#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k03 n PRO 2 N 0.00 0.51 0.18 1.97 -0.02 -1.26 -3.68 135.00 132.70 2k03 n PRO 2 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.52 2k03 n PRO 2 Cb 0.00 -1.25 0.30 0.00 -0.02 0.00 0.00 33.50 32.53 2k03 n PRO 2 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2k03 h VAL 3 N 0.40 1.02 -3.16 -1.45 -1.51 -2.11 -3.38 116.25 106.07 2k03 h VAL 3 Ca 0.00 -1.65 -0.49 0.00 -1.23 0.00 0.00 66.70 63.33 2k03 h VAL 3 Cb 0.46 1.97 -0.40 0.00 -2.13 0.00 0.00 31.29 31.19 2k03 h VAL 3 CO 0.00 0.42 -0.76 -0.55 -1.23 0.00 0.00 177.57 175.45 2k03 s SER 4 N -6.55 2.69 -0.36 4.19 0.15 -1.24 -5.06 113.70 107.52 2k03 s SER 4 Ca -0.00 -0.75 0.06 0.00 0.70 0.00 0.00 55.95 55.96 2k03 s SER 4 Cb 0.11 -0.43 0.18 0.00 -1.71 0.00 0.00 66.02 64.17 2k03 s SER 4 CO 0.71 -0.33 0.56 -0.22 1.20 0.00 0.00 173.24 175.15 2k03 s LEU 5 N 1.99 -1.27 -0.25 3.45 2.96 -1.26 -4.95 118.68 119.35 2k03 s LEU 5 Ca 0.01 -0.57 0.09 0.00 -0.22 0.00 0.00 54.13 53.44 2k03 s LEU 5 Cb -0.17 1.68 0.64 0.00 0.50 0.00 0.00 46.19 48.85 2k03 s LEU 5 CO -0.09 -0.24 1.59 -1.20 -1.32 0.00 0.00 176.35 175.09 2k03 n SER 6 N 4.80 4.54 -3.01 3.68 7.64 -1.26 -4.91 113.62 125.09 2k03 n SER 6 Ca 0.08 -2.93 -0.04 0.00 1.01 0.00 0.00 58.87 56.99 2k03 n SER 6 Cb 0.54 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 2k03 n SER 6 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2k03 n TYR 7 N 0.12 -3.14 -4.39 1.43 4.02 -1.26 -5.05 117.16 108.89 2k03 n TYR 7 Ca 0.30 1.23 -0.25 0.00 -0.01 0.00 0.00 57.90 59.18 2k03 n TYR 7 Cb 1.16 -4.03 -0.09 0.00 -0.02 0.00 0.00 39.34 36.36 2k03 n TYR 7 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2k03 s ARG 8 N -2.91 2.00 0.36 -0.72 1.81 -1.26 -4.88 118.95 113.36 2k03 s ARG 8 Ca 0.10 -1.76 -0.02 0.00 -1.72 0.00 0.00 55.73 52.33 2k03 s ARG 8 Cb -0.03 -1.89 -0.04 0.00 -0.45 0.00 0.00 34.95 32.55 2k03 s ARG 8 CO 0.76 0.17 0.60 0.00 -0.68 0.00 0.00 175.30 176.16 2k03 h PRO 10 N 0.86 0.69 -4.47 0.00 0.13 -1.95 -3.41 132.00 123.86 2k03 h PRO 10 Ca -0.49 -0.05 -0.25 0.00 -0.87 0.00 0.00 66.00 64.35 2k03 h PRO 10 Cb 1.21 -0.15 -0.20 0.00 0.13 0.00 0.00 31.00 31.98 2k03 h PRO 10 CO 0.63 0.47 -0.72 0.00 -0.23 0.00 0.00 178.00 178.14 2k03 h ARG 12 N 4.35 0.63 -4.59 0.00 2.43 -2.02 -3.45 114.38 111.74 2k03 h ARG 12 Ca -0.35 -0.80 -0.26 0.00 -0.81 0.00 0.00 59.98 57.76 2k03 h ARG 12 Cb 1.20 0.26 -0.20 0.00 -0.42 0.00 0.00 29.97 30.81 2k03 h ARG 12 CO 0.43 1.36 -0.72 -0.06 -1.51 0.00 0.00 179.97 179.47 2k03 s PHE 13 N -3.06 0.72 0.12 2.20 0.08 -1.26 -5.11 117.98 111.68 2k03 s PHE 13 Ca -0.10 -0.60 0.08 0.00 0.12 0.00 0.00 56.93 56.43 2k03 s PHE 13 Cb 0.06 -0.43 -0.04 0.00 -0.57 0.00 0.00 43.02 42.04 2k03 s PHE 13 CO 0.93 -0.10 -0.20 -0.59 -0.10 0.00 0.00 175.22 175.16 2k03 s PHE 14 N -1.94 1.78 0.44 0.36 -0.71 -1.26 -4.80 117.98 111.85 2k03 s PHE 14 Ca -0.05 -0.44 -0.21 0.00 -1.04 0.00 0.00 56.93 55.20 2k03 s PHE 14 Cb -0.06 -0.94 -0.11 0.00 -1.21 0.00 0.00 43.02 40.70 2k03 s PHE 14 CO -0.01 0.24 0.96 -1.21 -1.34 0.00 0.00 175.22 173.87 2k03 s GLU 15 N -2.24 4.16 0.02 1.99 0.41 0.91 -4.73 118.70 119.23 2k03 s GLU 15 Ca 0.10 1.14 0.00 0.00 -0.41 0.00 0.00 54.97 55.80 2k03 s GLU 15 Cb -0.08 -2.17 0.00 0.00 -1.78 0.00 0.00 34.13 30.10 2k03 s GLU 15 CO 0.05 -0.09 0.00 -1.13 -0.49 0.00 0.00 175.26 173.60 2k03 n SER 16 N -0.72 0.11 -4.57 -0.19 3.41 -1.26 -1.15 113.62 109.24 2k03 n SER 16 Ca 0.07 0.03 -0.36 0.00 -0.26 0.00 0.00 58.87 58.35 2k03 n SER 16 Cb 0.54 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 2k03 n SER 16 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2k03 s HIS 17 N -1.13 2.33 0.02 7.33 3.76 -1.26 -4.84 115.29 121.50 2k03 s HIS 17 Ca 0.00 -0.49 0.02 0.00 -0.15 0.00 0.00 55.06 54.44 2k03 s HIS 17 Cb 0.00 -4.43 -0.01 0.00 1.11 0.00 0.00 32.58 29.25 2k03 s HIS 17 CO 0.00 -1.69 -0.07 0.08 -0.85 0.00 0.00 174.74 172.21 2k03 s VAL 18 N 7.14 0.55 -0.21 -0.90 1.01 -1.26 -5.14 120.40 121.59 2k03 s VAL 18 Ca 0.58 -0.60 -0.07 0.00 0.00 0.00 0.00 61.98 61.89 2k03 s VAL 18 Cb -0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 2k03 s VAL 18 CO 0.03 -0.05 0.07 0.00 0.00 0.00 0.00 175.10 175.14 2k03 s ALA 19 N -0.62 3.31 -0.29 5.51 0.00 -1.26 -4.96 121.76 123.45 2k03 s ALA 19 Ca -0.02 -0.88 0.24 0.00 0.00 0.00 0.00 51.96 51.30 2k03 s ALA 19 Cb -0.05 -1.98 1.14 0.00 0.00 0.00 0.00 23.12 22.23 2k03 s ALA 19 CO 0.00 -0.06 1.74 0.07 0.00 0.00 0.00 175.76 177.51 2k03 h ARG 20 N 7.25 0.00 0.00 0.00 0.11 -1.98 0.21 114.38 119.97 2k03 h ARG 20 Ca -0.37 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.71 2k03 h ARG 20 Cb 1.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.25 2k03 h ARG 20 CO 0.65 0.00 0.04 0.00 0.10 0.00 0.00 179.97 180.75 2k03 n ALA 21 N -1.81 0.95 1.02 0.08 0.00 -1.26 0.18 120.51 119.67 2k03 n ALA 21 Ca 0.01 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.60 2k03 n ALA 21 Cb 0.16 -1.01 0.02 0.00 0.00 0.00 0.00 19.45 18.61 2k03 n ALA 21 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2k03 n ASN 22 N -1.66 1.79 -4.76 0.00 2.04 0.06 -4.95 115.26 107.79 2k03 n ASN 22 Ca -0.00 -1.38 -0.27 0.00 -0.44 0.00 0.00 54.58 52.49 2k03 n ASN 22 Cb 0.04 0.52 -0.06 0.00 -2.53 0.00 0.00 39.78 37.75 2k03 n ASN 22 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 2k03 s VAL 23 N -2.56 4.32 -0.15 3.53 -7.23 0.13 -0.98 120.40 117.45 2k03 s VAL 23 Ca 0.17 -1.09 0.05 0.00 -1.81 0.00 0.00 61.98 59.30 2k03 s VAL 23 Cb 0.18 -3.17 -0.23 0.00 0.56 0.00 0.00 36.38 33.72 2k03 s VAL 23 CO 0.61 -0.06 0.25 0.29 -0.31 0.00 0.00 175.10 175.88 2k03 n LYS 24 N -0.12 0.69 -3.67 4.82 5.02 0.44 -4.73 118.16 120.61 2k03 n LYS 24 Ca -0.09 0.19 -0.04 0.00 -2.02 0.00 0.00 58.31 56.35 2k03 n LYS 24 Cb 0.54 -1.65 0.02 0.00 -0.02 0.00 0.00 35.03 33.92 2k03 n LYS 24 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 2k03 n HIS 25 N -3.19 -1.57 -4.29 2.13 1.44 -1.26 -5.04 115.22 103.44 2k03 n HIS 25 Ca -0.32 -1.33 -0.29 0.00 -2.01 0.00 0.00 57.72 53.77 2k03 n HIS 25 Cb 1.06 0.65 -0.11 0.00 0.12 0.00 0.00 29.99 31.71 2k03 n HIS 25 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2k03 s LEU 26 N 0.00 2.74 -0.07 2.39 1.02 -1.26 -3.66 118.68 119.83 2k03 s LEU 26 Ca 0.20 -0.54 -0.03 0.00 0.02 0.00 0.00 54.13 53.78 2k03 s LEU 26 Cb -0.03 -1.57 0.04 0.00 0.02 0.00 0.00 46.19 44.64 2k03 s LEU 26 CO 0.07 0.18 0.09 -0.75 0.02 0.00 0.00 176.35 175.95 2k03 s LYS 27 N -2.15 -0.03 -0.12 1.70 2.20 0.20 -5.00 119.74 116.54 2k03 s LYS 27 Ca 0.18 0.36 -0.01 0.00 -0.36 0.00 0.00 55.97 56.15 2k03 s LYS 27 Cb -0.11 -0.62 -0.02 0.00 -1.51 0.00 0.00 37.83 35.57 2k03 s LYS 27 CO 0.10 -0.37 -0.08 0.42 -0.36 0.00 0.00 175.35 175.06 2k03 s ILE 28 N 2.20 3.51 -0.05 5.43 1.01 -1.26 0.92 121.20 132.96 2k03 s ILE 28 Ca 0.04 -0.51 -0.15 0.00 0.00 0.00 0.00 60.65 60.04 2k03 s ILE 28 Cb -0.13 -2.48 0.03 0.00 0.01 0.00 0.00 42.46 39.89 2k03 s ILE 28 CO -0.04 0.53 0.34 -0.76 0.00 0.00 0.00 174.94 175.01 2k03 s LEU 29 N 0.02 0.74 -0.29 2.97 1.02 0.50 -4.98 118.68 118.65 2k03 s LEU 29 Ca -0.02 0.31 0.02 0.00 0.02 0.00 0.00 54.13 54.47 2k03 s LEU 29 Cb -0.14 1.29 0.08 0.00 0.02 0.00 0.00 46.19 47.45 2k03 s LEU 29 CO 0.03 -0.35 -0.00 0.54 0.02 0.00 0.00 176.35 176.59 2k03 s ASN 30 N -0.83 4.34 0.54 2.29 4.22 -1.26 -2.00 114.94 122.24 2k03 s ASN 30 Ca -0.09 -1.66 -0.19 0.00 -2.14 0.00 0.00 52.86 48.78 2k03 s ASN 30 Cb -0.04 -1.37 -0.06 0.00 1.28 0.00 0.00 41.25 41.06 2k03 s ASN 30 CO 0.03 -0.31 1.10 0.42 -2.04 0.00 0.00 177.10 176.31 2k03 s THR 31 N 1.19 3.36 -1.14 0.54 -4.23 -1.26 -4.87 115.64 109.22 2k03 s THR 31 Ca 0.02 0.81 -0.24 0.00 -1.18 0.00 0.00 61.69 61.11 2k03 s THR 31 Cb -0.19 -3.32 -0.13 0.00 1.34 0.00 0.00 72.50 70.20 2k03 s THR 31 CO -0.09 -0.21 2.00 -2.84 -0.54 0.00 0.00 174.62 172.93 2k03 s PRO 32 N -3.38 2.06 0.00 3.99 0.02 -1.26 -1.19 135.00 135.24 2k03 s PRO 32 Ca 0.70 -0.90 0.00 0.00 0.02 0.00 0.00 61.00 60.83 2k03 s PRO 32 Cb -0.21 -5.15 0.00 0.00 0.02 0.00 0.00 34.50 29.16 2k03 s PRO 32 CO 0.27 -4.47 0.00 -1.71 -0.33 0.00 0.00 177.00 170.76 2k03 n ASN 33 N 16.13 0.00 -4.39 2.53 5.15 -1.26 -4.74 115.26 128.68 2k03 n ASN 33 Ca 0.44 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 54.22 2k03 n ASN 33 Cb 0.47 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.61 2k03 n ASN 33 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k03 n ALA 35 N -0.48 -1.60 -1.69 0.00 0.00 -1.26 -4.16 120.51 111.32 2k03 n ALA 35 Ca -0.07 -1.06 -0.43 0.00 0.00 0.00 0.00 53.44 51.88 2k03 n ALA 35 Cb 0.61 -0.06 -0.01 0.00 0.00 0.00 0.00 19.45 19.99 2k03 n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k03 s GLN 37 N -1.25 0.72 -0.08 0.00 0.74 -0.85 -4.72 119.66 114.22 2k03 s GLN 37 Ca 0.61 0.78 -0.01 0.00 0.05 0.00 0.00 55.36 56.79 2k03 s GLN 37 Cb -0.59 0.35 -0.03 0.00 1.10 0.00 0.00 33.01 33.83 2k03 s GLN 37 CO 0.57 -0.10 -0.03 0.42 -0.55 0.00 0.00 175.29 175.60 2k03 s ILE 38 N 0.19 4.02 -0.07 -2.34 1.01 -1.10 -0.37 121.20 122.54 2k03 s ILE 38 Ca -0.01 -0.36 0.04 0.00 0.00 0.00 0.00 60.65 60.33 2k03 s ILE 38 Cb -0.04 -2.67 -0.02 0.00 0.01 0.00 0.00 42.46 39.74 2k03 s ILE 38 CO 0.01 0.59 -0.20 -0.69 0.00 0.00 0.00 174.94 174.66 2k03 s VAL 39 N -0.76 2.52 0.03 2.92 1.01 0.26 0.11 120.40 126.50 2k03 s VAL 39 Ca 0.12 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.24 2k03 s VAL 39 Cb -0.11 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 2k03 s VAL 39 CO 0.02 0.57 -0.12 0.00 0.00 0.00 0.00 175.10 175.57 2k03 s ALA 40 N -0.26 0.96 -0.18 5.51 0.00 0.40 -0.63 121.76 127.56 2k03 s ALA 40 Ca 0.00 -0.71 -0.12 0.00 0.00 0.00 0.00 51.96 51.13 2k03 s ALA 40 Cb -0.13 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 2k03 s ALA 40 CO 0.03 0.17 0.23 1.03 0.00 0.00 0.00 175.76 177.22 2k03 s ARG 41 N -0.99 4.23 0.32 0.00 0.52 -1.24 -1.25 118.95 120.54 2k03 s ARG 41 Ca 0.00 -0.03 -0.29 0.00 -0.52 0.00 0.00 55.73 54.89 2k03 s ARG 41 Cb -0.07 -3.43 -0.11 0.00 0.52 0.00 0.00 34.95 31.86 2k03 s ARG 41 CO 0.01 0.25 1.43 -0.51 0.02 0.00 0.00 175.30 176.49 2k03 s LEU 42 N 0.46 4.37 0.06 2.53 2.01 -1.24 -0.42 118.68 126.46 2k03 s LEU 42 Ca 0.13 2.82 -0.32 0.00 0.01 0.00 0.00 54.13 56.78 2k03 s LEU 42 Cb -0.12 -3.65 -0.16 0.00 0.01 0.00 0.00 46.19 42.27 2k03 s LEU 42 CO 0.02 -0.72 1.48 0.11 1.01 0.00 0.00 176.35 178.24 2k03 h LYS 43 N 3.86 -0.99 -0.88 1.70 1.57 -1.35 -3.44 116.57 117.04 2k03 h LYS 43 Ca -0.49 0.07 0.08 0.00 -1.87 0.00 0.00 60.65 58.44 2k03 h LYS 43 Cb 1.23 0.23 -0.21 0.00 0.08 0.00 0.00 32.23 33.55 2k03 h LYS 43 CO 0.70 -0.66 -0.27 1.21 -0.57 0.00 0.00 179.45 179.86 2k03 s ASN 44 N -3.85 -1.36 0.00 0.86 2.47 -1.26 -5.02 114.94 106.78 2k03 s ASN 44 Ca -0.16 0.42 0.00 0.00 0.42 0.00 0.00 52.86 53.53 2k03 s ASN 44 Cb 0.03 1.96 0.00 0.00 -1.45 0.00 0.00 41.25 41.79 2k03 s ASN 44 CO 0.51 -0.25 0.00 -3.20 -3.72 0.00 0.00 177.10 170.44 2k03 n ASN 45 N 5.40 0.00 0.00 -4.21 5.15 -1.26 -5.10 115.26 115.24 2k03 n ASN 45 Ca 0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.01 2k03 n ASN 45 Cb 0.53 0.26 0.00 0.00 -0.53 0.00 0.00 39.78 40.04 2k03 n ASN 45 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2k03 n ASN 46 N -1.85 0.00 -0.47 1.20 4.13 -1.26 -5.18 115.26 111.83 2k03 n ASN 46 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 2k03 n ASN 46 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 2k03 n ASN 46 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 2k03 n ARG 47 N -2.06 0.00 -3.80 3.52 -4.01 -1.26 -5.06 116.66 103.99 2k03 n ARG 47 Ca 0.00 0.00 -0.27 0.00 -1.04 0.00 0.00 57.85 56.54 2k03 n ARG 47 Cb 0.00 0.00 -0.03 0.00 -3.04 0.00 0.00 32.46 29.39 2k03 n ARG 47 CO 0.00 0.00 0.00 1.14 -3.04 0.00 0.00 177.63 175.73 2k03 s GLN 48 N -0.40 3.49 0.07 2.89 -2.07 -1.26 -3.61 119.66 118.77 2k03 s GLN 48 Ca 0.00 -0.44 0.02 0.00 -1.82 0.00 0.00 55.36 53.12 2k03 s GLN 48 Cb 0.00 -2.90 -0.03 0.00 -1.09 0.00 0.00 33.01 28.98 2k03 s GLN 48 CO 0.00 0.46 -0.07 0.14 -1.32 0.00 0.00 175.29 174.51 2k03 s VAL 49 N -1.79 0.58 0.00 3.63 -7.23 -0.38 -4.97 120.40 110.25 2k03 s VAL 49 Ca 0.37 -1.56 -0.18 0.00 -1.81 0.00 0.00 61.98 58.79 2k03 s VAL 49 Cb -0.11 -1.21 -0.06 0.00 0.56 0.00 0.00 36.38 35.56 2k03 s VAL 49 CO 0.29 -0.68 0.52 0.00 -0.31 0.00 0.00 175.10 174.92 2k03 s ILE 51 N -0.58 3.93 -0.03 0.00 -1.09 0.30 -0.06 121.20 123.68 2k03 s ILE 51 Ca 0.28 -0.62 -0.30 0.00 -2.23 0.00 0.00 60.65 57.78 2k03 s ILE 51 Cb -0.18 -2.71 -0.06 0.00 -1.58 0.00 0.00 42.46 37.93 2k03 s ILE 51 CO 0.16 0.43 1.67 -0.62 -1.23 0.00 0.00 174.94 175.35 2k03 s ASP 52 N -1.37 6.65 0.00 3.58 2.15 -0.30 -2.71 116.67 124.66 2k03 s ASP 52 Ca 0.17 2.30 0.13 0.00 0.43 0.00 0.00 52.55 55.58 2k03 s ASP 52 Cb -0.11 -2.54 0.72 0.00 -0.30 0.00 0.00 42.92 40.69 2k03 s ASP 52 CO 0.08 -0.92 1.22 -0.81 -0.17 0.00 0.00 175.17 174.56 2k03 n PRO 53 N 6.91 0.33 -0.00 4.34 -0.04 -1.26 -0.80 135.00 144.48 2k03 n PRO 53 Ca 0.17 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 2k03 n PRO 53 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 2k03 n PRO 53 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2k03 n LYS 54 N -1.08 1.72 -1.36 0.54 2.85 -1.26 -4.67 118.16 114.89 2k03 n LYS 54 Ca 0.08 -1.20 -0.34 0.00 -1.05 0.00 0.00 58.31 55.80 2k03 n LYS 54 Cb 0.06 -1.01 0.10 0.00 -0.65 0.00 0.00 35.03 33.53 2k03 n LYS 54 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 2k03 s LEU 55 N -0.69 3.29 0.12 -5.58 0.20 0.02 -4.72 118.68 111.33 2k03 s LEU 55 Ca 0.01 2.41 -0.28 0.00 0.69 0.00 0.00 54.13 56.96 2k03 s LEU 55 Cb 0.00 -4.59 -0.08 0.00 -0.43 0.00 0.00 46.19 41.09 2k03 s LEU 55 CO 0.01 -2.37 1.46 0.50 -0.29 0.00 0.00 176.35 175.65 2k03 h LYS 56 N -0.38 -0.24 0.00 1.98 3.64 -1.91 0.29 116.57 119.94 2k03 h LYS 56 Ca -0.48 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 58.88 2k03 h LYS 56 Cb 1.30 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.17 2k03 h LYS 56 CO 0.49 -0.16 -0.18 0.11 -2.27 0.00 0.00 179.45 177.44 2k03 h TRP 57 N -0.25 0.00 -0.17 1.91 5.08 -1.94 -1.63 115.95 118.95 2k03 h TRP 57 Ca 0.08 0.00 -0.14 0.00 1.08 0.00 0.00 58.89 59.92 2k03 h TRP 57 Cb 0.46 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.62 2k03 h TRP 57 CO -0.79 0.18 -0.43 0.82 -1.28 0.00 0.00 178.44 176.94 2k03 h ILE 58 N 0.00 1.34 -0.26 0.12 1.08 -1.51 -2.54 117.51 115.74 2k03 h ILE 58 Ca -0.00 -1.68 0.06 0.00 -0.39 0.00 0.00 64.86 62.85 2k03 h ILE 58 Cb 0.47 1.95 -0.07 0.00 -3.07 0.00 0.00 36.82 36.10 2k03 h ILE 58 CO 0.02 0.52 -0.21 1.56 -0.69 0.00 0.00 178.15 179.35 2k03 h GLN 59 N 0.25 -0.19 -0.01 2.37 1.08 0.47 0.19 115.11 119.27 2k03 h GLN 59 Ca -0.00 0.01 -0.10 0.00 -1.45 0.00 0.00 58.65 57.11 2k03 h GLN 59 Cb 1.04 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.50 2k03 h GLN 59 CO 0.09 -0.13 -0.46 1.05 -0.95 0.00 0.00 178.83 178.43 2k03 h GLU 60 N -0.20 0.02 0.19 1.46 -0.00 -1.53 -1.36 114.58 113.17 2k03 h GLU 60 Ca 0.14 -0.01 -0.01 0.00 -0.00 0.00 0.00 59.36 59.48 2k03 h GLU 60 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.17 2k03 h GLU 60 CO -0.38 0.48 -0.09 -0.92 -0.00 0.00 0.00 179.01 178.10 2k03 h TYR 61 N 0.02 -0.24 0.13 2.06 3.20 -0.83 -2.86 116.97 118.45 2k03 h TYR 61 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2k03 h TYR 61 Cb 0.83 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 2k03 h TYR 61 CO 0.00 0.17 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.51 2k03 h LEU 62 N -0.80 -0.27 -0.81 2.82 3.38 -0.63 -1.58 115.31 117.43 2k03 h LEU 62 Ca -0.03 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.05 2k03 h LEU 62 Cb 0.52 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.29 2k03 h LEU 62 CO 0.04 -0.16 0.47 -0.33 0.09 0.00 0.00 178.44 178.55 2k03 h GLU 63 N -0.24 0.79 -0.01 1.13 5.08 -1.35 0.11 114.58 120.09 2k03 h GLU 63 Ca -0.00 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 2k03 h GLU 63 Cb 0.22 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2k03 h GLU 63 CO -0.01 0.52 -0.69 1.57 -1.00 0.00 0.00 179.01 179.40 2k03 h LYS 64 N 0.81 0.06 -0.80 2.33 2.10 -1.44 -3.00 116.57 116.64 2k03 h LYS 64 Ca 0.38 -0.05 -0.03 0.00 -2.00 0.00 0.00 60.65 58.94 2k03 h LYS 64 Cb 0.30 0.01 -0.04 0.00 -0.90 0.00 0.00 32.23 31.60 2k03 h LYS 64 CO -0.22 0.73 0.37 0.00 -2.00 0.00 0.00 179.45 178.33 2k03 h LEU 66 N 1.14 -0.30 0.00 0.00 7.12 -0.69 -3.41 115.31 119.18 2k03 h LEU 66 Ca 0.27 0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.34 2k03 h LEU 66 Cb 0.13 0.15 0.00 0.00 -0.53 0.00 0.00 40.66 40.41 2k03 h LEU 66 CO -0.03 -0.13 -0.08 -3.20 -0.13 0.00 0.00 178.44 174.86 2k03 n ASN 67 N -5.23 0.28 0.00 1.25 2.85 -1.17 -5.12 115.26 108.12 2k03 n ASN 67 Ca -0.04 0.04 0.15 0.00 -0.11 0.00 0.00 54.58 54.62 2k03 n ASN 67 Cb 0.16 -0.27 0.90 0.00 1.24 0.00 0.00 39.78 41.80 2k03 n ASN 67 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44