#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 4.65 -4.55 1.61 3.41 -1.26 -5.03 113.62 112.45 2dk2 n SER 2 Ca 0.00 -3.71 -0.37 0.00 -0.26 0.00 0.00 58.87 54.53 2dk2 n SER 2 Cb 0.00 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.40 2dk2 n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dk2 s SER 3 N -3.48 5.05 -1.15 4.04 1.04 -1.26 -3.55 113.70 114.40 2dk2 s SER 3 Ca 0.48 0.45 -0.14 0.00 0.48 0.00 0.00 55.95 57.22 2dk2 s SER 3 Cb 0.34 -2.52 -0.02 0.00 0.10 0.00 0.00 66.02 63.92 2dk2 s SER 3 CO -0.17 -2.53 0.80 0.61 0.98 0.00 0.00 173.24 172.92 2dk2 n GLY 4 N 5.84 -0.91 0.19 7.32 0.00 -1.26 -4.89 105.19 111.48 2dk2 n GLY 4 Ca 0.25 0.43 -0.03 0.00 0.00 0.00 0.00 46.02 46.68 2dk2 n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dk2 h SER 5 N -1.71 0.24 -4.34 1.61 4.64 -1.96 -3.44 113.55 108.58 2dk2 h SER 5 Ca -0.64 -0.11 -0.46 0.00 -0.47 0.00 0.00 61.79 60.11 2dk2 h SER 5 Cb 1.35 -0.07 -0.24 0.00 -0.31 0.00 0.00 62.40 63.13 2dk2 h SER 5 CO 0.49 0.67 -0.80 -0.55 -0.87 0.00 0.00 176.83 175.77 2dk2 s SER 6 N -6.88 1.81 0.21 4.97 0.15 -1.26 -5.08 113.70 107.61 2dk2 s SER 6 Ca -0.04 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.09 2dk2 s SER 6 Cb 0.13 -0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2dk2 s SER 6 CO 0.78 0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.85 2dk2 n GLY 7 N 1.70 -1.00 3.79 9.45 0.00 -1.26 -4.90 105.19 112.96 2dk2 n GLY 7 Ca -0.19 -1.21 -0.24 0.00 0.00 0.00 0.00 46.02 44.38 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 -4.00 5.39 0.28 1.61 1.11 -1.26 -5.03 116.67 114.77 2dk2 s ASP 8 Ca 0.00 -0.24 0.06 0.00 0.18 0.00 0.00 52.55 52.55 2dk2 s ASP 8 Cb 0.00 -1.35 0.40 0.00 1.07 0.00 0.00 42.92 43.04 2dk2 s ASP 8 CO 0.00 0.02 1.66 1.55 1.18 0.00 0.00 175.17 179.59 2dk2 h PRO 9 N 2.04 0.24 -0.20 8.23 0.13 -1.92 -2.98 132.00 137.54 2dk2 h PRO 9 Ca -0.48 -0.12 -0.03 0.00 -0.87 0.00 0.00 66.00 64.50 2dk2 h PRO 9 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2dk2 h PRO 9 CO 0.61 0.65 -0.01 0.93 -0.23 0.00 0.00 178.00 179.96 2dk2 h GLU 10 N 0.19 0.29 0.49 0.86 4.39 -1.98 -0.72 114.58 118.11 2dk2 h GLU 10 Ca 0.01 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 2dk2 h GLU 10 Cb 0.89 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2dk2 h GLU 10 CO 0.07 0.33 -0.24 0.28 -1.16 0.00 0.00 179.01 178.29 2dk2 h VAL 11 N 0.29 0.00 -0.17 3.13 2.07 -1.94 -2.98 116.25 116.64 2dk2 h VAL 11 Ca 0.07 -0.47 0.05 0.00 0.82 0.00 0.00 66.70 67.17 2dk2 h VAL 11 Cb 0.22 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 2dk2 h VAL 11 CO 0.01 0.00 0.15 0.24 0.02 0.00 0.00 177.57 177.99 2dk2 h MET 12 N -1.13 0.00 0.00 1.57 2.86 -1.52 0.80 114.93 117.51 2dk2 h MET 12 Ca -0.07 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.52 2dk2 h MET 12 Cb 0.51 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 2dk2 h MET 12 CO 0.11 0.00 -0.26 0.00 1.06 0.00 0.00 176.91 177.83 2dk2 h ALA 13 N 1.85 1.16 -0.85 6.32 0.00 -1.12 -2.77 119.26 123.85 2dk2 h ALA 13 Ca 0.08 -0.23 -0.49 0.00 0.00 0.00 0.00 54.91 54.27 2dk2 h ALA 13 Cb 0.39 -0.04 -0.26 0.00 0.00 0.00 0.00 17.79 17.88 2dk2 h ALA 13 CO -0.00 0.32 0.63 1.17 0.00 0.00 0.00 179.25 181.37 2dk2 n LYS 14 N -3.62 2.20 -3.83 0.00 4.81 0.27 -4.76 118.16 113.24 2dk2 n LYS 14 Ca -0.01 -2.65 -0.36 0.00 -0.87 0.00 0.00 58.31 54.42 2dk2 n LYS 14 Cb 0.39 -2.04 -0.13 0.00 0.02 0.00 0.00 35.03 33.27 2dk2 n LYS 14 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2dk2 s VAL 15 N -3.28 3.26 -0.27 3.15 1.01 -1.05 -4.94 120.40 118.29 2dk2 s VAL 15 Ca 0.51 -1.60 0.11 0.00 0.00 0.00 0.00 61.98 61.00 2dk2 s VAL 15 Cb 0.42 -3.01 0.54 0.00 0.00 0.00 0.00 36.38 34.33 2dk2 s VAL 15 CO 0.06 -0.35 1.51 2.29 0.00 0.00 0.00 175.10 178.61 2dk2 n LYS 16 N 4.65 2.35 -3.85 2.72 2.85 -1.26 -4.69 118.16 120.93 2dk2 n LYS 16 Ca -0.09 -3.05 -0.27 0.00 -1.05 0.00 0.00 58.31 53.85 2dk2 n LYS 16 Cb 0.43 -1.88 -0.17 0.00 -0.65 0.00 0.00 35.03 32.76 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 -3.10 0.92 -0.27 0.58 1.01 -1.26 -3.62 120.40 114.66 2dk2 s VAL 17 Ca 0.45 -0.52 -0.10 0.00 0.00 0.00 0.00 61.98 61.81 2dk2 s VAL 17 Cb 0.39 -1.15 -0.05 0.00 0.00 0.00 0.00 36.38 35.58 2dk2 s VAL 17 CO 0.05 0.09 0.16 -0.76 0.00 0.00 0.00 175.10 174.63 2dk2 s LEU 18 N 1.71 3.90 -0.64 3.92 1.43 -1.25 -2.50 118.68 125.25 2dk2 s LEU 18 Ca 0.01 -0.05 -0.25 0.00 -1.03 0.00 0.00 54.13 52.81 2dk2 s LEU 18 Cb -0.15 -2.08 0.04 0.00 0.03 0.00 0.00 46.19 44.04 2dk2 s LEU 18 CO -0.07 -0.04 1.09 0.12 0.23 0.00 0.00 176.35 177.68 2dk2 s PHE 19 N 1.68 2.58 -0.41 0.29 5.36 0.21 -4.31 117.98 123.38 2dk2 s PHE 19 Ca 0.07 -0.10 -0.15 0.00 -0.96 0.00 0.00 56.93 55.79 2dk2 s PHE 19 Cb -0.16 -4.37 0.02 0.00 -0.34 0.00 0.00 43.02 38.17 2dk2 s PHE 19 CO 0.09 -1.68 0.31 0.08 -1.46 0.00 0.00 175.22 172.55 2dk2 s VAL 20 N 4.67 5.25 0.45 3.12 1.01 -1.24 -1.19 120.40 132.48 2dk2 s VAL 20 Ca 0.32 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 61.74 2dk2 s VAL 20 Cb -0.12 -3.93 0.02 0.00 0.00 0.00 0.00 36.38 32.35 2dk2 s VAL 20 CO 0.17 -0.31 0.54 0.00 0.00 0.00 0.00 175.10 175.49 2dk2 s ARG 21 N 1.71 2.61 -0.71 2.72 1.70 -0.52 -1.02 118.95 125.43 2dk2 s ARG 21 Ca 0.05 -1.45 -0.02 0.00 -0.47 0.00 0.00 55.73 53.84 2dk2 s ARG 21 Cb -0.19 -2.58 0.00 0.00 -0.57 0.00 0.00 34.95 31.62 2dk2 s ARG 21 CO 0.10 -0.37 0.68 0.09 -1.08 0.00 0.00 175.30 174.73 2dk2 n ASN 22 N -1.82 -7.59 -4.95 -2.89 4.13 -1.15 -1.56 115.26 99.43 2dk2 n ASN 22 Ca 0.07 -0.07 -0.24 0.00 1.68 0.00 0.00 54.58 56.02 2dk2 n ASN 22 Cb 0.61 -5.03 0.02 0.00 -1.54 0.00 0.00 39.78 33.83 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 -3.91 2.87 0.01 3.41 1.02 -0.44 -3.85 118.68 117.80 2dk2 s LEU 23 Ca 0.03 -1.09 -0.02 0.00 0.02 0.00 0.00 54.13 53.07 2dk2 s LEU 23 Cb -0.01 -1.38 -0.04 0.00 0.02 0.00 0.00 46.19 44.78 2dk2 s LEU 23 CO 0.76 -1.17 0.19 0.00 0.02 0.00 0.00 176.35 176.15 2dk2 s ALA 24 N -2.72 3.97 -0.15 4.21 0.00 -1.26 -5.01 121.76 120.80 2dk2 s ALA 24 Ca 0.44 -0.79 0.16 0.00 0.00 0.00 0.00 51.96 51.78 2dk2 s ALA 24 Cb -0.03 -1.86 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 2dk2 s ALA 24 CO 0.28 0.78 1.11 1.15 0.00 0.00 0.00 175.76 179.08 2dk2 h THR 25 N 2.57 0.62 0.00 0.00 2.02 -1.99 -3.31 112.91 112.82 2dk2 h THR 25 Ca -0.48 -2.01 -0.19 0.00 0.77 0.00 0.00 66.41 64.50 2dk2 h THR 25 Cb 1.18 2.16 -0.03 0.00 -1.74 0.00 0.00 68.15 69.73 2dk2 h THR 25 CO 0.71 0.35 -0.88 0.71 0.37 0.00 0.00 175.52 176.78 2dk2 h THR 26 N 0.00 1.63 -4.21 3.16 1.35 -1.99 -3.46 112.91 109.40 2dk2 h THR 26 Ca -0.08 -3.03 -0.50 0.00 -0.55 0.00 0.00 66.41 62.24 2dk2 h THR 26 Cb 1.45 2.64 0.14 0.00 -1.73 0.00 0.00 68.15 70.65 2dk2 h THR 26 CO 0.05 0.87 0.28 0.68 -0.25 0.00 0.00 175.52 177.15 2dk2 s VAL 27 N -2.97 2.99 0.26 6.82 -7.23 -1.25 -5.07 120.40 113.95 2dk2 s VAL 27 Ca 0.00 0.32 0.05 0.00 -1.81 0.00 0.00 61.98 60.54 2dk2 s VAL 27 Cb 0.11 -2.77 -0.06 0.00 0.56 0.00 0.00 36.38 34.22 2dk2 s VAL 27 CO 0.80 -0.42 -0.01 0.28 -0.31 0.00 0.00 175.10 175.44 2dk2 s THR 28 N -2.89 1.25 0.55 5.32 -1.32 -1.26 -4.98 115.64 112.31 2dk2 s THR 28 Ca 0.62 -2.05 0.26 0.00 -1.21 0.00 0.00 61.69 59.31 2dk2 s THR 28 Cb -0.18 -2.47 0.38 0.00 -1.51 0.00 0.00 72.50 68.72 2dk2 s THR 28 CO 0.57 -0.25 2.01 -0.33 -2.21 0.00 0.00 174.62 174.41 2dk2 h GLU 29 N 2.34 0.00 -0.50 7.08 5.08 -1.98 -0.51 114.58 126.09 2dk2 h GLU 29 Ca -0.39 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.92 2dk2 h GLU 29 Cb 1.23 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 2dk2 h GLU 29 CO 0.66 0.00 0.13 0.93 -1.00 0.00 0.00 179.01 179.73 2dk2 h GLU 30 N 0.00 0.79 0.26 2.33 4.39 -1.98 -1.04 114.58 119.33 2dk2 h GLU 30 Ca 0.20 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 2dk2 h GLU 30 Cb 0.88 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 2dk2 h GLU 30 CO -0.00 0.76 -0.12 0.82 -1.16 0.00 0.00 179.01 179.31 2dk2 h ILE 31 N 0.68 0.75 -0.95 3.13 2.04 -1.51 -2.70 117.51 118.96 2dk2 h ILE 31 Ca 0.16 -0.74 0.14 0.00 1.00 0.00 0.00 64.86 65.42 2dk2 h ILE 31 Cb 0.32 1.13 -0.08 0.00 -0.74 0.00 0.00 36.82 37.45 2dk2 h ILE 31 CO 0.00 0.14 0.60 -0.07 0.00 0.00 0.00 178.15 178.83 2dk2 h LEU 32 N -0.77 0.76 -1.56 1.44 3.38 -1.46 0.30 115.31 117.40 2dk2 h LEU 32 Ca -0.04 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2dk2 h LEU 32 Cb 0.50 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2dk2 h LEU 32 CO 0.06 0.38 -0.22 -0.33 0.09 0.00 0.00 178.44 178.42 2dk2 h GLU 33 N 0.80 0.00 0.00 1.13 5.08 -1.16 -2.47 114.58 117.96 2dk2 h GLU 33 Ca 0.48 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.68 2dk2 h GLU 33 Cb 0.67 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.89 2dk2 h GLU 33 CO -0.25 0.22 -1.15 0.87 -1.00 0.00 0.00 179.01 177.70 2dk2 h LYS 34 N 0.00 0.00 -0.33 2.33 6.56 -0.18 -2.20 116.57 122.75 2dk2 h LYS 34 Ca -0.00 0.00 -0.12 0.00 -1.06 0.00 0.00 60.65 59.47 2dk2 h LYS 34 Cb 0.50 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.15 2dk2 h LYS 34 CO 0.03 0.40 -0.29 0.77 -2.06 0.00 0.00 179.45 178.30 2dk2 h SER 35 N 0.00 0.71 0.35 0.86 0.02 -0.47 -3.08 113.55 111.94 2dk2 h SER 35 Ca -0.12 -0.28 -0.32 0.00 -0.84 0.00 0.00 61.79 60.24 2dk2 h SER 35 Cb 1.56 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.86 2dk2 h SER 35 CO 0.06 0.96 -1.84 0.49 -1.14 0.00 0.00 176.83 175.36 2dk2 n PHE 36 N -4.09 1.01 0.14 3.45 3.72 -1.09 -4.01 117.46 116.60 2dk2 n PHE 36 Ca -0.01 0.31 0.18 0.00 -0.05 0.00 0.00 57.45 57.89 2dk2 n PHE 36 Cb 0.46 -1.17 0.78 0.00 -0.94 0.00 0.00 39.48 38.61 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 0.02 0.00 0.52 4.37 0.87 -1.40 0.25 113.55 118.18 2dk2 h SER 37 Ca -0.34 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.16 2dk2 h SER 37 Cb 2.03 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.98 2dk2 h SER 37 CO 0.08 0.00 -0.25 -0.33 -0.53 0.00 0.00 176.83 175.80 2dk2 h GLU 38 N 0.00 0.00 0.00 2.24 5.08 -1.67 -3.22 114.58 117.01 2dk2 h GLU 38 Ca 0.14 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.38 2dk2 h GLU 38 Cb 0.72 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 2dk2 h GLU 38 CO -0.00 0.25 -0.70 0.74 -1.00 0.00 0.00 179.01 178.29 2dk2 h PHE 39 N 0.00 0.00 -2.50 4.33 0.04 -0.74 -3.50 116.94 114.57 2dk2 h PHE 39 Ca -0.00 0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.85 2dk2 h PHE 39 Cb 0.57 0.00 -0.13 0.00 2.20 0.00 0.00 35.95 38.59 2dk2 h PHE 39 CO 0.00 1.16 0.41 0.20 -0.60 0.00 0.00 178.31 179.48 2dk2 s GLY 40 N -4.53 -0.45 -0.07 -1.45 0.00 -0.95 -4.99 107.32 94.87 2dk2 s GLY 40 Ca -0.23 0.70 -0.36 0.00 0.00 0.00 0.00 44.72 44.83 2dk2 s GLY 40 CO 0.58 0.23 1.70 0.28 0.00 0.00 0.00 173.10 175.89 2dk2 n LYS 41 N -0.32 1.70 -2.49 2.90 4.76 -1.26 -4.18 118.16 119.27 2dk2 n LYS 41 Ca -0.10 0.62 -0.24 0.00 -2.87 0.00 0.00 58.31 55.72 2dk2 n LYS 41 Cb 0.62 -2.37 0.04 0.00 -1.84 0.00 0.00 35.03 31.48 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 2.78 3.17 -0.16 -0.35 1.43 -1.26 -3.28 118.68 121.01 2dk2 s LEU 42 Ca 0.91 0.35 -0.07 0.00 -1.03 0.00 0.00 54.13 54.29 2dk2 s LEU 42 Cb -0.84 -3.15 -0.07 0.00 0.03 0.00 0.00 46.19 42.16 2dk2 s LEU 42 CO 0.53 -1.20 -0.20 1.21 0.23 0.00 0.00 176.35 176.91 2dk2 n GLU 43 N -2.54 0.34 -3.64 1.70 2.13 0.85 -4.67 120.64 114.80 2dk2 n GLU 43 Ca 0.06 0.14 -0.03 0.00 0.66 0.00 0.00 57.16 57.99 2dk2 n GLU 43 Cb 0.59 -1.09 -0.06 0.00 0.27 0.00 0.00 31.44 31.15 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 -2.29 0.09 0.11 5.31 3.52 -1.24 -4.94 118.95 119.50 2dk2 s ARG 44 Ca -0.22 0.08 0.09 0.00 -0.13 0.00 0.00 55.73 55.55 2dk2 s ARG 44 Cb 0.08 0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.48 2dk2 s ARG 44 CO 0.29 -0.02 -0.23 0.08 -0.81 0.00 0.00 175.30 174.61 2dk2 s VAL 45 N -0.26 1.91 -0.07 7.11 1.01 -1.26 -0.63 120.40 128.21 2dk2 s VAL 45 Ca 0.07 -1.59 -0.05 0.00 0.00 0.00 0.00 61.98 60.41 2dk2 s VAL 45 Cb -0.04 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.66 2dk2 s VAL 45 CO -0.13 0.02 0.17 -0.75 0.00 0.00 0.00 175.10 174.41 2dk2 s LYS 46 N -1.90 0.17 -0.63 2.72 2.47 -0.31 -4.98 119.74 117.28 2dk2 s LYS 46 Ca 0.09 0.29 -0.22 0.00 -1.56 0.00 0.00 55.97 54.57 2dk2 s LYS 46 Cb -0.10 0.01 0.07 0.00 -1.46 0.00 0.00 37.83 36.36 2dk2 s LYS 46 CO 0.05 -0.07 0.90 0.21 0.16 0.00 0.00 175.35 176.60 2dk2 s LYS 47 N 0.44 3.12 -0.23 4.03 2.20 -1.26 -1.36 119.74 126.67 2dk2 s LYS 47 Ca -0.03 -0.88 0.01 0.00 -0.36 0.00 0.00 55.97 54.71 2dk2 s LYS 47 Cb -0.04 -4.21 0.06 0.00 -1.51 0.00 0.00 37.83 32.12 2dk2 s LYS 47 CO -0.02 -1.71 -0.06 -0.51 -0.36 0.00 0.00 175.35 172.68 2dk2 s LEU 48 N 3.74 2.60 0.00 5.43 2.01 -1.14 -5.03 118.68 126.30 2dk2 s LEU 48 Ca 0.21 -1.16 0.00 0.00 0.01 0.00 0.00 54.13 53.19 2dk2 s LEU 48 Cb -0.18 -1.21 0.00 0.00 0.01 0.00 0.00 46.19 44.81 2dk2 s LEU 48 CO 0.10 -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 0.70 0.00 0.00 0.00 0.00 35.03 36.17 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 -4.92 3.14 5.19 -1.96 -3.43 116.42 114.44 2dk2 h ASP 50 Ca 0.00 0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 56.13 2dk2 h ASP 50 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 2dk2 h ASP 50 CO 0.00 0.00 -0.10 0.00 -3.12 0.00 0.00 179.24 176.02 2dk2 n TYR 51 N -2.44 -1.61 -3.93 4.55 0.18 -1.14 -1.32 117.16 111.45 2dk2 n TYR 51 Ca -0.01 -1.15 -0.09 0.00 1.88 0.00 0.00 57.90 58.53 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 -0.01 -0.30 -3.48 0.00 -0.19 -2.88 121.76 112.51 2dk2 s ALA 52 Ca 0.21 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.47 2dk2 s ALA 52 Cb -0.02 0.36 0.07 0.00 0.00 0.00 0.00 23.12 23.53 2dk2 s ALA 52 CO 0.13 -0.41 -0.03 -0.06 0.00 0.00 0.00 175.76 175.39 2dk2 s PHE 53 N -3.45 3.40 0.01 0.00 0.08 -0.46 -3.58 117.98 113.98 2dk2 s PHE 53 Ca 0.02 -2.37 0.06 0.00 0.12 0.00 0.00 56.93 54.76 2dk2 s PHE 53 Cb 0.04 -2.27 -0.03 0.00 -0.57 0.00 0.00 43.02 40.19 2dk2 s PHE 53 CO -0.09 -0.88 -0.17 0.08 -0.10 0.00 0.00 175.22 174.06 2dk2 s VAL 54 N 1.10 2.82 0.19 -0.44 1.01 -1.26 -1.17 120.40 122.65 2dk2 s VAL 54 Ca -0.03 -1.05 0.09 0.00 0.00 0.00 0.00 61.98 60.99 2dk2 s VAL 54 Cb -0.20 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2dk2 s VAL 54 CO -0.05 0.42 -0.09 -1.00 0.00 0.00 0.00 175.10 174.39 2dk2 s HIS 55 N -0.85 2.64 0.13 5.22 3.76 0.20 -3.89 115.29 122.49 2dk2 s HIS 55 Ca 0.14 -0.22 0.07 0.00 -0.15 0.00 0.00 55.06 54.89 2dk2 s HIS 55 Cb -0.10 -1.28 -0.04 0.00 1.11 0.00 0.00 32.58 32.27 2dk2 s HIS 55 CO 0.04 0.52 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.23 2dk2 s PHE 56 N -1.76 1.53 0.58 1.40 0.40 -1.24 -0.10 117.98 118.78 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 -0.80 1.57 0.00 0.51 0.00 0.00 43.02 44.22 2dk2 s PHE 56 CO 0.16 0.19 2.04 1.05 0.70 0.00 0.00 175.22 179.36 2dk2 h GLU 57 N 3.59 0.00 0.00 0.44 4.11 -1.82 -3.45 114.58 117.45 2dk2 h GLU 57 Ca -0.41 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.00 2dk2 h GLU 57 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2dk2 h GLU 57 CO 0.48 0.00 0.11 -0.25 0.07 0.00 0.00 179.01 179.42 2dk2 n ASP 58 N -3.86 -0.98 0.03 3.06 8.00 -1.26 -5.06 116.55 116.48 2dk2 n ASP 58 Ca 0.04 -1.70 -0.19 0.00 0.71 0.00 0.00 54.79 53.65 2dk2 n ASP 58 Cb 0.43 1.63 -0.11 0.00 -0.02 0.00 0.00 41.12 43.06 2dk2 n ASP 58 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2dk2 h ARG 59 N 0.00 0.60 -0.25 -1.24 1.12 -1.86 -3.27 114.38 109.49 2dk2 h ARG 59 Ca -0.14 -0.66 0.06 0.00 -1.11 0.00 0.00 59.98 58.13 2dk2 h ARG 59 Cb 0.53 0.19 -0.06 0.00 -0.01 0.00 0.00 29.97 30.62 2dk2 h ARG 59 CO 0.18 1.26 -0.13 0.78 -3.11 0.00 0.00 179.97 178.95 2dk2 h GLY 60 N 0.22 0.07 1.59 2.80 0.00 -1.91 0.16 103.07 106.00 2dk2 h GLY 60 Ca -0.11 0.16 0.04 0.00 0.00 0.00 0.00 47.33 47.42 2dk2 h GLY 60 CO 0.18 -0.15 0.17 0.00 0.00 0.00 0.00 176.54 176.74 2dk2 h ALA 61 N 1.10 1.74 0.13 3.60 0.00 -1.97 0.89 119.26 124.75 2dk2 h ALA 61 Ca 0.13 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.80 2dk2 h ALA 61 Cb 0.30 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.11 2dk2 h ALA 61 CO -0.31 -0.24 -1.15 0.00 0.00 0.00 0.00 179.25 177.54 2dk2 h ALA 62 N 1.80 0.06 0.46 0.00 0.00 -1.01 -3.17 119.26 117.39 2dk2 h ALA 62 Ca 0.07 -0.92 -0.02 0.00 0.00 0.00 0.00 54.91 54.04 2dk2 h ALA 62 Cb 0.40 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2dk2 h ALA 62 CO -0.00 0.63 -0.22 0.28 0.00 0.00 0.00 179.25 179.93 2dk2 h VAL 63 N -0.34 0.40 -0.57 0.00 2.07 0.01 0.17 116.25 117.99 2dk2 h VAL 63 Ca -0.23 -0.49 0.16 0.00 0.82 0.00 0.00 66.70 66.96 2dk2 h VAL 63 Cb 1.71 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 2dk2 h VAL 63 CO 0.10 0.07 0.45 0.50 0.02 0.00 0.00 177.57 178.71 2dk2 h LYS 64 N -0.96 0.00 0.04 1.57 3.11 -1.05 0.19 116.57 119.48 2dk2 h LYS 64 Ca -0.06 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.77 2dk2 h LYS 64 Cb 0.58 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.81 2dk2 h LYS 64 CO 0.10 0.00 -0.02 0.00 -2.81 0.00 0.00 179.45 176.72 2dk2 h ALA 65 N 1.63 -0.06 -0.31 5.00 0.00 -1.49 -3.33 119.26 120.70 2dk2 h ALA 65 Ca 0.27 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.26 2dk2 h ALA 65 Cb 1.17 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2dk2 h ALA 65 CO -0.00 -0.06 0.31 1.98 0.00 0.00 0.00 179.25 181.48 2dk2 h MET 66 N -0.93 0.00 -0.28 0.00 1.85 -0.60 0.24 114.93 115.22 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 0.04 0.00 -0.05 0.00 0.43 0.00 0.00 31.60 32.02 2dk2 h MET 66 CO 0.01 0.00 -0.07 0.22 -0.40 0.00 0.00 176.91 176.67 2dk2 h ASP 67 N 0.00 -0.26 0.08 1.39 3.58 -0.73 0.05 116.42 120.54 2dk2 h ASP 67 Ca 0.15 0.08 -0.36 0.00 0.42 0.00 0.00 57.03 57.32 2dk2 h ASP 67 Cb 0.76 0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.95 2dk2 h ASP 67 CO -0.00 -0.09 -2.03 -0.62 -2.88 0.00 0.00 179.24 173.62 2dk2 n GLU 68 N -5.24 0.71 -0.28 0.28 1.02 -0.68 -4.28 120.64 112.18 2dk2 n GLU 68 Ca -0.01 0.28 0.06 0.00 -0.02 0.00 0.00 57.16 57.47 2dk2 n GLU 68 Cb 0.16 -1.67 0.20 0.00 -0.02 0.00 0.00 31.44 30.11 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 -0.10 0.54 -6.11 3.49 2.86 -0.58 -3.41 114.93 111.62 2dk2 h MET 69 Ca -0.46 -0.03 -0.67 0.00 -2.06 0.00 0.00 59.70 56.48 2dk2 h MET 69 Cb 1.92 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 33.46 2dk2 h MET 69 CO 0.00 0.35 1.21 -1.71 1.06 0.00 0.00 176.91 177.83 2dk2 n ASN 70 N -4.92 2.65 -0.80 1.22 2.85 0.00 -2.18 115.26 114.09 2dk2 n ASN 70 Ca 0.16 0.72 0.00 0.00 -0.11 0.00 0.00 54.58 55.35 2dk2 n ASN 70 Cb 0.42 -1.28 0.00 0.00 1.24 0.00 0.00 39.78 40.15 2dk2 n ASN 70 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dk2 n GLY 71 N 5.33 0.47 3.80 8.20 0.00 -1.26 -5.00 105.19 116.74 2dk2 n GLY 71 Ca 0.32 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.90 2.22 -0.25 1.61 1.02 -0.93 -5.06 119.74 115.46 2dk2 s LYS 72 Ca 0.00 -2.36 0.01 0.00 0.02 0.00 0.00 55.97 53.65 2dk2 s LYS 72 Cb 0.00 -1.63 0.06 0.00 -0.52 0.00 0.00 37.83 35.74 2dk2 s LYS 72 CO 0.00 -0.44 -0.06 -2.00 -0.92 0.00 0.00 175.35 171.93 2dk2 s GLU 73 N -3.97 1.75 -0.22 1.68 2.12 -1.26 -3.34 118.70 115.46 2dk2 s GLU 73 Ca 0.09 -1.11 -0.04 0.00 0.36 0.00 0.00 54.97 54.26 2dk2 s GLU 73 Cb 0.00 -2.67 -0.01 0.00 0.26 0.00 0.00 34.13 31.71 2dk2 s GLU 73 CO 0.05 -0.61 -0.04 0.42 -0.54 0.00 0.00 175.26 174.54 2dk2 s ILE 74 N 1.31 3.42 -1.46 -3.70 1.01 -1.07 -4.59 121.20 116.11 2dk2 s ILE 74 Ca -0.06 -0.47 -0.10 0.00 0.00 0.00 0.00 60.65 60.01 2dk2 s ILE 74 Cb -0.19 -2.56 0.05 0.00 0.01 0.00 0.00 42.46 39.77 2dk2 s ILE 74 CO -0.06 0.42 0.90 1.21 0.00 0.00 0.00 174.94 177.41 2dk2 n GLU 75 N 4.79 -5.77 -2.13 2.79 0.00 -1.26 -0.83 120.64 118.24 2dk2 n GLU 75 Ca -0.18 0.70 -0.20 0.00 0.00 0.00 0.00 57.16 57.49 2dk2 n GLU 75 Cb 0.51 -5.61 -0.03 0.00 0.00 0.00 0.00 31.44 26.31 2dk2 n GLU 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dk2 n GLY 76 N -1.68 0.26 3.02 8.31 0.00 -1.26 -4.98 105.19 108.87 2dk2 n GLY 76 Ca -0.00 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 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 -4.58 1.84 0.08 1.61 0.41 -0.01 -5.10 118.70 112.96 2dk2 s GLU 77 Ca 0.00 -0.44 -0.31 0.00 -0.41 0.00 0.00 54.97 53.81 2dk2 s GLU 77 Cb 0.00 -1.58 -0.11 0.00 -1.78 0.00 0.00 34.13 30.67 2dk2 s GLU 77 CO 0.00 -0.03 1.87 0.39 -0.49 0.00 0.00 175.26 176.99 2dk2 n GLU 78 N 4.06 2.72 -5.07 1.61 -0.58 -1.26 -2.61 120.64 119.52 2dk2 n GLU 78 Ca -0.20 0.99 -0.32 0.00 -0.42 0.00 0.00 57.16 57.21 2dk2 n GLU 78 Cb 0.51 -2.89 -0.14 0.00 -0.57 0.00 0.00 31.44 28.35 2dk2 n GLU 78 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 2dk2 s ILE 79 N 3.20 2.62 0.22 -3.67 -4.36 -1.21 -4.55 121.20 113.46 2dk2 s ILE 79 Ca 0.85 -0.89 0.11 0.00 -0.26 0.00 0.00 60.65 60.46 2dk2 s ILE 79 Cb -0.50 -1.98 -0.05 0.00 1.25 0.00 0.00 42.46 41.18 2dk2 s ILE 79 CO 0.40 0.59 -0.21 -1.61 0.24 0.00 0.00 174.94 174.34 2dk2 s GLU 80 N -0.64 1.62 -0.03 0.37 8.01 -0.60 -4.00 118.70 123.42 2dk2 s GLU 80 Ca 0.10 -1.59 -0.02 0.00 0.01 0.00 0.00 54.97 53.47 2dk2 s GLU 80 Cb -0.11 -1.85 0.01 0.00 -4.31 0.00 0.00 34.13 27.88 2dk2 s GLU 80 CO 0.00 0.38 0.08 0.42 0.01 0.00 0.00 175.26 176.14 2dk2 s ILE 81 N -1.96 -0.01 0.02 -1.63 1.01 -1.26 -1.44 121.20 115.92 2dk2 s ILE 81 Ca 0.24 0.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.80 2dk2 s ILE 81 Cb -0.07 -0.12 0.01 0.00 0.01 0.00 0.00 42.46 42.30 2dk2 s ILE 81 CO 0.12 0.01 0.26 0.68 0.00 0.00 0.00 174.94 176.01 2dk2 s VAL 82 N 0.20 0.08 0.14 2.92 -7.23 -0.33 -4.96 120.40 111.22 2dk2 s VAL 82 Ca -0.01 -0.67 -0.31 0.00 -1.81 0.00 0.00 61.98 59.18 2dk2 s VAL 82 Cb -0.02 -0.76 -0.08 0.00 0.56 0.00 0.00 36.38 36.07 2dk2 s VAL 82 CO -0.01 -0.37 1.40 -0.76 -0.31 0.00 0.00 175.10 175.05 2dk2 s LEU 83 N -1.74 4.38 -0.41 1.32 1.43 -1.26 -0.61 118.68 121.78 2dk2 s LEU 83 Ca -0.09 2.38 -0.15 0.00 -1.03 0.00 0.00 54.13 55.24 2dk2 s LEU 83 Cb -0.03 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.62 2dk2 s LEU 83 CO -0.00 -0.65 0.30 0.00 0.23 0.00 0.00 176.35 176.22 2dk2 s ALA 84 N 0.92 3.47 0.09 4.21 0.00 -1.04 -4.82 121.76 124.59 2dk2 s ALA 84 Ca 0.64 -1.73 0.03 0.00 0.00 0.00 0.00 51.96 50.89 2dk2 s ALA 84 Cb -0.38 -2.88 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2dk2 s ALA 84 CO 0.32 -1.46 0.13 -1.59 0.00 0.00 0.00 175.76 173.16 2dk2 s LYS 85 N 1.67 3.05 0.96 0.00 0.00 -1.26 -4.72 119.74 119.44 2dk2 s LYS 85 Ca 0.05 -0.66 -0.12 0.00 0.00 0.00 0.00 55.97 55.24 2dk2 s LYS 85 Cb -0.19 -2.80 0.17 0.00 0.00 0.00 0.00 37.83 35.00 2dk2 s LYS 85 CO 0.10 0.56 1.09 -1.25 0.00 0.00 0.00 175.35 175.85 2dk2 s PRO 86 N -2.60 0.74 -0.20 1.78 0.04 -1.26 -4.95 135.00 128.56 2dk2 s PRO 86 Ca 0.31 0.64 -0.29 0.00 0.04 0.00 0.00 61.00 61.70 2dk2 s PRO 86 Cb -0.12 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 2dk2 s PRO 86 CO 0.24 -2.55 1.60 -1.25 0.04 0.00 0.00 177.00 175.08 2dk2 s PRO 87 N -4.95 3.87 0.78 0.56 0.04 -1.26 -5.00 135.00 129.04 2dk2 s PRO 87 Ca 0.65 1.73 -0.11 0.00 0.04 0.00 0.00 61.00 63.30 2dk2 s PRO 87 Cb -0.18 -4.01 0.06 0.00 0.04 0.00 0.00 34.50 30.41 2dk2 s PRO 87 CO 0.57 -1.20 1.08 0.34 0.04 0.00 0.00 177.00 177.84 2dk2 s ASP 88 N 3.96 4.52 -0.24 6.66 2.15 -1.26 -5.05 116.67 127.41 2dk2 s ASP 88 Ca 0.70 1.68 0.01 0.00 0.43 0.00 0.00 52.55 55.37 2dk2 s ASP 88 Cb -0.26 -2.41 0.06 0.00 -0.30 0.00 0.00 42.92 40.01 2dk2 s ASP 88 CO 0.28 -2.00 -0.05 -0.54 -0.17 0.00 0.00 175.17 172.69 2dk2 s LYS 89 N -4.96 1.57 0.22 4.34 -0.14 -1.26 -5.11 119.74 114.40 2dk2 s LYS 89 Ca 0.61 -0.98 0.03 0.00 -1.36 0.00 0.00 55.97 54.27 2dk2 s LYS 89 Cb -0.16 -2.57 -0.01 0.00 -1.68 0.00 0.00 37.83 33.41 2dk2 s LYS 89 CO 0.56 -0.61 0.10 1.17 -0.76 0.00 0.00 175.35 175.81 2dk2 n LYS 90 N 4.68 0.62 -2.80 1.68 4.81 -1.26 -5.01 118.16 120.90 2dk2 n LYS 90 Ca -0.12 -1.95 -0.05 0.00 -0.87 0.00 0.00 58.31 55.32 2dk2 n LYS 90 Cb 0.44 1.18 0.01 0.00 0.02 0.00 0.00 35.03 36.67 2dk2 n LYS 90 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2dk2 n ARG 91 N -0.49 -2.81 -1.42 1.64 3.00 -1.26 -4.97 116.66 110.36 2dk2 n ARG 91 Ca -0.02 2.38 -0.32 0.00 -0.00 0.00 0.00 57.85 59.89 2dk2 n ARG 91 Cb 0.35 -5.57 0.08 0.00 0.00 0.00 0.00 32.46 27.32 2dk2 n ARG 91 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2dk2 s SER 92 N -2.24 4.60 0.24 6.15 0.15 -1.26 -4.85 113.70 116.49 2dk2 s SER 92 Ca 0.16 1.96 0.00 0.00 0.70 0.00 0.00 55.95 58.76 2dk2 s SER 92 Cb -0.04 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2dk2 s SER 92 CO 0.77 -1.98 0.00 0.61 1.20 0.00 0.00 173.24 173.85 2dk2 n GLY 93 N -0.72 -1.97 3.77 9.45 0.00 -1.26 -4.83 105.19 109.62 2dk2 n GLY 93 Ca 0.10 -1.31 -0.39 0.00 0.00 0.00 0.00 46.02 44.41 2dk2 n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dk2 s PRO 94 N -1.35 4.24 0.07 1.61 0.04 -1.26 -5.05 135.00 133.30 2dk2 s PRO 94 Ca 0.00 1.97 0.07 0.00 0.04 0.00 0.00 61.00 63.08 2dk2 s PRO 94 Cb 0.00 -2.89 -0.03 0.00 0.04 0.00 0.00 34.50 31.62 2dk2 s PRO 94 CO 0.00 -0.20 -0.19 -1.54 0.04 0.00 0.00 177.00 175.12 2dk2 s SER 95 N -0.87 2.23 0.44 6.66 1.04 -1.26 -5.08 113.70 116.86 2dk2 s SER 95 Ca 0.52 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2dk2 s SER 95 Cb -0.34 -0.14 0.00 0.00 0.10 0.00 0.00 66.02 65.64 2dk2 s SER 95 CO 0.44 0.07 0.00 -0.24 0.98 0.00 0.00 173.24 174.49 2dk2 n SER 96 N 1.53 -8.14 0.00 7.02 2.88 -1.26 -5.26 113.62 110.39 2dk2 n SER 96 Ca -0.19 0.91 0.00 0.00 -1.33 0.00 0.00 58.87 58.26 2dk2 n SER 96 Cb 0.54 -4.35 0.00 0.00 -0.75 0.00 0.00 64.21 59.65 2dk2 n SER 96 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42