51 N 9.08 -0.26 -0.96 -0.60 2.86 -1.93 -2.91 114.93 120.23 3dxk h MET 51 Ca 0.26 0.02 0.19 0.00 -2.06 0.00 0.00 59.70 58.11 3dxk h MET 51 Cb 0.97 0.06 -0.08 0.00 0.06 0.00 0.00 31.60 32.61 3dxk h MET 51 CO 1.40 0.14 0.61 1.15 1.06 0.00 0.00 176.91 181.28 3dxk h THR 52 N -0.83 0.71 -0.29 2.22 2.02 -1.95 -1.06 112.91 113.73 3dxk h THR 52 Ca -0.03 -0.21 -0.06 0.00 0.77 0.00 0.00 66.41 66.89 3dxk h THR 52 Cb 0.52 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 3dxk h THR 52 CO 0.04 0.11 -0.06 0.00 0.37 0.00 0.00 175.52 175.99 3dxk h ALA 53 N 1.62 0.39 -0.87 6.16 0.00 -1.96 -2.88 119.26 121.73 3dxk h ALA 53 Ca 0.52 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 55.19 3dxk h ALA 53 Cb 1.01 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 3dxk h ALA 53 CO -0.27 0.20 0.56 0.00 0.00 0.00 0.00 179.25 179.74 3dxk h ALA 54 N 0.79 1.13 0.34 0.00 0.00 -1.00 -2.04 119.26 118.48 3dxk h ALA 54 Ca 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3dxk h ALA 54 Cb 0.53 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3dxk h ALA 54 CO 0.03 0.43 -0.26 1.25 0.00 0.00 0.00 179.25 180.70 3dxk h LEU 55 N 1.11 -0.66 -2.91 0.00 5.85 -1.38 -0.79 115.31 116.53 3dxk h LEU 55 Ca 0.34 0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.11 3dxk h LEU 55 Cb -0.03 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 3dxk h LEU 55 CO -0.10 -0.39 0.00 1.56 -0.34 0.00 0.00 178.44 179.17 3dxk h GLN 56 N -0.60 0.00 0.10 1.25 4.20 -1.25 -2.21 115.11 116.61 3dxk h GLN 56 Ca -0.03 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.36 3dxk h GLN 56 Cb 0.52 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 3dxk h GLN 56 CO -0.00 0.00 -1.72 0.00 -0.67 0.00 0.00 178.83 176.43 3dxk h ALA 57 N 2.00 0.42 0.00 3.87 0.00 -0.67 -3.34 119.26 121.54 3dxk h ALA 57 Ca 0.00 -1.28 -0.06 0.00 0.00 0.00 0.00 54.91 53.58 3dxk h ALA 57 Cb 0.00 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3dxk h ALA 57 CO -0.00 1.28 -0.28 0.00 0.00 0.00 0.00 179.25 180.26 3dxk h ALA 58 N 0.45 0.99 -0.20 0.00 0.00 -0.59 -2.82 119.26 117.09 3dxk h ALA 58 Ca -0.31 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3dxk h ALA 58 Cb 2.03 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.77 3dxk h ALA 58 CO 0.12 0.34 0.00 1.28 0.00 0.00 0.00 179.25 181.00 3dxk n LEU 59 N -3.41 2.42 -4.84 0.00 4.77 -0.89 -4.70 117.00 110.35 3dxk n LEU 59 Ca 0.00 -1.22 -0.34 0.00 -0.03 0.00 0.00 56.01 54.42 3dxk n LEU 59 Cb 0.47 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 3dxk n LEU 59 CO 0.35 0.37 -0.20 -0.75 -1.33 0.00 0.00 177.39 175.82 3dxk s LYS 60 N -1.61 3.27 -1.24 3.23 2.20 -1.06 -4.66 119.74 119.87 3dxk s LYS 60 Ca 0.18 -0.35 -0.32 0.00 -0.36 0.00 0.00 55.97 55.13 3dxk s LYS 60 Cb 0.13 -3.01 0.04 0.00 -1.51 0.00 0.00 37.83 33.48 3dxk s LYS 60 CO 0.06 0.69 0.63 0.09 -0.36 0.00 0.00 175.35 176.46 3dxk n ASN 61 N 1.31 -3.76 -4.77 1.43 3.02 -1.26 -3.75 115.26 107.47 3dxk n ASN 61 Ca -0.14 -1.29 -0.40 0.00 -0.03 0.00 0.00 54.58 52.72 3dxk n ASN 61 Cb 0.53 -1.74 0.00 0.00 -0.61 0.00 0.00 39.78 37.96 3dxk n ASN 61 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3dxk s PRO 62 N -7.38 3.95 0.00 3.52 0.04 -1.26 -4.10 135.00 129.77 3dxk s PRO 62 Ca 0.45 2.47 -0.01 0.00 0.04 0.00 0.00 61.00 63.95 3dxk s PRO 62 Cb -0.25 -2.84 -0.04 0.00 0.04 0.00 0.00 34.50 31.42 3dxk s PRO 62 CO 0.97 -0.62 0.92 -2.30 0.04 0.00 0.00 177.00 176.01 3dxk n PRO 63 N 0.21 0.38 0.18 0.56 -0.02 -1.26 -4.50 135.00 130.56 3dxk n PRO 63 Ca 0.03 -0.13 0.13 0.00 -2.02 0.00 0.00 63.50 61.50 3dxk n PRO 63 Cb 0.41 -1.51 0.65 0.00 -0.02 0.00 0.00 33.50 33.02 3dxk n PRO 63 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3dxk h ILE 64 N 2.29 0.00 0.00 4.25 2.04 -1.87 -3.13 117.51 121.08 3dxk h ILE 64 Ca 0.03 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.81 3dxk h ILE 64 Cb 0.32 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 3dxk h ILE 64 CO 0.23 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.97 3dxk n ASN 65 N -2.38 1.33 -4.85 1.72 3.02 -1.26 -4.51 115.26 108.33 3dxk n ASN 65 Ca -0.01 -1.34 -0.32 0.00 -0.03 0.00 0.00 54.58 52.88 3dxk n ASN 65 Cb 0.09 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.20 3dxk n ASN 65 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3dxk s THR 66 N -0.34 4.65 -0.02 3.41 -4.23 -1.19 -5.01 115.64 112.91 3dxk s THR 66 Ca 0.00 0.99 -0.00 0.00 -1.18 0.00 0.00 61.69 61.49 3dxk s THR 66 Cb 0.00 -3.62 -0.26 0.00 1.34 0.00 0.00 72.50 69.96 3dxk s THR 66 CO 0.00 -0.23 0.74 0.11 -0.54 0.00 0.00 174.62 174.70 3dxk h LYS 67 N 2.13 0.20 -6.62 3.99 1.79 -1.96 -3.47 116.57 112.62 3dxk h LYS 67 Ca -0.48 -0.33 -0.52 0.00 -2.18 0.00 0.00 60.65 57.13 3dxk h LYS 67 Cb 1.18 0.12 0.01 0.00 -1.58 0.00 0.00 32.23 31.96 3dxk h LYS 67 CO 0.65 1.01 0.56 -1.54 -1.08 0.00 0.00 179.45 179.04 3dxk s SER 68 N -6.81 7.09 0.00 0.86 1.04 -1.26 -4.88 113.70 109.75 3dxk s SER 68 Ca -0.10 2.17 0.25 0.00 0.48 0.00 0.00 55.95 58.75 3dxk s SER 68 Cb 0.07 -2.60 1.38 0.00 0.10 0.00 0.00 66.02 64.97 3dxk s SER 68 CO 0.83 -0.39 1.83 0.00 0.98 0.00 0.00 173.24 176.49 3dxk n GLN 69 N 2.87 0.60 -0.04 4.02 1.13 -1.26 -3.18 117.38 121.52 3dxk n GLN 69 Ca 0.05 0.02 -0.14 0.00 -1.94 0.00 0.00 57.00 55.00 3dxk n GLN 69 Cb 0.45 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 29.18 3dxk n GLN 69 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dxk h ALA 70 N 3.39 0.01 -0.30 -1.58 0.00 -1.98 -1.36 119.26 117.43 3dxk h ALA 70 Ca 0.00 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.39 3dxk h ALA 70 Cb 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3dxk h ALA 70 CO 0.00 -0.06 -0.24 -0.24 0.00 0.00 0.00 179.25 178.71 3dxk h VAL 71 N -0.74 1.27 -0.10 0.00 3.04 -1.96 -2.57 116.25 115.19 3dxk h VAL 71 Ca -0.01 -1.29 -0.05 0.00 -1.01 0.00 0.00 66.70 64.34 3dxk h VAL 71 Cb 0.85 1.30 -0.00 0.00 -2.01 0.00 0.00 31.29 31.43 3dxk h VAL 71 CO 0.01 0.42 -0.13 0.11 -1.01 0.00 0.00 177.57 176.97 3dxk h LYS 72 N 0.51 0.26 -0.13 4.17 1.57 -1.64 -2.39 116.57 118.93 3dxk h LYS 72 Ca 0.07 -0.15 0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3dxk h LYS 72 Cb 0.69 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 3dxk h LYS 72 CO 0.05 0.71 0.15 -0.44 -0.57 0.00 0.00 179.45 179.35 3dxk h ASP 73 N -0.17 0.00 0.21 0.86 5.19 -1.19 0.10 116.42 121.42 3dxk h ASP 73 Ca 0.01 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 3dxk h ASP 73 Cb 0.68 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.19 3dxk h ASP 73 CO 0.03 0.00 -0.10 -0.09 -3.12 0.00 0.00 179.24 175.96 3dxk h ARG 74 N 0.00 -0.28 -0.81 3.56 2.43 -1.23 -1.86 114.38 116.20 3dxk h ARG 74 Ca 0.06 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.37 3dxk h ARG 74 Cb 0.37 0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 29.89 3dxk h ARG 74 CO -0.00 0.09 0.42 0.00 -1.51 0.00 0.00 179.97 178.98 3dxk h ALA 75 N -0.46 1.18 -0.41 2.80 0.00 -0.80 -0.10 119.26 121.47 3dxk h ALA 75 Ca -0.03 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3dxk h ALA 75 Cb 0.50 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3dxk h ALA 75 CO 0.05 -0.04 0.23 0.78 0.00 0.00 0.00 179.25 180.27 3dxk h GLY 76 N 0.65 0.57 0.60 0.00 0.00 -1.04 -1.98 103.07 101.87 3dxk h GLY 76 Ca 0.42 -0.17 0.05 0.00 0.00 0.00 0.00 47.33 47.63 3dxk h GLY 76 CO -0.32 0.15 0.07 1.76 0.00 0.00 0.00 176.54 178.20 3dxk h SER 77 N 0.47 0.01 -0.08 0.19 0.02 -0.17 0.20 113.55 114.20 3dxk h SER 77 Ca 0.16 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.19 3dxk h SER 77 Cb 0.02 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 3dxk h SER 77 CO -0.08 0.04 -0.02 0.40 -1.14 0.00 0.00 176.83 176.03 3dxk h ILE 78 N 0.18 0.91 -0.61 3.27 2.04 -1.07 0.20 117.51 122.44 3dxk h ILE 78 Ca 0.16 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.01 3dxk h ILE 78 Cb 0.18 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 3dxk h ILE 78 CO -0.21 0.00 0.36 0.58 0.00 0.00 0.00 178.15 178.88 3dxk h VAL 79 N -0.00 1.18 -0.49 1.67 2.07 -1.02 -2.16 116.25 117.51 3dxk h VAL 79 Ca 0.04 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3dxk h VAL 79 Cb 0.06 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 3dxk h VAL 79 CO -0.09 0.19 0.13 0.25 0.02 0.00 0.00 177.57 178.08 3dxk h LEU 80 N 0.83 0.68 -1.28 2.57 5.85 -0.18 -1.84 115.31 121.93 3dxk h LEU 80 Ca 0.22 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3dxk h LEU 80 Cb -0.01 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.85 3dxk h LEU 80 CO -0.04 0.66 0.00 0.50 -0.34 0.00 0.00 178.44 179.22 3dxk h LYS 81 N 0.72 0.00 0.05 1.25 3.64 0.02 -2.36 116.57 119.90 3dxk h LYS 81 Ca 0.16 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.22 3dxk h LYS 81 Cb 0.24 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 3dxk h LYS 81 CO -0.01 0.00 -1.80 0.28 -2.27 0.00 0.00 179.45 175.65 3dxk h VAL 82 N 0.00 0.78 -0.14 2.00 2.07 -0.94 -3.22 116.25 116.79 3dxk h VAL 82 Ca 0.00 -2.58 -0.07 0.00 0.82 0.00 0.00 66.70 64.87 3dxk h VAL 82 Cb 0.43 2.47 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 3dxk h VAL 82 CO 0.00 0.66 -0.17 -0.07 0.02 0.00 0.00 177.57 178.00 3dxk h LEU 83 N 0.03 0.40 -0.70 2.57 3.38 -1.22 -3.17 115.31 116.61 3dxk h LEU 83 Ca -0.33 -0.50 -0.06 0.00 0.09 0.00 0.00 57.88 57.08 3dxk h LEU 83 Cb 2.02 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.63 3dxk h LEU 83 CO 0.09 0.82 0.22 0.40 0.09 0.00 0.00 178.44 180.06 3dxk h ILE 84 N -0.01 1.26 0.00 1.22 5.03 -1.62 -2.60 117.51 120.78 3dxk h ILE 84 Ca 0.02 -0.88 0.00 0.00 -0.12 0.00 0.00 64.86 63.88 3dxk h ILE 84 Cb 0.72 0.51 0.00 0.00 -3.03 0.00 0.00 36.82 35.02 3dxk h ILE 84 CO 0.04 0.34 0.00 -1.20 -0.68 0.00 0.00 178.15 176.66 3dxk n SER 85 N -4.30 0.22 -4.82 1.72 7.64 -1.20 -4.78 113.62 108.10 3dxk n SER 85 Ca 0.05 -0.89 -0.28 0.00 1.01 0.00 0.00 58.87 58.76 3dxk n SER 85 Cb 0.22 -0.11 -0.05 0.00 -1.01 0.00 0.00 64.21 63.26 3dxk n SER 85 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3dxk s PHE 86 N -1.50 3.24 -0.07 1.43 0.40 -0.98 -5.03 117.98 115.46 3dxk s PHE 86 Ca 0.00 0.05 -0.18 0.00 -0.60 0.00 0.00 56.93 56.20 3dxk s PHE 86 Cb 0.00 -1.59 -0.05 0.00 0.51 0.00 0.00 43.02 41.90 3dxk s PHE 86 CO 0.00 0.52 0.48 0.15 0.70 0.00 0.00 175.22 177.08 3dxk s LYS 87 N -2.86 4.25 0.05 0.44 3.01 -1.26 -5.00 119.74 118.37 3dxk s LYS 87 Ca 0.31 0.49 -0.10 0.00 -1.01 0.00 0.00 55.97 55.66 3dxk s LYS 87 Cb -0.11 -3.37 -0.02 0.00 -1.01 0.00 0.00 37.83 33.31 3dxk s LYS 87 CO 0.24 0.31 0.91 0.00 0.51 0.00 0.00 175.35 177.32 3dxk n ALA 88 N 3.10 -0.21 0.70 5.17 0.00 -1.26 0.29 120.51 128.29 3dxk n ALA 88 Ca -0.09 0.28 0.04 0.00 0.00 0.00 0.00 53.44 53.67 3dxk n ALA 88 Cb 0.52 0.15 0.23 0.00 0.00 0.00 0.00 19.45 20.35 3dxk n ALA 88 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dxk n ASN 89 N -3.72 0.00 -0.66 0.00 3.02 -1.26 -2.79 115.26 109.85 3dxk n ASN 89 Ca 0.01 -0.46 0.07 0.00 -0.03 0.00 0.00 54.58 54.17 3dxk n ASN 89 Cb 0.09 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.36 3dxk n ASN 89 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3dxk n ASP 90 N -0.84 2.52 -0.03 6.41 9.92 0.14 -4.63 116.55 130.04 3dxk n ASP 90 Ca 0.06 -1.73 -0.16 0.00 -0.53 0.00 0.00 54.79 52.43 3dxk n ASP 90 Cb 0.03 -0.09 -0.13 0.00 -0.64 0.00 0.00 41.12 40.29 3dxk n ASP 90 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 3dxk h ILE 91 N 2.81 1.66 -0.70 0.53 2.04 -1.54 -3.27 117.51 119.04 3dxk h ILE 91 Ca 0.00 -2.26 0.15 0.00 1.00 0.00 0.00 64.86 63.75 3dxk h ILE 91 Cb 0.67 3.17 -0.12 0.00 -0.74 0.00 0.00 36.82 39.80 3dxk h ILE 91 CO 0.00 0.61 0.05 -0.08 0.00 0.00 0.00 178.15 178.72 3dxk h GLU 92 N -0.71 0.14 0.31 2.37 4.81 -1.82 -1.11 114.58 118.57 3dxk h GLU 92 Ca -0.04 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3dxk h GLU 92 Cb 1.14 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 3dxk h GLU 92 CO 0.05 0.09 -0.27 -0.22 -0.73 0.00 0.00 179.01 177.93 3dxk h LYS 93 N 0.15 -0.58 -0.70 1.92 3.64 -1.86 -2.56 116.57 116.57 3dxk h LYS 93 Ca 0.38 0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.88 3dxk h LYS 93 Cb 0.65 0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 32.54 3dxk h LYS 93 CO -0.58 -0.39 0.37 0.00 -2.27 0.00 0.00 179.45 176.59 3dxk h ALA 94 N -0.01 0.96 0.00 5.00 0.00 -1.39 -2.57 119.26 121.24 3dxk h ALA 94 Ca -0.02 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3dxk h ALA 94 Cb 0.54 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3dxk h ALA 94 CO -0.03 0.01 -0.10 0.28 0.00 0.00 0.00 179.25 179.41 3dxk h VAL 95 N 0.66 0.74 0.00 0.00 2.07 -1.11 -2.15 116.25 116.46 3dxk h VAL 95 Ca 0.33 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.85 3dxk h VAL 95 Cb 0.28 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 3dxk h VAL 95 CO -0.23 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.36 3dxk n GLN 96 N -5.23 0.12 0.00 1.57 6.02 -0.97 -1.48 117.38 117.41 3dxk n GLN 96 Ca -0.06 0.21 0.13 0.00 -0.01 0.00 0.00 57.00 57.27 3dxk n GLN 96 Cb 0.15 -1.50 0.29 0.00 1.02 0.00 0.00 30.24 30.20 3dxk n GLN 96 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 3dxk n SER 97 N -1.29 1.35 -4.94 1.08 3.41 -0.81 -4.90 113.62 107.52 3dxk n SER 97 Ca 0.04 -1.11 -0.25 0.00 -0.26 0.00 0.00 58.87 57.28 3dxk n SER 97 Cb 0.07 0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.20 3dxk n SER 97 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3dxk s LEU 98 N -2.45 4.23 0.48 1.04 1.43 -0.55 -5.11 118.68 117.75 3dxk s LEU 98 Ca 0.24 0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.66 3dxk s LEU 98 Cb 0.19 -3.09 0.01 0.00 0.03 0.00 0.00 46.19 43.33 3dxk s LEU 98 CO 0.52 -0.07 0.70 1.51 0.23 0.00 0.00 176.35 179.24 3dxk s ASP 99 N -3.47 5.64 0.26 2.29 -4.77 -1.26 -4.81 116.67 110.55 3dxk s ASP 99 Ca 0.37 0.17 -0.02 0.00 -3.30 0.00 0.00 52.55 49.77 3dxk s ASP 99 Cb -0.10 -1.30 0.55 0.00 -1.09 0.00 0.00 42.92 40.98 3dxk s ASP 99 CO 0.30 -0.85 1.67 0.11 0.70 0.00 0.00 175.17 177.10 3dxk h LYS 100 N 0.29 0.24 -0.53 2.11 1.79 -1.98 0.50 116.57 118.99 3dxk h LYS 100 Ca -0.45 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.01 3dxk h LYS 100 Cb 1.27 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.84 3dxk h LYS 100 CO 0.55 0.16 0.31 -0.91 -1.08 0.00 0.00 179.45 178.48 3dxk h ASN 101 N 0.24 0.63 -0.36 0.86 2.35 -1.99 0.12 115.58 117.42 3dxk h ASN 101 Ca 0.47 -0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 56.10 3dxk h ASN 101 Cb 0.86 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.06 3dxk h ASN 101 CO -0.58 0.49 -0.12 1.23 -1.65 0.00 0.00 177.43 176.81 3dxk h GLY 102 N 0.78 0.78 0.99 2.83 0.00 -0.49 -1.59 103.07 106.37 3dxk h GLY 102 Ca 0.19 -0.67 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 3dxk h GLY 102 CO -0.04 0.61 0.23 -2.08 0.00 0.00 0.00 176.54 175.26 3dxk h VAL 103 N 0.52 1.12 -0.76 4.60 2.07 -0.12 0.33 116.25 124.00 3dxk h VAL 103 Ca 0.09 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.37 3dxk h VAL 103 Cb 0.64 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 3dxk h VAL 103 CO 0.04 0.12 0.49 0.44 0.02 0.00 0.00 177.57 178.68 3dxk h ASP 104 N 0.49 0.82 -0.45 0.57 3.32 -0.87 -1.09 116.42 119.21 3dxk h ASP 104 Ca 0.13 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 3dxk h ASP 104 Cb -0.01 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 3dxk h ASP 104 CO -0.03 0.58 -0.13 0.25 -1.72 0.00 0.00 179.24 178.19 3dxk h LEU 105 N 0.97 0.89 0.07 1.55 5.85 -0.81 -2.58 115.31 121.24 3dxk h LEU 105 Ca 0.30 -0.37 0.02 0.00 0.84 0.00 0.00 57.88 58.67 3dxk h LEU 105 Cb -0.03 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 3dxk h LEU 105 CO -0.10 1.05 -0.23 0.25 -0.34 0.00 0.00 178.44 179.08 3dxk h LEU 106 N 0.71 -0.65 -1.14 2.25 5.85 0.04 -2.15 115.31 120.22 3dxk h LEU 106 Ca 0.11 0.08 0.21 0.00 0.84 0.00 0.00 57.88 59.13 3dxk h LEU 106 Cb 0.68 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 41.86 3dxk h LEU 106 CO 0.05 -0.31 0.62 -0.03 -0.34 0.00 0.00 178.44 178.43 3dxk h MET 107 N -0.40 0.61 -0.77 1.25 4.05 -1.11 0.20 114.93 118.76 3dxk h MET 107 Ca 0.04 -0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.38 3dxk h MET 107 Cb 0.44 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 31.07 3dxk h MET 107 CO -0.16 0.40 0.30 0.87 0.23 0.00 0.00 176.91 178.55 3dxk h LYS 108 N 0.63 1.16 -0.29 0.39 1.57 -0.98 -2.50 116.57 116.54 3dxk h LYS 108 Ca 0.58 -0.21 -0.13 0.00 -1.87 0.00 0.00 60.65 59.01 3dxk h LYS 108 Cb 1.09 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.21 3dxk h LYS 108 CO -0.35 0.94 -0.34 1.88 -0.57 0.00 0.00 179.45 181.02 3dxk h TYR 109 N 1.12 0.90 -0.57 -1.35 -1.99 -0.37 -2.58 116.97 112.14 3dxk h TYR 109 Ca 0.26 -0.28 0.09 0.00 2.00 0.00 0.00 58.73 60.79 3dxk h TYR 109 Cb 0.23 -0.19 -0.07 0.00 2.00 0.00 0.00 36.73 38.71 3dxk h TYR 109 CO 0.02 1.05 0.20 0.82 -0.00 0.00 0.00 178.16 180.25 3dxk h ILE 110 N 0.50 0.78 0.00 -2.88 2.04 -1.01 0.26 117.51 117.19 3dxk h ILE 110 Ca 0.04 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 3dxk h ILE 110 Cb 0.92 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 3dxk h ILE 110 CO 0.08 0.07 -0.05 1.88 0.00 0.00 0.00 178.15 180.13 3dxk h TYR 111 N 0.38 0.00 0.06 1.37 -1.99 -1.36 -2.00 116.97 113.43 3dxk h TYR 111 Ca 0.28 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.81 3dxk h TYR 111 Cb 0.34 0.00 0.02 0.00 2.00 0.00 0.00 36.73 39.09 3dxk h TYR 111 CO -0.17 0.05 -0.81 -0.22 -0.00 0.00 0.00 178.16 177.00 3dxk h LYS 112 N 0.00 0.45 -0.96 4.88 3.11 -0.23 -3.25 116.57 120.57 3dxk h LYS 112 Ca -0.00 -0.56 0.08 0.00 -2.81 0.00 0.00 60.65 57.36 3dxk h LYS 112 Cb 0.36 0.18 -0.07 0.00 -1.00 0.00 0.00 32.23 31.70 3dxk h LYS 112 CO 0.01 1.21 0.62 0.78 -2.81 0.00 0.00 179.45 179.25 3dxk h GLY 113 N -0.06 1.45 1.36 5.01 0.00 -0.00 -1.23 103.07 109.60 3dxk h GLY 113 Ca -0.12 -0.43 0.03 0.00 0.00 0.00 0.00 47.33 46.82 3dxk h GLY 113 CO 0.16 0.27 0.29 0.74 0.00 0.00 0.00 176.54 177.99 3dxk h PHE 114 N 1.05 0.00 -0.00 5.60 0.05 -1.46 0.89 116.94 123.06 3dxk h PHE 114 Ca 0.43 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.22 3dxk h PHE 114 Cb 0.29 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.24 3dxk h PHE 114 CO -0.00 0.00 -0.12 0.39 -0.18 0.00 0.00 178.31 178.39 3dxk n GLU 115 N -3.24 0.46 -3.14 1.51 1.02 -0.46 -4.19 120.64 112.59 3dxk n GLU 115 Ca 0.00 -0.14 -0.23 0.00 -0.02 0.00 0.00 57.16 56.77 3dxk n GLU 115 Cb 0.38 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.25 3dxk n GLU 115 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3dxk n SER 116 N -1.15 2.43 -4.67 1.62 7.64 0.31 -5.11 113.62 114.69 3dxk n SER 116 Ca 0.12 -3.26 -0.37 0.00 1.01 0.00 0.00 58.87 56.38 3dxk n SER 116 Cb 0.29 -0.61 0.07 0.00 -1.01 0.00 0.00 64.21 62.95 3dxk n SER 116 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3dxk n PRO 117 N 0.38 0.90 -3.87 1.43 -0.02 -1.26 -4.91 135.00 127.67 3dxk n PRO 117 Ca 0.27 0.36 -0.04 0.00 -2.02 0.00 0.00 63.50 62.07 3dxk n PRO 117 Cb 0.51 -2.36 0.02 0.00 -0.02 0.00 0.00 33.50 31.65 3dxk n PRO 117 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3dxk s SER 118 N -1.41 -0.01 -0.27 2.55 1.04 -1.26 -4.99 113.70 109.36 3dxk s SER 118 Ca 0.79 -0.73 -0.02 0.00 0.48 0.00 0.00 55.95 56.47 3dxk s SER 118 Cb -0.38 0.55 -0.09 0.00 0.10 0.00 0.00 66.02 66.20 3dxk s SER 118 CO 0.44 -1.09 1.10 0.47 0.98 0.00 0.00 173.24 175.14 3dxk n ASP 119 N -1.21 -1.46 0.00 7.02 8.00 -1.26 0.11 116.55 127.76 3dxk n ASP 119 Ca -0.04 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.57 3dxk n ASP 119 Cb 0.60 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 3dxk n ASP 119 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3dxk n ASN 120 N 3.85 -0.83 -0.32 -2.24 3.02 -1.26 -4.82 115.26 112.66 3dxk n ASN 120 Ca 0.18 0.00 0.15 0.00 -0.03 0.00 0.00 54.58 54.88 3dxk n ASN 120 Cb 0.30 -1.71 0.38 0.00 -0.61 0.00 0.00 39.78 38.15 3dxk n ASN 120 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3dxk h SER 121 N 0.00 0.67 0.45 6.41 4.64 -0.72 0.93 113.55 125.94 3dxk h SER 121 Ca 0.00 0.08 -0.18 0.00 -0.47 0.00 0.00 61.79 61.21 3dxk h SER 121 Cb 0.11 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3dxk h SER 121 CO 0.00 0.25 -0.78 0.28 -0.87 0.00 0.00 176.83 175.71 3dxk h SER 122 N 0.66 0.31 0.10 4.97 0.02 -1.88 -2.66 113.55 115.07 3dxk h SER 122 Ca 0.54 -0.22 -0.04 0.00 -0.84 0.00 0.00 61.79 61.22 3dxk h SER 122 Cb 0.98 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.42 3dxk h SER 122 CO -0.30 0.98 -0.15 0.00 -1.14 0.00 0.00 176.83 176.21 3dxk h ALA 123 N 1.01 1.61 0.08 3.77 0.00 -1.15 -2.22 119.26 122.35 3dxk h ALA 123 Ca -0.03 -0.18 -0.32 0.00 0.00 0.00 0.00 54.91 54.37 3dxk h ALA 123 Cb 1.37 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 3dxk h ALA 123 CO 0.12 0.29 -1.76 -0.24 0.00 0.00 0.00 179.25 177.66 3dxk h VAL 124 N 0.11 0.85 -0.44 0.00 3.04 -1.48 -3.33 116.25 115.00 3dxk h VAL 124 Ca 0.02 -2.60 0.05 0.00 -1.01 0.00 0.00 66.70 63.16 3dxk h VAL 124 Cb 0.34 2.54 -0.02 0.00 -2.01 0.00 0.00 31.29 32.14 3dxk h VAL 124 CO 0.02 0.73 0.29 -0.07 -1.01 0.00 0.00 177.57 177.53 3dxk h LEU 125 N 0.04 0.35 0.00 3.16 3.38 -1.27 0.42 115.31 121.39 3dxk h LEU 125 Ca -0.32 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 3dxk h LEU 125 Cb 2.02 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.69 3dxk h LEU 125 CO 0.10 0.23 0.00 0.18 0.09 0.00 0.00 178.44 179.05 3dxk n LEU 126 N -4.48 0.00 -0.04 1.67 4.77 -0.85 -0.96 117.00 117.10 3dxk n LEU 126 Ca 0.05 0.32 -0.19 0.00 -0.03 0.00 0.00 56.01 56.16 3dxk n LEU 126 Cb 0.21 -0.32 -0.13 0.00 -2.33 0.00 0.00 43.42 40.84 3dxk n LEU 126 CO 0.35 -0.15 -0.98 0.00 -1.33 0.00 0.00 177.39 175.28 3dxk n GLN 127 N -1.32 0.72 -0.19 3.23 1.13 0.14 -2.96 117.38 118.13 3dxk n GLN 127 Ca 0.07 0.22 -0.08 0.00 -1.94 0.00 0.00 57.00 55.27 3dxk n GLN 127 Cb 0.14 -1.65 0.06 0.00 0.11 0.00 0.00 30.24 28.89 3dxk n GLN 127 CO 0.00 0.00 0.00 -1.49 -1.44 0.00 0.00 177.06 174.13 3dxk h TRP 128 N 0.04 1.10 -0.06 1.08 4.06 -0.85 -1.42 115.95 119.91 3dxk h TRP 128 Ca -0.47 -0.18 -0.00 0.00 2.06 0.00 0.00 58.89 60.29 3dxk h TRP 128 Cb 2.00 -0.29 -0.00 0.00 -1.00 0.00 0.00 29.16 29.86 3dxk h TRP 128 CO 0.06 0.98 0.03 1.25 -3.56 0.00 0.00 178.44 177.19 3dxk h HIS 129 N 0.93 0.09 -0.57 0.49 2.76 -1.19 0.43 115.15 118.09 3dxk h HIS 129 Ca 0.17 -0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.42 3dxk h HIS 129 Cb 0.54 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 29.40 3dxk h HIS 129 CO 0.04 0.19 0.18 1.49 -1.30 0.00 0.00 177.93 178.53 3dxk h GLU 130 N -0.04 0.33 -0.08 5.26 4.81 -1.39 -0.18 114.58 123.29 3dxk h GLU 130 Ca 0.02 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 3dxk h GLU 130 Cb 0.14 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 3dxk h GLU 130 CO -0.00 0.22 -0.12 0.87 -0.73 0.00 0.00 179.01 179.24 3dxk h LYS 131 N 0.34 0.22 -0.89 1.92 6.56 -0.96 -3.08 116.57 120.68 3dxk h LYS 131 Ca 0.29 -0.13 0.06 0.00 -1.06 0.00 0.00 60.65 59.80 3dxk h LYS 131 Cb 0.36 0.01 -0.06 0.00 -0.57 0.00 0.00 32.23 31.98 3dxk h LYS 131 CO -0.31 0.70 0.58 0.00 -2.06 0.00 0.00 179.45 178.36 3dxk h ALA 132 N 0.52 1.51 -0.54 3.86 0.00 0.06 -2.35 119.26 122.32 3dxk h ALA 132 Ca 0.01 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 3dxk h ALA 132 Cb 0.68 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3dxk h ALA 132 CO 0.03 0.37 -0.10 1.25 0.00 0.00 0.00 179.25 180.79 3dxk h LEU 133 N 1.03 1.01 -1.96 0.00 5.85 -1.07 0.16 115.31 120.32 3dxk h LEU 133 Ca 0.38 -0.33 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3dxk h LEU 133 Cb 0.17 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.92 3dxk h LEU 133 CO -0.14 1.11 -0.11 0.00 -0.34 0.00 0.00 178.44 178.97 3dxk h ALA 134 N 0.97 1.29 0.01 1.25 0.00 -1.33 0.63 119.26 122.09 3dxk h ALA 134 Ca 0.14 -0.10 -0.30 0.00 0.00 0.00 0.00 54.91 54.65 3dxk h ALA 134 Cb 0.66 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 3dxk h ALA 134 CO 0.05 0.13 -1.67 0.00 0.00 0.00 0.00 179.25 177.76 3dxk n ALA 135 N -2.28 0.91 0.39 0.00 0.00 -1.01 -4.47 120.51 114.05 3dxk n ALA 135 Ca -0.02 -0.65 0.12 0.00 0.00 0.00 0.00 53.44 52.89 3dxk n ALA 135 Cb 0.23 -0.41 0.14 0.00 0.00 0.00 0.00 19.45 19.41 3dxk n ALA 135 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3dxk h GLY 136 N -0.67 0.00 -1.12 0.00 0.00 -0.69 -3.51 103.07 97.09 3dxk h GLY 136 Ca -0.44 0.00 0.13 0.00 0.00 0.00 0.00 47.33 47.01 3dxk h GLY 136 CO -0.22 0.00 -0.27 0.61 0.00 0.00 0.00 176.54 176.66 3dxk n GLY 137 N 1.25 -2.00 0.30 4.60 0.00 0.22 -3.30 105.19 106.27 3dxk n GLY 137 Ca 0.03 -1.38 0.14 0.00 0.00 0.00 0.00 46.02 44.81 3dxk n GLY 137 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3dxk h VAL 138 N -0.46 0.64 -0.88 1.61 3.04 -1.96 -2.41 116.25 115.83 3dxk h VAL 138 Ca -0.02 0.00 0.15 0.00 -1.01 0.00 0.00 66.70 65.82 3dxk h VAL 138 Cb 0.45 0.95 -0.10 0.00 -2.01 0.00 0.00 31.29 30.59 3dxk h VAL 138 CO 0.01 0.00 0.47 1.23 -1.01 0.00 0.00 177.57 178.27 3dxk h GLY 139 N 0.00 1.45 1.22 3.17 0.00 -1.95 -1.18 103.07 105.77 3dxk h GLY 139 Ca 0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 3dxk h GLY 139 CO -0.00 -0.04 0.28 1.48 0.00 0.00 0.00 176.54 178.26 3dxk h SER 140 N 0.65 0.91 -0.42 0.19 4.64 -1.42 -1.94 113.55 116.16 3dxk h SER 140 Ca 0.48 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.65 3dxk h SER 140 Cb 0.69 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 3dxk h SER 140 CO -0.37 0.81 0.16 0.40 -0.87 0.00 0.00 176.83 176.97 3dxk h ILE 141 N 0.98 1.20 -0.71 0.95 2.04 -1.38 -2.40 117.51 118.19 3dxk h ILE 141 Ca 0.23 -0.63 0.14 0.00 1.00 0.00 0.00 64.86 65.60 3dxk h ILE 141 Cb 0.18 0.83 -0.09 0.00 -0.74 0.00 0.00 36.82 36.99 3dxk h ILE 141 CO -0.02 0.23 0.24 0.58 0.00 0.00 0.00 178.15 179.18 3dxk h VAL 142 N 0.53 0.64 0.00 1.67 2.07 -0.75 0.35 116.25 120.76 3dxk h VAL 142 Ca 0.14 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.53 3dxk h VAL 142 Cb 0.20 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 3dxk h VAL 142 CO -0.01 0.07 0.00 0.54 0.02 0.00 0.00 177.57 178.19 3dxk n ARG 143 N -5.05 0.01 0.01 1.57 1.74 -0.79 -0.84 116.66 113.31 3dxk n ARG 143 Ca 0.13 0.30 -0.20 0.00 -0.77 0.00 0.00 57.85 57.31 3dxk n ARG 143 Cb 0.39 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.20 3dxk n ARG 143 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3dxk h VAL 144 N 0.00 1.24 0.00 1.55 2.07 -0.08 -3.04 116.25 118.00 3dxk h VAL 144 Ca 0.00 -2.42 -0.06 0.00 0.82 0.00 0.00 66.70 65.04 3dxk h VAL 144 Cb 0.18 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 32.83 3dxk h VAL 144 CO 0.00 0.67 -0.28 -0.07 0.02 0.00 0.00 177.57 177.91 3dxk h LEU 145 N -0.44 0.00 0.00 2.57 3.38 -0.69 -3.22 115.31 116.91 3dxk h LEU 145 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3dxk h LEU 145 Cb 1.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.37 3dxk h LEU 145 CO 0.06 0.28 -0.76 0.35 0.09 0.00 0.00 178.44 178.46 3dxk n THR 146 N -3.69 0.10 -2.10 0.22 -2.24 -0.02 -4.95 114.28 101.59 3dxk n THR 146 Ca -0.01 -0.12 -0.42 0.00 -2.27 0.00 0.00 64.05 61.23 3dxk n THR 146 Cb 0.39 0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.89 3dxk n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dxk s ALA 147 N -3.09 3.63 -0.09 6.98 0.00 -1.15 -4.92 121.76 123.13 3dxk s ALA 147 Ca 0.08 1.10 0.04 0.00 0.00 0.00 0.00 51.96 53.17 3dxk s ALA 147 Cb 0.16 -3.60 -0.24 0.00 0.00 0.00 0.00 23.12 19.43 3dxk s ALA 147 CO 0.76 -0.84 0.48 0.54 0.00 0.00 0.00 175.76 176.70 3dxk n ARG 148 N 4.79 0.69 -3.59 0.00 5.12 -1.26 -4.61 116.66 117.80 3dxk n ARG 148 Ca 0.13 0.26 -0.40 0.00 -1.93 0.00 0.00 57.85 55.91 3dxk n ARG 148 Cb 0.42 -1.74 -0.09 0.00 -1.16 0.00 0.00 32.46 29.89 3dxk n ARG 148 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3dxk s LYS 149 N -2.57 2.53 0.37 5.56 3.01 -1.26 -5.07 119.74 122.31 3dxk s LYS 149 Ca -0.13 -1.59 0.05 0.00 -1.01 0.00 0.00 55.97 53.29 3dxk s LYS 149 Cb 0.07 -3.83 -0.07 0.00 -1.01 0.00 0.00 37.83 32.99 3dxk s LYS 149 CO 0.79 -1.05 0.04 -0.08 0.51 0.00 0.00 175.35 175.56 3dxk s THR 150 N 1.39 1.57 -2.00 2.17 -1.32 -1.26 -4.95 115.64 111.24 3dxk s THR 150 Ca 0.04 -2.00 0.14 0.00 -1.21 0.00 0.00 61.69 58.66 3dxk s THR 150 Cb -0.24 -2.88 0.39 0.00 -1.51 0.00 0.00 72.50 68.26 3dxk s THR 150 CO 0.01 0.00 1.24 1.33 -2.21 0.00 0.00 174.62 174.99