#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 0.37 0.00 0.03 7.27 -1.26 -4.84 117.38 118.95 1krw n GLN 2 Ca 0.00 -2.16 0.00 0.00 0.07 0.00 0.00 57.00 54.91 1krw n GLN 2 Cb 0.00 1.62 0.00 0.00 2.41 0.00 0.00 30.24 34.27 1krw n GLN 2 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 1krw n ARG 3 N -0.45 0.00 -0.11 3.69 1.85 -1.26 -4.16 116.66 116.22 1krw n ARG 3 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.88 1krw n ARG 3 Cb 0.39 -2.96 0.00 0.00 -1.05 0.00 0.00 32.46 28.84 1krw n ARG 3 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1krw n GLY 4 N -1.62 -0.31 2.94 2.89 0.00 -1.26 -4.66 105.19 103.18 1krw n GLY 4 Ca 0.00 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 1.47 -0.16 -0.61 -1.09 -1.26 -0.43 121.20 119.12 1krw s ILE 5 Ca 0.00 -1.03 -0.03 0.00 -2.23 0.00 0.00 60.65 57.36 1krw s ILE 5 Cb 0.00 -1.66 -0.02 0.00 -1.58 0.00 0.00 42.46 39.20 1krw s ILE 5 CO 0.00 0.03 -0.05 0.54 -1.23 0.00 0.00 174.94 174.23 1krw s VAL 6 N 1.45 3.74 -0.14 2.92 0.11 0.24 0.30 120.40 129.01 1krw s VAL 6 Ca -0.03 -0.41 0.01 0.00 -2.93 0.00 0.00 61.98 58.62 1krw s VAL 6 Cb -0.17 -2.64 -0.00 0.00 -1.53 0.00 0.00 36.38 32.04 1krw s VAL 6 CO -0.07 0.49 -0.17 0.26 -3.33 0.00 0.00 175.10 172.27 1krw s TRP 7 N 0.50 2.73 0.05 1.54 0.52 -1.08 -1.94 118.94 121.28 1krw s TRP 7 Ca -0.04 -1.07 0.08 0.00 0.02 0.00 0.00 56.10 55.09 1krw s TRP 7 Cb -0.14 -1.85 -0.03 0.00 -1.15 0.00 0.00 33.47 30.29 1krw s TRP 7 CO 0.03 -0.47 -0.19 0.08 0.02 0.00 0.00 176.95 176.42 1krw s VAL 8 N 0.72 2.72 -0.23 4.03 1.01 0.12 -0.61 120.40 128.16 1krw s VAL 8 Ca -0.08 -1.26 0.01 0.00 0.00 0.00 0.00 61.98 60.65 1krw s VAL 8 Cb -0.16 -2.15 0.06 0.00 0.00 0.00 0.00 36.38 34.13 1krw s VAL 8 CO 0.01 0.30 -0.07 -0.69 0.00 0.00 0.00 175.10 174.65 1krw s VAL 9 N -0.95 1.65 0.00 2.92 1.01 0.30 -0.45 120.40 124.88 1krw s VAL 9 Ca 0.15 -1.23 0.00 0.00 0.00 0.00 0.00 61.98 60.90 1krw s VAL 9 Cb -0.10 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.43 1krw s VAL 9 CO 0.06 -0.03 0.00 -0.67 0.00 0.00 0.00 175.10 174.46 1krw n ASP 10 N 4.64 0.00 0.00 3.32 -0.08 -0.95 -0.49 116.55 122.99 1krw n ASP 10 Ca -0.13 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.21 1krw n ASP 10 Cb 0.44 0.00 0.32 0.00 2.34 0.00 0.00 41.12 44.23 1krw n ASP 10 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1krw n ASP 11 N 0.00 0.00 0.00 1.67 2.03 -1.26 -3.67 116.55 115.32 1krw n ASP 11 Ca 0.00 -0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.01 1krw n ASP 11 Cb 0.00 -0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.37 1krw n ASP 11 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1krw n ASP 12 N -1.03 -1.52 0.00 1.67 -0.08 -1.26 -4.69 116.55 109.64 1krw n ASP 12 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 1krw n ASP 12 Cb 0.04 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.50 1krw n ASP 12 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1krw n SER 13 N -1.73 0.00 0.16 1.67 2.88 -1.26 -0.90 113.62 114.44 1krw n SER 13 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1krw n SER 13 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 1krw n SER 13 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1krw h SER 14 N 0.00 -0.89 0.09 -3.46 0.87 -1.99 0.92 113.55 109.09 1krw h SER 14 Ca 0.00 0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 1krw h SER 14 Cb 0.00 0.30 -0.00 0.00 -0.44 0.00 0.00 62.40 62.26 1krw h SER 14 CO 0.00 -0.40 -0.06 0.40 -0.53 0.00 0.00 176.83 176.24 1krw h ILE 15 N -0.59 0.86 -0.11 2.23 1.08 -1.35 -1.78 117.51 117.85 1krw h ILE 15 Ca -0.03 -0.21 -0.14 0.00 -0.39 0.00 0.00 64.86 64.08 1krw h ILE 15 Cb 0.53 1.12 0.01 0.00 -3.07 0.00 0.00 36.82 35.41 1krw h ILE 15 CO -0.07 0.06 -0.49 -0.09 -0.69 0.00 0.00 178.15 176.87 1krw h ARG 16 N 0.00 0.52 -0.48 2.37 2.43 -1.31 -2.52 114.38 115.39 1krw h ARG 16 Ca -0.00 -0.42 -0.12 0.00 -0.81 0.00 0.00 59.98 58.63 1krw h ARG 16 Cb 0.12 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1krw h ARG 16 CO 0.01 1.05 -0.16 2.35 -1.51 0.00 0.00 179.97 181.71 1krw h TRP 17 N 0.12 1.08 -0.35 2.20 7.01 0.14 0.13 115.95 126.28 1krw h TRP 17 Ca -0.03 -0.25 -0.16 0.00 2.11 0.00 0.00 58.89 60.56 1krw h TRP 17 Cb 1.13 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.93 1krw h TRP 17 CO 0.11 1.05 -0.42 0.28 -2.79 0.00 0.00 178.44 176.67 1krw h VAL 18 N 0.80 1.28 0.00 2.65 2.07 -1.42 -3.07 116.25 118.56 1krw h VAL 18 Ca 0.12 -1.60 -0.19 0.00 0.82 0.00 0.00 66.70 65.85 1krw h VAL 18 Cb 0.72 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 1krw h VAL 18 CO 0.06 0.53 -1.11 -0.07 0.02 0.00 0.00 177.57 177.00 1krw h LEU 19 N 0.70 0.00 0.49 2.57 3.38 -1.45 -3.19 115.31 117.82 1krw h LEU 19 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1krw h LEU 19 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1krw h LEU 19 CO 0.10 0.77 -0.24 1.05 0.09 0.00 0.00 178.44 180.21 1krw h GLU 20 N 0.00 -0.63 0.24 1.13 4.11 -0.78 -1.55 114.58 117.10 1krw h GLU 20 Ca -0.10 0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.36 1krw h GLU 20 Cb 1.68 0.14 0.00 0.00 0.50 0.00 0.00 28.75 31.07 1krw h GLU 20 CO 0.08 -0.34 -0.12 0.00 0.07 0.00 0.00 179.01 178.71 1krw h ARG 21 N -1.03 -0.31 -0.67 1.06 2.47 -1.71 0.37 114.38 114.56 1krw h ARG 21 Ca -0.07 0.02 0.05 0.00 -1.26 0.00 0.00 59.98 58.72 1krw h ARG 21 Cb 0.59 0.07 -0.05 0.00 -1.65 0.00 0.00 29.97 28.93 1krw h ARG 21 CO 0.11 -0.18 0.39 0.00 0.56 0.00 0.00 179.97 180.85 1krw h ALA 22 N 0.38 0.89 -0.06 0.04 0.00 -1.67 -0.23 119.26 118.61 1krw h ALA 22 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1krw h ALA 22 Cb 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1krw h ALA 22 CO 0.05 0.10 -0.53 1.25 0.00 0.00 0.00 179.25 180.13 1krw h LEU 23 N 0.74 0.18 -1.21 0.00 7.12 -1.15 -2.54 115.31 118.45 1krw h LEU 23 Ca 0.29 -0.09 -0.05 0.00 0.13 0.00 0.00 57.88 58.15 1krw h LEU 23 Cb 0.12 -0.05 -0.02 0.00 -0.53 0.00 0.00 40.66 40.18 1krw h LEU 23 CO -0.15 0.67 -0.04 0.00 -0.13 0.00 0.00 178.44 178.79 1krw h ALA 24 N 1.33 1.35 0.00 1.25 0.00 0.88 -0.82 119.26 123.26 1krw h ALA 24 Ca 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1krw h ALA 24 Cb 0.97 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1krw h ALA 24 CO 0.08 0.44 -0.10 0.78 0.00 0.00 0.00 179.25 180.45 1krw h GLY 25 N 0.85 0.00 2.00 0.00 0.00 -0.64 0.20 103.07 105.47 1krw h GLY 25 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1krw h GLY 25 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 1krw h ALA 26 N 1.90 1.00 0.00 3.60 0.00 -1.12 -3.47 119.26 121.18 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 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 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 0.98 1.46 3.35 0.00 0.00 0.06 -5.11 105.19 105.92 1krw n GLY 27 Ca 0.05 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 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 1.75 -0.16 0.99 1.02 -1.19 -4.77 118.68 116.31 1krw s LEU 28 Ca 0.00 -1.43 -0.16 0.00 0.02 0.00 0.00 54.13 52.56 1krw s LEU 28 Cb 0.00 -0.02 -0.04 0.00 0.02 0.00 0.00 46.19 46.15 1krw s LEU 28 CO 0.00 -0.75 0.39 -0.89 0.02 0.00 0.00 176.35 175.12 1krw s THR 29 N -3.62 5.23 -0.22 5.49 2.01 0.43 -3.97 115.64 120.99 1krw s THR 29 Ca 0.36 0.73 0.02 0.00 0.31 0.00 0.00 61.69 63.11 1krw s THR 29 Cb 0.07 -3.73 0.05 0.00 0.01 0.00 0.00 72.50 68.90 1krw s THR 29 CO 0.15 0.32 -0.12 0.00 -0.69 0.00 0.00 174.62 174.27 1krw s THR 31 N 1.27 2.64 0.29 0.00 -1.32 -0.82 -4.66 115.64 113.04 1krw s THR 31 Ca -0.03 -1.73 0.07 0.00 -1.21 0.00 0.00 61.69 58.79 1krw s THR 31 Cb -0.17 -2.23 -0.06 0.00 -1.51 0.00 0.00 72.50 68.53 1krw s THR 31 CO -0.08 0.00 -0.07 0.42 -2.21 0.00 0.00 174.62 172.68 1krw s THR 32 N -1.36 1.80 0.33 5.08 -4.23 -1.25 0.16 115.64 116.17 1krw s THR 32 Ca 0.19 -2.15 0.03 0.00 -1.18 0.00 0.00 61.69 58.58 1krw s THR 32 Cb -0.09 -2.47 -0.04 0.00 1.34 0.00 0.00 72.50 71.24 1krw s THR 32 CO 0.10 -0.29 0.13 -0.36 -0.54 0.00 0.00 174.62 173.66 1krw s PHE 33 N -2.91 1.70 0.22 3.99 0.40 0.40 -4.91 117.98 116.87 1krw s PHE 33 Ca 0.30 -1.28 -0.08 0.00 -0.60 0.00 0.00 56.93 55.27 1krw s PHE 33 Cb 0.03 -1.00 0.19 0.00 0.51 0.00 0.00 43.02 42.75 1krw s PHE 33 CO 0.13 -0.37 1.85 1.05 0.70 0.00 0.00 175.22 178.57 1krw h GLU 34 N 2.10 1.18 0.00 0.44 4.11 -1.90 -2.52 114.58 117.99 1krw h GLU 34 Ca -0.35 -0.13 0.00 0.00 0.07 0.00 0.00 59.36 58.94 1krw h GLU 34 Cb 1.25 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1krw h GLU 34 CO 0.56 0.86 0.00 0.09 0.07 0.00 0.00 179.01 180.60 1krw n ASN 35 N -4.38 0.00 0.01 3.06 4.13 -1.24 -4.20 115.26 112.64 1krw n ASN 35 Ca 0.09 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.35 1krw n ASN 35 Cb 0.09 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.33 1krw n ASN 35 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1krw n GLY 36 N -0.83 -1.54 0.43 7.41 0.00 -1.26 -4.35 105.19 105.05 1krw n GLY 36 Ca 0.00 0.62 0.24 0.00 0.00 0.00 0.00 46.02 46.88 1krw n GLY 36 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1krw h ASN 37 N 0.00 0.26 -0.11 1.61 -0.26 -1.97 -1.09 115.58 114.02 1krw h ASN 37 Ca 0.00 0.04 0.02 0.00 -0.56 0.00 0.00 56.30 55.80 1krw h ASN 37 Cb 0.00 -0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 37.23 1krw h ASN 37 CO 0.00 0.08 -0.03 -0.08 -1.06 0.00 0.00 177.43 176.34 1krw h GLU 38 N 0.25 -0.01 -0.74 0.81 4.22 -1.97 -0.74 114.58 116.40 1krw h GLU 38 Ca 0.49 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.90 1krw h GLU 38 Cb 1.49 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.71 1krw h GLU 38 CO -0.14 -0.00 0.34 0.28 -2.18 0.00 0.00 179.01 177.30 1krw h VAL 39 N -0.01 1.24 -0.83 0.32 2.07 -1.59 0.12 116.25 117.57 1krw h VAL 39 Ca 0.05 -0.70 0.07 0.00 0.82 0.00 0.00 66.70 66.94 1krw h VAL 39 Cb 0.09 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 30.11 1krw h VAL 39 CO -0.12 0.29 0.50 -0.07 0.02 0.00 0.00 177.57 178.19 1krw h LEU 40 N 1.06 0.77 -0.03 2.57 3.38 -1.10 0.57 115.31 122.53 1krw h LEU 40 Ca 0.25 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 1krw h LEU 40 Cb 0.14 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1krw h LEU 40 CO -0.03 0.49 -0.14 0.00 0.09 0.00 0.00 178.44 178.84 1krw h ALA 41 N 1.40 0.06 0.00 1.53 0.00 -0.62 -3.22 119.26 118.41 1krw h ALA 41 Ca 0.37 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1krw h ALA 41 Cb 0.20 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1krw h ALA 41 CO -0.19 -0.01 -0.16 0.00 0.00 0.00 0.00 179.25 178.90 1krw h ALA 42 N 0.37 1.58 0.00 0.00 0.00 -0.69 -2.23 119.26 118.29 1krw h ALA 42 Ca -0.01 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1krw h ALA 42 Cb 0.80 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1krw h ALA 42 CO 0.03 0.20 -0.19 -0.07 0.00 0.00 0.00 179.25 179.22 1krw h LEU 43 N 0.00 0.00 -1.77 0.00 3.38 0.12 -2.86 115.31 114.18 1krw h LEU 43 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1krw h LEU 43 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1krw h LEU 43 CO 0.02 0.19 0.21 0.00 0.09 0.00 0.00 178.44 178.95 1krw h ALA 44 N 1.81 1.18 0.00 1.53 0.00 -1.42 -0.48 119.26 121.88 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 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1krw h ALA 44 CO 0.03 -0.18 0.00 0.43 0.00 0.00 0.00 179.25 179.53 1krw n SER 45 N -2.59 0.85 -3.48 0.00 7.64 -1.09 -5.07 113.62 109.88 1krw n SER 45 Ca -0.02 -1.05 -0.13 0.00 1.01 0.00 0.00 58.87 58.68 1krw n SER 45 Cb 0.25 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.41 1krw n SER 45 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1krw s LYS 46 N -0.05 1.07 -0.11 1.43 2.20 -0.19 -5.16 119.74 118.93 1krw s LYS 46 Ca 0.00 -0.13 -0.03 0.00 -0.36 0.00 0.00 55.97 55.44 1krw s LYS 46 Cb 0.00 0.50 0.05 0.00 -1.51 0.00 0.00 37.83 36.86 1krw s LYS 46 CO 0.00 -0.41 0.07 0.99 -0.36 0.00 0.00 175.35 175.63 1krw s THR 47 N -2.51 0.01 0.80 3.43 2.01 -1.26 -4.04 115.64 114.08 1krw s THR 47 Ca -0.03 0.05 -0.12 0.00 0.31 0.00 0.00 61.69 61.91 1krw s THR 47 Cb -0.01 -0.45 0.07 0.00 0.01 0.00 0.00 72.50 72.12 1krw s THR 47 CO -0.03 -0.05 1.11 -2.16 -0.69 0.00 0.00 174.62 172.80 1krw s PRO 48 N 2.11 2.03 0.46 4.92 0.04 -1.26 -2.32 135.00 140.97 1krw s PRO 48 Ca 0.03 0.50 0.26 0.00 0.04 0.00 0.00 61.00 61.83 1krw s PRO 48 Cb -0.14 -1.92 0.82 0.00 0.04 0.00 0.00 34.50 33.29 1krw s PRO 48 CO -0.06 -1.63 1.78 -0.44 0.04 0.00 0.00 177.00 176.68 1krw h ASP 49 N -1.09 0.00 -5.36 6.66 3.32 -0.48 -3.44 116.42 116.03 1krw h ASP 49 Ca -0.47 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.45 1krw h ASP 49 Cb 1.28 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.71 1krw h ASP 49 CO 0.61 0.14 -0.34 0.54 -1.72 0.00 0.00 179.24 178.46 1krw s VAL 50 N -3.47 0.02 -0.21 -1.35 0.11 -1.14 -4.59 120.40 109.78 1krw s VAL 50 Ca 0.03 -1.59 -0.07 0.00 -2.93 0.00 0.00 61.98 57.41 1krw s VAL 50 Cb 0.08 -2.18 0.09 0.00 -1.53 0.00 0.00 36.38 32.85 1krw s VAL 50 CO 0.63 -0.10 0.44 -0.22 -3.33 0.00 0.00 175.10 172.52 1krw s LEU 51 N -3.05 -0.67 -0.23 2.54 2.96 -0.56 -2.62 118.68 117.05 1krw s LEU 51 Ca 0.26 1.05 -0.07 0.00 -0.22 0.00 0.00 54.13 55.14 1krw s LEU 51 Cb 0.03 1.45 -0.03 0.00 0.50 0.00 0.00 46.19 48.14 1krw s LEU 51 CO 0.07 -0.23 0.06 -0.22 -1.32 0.00 0.00 176.35 174.71 1krw s LEU 52 N 2.59 3.49 -0.07 -0.68 0.20 0.22 0.62 118.68 125.05 1krw s LEU 52 Ca -0.02 -0.16 0.03 0.00 0.69 0.00 0.00 54.13 54.67 1krw s LEU 52 Cb -0.12 -1.92 -0.02 0.00 -0.43 0.00 0.00 46.19 43.69 1krw s LEU 52 CO -0.13 0.01 -0.13 -0.44 -0.29 0.00 0.00 176.35 175.37 1krw s SER 53 N 1.34 4.10 0.13 3.68 0.01 0.64 0.11 113.70 123.71 1krw s SER 53 Ca 0.05 -0.20 0.26 0.00 1.31 0.00 0.00 55.95 57.37 1krw s SER 53 Cb -0.15 -1.02 0.96 0.00 0.21 0.00 0.00 66.02 66.02 1krw s SER 53 CO 0.03 0.31 1.80 -0.90 0.41 0.00 0.00 173.24 174.90 1krw n ASP 54 N 2.52 0.46 -3.11 2.44 5.75 0.36 -2.74 116.55 122.23 1krw n ASP 54 Ca -0.17 0.55 -0.18 0.00 -0.01 0.00 0.00 54.79 54.98 1krw n ASP 54 Cb 0.52 -0.67 0.02 0.00 -1.03 0.00 0.00 41.12 39.96 1krw n ASP 54 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1krw n ILE 55 N -1.94 -7.64 0.00 2.12 3.06 -1.26 -4.50 119.36 109.20 1krw n ILE 55 Ca 0.06 0.68 0.00 0.00 -2.50 0.00 0.00 62.75 60.98 1krw n ILE 55 Cb 0.36 -5.43 0.00 0.00 0.54 0.00 0.00 39.64 35.11 1krw n ILE 55 CO 0.00 0.00 0.00 -2.11 -2.50 0.00 0.00 176.55 171.94 1krw n ARG 56 N 0.04 0.00 0.00 9.51 1.85 -1.20 -4.36 116.66 122.50 1krw n ARG 56 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.87 1krw n ARG 56 Cb 0.49 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.90 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 -0.20 0.00 -0.35 2.89 0.00 0.22 -4.72 117.12 114.95 1krw n MET 57 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 57.70 57.41 1krw n MET 57 Cb 0.00 0.00 0.27 0.00 0.00 0.00 0.00 33.22 33.49 1krw n MET 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1krw n PRO 58 N 0.00 -3.75 0.00 2.12 -0.04 -0.54 -4.77 135.00 128.01 1krw n PRO 58 Ca 0.00 -1.10 0.00 0.00 -0.04 0.00 0.00 63.50 62.36 1krw n PRO 58 Cb 0.00 -1.95 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 1krw n PRO 58 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1krw n GLY 59 N 1.68 -3.31 2.52 0.55 0.00 -1.26 -1.64 105.19 103.73 1krw n GLY 59 Ca 0.08 0.61 -0.14 0.00 0.00 0.00 0.00 46.02 46.57 1krw n GLY 59 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1krw n MET 60 N -2.02 1.45 0.00 1.61 0.00 -1.26 -4.78 117.12 112.12 1krw n MET 60 Ca 0.00 -0.99 0.00 0.00 -0.00 0.00 0.00 57.70 56.71 1krw n MET 60 Cb 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 33.22 31.08 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 3.74 0.00 0.00 6.12 8.00 -0.65 -1.76 116.55 131.99 1krw n ASP 61 Ca 0.31 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.81 1krw n ASP 61 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 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 0.00 0.18 0.44 0.00 -1.26 0.71 105.19 105.26 1krw n GLY 62 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.41 0.99 4.07 -1.65 -2.82 115.31 115.49 1krw h LEU 63 Ca 0.00 0.00 0.07 0.00 0.08 0.00 0.00 57.88 58.03 1krw h LEU 63 Cb 0.14 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.82 1krw h LEU 63 CO 0.00 0.00 0.02 0.00 -1.08 0.00 0.00 178.44 177.38 1krw h ALA 64 N 2.07 0.39 -1.00 1.53 0.00 -1.83 -1.24 119.26 119.18 1krw h ALA 64 Ca 0.00 0.11 0.19 0.00 0.00 0.00 0.00 54.91 55.21 1krw h ALA 64 Cb 0.13 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 18.00 1krw h ALA 64 CO 0.00 -0.38 0.61 1.37 0.00 0.00 0.00 179.25 180.86 1krw h LEU 65 N 0.13 0.75 -0.30 0.00 8.10 -1.83 -0.39 115.31 121.78 1krw h LEU 65 Ca 0.20 0.09 0.03 0.00 0.11 0.00 0.00 57.88 58.31 1krw h LEU 65 Cb 0.28 -0.05 -0.03 0.00 -0.44 0.00 0.00 40.66 40.42 1krw h LEU 65 CO -0.31 0.27 0.11 -0.07 -4.11 0.00 0.00 178.44 174.33 1krw h LEU 66 N 0.73 0.13 -0.78 0.17 4.07 -1.40 -1.48 115.31 116.74 1krw h LEU 66 Ca 0.57 0.03 0.16 0.00 0.08 0.00 0.00 57.88 58.72 1krw h LEU 66 Cb 0.92 0.01 -0.11 0.00 1.08 0.00 0.00 40.66 42.57 1krw h LEU 66 CO -0.35 0.11 0.28 0.11 -1.08 0.00 0.00 178.44 177.51 1krw h LYS 67 N 0.24 0.37 0.00 1.13 1.57 -0.93 0.86 116.57 119.82 1krw h LYS 67 Ca 0.13 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 1krw h LYS 67 Cb 0.09 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1krw h LYS 67 CO -0.13 0.24 -0.18 1.96 -0.57 0.00 0.00 179.45 180.78 1krw h GLN 68 N 0.38 0.00 -0.73 3.15 1.08 -1.11 -2.65 115.11 115.23 1krw h GLN 68 Ca 0.45 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.59 1krw h GLN 68 Cb 0.74 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.14 1krw h GLN 68 CO -0.47 0.18 0.22 0.82 -0.95 0.00 0.00 178.83 178.63 1krw h ILE 69 N 0.00 1.26 0.00 2.54 2.04 0.17 0.39 117.51 123.92 1krw h ILE 69 Ca -0.00 -0.91 -0.11 0.00 1.00 0.00 0.00 64.86 64.84 1krw h ILE 69 Cb 0.42 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1krw h ILE 69 CO 0.02 0.36 -0.51 0.07 0.00 0.00 0.00 178.15 178.09 1krw h LYS 70 N 1.08 0.00 0.07 2.37 2.10 -1.10 1.26 116.57 122.35 1krw h LYS 70 Ca 0.23 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 58.59 1krw h LYS 70 Cb 0.31 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.62 1krw h LYS 70 CO -0.01 0.51 -1.54 1.96 -2.00 0.00 0.00 179.45 178.37 1krw h GLN 71 N 0.00 0.14 0.00 0.07 4.20 -1.29 -3.40 115.11 114.82 1krw h GLN 71 Ca -0.01 -0.24 -0.26 0.00 0.06 0.00 0.00 58.65 58.21 1krw h GLN 71 Cb 1.10 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.92 1krw h GLN 71 CO 0.07 0.93 -1.97 0.54 -0.67 0.00 0.00 178.83 177.73 1krw n ARG 72 N -3.32 1.09 -3.79 1.46 3.00 0.13 -4.98 116.66 110.25 1krw n ARG 72 Ca -0.15 0.05 -0.36 0.00 -0.01 0.00 0.00 57.85 57.37 1krw n ARG 72 Cb 1.03 -1.35 -0.07 0.00 0.00 0.00 0.00 32.46 32.07 1krw n ARG 72 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1krw s HIS 73 N -2.34 3.53 -0.60 -1.55 3.76 0.43 -4.92 115.29 113.61 1krw s HIS 73 Ca -0.15 0.49 -0.20 0.00 -0.15 0.00 0.00 55.06 55.05 1krw s HIS 73 Cb 0.05 -2.05 0.09 0.00 1.11 0.00 0.00 32.58 31.78 1krw s HIS 73 CO 0.48 0.56 0.76 -1.25 -0.85 0.00 0.00 174.74 174.44 1krw s PRO 74 N -0.48 3.07 -1.22 8.40 0.04 -1.26 -4.10 135.00 139.45 1krw s PRO 74 Ca 0.13 -1.15 0.00 0.00 0.04 0.00 0.00 61.00 60.02 1krw s PRO 74 Cb -0.12 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1krw s PRO 74 CO 0.02 -1.58 0.00 -1.33 0.04 0.00 0.00 177.00 174.15 1krw n MET 75 N 6.67 -1.84 -2.11 4.56 2.81 -1.17 -4.87 117.12 121.17 1krw n MET 75 Ca -0.08 0.69 -0.43 0.00 -1.81 0.00 0.00 57.70 56.07 1krw n MET 75 Cb 0.43 -5.15 -0.03 0.00 -0.71 0.00 0.00 33.22 27.76 1krw n MET 75 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 1krw s LEU 76 N -4.93 3.73 0.03 4.03 2.96 -1.26 -4.74 118.68 118.50 1krw s LEU 76 Ca 0.00 1.42 -0.34 0.00 -0.22 0.00 0.00 54.13 54.98 1krw s LEU 76 Cb 0.00 -3.53 -0.13 0.00 0.50 0.00 0.00 46.19 43.03 1krw s LEU 76 CO 0.00 -1.43 1.70 -2.65 -1.32 0.00 0.00 176.35 172.65 1krw n PRO 77 N 7.96 2.05 -4.47 0.98 -0.02 -1.20 -4.31 135.00 135.98 1krw n PRO 77 Ca 0.20 0.74 -0.30 0.00 -2.02 0.00 0.00 63.50 62.13 1krw n PRO 77 Cb 0.46 -2.53 -0.13 0.00 -0.02 0.00 0.00 33.50 31.28 1krw n PRO 77 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1krw s VAL 78 N 2.33 2.51 -0.18 -1.45 1.01 -1.25 -1.50 120.40 121.86 1krw s VAL 78 Ca 0.86 -1.54 -0.00 0.00 0.00 0.00 0.00 61.98 61.29 1krw s VAL 78 Cb -0.72 -2.10 0.05 0.00 0.00 0.00 0.00 36.38 33.60 1krw s VAL 78 CO 0.46 0.17 -0.06 -0.63 0.00 0.00 0.00 175.10 175.03 1krw s ILE 79 N -1.03 1.26 -0.05 2.22 1.01 0.20 0.14 121.20 124.95 1krw s ILE 79 Ca 0.15 -0.79 -0.05 0.00 0.00 0.00 0.00 60.65 59.96 1krw s ILE 79 Cb -0.10 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1krw s ILE 79 CO 0.07 0.09 0.18 -0.63 0.00 0.00 0.00 174.94 174.65 1krw s ILE 80 N 1.56 5.44 -0.06 2.92 -1.09 -1.11 -0.26 121.20 128.60 1krw s ILE 80 Ca -0.01 0.04 -0.09 0.00 -2.23 0.00 0.00 60.65 58.36 1krw s ILE 80 Cb -0.16 -3.49 -0.30 0.00 -1.58 0.00 0.00 42.46 36.93 1krw s ILE 80 CO -0.08 0.45 0.60 0.00 -1.23 0.00 0.00 174.94 174.69 1krw h MET 81 N 4.30 0.36 -5.67 2.79 -0.00 -1.78 -0.10 114.93 114.83 1krw h MET 81 Ca -0.51 -0.61 -0.57 0.00 -0.00 0.00 0.00 59.70 58.01 1krw h MET 81 Cb 1.21 0.23 -0.14 0.00 -0.00 0.00 0.00 31.60 32.90 1krw h MET 81 CO 0.64 1.28 -0.65 0.99 -0.00 0.00 0.00 176.91 179.17 1krw s THR 82 N -2.58 1.89 0.00 -0.10 2.01 -1.25 -3.75 115.64 111.87 1krw s THR 82 Ca -0.17 -2.11 0.00 0.00 0.31 0.00 0.00 61.69 59.71 1krw s THR 82 Cb 0.06 -2.68 0.00 0.00 0.01 0.00 0.00 72.50 69.89 1krw s THR 82 CO 0.83 -0.17 0.00 0.00 -0.69 0.00 0.00 174.62 174.60 1krw n ALA 83 N -0.75 0.89 0.00 7.40 0.00 -1.26 -4.64 120.51 122.15 1krw n ALA 83 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1krw n ALA 83 Cb 0.65 0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1krw n ALA 83 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1krw n HIS 84 N -0.49 -0.09 -0.72 0.00 1.44 -1.26 -2.64 115.22 111.46 1krw n HIS 84 Ca 0.00 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.64 1krw n HIS 84 Cb 0.02 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.11 1krw n HIS 84 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1krw n SER 85 N -3.64 5.64 -0.21 4.39 2.88 -1.26 -3.61 113.62 117.81 1krw n SER 85 Ca 0.00 -2.61 0.02 0.00 -1.33 0.00 0.00 58.87 54.95 1krw n SER 85 Cb 0.00 -1.16 0.03 0.00 -0.75 0.00 0.00 64.21 62.33 1krw n SER 85 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1krw n ASP 86 N 1.37 0.79 0.19 -3.46 9.92 -1.08 -4.84 116.55 119.43 1krw n ASP 86 Ca 0.16 -1.97 0.12 0.00 -0.53 0.00 0.00 54.79 52.56 1krw n ASP 86 Cb 0.58 -0.17 0.38 0.00 -0.64 0.00 0.00 41.12 41.27 1krw n ASP 86 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1krw h LEU 87 N 0.00 0.00 -0.59 0.64 3.38 -1.62 -1.26 115.31 115.86 1krw h LEU 87 Ca 0.00 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 1krw h LEU 87 Cb 1.08 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.72 1krw h LEU 87 CO 0.00 0.00 -0.16 0.44 0.09 0.00 0.00 178.44 178.81 1krw h ASP 88 N 0.00 -0.60 1.01 -0.43 5.19 -1.92 0.53 116.42 120.19 1krw h ASP 88 Ca 0.13 0.18 -0.01 0.00 -0.62 0.00 0.00 57.03 56.71 1krw h ASP 88 Cb 1.77 0.39 -0.00 0.00 0.18 0.00 0.00 39.33 41.67 1krw h ASP 88 CO -0.00 -0.21 -0.06 0.00 -3.12 0.00 0.00 179.24 175.85 1krw h ALA 89 N 1.54 1.01 -0.24 3.45 0.00 -1.60 -2.85 119.26 120.58 1krw h ALA 89 Ca 0.28 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 1krw h ALA 89 Cb 0.45 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1krw h ALA 89 CO -0.62 0.08 -0.09 0.00 0.00 0.00 0.00 179.25 178.63 1krw h ALA 90 N 1.94 1.42 -0.44 0.00 0.00 -0.05 -2.84 119.26 119.29 1krw h ALA 90 Ca -0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1krw h ALA 90 Cb 0.58 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1krw h ALA 90 CO 0.01 0.40 0.00 0.28 0.00 0.00 0.00 179.25 179.94 1krw h VAL 91 N 0.35 1.26 0.00 0.00 2.07 -1.19 -1.96 116.25 116.78 1krw h VAL 91 Ca 0.07 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.56 1krw h VAL 91 Cb 0.38 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1krw h VAL 91 CO 0.02 0.35 0.00 0.28 0.02 0.00 0.00 177.57 178.24 1krw h SER 92 N 0.62 0.00 0.08 0.57 0.02 -1.62 -2.44 113.55 110.79 1krw h SER 92 Ca 0.13 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1krw h SER 92 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1krw h SER 92 CO 0.02 0.00 -0.04 0.00 -1.14 0.00 0.00 176.83 175.67 1krw h ALA 93 N 2.00 -0.11 -0.53 3.77 0.00 -1.30 -2.28 119.26 120.81 1krw h ALA 93 Ca 0.00 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.73 1krw h ALA 93 Cb 0.02 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1krw h ALA 93 CO 0.00 -0.17 0.35 1.88 0.00 0.00 0.00 179.25 181.31 1krw h TYR 94 N -0.90 0.38 0.01 0.00 0.05 -1.22 0.83 116.97 116.12 1krw h TYR 94 Ca -0.01 0.01 -0.19 0.00 0.05 0.00 0.00 58.73 58.59 1krw h TYR 94 Cb 0.57 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.16 1krw h TYR 94 CO 0.12 0.19 -0.89 -0.56 -1.05 0.00 0.00 178.16 175.98 1krw h GLN 95 N 0.37 0.08 0.00 4.88 -0.00 -1.54 -3.16 115.11 115.74 1krw h GLN 95 Ca 0.24 -0.10 0.00 0.00 -0.00 0.00 0.00 58.65 58.79 1krw h GLN 95 Cb 0.45 0.03 0.00 0.00 -0.00 0.00 0.00 27.48 27.96 1krw h GLN 95 CO -0.06 0.91 -0.29 -0.56 -0.00 0.00 0.00 178.83 178.84 1krw h GLN 96 N 0.04 0.00 0.00 0.06 -0.00 -0.50 -3.47 115.11 111.24 1krw h GLN 96 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1krw h GLN 96 Cb 1.54 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.02 1krw h GLN 96 CO 0.12 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.36 1krw n GLY 97 N 1.18 -0.22 3.62 0.06 0.00 0.44 -3.04 105.19 107.22 1krw n GLY 97 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1krw n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1krw n ALA 98 N 0.00 -0.95 -0.08 4.61 0.00 0.26 -3.26 120.51 121.10 1krw n ALA 98 Ca 0.00 -0.48 -0.12 0.00 0.00 0.00 0.00 53.44 52.84 1krw n ALA 98 Cb 0.00 -2.12 -0.08 0.00 0.00 0.00 0.00 19.45 17.25 1krw n ALA 98 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1krw h PHE 99 N -1.44 0.00 0.00 0.00 3.57 0.10 -3.42 116.94 115.75 1krw h PHE 99 Ca -0.44 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.06 1krw h PHE 99 Cb 1.29 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.03 1krw h PHE 99 CO 0.46 0.79 0.00 -3.47 -2.23 0.00 0.00 178.31 173.86 1krw n ASP 100 N -4.59 0.00 -4.03 0.41 -0.08 -1.09 -4.99 116.55 102.18 1krw n ASP 100 Ca -0.15 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.04 1krw n ASP 100 Cb 0.42 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.77 1krw n ASP 100 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1krw s TYR 101 N -3.00 0.45 -0.24 -0.67 1.51 -1.26 -2.73 117.35 111.40 1krw s TYR 101 Ca 0.00 -0.66 -0.08 0.00 -1.01 0.00 0.00 57.07 55.32 1krw s TYR 101 Cb 0.00 -0.30 -0.04 0.00 -0.11 0.00 0.00 41.96 41.52 1krw s TYR 101 CO 0.00 -0.20 0.09 -0.51 -1.11 0.00 0.00 175.55 173.82 1krw s LEU 102 N -1.88 3.65 0.00 -1.29 1.02 -0.05 -4.95 118.68 115.18 1krw s LEU 102 Ca -0.08 -0.10 0.00 0.00 0.02 0.00 0.00 54.13 53.97 1krw s LEU 102 Cb -0.05 -1.98 0.00 0.00 0.02 0.00 0.00 46.19 44.18 1krw s LEU 102 CO -0.03 0.01 0.52 -0.81 0.02 0.00 0.00 176.35 176.06 1krw n PRO 103 N 4.65 0.00 0.01 1.29 -0.04 -1.26 -3.80 135.00 135.85 1krw n PRO 103 Ca -0.16 0.27 -0.02 0.00 -0.04 0.00 0.00 63.50 63.55 1krw n PRO 103 Cb 0.52 -1.11 -0.01 0.00 -0.04 0.00 0.00 33.50 32.86 1krw n PRO 103 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1krw n LYS 104 N -1.30 0.12 -0.67 0.54 5.02 -1.26 -4.72 118.16 115.90 1krw n LYS 104 Ca 0.00 0.05 -0.31 0.00 -2.02 0.00 0.00 58.31 56.03 1krw n LYS 104 Cb 0.00 -0.69 0.17 0.00 -0.02 0.00 0.00 35.03 34.50 1krw n LYS 104 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1krw n PRO 105 N -3.64 -0.99 0.00 1.97 -0.04 -1.26 -4.96 135.00 126.07 1krw n PRO 105 Ca -0.03 -0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.18 1krw n PRO 105 Cb 0.12 -2.08 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 1krw n PRO 105 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1krw n PHE 106 N -4.24 0.00 -0.22 0.54 7.35 -1.26 -4.88 117.46 114.76 1krw n PHE 106 Ca 0.07 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.77 1krw n PHE 106 Cb 0.54 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.37 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 -0.55 -0.16 -2.13 5.75 -1.26 -1.50 116.55 116.69 1krw n ASP 107 Ca 0.00 0.07 -0.11 0.00 -0.01 0.00 0.00 54.79 54.73 1krw n ASP 107 Cb 0.00 -0.45 -0.00 0.00 -1.03 0.00 0.00 41.12 39.64 1krw n ASP 107 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 1krw h ILE 108 N -0.06 1.27 0.13 2.12 5.03 -1.97 -0.31 117.51 123.72 1krw h ILE 108 Ca 0.00 -1.35 0.02 0.00 -0.12 0.00 0.00 64.86 63.41 1krw h ILE 108 Cb 0.06 1.11 -0.05 0.00 -3.03 0.00 0.00 36.82 34.91 1krw h ILE 108 CO 0.00 0.47 -0.48 0.44 -0.68 0.00 0.00 178.15 177.90 1krw h ASP 109 N 0.84 -1.43 0.64 1.72 3.32 -1.98 1.23 116.42 120.76 1krw h ASP 109 Ca 0.11 0.15 -0.17 0.00 0.02 0.00 0.00 57.03 57.15 1krw h ASP 109 Cb 0.77 0.53 -0.02 0.00 0.22 0.00 0.00 39.33 40.83 1krw h ASP 109 CO 0.06 -0.53 -0.78 -0.33 -1.72 0.00 0.00 179.24 175.94 1krw h GLU 110 N -0.72 0.11 0.43 3.56 4.39 -1.33 -1.92 114.58 119.09 1krw h GLU 110 Ca 0.01 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 1krw h GLU 110 Cb 0.73 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 1krw h GLU 110 CO -0.27 0.83 -0.20 0.00 -1.16 0.00 0.00 179.01 178.21 1krw h ALA 111 N 1.13 -0.66 -0.31 3.43 0.00 -0.50 -0.70 119.26 121.65 1krw h ALA 111 Ca -0.02 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.84 1krw h ALA 111 Cb 1.37 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 1krw h ALA 111 CO 0.11 -0.62 0.22 0.28 0.00 0.00 0.00 179.25 179.25 1krw h VAL 112 N -0.98 0.88 -0.05 0.00 2.07 0.14 0.18 116.25 118.49 1krw h VAL 112 Ca -0.06 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1krw h VAL 112 Cb 0.44 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1krw h VAL 112 CO 0.10 0.01 0.01 0.00 0.02 0.00 0.00 177.57 177.71 1krw h ALA 113 N 1.84 0.07 0.00 1.67 0.00 -1.32 -1.46 119.26 120.05 1krw h ALA 113 Ca 0.15 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1krw h ALA 113 Cb 0.49 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1krw h ALA 113 CO -0.01 -0.29 -0.07 1.25 0.00 0.00 0.00 179.25 180.13 1krw h LEU 114 N -0.15 0.00 0.06 0.00 5.85 0.30 -2.32 115.31 119.04 1krw h LEU 114 Ca 0.02 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.65 1krw h LEU 114 Cb 0.27 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.31 1krw h LEU 114 CO 0.00 0.07 -0.35 1.62 -0.34 0.00 0.00 178.44 179.44 1krw h VAL 115 N 0.00 1.65 -0.30 1.05 3.04 -0.46 -2.99 116.25 118.24 1krw h VAL 115 Ca -0.00 -2.37 -0.05 0.00 -1.01 0.00 0.00 66.70 63.27 1krw h VAL 115 Cb 0.64 3.24 -0.01 0.00 -2.01 0.00 0.00 31.29 33.15 1krw h VAL 115 CO 0.01 0.64 0.00 -0.33 -1.01 0.00 0.00 177.57 176.88 1krw h GLU 116 N -0.69 0.54 0.00 4.17 5.08 -1.29 -2.39 114.58 119.99 1krw h GLU 116 Ca -0.06 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1krw h GLU 116 Cb 1.25 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 1krw h GLU 116 CO 0.07 0.68 -0.01 0.00 -1.00 0.00 0.00 179.01 178.74 1krw h ARG 117 N 0.33 0.00 -0.04 2.33 3.08 -1.56 -0.58 114.38 117.95 1krw h ARG 117 Ca 0.09 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1krw h ARG 117 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1krw h ARG 117 CO 0.02 0.01 -0.07 0.00 -1.07 0.00 0.00 179.97 178.86 1krw h ALA 118 N 1.99 0.06 -0.05 0.04 0.00 -1.28 0.20 119.26 120.21 1krw h ALA 118 Ca -0.00 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1krw h ALA 118 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1krw h ALA 118 CO 0.00 -0.11 -0.41 0.82 0.00 0.00 0.00 179.25 179.56 1krw h ILE 119 N -0.41 1.30 0.10 0.00 2.04 -1.14 -1.92 117.51 117.47 1krw h ILE 119 Ca 0.00 -1.45 -0.00 0.00 1.00 0.00 0.00 64.86 64.41 1krw h ILE 119 Cb 0.63 1.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 1krw h ILE 119 CO 0.01 0.42 -0.05 -1.28 0.00 0.00 0.00 178.15 177.26 1krw h SER 120 N 0.09 -0.11 -0.05 1.72 0.87 -1.11 -2.75 113.55 112.21 1krw h SER 120 Ca 0.01 -0.44 0.02 0.00 -1.23 0.00 0.00 61.79 60.15 1krw h SER 120 Cb 0.76 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.75 1krw h SER 120 CO 0.06 0.53 0.05 0.45 -0.53 0.00 0.00 176.83 177.39 1krw h HIS 121 N -0.91 0.00 0.42 2.24 3.86 -0.62 -2.92 115.15 117.21 1krw h HIS 121 Ca -0.01 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.18 1krw h HIS 121 Cb 0.54 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.01 1krw h HIS 121 CO 0.11 0.00 -0.20 -0.92 0.86 0.00 0.00 177.93 177.78 1krw h TYR 122 N 0.00 -0.52 -2.69 2.45 3.20 -1.41 -3.50 116.97 114.51 1krw h TYR 122 Ca 0.03 -0.01 0.30 0.00 3.14 0.00 0.00 58.73 62.19 1krw h TYR 122 Cb 0.12 0.17 -0.09 0.00 1.54 0.00 0.00 36.73 38.47 1krw h TYR 122 CO 0.00 -0.33 -0.54 0.94 -1.64 0.00 0.00 178.16 176.60 1krw n GLN 123 N -5.06 -2.38 0.00 1.82 7.27 -1.04 -5.11 117.38 112.89 1krw n GLN 123 Ca -0.07 1.66 0.00 0.00 0.07 0.00 0.00 57.00 58.66 1krw n GLN 123 Cb 0.22 -2.92 0.00 0.00 2.41 0.00 0.00 30.24 29.95 1krw n GLN 123 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22