#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1krw n GLN 2 N 0.00 -3.50 -0.15 3.17 7.27 -1.26 -4.92 117.38 117.99 1krw n GLN 2 Ca 0.00 -1.02 -0.10 0.00 0.07 0.00 0.00 57.00 55.95 1krw n GLN 2 Cb 0.00 -1.98 -0.01 0.00 2.41 0.00 0.00 30.24 30.66 1krw n GLN 2 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 1krw h ARG 3 N -3.09 0.69 -4.98 3.69 9.65 -2.03 -3.49 114.38 114.82 1krw h ARG 3 Ca -0.51 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 58.19 1krw h ARG 3 Cb 1.31 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.80 1krw h ARG 3 CO 0.37 0.72 -0.82 0.41 2.80 0.00 0.00 179.97 183.45 1krw n GLY 4 N -0.52 -3.63 3.27 2.80 0.00 -1.26 -4.54 105.19 101.31 1krw n GLY 4 Ca -0.00 0.56 -0.37 0.00 0.00 0.00 0.00 46.02 46.21 1krw n GLY 4 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1krw s ILE 5 N -1.69 3.55 -0.19 -0.61 1.09 -1.26 -1.51 121.20 120.58 1krw s ILE 5 Ca 0.05 -1.02 -0.05 0.00 -1.10 0.00 0.00 60.65 58.52 1krw s ILE 5 Cb -0.01 -2.93 -0.03 0.00 -1.06 0.00 0.00 42.46 38.43 1krw s ILE 5 CO 0.72 -0.02 0.00 0.54 -0.10 0.00 0.00 174.94 176.08 1krw s VAL 6 N 1.39 4.08 -0.05 2.92 0.11 0.76 0.10 120.40 129.71 1krw s VAL 6 Ca -0.01 -0.28 0.04 0.00 -2.93 0.00 0.00 61.98 58.80 1krw s VAL 6 Cb -0.18 -2.83 -0.03 0.00 -1.53 0.00 0.00 36.38 31.81 1krw s VAL 6 CO 0.01 0.44 -0.14 0.26 -3.33 0.00 0.00 175.10 172.34 1krw s TRP 7 N 0.82 2.70 0.08 1.54 0.52 -1.10 -2.40 118.94 121.09 1krw s TRP 7 Ca 0.01 -0.15 0.08 0.00 0.02 0.00 0.00 56.10 56.06 1krw s TRP 7 Cb -0.14 -1.62 -0.03 0.00 -1.15 0.00 0.00 33.47 30.52 1krw s TRP 7 CO 0.02 0.19 -0.22 0.08 0.02 0.00 0.00 176.95 177.04 1krw s VAL 8 N -0.74 1.81 -0.19 4.03 1.01 0.17 0.29 120.40 126.78 1krw s VAL 8 Ca 0.12 -1.44 -0.01 0.00 0.00 0.00 0.00 61.98 60.64 1krw s VAL 8 Cb -0.11 -1.61 0.05 0.00 0.00 0.00 0.00 36.38 34.72 1krw s VAL 8 CO 0.01 0.09 -0.01 -0.69 0.00 0.00 0.00 175.10 174.50 1krw s VAL 9 N -0.99 0.92 0.00 2.92 1.01 0.23 -1.20 120.40 123.30 1krw s VAL 9 Ca 0.08 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1krw s VAL 9 Cb -0.10 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 35.02 1krw s VAL 9 CO 0.03 -0.06 0.00 -0.67 0.00 0.00 0.00 175.10 174.40 1krw n ASP 10 N 4.91 0.00 0.00 3.32 -0.08 -1.15 -1.03 116.55 122.53 1krw n ASP 10 Ca -0.10 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.23 1krw n ASP 10 Cb 0.47 0.00 0.31 0.00 2.34 0.00 0.00 41.12 44.23 1krw n ASP 10 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1krw n ASP 11 N 0.00 0.00 0.00 1.67 9.92 -1.26 -2.80 116.55 124.08 1krw n ASP 11 Ca 0.00 -0.19 0.00 0.00 -0.53 0.00 0.00 54.79 54.07 1krw n ASP 11 Cb 0.00 -0.09 0.00 0.00 -0.64 0.00 0.00 41.12 40.39 1krw n ASP 11 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1krw n ASP 12 N -1.09 -1.26 0.00 -2.24 2.03 -1.24 -4.71 116.55 108.03 1krw n ASP 12 Ca 0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.38 1krw n ASP 12 Cb 0.05 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.45 1krw n ASP 12 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1krw n SER 13 N -1.49 0.00 0.14 1.67 2.88 -1.26 -0.87 113.62 114.68 1krw n SER 13 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1krw n SER 13 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 1krw n SER 13 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1krw h SER 14 N 0.00 -1.00 0.10 -3.46 0.02 -2.00 0.47 113.55 107.68 1krw h SER 14 Ca 0.00 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1krw h SER 14 Cb 0.00 0.35 -0.00 0.00 0.14 0.00 0.00 62.40 62.89 1krw h SER 14 CO 0.00 -0.41 -0.04 0.40 -1.14 0.00 0.00 176.83 175.64 1krw h ILE 15 N -0.59 0.60 0.25 3.27 1.08 -1.34 -2.49 117.51 118.28 1krw h ILE 15 Ca -0.02 -0.17 -0.01 0.00 -0.39 0.00 0.00 64.86 64.26 1krw h ILE 15 Cb 0.55 1.11 0.00 0.00 -3.07 0.00 0.00 36.82 35.41 1krw h ILE 15 CO -0.12 0.04 -0.12 -0.09 -0.69 0.00 0.00 178.15 177.17 1krw h ARG 16 N 0.00 -0.32 -0.91 2.37 2.43 -1.17 -2.70 114.38 114.08 1krw h ARG 16 Ca -0.00 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.23 1krw h ARG 16 Cb 0.11 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 1krw h ARG 16 CO 0.01 0.04 0.59 2.35 -1.51 0.00 0.00 179.97 181.44 1krw h TRP 17 N -0.90 1.10 -0.06 2.20 7.01 0.09 0.60 115.95 125.99 1krw h TRP 17 Ca -0.03 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 1krw h TRP 17 Cb 0.50 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 27.20 1krw h TRP 17 CO 0.05 0.63 0.01 0.28 -2.79 0.00 0.00 178.44 176.62 1krw h VAL 18 N 1.14 1.22 0.00 2.65 2.07 -1.54 -3.06 116.25 118.71 1krw h VAL 18 Ca 0.36 -0.66 -0.11 0.00 0.82 0.00 0.00 66.70 67.12 1krw h VAL 18 Cb 0.01 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1krw h VAL 18 CO -0.12 0.18 -0.70 0.25 0.02 0.00 0.00 177.57 177.20 1krw h LEU 19 N -0.15 0.00 0.55 2.57 5.85 -1.34 -3.09 115.31 119.70 1krw h LEU 19 Ca 0.02 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1krw h LEU 19 Cb 0.28 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.32 1krw h LEU 19 CO 0.00 0.48 -0.27 1.05 -0.34 0.00 0.00 178.44 179.37 1krw h GLU 20 N 0.00 -0.71 -0.06 1.25 4.11 0.18 -1.91 114.58 117.45 1krw h GLU 20 Ca -0.04 0.05 -0.01 0.00 0.07 0.00 0.00 59.36 59.43 1krw h GLU 20 Cb 1.40 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.81 1krw h GLU 20 CO 0.06 -0.41 -0.01 0.00 0.07 0.00 0.00 179.01 178.72 1krw h ARG 21 N -1.03 0.11 -0.96 1.06 2.47 -1.70 -0.86 114.38 113.47 1krw h ARG 21 Ca -0.08 -0.04 0.05 0.00 -1.26 0.00 0.00 59.98 58.65 1krw h ARG 21 Cb 0.64 -0.01 -0.06 0.00 -1.65 0.00 0.00 29.97 28.89 1krw h ARG 21 CO 0.12 0.43 0.62 0.00 0.56 0.00 0.00 179.97 181.70 1krw h ALA 22 N 0.67 1.29 0.00 0.04 0.00 -1.65 -0.65 119.26 118.97 1krw h ALA 22 Ca 0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1krw h ALA 22 Cb 0.39 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1krw h ALA 22 CO 0.00 0.46 -0.45 1.25 0.00 0.00 0.00 179.25 180.52 1krw h LEU 23 N 1.17 0.00 -1.07 0.00 6.46 -1.35 -2.87 115.31 117.65 1krw h LEU 23 Ca 0.39 0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 58.08 1krw h LEU 23 Cb 0.07 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1krw h LEU 23 CO -0.14 0.45 -0.17 0.00 -0.62 0.00 0.00 178.44 177.96 1krw h ALA 24 N 1.55 1.22 0.00 1.25 0.00 0.16 -0.35 119.26 123.10 1krw h ALA 24 Ca -0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1krw h ALA 24 Cb 1.21 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1krw h ALA 24 CO 0.06 0.50 -0.11 0.78 0.00 0.00 0.00 179.25 180.48 1krw h GLY 25 N 0.95 0.00 2.00 0.00 0.00 -0.94 -0.40 103.07 104.67 1krw h GLY 25 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1krw h GLY 25 CO 0.03 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.57 1krw h ALA 26 N 1.89 1.00 0.00 3.60 0.00 -1.05 -3.47 119.26 121.23 1krw h ALA 26 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1krw h ALA 26 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1krw h ALA 26 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1krw n GLY 27 N 0.86 1.37 3.34 0.00 0.00 -0.16 -5.10 105.19 105.50 1krw n GLY 27 Ca 0.04 -0.20 -0.17 0.00 0.00 0.00 0.00 46.02 45.69 1krw n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1krw s LEU 28 N 0.00 1.84 -0.46 0.99 1.02 -1.18 -4.83 118.68 116.06 1krw s LEU 28 Ca 0.00 -1.35 -0.22 0.00 0.02 0.00 0.00 54.13 52.58 1krw s LEU 28 Cb 0.00 -0.10 0.03 0.00 0.02 0.00 0.00 46.19 46.14 1krw s LEU 28 CO 0.00 -0.67 0.74 -0.89 0.02 0.00 0.00 176.35 175.55 1krw s THR 29 N -3.62 4.70 -0.35 5.49 2.01 -0.57 -4.09 115.64 119.22 1krw s THR 29 Ca 0.36 0.22 -0.08 0.00 0.31 0.00 0.00 61.69 62.49 1krw s THR 29 Cb 0.08 -4.31 0.03 0.00 0.01 0.00 0.00 72.50 68.31 1krw s THR 29 CO 0.13 -0.73 0.14 0.00 -0.69 0.00 0.00 174.62 173.46 1krw s THR 31 N 1.47 2.49 0.26 0.00 -1.32 -1.01 -4.62 115.64 112.91 1krw s THR 31 Ca 0.00 -1.91 0.08 0.00 -1.21 0.00 0.00 61.69 58.64 1krw s THR 31 Cb -0.19 -2.19 -0.05 0.00 -1.51 0.00 0.00 72.50 68.56 1krw s THR 31 CO 0.04 -0.08 -0.10 0.42 -2.21 0.00 0.00 174.62 172.70 1krw s THR 32 N -1.57 1.76 0.37 5.08 -4.23 -1.26 0.44 115.64 116.23 1krw s THR 32 Ca 0.20 -2.18 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 1krw s THR 32 Cb -0.08 -2.31 -0.04 0.00 1.34 0.00 0.00 72.50 71.41 1krw s THR 32 CO 0.10 -0.40 0.09 -0.36 -0.54 0.00 0.00 174.62 173.51 1krw s PHE 33 N -2.95 1.84 0.31 3.99 0.40 -0.34 -4.92 117.98 116.30 1krw s PHE 33 Ca 0.27 -1.14 -0.00 0.00 -0.60 0.00 0.00 56.93 55.46 1krw s PHE 33 Cb 0.01 -1.20 0.48 0.00 0.51 0.00 0.00 43.02 42.82 1krw s PHE 33 CO 0.11 -0.16 1.92 1.05 0.70 0.00 0.00 175.22 178.83 1krw h GLU 34 N 1.95 0.90 0.00 0.44 4.11 -1.91 -3.04 114.58 117.04 1krw h GLU 34 Ca -0.38 -0.11 0.00 0.00 0.07 0.00 0.00 59.36 58.94 1krw h GLU 34 Cb 1.26 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1krw h GLU 34 CO 0.63 0.68 0.00 0.09 0.07 0.00 0.00 179.01 180.48 1krw n ASN 35 N -4.36 -1.45 0.16 3.06 5.03 -1.12 -4.05 115.26 112.54 1krw n ASN 35 Ca 0.06 0.47 0.00 0.00 0.87 0.00 0.00 54.58 55.98 1krw n ASN 35 Cb 0.12 1.59 0.00 0.00 -1.02 0.00 0.00 39.78 40.46 1krw n ASN 35 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1krw n GLY 36 N -1.25 -1.56 0.43 7.41 0.00 -1.26 -3.75 105.19 105.21 1krw n GLY 36 Ca 0.00 0.37 0.25 0.00 0.00 0.00 0.00 46.02 46.64 1krw n GLY 36 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1krw h ASN 37 N 0.00 0.34 0.08 1.61 -0.00 -1.97 -1.65 115.58 113.99 1krw h ASN 37 Ca 0.00 0.07 0.02 0.00 -0.00 0.00 0.00 56.30 56.39 1krw h ASN 37 Cb 0.00 0.01 -0.03 0.00 -0.00 0.00 0.00 38.32 38.30 1krw h ASN 37 CO 0.00 0.06 -0.24 -0.08 -0.00 0.00 0.00 177.43 177.17 1krw h GLU 38 N 0.30 -0.41 -0.77 6.67 4.22 -1.98 -1.63 114.58 120.98 1krw h GLU 38 Ca 0.59 0.03 0.03 0.00 0.08 0.00 0.00 59.36 60.09 1krw h GLU 38 Cb 1.67 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 30.96 1krw h GLU 38 CO -0.24 -0.27 0.49 0.28 -2.18 0.00 0.00 179.01 177.09 1krw h VAL 39 N -0.43 1.11 -0.70 0.32 2.07 -1.69 0.94 116.25 117.88 1krw h VAL 39 Ca 0.04 -0.33 0.13 0.00 0.82 0.00 0.00 66.70 67.36 1krw h VAL 39 Cb 0.47 0.08 -0.09 0.00 -1.52 0.00 0.00 31.29 30.22 1krw h VAL 39 CO -0.16 0.17 0.22 -0.07 0.02 0.00 0.00 177.57 177.75 1krw h LEU 40 N 0.95 0.14 -0.04 2.57 3.38 -1.24 1.41 115.31 122.48 1krw h LEU 40 Ca 0.31 0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.33 1krw h LEU 40 Cb 0.01 0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1krw h LEU 40 CO -0.11 0.05 -0.22 0.00 0.09 0.00 0.00 178.44 178.25 1krw h ALA 41 N 1.53 0.08 -0.10 1.53 0.00 -0.65 -3.20 119.26 118.45 1krw h ALA 41 Ca 0.38 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1krw h ALA 41 Cb 0.58 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1krw h ALA 41 CO -0.42 0.07 0.02 0.00 0.00 0.00 0.00 179.25 178.92 1krw h ALA 42 N 0.38 1.86 0.00 0.00 0.00 -0.15 -1.13 119.26 120.22 1krw h ALA 42 Ca -0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1krw h ALA 42 Cb 0.88 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1krw h ALA 42 CO 0.04 0.12 -0.03 -0.07 0.00 0.00 0.00 179.25 179.31 1krw h LEU 43 N 0.14 0.00 -2.11 0.00 3.38 0.19 -2.86 115.31 114.05 1krw h LEU 43 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1krw h LEU 43 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1krw h LEU 43 CO -0.00 0.03 0.15 0.00 0.09 0.00 0.00 178.44 178.71 1krw h ALA 44 N 1.97 1.14 0.00 1.53 0.00 -1.21 -1.29 119.26 121.39 1krw h ALA 44 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1krw h ALA 44 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1krw h ALA 44 CO 0.00 -0.14 0.00 0.45 0.00 0.00 0.00 179.25 179.57 1krw n SER 45 N -2.73 0.83 -3.49 0.00 2.88 -1.08 -5.07 113.62 104.94 1krw n SER 45 Ca -0.02 -0.97 -0.11 0.00 -1.33 0.00 0.00 58.87 56.43 1krw n SER 45 Cb 0.20 0.04 -0.03 0.00 -0.75 0.00 0.00 64.21 63.67 1krw n SER 45 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1krw s LYS 46 N -0.04 0.96 -0.10 -1.46 2.20 -0.49 -5.16 119.74 115.66 1krw s LYS 46 Ca 0.00 -0.21 -0.03 0.00 -0.36 0.00 0.00 55.97 55.37 1krw s LYS 46 Cb 0.00 0.45 0.04 0.00 -1.51 0.00 0.00 37.83 36.81 1krw s LYS 46 CO 0.00 -0.39 0.06 0.99 -0.36 0.00 0.00 175.35 175.65 1krw s THR 47 N -2.75 0.00 0.85 3.43 2.01 -1.26 -4.07 115.64 113.86 1krw s THR 47 Ca 0.01 0.13 -0.12 0.00 0.31 0.00 0.00 61.69 62.01 1krw s THR 47 Cb -0.01 -0.40 0.10 0.00 0.01 0.00 0.00 72.50 72.20 1krw s THR 47 CO -0.06 0.01 1.10 -2.16 -0.69 0.00 0.00 174.62 172.82 1krw s PRO 48 N 2.11 1.62 0.30 4.92 0.04 -1.26 -4.96 135.00 137.77 1krw s PRO 48 Ca 0.04 0.72 0.15 0.00 0.04 0.00 0.00 61.00 61.95 1krw s PRO 48 Cb -0.14 -1.86 0.34 0.00 0.04 0.00 0.00 34.50 32.89 1krw s PRO 48 CO -0.06 -1.96 1.57 -0.44 0.04 0.00 0.00 177.00 176.15 1krw h ASP 49 N -1.34 0.00 -2.08 6.66 5.19 0.28 -3.42 116.42 121.71 1krw h ASP 49 Ca -0.48 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 55.67 1krw h ASP 49 Cb 1.28 0.00 -0.32 0.00 0.18 0.00 0.00 39.33 40.47 1krw h ASP 49 CO 0.57 0.54 -0.57 0.54 -3.12 0.00 0.00 179.24 177.20 1krw s VAL 50 N -3.31 -0.48 -0.03 -1.35 0.11 -1.17 -4.82 120.40 109.34 1krw s VAL 50 Ca 0.01 -0.26 -0.23 0.00 -2.93 0.00 0.00 61.98 58.57 1krw s VAL 50 Cb 0.10 -0.88 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 1krw s VAL 50 CO 0.73 -0.29 0.70 -0.22 -3.33 0.00 0.00 175.10 172.70 1krw s LEU 51 N 2.44 4.37 -0.18 2.54 2.96 -0.98 -2.73 118.68 127.10 1krw s LEU 51 Ca 0.10 1.25 -0.01 0.00 -0.22 0.00 0.00 54.13 55.24 1krw s LEU 51 Cb -0.14 -3.09 -0.00 0.00 0.50 0.00 0.00 46.19 43.45 1krw s LEU 51 CO -0.23 -0.04 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.42 1krw s LEU 52 N 0.41 2.63 -0.02 -0.68 0.20 0.14 -0.59 118.68 120.76 1krw s LEU 52 Ca 0.37 -0.44 0.06 0.00 0.69 0.00 0.00 54.13 54.80 1krw s LEU 52 Cb -0.18 -1.63 -0.01 0.00 -0.43 0.00 0.00 46.19 43.94 1krw s LEU 52 CO 0.19 0.04 -0.18 -0.44 -0.29 0.00 0.00 176.35 175.67 1krw s SER 53 N 1.07 2.17 0.84 3.68 0.01 0.13 0.78 113.70 122.39 1krw s SER 53 Ca -0.00 -0.34 -0.00 0.00 1.31 0.00 0.00 55.95 56.92 1krw s SER 53 Cb -0.15 -0.27 0.00 0.00 0.21 0.00 0.00 66.02 65.82 1krw s SER 53 CO -0.03 0.22 0.01 -0.67 0.41 0.00 0.00 173.24 173.18 1krw n ASP 54 N 2.66 0.00 -3.27 2.44 2.03 -0.20 -2.77 116.55 117.45 1krw n ASP 54 Ca -0.15 -1.00 -0.06 0.00 0.52 0.00 0.00 54.79 54.09 1krw n ASP 54 Cb 0.54 -0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.89 1krw n ASP 54 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1krw s ILE 55 N -0.69 -0.72 0.00 5.18 2.07 -1.26 -4.62 121.20 121.15 1krw s ILE 55 Ca 0.00 -0.40 0.00 0.00 -1.41 0.00 0.00 60.65 58.85 1krw s ILE 55 Cb -0.00 -0.36 0.00 0.00 0.13 0.00 0.00 42.46 42.23 1krw s ILE 55 CO 0.00 -0.24 0.00 -2.11 -1.91 0.00 0.00 174.94 170.68 1krw n ARG 56 N 4.45 0.00 0.14 3.50 1.85 -0.27 -4.61 116.66 121.71 1krw n ARG 56 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.95 1krw n ARG 56 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 1krw n ARG 56 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1krw n MET 57 N 0.00 0.00 -0.45 2.89 1.56 0.09 -5.03 117.12 116.17 1krw n MET 57 Ca 0.00 0.00 -0.26 0.00 -0.27 0.00 0.00 57.70 57.17 1krw n MET 57 Cb 0.00 0.00 0.21 0.00 2.15 0.00 0.00 33.22 35.58 1krw n MET 57 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1krw n PRO 58 N -3.07 -3.00 0.16 2.12 -0.04 -1.07 -4.79 135.00 125.31 1krw n PRO 58 Ca 0.00 -0.88 -0.17 0.00 -0.04 0.00 0.00 63.50 62.41 1krw n PRO 58 Cb 0.00 -1.75 -0.10 0.00 -0.04 0.00 0.00 33.50 31.62 1krw n PRO 58 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1krw h GLY 59 N -2.88 -1.15 -4.36 0.55 0.00 -1.97 -2.37 103.07 90.89 1krw h GLY 59 Ca -0.40 0.61 -0.36 0.00 0.00 0.00 0.00 47.33 47.18 1krw h GLY 59 CO 0.27 -0.30 0.63 -0.13 0.00 0.00 0.00 176.54 177.02 1krw n MET 60 N -5.51 2.51 0.00 4.80 0.00 -1.26 -4.86 117.12 112.81 1krw n MET 60 Ca -0.09 -1.59 0.00 0.00 -0.00 0.00 0.00 57.70 56.02 1krw n MET 60 Cb 0.42 -2.20 0.00 0.00 0.00 0.00 0.00 33.22 31.45 1krw n MET 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1krw n ASP 61 N 2.34 0.00 0.00 6.12 8.00 -0.89 -1.43 116.55 130.69 1krw n ASP 61 Ca 0.51 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.01 1krw n ASP 61 Cb 0.70 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.80 1krw n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1krw n GLY 62 N 0.00 0.08 0.37 0.44 0.00 -1.26 -0.73 105.19 104.09 1krw n GLY 62 Ca 0.00 -0.04 0.19 0.00 0.00 0.00 0.00 46.02 46.16 1krw n GLY 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1krw h LEU 63 N 0.00 0.00 -1.61 0.99 4.07 -1.52 0.42 115.31 117.65 1krw h LEU 63 Ca 0.00 0.00 0.08 0.00 0.08 0.00 0.00 57.88 58.04 1krw h LEU 63 Cb 0.00 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 1krw h LEU 63 CO 0.00 0.00 0.39 0.00 -1.08 0.00 0.00 178.44 177.75 1krw h ALA 64 N 1.46 1.95 -0.60 1.53 0.00 -1.86 0.37 119.26 122.11 1krw h ALA 64 Ca 0.14 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1krw h ALA 64 Cb 0.94 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1krw h ALA 64 CO -0.00 -0.07 0.40 -0.07 0.00 0.00 0.00 179.25 179.51 1krw h LEU 65 N 0.45 0.67 -0.50 0.00 3.38 -0.47 -1.98 115.31 116.86 1krw h LEU 65 Ca 0.26 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 1krw h LEU 65 Cb 0.44 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1krw h LEU 65 CO -0.07 0.48 0.18 -0.07 0.09 0.00 0.00 178.44 179.05 1krw h LEU 66 N 0.79 0.72 -0.31 1.67 -0.00 -1.03 -0.86 115.31 116.28 1krw h LEU 66 Ca 0.22 -0.19 0.07 0.00 -0.00 0.00 0.00 57.88 57.98 1krw h LEU 66 Cb -0.06 -0.19 -0.07 0.00 -0.00 0.00 0.00 40.66 40.35 1krw h LEU 66 CO -0.05 0.71 -0.12 0.11 -0.00 0.00 0.00 178.44 179.10 1krw h LYS 67 N 0.68 -0.05 -0.71 1.13 1.79 -1.23 -0.59 116.57 117.59 1krw h LYS 67 Ca 0.16 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.60 1krw h LYS 67 Cb 0.24 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.87 1krw h LYS 67 CO -0.01 -0.03 0.30 1.96 -1.08 0.00 0.00 179.45 180.59 1krw h GLN 68 N -0.05 1.04 -0.55 3.15 1.08 -1.27 -2.84 115.11 115.66 1krw h GLN 68 Ca 0.16 -0.17 0.08 0.00 -1.45 0.00 0.00 58.65 57.27 1krw h GLN 68 Cb 0.29 -0.18 -0.06 0.00 -0.05 0.00 0.00 27.48 27.48 1krw h GLN 68 CO -0.35 0.83 0.21 0.82 -0.95 0.00 0.00 178.83 179.38 1krw h ILE 69 N 1.02 0.81 0.00 2.54 2.04 0.33 0.41 117.51 124.66 1krw h ILE 69 Ca 0.24 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.91 1krw h ILE 69 Cb 0.17 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1krw h ILE 69 CO -0.02 0.07 -0.29 0.07 0.00 0.00 0.00 178.15 177.98 1krw h LYS 70 N 0.39 0.00 0.18 2.37 2.10 -1.09 0.82 116.57 121.34 1krw h LYS 70 Ca 0.27 0.00 -0.35 0.00 -2.00 0.00 0.00 60.65 58.57 1krw h LYS 70 Cb 0.30 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.64 1krw h LYS 70 CO -0.27 0.29 -1.76 1.96 -2.00 0.00 0.00 179.45 177.67 1krw h GLN 71 N 0.00 0.38 0.00 0.07 4.20 -0.98 -3.42 115.11 115.36 1krw h GLN 71 Ca -0.00 -0.66 -0.35 0.00 0.06 0.00 0.00 58.65 57.70 1krw h GLN 71 Cb 0.70 0.24 -0.06 0.00 0.30 0.00 0.00 27.48 28.66 1krw h GLN 71 CO 0.04 1.31 -2.31 0.54 -0.67 0.00 0.00 178.83 177.73 1krw n ARG 72 N -3.58 0.57 -3.05 1.46 1.74 0.13 -4.97 116.66 108.97 1krw n ARG 72 Ca -0.25 0.14 -0.39 0.00 -0.77 0.00 0.00 57.85 56.58 1krw n ARG 72 Cb 1.07 -1.45 -0.06 0.00 -1.02 0.00 0.00 32.46 31.01 1krw n ARG 72 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1krw s HIS 73 N -2.46 3.79 -0.54 -1.55 3.76 0.28 -4.88 115.29 113.69 1krw s HIS 73 Ca -0.31 1.46 -0.25 0.00 -0.15 0.00 0.00 55.06 55.81 1krw s HIS 73 Cb 0.08 -2.74 -0.23 0.00 1.11 0.00 0.00 32.58 30.81 1krw s HIS 73 CO 0.52 0.39 1.82 -2.30 -0.85 0.00 0.00 174.74 174.33 1krw n PRO 74 N 2.31 1.02 -3.07 8.40 -0.02 -1.26 -4.10 135.00 138.27 1krw n PRO 74 Ca -0.05 -1.59 -0.20 0.00 -2.02 0.00 0.00 63.50 59.64 1krw n PRO 74 Cb 0.50 -2.82 -0.00 0.00 -0.02 0.00 0.00 33.50 31.16 1krw n PRO 74 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1krw n MET 75 N 7.36 -3.18 -2.09 -0.52 0.00 -1.26 -4.88 117.12 112.55 1krw n MET 75 Ca 0.49 0.52 -0.42 0.00 0.00 0.00 0.00 57.70 58.29 1krw n MET 75 Cb 0.41 -5.21 -0.03 0.00 0.00 0.00 0.00 33.22 28.40 1krw n MET 75 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 175.97 174.80 1krw s LEU 76 N -6.23 4.38 0.12 3.17 2.96 -1.26 -4.56 118.68 117.26 1krw s LEU 76 Ca 0.28 2.48 -0.31 0.00 -0.22 0.00 0.00 54.13 56.36 1krw s LEU 76 Cb -0.14 -3.60 -0.09 0.00 0.50 0.00 0.00 46.19 42.85 1krw s LEU 76 CO 0.34 -0.68 1.65 -2.16 -1.32 0.00 0.00 176.35 174.18 1krw s PRO 77 N 0.60 4.19 0.09 0.98 0.04 -1.24 -4.67 135.00 134.99 1krw s PRO 77 Ca 0.63 2.40 0.09 0.00 0.04 0.00 0.00 61.00 64.17 1krw s PRO 77 Cb -0.40 -3.39 -0.04 0.00 0.04 0.00 0.00 34.50 30.72 1krw s PRO 77 CO 0.34 -0.70 -0.23 0.08 0.04 0.00 0.00 177.00 176.53 1krw s VAL 78 N 1.98 2.49 -0.22 -0.36 1.01 -1.26 -2.33 120.40 121.71 1krw s VAL 78 Ca 0.73 -1.50 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1krw s VAL 78 Cb -0.43 -2.08 0.05 0.00 0.00 0.00 0.00 36.38 33.92 1krw s VAL 78 CO 0.32 0.20 -0.11 -0.63 0.00 0.00 0.00 175.10 174.89 1krw s ILE 79 N -1.00 1.82 -0.03 2.22 1.09 0.24 -0.60 121.20 124.94 1krw s ILE 79 Ca 0.15 -1.21 -0.05 0.00 -1.10 0.00 0.00 60.65 58.43 1krw s ILE 79 Cb -0.10 -1.91 -0.04 0.00 -1.06 0.00 0.00 42.46 39.35 1krw s ILE 79 CO 0.06 0.11 0.20 -0.63 -0.10 0.00 0.00 174.94 174.58 1krw s ILE 80 N 1.30 5.42 -0.00 2.92 -1.09 -1.12 0.21 121.20 128.83 1krw s ILE 80 Ca -0.03 0.02 -0.06 0.00 -2.23 0.00 0.00 60.65 58.34 1krw s ILE 80 Cb -0.17 -3.52 -0.04 0.00 -1.58 0.00 0.00 42.46 37.16 1krw s ILE 80 CO -0.08 0.41 0.71 -0.03 -1.23 0.00 0.00 174.94 174.72 1krw h MET 81 N 4.14 -0.23 -6.19 2.79 1.85 -1.78 -1.71 114.93 113.81 1krw h MET 81 Ca -0.51 0.02 -0.49 0.00 -0.61 0.00 0.00 59.70 58.11 1krw h MET 81 Cb 1.20 0.05 -0.03 0.00 0.43 0.00 0.00 31.60 33.25 1krw h MET 81 CO 0.66 -0.15 -0.38 0.99 -0.40 0.00 0.00 176.91 177.63 1krw s THR 82 N -2.80 2.74 0.00 -0.77 2.01 -1.25 -1.59 115.64 113.98 1krw s THR 82 Ca -0.03 -1.33 0.00 0.00 0.31 0.00 0.00 61.69 60.64 1krw s THR 82 Cb 0.00 -3.01 0.00 0.00 0.01 0.00 0.00 72.50 69.50 1krw s THR 82 CO 0.10 -0.01 0.28 0.00 -0.69 0.00 0.00 174.62 174.30 1krw n ALA 83 N -1.55 1.86 0.00 7.40 0.00 -1.26 -4.76 120.51 122.19 1krw n ALA 83 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1krw n ALA 83 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 1krw n ALA 83 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1krw n HIS 84 N -0.22 -0.04 0.17 0.00 8.25 -1.26 -2.53 115.22 119.59 1krw n HIS 84 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.53 1krw n HIS 84 Cb 0.04 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.23 1krw n HIS 84 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1krw h SER 85 N 0.00 0.00 0.00 0.41 0.02 -2.00 -3.26 113.55 108.72 1krw h SER 85 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1krw h SER 85 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1krw h SER 85 CO 0.00 0.26 0.00 0.47 -1.14 0.00 0.00 176.83 176.42 1krw n ASP 86 N -3.12 1.31 -0.05 3.07 8.00 -1.25 -4.38 116.55 120.12 1krw n ASP 86 Ca 0.02 -1.98 0.22 0.00 0.71 0.00 0.00 54.79 53.76 1krw n ASP 86 Cb 0.64 -0.50 0.47 0.00 -0.02 0.00 0.00 41.12 41.72 1krw n ASP 86 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1krw h LEU 87 N 0.17 0.00 -1.18 0.64 7.12 -1.54 -1.13 115.31 119.39 1krw h LEU 87 Ca 0.00 0.00 0.25 0.00 0.13 0.00 0.00 57.88 58.26 1krw h LEU 87 Cb 0.57 0.00 -0.11 0.00 -0.53 0.00 0.00 40.66 40.60 1krw h LEU 87 CO 0.00 0.00 0.63 0.44 -0.13 0.00 0.00 178.44 179.38 1krw h ASP 88 N 0.00 0.57 0.97 1.25 5.19 -1.89 0.27 116.42 122.79 1krw h ASP 88 Ca 0.34 0.11 -0.04 0.00 -0.62 0.00 0.00 57.03 56.82 1krw h ASP 88 Cb 2.28 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 41.80 1krw h ASP 88 CO -0.00 0.11 -0.17 0.00 -3.12 0.00 0.00 179.24 176.06 1krw h ALA 89 N 1.67 1.02 0.00 3.45 0.00 -1.56 -2.91 119.26 120.93 1krw h ALA 89 Ca 0.61 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 55.23 1krw h ALA 89 Cb 1.33 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1krw h ALA 89 CO -0.38 0.21 -0.66 0.00 0.00 0.00 0.00 179.25 178.42 1krw h ALA 90 N 1.83 0.89 -0.40 0.00 0.00 -0.64 -2.79 119.26 118.16 1krw h ALA 90 Ca -0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1krw h ALA 90 Cb 0.70 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1krw h ALA 90 CO 0.02 0.83 0.21 0.28 0.00 0.00 0.00 179.25 180.59 1krw h VAL 91 N 0.00 1.15 0.00 0.00 2.07 -1.37 -0.57 116.25 117.53 1krw h VAL 91 Ca -0.01 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1krw h VAL 91 Cb 1.18 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1krw h VAL 91 CO 0.09 0.16 -0.08 0.77 0.02 0.00 0.00 177.57 178.52 1krw h SER 92 N 0.51 0.00 -0.70 0.57 4.64 -1.63 -2.15 113.55 114.79 1krw h SER 92 Ca 0.14 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.39 1krw h SER 92 Cb 0.07 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.13 1krw h SER 92 CO -0.02 0.08 0.17 0.00 -0.87 0.00 0.00 176.83 176.20 1krw h ALA 93 N 1.92 0.97 0.00 5.18 0.00 -0.84 -1.18 119.26 125.31 1krw h ALA 93 Ca -0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 1krw h ALA 93 Cb 0.44 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1krw h ALA 93 CO 0.01 0.66 -0.18 1.88 0.00 0.00 0.00 179.25 181.62 1krw h TYR 94 N 1.07 0.00 -0.19 0.00 0.05 -0.86 0.70 116.97 117.74 1krw h TYR 94 Ca 0.22 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.96 1krw h TYR 94 Cb 0.37 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.10 1krw h TYR 94 CO 0.03 0.18 -0.05 0.37 -1.05 0.00 0.00 178.16 177.64 1krw h GLN 95 N 0.00 0.37 0.00 4.88 -0.00 -1.05 -2.88 115.11 116.43 1krw h GLN 95 Ca -0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 58.65 58.50 1krw h GLN 95 Cb 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.06 1krw h GLN 95 CO 0.02 0.63 0.00 -0.56 0.00 0.00 0.00 178.83 178.93 1krw h GLN 96 N 0.08 0.00 0.00 1.69 -0.00 -1.28 -3.46 115.11 112.14 1krw h GLN 96 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.70 1krw h GLN 96 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.98 1krw h GLN 96 CO 0.02 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.26 1krw n GLY 97 N 0.73 1.61 3.71 0.06 0.00 -0.83 -4.58 105.19 105.89 1krw n GLY 97 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1krw n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1krw s ALA 98 N -2.00 1.98 -0.09 4.61 0.00 0.24 -3.66 121.76 122.85 1krw s ALA 98 Ca 0.00 0.77 -0.20 0.00 0.00 0.00 0.00 51.96 52.52 1krw s ALA 98 Cb 0.00 -3.45 -0.17 0.00 0.00 0.00 0.00 23.12 19.50 1krw s ALA 98 CO 0.00 -2.07 0.70 0.35 0.00 0.00 0.00 175.76 174.74 1krw h PHE 99 N -0.72 -0.08 0.00 0.00 3.57 -1.13 -3.44 116.94 115.14 1krw h PHE 99 Ca -0.46 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1krw h PHE 99 Cb 1.28 0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.05 1krw h PHE 99 CO 0.49 0.47 0.00 -0.25 -2.23 0.00 0.00 178.31 176.78 1krw n ASP 100 N -4.79 0.00 -4.09 0.41 9.92 -1.17 -5.01 116.55 111.82 1krw n ASP 100 Ca -0.07 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.07 1krw n ASP 100 Cb 0.29 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.66 1krw n ASP 100 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1krw s TYR 101 N -3.00 0.73 -0.27 1.24 1.51 -1.26 -2.79 117.35 113.51 1krw s TYR 101 Ca 0.00 -0.64 -0.10 0.00 -1.01 0.00 0.00 57.07 55.33 1krw s TYR 101 Cb 0.00 -0.43 -0.04 0.00 -0.11 0.00 0.00 41.96 41.37 1krw s TYR 101 CO 0.00 -0.11 0.15 -0.51 -1.11 0.00 0.00 175.55 173.96 1krw s LEU 102 N -2.05 3.81 0.01 -1.29 1.02 -0.62 -4.98 118.68 114.58 1krw s LEU 102 Ca -0.03 -0.08 -0.09 0.00 0.02 0.00 0.00 54.13 53.95 1krw s LEU 102 Cb -0.05 -2.05 -0.05 0.00 0.02 0.00 0.00 46.19 44.06 1krw s LEU 102 CO -0.01 -0.04 1.05 1.55 0.02 0.00 0.00 176.35 178.92 1krw h PRO 103 N 8.28 -0.32 0.00 1.29 0.13 -1.92 -3.35 132.00 136.11 1krw h PRO 103 Ca -0.36 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1krw h PRO 103 Cb 1.18 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1krw h PRO 103 CO 0.56 -0.21 -0.47 1.17 -0.23 0.00 0.00 178.00 178.82 1krw n LYS 104 N -2.96 0.00 -0.61 0.86 4.81 -1.26 -4.84 118.16 114.17 1krw n LYS 104 Ca -0.04 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.10 1krw n LYS 104 Cb 0.13 -0.34 0.20 0.00 0.02 0.00 0.00 35.03 35.05 1krw n LYS 104 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1krw n PRO 105 N -3.04 -1.30 0.00 1.64 -0.02 -1.26 -4.96 135.00 126.06 1krw n PRO 105 Ca 0.00 -0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.15 1krw n PRO 105 Cb 0.23 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1krw n PRO 105 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1krw n PHE 106 N -4.50 0.00 -0.12 6.00 7.35 -1.26 -4.86 117.46 120.07 1krw n PHE 106 Ca 0.07 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.76 1krw n PHE 106 Cb 0.53 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.36 1krw n PHE 106 CO 0.00 0.00 0.00 -0.40 -0.76 0.00 0.00 176.76 175.60 1krw n ASP 107 N 0.00 0.00 -0.03 -2.13 5.68 -1.26 -1.71 116.55 117.10 1krw n ASP 107 Ca 0.00 0.00 -0.13 0.00 -0.50 0.00 0.00 54.79 54.16 1krw n ASP 107 Cb 0.00 -0.67 -0.08 0.00 -1.14 0.00 0.00 41.12 39.23 1krw n ASP 107 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 1krw h ILE 108 N -0.24 1.32 -0.10 2.12 5.03 -1.97 -0.89 117.51 122.78 1krw h ILE 108 Ca 0.00 -1.04 0.03 0.00 -0.12 0.00 0.00 64.86 63.74 1krw h ILE 108 Cb 0.88 1.83 -0.06 0.00 -3.03 0.00 0.00 36.82 36.43 1krw h ILE 108 CO 0.00 0.29 -0.49 -2.24 -0.68 0.00 0.00 178.15 175.03 1krw h ASP 109 N -0.18 -1.53 0.44 1.72 2.03 -1.98 1.12 116.42 118.04 1krw h ASP 109 Ca 0.02 0.19 -0.11 0.00 -0.73 0.00 0.00 57.03 56.40 1krw h ASP 109 Cb 0.48 0.60 -0.01 0.00 -0.83 0.00 0.00 39.33 39.57 1krw h ASP 109 CO 0.01 -0.47 -0.50 -0.33 -1.03 0.00 0.00 179.24 176.92 1krw h GLU 110 N -0.57 0.07 0.47 4.15 4.39 -1.62 -0.80 114.58 120.68 1krw h GLU 110 Ca 0.05 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 1krw h GLU 110 Cb 0.67 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1krw h GLU 110 CO -0.40 0.56 -0.23 0.00 -1.16 0.00 0.00 179.01 177.78 1krw h ALA 111 N 1.44 -0.77 -0.66 3.43 0.00 -0.26 -1.68 119.26 120.77 1krw h ALA 111 Ca -0.00 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 54.88 1krw h ALA 111 Cb 0.91 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1krw h ALA 111 CO 0.07 -0.72 0.44 0.28 0.00 0.00 0.00 179.25 179.32 1krw h VAL 112 N -0.96 0.89 -0.41 0.00 2.07 0.12 0.19 116.25 118.16 1krw h VAL 112 Ca -0.07 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1krw h VAL 112 Cb 0.49 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1krw h VAL 112 CO 0.11 0.08 0.27 0.00 0.02 0.00 0.00 177.57 178.05 1krw h ALA 113 N 1.67 0.52 0.00 1.67 0.00 -1.11 -0.88 119.26 121.13 1krw h ALA 113 Ca 0.31 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 1krw h ALA 113 Cb 0.58 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1krw h ALA 113 CO -0.09 -0.02 -0.14 1.25 0.00 0.00 0.00 179.25 180.25 1krw h LEU 114 N 0.56 0.00 0.01 0.00 5.85 -0.16 -3.20 115.31 118.36 1krw h LEU 114 Ca 0.15 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.61 1krw h LEU 114 Cb -0.06 0.00 0.01 0.00 0.37 0.00 0.00 40.66 40.98 1krw h LEU 114 CO -0.03 0.14 -1.14 1.62 -0.34 0.00 0.00 178.44 178.69 1krw h VAL 115 N 0.00 1.41 -0.43 1.05 3.04 -0.11 -3.24 116.25 117.97 1krw h VAL 115 Ca -0.00 -2.70 -0.12 0.00 -1.01 0.00 0.00 66.70 62.87 1krw h VAL 115 Cb 1.03 2.70 -0.01 0.00 -2.01 0.00 0.00 31.29 33.00 1krw h VAL 115 CO 0.02 0.80 -0.21 -0.33 -1.01 0.00 0.00 177.57 176.84 1krw h GLU 116 N 0.17 0.89 0.00 4.17 4.39 -1.23 -2.81 114.58 120.16 1krw h GLU 116 Ca -0.13 -0.39 -0.00 0.00 0.34 0.00 0.00 59.36 59.18 1krw h GLU 116 Cb 1.81 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.44 1krw h GLU 116 CO 0.20 1.04 -0.01 0.00 -1.16 0.00 0.00 179.01 179.08 1krw h ARG 117 N 0.72 0.00 -0.19 2.33 2.47 -1.63 -0.92 114.38 117.15 1krw h ARG 117 Ca 0.09 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.69 1krw h ARG 117 Cb 0.78 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.10 1krw h ARG 117 CO 0.06 0.01 -0.37 0.00 0.56 0.00 0.00 179.97 180.24 1krw h ALA 118 N 1.99 0.31 -0.03 0.04 0.00 -1.52 -2.64 119.26 117.40 1krw h ALA 118 Ca -0.00 -0.44 -0.16 0.00 0.00 0.00 0.00 54.91 54.31 1krw h ALA 118 Cb 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1krw h ALA 118 CO 0.00 0.38 -0.70 0.82 0.00 0.00 0.00 179.25 179.75 1krw h ILE 119 N 0.27 1.45 -0.55 0.00 2.04 -1.36 -3.19 117.51 116.16 1krw h ILE 119 Ca 0.01 -2.26 -0.05 0.00 1.00 0.00 0.00 64.86 63.56 1krw h ILE 119 Cb 0.96 2.20 -0.02 0.00 -0.74 0.00 0.00 36.82 39.22 1krw h ILE 119 CO 0.08 0.66 0.14 -1.28 0.00 0.00 0.00 178.15 177.75 1krw h SER 120 N 0.11 0.84 0.22 1.72 0.87 -1.19 -0.11 113.55 116.00 1krw h SER 120 Ca -0.02 -0.23 -0.03 0.00 -1.23 0.00 0.00 61.79 60.28 1krw h SER 120 Cb 1.25 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1krw h SER 120 CO 0.10 0.85 -0.13 0.45 -0.53 0.00 0.00 176.83 177.57 1krw h HIS 121 N 0.78 0.00 0.00 2.24 3.86 -1.46 -3.11 115.15 117.46 1krw h HIS 121 Ca 0.17 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1krw h HIS 121 Cb 0.34 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.81 1krw h HIS 121 CO 0.02 0.13 -0.18 1.88 0.86 0.00 0.00 177.93 180.65 1krw h TYR 122 N 0.00 0.00 -2.94 2.45 0.05 -1.43 -3.50 116.97 111.60 1krw h TYR 122 Ca -0.00 0.00 0.31 0.00 0.05 0.00 0.00 58.73 59.08 1krw h TYR 122 Cb 0.28 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 37.94 1krw h TYR 122 CO 0.00 0.59 -0.41 0.94 -1.05 0.00 0.00 178.16 178.23 1krw n GLN 123 N -4.66 -2.26 0.00 4.88 0.00 -0.10 -5.13 117.38 110.12 1krw n GLN 123 Ca -0.08 1.49 0.16 0.00 -0.00 0.00 0.00 57.00 58.56 1krw n GLN 123 Cb 0.30 -2.76 0.86 0.00 0.00 0.00 0.00 30.24 28.64 1krw n GLN 123 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15