#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k04 n PRO 2 N 0.00 2.51 -2.48 1.97 -0.04 -1.26 -4.91 135.00 130.80 2k04 n PRO 2 Ca 0.00 -2.99 -0.01 0.00 -0.04 0.00 0.00 63.50 60.46 2k04 n PRO 2 Cb 0.00 -2.17 -0.01 0.00 -0.04 0.00 0.00 33.50 31.28 2k04 n PRO 2 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2k04 n VAL 3 N -0.75-10.47 -3.61 0.52 0.31 -1.26 -5.07 118.33 98.00 2k04 n VAL 3 Ca 0.58 1.67 -0.10 0.00 -0.01 0.00 0.00 64.34 66.48 2k04 n VAL 3 Cb 0.73 -6.36 -0.10 0.00 -0.91 0.00 0.00 33.84 27.21 2k04 n VAL 3 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2k04 s SER 4 N -1.20 -0.01 -0.40 4.52 0.01 -1.26 -5.07 113.70 110.29 2k04 s SER 4 Ca -0.04 0.77 0.02 0.00 1.31 0.00 0.00 55.95 58.00 2k04 s SER 4 Cb 0.00 1.15 0.19 0.00 0.21 0.00 0.00 66.02 67.57 2k04 s SER 4 CO 0.65 -0.25 0.81 -0.22 0.41 0.00 0.00 173.24 174.64 2k04 s LEU 5 N 2.55 -1.08 0.29 2.44 2.96 -1.26 -5.15 118.68 119.43 2k04 s LEU 5 Ca 0.01 -0.76 -0.19 0.00 -0.22 0.00 0.00 54.13 52.98 2k04 s LEU 5 Cb -0.13 1.39 0.07 0.00 0.50 0.00 0.00 46.19 48.02 2k04 s LEU 5 CO -0.12 -0.10 0.91 -0.94 -1.32 0.00 0.00 176.35 174.79 2k04 s SER 6 N 1.60 0.01 -1.07 3.68 1.04 -1.26 -5.07 113.70 112.64 2k04 s SER 6 Ca 0.19 -0.92 -0.21 0.00 0.48 0.00 0.00 55.95 55.49 2k04 s SER 6 Cb 0.00 0.68 0.07 0.00 0.10 0.00 0.00 66.02 66.88 2k04 s SER 6 CO -0.09 -1.35 1.45 -0.31 0.98 0.00 0.00 173.24 173.92 2k04 s TYR 7 N -2.22 2.72 0.05 5.02 2.02 -1.26 -4.92 117.35 118.77 2k04 s TYR 7 Ca 0.19 -1.14 0.01 0.00 -0.37 0.00 0.00 57.07 55.76 2k04 s TYR 7 Cb -0.04 -4.62 -0.03 0.00 -0.40 0.00 0.00 41.96 36.87 2k04 s TYR 7 CO 0.08 -1.81 -0.05 0.50 -1.57 0.00 0.00 175.55 172.70 2k04 s ARG 8 N 4.29 0.53 -0.12 -0.62 3.52 -1.26 -4.96 118.95 120.34 2k04 s ARG 8 Ca 0.45 -0.90 -0.10 0.00 -0.13 0.00 0.00 55.73 55.05 2k04 s ARG 8 Cb -0.00 -0.07 -0.05 0.00 -1.56 0.00 0.00 34.95 33.28 2k04 s ARG 8 CO -0.06 -0.02 0.21 0.00 -0.81 0.00 0.00 175.30 174.62 2k04 h PRO 10 N 5.47 0.85 -4.84 0.00 0.13 -2.00 -3.37 132.00 128.25 2k04 h PRO 10 Ca -0.50 -0.05 -0.67 0.00 -0.87 0.00 0.00 66.00 63.91 2k04 h PRO 10 Cb 1.20 -0.19 -0.18 0.00 0.13 0.00 0.00 31.00 31.96 2k04 h PRO 10 CO 0.64 0.57 -0.40 0.00 -0.23 0.00 0.00 178.00 178.58 2k04 h ARG 12 N 8.46 0.50 -4.56 0.00 2.43 -2.03 -3.45 114.38 115.74 2k04 h ARG 12 Ca -0.31 -0.65 -0.21 0.00 -0.81 0.00 0.00 59.98 58.01 2k04 h ARG 12 Cb 1.15 0.21 -0.15 0.00 -0.42 0.00 0.00 29.97 30.76 2k04 h ARG 12 CO 0.65 1.27 -0.69 -0.06 -1.51 0.00 0.00 179.97 179.63 2k04 s PHE 13 N -3.04 0.85 0.07 2.20 0.08 -1.26 -5.12 117.98 111.76 2k04 s PHE 13 Ca -0.07 -0.99 0.04 0.00 0.12 0.00 0.00 56.93 56.03 2k04 s PHE 13 Cb 0.07 -0.51 -0.03 0.00 -0.57 0.00 0.00 43.02 41.98 2k04 s PHE 13 CO 0.90 -0.23 -0.12 -0.59 -0.10 0.00 0.00 175.22 175.08 2k04 s PHE 14 N -3.72 1.09 0.07 0.36 -0.12 -1.26 -4.91 117.98 109.49 2k04 s PHE 14 Ca 0.13 -0.51 -0.30 0.00 -0.05 0.00 0.00 56.93 56.20 2k04 s PHE 14 Cb 0.06 -0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 41.79 2k04 s PHE 14 CO -0.04 0.02 1.09 -1.21 -0.05 0.00 0.00 175.22 175.03 2k04 s GLU 15 N -1.94 4.53 0.32 1.99 8.01 0.18 -4.88 118.70 126.91 2k04 s GLU 15 Ca -0.02 1.62 0.10 0.00 0.01 0.00 0.00 54.97 56.69 2k04 s GLU 15 Cb -0.08 -3.37 -0.06 0.00 -4.31 0.00 0.00 34.13 26.31 2k04 s GLU 15 CO 0.02 -0.08 -0.13 0.45 0.01 0.00 0.00 175.26 175.53 2k04 s SER 16 N 0.68 3.71 -2.06 -0.19 0.15 -1.26 -2.49 113.70 112.24 2k04 s SER 16 Ca 0.54 -1.12 0.00 0.00 0.70 0.00 0.00 55.95 56.07 2k04 s SER 16 Cb -0.26 -0.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.70 2k04 s SER 16 CO 0.30 -0.10 0.00 1.41 1.20 0.00 0.00 173.24 176.05 2k04 n HIS 17 N -0.73 -0.25 -1.75 3.44 8.25 -1.26 -4.93 115.22 117.99 2k04 n HIS 17 Ca -0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.99 2k04 n HIS 17 Cb 0.62 -3.51 -0.01 0.00 1.12 0.00 0.00 29.99 28.20 2k04 n HIS 17 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2k04 n VAL 18 N -2.69 1.13 -1.96 1.59 0.31 -1.26 -4.85 118.33 110.60 2k04 n VAL 18 Ca -0.21 -0.28 -0.42 0.00 -0.01 0.00 0.00 64.34 63.41 2k04 n VAL 18 Cb 0.67 -1.96 -0.03 0.00 -0.91 0.00 0.00 33.84 31.61 2k04 n VAL 18 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k04 s ALA 19 N -0.13 3.64 0.28 3.52 0.00 -1.26 -4.84 121.76 122.97 2k04 s ALA 19 Ca 0.63 1.08 0.36 0.00 0.00 0.00 0.00 51.96 54.03 2k04 s ALA 19 Cb -0.49 -3.72 1.66 0.00 0.00 0.00 0.00 23.12 20.56 2k04 s ALA 19 CO 0.50 -1.26 2.10 -0.09 0.00 0.00 0.00 175.76 177.00 2k04 h ARG 20 N 9.03 0.00 0.00 0.00 1.12 -1.97 -0.84 114.38 121.72 2k04 h ARG 20 Ca -0.41 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.46 2k04 h ARG 20 Cb 1.19 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.15 2k04 h ARG 20 CO 0.94 0.02 -0.18 0.00 -3.11 0.00 0.00 179.97 177.63 2k04 n ALA 21 N -2.11 2.68 0.19 2.80 0.00 -1.26 -3.96 120.51 118.85 2k04 n ALA 21 Ca -0.01 -0.16 0.06 0.00 0.00 0.00 0.00 53.44 53.33 2k04 n ALA 21 Cb 0.24 -1.35 0.11 0.00 0.00 0.00 0.00 19.45 18.44 2k04 n ALA 21 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k04 n ASN 22 N -1.67 2.50 -4.89 0.00 5.15 -0.33 -4.99 115.26 111.03 2k04 n ASN 22 Ca 0.06 -1.74 -0.33 0.00 -0.60 0.00 0.00 54.58 51.97 2k04 n ASN 22 Cb 0.36 -0.12 -0.05 0.00 -0.53 0.00 0.00 39.78 39.44 2k04 n ASN 22 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2k04 s VAL 23 N -1.02 5.18 -0.20 3.44 0.11 -1.20 -0.70 120.40 126.01 2k04 s VAL 23 Ca 0.20 0.15 0.11 0.00 -2.93 0.00 0.00 61.98 59.51 2k04 s VAL 23 Cb 0.12 -3.62 -0.22 0.00 -1.53 0.00 0.00 36.38 31.13 2k04 s VAL 23 CO 0.17 0.17 0.03 0.29 -3.33 0.00 0.00 175.10 172.43 2k04 n LYS 24 N 0.51 0.68 0.00 1.54 5.02 0.08 -4.68 118.16 121.30 2k04 n LYS 24 Ca -0.06 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2k04 n LYS 24 Cb 0.52 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 2k04 n LYS 24 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 2k04 n HIS 25 N -2.98 0.00 -4.31 2.13 1.44 -1.24 -5.05 115.22 105.21 2k04 n HIS 25 Ca -0.36 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.06 2k04 n HIS 25 Cb 1.09 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 31.09 2k04 n HIS 25 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2k04 s LEU 26 N 0.00 2.68 -0.14 2.39 1.02 -1.26 -2.11 118.68 121.27 2k04 s LEU 26 Ca 0.00 -0.59 0.00 0.00 0.02 0.00 0.00 54.13 53.56 2k04 s LEU 26 Cb 0.00 -1.51 0.02 0.00 0.02 0.00 0.00 46.19 44.72 2k04 s LEU 26 CO 0.00 0.17 -0.12 -0.75 0.02 0.00 0.00 176.35 175.67 2k04 s LYS 27 N -2.23 2.02 -0.12 1.70 2.20 0.13 -4.98 119.74 118.47 2k04 s LYS 27 Ca 0.18 -0.45 -0.05 0.00 -0.36 0.00 0.00 55.97 55.29 2k04 s LYS 27 Cb -0.10 -1.92 -0.04 0.00 -1.51 0.00 0.00 37.83 34.26 2k04 s LYS 27 CO 0.10 -0.25 0.08 0.42 -0.36 0.00 0.00 175.35 175.34 2k04 s ILE 28 N 1.57 4.95 -0.08 5.43 1.01 -1.26 -0.38 121.20 132.43 2k04 s ILE 28 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 60.65 60.56 2k04 s ILE 28 Cb -0.13 -3.15 0.03 0.00 0.01 0.00 0.00 42.46 39.22 2k04 s ILE 28 CO -0.10 0.58 0.36 -1.48 0.00 0.00 0.00 174.94 174.30 2k04 s LEU 29 N -0.67 0.63 -0.30 2.97 2.34 0.13 -5.01 118.68 118.77 2k04 s LEU 29 Ca 0.12 0.47 0.03 0.00 0.06 0.00 0.00 54.13 54.81 2k04 s LEU 29 Cb -0.12 1.33 0.08 0.00 -0.56 0.00 0.00 46.19 46.93 2k04 s LEU 29 CO 0.02 -0.29 -0.02 0.20 -1.06 0.00 0.00 176.35 175.21 2k04 s ASN 30 N -0.51 4.59 0.31 1.48 -0.87 -1.26 -0.74 114.94 117.94 2k04 s ASN 30 Ca -0.06 -1.81 -0.19 0.00 -1.57 0.00 0.00 52.86 49.24 2k04 s ASN 30 Cb -0.04 -1.56 -0.09 0.00 -0.02 0.00 0.00 41.25 39.54 2k04 s ASN 30 CO 0.03 -0.30 0.79 0.42 -2.57 0.00 0.00 177.10 175.47 2k04 s THR 31 N 1.02 4.55 -1.38 1.60 -4.23 -1.26 -4.95 115.64 110.99 2k04 s THR 31 Ca 0.02 1.23 0.00 0.00 -1.18 0.00 0.00 61.69 61.77 2k04 s THR 31 Cb -0.19 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 69.92 2k04 s THR 31 CO -0.07 -0.06 0.08 -0.81 -0.54 0.00 0.00 174.62 173.22 2k04 n PRO 32 N 0.01 0.12 -0.23 3.99 -0.04 -1.26 -1.61 135.00 135.97 2k04 n PRO 32 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 2k04 n PRO 32 Cb 0.52 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 2k04 n PRO 32 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2k04 n ASN 33 N 0.08 0.00 -4.22 3.54 4.05 -1.26 -4.98 115.26 112.47 2k04 n ASN 33 Ca 0.00 -1.16 -0.13 0.00 0.45 0.00 0.00 54.58 53.74 2k04 n ASN 33 Cb 0.02 -0.03 -0.10 0.00 1.23 0.00 0.00 39.78 40.90 2k04 n ASN 33 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2k04 n ALA 35 N -0.15 -1.45 -1.69 0.00 0.00 -1.26 -4.57 120.51 111.38 2k04 n ALA 35 Ca -0.10 -0.98 -0.44 0.00 0.00 0.00 0.00 53.44 51.92 2k04 n ALA 35 Cb 0.61 -0.06 -0.04 0.00 0.00 0.00 0.00 19.45 19.97 2k04 n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k04 s GLN 37 N 1.63 2.84 -0.13 0.00 2.00 0.08 -4.67 119.66 121.41 2k04 s GLN 37 Ca 0.79 -0.85 0.01 0.00 -2.00 0.00 0.00 55.36 53.32 2k04 s GLN 37 Cb -0.59 -2.30 0.02 0.00 0.80 0.00 0.00 33.01 30.94 2k04 s GLN 37 CO 0.37 0.31 -0.14 0.42 -0.50 0.00 0.00 175.29 175.75 2k04 s ILE 38 N 0.04 1.48 -0.17 -2.34 1.01 -1.26 -0.69 121.20 119.27 2k04 s ILE 38 Ca -0.09 -0.59 -0.03 0.00 0.00 0.00 0.00 60.65 59.94 2k04 s ILE 38 Cb -0.15 -1.38 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 2k04 s ILE 38 CO 0.06 0.44 -0.06 -0.69 0.00 0.00 0.00 174.94 174.68 2k04 s VAL 39 N 1.33 3.52 -0.09 2.92 1.01 0.49 0.25 120.40 129.83 2k04 s VAL 39 Ca 0.01 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.54 2k04 s VAL 39 Cb -0.14 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 2k04 s VAL 39 CO -0.07 0.48 -0.17 0.00 0.00 0.00 0.00 175.10 175.33 2k04 s ALA 40 N 0.69 2.48 -0.20 5.51 0.00 0.79 0.22 121.76 131.24 2k04 s ALA 40 Ca -0.03 -0.96 -0.11 0.00 0.00 0.00 0.00 51.96 50.85 2k04 s ALA 40 Cb -0.15 -0.98 -0.05 0.00 0.00 0.00 0.00 23.12 21.95 2k04 s ALA 40 CO 0.02 0.38 0.19 0.50 0.00 0.00 0.00 175.76 176.85 2k04 s ARG 41 N -0.06 4.18 0.99 0.00 3.52 -0.90 -0.82 118.95 125.86 2k04 s ARG 41 Ca -0.04 -0.13 -0.12 0.00 -0.13 0.00 0.00 55.73 55.31 2k04 s ARG 41 Cb -0.14 -3.46 0.18 0.00 -1.56 0.00 0.00 34.95 29.97 2k04 s ARG 41 CO 0.04 0.20 1.10 -0.51 -0.81 0.00 0.00 175.30 175.32 2k04 s LEU 42 N 0.62 1.64 0.00 -0.88 1.43 -1.14 -0.75 118.68 119.61 2k04 s LEU 42 Ca 0.11 1.15 -0.00 0.00 -1.03 0.00 0.00 54.13 54.36 2k04 s LEU 42 Cb -0.12 -3.35 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 2k04 s LEU 42 CO 0.02 -3.07 0.90 0.29 0.23 0.00 0.00 176.35 174.72 2k04 n LYS 43 N -4.13 0.45 -0.77 1.70 5.02 0.12 -4.42 118.16 116.13 2k04 n LYS 43 Ca 0.05 -0.01 0.08 0.00 -2.02 0.00 0.00 58.31 56.42 2k04 n LYS 43 Cb 0.58 -1.29 -0.05 0.00 -0.02 0.00 0.00 35.03 34.25 2k04 n LYS 43 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2k04 n ASN 44 N 1.80 -4.16 0.00 4.39 5.15 -1.26 -4.78 115.26 116.39 2k04 n ASN 44 Ca 0.00 0.80 0.00 0.00 -0.60 0.00 0.00 54.58 54.78 2k04 n ASN 44 Cb 0.22 -2.59 0.00 0.00 -0.53 0.00 0.00 39.78 36.88 2k04 n ASN 44 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2k04 n ASN 45 N -3.14 0.00 -4.88 1.20 2.85 -1.26 -4.82 115.26 105.20 2k04 n ASN 45 Ca -0.05 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.13 2k04 n ASN 45 Cb 0.35 0.00 0.09 0.00 1.24 0.00 0.00 39.78 41.46 2k04 n ASN 45 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 2k04 s ASN 46 N 0.00 4.48 0.18 1.20 0.01 -1.26 -5.09 114.94 114.45 2k04 s ASN 46 Ca 0.00 0.84 0.02 0.00 -0.71 0.00 0.00 52.86 53.01 2k04 s ASN 46 Cb 0.00 -1.38 0.02 0.00 0.41 0.00 0.00 41.25 40.30 2k04 s ASN 46 CO 0.00 -1.93 0.14 -2.11 -1.51 0.00 0.00 177.10 171.69 2k04 n ARG 47 N -3.34 1.20 -3.64 -0.60 -4.01 -1.26 -4.79 116.66 100.22 2k04 n ARG 47 Ca 0.08 -1.08 -0.36 0.00 -1.04 0.00 0.00 57.85 55.45 2k04 n ARG 47 Cb 0.60 0.10 -0.07 0.00 -3.04 0.00 0.00 32.46 30.05 2k04 n ARG 47 CO 0.00 0.00 0.00 1.14 -3.04 0.00 0.00 177.63 175.73 2k04 s GLN 48 N -2.73 4.11 0.20 2.89 -2.07 -1.26 -2.88 119.66 117.93 2k04 s GLN 48 Ca 0.11 -0.01 0.08 0.00 -1.82 0.00 0.00 55.36 53.72 2k04 s GLN 48 Cb -0.01 -3.38 -0.04 0.00 -1.09 0.00 0.00 33.01 28.49 2k04 s GLN 48 CO 0.07 0.36 -0.01 0.14 -1.32 0.00 0.00 175.29 174.53 2k04 s VAL 49 N 0.14 3.58 -0.17 3.63 -7.23 0.00 -4.97 120.40 115.39 2k04 s VAL 49 Ca 0.14 -1.61 -0.07 0.00 -1.81 0.00 0.00 61.98 58.64 2k04 s VAL 49 Cb -0.12 -2.83 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 2k04 s VAL 49 CO 0.03 -0.20 0.07 0.00 -0.31 0.00 0.00 175.10 174.69 2k04 s ILE 51 N 0.07 4.21 -0.26 0.00 -1.09 0.14 0.47 121.20 124.74 2k04 s ILE 51 Ca 0.06 -0.79 -0.29 0.00 -2.23 0.00 0.00 60.65 57.40 2k04 s ILE 51 Cb -0.12 -2.97 -0.02 0.00 -1.58 0.00 0.00 42.46 37.77 2k04 s ILE 51 CO 0.01 0.21 1.67 -0.62 -1.23 0.00 0.00 174.94 174.97 2k04 s ASP 52 N -2.07 6.23 0.00 3.58 2.15 -1.04 -4.10 116.67 121.41 2k04 s ASP 52 Ca 0.25 1.50 0.18 0.00 0.43 0.00 0.00 52.55 54.90 2k04 s ASP 52 Cb -0.12 -2.53 1.05 0.00 -0.30 0.00 0.00 42.92 41.02 2k04 s ASP 52 CO 0.16 -1.40 1.45 -0.81 -0.17 0.00 0.00 175.17 174.40 2k04 n PRO 53 N 7.92 0.56 -0.16 4.34 -0.04 -1.26 -1.48 135.00 144.88 2k04 n PRO 53 Ca 0.20 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.74 2k04 n PRO 53 Cb 0.46 -1.49 0.16 0.00 -0.04 0.00 0.00 33.50 32.59 2k04 n PRO 53 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k04 n LYS 54 N -0.99 2.23 -1.68 0.54 5.02 -1.26 -4.56 118.16 117.46 2k04 n LYS 54 Ca 0.13 -1.98 -0.42 0.00 -2.02 0.00 0.00 58.31 54.03 2k04 n LYS 54 Cb 0.06 -1.35 0.01 0.00 -0.02 0.00 0.00 35.03 33.72 2k04 n LYS 54 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2k04 n LEU 55 N 0.93 3.60 0.04 -0.35 4.77 -0.55 -4.71 117.00 120.74 2k04 n LEU 55 Ca 0.14 1.13 0.01 0.00 -0.03 0.00 0.00 56.01 57.26 2k04 n LEU 55 Cb 0.46 -1.47 0.33 0.00 -2.33 0.00 0.00 43.42 40.41 2k04 n LEU 55 CO 0.11 -0.74 0.91 0.50 -1.33 0.00 0.00 177.39 176.84 2k04 h LYS 56 N 2.15 0.42 0.00 3.23 3.64 -1.93 0.29 116.57 124.36 2k04 h LYS 56 Ca -0.46 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 58.77 2k04 h LYS 56 Cb 1.30 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 2k04 h LYS 56 CO 0.60 0.49 -0.24 0.11 -2.27 0.00 0.00 179.45 178.15 2k04 h TRP 57 N 0.40 0.00 -0.05 1.91 5.08 -1.98 0.03 115.95 121.34 2k04 h TRP 57 Ca 0.08 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 59.92 2k04 h TRP 57 Cb 0.36 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.53 2k04 h TRP 57 CO 0.01 0.24 -0.48 0.82 -1.28 0.00 0.00 178.44 177.74 2k04 h ILE 58 N 0.00 1.42 -0.07 0.12 1.08 -1.32 -1.59 117.51 117.15 2k04 h ILE 58 Ca -0.00 -1.91 0.03 0.00 -0.39 0.00 0.00 64.86 62.59 2k04 h ILE 58 Cb 0.50 2.42 -0.03 0.00 -3.07 0.00 0.00 36.82 36.63 2k04 h ILE 58 CO 0.03 0.56 -0.11 1.56 -0.69 0.00 0.00 178.15 179.50 2k04 h GLN 59 N -0.07 -0.15 -0.52 2.37 1.08 0.08 0.11 115.11 118.01 2k04 h GLN 59 Ca -0.05 0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 2k04 h GLN 59 Cb 1.16 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.60 2k04 h GLN 59 CO 0.10 -0.10 0.17 0.93 -0.95 0.00 0.00 178.83 178.97 2k04 h GLU 60 N -0.16 0.80 -0.27 1.46 4.39 -1.11 -1.77 114.58 117.92 2k04 h GLU 60 Ca 0.06 -0.17 0.06 0.00 0.34 0.00 0.00 59.36 59.65 2k04 h GLU 60 Cb 0.24 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.72 2k04 h GLU 60 CO -0.16 0.74 -0.09 -0.92 -1.16 0.00 0.00 179.01 177.41 2k04 h TYR 61 N 0.70 -0.21 -0.13 4.33 5.03 -0.50 0.65 116.97 126.85 2k04 h TYR 61 Ca 0.17 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.53 2k04 h TYR 61 Cb 0.27 0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.65 2k04 h TYR 61 CO 0.01 -0.15 -0.06 -0.07 -1.32 0.00 0.00 178.16 176.57 2k04 h LEU 62 N -0.04 -0.21 -0.44 2.82 3.38 -0.68 -1.44 115.31 118.70 2k04 h LEU 62 Ca 0.13 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 2k04 h LEU 62 Cb 0.24 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2k04 h LEU 62 CO -0.30 -0.09 0.11 -0.33 0.09 0.00 0.00 178.44 177.93 2k04 h GLU 63 N -0.05 0.71 -0.34 1.13 5.08 -0.39 -3.22 114.58 117.50 2k04 h GLU 63 Ca 0.07 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 2k04 h GLU 63 Cb 0.16 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2k04 h GLU 63 CO -0.17 0.71 -0.11 0.87 -1.00 0.00 0.00 179.01 179.31 2k04 h LYS 64 N 0.58 0.68 -0.72 2.33 1.79 0.42 -3.20 116.57 118.44 2k04 h LYS 64 Ca 0.14 -0.27 0.12 0.00 -2.18 0.00 0.00 60.65 58.45 2k04 h LYS 64 Cb 0.32 -0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 30.85 2k04 h LYS 64 CO 0.00 0.86 0.32 0.00 -1.08 0.00 0.00 179.45 179.55 2k04 h LEU 66 N 0.51 0.00 0.00 0.00 8.10 -1.59 -3.38 115.31 118.95 2k04 h LEU 66 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.37 2k04 h LEU 66 Cb 0.49 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.71 2k04 h LEU 66 CO -0.34 0.74 0.00 -3.20 -4.11 0.00 0.00 178.44 171.53 2k04 n ASN 67 N -3.47 0.00 0.00 0.17 2.85 -0.81 -5.17 115.26 108.83 2k04 n ASN 67 Ca 0.00 0.29 0.00 0.00 -0.11 0.00 0.00 54.58 54.76 2k04 n ASN 67 Cb 0.77 -0.50 0.00 0.00 1.24 0.00 0.00 39.78 41.29 2k04 n ASN 67 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44