#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 -7.20 -4.16 1.61 7.64 -1.26 -4.97 113.62 105.28 2dk2 n SER 2 Ca 0.00 0.21 -0.37 0.00 1.01 0.00 0.00 58.87 59.73 2dk2 n SER 2 Cb 0.00 -4.32 -0.12 0.00 -1.01 0.00 0.00 64.21 58.77 2dk2 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dk2 s SER 3 N -2.42 5.24 0.71 6.43 0.15 -1.26 -5.09 113.70 117.46 2dk2 s SER 3 Ca 0.24 -1.74 -0.14 0.00 0.70 0.00 0.00 55.95 55.01 2dk2 s SER 3 Cb -0.05 -1.83 0.02 0.00 -1.71 0.00 0.00 66.02 62.45 2dk2 s SER 3 CO 0.80 -0.47 1.12 -0.83 1.20 0.00 0.00 173.24 175.06 2dk2 s GLY 4 N 1.73 2.05 0.35 9.45 0.00 -1.26 -4.90 107.32 114.73 2dk2 s GLY 4 Ca 0.04 0.52 0.00 0.00 0.00 0.00 0.00 44.72 45.28 2dk2 s GLY 4 CO -0.02 0.88 0.00 -1.26 0.00 0.00 0.00 173.10 172.70 2dk2 n SER 5 N -2.79 -3.13 -3.65 1.64 2.88 -1.26 -5.15 113.62 102.16 2dk2 n SER 5 Ca 0.10 0.82 -0.03 0.00 -1.33 0.00 0.00 58.87 58.43 2dk2 n SER 5 Cb 0.52 3.03 -0.07 0.00 -0.75 0.00 0.00 64.21 66.95 2dk2 n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dk2 s SER 6 N -2.00 -0.14 -0.06 -3.46 1.04 -1.26 -5.08 113.70 102.75 2dk2 s SER 6 Ca 0.00 0.26 -0.01 0.00 0.48 0.00 0.00 55.95 56.68 2dk2 s SER 6 Cb 0.00 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2dk2 s SER 6 CO 0.00 -0.04 0.06 0.61 0.98 0.00 0.00 173.24 174.85 2dk2 n GLY 7 N 2.13 -0.61 3.95 7.32 0.00 -1.26 -5.08 105.19 111.65 2dk2 n GLY 7 Ca -0.13 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.54 6.33 0.21 1.61 1.11 -1.26 -5.02 116.67 118.11 2dk2 s ASP 8 Ca 0.02 0.18 -0.03 0.00 0.18 0.00 0.00 52.55 52.90 2dk2 s ASP 8 Cb -0.00 -1.91 0.17 0.00 1.07 0.00 0.00 42.92 42.24 2dk2 s ASP 8 CO 0.08 -0.04 1.56 1.55 1.18 0.00 0.00 175.17 179.50 2dk2 h PRO 9 N 1.62 0.60 -0.46 8.23 0.13 -1.99 -3.03 132.00 137.10 2dk2 h PRO 9 Ca -0.50 -0.32 0.01 0.00 -0.87 0.00 0.00 66.00 64.32 2dk2 h PRO 9 Cb 1.21 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 2dk2 h PRO 9 CO 0.65 0.92 0.31 0.93 -0.23 0.00 0.00 178.00 180.57 2dk2 h GLU 10 N 0.49 0.59 0.45 0.86 5.08 -1.97 0.37 114.58 120.46 2dk2 h GLU 10 Ca 0.04 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2dk2 h GLU 10 Cb 0.95 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2dk2 h GLU 10 CO 0.08 0.39 -0.22 0.28 -1.00 0.00 0.00 179.01 178.55 2dk2 h VAL 11 N 0.61 0.00 -0.20 3.13 2.07 -1.95 0.65 116.25 120.56 2dk2 h VAL 11 Ca 0.17 -0.41 0.06 0.00 0.82 0.00 0.00 66.70 67.34 2dk2 h VAL 11 Cb -0.04 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.72 2dk2 h VAL 11 CO -0.04 0.00 0.20 0.24 0.02 0.00 0.00 177.57 177.99 2dk2 h MET 12 N -1.02 0.00 0.00 1.57 2.86 -1.46 0.83 114.93 117.71 2dk2 h MET 12 Ca -0.06 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.43 2dk2 h MET 12 Cb 0.47 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 2dk2 h MET 12 CO 0.10 0.00 -0.96 0.00 1.06 0.00 0.00 176.91 177.11 2dk2 h ALA 13 N 1.79 0.63 -0.47 6.32 0.00 -0.90 -3.30 119.26 123.32 2dk2 h ALA 13 Ca 0.09 -0.70 0.13 0.00 0.00 0.00 0.00 54.91 54.43 2dk2 h ALA 13 Cb 0.49 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2dk2 h ALA 13 CO -0.00 0.85 0.34 -0.22 0.00 0.00 0.00 179.25 180.22 2dk2 h LYS 14 N 0.00 0.04 -6.74 0.00 3.11 0.16 -3.43 116.57 109.71 2dk2 h LYS 14 Ca -0.08 -0.00 -0.57 0.00 -2.81 0.00 0.00 60.65 57.19 2dk2 h LYS 14 Cb 1.53 -0.01 0.16 0.00 -1.00 0.00 0.00 32.23 32.92 2dk2 h LYS 14 CO 0.07 0.02 -0.02 1.33 -2.81 0.00 0.00 179.45 178.04 2dk2 n VAL 15 N -4.41 3.29 -1.24 2.00 0.24 -1.23 -4.74 118.33 112.25 2dk2 n VAL 15 Ca 0.08 -0.50 -0.05 0.00 -2.04 0.00 0.00 64.34 61.83 2dk2 n VAL 15 Cb 0.52 -1.01 0.23 0.00 -1.47 0.00 0.00 33.84 32.11 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 -0.74 2.51 -3.87 7.34 2.85 -1.26 -4.70 118.16 120.29 2dk2 n LYS 16 Ca 0.13 -3.07 -0.14 0.00 -1.05 0.00 0.00 58.31 54.18 2dk2 n LYS 16 Cb 0.47 -1.97 -0.15 0.00 -0.65 0.00 0.00 35.03 32.73 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 -3.12 0.05 -0.09 0.58 1.01 -1.26 -3.89 120.40 113.67 2dk2 s VAL 17 Ca 0.48 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.56 2dk2 s VAL 17 Cb 0.41 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 36.65 2dk2 s VAL 17 CO 0.06 0.07 -0.14 -0.76 0.00 0.00 0.00 175.10 174.34 2dk2 s LEU 18 N 0.60 2.73 -0.53 3.92 1.43 -1.25 -3.02 118.68 122.56 2dk2 s LEU 18 Ca -0.05 -0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 52.62 2dk2 s LEU 18 Cb -0.08 -1.58 0.10 0.00 0.03 0.00 0.00 46.19 44.66 2dk2 s LEU 18 CO -0.01 0.26 0.53 0.12 0.23 0.00 0.00 176.35 177.48 2dk2 s PHE 19 N -0.22 3.17 -0.42 0.29 5.36 0.16 -4.24 117.98 122.09 2dk2 s PHE 19 Ca 0.01 -1.04 -0.17 0.00 -0.96 0.00 0.00 56.93 54.78 2dk2 s PHE 19 Cb -0.13 -3.66 0.02 0.00 -0.34 0.00 0.00 43.02 38.91 2dk2 s PHE 19 CO 0.03 -1.03 0.41 0.08 -1.46 0.00 0.00 175.22 173.25 2dk2 s VAL 20 N 1.98 5.12 0.44 3.12 1.01 -1.24 -1.52 120.40 129.32 2dk2 s VAL 20 Ca 0.07 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.74 2dk2 s VAL 20 Cb -0.26 -4.01 0.01 0.00 0.00 0.00 0.00 36.38 32.12 2dk2 s VAL 20 CO 0.06 -0.39 0.51 0.00 0.00 0.00 0.00 175.10 175.28 2dk2 s ARG 21 N 2.05 2.61 -0.68 2.72 1.70 -0.73 -0.93 118.95 125.69 2dk2 s ARG 21 Ca 0.11 -1.46 -0.05 0.00 -0.47 0.00 0.00 55.73 53.86 2dk2 s ARG 21 Cb -0.17 -2.55 0.01 0.00 -0.57 0.00 0.00 34.95 31.66 2dk2 s ARG 21 CO 0.13 -0.33 0.67 0.09 -1.08 0.00 0.00 175.30 174.78 2dk2 n ASN 22 N -1.77 -7.46 -4.94 -2.89 4.13 -1.14 -1.83 115.26 99.36 2dk2 n ASN 22 Ca 0.06 -0.04 -0.23 0.00 1.68 0.00 0.00 54.58 56.05 2dk2 n ASN 22 Cb 0.61 -4.84 0.01 0.00 -1.54 0.00 0.00 39.78 34.02 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 -3.77 3.01 0.05 3.41 1.02 -0.37 -3.93 118.68 118.10 2dk2 s LEU 23 Ca 0.06 -0.98 -0.04 0.00 0.02 0.00 0.00 54.13 53.19 2dk2 s LEU 23 Cb -0.02 -1.58 -0.05 0.00 0.02 0.00 0.00 46.19 44.57 2dk2 s LEU 23 CO 0.77 -1.06 0.27 0.00 0.02 0.00 0.00 176.35 176.36 2dk2 s ALA 24 N -2.66 3.88 -0.14 4.21 0.00 -1.26 -5.01 121.76 120.78 2dk2 s ALA 24 Ca 0.46 -0.65 0.16 0.00 0.00 0.00 0.00 51.96 51.94 2dk2 s ALA 24 Cb -0.04 -2.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.03 2dk2 s ALA 24 CO 0.28 0.71 1.09 1.15 0.00 0.00 0.00 175.76 178.99 2dk2 h THR 25 N 2.55 0.61 0.00 0.00 2.02 -1.99 -3.32 112.91 112.78 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 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 69.72 2dk2 h THR 25 CO 0.70 0.35 -0.90 0.71 0.37 0.00 0.00 175.52 176.75 2dk2 h THR 26 N 0.00 1.65 -4.21 3.16 1.35 -1.99 -3.46 112.91 109.41 2dk2 h THR 26 Ca -0.09 -3.10 -0.50 0.00 -0.55 0.00 0.00 66.41 62.17 2dk2 h THR 26 Cb 1.46 2.67 0.15 0.00 -1.73 0.00 0.00 68.15 70.70 2dk2 h THR 26 CO 0.05 0.89 0.28 0.68 -0.25 0.00 0.00 175.52 177.16 2dk2 s VAL 27 N -2.93 2.92 0.32 6.82 -7.23 -1.25 -5.07 120.40 113.98 2dk2 s VAL 27 Ca 0.00 0.30 0.06 0.00 -1.81 0.00 0.00 61.98 60.53 2dk2 s VAL 27 Cb 0.11 -2.70 -0.06 0.00 0.56 0.00 0.00 36.38 34.29 2dk2 s VAL 27 CO 0.81 -0.39 -0.02 0.28 -0.31 0.00 0.00 175.10 175.47 2dk2 s THR 28 N -2.86 1.64 0.55 5.32 -1.32 -1.26 -4.99 115.64 112.72 2dk2 s THR 28 Ca 0.63 -2.08 0.25 0.00 -1.21 0.00 0.00 61.69 59.28 2dk2 s THR 28 Cb -0.18 -2.65 0.37 0.00 -1.51 0.00 0.00 72.50 68.52 2dk2 s THR 28 CO 0.57 -0.16 2.04 -0.33 -2.21 0.00 0.00 174.62 174.52 2dk2 h GLU 29 N 2.13 0.00 0.57 7.08 5.08 -1.99 -2.30 114.58 125.14 2dk2 h GLU 29 Ca -0.41 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.92 2dk2 h GLU 29 Cb 1.24 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.49 2dk2 h GLU 29 CO 0.70 0.00 -0.27 1.49 -1.00 0.00 0.00 179.01 179.93 2dk2 h GLU 30 N 0.00 -0.73 -0.37 2.33 4.81 -1.98 -1.13 114.58 117.51 2dk2 h GLU 30 Ca 0.17 0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.52 2dk2 h GLU 30 Cb 0.73 0.17 -0.07 0.00 0.63 0.00 0.00 28.75 30.21 2dk2 h GLU 30 CO -0.00 -0.42 -0.06 0.82 -0.73 0.00 0.00 179.01 178.61 2dk2 h ILE 31 N -1.00 0.66 -0.75 2.32 2.04 -1.84 -0.54 117.51 118.40 2dk2 h ILE 31 Ca -0.08 -0.01 0.03 0.00 1.00 0.00 0.00 64.86 65.80 2dk2 h ILE 31 Cb 0.65 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 2dk2 h ILE 31 CO 0.13 0.01 0.49 -0.07 0.00 0.00 0.00 178.15 178.71 2dk2 h LEU 32 N 0.03 0.79 -1.34 1.44 3.38 -1.48 0.98 115.31 119.11 2dk2 h LEU 32 Ca 0.18 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 2dk2 h LEU 32 Cb 0.27 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2dk2 h LEU 32 CO -0.36 0.54 -0.27 -0.33 0.09 0.00 0.00 178.44 178.11 2dk2 h GLU 33 N 0.91 0.00 0.00 1.13 5.08 0.18 -2.74 114.58 119.14 2dk2 h GLU 33 Ca 0.30 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.50 2dk2 h GLU 33 Cb 0.05 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2dk2 h GLU 33 CO -0.08 0.27 -1.21 0.87 -1.00 0.00 0.00 179.01 177.86 2dk2 h LYS 34 N 0.00 0.00 -0.38 2.33 1.57 0.20 -2.28 116.57 118.01 2dk2 h LYS 34 Ca -0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2dk2 h LYS 34 Cb 0.65 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 2dk2 h LYS 34 CO 0.04 0.37 -0.09 0.77 -0.57 0.00 0.00 179.45 179.97 2dk2 h SER 35 N 0.00 0.64 0.29 0.86 0.02 -0.58 -3.10 113.55 111.69 2dk2 h SER 35 Ca -0.13 -0.17 -0.31 0.00 -0.84 0.00 0.00 61.79 60.35 2dk2 h SER 35 Cb 1.57 -0.17 -0.06 0.00 0.14 0.00 0.00 62.40 63.88 2dk2 h SER 35 CO 0.06 0.77 -1.97 0.49 -1.14 0.00 0.00 176.83 175.04 2dk2 n PHE 36 N -4.19 0.56 0.13 3.45 3.72 -1.16 -4.13 117.46 115.85 2dk2 n PHE 36 Ca 0.01 0.20 0.19 0.00 -0.05 0.00 0.00 57.45 57.80 2dk2 n PHE 36 Cb 0.33 -1.08 0.77 0.00 -0.94 0.00 0.00 39.48 38.56 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 0.00 0.00 0.30 4.37 0.87 -1.35 0.21 113.55 117.95 2dk2 h SER 37 Ca -0.38 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.15 2dk2 h SER 37 Cb 2.05 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 64.00 2dk2 h SER 37 CO 0.05 0.00 -0.14 -0.33 -0.53 0.00 0.00 176.83 175.88 2dk2 h GLU 38 N 0.00 0.00 0.00 2.24 5.08 -1.70 -3.15 114.58 117.05 2dk2 h GLU 38 Ca 0.15 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.34 2dk2 h GLU 38 Cb 0.77 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 2dk2 h GLU 38 CO -0.00 0.14 -0.95 0.74 -1.00 0.00 0.00 179.01 177.94 2dk2 h PHE 39 N 0.00 0.00 -2.18 4.33 0.04 -0.84 -3.50 116.94 114.80 2dk2 h PHE 39 Ca -0.00 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.80 2dk2 h PHE 39 Cb 0.33 0.00 -0.17 0.00 2.20 0.00 0.00 35.95 38.31 2dk2 h PHE 39 CO 0.00 1.24 0.37 0.20 -0.60 0.00 0.00 178.31 179.52 2dk2 s GLY 40 N -4.66 -0.48 -0.28 -1.45 0.00 -1.00 -5.02 107.32 94.42 2dk2 s GLY 40 Ca -0.25 1.23 -0.35 0.00 0.00 0.00 0.00 44.72 45.35 2dk2 s GLY 40 CO 0.56 0.63 2.08 0.28 0.00 0.00 0.00 173.10 176.65 2dk2 n LYS 41 N 0.26 1.34 -1.29 2.90 4.76 -1.26 -4.19 118.16 120.68 2dk2 n LYS 41 Ca -0.13 0.41 -0.30 0.00 -2.87 0.00 0.00 58.31 55.42 2dk2 n LYS 41 Cb 0.60 -2.50 0.13 0.00 -1.84 0.00 0.00 35.03 31.42 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 6.30 2.29 -0.23 -0.35 1.43 -1.26 -3.76 118.68 123.11 2dk2 s LEU 42 Ca 1.05 1.42 -0.12 0.00 -1.03 0.00 0.00 54.13 55.44 2dk2 s LEU 42 Cb -0.82 -3.87 -0.10 0.00 0.03 0.00 0.00 46.19 41.43 2dk2 s LEU 42 CO 0.51 -2.51 -0.30 1.21 0.23 0.00 0.00 176.35 175.48 2dk2 n GLU 43 N -3.80 0.50 -3.65 1.70 0.00 0.81 -4.76 120.64 111.44 2dk2 n GLU 43 Ca 0.07 0.22 -0.03 0.00 0.00 0.00 0.00 57.16 57.42 2dk2 n GLU 43 Cb 0.56 -1.33 -0.07 0.00 0.00 0.00 0.00 31.44 30.60 2dk2 n GLU 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 2dk2 s ARG 44 N -2.44 0.22 0.10 5.31 3.52 -1.24 -4.93 118.95 119.48 2dk2 s ARG 44 Ca -0.33 0.31 0.09 0.00 -0.13 0.00 0.00 55.73 55.68 2dk2 s ARG 44 Cb 0.12 0.08 -0.04 0.00 -1.56 0.00 0.00 34.95 33.55 2dk2 s ARG 44 CO 0.41 -0.04 -0.23 0.08 -0.81 0.00 0.00 175.30 174.72 2dk2 s VAL 45 N 0.64 2.51 -0.08 7.11 1.01 -1.26 -0.87 120.40 129.47 2dk2 s VAL 45 Ca -0.01 -1.52 -0.06 0.00 0.00 0.00 0.00 61.98 60.38 2dk2 s VAL 45 Cb -0.04 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.27 2dk2 s VAL 45 CO -0.12 0.18 0.20 -0.75 0.00 0.00 0.00 175.10 174.61 2dk2 s LYS 46 N -1.85 0.20 -0.63 2.72 2.47 -0.35 -4.98 119.74 117.32 2dk2 s LYS 46 Ca 0.15 0.35 -0.22 0.00 -1.56 0.00 0.00 55.97 54.69 2dk2 s LYS 46 Cb -0.10 0.01 0.07 0.00 -1.46 0.00 0.00 37.83 36.35 2dk2 s LYS 46 CO 0.07 -0.08 0.91 0.21 0.16 0.00 0.00 175.35 176.61 2dk2 s LYS 47 N 0.54 3.14 -0.23 4.03 2.20 -1.26 -1.35 119.74 126.80 2dk2 s LYS 47 Ca -0.04 -0.80 0.01 0.00 -0.36 0.00 0.00 55.97 54.78 2dk2 s LYS 47 Cb -0.05 -4.20 0.06 0.00 -1.51 0.00 0.00 37.83 32.13 2dk2 s LYS 47 CO -0.03 -1.70 -0.06 -0.51 -0.36 0.00 0.00 175.35 172.69 2dk2 s LEU 48 N 3.80 2.61 0.00 5.43 2.01 -1.13 -5.03 118.68 126.37 2dk2 s LEU 48 Ca 0.22 -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 44.82 2dk2 s LEU 48 CO 0.11 -0.22 0.00 0.29 1.01 0.00 0.00 176.35 177.54 2dk2 n LYS 49 N 4.66 0.00 0.21 1.70 5.02 -1.26 -2.90 118.16 125.59 2dk2 n LYS 49 Ca -0.12 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.31 2dk2 n LYS 49 Cb 0.44 0.00 0.76 0.00 -0.02 0.00 0.00 35.03 36.21 2dk2 n LYS 49 CO 0.00 0.00 0.00 0.38 -0.52 0.00 0.00 177.40 177.26 2dk2 h ASP 50 N 0.00 0.00 -4.86 4.39 3.04 -1.96 -3.43 116.42 113.60 2dk2 h ASP 50 Ca 0.00 0.00 -0.27 0.00 -3.24 0.00 0.00 57.03 53.52 2dk2 h ASP 50 Cb 0.00 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.28 2dk2 h ASP 50 CO 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 179.24 177.10 2dk2 n TYR 51 N -2.52 -1.60 -3.92 4.15 0.18 -1.14 -1.24 117.16 111.07 2dk2 n TYR 51 Ca -0.01 -1.11 -0.08 0.00 1.88 0.00 0.00 57.90 58.57 2dk2 n TYR 51 Cb 0.07 -0.24 -0.08 0.00 -0.38 0.00 0.00 39.34 38.71 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 -2.37 -0.04 -0.29 -3.48 0.00 -0.11 -2.85 121.76 112.63 2dk2 s ALA 52 Ca 0.20 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.44 2dk2 s ALA 52 Cb -0.02 0.41 0.07 0.00 0.00 0.00 0.00 23.12 23.59 2dk2 s ALA 52 CO 0.13 -0.46 -0.05 -0.06 0.00 0.00 0.00 175.76 175.32 2dk2 s PHE 53 N -3.75 3.40 -0.06 0.00 0.08 -0.46 -3.59 117.98 113.60 2dk2 s PHE 53 Ca 0.04 -2.46 0.05 0.00 0.12 0.00 0.00 56.93 54.68 2dk2 s PHE 53 Cb 0.05 -2.23 -0.02 0.00 -0.57 0.00 0.00 43.02 40.25 2dk2 s PHE 53 CO -0.10 -0.89 -0.21 0.08 -0.10 0.00 0.00 175.22 174.00 2dk2 s VAL 54 N 1.06 2.45 0.21 -0.44 1.01 -1.26 -1.22 120.40 122.22 2dk2 s VAL 54 Ca -0.03 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.09 2dk2 s VAL 54 Cb -0.20 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2dk2 s VAL 54 CO -0.05 0.57 0.10 -1.00 0.00 0.00 0.00 175.10 174.72 2dk2 s HIS 55 N -0.30 3.00 0.14 5.22 3.76 -0.05 -3.87 115.29 123.18 2dk2 s HIS 55 Ca 0.01 -0.10 0.06 0.00 -0.15 0.00 0.00 55.06 54.88 2dk2 s HIS 55 Cb -0.13 -1.40 -0.04 0.00 1.11 0.00 0.00 32.58 32.12 2dk2 s HIS 55 CO 0.02 0.53 -0.14 -0.06 -0.85 0.00 0.00 174.74 174.24 2dk2 s PHE 56 N -1.94 1.49 0.55 1.40 0.40 -1.25 -0.14 117.98 118.49 2dk2 s PHE 56 Ca 0.31 -0.56 0.27 0.00 -0.60 0.00 0.00 56.93 56.35 2dk2 s PHE 56 Cb -0.09 -0.76 1.46 0.00 0.51 0.00 0.00 43.02 44.14 2dk2 s PHE 56 CO 0.22 0.19 1.97 0.93 0.70 0.00 0.00 175.22 179.23 2dk2 h GLU 57 N 3.32 0.00 0.00 0.44 5.08 -1.86 -3.45 114.58 118.11 2dk2 h GLU 57 Ca -0.40 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.96 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 0.53 0.00 0.04 -3.47 -1.00 0.00 0.00 179.01 175.11 2dk2 n ASP 58 N -4.13 -0.33 0.11 1.42 2.03 -1.26 -5.06 116.55 109.34 2dk2 n ASP 58 Ca 0.10 -1.22 -0.22 0.00 0.52 0.00 0.00 54.79 53.96 2dk2 n ASP 58 Cb 0.64 0.55 -0.14 0.00 -0.72 0.00 0.00 41.12 41.45 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 0.55 -0.61 -0.67 1.12 -1.85 -3.21 114.38 109.71 2dk2 h ARG 59 Ca -0.05 -0.80 0.07 0.00 -1.11 0.00 0.00 59.98 58.09 2dk2 h ARG 59 Cb 0.18 0.28 -0.06 0.00 -0.01 0.00 0.00 29.97 30.36 2dk2 h ARG 59 CO 0.06 1.37 0.30 0.78 -3.11 0.00 0.00 179.97 179.37 2dk2 h GLY 60 N 0.46 0.88 1.40 2.80 0.00 -1.92 0.19 103.07 106.90 2dk2 h GLY 60 Ca -0.20 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 46.87 2dk2 h GLY 60 CO 0.24 0.09 0.03 0.00 0.00 0.00 0.00 176.54 176.91 2dk2 h ALA 61 N 1.35 1.19 -0.04 3.60 0.00 -1.98 -0.03 119.26 123.35 2dk2 h ALA 61 Ca 0.29 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2dk2 h ALA 61 Cb 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2dk2 h ALA 61 CO -0.21 0.53 -0.07 0.00 0.00 0.00 0.00 179.25 179.50 2dk2 h ALA 62 N 1.34 0.06 0.44 0.00 0.00 -1.32 -2.49 119.26 117.28 2dk2 h ALA 62 Ca 0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2dk2 h ALA 62 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2dk2 h ALA 62 CO 0.01 -0.11 -0.21 0.28 0.00 0.00 0.00 179.25 179.23 2dk2 h VAL 63 N -0.40 0.56 -0.62 0.00 2.07 -0.57 0.72 116.25 118.00 2dk2 h VAL 63 Ca 0.00 -0.21 0.17 0.00 0.82 0.00 0.00 66.70 67.48 2dk2 h VAL 63 Cb 0.63 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 2dk2 h VAL 63 CO 0.02 0.04 0.44 0.50 0.02 0.00 0.00 177.57 178.59 2dk2 h LYS 64 N -0.71 0.07 0.12 1.57 3.64 -1.11 0.24 116.57 120.38 2dk2 h LYS 64 Ca -0.06 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 2dk2 h LYS 64 Cb 0.51 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2dk2 h LYS 64 CO 0.10 0.05 -0.06 0.00 -2.27 0.00 0.00 179.45 177.27 2dk2 h ALA 65 N 1.69 -0.19 -0.37 5.00 0.00 -1.08 -3.31 119.26 121.00 2dk2 h ALA 65 Ca 0.30 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.28 2dk2 h ALA 65 Cb 1.09 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2dk2 h ALA 65 CO -0.02 -0.18 0.34 1.98 0.00 0.00 0.00 179.25 181.37 2dk2 h MET 66 N -0.83 0.00 -0.33 0.00 1.85 -0.60 0.24 114.93 115.27 2dk2 h MET 66 Ca -0.02 0.00 0.06 0.00 -0.61 0.00 0.00 59.70 59.13 2dk2 h MET 66 Cb 0.12 0.00 -0.05 0.00 0.43 0.00 0.00 31.60 32.10 2dk2 h MET 66 CO 0.03 0.00 -0.01 -0.44 -0.40 0.00 0.00 176.91 176.08 2dk2 h ASP 67 N 0.00 -0.16 0.07 1.39 5.19 -0.62 0.20 116.42 122.50 2dk2 h ASP 67 Ca 0.17 0.08 -0.35 0.00 -0.62 0.00 0.00 57.03 56.31 2dk2 h ASP 67 Cb 0.85 0.14 -0.03 0.00 0.18 0.00 0.00 39.33 40.47 2dk2 h ASP 67 CO -0.00 -0.04 -1.96 -0.62 -3.12 0.00 0.00 179.24 173.50 2dk2 n GLU 68 N -5.19 0.69 -0.30 3.56 -0.58 -0.61 -4.22 120.64 113.99 2dk2 n GLU 68 Ca 0.01 0.31 0.15 0.00 -0.42 0.00 0.00 57.16 57.20 2dk2 n GLU 68 Cb 0.17 -1.68 0.40 0.00 -0.57 0.00 0.00 31.44 29.76 2dk2 n GLU 68 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 2dk2 h MET 69 N -0.22 0.62 -6.02 3.49 2.86 -0.59 -3.41 114.93 111.66 2dk2 h MET 69 Ca -0.45 -0.04 -0.65 0.00 -2.06 0.00 0.00 59.70 56.50 2dk2 h MET 69 Cb 1.84 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 33.35 2dk2 h MET 69 CO -0.03 0.41 1.39 -1.71 1.06 0.00 0.00 176.91 178.03 2dk2 n ASN 70 N -4.62 2.54 -0.27 1.22 5.15 0.06 -1.41 115.26 117.92 2dk2 n ASN 70 Ca 0.21 0.43 0.00 0.00 -0.60 0.00 0.00 54.58 54.62 2dk2 n ASN 70 Cb 0.59 -1.34 0.00 0.00 -0.53 0.00 0.00 39.78 38.50 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 6.10 0.98 3.88 8.20 0.00 -1.26 -5.01 105.19 118.08 2dk2 n GLY 71 Ca 0.36 -0.40 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.89 2.56 -0.23 1.61 -0.14 -0.50 -5.04 119.74 115.11 2dk2 s LYS 72 Ca 0.00 -1.50 -0.02 0.00 -1.36 0.00 0.00 55.97 53.09 2dk2 s LYS 72 Cb 0.00 -2.40 0.01 0.00 -1.68 0.00 0.00 37.83 33.76 2dk2 s LYS 72 CO 0.00 -0.16 -0.06 -2.00 -0.76 0.00 0.00 175.35 172.37 2dk2 s GLU 73 N -4.12 3.06 -0.18 1.68 2.12 -1.26 -3.38 118.70 116.62 2dk2 s GLU 73 Ca 0.47 -0.83 0.01 0.00 0.36 0.00 0.00 54.97 54.99 2dk2 s GLU 73 Cb -0.04 -2.97 0.02 0.00 0.26 0.00 0.00 34.13 31.41 2dk2 s GLU 73 CO 0.28 -0.31 -0.19 0.42 -0.54 0.00 0.00 175.26 174.92 2dk2 s ILE 74 N 1.39 2.00 -1.62 -3.70 1.01 -1.08 -4.67 121.20 114.52 2dk2 s ILE 74 Ca 0.03 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.76 2dk2 s ILE 74 Cb -0.15 -1.82 0.00 0.00 0.01 0.00 0.00 42.46 40.50 2dk2 s ILE 74 CO -0.05 0.52 0.00 1.21 0.00 0.00 0.00 174.94 176.62 2dk2 n GLU 75 N 4.64 -1.81 -1.63 2.79 4.07 -1.26 -0.82 120.64 126.62 2dk2 n GLU 75 Ca -0.20 0.92 -0.10 0.00 -0.06 0.00 0.00 57.16 57.72 2dk2 n GLU 75 Cb 0.50 -5.57 -0.03 0.00 -0.06 0.00 0.00 31.44 26.28 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 -0.95 0.70 3.17 8.31 0.00 -1.26 -5.01 105.19 110.15 2dk2 n GLY 76 Ca -0.22 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 44.97 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 -3.47 2.47 -0.46 1.61 0.41 -0.00 -5.08 118.70 114.18 2dk2 s GLU 77 Ca 0.00 -0.74 -0.27 0.00 -0.41 0.00 0.00 54.97 53.55 2dk2 s GLU 77 Cb 0.00 -1.96 -0.03 0.00 -1.78 0.00 0.00 34.13 30.36 2dk2 s GLU 77 CO 0.00 0.19 1.89 -1.21 -0.49 0.00 0.00 175.26 175.65 2dk2 s GLU 78 N 0.27 2.91 -0.14 1.61 2.02 -1.26 -2.62 118.70 121.49 2dk2 s GLU 78 Ca -0.13 1.10 -0.09 0.00 0.02 0.00 0.00 54.97 55.87 2dk2 s GLU 78 Cb -0.16 -4.32 -0.04 0.00 0.10 0.00 0.00 34.13 29.71 2dk2 s GLU 78 CO 0.06 -2.37 0.16 0.96 0.02 0.00 0.00 175.26 174.09 2dk2 s ILE 79 N 8.36 5.44 0.21 -1.63 -5.25 -1.22 -4.75 121.20 122.36 2dk2 s ILE 79 Ca 0.77 0.26 0.08 0.00 -0.99 0.00 0.00 60.65 60.76 2dk2 s ILE 79 Cb -0.18 -3.46 -0.04 0.00 2.95 0.00 0.00 42.46 41.73 2dk2 s ILE 79 CO 0.27 0.54 0.02 -1.61 -1.79 0.00 0.00 174.94 172.37 2dk2 s GLU 80 N -0.44 2.43 -0.03 0.37 2.02 -0.76 -4.04 118.70 118.24 2dk2 s GLU 80 Ca 0.13 -1.18 -0.02 0.00 0.02 0.00 0.00 54.97 53.91 2dk2 s GLU 80 Cb -0.12 -2.33 0.01 0.00 0.10 0.00 0.00 34.13 31.79 2dk2 s GLU 80 CO 0.02 0.43 0.07 0.42 0.02 0.00 0.00 175.26 176.22 2dk2 s ILE 81 N -1.92 -0.00 0.16 -1.63 1.01 -1.26 -1.77 121.20 115.78 2dk2 s ILE 81 Ca 0.29 0.01 -0.09 0.00 0.00 0.00 0.00 60.65 60.86 2dk2 s ILE 81 Cb -0.08 -0.11 -0.01 0.00 0.01 0.00 0.00 42.46 42.26 2dk2 s ILE 81 CO 0.20 0.00 0.27 0.68 0.00 0.00 0.00 174.94 176.09 2dk2 s VAL 82 N 0.10 0.07 -0.11 2.92 -7.23 -0.58 -4.94 120.40 110.64 2dk2 s VAL 82 Ca -0.01 -1.37 -0.29 0.00 -1.81 0.00 0.00 61.98 58.50 2dk2 s VAL 82 Cb -0.01 -1.79 -0.01 0.00 0.56 0.00 0.00 36.38 35.12 2dk2 s VAL 82 CO -0.00 -0.34 1.00 -0.76 -0.31 0.00 0.00 175.10 174.69 2dk2 s LEU 83 N -2.96 4.24 0.40 1.32 1.43 -1.26 -0.66 118.68 121.19 2dk2 s LEU 83 Ca 0.16 1.51 -0.08 0.00 -1.03 0.00 0.00 54.13 54.69 2dk2 s LEU 83 Cb 0.04 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.66 2dk2 s LEU 83 CO -0.01 -0.45 0.72 0.00 0.23 0.00 0.00 176.35 176.84 2dk2 s ALA 84 N 2.03 3.42 0.54 4.21 0.00 -1.17 -4.83 121.76 125.97 2dk2 s ALA 84 Ca 0.48 -0.35 -0.19 0.00 0.00 0.00 0.00 51.96 51.90 2dk2 s ALA 84 Cb -0.18 -2.59 -0.06 0.00 0.00 0.00 0.00 23.12 20.29 2dk2 s ALA 84 CO 0.17 -0.03 1.07 0.15 0.00 0.00 0.00 175.76 177.13 2dk2 s LYS 85 N -3.98 3.51 0.96 0.00 1.02 -1.26 -4.86 119.74 115.13 2dk2 s LYS 85 Ca 0.49 1.41 -0.12 0.00 0.02 0.00 0.00 55.97 57.76 2dk2 s LYS 85 Cb -0.10 -2.05 0.17 0.00 -0.52 0.00 0.00 37.83 35.33 2dk2 s LYS 85 CO 0.34 -0.68 1.09 -1.25 -0.92 0.00 0.00 175.35 173.93 2dk2 s PRO 86 N -3.47 0.74 1.15 -1.68 0.04 -1.26 -5.00 135.00 125.53 2dk2 s PRO 86 Ca 0.68 0.64 -0.17 0.00 0.04 0.00 0.00 61.00 62.19 2dk2 s PRO 86 Cb -0.19 -1.76 0.26 0.00 0.04 0.00 0.00 34.50 32.85 2dk2 s PRO 86 CO 0.27 -2.55 1.10 -1.25 0.04 0.00 0.00 177.00 174.61 2dk2 s PRO 87 N -4.95 -0.82 1.02 0.56 0.04 -1.26 -4.89 135.00 124.70 2dk2 s PRO 87 Ca 0.65 0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.77 2dk2 s PRO 87 Cb -0.18 -1.63 0.00 0.00 0.04 0.00 0.00 34.50 32.73 2dk2 s PRO 87 CO 0.57 -3.48 0.00 -0.25 0.04 0.00 0.00 177.00 173.89 2dk2 n ASP 88 N -4.62 -6.13 -3.53 6.66 8.00 -1.26 -4.91 116.55 110.77 2dk2 n ASP 88 Ca 0.11 0.63 -0.21 0.00 0.71 0.00 0.00 54.79 56.03 2dk2 n ASP 88 Cb 0.59 -1.80 0.05 0.00 -0.02 0.00 0.00 41.12 39.94 2dk2 n ASP 88 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2dk2 n LYS 89 N -2.63 -3.78 -4.36 -1.24 5.02 -1.26 -5.01 118.16 104.90 2dk2 n LYS 89 Ca 0.00 0.69 -0.26 0.00 -2.02 0.00 0.00 58.31 56.73 2dk2 n LYS 89 Cb 0.27 -5.27 -0.12 0.00 -0.02 0.00 0.00 35.03 29.89 2dk2 n LYS 89 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2dk2 s LYS 90 N -5.45 1.33 0.68 1.97 -0.14 -1.26 -5.13 119.74 111.74 2dk2 s LYS 90 Ca 0.21 -1.34 -0.12 0.00 -1.36 0.00 0.00 55.97 53.36 2dk2 s LYS 90 Cb -0.05 -1.67 -0.00 0.00 -1.68 0.00 0.00 37.83 34.43 2dk2 s LYS 90 CO 0.79 0.38 1.06 1.03 -0.76 0.00 0.00 175.35 177.85 2dk2 s ARG 91 N -2.24 3.01 0.07 1.68 0.52 -1.26 -5.02 118.95 115.70 2dk2 s ARG 91 Ca 0.14 1.00 -0.02 0.00 -0.52 0.00 0.00 55.73 56.33 2dk2 s ARG 91 Cb -0.09 -2.00 -0.01 0.00 0.52 0.00 0.00 34.95 33.38 2dk2 s ARG 91 CO 0.06 -1.04 -0.03 0.43 0.02 0.00 0.00 175.30 174.74 2dk2 n SER 92 N -2.93 1.07 -2.30 0.23 7.64 -1.26 -5.10 113.62 110.96 2dk2 n SER 92 Ca 0.08 0.14 -0.01 0.00 1.01 0.00 0.00 58.87 60.09 2dk2 n SER 92 Cb 0.53 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2dk2 n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dk2 n GLY 93 N 3.30 -0.85 2.62 0.23 0.00 -1.26 -5.04 105.19 104.19 2dk2 n GLY 93 Ca -0.01 0.26 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.18 -2.61 -3.91 1.61 -0.04 -1.26 -5.10 135.00 122.51 2dk2 n PRO 94 Ca 0.01 -1.31 -0.09 0.00 -0.04 0.00 0.00 63.50 62.07 2dk2 n PRO 94 Cb 0.44 -1.23 -0.07 0.00 -0.04 0.00 0.00 33.50 32.61 2dk2 n PRO 94 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dk2 s SER 95 N -3.71 0.03 1.01 3.54 1.04 -1.26 -5.17 113.70 109.18 2dk2 s SER 95 Ca 0.53 -0.77 -0.17 0.00 0.48 0.00 0.00 55.95 56.03 2dk2 s SER 95 Cb -0.05 0.42 0.22 0.00 0.10 0.00 0.00 66.02 66.71 2dk2 s SER 95 CO 0.41 -0.86 1.31 -0.44 0.98 0.00 0.00 173.24 174.64 2dk2 s SER 96 N -2.93 2.70 0.00 7.02 0.01 -1.26 -5.35 113.70 113.90 2dk2 s SER 96 Ca 0.13 0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.65 2dk2 s SER 96 Cb 0.03 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 65.98 2dk2 s SER 96 CO -0.04 -2.99 0.00 0.61 0.41 0.00 0.00 173.24 171.23