#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktv h PRO 9 N 0.00 0.00 -0.13 4.33 0.11 -1.82 -2.95 132.00 131.54 3ktv h PRO 9 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3ktv h PRO 9 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3ktv h PRO 9 CO 0.00 0.44 0.00 0.00 -0.21 0.00 0.00 178.00 178.23 3ktv n ALA 10 N -2.36 2.54 -2.66 -0.75 0.00 -1.25 -4.54 120.51 111.49 3ktv n ALA 10 Ca -0.01 -0.41 -0.37 0.00 0.00 0.00 0.00 53.44 52.65 3ktv n ALA 10 Cb 0.51 -1.13 -0.09 0.00 0.00 0.00 0.00 19.45 18.74 3ktv n ALA 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ktv s ASP 11 N -1.52 6.26 0.24 0.00 1.01 -1.11 -4.94 116.67 116.59 3ktv s ASP 11 Ca 0.30 0.29 0.14 0.00 0.71 0.00 0.00 52.55 53.99 3ktv s ASP 11 Cb 0.15 -2.17 0.77 0.00 1.01 0.00 0.00 42.92 42.69 3ktv s ASP 11 CO 0.24 -0.02 1.40 0.00 0.21 0.00 0.00 175.17 177.00 3ktv n GLN 12 N 4.49 0.09 0.00 8.23 6.02 -1.26 0.19 117.38 135.14 3ktv n GLN 12 Ca -0.12 0.57 0.13 0.00 -0.01 0.00 0.00 57.00 57.57 3ktv n GLN 12 Cb 0.51 -1.88 0.35 0.00 1.02 0.00 0.00 30.24 30.24 3ktv n GLN 12 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3ktv n ASP 13 N -2.00 0.61 -0.13 1.08 8.00 -1.26 -3.89 116.55 118.97 3ktv n ASP 13 Ca -0.01 -0.41 -0.20 0.00 0.71 0.00 0.00 54.79 54.89 3ktv n ASP 13 Cb 0.09 0.13 -0.12 0.00 -0.02 0.00 0.00 41.12 41.21 3ktv n ASP 13 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3ktv n ARG 14 N -1.21 0.64 -0.13 -1.24 5.12 0.50 -4.99 116.66 115.35 3ktv n ARG 14 Ca 0.08 0.17 -0.05 0.00 -1.93 0.00 0.00 57.85 56.13 3ktv n ARG 14 Cb 0.33 -1.52 -0.00 0.00 -1.16 0.00 0.00 32.46 30.11 3ktv n ARG 14 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 3ktv n PHE 15 N -3.41 -0.03 -1.86 -1.55 3.01 -0.87 -4.87 117.46 107.87 3ktv n PHE 15 Ca -0.47 0.09 -0.29 0.00 1.01 0.00 0.00 57.45 57.79 3ktv n PHE 15 Cb 0.98 -0.18 0.10 0.00 -0.01 0.00 0.00 39.48 40.36 3ktv n PHE 15 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 3ktv s ILE 16 N -0.08 2.00 -0.05 4.37 -4.36 -0.72 -4.76 121.20 117.61 3ktv s ILE 16 Ca 0.06 0.00 0.03 0.00 -0.26 0.00 0.00 60.65 60.48 3ktv s ILE 16 Cb -0.09 -2.97 -0.03 0.00 1.25 0.00 0.00 42.46 40.62 3ktv s ILE 16 CO 0.05 0.00 -0.12 0.00 0.24 0.00 0.00 174.94 175.11 3ktv s ILE 18 N -0.77 0.80 -0.22 0.00 -1.09 -0.72 -5.01 121.20 114.18 3ktv s ILE 18 Ca 0.12 -1.15 -0.19 0.00 -2.23 0.00 0.00 60.65 57.20 3ktv s ILE 18 Cb -0.11 -1.49 -0.03 0.00 -1.58 0.00 0.00 42.46 39.26 3ktv s ILE 18 CO 0.01 -0.52 0.57 -0.31 -1.23 0.00 0.00 174.94 173.46 3ktv s TYR 19 N 1.68 3.34 0.27 3.97 1.51 -1.26 -3.06 117.35 123.81 3ktv s TYR 19 Ca 0.06 0.80 0.06 0.00 -1.01 0.00 0.00 57.07 56.98 3ktv s TYR 19 Cb -0.17 -2.74 0.77 0.00 -0.11 0.00 0.00 41.96 39.71 3ktv s TYR 19 CO -0.20 -0.19 1.31 -2.30 -1.11 0.00 0.00 175.55 173.06 3ktv n PRO 20 N 5.13 -0.06 -0.33 -1.71 -0.02 -1.26 0.63 135.00 137.37 3ktv n PRO 20 Ca -0.03 1.22 0.17 0.00 -2.02 0.00 0.00 63.50 62.85 3ktv n PRO 20 Cb 0.50 -2.01 0.34 0.00 -0.02 0.00 0.00 33.50 32.31 3ktv n PRO 20 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ktv n ALA 21 N -3.00 0.59 -0.32 3.55 0.00 -1.26 0.21 120.51 120.27 3ktv n ALA 21 Ca 0.23 1.03 0.19 0.00 0.00 0.00 0.00 53.44 54.89 3ktv n ALA 21 Cb 0.76 -0.80 0.39 0.00 0.00 0.00 0.00 19.45 19.80 3ktv n ALA 21 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3ktv h TYR 22 N 0.00 0.73 -0.14 0.00 0.05 1.86 -2.10 116.97 117.37 3ktv h TYR 22 Ca 0.63 0.04 0.00 0.00 0.05 0.00 0.00 58.73 59.45 3ktv h TYR 22 Cb 1.39 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.96 3ktv h TYR 22 CO -0.41 -0.15 0.00 1.28 -1.05 0.00 0.00 178.16 177.83 3ktv n LEU 23 N -5.09 2.52 -4.56 3.88 4.77 0.13 -1.40 117.00 117.25 3ktv n LEU 23 Ca 0.27 -1.28 -0.42 0.00 -0.03 0.00 0.00 56.01 54.55 3ktv n LEU 23 Cb 0.83 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.81 3ktv n LEU 23 CO 0.09 0.52 0.98 0.21 -1.33 0.00 0.00 177.39 177.86 3ktv s ASN 24 N -1.17 6.40 0.63 -1.43 2.47 -0.79 -1.41 114.94 119.64 3ktv s ASN 24 Ca 0.21 -0.07 0.32 0.00 0.42 0.00 0.00 52.86 53.75 3ktv s ASN 24 Cb 0.13 -2.52 1.79 0.00 -1.45 0.00 0.00 41.25 39.20 3ktv s ASN 24 CO 0.19 -1.41 2.08 -0.55 -3.72 0.00 0.00 177.10 173.69 3ktv h ASN 25 N 9.49 0.00 -0.05 -4.21 7.08 0.51 -1.63 115.58 126.76 3ktv h ASN 25 Ca -0.25 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.97 3ktv h ASN 25 Cb 1.06 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.30 3ktv h ASN 25 CO 1.16 0.00 0.00 0.29 -2.08 0.00 0.00 177.43 176.80 3ktv n LYS 26 N -3.39 1.20 -4.30 4.14 4.76 -1.26 -4.78 118.16 114.53 3ktv n LYS 26 Ca 0.00 -0.30 -0.29 0.00 -2.87 0.00 0.00 58.31 54.86 3ktv n LYS 26 Cb 0.32 -1.28 -0.11 0.00 -1.84 0.00 0.00 35.03 32.13 3ktv n LYS 26 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3ktv s LYS 27 N -1.93 1.86 0.86 1.97 1.02 -0.62 -5.12 119.74 117.78 3ktv s LYS 27 Ca 0.25 -1.21 -0.12 0.00 0.02 0.00 0.00 55.97 54.91 3ktv s LYS 27 Cb 0.12 -2.12 0.19 0.00 -0.52 0.00 0.00 37.83 35.50 3ktv s LYS 27 CO 0.20 0.47 1.18 0.25 -0.92 0.00 0.00 175.35 176.52 3ktv n THR 28 N 0.56 0.00 0.50 2.17 -2.24 -1.26 -4.61 114.28 109.39 3ktv n THR 28 Ca -0.14 -1.05 -0.20 0.00 -2.27 0.00 0.00 64.05 60.38 3ktv n THR 28 Cb 0.54 -1.39 -0.10 0.00 -2.10 0.00 0.00 70.33 67.27 3ktv n THR 28 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3ktv h ILE 29 N -1.46 0.03 0.00 2.28 1.08 -1.95 -1.34 117.51 116.15 3ktv h ILE 29 Ca -0.38 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.09 3ktv h ILE 29 Cb 1.12 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.90 3ktv h ILE 29 CO 0.30 0.00 0.18 0.00 -0.69 0.00 0.00 178.15 177.94 3ktv h ALA 30 N -1.25 1.17 -0.00 1.87 0.00 -1.94 0.40 119.26 119.51 3ktv h ALA 30 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3ktv h ALA 30 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3ktv h ALA 30 CO 0.19 -0.17 -0.40 0.39 0.00 0.00 0.00 179.25 179.26 3ktv n GLU 31 N -2.75 0.44 0.00 0.00 1.02 -0.84 -4.95 120.64 113.55 3ktv n GLU 31 Ca -0.02 -0.26 0.00 0.00 -0.02 0.00 0.00 57.16 56.86 3ktv n GLU 31 Cb 0.23 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 3ktv n GLU 31 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ktv n GLY 32 N 1.42 1.12 3.76 0.62 0.00 0.14 -4.79 105.19 107.46 3ktv n GLY 32 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 3ktv n GLY 32 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ktv s ARG 33 N -0.10 4.34 0.00 1.61 3.52 -0.57 -3.65 118.95 124.11 3ktv s ARG 33 Ca 0.00 2.21 0.00 0.00 -0.13 0.00 0.00 55.73 57.81 3ktv s ARG 33 Cb 0.00 -3.09 0.00 0.00 -1.56 0.00 0.00 34.95 30.30 3ktv s ARG 33 CO 0.00 -0.24 0.14 0.54 -0.81 0.00 0.00 175.30 174.94 3ktv n ARG 34 N 1.29 4.19 -4.28 5.12 5.12 -0.49 -4.68 116.66 122.93 3ktv n ARG 34 Ca 0.02 -0.14 -0.15 0.00 -1.93 0.00 0.00 57.85 55.64 3ktv n ARG 34 Cb 0.42 -0.62 -0.10 0.00 -1.16 0.00 0.00 32.46 30.99 3ktv n ARG 34 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 3ktv s ILE 35 N -0.64 0.67 -0.04 0.55 -4.36 -1.25 -5.07 121.20 111.05 3ktv s ILE 35 Ca 0.00 -1.99 -0.30 0.00 -0.26 0.00 0.00 60.65 58.10 3ktv s ILE 35 Cb 0.00 -2.34 -0.04 0.00 1.25 0.00 0.00 42.46 41.32 3ktv s ILE 35 CO 0.00 -0.28 1.36 -2.84 0.24 0.00 0.00 174.94 173.42 3ktv s PRO 36 N -3.96 4.28 0.13 0.37 0.02 -1.26 -4.71 135.00 129.87 3ktv s PRO 36 Ca 0.30 1.87 -0.06 0.00 0.02 0.00 0.00 61.00 63.13 3ktv s PRO 36 Cb 0.07 -3.64 0.19 0.00 0.02 0.00 0.00 34.50 31.14 3ktv s PRO 36 CO 0.08 -0.59 0.78 -0.89 -0.33 0.00 0.00 177.00 176.05 3ktv n ILE 37 N 4.84 -0.23 -0.34 2.83 5.41 -1.26 0.29 119.36 130.90 3ktv n ILE 37 Ca 0.13 1.15 0.15 0.00 1.00 0.00 0.00 62.75 65.18 3ktv n ILE 37 Cb 0.44 -1.57 0.30 0.00 -0.71 0.00 0.00 39.64 38.10 3ktv n ILE 37 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 3ktv h SER 38 N 0.00 -0.44 0.00 4.38 4.64 -2.00 1.51 113.55 121.65 3ktv h SER 38 Ca 0.22 0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 3ktv h SER 38 Cb 0.34 0.47 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 3ktv h SER 38 CO -0.51 -0.35 -0.46 0.29 -0.87 0.00 0.00 176.83 174.92 3ktv n LYS 39 N -5.47 1.19 -0.91 4.77 4.01 0.83 -4.98 118.16 117.59 3ktv n LYS 39 Ca 0.24 -0.97 -0.28 0.00 -0.51 0.00 0.00 58.31 56.78 3ktv n LYS 39 Cb 0.78 -1.48 0.22 0.00 -0.51 0.00 0.00 35.03 34.03 3ktv n LYS 39 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3ktv s ALA 40 N -2.48 0.27 0.11 7.82 0.00 0.52 -4.65 121.76 123.34 3ktv s ALA 40 Ca 0.19 -0.37 -0.01 0.00 0.00 0.00 0.00 51.96 51.78 3ktv s ALA 40 Cb 0.18 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 3ktv s ALA 40 CO 0.57 -3.37 0.03 0.08 0.00 0.00 0.00 175.76 173.06 3ktv s VAL 41 N -2.76 0.18 -1.33 0.00 1.01 -0.50 -4.72 120.40 112.28 3ktv s VAL 41 Ca 0.67 -1.89 -0.17 0.00 0.00 0.00 0.00 61.98 60.59 3ktv s VAL 41 Cb -0.20 -1.92 0.04 0.00 0.00 0.00 0.00 36.38 34.30 3ktv s VAL 41 CO 0.60 -0.60 1.96 1.21 0.00 0.00 0.00 175.10 178.27 3ktv n GLU 42 N -0.05 2.86 -2.35 2.72 4.07 -1.26 0.11 120.64 126.74 3ktv n GLU 42 Ca -0.08 -2.88 -0.05 0.00 -0.06 0.00 0.00 57.16 54.09 3ktv n GLU 42 Cb 0.63 -3.40 0.03 0.00 -0.06 0.00 0.00 31.44 28.64 3ktv n GLU 42 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3ktv n ASN 43 N 7.80 -2.42 -4.60 4.31 3.02 -1.26 -4.99 115.26 117.13 3ktv n ASN 43 Ca 0.50 -0.21 -0.34 0.00 -0.03 0.00 0.00 54.58 54.50 3ktv n ASN 43 Cb 0.43 -2.00 0.12 0.00 -0.61 0.00 0.00 39.78 37.72 3ktv n ASN 43 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3ktv n PRO 44 N -2.02 0.09 -4.44 3.52 -0.04 -1.26 -5.01 135.00 125.84 3ktv n PRO 44 Ca -0.07 0.10 -0.25 0.00 -0.04 0.00 0.00 63.50 63.23 3ktv n PRO 44 Cb 0.55 -2.21 -0.11 0.00 -0.04 0.00 0.00 33.50 31.69 3ktv n PRO 44 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3ktv s THR 45 N -2.15 2.48 0.05 0.52 -4.23 -1.26 -4.89 115.64 106.15 3ktv s THR 45 Ca 0.69 -2.23 -0.14 0.00 -1.18 0.00 0.00 61.69 58.82 3ktv s THR 45 Cb -0.29 -2.26 -0.06 0.00 1.34 0.00 0.00 72.50 71.24 3ktv s THR 45 CO 0.55 -0.28 1.23 0.00 -0.54 0.00 0.00 174.62 175.58 3ktv h ALA 46 N 2.63 -0.66 -0.12 3.99 0.00 -1.85 -0.20 119.26 123.05 3ktv h ALA 46 Ca -0.43 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.46 3ktv h ALA 46 Cb 1.24 0.72 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 3ktv h ALA 46 CO 0.55 -0.74 -0.07 2.41 0.00 0.00 0.00 179.25 181.41 3ktv n THR 47 N -3.74 -0.08 -0.40 0.00 -1.04 -1.26 -0.11 114.28 107.64 3ktv n THR 47 Ca -0.03 1.08 -0.10 0.00 -2.04 0.00 0.00 64.05 62.96 3ktv n THR 47 Cb 0.16 -1.41 -0.08 0.00 -1.82 0.00 0.00 70.33 67.18 3ktv n THR 47 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3ktv n GLU 48 N -3.04 -0.40 -0.31 -2.82 1.02 -0.90 -0.62 120.64 113.57 3ktv n GLU 48 Ca 0.00 1.47 -0.02 0.00 -0.02 0.00 0.00 57.16 58.59 3ktv n GLU 48 Cb 0.03 -2.17 0.03 0.00 -0.02 0.00 0.00 31.44 29.31 3ktv n GLU 48 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3ktv h ILE 49 N 0.00 0.07 0.39 -3.67 2.04 0.13 -1.90 117.51 114.57 3ktv h ILE 49 Ca 0.18 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.02 3ktv h ILE 49 Cb 0.42 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 3ktv h ILE 49 CO -0.92 0.00 -0.24 -0.61 0.00 0.00 0.00 178.15 176.38 3ktv h GLN 50 N -0.06 -0.56 -0.77 2.37 4.15 0.40 -2.94 115.11 117.69 3ktv h GLN 50 Ca 0.31 0.04 0.28 0.00 0.77 0.00 0.00 58.65 60.04 3ktv h GLN 50 Cb 0.58 0.13 -0.14 0.00 0.21 0.00 0.00 27.48 28.26 3ktv h GLN 50 CO -0.86 -0.37 0.25 -0.25 -1.93 0.00 0.00 178.83 175.66 3ktv n ASP 51 N -3.76 0.12 0.10 -0.69 10.43 -0.02 0.27 116.55 123.00 3ktv n ASP 51 Ca -0.07 1.29 0.12 0.00 2.57 0.00 0.00 54.79 58.71 3ktv n ASP 51 Cb 0.24 -0.56 0.25 0.00 1.84 0.00 0.00 41.12 42.89 3ktv n ASP 51 CO 0.00 0.00 0.00 -0.37 -1.07 0.00 0.00 177.20 175.76 3ktv h VAL 52 N 0.00 0.00 0.01 2.53 -1.51 -1.39 -2.90 116.25 112.99 3ktv h VAL 52 Ca 0.58 -0.60 -0.00 0.00 -1.23 0.00 0.00 66.70 65.45 3ktv h VAL 52 Cb 1.42 1.40 0.00 0.00 -2.13 0.00 0.00 31.29 31.98 3ktv h VAL 52 CO -0.65 0.00 -0.01 0.00 -1.23 0.00 0.00 177.57 175.68 3ktv h SER 54 N -0.95 -0.71 0.00 0.00 4.64 -1.44 -1.71 113.55 113.38 3ktv h SER 54 Ca -0.00 0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 3ktv h SER 54 Cb 0.76 0.29 -0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3ktv h SER 54 CO 0.00 -0.32 0.10 0.00 -0.87 0.00 0.00 176.83 175.74 3ktv n ALA 55 N -2.63 1.75 -1.92 5.18 0.00 -1.10 0.20 120.51 122.00 3ktv n ALA 55 Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3ktv n ALA 55 Cb 0.28 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.75 3ktv n ALA 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3ktv n VAL 56 N 2.19 0.00 -0.84 0.00 0.31 -0.66 -4.97 118.33 114.36 3ktv n VAL 56 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3ktv n VAL 56 Cb 0.07 0.10 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 3ktv n VAL 56 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ktv n GLY 57 N 0.00 0.67 3.81 2.92 0.00 0.53 -5.05 105.19 108.07 3ktv n GLY 57 Ca 0.00 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 3ktv n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ktv s LEU 58 N 0.00 4.45 -0.29 0.99 1.43 -1.08 -4.95 118.68 119.22 3ktv s LEU 58 Ca 0.00 1.03 -0.29 0.00 -1.03 0.00 0.00 54.13 53.84 3ktv s LEU 58 Cb 0.00 -2.70 0.01 0.00 0.03 0.00 0.00 46.19 43.52 3ktv s LEU 58 CO 0.00 0.25 1.21 0.20 0.23 0.00 0.00 176.35 178.24 3ktv s ASN 59 N -0.76 6.80 -0.30 2.29 0.02 -1.26 -4.16 114.94 117.57 3ktv s ASN 59 Ca 0.26 1.20 -0.14 0.00 -1.02 0.00 0.00 52.86 53.15 3ktv s ASN 59 Cb -0.17 -2.54 0.16 0.00 0.02 0.00 0.00 41.25 38.71 3ktv s ASN 59 CO 0.15 -0.97 0.93 0.54 0.02 0.00 0.00 177.10 177.77 3ktv s VAL 60 N 3.99 -0.51 0.12 1.60 0.11 -1.25 0.10 120.40 124.57 3ktv s VAL 60 Ca 0.52 0.00 0.09 0.00 -2.93 0.00 0.00 61.98 59.66 3ktv s VAL 60 Cb -0.15 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.66 3ktv s VAL 60 CO 0.19 0.00 -0.22 0.72 -3.33 0.00 0.00 175.10 172.46 3ktv s PHE 61 N 2.38 1.96 -0.23 1.54 -0.12 -0.65 -4.89 117.98 117.96 3ktv s PHE 61 Ca -0.04 -0.41 -0.14 0.00 -0.05 0.00 0.00 56.93 56.29 3ktv s PHE 61 Cb -0.07 -1.05 -0.04 0.00 -0.63 0.00 0.00 43.02 41.23 3ktv s PHE 61 CO -0.17 0.28 0.31 -1.17 -0.05 0.00 0.00 175.22 174.41 3ktv s LEU 62 N -2.10 4.11 -1.25 -1.99 2.96 -1.26 -1.95 118.68 117.19 3ktv s LEU 62 Ca 0.10 0.31 -0.05 0.00 -0.22 0.00 0.00 54.13 54.27 3ktv s LEU 62 Cb -0.09 -2.34 0.17 0.00 0.50 0.00 0.00 46.19 44.43 3ktv s LEU 62 CO 0.05 -0.06 2.15 -0.62 -1.32 0.00 0.00 176.35 176.56 3ktv n GLU 63 N 4.65 4.55 -0.09 1.98 1.02 0.19 -4.87 120.64 128.06 3ktv n GLU 63 Ca -0.11 -3.73 0.08 0.00 -0.02 0.00 0.00 57.16 53.38 3ktv n GLU 63 Cb 0.51 -2.65 0.14 0.00 -0.02 0.00 0.00 31.44 29.43 3ktv n GLU 63 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3ktv n LYS 64 N 1.81 -0.01 -0.01 3.49 0.00 -1.26 -1.36 118.16 120.82 3ktv n LYS 64 Ca 0.54 0.29 0.08 0.00 -0.00 0.00 0.00 58.31 59.21 3ktv n LYS 64 Cb 0.27 -0.55 -0.12 0.00 -0.00 0.00 0.00 35.03 34.64 3ktv n LYS 64 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3ktv n ASN 65 N -3.22 1.31 -4.28 -5.58 3.02 -1.26 -3.76 115.26 101.48 3ktv n ASN 65 Ca 0.09 -0.12 -0.37 0.00 -0.03 0.00 0.00 54.58 54.15 3ktv n ASN 65 Cb 0.33 1.62 0.05 0.00 -0.61 0.00 0.00 39.78 41.17 3ktv n ASN 65 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3ktv n LYS 66 N -1.95 0.11 -4.19 3.52 4.76 -0.46 -4.61 118.16 115.33 3ktv n LYS 66 Ca -0.02 0.05 -0.17 0.00 -2.87 0.00 0.00 58.31 55.30 3ktv n LYS 66 Cb 0.39 -1.37 -0.11 0.00 -1.84 0.00 0.00 35.03 32.10 3ktv n LYS 66 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3ktv s MET 67 N -2.06 0.87 0.09 1.97 -1.94 -1.26 -0.25 119.30 116.73 3ktv s MET 67 Ca 0.56 -1.08 -0.27 0.00 -1.71 0.00 0.00 55.69 53.19 3ktv s MET 67 Cb -0.35 -0.75 -0.06 0.00 2.01 0.00 0.00 34.83 35.68 3ktv s MET 67 CO 0.67 0.15 0.85 -0.47 -0.01 0.00 0.00 175.02 176.21 3ktv s TYR 68 N -1.84 3.79 0.07 -0.03 5.04 -1.26 -4.95 117.35 118.16 3ktv s TYR 68 Ca 0.03 1.63 -0.20 0.00 -2.44 0.00 0.00 57.07 56.09 3ktv s TYR 68 Cb -0.07 -2.92 -0.08 0.00 0.35 0.00 0.00 41.96 39.25 3ktv s TYR 68 CO 0.02 0.27 1.32 0.77 -1.34 0.00 0.00 175.55 176.58 3ktv h SER 69 N 5.49 -0.99 0.00 4.32 0.02 -2.00 -1.70 113.55 118.69 3ktv h SER 69 Ca -0.44 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 3ktv h SER 69 Cb 1.21 0.38 0.00 0.00 0.14 0.00 0.00 62.40 64.13 3ktv h SER 69 CO 0.71 -0.29 0.00 0.54 -1.14 0.00 0.00 176.83 176.65 3ktv n ARG 70 N -4.21 0.44 -3.04 3.45 1.74 -1.26 -4.44 116.66 109.34 3ktv n ARG 70 Ca -0.04 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.67 3ktv n ARG 70 Cb 0.22 -1.22 -0.02 0.00 -1.02 0.00 0.00 32.46 30.43 3ktv n ARG 70 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3ktv n GLU 71 N 0.29 4.04 -0.23 5.56 4.07 -0.64 -4.89 120.64 128.84 3ktv n GLU 71 Ca 0.00 -4.64 0.20 0.00 -0.06 0.00 0.00 57.16 52.66 3ktv n GLU 71 Cb 0.11 -2.41 0.38 0.00 -0.06 0.00 0.00 31.44 29.46 3ktv n GLU 71 CO 0.00 0.00 0.00 -2.67 -0.06 0.00 0.00 177.13 174.40 3ktv n TRP 72 N 0.79 0.76 -2.55 4.31 4.27 -1.26 -4.41 117.44 119.35 3ktv n TRP 72 Ca 0.31 0.83 -0.40 0.00 -3.89 0.00 0.00 57.50 54.35 3ktv n TRP 72 Cb 0.34 -1.22 -0.05 0.00 -1.36 0.00 0.00 31.31 29.03 3ktv n TRP 72 CO 0.00 0.00 0.00 1.21 -2.29 0.00 0.00 177.69 176.61 3ktv s ASN 73 N -4.72 7.35 0.00 -0.67 3.84 -1.26 -4.95 114.94 114.53 3ktv s ASN 73 Ca -0.07 2.13 0.23 0.00 0.21 0.00 0.00 52.86 55.36 3ktv s ASN 73 Cb 0.23 -2.61 0.09 0.00 -0.55 0.00 0.00 41.25 38.40 3ktv s ASN 73 CO 0.55 -0.11 1.13 -1.14 -2.79 0.00 0.00 177.10 174.74 3ktv n ARG 74 N 1.69 0.41 -1.62 0.43 0.63 -1.26 -4.92 116.66 112.01 3ktv n ARG 74 Ca 0.00 -0.32 -0.47 0.00 -0.92 0.00 0.00 57.85 56.14 3ktv n ARG 74 Cb 0.46 -1.49 -0.04 0.00 0.45 0.00 0.00 32.46 31.84 3ktv n ARG 74 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 3ktv n ASP 75 N -1.02 2.11 0.00 6.15 -0.08 -1.26 -4.85 116.55 117.60 3ktv n ASP 75 Ca 0.07 1.13 0.00 0.00 -1.51 0.00 0.00 54.79 54.48 3ktv n ASP 75 Cb 0.37 -1.31 0.00 0.00 2.34 0.00 0.00 41.12 42.51 3ktv n ASP 75 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 3ktv n VAL 76 N 2.04 0.00 -0.03 5.18 3.14 -1.26 0.83 118.33 128.23 3ktv n VAL 76 Ca 0.15 1.30 0.08 0.00 -2.96 0.00 0.00 64.34 62.91 3ktv n VAL 76 Cb 0.27 -1.81 0.13 0.00 -1.06 0.00 0.00 33.84 31.36 3ktv n VAL 76 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 3ktv n GLN 77 N -2.18 0.01 -0.21 1.45 7.27 -1.26 0.29 117.38 122.74 3ktv n GLN 77 Ca 0.00 0.38 0.10 0.00 0.07 0.00 0.00 57.00 57.55 3ktv n GLN 77 Cb 0.00 -0.95 0.21 0.00 2.41 0.00 0.00 30.24 31.91 3ktv n GLN 77 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 3ktv n TYR 78 N -1.84 0.54 -4.18 3.69 4.02 0.24 -4.75 117.16 114.89 3ktv n TYR 78 Ca 0.07 -0.32 -0.11 0.00 -0.01 0.00 0.00 57.90 57.53 3ktv n TYR 78 Cb 0.53 -0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.75 3ktv n TYR 78 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 3ktv s ARG 79 N -1.25 1.04 0.00 -0.72 1.70 0.82 -4.75 118.95 115.78 3ktv s ARG 79 Ca 0.36 -1.51 0.00 0.00 -0.47 0.00 0.00 55.73 54.11 3ktv s ARG 79 Cb 0.20 0.15 0.00 0.00 -0.57 0.00 0.00 34.95 34.73 3ktv s ARG 79 CO 0.28 -0.27 0.00 0.41 -1.08 0.00 0.00 175.30 174.64 3ktv n GLY 80 N -0.17 1.40 3.52 3.88 0.00 0.66 -4.58 105.19 109.90 3ktv n GLY 80 Ca -0.04 -2.27 -0.14 0.00 0.00 0.00 0.00 46.02 43.57 3ktv n GLY 80 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ktv s ARG 81 N -1.31 0.76 0.01 1.61 3.52 -1.18 -4.60 118.95 117.76 3ktv s ARG 81 Ca 0.00 0.79 0.03 0.00 -0.13 0.00 0.00 55.73 56.42 3ktv s ARG 81 Cb 0.00 0.37 -0.03 0.00 -1.56 0.00 0.00 34.95 33.72 3ktv s ARG 81 CO 0.00 -0.11 -0.06 0.08 -0.81 0.00 0.00 175.30 174.40 3ktv s VAL 82 N 0.15 3.70 -0.14 7.11 1.01 -1.17 0.56 120.40 131.62 3ktv s VAL 82 Ca -0.01 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.18 3ktv s VAL 82 Cb -0.04 -2.63 0.02 0.00 0.00 0.00 0.00 36.38 33.73 3ktv s VAL 82 CO 0.02 0.37 -0.16 -0.13 0.00 0.00 0.00 175.10 175.20 3ktv s ARG 83 N -1.51 2.40 -0.05 2.72 0.52 -0.82 -1.76 118.95 120.45 3ktv s ARG 83 Ca 0.18 -0.61 0.06 0.00 -0.52 0.00 0.00 55.73 54.84 3ktv s ARG 83 Cb -0.11 -2.11 -0.01 0.00 0.52 0.00 0.00 34.95 33.23 3ktv s ARG 83 CO 0.09 -0.16 -0.25 0.14 0.02 0.00 0.00 175.30 175.13 3ktv s VAL 84 N 1.27 2.03 -0.38 3.52 -7.23 -1.05 -1.64 120.40 116.91 3ktv s VAL 84 Ca 0.01 -1.06 -0.29 0.00 -1.81 0.00 0.00 61.98 58.83 3ktv s VAL 84 Cb -0.14 -1.71 0.02 0.00 0.56 0.00 0.00 36.38 35.11 3ktv s VAL 84 CO -0.08 0.56 1.09 -1.58 -0.31 0.00 0.00 175.10 174.79 3ktv s GLN 85 N -0.19 3.94 -0.10 4.82 0.74 0.29 -1.75 119.66 127.40 3ktv s GLN 85 Ca -0.02 0.88 -0.03 0.00 0.05 0.00 0.00 55.36 56.24 3ktv s GLN 85 Cb -0.13 -3.80 -0.01 0.00 1.10 0.00 0.00 33.01 30.17 3ktv s GLN 85 CO 0.03 -1.07 -0.05 -0.07 -0.55 0.00 0.00 175.29 173.57 3ktv h LEU 86 N 10.49 0.00 -9.90 3.68 3.38 -1.88 -3.40 115.31 117.68 3ktv h LEU 86 Ca -0.21 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.25 3ktv h LEU 86 Cb 1.06 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.76 3ktv h LEU 86 CO 1.07 0.54 -0.53 -0.54 0.09 0.00 0.00 178.44 179.07 3ktv s LYS 87 N -1.72 2.89 -0.24 1.13 1.02 -1.26 -0.74 119.74 120.83 3ktv s LYS 87 Ca -0.04 -1.08 -0.14 0.00 0.02 0.00 0.00 55.97 54.73 3ktv s LYS 87 Cb 0.01 -2.55 -0.04 0.00 -0.52 0.00 0.00 37.83 34.73 3ktv s LYS 87 CO 0.07 0.38 0.32 -0.65 -0.92 0.00 0.00 175.35 174.55 3ktv s GLN 88 N -3.85 4.09 0.02 1.68 -0.21 1.03 -3.93 119.66 118.48 3ktv s GLN 88 Ca 0.33 0.00 0.01 0.00 0.02 0.00 0.00 55.36 55.73 3ktv s GLN 88 Cb -0.08 -3.58 0.05 0.00 1.00 0.00 0.00 33.01 30.41 3ktv s GLN 88 CO 0.25 -0.09 0.06 -1.91 -2.12 0.00 0.00 175.29 171.48 3ktv n GLU 89 N 4.71 -0.00 0.30 2.91 4.07 -1.26 1.41 120.64 132.77 3ktv n GLU 89 Ca -0.10 0.05 0.18 0.00 -0.06 0.00 0.00 57.16 57.23 3ktv n GLU 89 Cb 0.51 -0.09 0.90 0.00 -0.06 0.00 0.00 31.44 32.70 3ktv n GLU 89 CO 0.00 0.00 0.00 0.38 -0.06 0.00 0.00 177.13 177.45 3ktv h ASP 90 N 0.00 0.00 0.00 4.31 3.04 -1.99 -3.41 116.42 118.37 3ktv h ASP 90 Ca 0.03 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.82 3ktv h ASP 90 Cb 0.09 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.38 3ktv h ASP 90 CO -0.02 0.03 0.00 0.61 -2.04 0.00 0.00 179.24 177.82 3ktv n GLY 91 N -0.58 1.46 3.75 7.15 0.00 13.83 -5.07 105.19 125.72 3ktv n GLY 91 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3ktv n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ktv n SER 92 N 0.00 3.52 -4.70 1.61 7.64 -1.09 -4.08 113.62 116.52 3ktv n SER 92 Ca 0.00 1.21 -0.42 0.00 1.01 0.00 0.00 58.87 60.67 3ktv n SER 92 Cb 0.00 -1.58 -0.03 0.00 -1.01 0.00 0.00 64.21 61.59 3ktv n SER 92 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3ktv s LEU 93 N -1.58 4.33 0.26 -3.43 1.43 -1.26 0.34 118.68 118.76 3ktv s LEU 93 Ca 0.55 1.97 -0.05 0.00 -1.03 0.00 0.00 54.13 55.58 3ktv s LEU 93 Cb -0.51 -3.57 0.32 0.00 0.03 0.00 0.00 46.19 42.47 3ktv s LEU 93 CO 0.62 -0.56 1.93 0.00 0.23 0.00 0.00 176.35 178.56 3ktv s LEU 95 N -10.09 1.66 0.00 0.00 1.43 -1.26 -5.01 118.68 105.41 3ktv s LEU 95 Ca -0.13 -2.00 0.00 0.00 -1.03 0.00 0.00 54.13 50.98 3ktv s LEU 95 Cb 0.18 -0.67 0.00 0.00 0.03 0.00 0.00 46.19 45.73 3ktv s LEU 95 CO 0.81 -0.35 0.00 1.33 0.23 0.00 0.00 176.35 178.37 3ktv n VAL 96 N 4.34 0.00 0.62 -1.59 0.24 -1.26 0.51 118.33 121.19 3ktv n VAL 96 Ca 0.04 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.47 3ktv n VAL 96 Cb 0.38 0.00 0.45 0.00 -1.47 0.00 0.00 33.84 33.20 3ktv n VAL 96 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ktv n GLN 97 N -2.13 0.21 -3.37 7.34 10.64 -1.26 -4.12 117.38 124.70 3ktv n GLN 97 Ca 0.00 0.23 -0.29 0.00 -1.83 0.00 0.00 57.00 55.11 3ktv n GLN 97 Cb 0.00 -1.77 -0.07 0.00 -0.86 0.00 0.00 30.24 27.54 3ktv n GLN 97 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3ktv n PHE 98 N -2.14 3.51 0.37 2.61 3.72 0.18 -4.89 117.46 120.82 3ktv n PHE 98 Ca 0.05 -3.98 -0.16 0.00 -0.05 0.00 0.00 57.45 53.31 3ktv n PHE 98 Cb 0.37 -0.64 -0.08 0.00 -0.94 0.00 0.00 39.48 38.20 3ktv n PHE 98 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3ktv h PRO 99 N 4.30 -0.92 0.00 -1.08 0.11 -1.82 -3.46 132.00 129.13 3ktv h PRO 99 Ca 0.20 0.06 -0.47 0.00 0.11 0.00 0.00 66.00 65.90 3ktv h PRO 99 Cb 0.65 0.21 0.05 0.00 0.11 0.00 0.00 31.00 32.02 3ktv h PRO 99 CO 0.90 -0.59 0.00 -1.13 -0.21 0.00 0.00 178.00 176.96 3ktv n SER 100 N -5.42 1.80 0.00 -2.05 3.41 -1.26 -5.00 113.62 105.10 3ktv n SER 100 Ca -0.12 -2.37 -0.18 0.00 -0.26 0.00 0.00 58.87 55.94 3ktv n SER 100 Cb 0.39 -0.51 -0.10 0.00 -0.26 0.00 0.00 64.21 63.73 3ktv n SER 100 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3ktv h ARG 101 N 0.00 0.51 -0.45 4.33 3.08 -2.00 -3.24 114.38 116.61 3ktv h ARG 101 Ca -0.29 -0.51 0.09 0.00 0.07 0.00 0.00 59.98 59.34 3ktv h ARG 101 Cb 1.23 0.14 -0.10 0.00 0.08 0.00 0.00 29.97 31.32 3ktv h ARG 101 CO 0.37 1.14 -0.23 -0.22 -1.07 0.00 0.00 179.97 179.97 3ktv h LYS 102 N 0.07 -0.13 -0.88 0.04 1.63 -1.97 0.10 116.57 115.43 3ktv h LYS 102 Ca -0.08 0.01 0.16 0.00 -0.85 0.00 0.00 60.65 59.89 3ktv h LYS 102 Cb 1.36 0.03 -0.16 0.00 -0.60 0.00 0.00 32.23 32.86 3ktv h LYS 102 CO 0.13 -0.09 -0.26 -1.13 -3.45 0.00 0.00 179.45 174.65 3ktv n SER 103 N -5.40 -0.41 0.32 4.20 3.41 -1.22 0.22 113.62 114.74 3ktv n SER 103 Ca 0.03 1.53 -0.15 0.00 -0.26 0.00 0.00 58.87 60.02 3ktv n SER 103 Cb 0.31 -0.42 -0.08 0.00 -0.26 0.00 0.00 64.21 63.76 3ktv n SER 103 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3ktv h VAL 104 N 0.00 0.21 -0.79 -3.33 2.07 -0.94 -2.30 116.25 111.17 3ktv h VAL 104 Ca 0.38 -0.33 0.09 0.00 0.82 0.00 0.00 66.70 67.66 3ktv h VAL 104 Cb 0.60 0.28 -0.12 0.00 -1.52 0.00 0.00 31.29 30.54 3ktv h VAL 104 CO -0.90 0.03 -0.51 0.24 0.02 0.00 0.00 177.57 176.45 3ktv h MET 105 N -1.10 -0.13 0.13 1.57 2.07 0.94 0.13 114.93 118.54 3ktv h MET 105 Ca -0.08 0.01 0.02 0.00 -2.07 0.00 0.00 59.70 57.57 3ktv h MET 105 Cb 0.68 0.03 -0.04 0.00 -1.87 0.00 0.00 31.60 30.40 3ktv h MET 105 CO 0.14 -0.08 -0.31 -0.07 1.07 0.00 0.00 176.91 177.65 3ktv h LEU 106 N -0.13 -0.90 -0.26 1.22 3.38 -0.26 0.27 115.31 118.64 3ktv h LEU 106 Ca 0.18 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.29 3ktv h LEU 106 Cb 0.51 0.34 -0.06 0.00 0.09 0.00 0.00 40.66 41.55 3ktv h LEU 106 CO -0.82 -0.40 -0.40 0.22 0.09 0.00 0.00 178.44 177.13 3ktv h TYR 107 N -0.54 -1.21 -0.71 1.13 3.20 -0.60 0.52 116.97 118.76 3ktv h TYR 107 Ca 0.03 0.06 0.14 0.00 3.14 0.00 0.00 58.73 62.10 3ktv h TYR 107 Cb 0.57 0.56 -0.04 0.00 1.54 0.00 0.00 36.73 39.35 3ktv h TYR 107 CO -0.28 -0.36 0.48 0.00 -1.64 0.00 0.00 178.16 176.36 3ktv h ALA 108 N -0.44 2.14 -0.44 1.82 0.00 -0.31 0.26 119.26 122.28 3ktv h ALA 108 Ca 0.05 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.06 3ktv h ALA 108 Cb 0.43 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3ktv h ALA 108 CO -0.41 -0.33 0.31 0.00 0.00 0.00 0.00 179.25 178.82 3ktv h ALA 109 N 1.66 2.24 -0.01 0.00 0.00 0.18 -2.80 119.26 120.54 3ktv h ALA 109 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3ktv h ALA 109 Cb 0.82 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3ktv h ALA 109 CO -0.10 -0.35 -0.74 0.39 0.00 0.00 0.00 179.25 178.44 3ktv n GLU 110 N -4.44 0.83 -0.11 0.00 1.02 0.88 -4.48 120.64 114.34 3ktv n GLU 110 Ca 0.07 -0.36 -0.23 0.00 -0.02 0.00 0.00 57.16 56.63 3ktv n GLU 110 Cb 0.42 -1.42 -0.12 0.00 -0.02 0.00 0.00 31.44 30.30 3ktv n GLU 110 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 3ktv n MET 111 N -0.93 0.64 -0.16 3.49 2.81 -1.07 -4.57 117.12 117.33 3ktv n MET 111 Ca 0.06 0.24 -0.11 0.00 -1.81 0.00 0.00 57.70 56.08 3ktv n MET 111 Cb 0.35 -1.56 -0.08 0.00 -0.71 0.00 0.00 33.22 31.22 3ktv n MET 111 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3ktv h ILE 112 N -0.40 0.00 0.00 2.02 2.04 -1.74 3.03 117.51 122.45 3ktv h ILE 112 Ca -0.57 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.29 3ktv h ILE 112 Cb 1.77 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 3ktv h ILE 112 CO -0.18 0.00 0.28 -2.65 0.00 0.00 0.00 178.15 175.60 3ktv n PRO 113 N -4.84 0.00 -0.12 2.37 -0.02 -1.26 -0.06 135.00 131.07 3ktv n PRO 113 Ca -0.02 0.10 -0.16 0.00 -2.02 0.00 0.00 63.50 61.40 3ktv n PRO 113 Cb 0.26 -1.78 -0.11 0.00 -0.02 0.00 0.00 33.50 31.84 3ktv n PRO 113 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3ktv n LYS 114 N -1.01 0.64 0.00 -0.52 5.02 1.00 -5.20 118.16 118.09 3ktv n LYS 114 Ca 0.00 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 3ktv n LYS 114 Cb 0.28 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 3ktv n LYS 114 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16