#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dk2 n SER 2 N 0.00 1.93 -3.34 1.61 2.88 -1.26 -4.91 113.62 110.53 2dk2 n SER 2 Ca 0.00 -0.05 -0.13 0.00 -1.33 0.00 0.00 58.87 57.35 2dk2 n SER 2 Cb 0.00 0.26 -0.07 0.00 -0.75 0.00 0.00 64.21 63.65 2dk2 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dk2 s SER 3 N -5.37 0.81 0.32 -3.46 0.01 -1.26 -5.11 113.70 99.64 2dk2 s SER 3 Ca -0.17 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.05 2dk2 s SER 3 Cb 0.06 0.82 0.00 0.00 0.21 0.00 0.00 66.02 67.11 2dk2 s SER 3 CO 0.53 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.48 2dk2 n GLY 4 N 4.75 0.58 3.47 3.44 0.00 -1.26 -4.88 105.19 111.29 2dk2 n GLY 4 Ca 0.06 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 2dk2 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dk2 n SER 5 N 4.44 -1.48 -4.07 1.61 3.41 -1.26 -3.91 113.62 112.35 2dk2 n SER 5 Ca 0.00 0.26 -0.41 0.00 -0.26 0.00 0.00 58.87 58.46 2dk2 n SER 5 Cb 0.00 -1.25 -0.01 0.00 -0.26 0.00 0.00 64.21 62.69 2dk2 n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2dk2 n SER 6 N -2.38 5.63 -2.70 4.04 7.64 -1.26 -4.57 113.62 120.02 2dk2 n SER 6 Ca 0.07 -3.26 -0.04 0.00 1.01 0.00 0.00 58.87 56.65 2dk2 n SER 6 Cb 0.54 -1.22 0.03 0.00 -1.01 0.00 0.00 64.21 62.55 2dk2 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dk2 n GLY 7 N 1.83 -1.29 3.29 0.23 0.00 -1.26 -5.02 105.19 102.96 2dk2 n GLY 7 Ca 0.25 0.97 -0.18 0.00 0.00 0.00 0.00 46.02 47.06 2dk2 n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dk2 s ASP 8 N 0.74 2.28 0.21 1.61 1.11 -1.26 -5.05 116.67 116.30 2dk2 s ASP 8 Ca 0.26 -0.92 -0.03 0.00 0.18 0.00 0.00 52.55 52.05 2dk2 s ASP 8 Cb 0.10 -0.10 0.17 0.00 1.07 0.00 0.00 42.92 44.16 2dk2 s ASP 8 CO -0.09 -0.16 1.57 1.55 1.18 0.00 0.00 175.17 179.21 2dk2 h PRO 9 N 3.06 0.61 0.00 8.23 0.13 -2.02 -2.97 132.00 139.04 2dk2 h PRO 9 Ca -0.39 -0.32 -0.04 0.00 -0.87 0.00 0.00 66.00 64.38 2dk2 h PRO 9 Cb 1.20 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2dk2 h PRO 9 CO 0.56 0.92 -0.18 0.93 -0.23 0.00 0.00 178.00 180.00 2dk2 h GLU 10 N 0.50 0.00 0.47 0.86 5.08 -1.97 -1.76 114.58 117.76 2dk2 h GLU 10 Ca 0.04 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2dk2 h GLU 10 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 2dk2 h GLU 10 CO 0.08 0.18 -0.23 0.28 -1.00 0.00 0.00 179.01 178.33 2dk2 h VAL 11 N 0.00 0.00 -0.24 3.13 2.07 -1.95 -0.78 116.25 118.48 2dk2 h VAL 11 Ca -0.00 -0.32 0.07 0.00 0.82 0.00 0.00 66.70 67.27 2dk2 h VAL 11 Cb 0.35 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2dk2 h VAL 11 CO 0.02 0.00 0.20 0.24 0.02 0.00 0.00 177.57 178.05 2dk2 h MET 12 N -0.95 0.00 0.00 1.57 2.86 -1.53 0.11 114.93 116.99 2dk2 h MET 12 Ca -0.06 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.47 2dk2 h MET 12 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 2dk2 h MET 12 CO 0.11 0.00 -0.50 0.00 1.06 0.00 0.00 176.91 177.58 2dk2 h ALA 13 N 1.83 0.72 -0.81 6.32 0.00 -1.29 -3.23 119.26 122.80 2dk2 h ALA 13 Ca 0.11 -0.45 0.23 0.00 0.00 0.00 0.00 54.91 54.81 2dk2 h ALA 13 Cb 0.51 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2dk2 h ALA 13 CO -0.00 0.62 0.58 -0.22 0.00 0.00 0.00 179.25 180.23 2dk2 h LYS 14 N 0.00 0.01 -6.93 0.00 3.64 0.77 -3.43 116.57 110.63 2dk2 h LYS 14 Ca -0.00 -0.00 -0.50 0.00 -1.27 0.00 0.00 60.65 58.88 2dk2 h LYS 14 Cb 1.31 -0.00 0.22 0.00 -0.41 0.00 0.00 32.23 33.34 2dk2 h LYS 14 CO 0.06 0.00 -0.40 1.33 -2.27 0.00 0.00 179.45 178.18 2dk2 n VAL 15 N -4.30 0.00 -1.70 2.00 0.24 -1.22 -4.73 118.33 108.62 2dk2 n VAL 15 Ca 0.17 -0.21 0.06 0.00 -2.04 0.00 0.00 64.34 62.32 2dk2 n VAL 15 Cb 0.88 -0.77 0.16 0.00 -1.47 0.00 0.00 33.84 32.64 2dk2 n VAL 15 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2dk2 n LYS 16 N -2.91 1.21 -3.69 7.34 2.85 -1.26 -4.62 118.16 117.07 2dk2 n LYS 16 Ca 0.06 -2.89 -0.23 0.00 -1.05 0.00 0.00 58.31 54.20 2dk2 n LYS 16 Cb 0.55 -1.27 -0.17 0.00 -0.65 0.00 0.00 35.03 33.48 2dk2 n LYS 16 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2dk2 s VAL 17 N -2.49 0.12 -0.24 0.58 1.01 -1.26 -3.85 120.40 114.27 2dk2 s VAL 17 Ca 0.35 0.07 -0.13 0.00 0.00 0.00 0.00 61.98 62.27 2dk2 s VAL 17 Cb 0.35 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 36.21 2dk2 s VAL 17 CO -0.07 0.04 0.29 -0.76 0.00 0.00 0.00 175.10 174.60 2dk2 s LEU 18 N 2.06 4.10 -0.71 3.92 1.43 -1.26 -2.70 118.68 125.53 2dk2 s LEU 18 Ca 0.04 0.27 -0.21 0.00 -1.03 0.00 0.00 54.13 53.19 2dk2 s LEU 18 Cb -0.14 -2.31 0.09 0.00 0.03 0.00 0.00 46.19 43.86 2dk2 s LEU 18 CO -0.06 -0.05 0.96 0.12 0.23 0.00 0.00 176.35 177.56 2dk2 s PHE 19 N 1.44 2.82 -0.42 0.29 5.36 -0.45 -4.29 117.98 122.72 2dk2 s PHE 19 Ca 0.13 -0.80 -0.23 0.00 -0.96 0.00 0.00 56.93 55.07 2dk2 s PHE 19 Cb -0.15 -4.25 0.02 0.00 -0.34 0.00 0.00 43.02 38.30 2dk2 s PHE 19 CO 0.08 -1.56 0.79 0.08 -1.46 0.00 0.00 175.22 173.14 2dk2 s VAL 20 N 3.56 4.67 0.31 3.12 1.01 -1.24 -1.25 120.40 130.58 2dk2 s VAL 20 Ca 0.23 0.58 0.07 0.00 0.00 0.00 0.00 61.98 62.86 2dk2 s VAL 20 Cb -0.15 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 31.92 2dk2 s VAL 20 CO 0.05 -0.63 0.36 -0.13 0.00 0.00 0.00 175.10 174.75 2dk2 s ARG 21 N 3.25 3.01 -0.56 2.72 1.81 0.15 -1.52 118.95 127.80 2dk2 s ARG 21 Ca 0.31 -1.08 -0.11 0.00 -1.72 0.00 0.00 55.73 53.13 2dk2 s ARG 21 Cb -0.12 -2.69 0.01 0.00 -0.45 0.00 0.00 34.95 31.71 2dk2 s ARG 21 CO 0.21 0.16 0.64 0.09 -0.68 0.00 0.00 175.30 175.72 2dk2 n ASN 22 N -1.47 -7.60 -4.95 0.23 4.13 -1.18 -0.79 115.26 103.63 2dk2 n ASN 22 Ca -0.03 0.20 -0.23 0.00 1.68 0.00 0.00 54.58 56.20 2dk2 n ASN 22 Cb 0.58 -4.96 0.02 0.00 -1.54 0.00 0.00 39.78 33.89 2dk2 n ASN 22 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2dk2 s LEU 23 N -3.22 2.89 0.04 3.41 1.02 -0.46 -3.92 118.68 118.45 2dk2 s LEU 23 Ca 0.15 -1.06 -0.03 0.00 0.02 0.00 0.00 54.13 53.21 2dk2 s LEU 23 Cb -0.04 -1.41 -0.04 0.00 0.02 0.00 0.00 46.19 44.72 2dk2 s LEU 23 CO 0.78 -1.18 0.24 0.00 0.02 0.00 0.00 176.35 176.21 2dk2 s ALA 24 N -2.71 3.92 -0.15 4.21 0.00 -1.26 -5.01 121.76 120.75 2dk2 s ALA 24 Ca 0.46 -0.70 0.17 0.00 0.00 0.00 0.00 51.96 51.88 2dk2 s ALA 24 Cb -0.04 -1.96 -0.03 0.00 0.00 0.00 0.00 23.12 21.09 2dk2 s ALA 24 CO 0.28 0.73 1.11 1.15 0.00 0.00 0.00 175.76 179.04 2dk2 h THR 25 N 2.56 0.59 0.00 0.00 2.02 -1.99 -3.32 112.91 112.77 2dk2 h THR 25 Ca -0.48 -1.98 -0.20 0.00 0.77 0.00 0.00 66.41 64.52 2dk2 h THR 25 Cb 1.18 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 69.71 2dk2 h THR 25 CO 0.71 0.34 -0.97 0.71 0.37 0.00 0.00 175.52 176.67 2dk2 h THR 26 N 0.00 1.70 -4.18 3.16 1.35 -1.99 -3.46 112.91 109.49 2dk2 h THR 26 Ca -0.08 -3.35 -0.50 0.00 -0.55 0.00 0.00 66.41 61.93 2dk2 h THR 26 Cb 1.44 2.81 0.15 0.00 -1.73 0.00 0.00 68.15 70.82 2dk2 h THR 26 CO 0.05 0.96 0.26 0.68 -0.25 0.00 0.00 175.52 177.21 2dk2 s VAL 27 N -2.76 2.79 0.23 6.82 -7.23 -1.25 -5.07 120.40 113.93 2dk2 s VAL 27 Ca 0.01 0.26 0.04 0.00 -1.81 0.00 0.00 61.98 60.47 2dk2 s VAL 27 Cb 0.10 -2.61 -0.05 0.00 0.56 0.00 0.00 36.38 34.38 2dk2 s VAL 27 CO 0.82 -0.33 -0.01 0.28 -0.31 0.00 0.00 175.10 175.54 2dk2 s THR 28 N -2.83 1.08 0.56 5.32 -1.32 -1.26 -4.98 115.64 112.21 2dk2 s THR 28 Ca 0.63 -2.04 0.27 0.00 -1.21 0.00 0.00 61.69 59.34 2dk2 s THR 28 Cb -0.19 -2.34 0.38 0.00 -1.51 0.00 0.00 72.50 68.84 2dk2 s THR 28 CO 0.57 -0.33 2.01 -0.33 -2.21 0.00 0.00 174.62 174.33 2dk2 h GLU 29 N 2.46 0.00 -0.48 7.08 5.08 -1.98 0.67 114.58 127.41 2dk2 h GLU 29 Ca -0.38 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.89 2dk2 h GLU 29 Cb 1.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 2dk2 h GLU 29 CO 0.65 0.00 -0.05 1.49 -1.00 0.00 0.00 179.01 180.10 2dk2 h GLU 30 N 0.00 0.82 0.07 2.33 4.81 -1.99 -1.56 114.58 119.06 2dk2 h GLU 30 Ca 0.19 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2dk2 h GLU 30 Cb 0.87 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2dk2 h GLU 30 CO -0.00 0.86 -0.03 0.82 -0.73 0.00 0.00 179.01 179.92 2dk2 h ILE 31 N 0.76 0.99 -0.98 2.32 2.04 -1.29 -2.97 117.51 118.38 2dk2 h ILE 31 Ca 0.14 -1.50 0.17 0.00 1.00 0.00 0.00 64.86 64.67 2dk2 h ILE 31 Cb 0.52 1.79 -0.10 0.00 -0.74 0.00 0.00 36.82 38.29 2dk2 h ILE 31 CO 0.03 0.30 0.58 -0.07 0.00 0.00 0.00 178.15 179.00 2dk2 h LEU 32 N -0.92 0.77 -0.87 1.44 3.38 -1.42 0.12 115.31 117.81 2dk2 h LEU 32 Ca -0.01 0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 2dk2 h LEU 32 Cb 0.57 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2dk2 h LEU 32 CO 0.02 0.31 0.06 -0.33 0.09 0.00 0.00 178.44 178.59 2dk2 h GLU 33 N 0.78 0.91 0.00 1.13 5.08 -1.37 -2.42 114.58 118.69 2dk2 h GLU 33 Ca 0.54 -0.23 -0.09 0.00 -1.00 0.00 0.00 59.36 58.59 2dk2 h GLU 33 Cb 0.78 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2dk2 h GLU 33 CO -0.36 0.86 -0.41 -0.22 -1.00 0.00 0.00 179.01 177.88 2dk2 h LYS 34 N 0.85 0.00 -0.24 2.33 1.63 -0.70 0.24 116.57 120.68 2dk2 h LYS 34 Ca 0.17 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.85 2dk2 h LYS 34 Cb 0.41 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 2dk2 h LYS 34 CO 0.01 0.41 -0.37 0.77 -3.45 0.00 0.00 179.45 176.82 2dk2 h SER 35 N 0.00 0.58 0.24 4.20 0.02 -0.42 -3.11 113.55 115.05 2dk2 h SER 35 Ca -0.00 -0.24 -0.34 0.00 -0.84 0.00 0.00 61.79 60.37 2dk2 h SER 35 Cb 1.00 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.32 2dk2 h SER 35 CO 0.05 0.90 -2.05 0.49 -1.14 0.00 0.00 176.83 175.08 2dk2 n PHE 36 N -4.05 0.58 0.15 3.45 3.72 -1.07 -4.14 117.46 116.11 2dk2 n PHE 36 Ca -0.01 0.19 0.18 0.00 -0.05 0.00 0.00 57.45 57.76 2dk2 n PHE 36 Cb 0.49 -1.10 0.78 0.00 -0.94 0.00 0.00 39.48 38.72 2dk2 n PHE 36 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2dk2 h SER 37 N 0.01 0.00 0.66 4.37 0.87 -0.54 0.24 113.55 119.16 2dk2 h SER 37 Ca -0.42 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.08 2dk2 h SER 37 Cb 2.09 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 64.04 2dk2 h SER 37 CO 0.05 0.00 -0.30 1.05 -0.53 0.00 0.00 176.83 177.10 2dk2 h GLU 38 N 0.00 0.00 0.00 2.24 -0.00 -1.70 -3.24 114.58 111.88 2dk2 h GLU 38 Ca 0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 59.36 59.42 2dk2 h GLU 38 Cb 0.67 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.41 2dk2 h GLU 38 CO -0.00 0.30 -0.40 0.74 -0.00 0.00 0.00 179.01 179.65 2dk2 h PHE 39 N 0.00 0.00 -2.48 2.06 0.04 -0.76 -3.50 116.94 112.31 2dk2 h PHE 39 Ca -0.00 0.00 0.11 0.00 2.80 0.00 0.00 57.97 60.87 2dk2 h PHE 39 Cb 0.71 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.75 2dk2 h PHE 39 CO 0.00 1.05 0.42 0.20 -0.60 0.00 0.00 178.31 179.38 2dk2 s GLY 40 N -4.37 -0.39 -0.10 -1.45 0.00 -0.96 -5.00 107.32 95.06 2dk2 s GLY 40 Ca -0.21 0.54 -0.35 0.00 0.00 0.00 0.00 44.72 44.70 2dk2 s GLY 40 CO 0.60 0.17 1.84 0.28 0.00 0.00 0.00 173.10 175.98 2dk2 n LYS 41 N -0.36 2.03 -2.37 2.90 4.76 -1.26 -4.23 118.16 119.63 2dk2 n LYS 41 Ca -0.09 0.74 -0.25 0.00 -2.87 0.00 0.00 58.31 55.84 2dk2 n LYS 41 Cb 0.62 -2.56 0.05 0.00 -1.84 0.00 0.00 35.03 31.30 2dk2 n LYS 41 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2dk2 s LEU 42 N 3.75 3.04 -0.15 -0.35 1.43 -1.26 -3.14 118.68 122.01 2dk2 s LEU 42 Ca 0.92 0.41 -0.07 0.00 -1.03 0.00 0.00 54.13 54.37 2dk2 s LEU 42 Cb -0.75 -3.16 -0.07 0.00 0.03 0.00 0.00 46.19 42.24 2dk2 s LEU 42 CO 0.53 -1.34 -0.19 1.21 0.23 0.00 0.00 176.35 176.79 2dk2 n GLU 43 N -2.69 0.32 -3.64 1.70 2.13 0.84 -4.67 120.64 114.63 2dk2 n GLU 43 Ca 0.07 0.13 -0.03 0.00 0.66 0.00 0.00 57.16 57.99 2dk2 n GLU 43 Cb 0.59 -1.04 -0.06 0.00 0.27 0.00 0.00 31.44 31.20 2dk2 n GLU 43 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2dk2 s ARG 44 N -2.27 0.09 0.11 5.31 3.00 -1.24 -4.94 118.95 119.00 2dk2 s ARG 44 Ca -0.21 0.07 0.09 0.00 -1.00 0.00 0.00 55.73 54.69 2dk2 s ARG 44 Cb 0.08 0.04 -0.04 0.00 0.00 0.00 0.00 34.95 35.03 2dk2 s ARG 44 CO 0.27 -0.02 -0.23 0.08 0.00 0.00 0.00 175.30 175.39 2dk2 s VAL 45 N -0.31 1.92 -0.07 7.11 1.01 -1.26 -0.67 120.40 128.14 2dk2 s VAL 45 Ca 0.07 -1.60 -0.05 0.00 0.00 0.00 0.00 61.98 60.41 2dk2 s VAL 45 Cb -0.04 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.65 2dk2 s VAL 45 CO -0.13 0.03 0.17 -0.75 0.00 0.00 0.00 175.10 174.42 2dk2 s LYS 46 N -1.89 0.17 -0.63 2.72 2.47 -0.32 -4.98 119.74 117.27 2dk2 s LYS 46 Ca 0.09 0.29 -0.22 0.00 -1.56 0.00 0.00 55.97 54.58 2dk2 s LYS 46 Cb -0.10 0.00 0.07 0.00 -1.46 0.00 0.00 37.83 36.34 2dk2 s LYS 46 CO 0.05 -0.07 0.91 0.21 0.16 0.00 0.00 175.35 176.60 2dk2 s LYS 47 N 0.48 3.12 -0.23 4.03 2.20 -1.26 -1.35 119.74 126.73 2dk2 s LYS 47 Ca -0.03 -0.84 0.01 0.00 -0.36 0.00 0.00 55.97 54.75 2dk2 s LYS 47 Cb -0.05 -4.21 0.06 0.00 -1.51 0.00 0.00 37.83 32.12 2dk2 s LYS 47 CO -0.02 -1.72 -0.06 -0.51 -0.36 0.00 0.00 175.35 172.68 2dk2 s LEU 48 N 3.80 2.61 0.00 5.43 2.01 -1.14 -5.03 118.68 126.37 2dk2 s LEU 48 Ca 0.21 -1.17 0.00 0.00 0.01 0.00 0.00 54.13 53.19 2dk2 s LEU 48 Cb -0.17 -1.21 0.00 0.00 0.01 0.00 0.00 46.19 44.81 2dk2 s LEU 48 CO 0.11 -0.22 0.00 1.17 1.01 0.00 0.00 176.35 178.41 2dk2 n LYS 49 N 4.65 0.00 0.20 1.70 3.00 -1.26 -2.88 118.16 123.57 2dk2 n LYS 49 Ca -0.12 0.00 0.14 0.00 -0.00 0.00 0.00 58.31 58.32 2dk2 n LYS 49 Cb 0.44 0.00 0.71 0.00 0.00 0.00 0.00 35.03 36.18 2dk2 n LYS 49 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 2dk2 h ASP 50 N 0.00 0.00 -4.93 3.14 3.32 -1.96 -3.43 116.42 112.56 2dk2 h ASP 50 Ca 0.00 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.77 2dk2 h ASP 50 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2dk2 h ASP 50 CO 0.00 0.00 -0.10 0.00 -1.72 0.00 0.00 179.24 177.42 2dk2 n TYR 51 N -2.45 -1.60 -3.94 4.55 0.18 -1.14 -1.35 117.16 111.41 2dk2 n TYR 51 Ca -0.01 -1.16 -0.09 0.00 1.88 0.00 0.00 57.90 58.52 2dk2 n TYR 51 Cb 0.07 -0.25 -0.09 0.00 -0.38 0.00 0.00 39.34 38.70 2dk2 n TYR 51 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2dk2 s ALA 52 N -2.39 -0.00 -0.30 -3.48 0.00 -0.58 -2.88 121.76 112.14 2dk2 s ALA 52 Ca 0.21 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.46 2dk2 s ALA 52 Cb -0.02 0.35 0.07 0.00 0.00 0.00 0.00 23.12 23.53 2dk2 s ALA 52 CO 0.14 -0.41 -0.03 -0.06 0.00 0.00 0.00 175.76 175.39 2dk2 s PHE 53 N -3.46 3.40 0.01 0.00 0.08 -0.46 -3.68 117.98 113.86 2dk2 s PHE 53 Ca 0.02 -2.38 0.06 0.00 0.12 0.00 0.00 56.93 54.75 2dk2 s PHE 53 Cb 0.04 -2.27 -0.03 0.00 -0.57 0.00 0.00 43.02 40.18 2dk2 s PHE 53 CO -0.09 -0.88 -0.18 0.08 -0.10 0.00 0.00 175.22 174.05 2dk2 s VAL 54 N 1.09 2.79 0.18 -0.44 1.01 -1.26 -1.17 120.40 122.60 2dk2 s VAL 54 Ca -0.03 -1.04 0.08 0.00 0.00 0.00 0.00 61.98 61.00 2dk2 s VAL 54 Cb -0.20 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 2dk2 s VAL 54 CO -0.05 0.44 -0.07 -1.00 0.00 0.00 0.00 175.10 174.43 2dk2 s HIS 55 N -0.83 2.69 0.12 5.22 3.76 0.15 -4.01 115.29 122.39 2dk2 s HIS 55 Ca 0.13 -0.20 0.06 0.00 -0.15 0.00 0.00 55.06 54.91 2dk2 s HIS 55 Cb -0.10 -1.31 -0.04 0.00 1.11 0.00 0.00 32.58 32.24 2dk2 s HIS 55 CO 0.03 0.52 -0.15 -0.06 -0.85 0.00 0.00 174.74 174.22 2dk2 s PHE 56 N -1.73 1.48 0.58 1.40 0.40 -1.25 -0.11 117.98 118.75 2dk2 s PHE 56 Ca 0.26 -0.51 0.28 0.00 -0.60 0.00 0.00 56.93 56.35 2dk2 s PHE 56 Cb -0.09 -0.78 1.55 0.00 0.51 0.00 0.00 43.02 44.21 2dk2 s PHE 56 CO 0.16 0.17 2.02 1.49 0.70 0.00 0.00 175.22 179.76 2dk2 h GLU 57 N 3.65 0.00 0.00 0.44 4.81 -1.81 -3.45 114.58 118.22 2dk2 h GLU 57 Ca -0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 2dk2 h GLU 57 Cb 1.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2dk2 h GLU 57 CO 0.48 0.00 0.01 -3.47 -0.73 0.00 0.00 179.01 175.29 2dk2 n ASP 58 N -3.90 -0.03 0.13 1.04 2.03 -1.26 -5.06 116.55 109.50 2dk2 n ASP 58 Ca 0.05 -1.02 -0.24 0.00 0.52 0.00 0.00 54.79 54.09 2dk2 n ASP 58 Cb 0.47 0.06 -0.16 0.00 -0.72 0.00 0.00 41.12 40.77 2dk2 n ASP 58 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2dk2 h ARG 59 N 0.00 0.51 -0.86 -0.67 1.12 -1.85 -3.27 114.38 109.37 2dk2 h ARG 59 Ca -0.01 -0.88 0.15 0.00 -1.11 0.00 0.00 59.98 58.14 2dk2 h ARG 59 Cb 0.02 0.33 -0.06 0.00 -0.01 0.00 0.00 29.97 30.24 2dk2 h ARG 59 CO 0.01 1.42 0.56 0.78 -3.11 0.00 0.00 179.97 179.63 2dk2 h GLY 60 N 0.11 1.03 2.00 2.80 0.00 -1.92 0.24 103.07 107.34 2dk2 h GLY 60 Ca -0.25 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 46.75 2dk2 h GLY 60 CO 0.26 0.07 -0.36 0.00 0.00 0.00 0.00 176.54 176.50 2dk2 h ALA 61 N 1.61 0.92 0.06 3.60 0.00 -1.97 -2.26 119.26 121.23 2dk2 h ALA 61 Ca 0.43 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 2dk2 h ALA 61 Cb 0.82 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2dk2 h ALA 61 CO -0.18 0.46 -0.70 0.00 0.00 0.00 0.00 179.25 178.82 2dk2 h ALA 62 N 1.64 0.05 0.60 0.00 0.00 -0.73 -3.12 119.26 117.71 2dk2 h ALA 62 Ca -0.00 -0.79 -0.03 0.00 0.00 0.00 0.00 54.91 54.09 2dk2 h ALA 62 Cb 0.98 0.24 0.01 0.00 0.00 0.00 0.00 17.79 19.01 2dk2 h ALA 62 CO 0.05 0.38 -0.29 0.28 0.00 0.00 0.00 179.25 179.67 2dk2 h VAL 63 N -0.70 0.34 -0.52 0.00 2.07 -0.78 0.11 116.25 116.78 2dk2 h VAL 63 Ca -0.16 -0.21 0.15 0.00 0.82 0.00 0.00 66.70 67.30 2dk2 h VAL 63 Cb 1.37 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 2dk2 h VAL 63 CO 0.02 0.03 0.38 0.50 0.02 0.00 0.00 177.57 178.51 2dk2 h LYS 64 N -0.96 0.00 0.10 1.57 3.11 -1.60 0.24 116.57 119.03 2dk2 h LYS 64 Ca -0.08 -0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.75 2dk2 h LYS 64 Cb 0.67 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.90 2dk2 h LYS 64 CO 0.14 0.00 -0.05 0.00 -2.81 0.00 0.00 179.45 176.73 2dk2 h ALA 65 N 1.74 -0.21 -0.41 5.00 0.00 -1.42 -3.32 119.26 120.64 2dk2 h ALA 65 Ca 0.25 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.25 2dk2 h ALA 65 Cb 1.00 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2dk2 h ALA 65 CO -0.00 -0.20 0.37 1.98 0.00 0.00 0.00 179.25 181.39 2dk2 h MET 66 N -0.61 0.00 -0.31 0.00 1.85 -0.57 0.23 114.93 115.51 2dk2 h MET 66 Ca -0.01 0.00 0.06 0.00 -0.61 0.00 0.00 59.70 59.14 2dk2 h MET 66 Cb 0.11 0.00 -0.06 0.00 0.43 0.00 0.00 31.60 32.08 2dk2 h MET 66 CO 0.02 0.00 -0.08 -0.44 -0.40 0.00 0.00 176.91 176.01 2dk2 h ASP 67 N 0.00 -0.31 0.08 1.39 5.19 -0.62 0.41 116.42 122.56 2dk2 h ASP 67 Ca 0.19 0.10 -0.35 0.00 -0.62 0.00 0.00 57.03 56.35 2dk2 h ASP 67 Cb 0.93 0.20 -0.03 0.00 0.18 0.00 0.00 39.33 40.61 2dk2 h ASP 67 CO -0.00 -0.11 -1.98 -0.62 -3.12 0.00 0.00 179.24 173.40 2dk2 n GLU 68 N -5.27 0.71 -0.35 3.56 1.02 -0.63 -4.24 120.64 115.43 2dk2 n GLU 68 Ca 0.00 0.29 0.11 0.00 -0.02 0.00 0.00 57.16 57.55 2dk2 n GLU 68 Cb 0.18 -1.68 0.30 0.00 -0.02 0.00 0.00 31.44 30.23 2dk2 n GLU 68 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2dk2 h MET 69 N -0.15 0.79 -5.96 3.49 2.86 -0.59 -3.40 114.93 111.97 2dk2 h MET 69 Ca -0.45 -0.05 -0.64 0.00 -2.06 0.00 0.00 59.70 56.50 2dk2 h MET 69 Cb 1.89 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 33.35 2dk2 h MET 69 CO -0.01 0.52 1.45 -1.71 1.06 0.00 0.00 176.91 178.23 2dk2 n ASN 70 N -4.74 2.43 -0.38 1.22 5.15 0.13 -2.08 115.26 117.01 2dk2 n ASN 70 Ca 0.22 0.32 0.00 0.00 -0.60 0.00 0.00 54.58 54.52 2dk2 n ASN 70 Cb 0.52 -1.35 0.00 0.00 -0.53 0.00 0.00 39.78 38.42 2dk2 n ASN 70 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2dk2 n GLY 71 N 6.32 0.59 3.65 8.20 0.00 -1.25 -5.00 105.19 117.69 2dk2 n GLY 71 Ca 0.38 -0.22 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 2dk2 n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dk2 s LYS 72 N -1.36 2.08 -0.33 1.61 -0.14 -0.88 -5.05 119.74 115.68 2dk2 s LYS 72 Ca 0.00 -1.85 -0.02 0.00 -1.36 0.00 0.00 55.97 52.74 2dk2 s LYS 72 Cb 0.00 -1.88 0.07 0.00 -1.68 0.00 0.00 37.83 34.34 2dk2 s LYS 72 CO 0.00 0.03 0.06 -2.00 -0.76 0.00 0.00 175.35 172.69 2dk2 s GLU 73 N -3.76 2.29 -0.24 1.68 2.12 -1.26 -2.94 118.70 116.59 2dk2 s GLU 73 Ca 0.36 -1.43 -0.06 0.00 0.36 0.00 0.00 54.97 54.21 2dk2 s GLU 73 Cb 0.03 -3.31 -0.02 0.00 0.26 0.00 0.00 34.13 31.09 2dk2 s GLU 73 CO 0.20 -0.76 0.02 0.42 -0.54 0.00 0.00 175.26 174.60 2dk2 s ILE 74 N 1.22 3.87 -1.56 -3.70 1.01 -1.04 -4.51 121.20 116.49 2dk2 s ILE 74 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.32 2dk2 s ILE 74 Cb -0.20 -2.79 0.00 0.00 0.01 0.00 0.00 42.46 39.47 2dk2 s ILE 74 CO -0.02 0.38 0.00 1.21 0.00 0.00 0.00 174.94 176.51 2dk2 n GLU 75 N 4.87 -1.84 -1.22 2.79 4.07 -1.26 -0.47 120.64 127.58 2dk2 n GLU 75 Ca -0.17 0.88 -0.07 0.00 -0.06 0.00 0.00 57.16 57.74 2dk2 n GLU 75 Cb 0.51 -5.50 -0.03 0.00 -0.06 0.00 0.00 31.44 26.36 2dk2 n GLU 75 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2dk2 n GLY 76 N -0.89 0.91 3.10 8.31 0.00 -1.26 -5.01 105.19 110.34 2dk2 n GLY 76 Ca -0.21 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 44.77 2dk2 n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dk2 s GLU 77 N -2.63 2.63 -0.25 1.61 0.41 0.38 -5.08 118.70 115.77 2dk2 s GLU 77 Ca 0.00 -0.70 -0.28 0.00 -0.41 0.00 0.00 54.97 53.58 2dk2 s GLU 77 Cb 0.00 -2.21 -0.04 0.00 -1.78 0.00 0.00 34.13 30.10 2dk2 s GLU 77 CO 0.00 -0.08 2.14 -1.21 -0.49 0.00 0.00 175.26 175.62 2dk2 s GLU 78 N 1.02 3.13 -0.17 1.61 0.41 -1.26 -2.49 118.70 120.96 2dk2 s GLU 78 Ca -0.04 1.88 -0.10 0.00 -0.41 0.00 0.00 54.97 56.30 2dk2 s GLU 78 Cb -0.15 -4.35 -0.05 0.00 -1.78 0.00 0.00 34.13 27.81 2dk2 s GLU 78 CO -0.04 -2.10 0.18 0.96 -0.49 0.00 0.00 175.26 173.76 2dk2 s ILE 79 N 8.16 5.39 0.21 -1.63 -5.25 -1.15 -4.73 121.20 122.21 2dk2 s ILE 79 Ca 0.96 0.29 0.06 0.00 -0.99 0.00 0.00 60.65 60.98 2dk2 s ILE 79 Cb -0.30 -3.50 -0.04 0.00 2.95 0.00 0.00 42.46 41.57 2dk2 s ILE 79 CO 0.34 0.47 0.16 -0.70 -1.79 0.00 0.00 174.94 173.42 2dk2 s GLU 80 N 0.06 2.89 -0.05 0.37 2.12 0.03 -3.97 118.70 120.15 2dk2 s GLU 80 Ca 0.12 -0.98 -0.02 0.00 0.36 0.00 0.00 54.97 54.44 2dk2 s GLU 80 Cb -0.12 -2.58 0.04 0.00 0.26 0.00 0.00 34.13 31.72 2dk2 s GLU 80 CO 0.01 0.44 0.11 0.42 -0.54 0.00 0.00 175.26 175.70 2dk2 s ILE 81 N -1.96 -0.07 -0.01 -3.70 1.01 -1.26 -0.68 121.20 114.53 2dk2 s ILE 81 Ca 0.32 0.21 -0.01 0.00 0.00 0.00 0.00 60.65 61.17 2dk2 s ILE 81 Cb -0.09 -0.19 0.01 0.00 0.01 0.00 0.00 42.46 42.20 2dk2 s ILE 81 CO 0.24 0.09 0.03 0.68 0.00 0.00 0.00 174.94 175.98 2dk2 s VAL 82 N 1.24 -0.02 0.10 2.92 -7.23 -0.38 -4.96 120.40 112.07 2dk2 s VAL 82 Ca -0.08 0.07 -0.33 0.00 -1.81 0.00 0.00 61.98 59.83 2dk2 s VAL 82 Cb -0.12 -0.06 -0.12 0.00 0.56 0.00 0.00 36.38 36.64 2dk2 s VAL 82 CO -0.05 0.03 1.76 0.18 -0.31 0.00 0.00 175.10 176.71 2dk2 n LEU 83 N 3.44 3.67 -4.65 1.32 4.77 -1.26 -1.34 117.00 122.93 2dk2 n LEU 83 Ca -0.17 1.02 -0.40 0.00 -0.03 0.00 0.00 56.01 56.43 2dk2 n LEU 83 Cb 0.57 -1.48 -0.06 0.00 -2.33 0.00 0.00 43.42 40.11 2dk2 n LEU 83 CO 0.24 0.00 0.31 0.00 -1.33 0.00 0.00 177.39 176.61 2dk2 s ALA 84 N 2.31 3.55 0.55 -1.18 0.00 -1.10 -4.86 121.76 121.04 2dk2 s ALA 84 Ca 0.82 -0.37 -0.19 0.00 0.00 0.00 0.00 51.96 52.22 2dk2 s ALA 84 Cb -0.58 -2.90 -0.06 0.00 0.00 0.00 0.00 23.12 19.58 2dk2 s ALA 84 CO 0.40 -0.55 1.09 -1.59 0.00 0.00 0.00 175.76 175.10 2dk2 s LYS 85 N 1.89 3.42 0.96 0.00 -2.85 -1.26 -4.78 119.74 117.12 2dk2 s LYS 85 Ca 0.26 1.46 -0.12 0.00 -1.00 0.00 0.00 55.97 56.56 2dk2 s LYS 85 Cb -0.16 -2.03 0.17 0.00 -2.06 0.00 0.00 37.83 33.75 2dk2 s LYS 85 CO 0.10 -0.77 1.09 -1.25 0.10 0.00 0.00 175.35 174.62 2dk2 s PRO 86 N -3.47 0.75 -0.55 1.78 0.04 -1.26 -4.92 135.00 127.37 2dk2 s PRO 86 Ca 0.69 0.64 -0.27 0.00 0.04 0.00 0.00 61.00 62.10 2dk2 s PRO 86 Cb -0.20 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 32.55 2dk2 s PRO 86 CO 0.28 -2.54 1.83 -1.25 0.04 0.00 0.00 177.00 175.35 2dk2 s PRO 87 N -4.95 2.80 0.84 0.56 0.04 -1.26 -4.97 135.00 128.06 2dk2 s PRO 87 Ca 0.65 0.77 -0.14 0.00 0.04 0.00 0.00 61.00 62.32 2dk2 s PRO 87 Cb -0.18 -4.34 0.02 0.00 0.04 0.00 0.00 34.50 30.04 2dk2 s PRO 87 CO 0.57 -2.52 0.59 -0.25 0.04 0.00 0.00 177.00 175.43 2dk2 n ASP 88 N 12.13 -1.20 -4.67 6.66 9.92 -1.26 -4.80 116.55 133.34 2dk2 n ASP 88 Ca 0.21 0.47 -0.47 0.00 -0.53 0.00 0.00 54.79 54.47 2dk2 n ASP 88 Cb 0.51 -1.26 -0.04 0.00 -0.64 0.00 0.00 41.12 39.68 2dk2 n ASP 88 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2dk2 n LYS 89 N -1.60 2.30 -0.67 -1.24 4.76 -1.26 -4.93 118.16 115.51 2dk2 n LYS 89 Ca 0.09 0.83 -0.30 0.00 -2.87 0.00 0.00 58.31 56.06 2dk2 n LYS 89 Cb 0.52 -2.76 0.18 0.00 -1.84 0.00 0.00 35.03 31.13 2dk2 n LYS 89 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2dk2 s LYS 90 N 4.37 0.65 1.04 1.97 2.20 -1.26 -4.98 119.74 123.73 2dk2 s LYS 90 Ca 0.93 1.41 -0.12 0.00 -0.36 0.00 0.00 55.97 57.83 2dk2 s LYS 90 Cb -0.62 -1.69 0.21 0.00 -1.51 0.00 0.00 37.83 34.22 2dk2 s LYS 90 CO 0.49 -2.84 1.07 1.03 -0.36 0.00 0.00 175.35 174.74 2dk2 s ARG 91 N -4.62 0.07 0.07 4.03 3.00 -1.26 -5.05 118.95 115.20 2dk2 s ARG 91 Ca 0.67 0.89 0.09 0.00 0.00 0.00 0.00 55.73 57.38 2dk2 s ARG 91 Cb -0.23 -1.67 -0.03 0.00 0.00 0.00 0.00 34.95 33.02 2dk2 s ARG 91 CO 0.59 -3.07 -0.25 -1.54 0.00 0.00 0.00 175.30 171.03 2dk2 s SER 92 N -2.90 3.34 0.00 0.23 1.04 -1.26 -5.10 113.70 109.05 2dk2 s SER 92 Ca 0.66 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 56.49 2dk2 s SER 92 Cb -0.22 -0.34 0.00 0.00 0.10 0.00 0.00 66.02 65.56 2dk2 s SER 92 CO 0.61 0.24 0.00 0.61 0.98 0.00 0.00 173.24 175.67 2dk2 n GLY 93 N 1.48 -0.39 1.60 7.32 0.00 -1.26 -5.14 105.19 108.80 2dk2 n GLY 93 Ca -0.17 -1.69 -0.14 0.00 0.00 0.00 0.00 46.02 44.02 2dk2 n GLY 93 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dk2 n PRO 94 N -1.19 -2.01 0.00 1.61 -0.04 -1.26 -4.99 135.00 127.12 2dk2 n PRO 94 Ca 0.00 -0.80 0.00 0.00 -0.04 0.00 0.00 63.50 62.66 2dk2 n PRO 94 Cb 0.00 -0.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 2dk2 n PRO 94 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dk2 n SER 95 N -3.86 0.00 -1.10 3.54 3.41 -1.26 -5.17 113.62 109.19 2dk2 n SER 95 Ca 0.07 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.73 2dk2 n SER 95 Cb 0.27 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.21 2dk2 n SER 95 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dk2 n SER 96 N -0.65 -6.56 0.00 4.04 2.88 -1.26 -5.37 113.62 106.71 2dk2 n SER 96 Ca 0.00 0.42 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 2dk2 n SER 96 Cb 0.00 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.27 2dk2 n SER 96 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42