#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k04 s PRO 2 N 0.00 2.39 0.11 1.97 0.02 -1.26 -4.90 135.00 133.33 2k04 s PRO 2 Ca 0.00 0.27 0.04 0.00 0.02 0.00 0.00 61.00 61.33 2k04 s PRO 2 Cb 0.00 -4.77 -0.04 0.00 0.02 0.00 0.00 34.50 29.72 2k04 s PRO 2 CO 0.00 -3.33 -0.10 0.14 -0.33 0.00 0.00 177.00 173.38 2k04 s VAL 3 N 10.69 1.02 0.21 3.83 -7.23 -1.26 -5.16 120.40 122.50 2k04 s VAL 3 Ca 0.75 -1.77 0.09 0.00 -1.81 0.00 0.00 61.98 59.24 2k04 s VAL 3 Cb -0.10 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.27 2k04 s VAL 3 CO 0.10 -0.61 -0.17 -0.55 -0.31 0.00 0.00 175.10 173.56 2k04 s SER 4 N -2.67 2.81 -0.24 4.85 0.15 -1.26 -5.13 113.70 112.21 2k04 s SER 4 Ca 0.09 -0.97 -0.00 0.00 0.70 0.00 0.00 55.95 55.77 2k04 s SER 4 Cb -0.01 -0.17 0.07 0.00 -1.71 0.00 0.00 66.02 64.19 2k04 s SER 4 CO 0.00 -0.08 -0.00 -0.76 1.20 0.00 0.00 173.24 173.59 2k04 s LEU 5 N -3.13 2.24 0.08 3.45 1.02 -1.26 -5.10 118.68 115.98 2k04 s LEU 5 Ca 0.22 -1.18 -0.26 0.00 0.02 0.00 0.00 54.13 52.92 2k04 s LEU 5 Cb -0.03 -1.00 0.09 0.00 0.02 0.00 0.00 46.19 45.27 2k04 s LEU 5 CO 0.08 -0.28 1.15 -0.94 0.02 0.00 0.00 176.35 176.38 2k04 s SER 6 N 1.53 -0.03 -1.22 2.29 1.04 -1.26 -5.06 113.70 110.98 2k04 s SER 6 Ca -0.02 -0.38 -0.14 0.00 0.48 0.00 0.00 55.95 55.89 2k04 s SER 6 Cb -0.18 0.32 0.17 0.00 0.10 0.00 0.00 66.02 66.43 2k04 s SER 6 CO -0.09 -0.63 1.49 -1.22 0.98 0.00 0.00 173.24 173.76 2k04 n TYR 7 N -0.68 4.83 -4.16 5.02 4.02 -1.26 -4.88 117.16 120.05 2k04 n TYR 7 Ca -0.03 -3.30 -0.10 0.00 -0.01 0.00 0.00 57.90 54.46 2k04 n TYR 7 Cb 0.60 -2.20 -0.10 0.00 -0.02 0.00 0.00 39.34 37.62 2k04 n TYR 7 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 2k04 s ARG 8 N 1.64 0.92 0.22 -0.72 3.52 -1.26 -5.00 118.95 118.27 2k04 s ARG 8 Ca 0.43 -1.43 -0.05 0.00 -0.13 0.00 0.00 55.73 54.56 2k04 s ARG 8 Cb -0.02 0.11 -0.05 0.00 -1.56 0.00 0.00 34.95 33.43 2k04 s ARG 8 CO 0.01 -0.20 0.47 0.00 -0.81 0.00 0.00 175.30 174.76 2k04 h PRO 10 N 2.20 0.00 -4.71 0.00 0.14 -1.96 -3.45 132.00 124.22 2k04 h PRO 10 Ca -0.47 0.00 -0.70 0.00 0.14 0.00 0.00 66.00 64.97 2k04 h PRO 10 Cb 1.18 0.00 -0.19 0.00 0.14 0.00 0.00 31.00 32.13 2k04 h PRO 10 CO 0.69 0.00 -0.35 0.00 0.14 0.00 0.00 178.00 178.48 2k04 h ARG 12 N 8.61 0.11 -3.83 0.00 2.43 -2.01 -3.42 114.38 116.27 2k04 h ARG 12 Ca -0.28 -0.14 -0.36 0.00 -0.81 0.00 0.00 59.98 58.39 2k04 h ARG 12 Cb 1.13 0.05 -0.34 0.00 -0.42 0.00 0.00 29.97 30.39 2k04 h ARG 12 CO 0.73 0.98 -0.75 -0.06 -1.51 0.00 0.00 179.97 179.35 2k04 s PHE 13 N -2.96 0.45 -0.09 2.20 0.08 -1.26 -5.14 117.98 111.26 2k04 s PHE 13 Ca -0.01 -0.07 0.04 0.00 0.12 0.00 0.00 56.93 57.01 2k04 s PHE 13 Cb 0.10 -0.48 -0.01 0.00 -0.57 0.00 0.00 43.02 42.06 2k04 s PHE 13 CO 0.83 -0.14 -0.23 -0.59 -0.10 0.00 0.00 175.22 174.98 2k04 s PHE 14 N 0.94 2.54 -0.16 0.36 -0.71 -1.26 -3.40 117.98 116.29 2k04 s PHE 14 Ca -0.10 -0.90 -0.07 0.00 -1.04 0.00 0.00 56.93 54.82 2k04 s PHE 14 Cb -0.14 -1.68 -0.04 0.00 -1.21 0.00 0.00 43.02 39.95 2k04 s PHE 14 CO -0.01 -0.33 0.07 -1.21 -1.34 0.00 0.00 175.22 172.41 2k04 s GLU 15 N 0.16 3.78 0.00 1.99 0.41 0.23 -4.88 118.70 120.38 2k04 s GLU 15 Ca -0.13 -0.30 0.00 0.00 -0.41 0.00 0.00 54.97 54.13 2k04 s GLU 15 Cb -0.16 -3.17 0.00 0.00 -1.78 0.00 0.00 34.13 29.01 2k04 s GLU 15 CO 0.07 0.42 0.00 0.45 -0.49 0.00 0.00 175.26 175.71 2k04 n SER 16 N 3.08 0.00 -4.10 -0.19 2.88 -1.26 -1.53 113.62 112.50 2k04 n SER 16 Ca -0.17 0.01 -0.42 0.00 -1.33 0.00 0.00 58.87 56.96 2k04 n SER 16 Cb 0.53 -0.05 -0.00 0.00 -0.75 0.00 0.00 64.21 63.93 2k04 n SER 16 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2k04 n HIS 17 N -1.39 3.91 -3.72 0.66 8.25 -1.26 -4.79 115.22 116.88 2k04 n HIS 17 Ca 0.00 -2.83 -0.27 0.00 -0.26 0.00 0.00 57.72 54.36 2k04 n HIS 17 Cb 0.00 -2.56 -0.03 0.00 1.12 0.00 0.00 29.99 28.52 2k04 n HIS 17 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2k04 s VAL 18 N 3.94 5.22 -0.29 1.59 0.11 -1.26 -5.08 120.40 124.64 2k04 s VAL 18 Ca 0.51 -0.41 -0.11 0.00 -2.93 0.00 0.00 61.98 59.04 2k04 s VAL 18 Cb 0.09 -3.74 -0.05 0.00 -1.53 0.00 0.00 36.38 31.16 2k04 s VAL 18 CO -0.00 -0.17 0.20 0.00 -3.33 0.00 0.00 175.10 171.80 2k04 s ALA 19 N -1.86 3.53 -0.35 1.54 0.00 -1.26 -4.95 121.76 118.41 2k04 s ALA 19 Ca 0.38 -1.11 0.24 0.00 0.00 0.00 0.00 51.96 51.47 2k04 s ALA 19 Cb -0.11 -2.51 1.08 0.00 0.00 0.00 0.00 23.12 21.59 2k04 s ALA 19 CO 0.29 -0.59 1.71 2.89 0.00 0.00 0.00 175.76 180.06 2k04 n ARG 20 N 5.07 0.19 0.02 0.00 -4.01 -1.26 -1.65 116.66 115.01 2k04 n ARG 20 Ca -0.14 0.51 0.07 0.00 -1.04 0.00 0.00 57.85 57.25 2k04 n ARG 20 Cb 0.52 -1.93 0.31 0.00 -3.04 0.00 0.00 32.46 28.32 2k04 n ARG 20 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2k04 n ALA 21 N -1.79 1.62 0.82 2.89 0.00 -1.26 -2.61 120.51 120.18 2k04 n ALA 21 Ca 0.01 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.51 2k04 n ALA 21 Cb 0.16 -1.24 -0.00 0.00 0.00 0.00 0.00 19.45 18.37 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 -1.59 1.81 -4.70 0.00 5.15 -0.66 -4.95 115.26 110.33 2k04 n ASN 22 Ca 0.03 -1.41 -0.32 0.00 -0.60 0.00 0.00 54.58 52.28 2k04 n ASN 22 Cb 0.16 0.46 -0.08 0.00 -0.53 0.00 0.00 39.78 39.79 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 -2.11 4.20 -0.11 3.44 0.11 -1.07 -2.50 120.40 122.36 2k04 s VAL 23 Ca 0.16 -0.65 -0.09 0.00 -2.93 0.00 0.00 61.98 58.46 2k04 s VAL 23 Cb 0.15 -2.90 -0.27 0.00 -1.53 0.00 0.00 36.38 31.83 2k04 s VAL 23 CO 0.46 0.32 0.44 0.11 -3.33 0.00 0.00 175.10 173.11 2k04 h LYS 24 N 4.13 0.29 -2.48 1.54 1.57 -1.00 -3.45 116.57 117.16 2k04 h LYS 24 Ca -0.49 -0.49 0.15 0.00 -1.87 0.00 0.00 60.65 57.95 2k04 h LYS 24 Cb 1.17 0.18 -0.06 0.00 0.08 0.00 0.00 32.23 33.61 2k04 h LYS 24 CO 0.59 1.24 0.49 -3.38 -0.57 0.00 0.00 179.45 177.81 2k04 s HIS 25 N -2.55 -0.05 -0.06 -1.35 -3.43 -1.25 -5.06 115.29 101.54 2k04 s HIS 25 Ca -0.21 -0.33 0.03 0.00 -0.80 0.00 0.00 55.06 53.76 2k04 s HIS 25 Cb 0.06 0.68 -0.02 0.00 -1.43 0.00 0.00 32.58 31.87 2k04 s HIS 25 CO 0.78 -0.94 -0.15 -1.17 -2.00 0.00 0.00 174.74 171.26 2k04 s LEU 26 N -3.10 2.67 -0.22 5.38 2.96 -1.26 -2.97 118.68 122.15 2k04 s LEU 26 Ca 0.15 -0.24 -0.03 0.00 -0.22 0.00 0.00 54.13 53.80 2k04 s LEU 26 Cb -0.02 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 45.13 2k04 s LEU 26 CO 0.04 0.32 -0.07 -0.75 -1.32 0.00 0.00 176.35 174.57 2k04 s LYS 27 N -0.56 3.24 -0.20 1.98 2.47 0.19 -4.97 119.74 121.89 2k04 s LYS 27 Ca 0.08 -0.70 -0.08 0.00 -1.56 0.00 0.00 55.97 53.71 2k04 s LYS 27 Cb -0.11 -2.93 -0.04 0.00 -1.46 0.00 0.00 37.83 33.28 2k04 s LYS 27 CO 0.01 -0.23 0.08 0.42 0.16 0.00 0.00 175.35 175.79 2k04 s ILE 28 N 1.43 4.77 -0.32 5.43 1.01 -1.26 0.38 121.20 132.64 2k04 s ILE 28 Ca 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 60.65 60.68 2k04 s ILE 28 Cb -0.14 -3.17 0.15 0.00 0.01 0.00 0.00 42.46 39.30 2k04 s ILE 28 CO -0.05 0.42 0.37 -0.22 0.00 0.00 0.00 174.94 175.45 2k04 s LEU 29 N 0.72 -0.38 -0.28 2.97 0.20 -0.25 -5.01 118.68 116.66 2k04 s LEU 29 Ca 0.04 -0.94 -0.24 0.00 0.69 0.00 0.00 54.13 53.68 2k04 s LEU 29 Cb -0.13 0.74 -0.00 0.00 -0.43 0.00 0.00 46.19 46.37 2k04 s LEU 29 CO 0.02 -0.33 0.82 0.21 -0.29 0.00 0.00 176.35 176.78 2k04 s ASN 30 N 2.07 6.73 0.03 3.68 2.47 -1.26 -3.85 114.94 124.82 2k04 s ASN 30 Ca 0.12 0.81 -0.13 0.00 0.42 0.00 0.00 52.86 54.09 2k04 s ASN 30 Cb -0.14 -2.42 -0.06 0.00 -1.45 0.00 0.00 41.25 37.18 2k04 s ASN 30 CO -0.21 -0.59 0.40 0.42 -3.72 0.00 0.00 177.10 173.39 2k04 s THR 31 N 2.96 5.07 0.26 -5.21 -4.23 -1.26 -4.98 115.64 108.25 2k04 s THR 31 Ca 0.34 0.67 -0.30 0.00 -1.18 0.00 0.00 61.69 61.22 2k04 s THR 31 Cb -0.14 -3.67 -0.13 0.00 1.34 0.00 0.00 72.50 69.89 2k04 s THR 31 CO 0.11 0.47 1.33 -2.65 -0.54 0.00 0.00 174.62 173.34 2k04 n PRO 32 N 1.48 1.95 -0.98 3.99 -0.02 -1.26 -1.89 135.00 138.26 2k04 n PRO 32 Ca -0.12 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2k04 n PRO 32 Cb 0.52 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2k04 n PRO 32 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2k04 n ASN 33 N 1.74 -3.16 -4.37 2.55 4.05 -1.26 -4.32 115.26 110.49 2k04 n ASN 33 Ca 0.10 0.00 -0.20 0.00 0.45 0.00 0.00 54.58 54.93 2k04 n ASN 33 Cb 0.32 -1.14 -0.10 0.00 1.23 0.00 0.00 39.78 40.09 2k04 n ASN 33 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2k04 s ALA 35 N -2.93 1.29 0.25 0.00 0.00 -1.26 -4.67 121.76 114.43 2k04 s ALA 35 Ca 0.24 -0.56 -0.31 0.00 0.00 0.00 0.00 51.96 51.33 2k04 s ALA 35 Cb -0.01 -3.03 -0.13 0.00 0.00 0.00 0.00 23.12 19.96 2k04 s ALA 35 CO 0.09 -2.71 1.55 0.00 0.00 0.00 0.00 175.76 174.68 2k04 s GLN 37 N -0.06 1.62 -0.03 0.00 2.00 -1.25 -4.63 119.66 117.31 2k04 s GLN 37 Ca 0.69 -0.69 0.05 0.00 -2.00 0.00 0.00 55.36 53.40 2k04 s GLN 37 Cb -0.57 -1.55 -0.01 0.00 0.80 0.00 0.00 33.01 31.68 2k04 s GLN 37 CO 0.45 0.40 -0.19 0.42 -0.50 0.00 0.00 175.29 175.88 2k04 s ILE 38 N -0.41 1.52 -0.10 -2.34 1.01 -1.23 -1.09 121.20 118.56 2k04 s ILE 38 Ca 0.06 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 59.95 2k04 s ILE 38 Cb -0.08 -1.28 0.01 0.00 0.01 0.00 0.00 42.46 41.12 2k04 s ILE 38 CO -0.00 0.43 -0.17 -0.69 0.00 0.00 0.00 174.94 174.51 2k04 s VAL 39 N -0.18 1.59 -0.15 2.92 1.01 0.16 -0.17 120.40 125.59 2k04 s VAL 39 Ca 0.01 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.27 2k04 s VAL 39 Cb -0.10 -1.42 -0.00 0.00 0.00 0.00 0.00 36.38 34.85 2k04 s VAL 39 CO 0.01 0.46 -0.16 0.00 0.00 0.00 0.00 175.10 175.41 2k04 s ALA 40 N 0.75 2.49 -0.21 5.51 0.00 0.25 0.55 121.76 131.09 2k04 s ALA 40 Ca -0.11 -1.03 -0.13 0.00 0.00 0.00 0.00 51.96 50.69 2k04 s ALA 40 Cb -0.16 -1.20 -0.05 0.00 0.00 0.00 0.00 23.12 21.72 2k04 s ALA 40 CO 0.02 0.01 0.27 0.50 0.00 0.00 0.00 175.76 176.56 2k04 s ARG 41 N 0.74 4.15 1.21 0.00 3.52 -1.16 -0.57 118.95 126.84 2k04 s ARG 41 Ca -0.07 -0.03 -0.16 0.00 -0.13 0.00 0.00 55.73 55.35 2k04 s ARG 41 Cb -0.15 -3.51 0.29 0.00 -1.56 0.00 0.00 34.95 30.02 2k04 s ARG 41 CO 0.01 0.08 1.02 -0.51 -0.81 0.00 0.00 175.30 175.09 2k04 s LEU 42 N 0.99 0.46 0.03 -0.88 1.02 -1.25 -0.50 118.68 118.55 2k04 s LEU 42 Ca 0.13 1.20 -0.26 0.00 0.02 0.00 0.00 54.13 55.22 2k04 s LEU 42 Cb -0.14 -3.02 -0.17 0.00 0.02 0.00 0.00 46.19 42.88 2k04 s LEU 42 CO 0.05 -4.31 1.36 0.11 0.02 0.00 0.00 176.35 173.58 2k04 h LYS 43 N -2.70 -0.46 -2.14 1.70 6.56 -1.80 -3.39 116.57 114.33 2k04 h LYS 43 Ca -0.56 0.03 0.28 0.00 -1.06 0.00 0.00 60.65 59.35 2k04 h LYS 43 Cb 1.33 0.11 -0.07 0.00 -0.57 0.00 0.00 32.23 33.03 2k04 h LYS 43 CO 0.46 -0.18 0.79 1.21 -2.06 0.00 0.00 179.45 179.67 2k04 s ASN 44 N -4.95 -0.01 0.00 0.86 2.47 -1.26 -5.01 114.94 107.04 2k04 s ASN 44 Ca -0.15 -0.33 0.00 0.00 0.42 0.00 0.00 52.86 52.80 2k04 s ASN 44 Cb 0.03 0.26 0.00 0.00 -1.45 0.00 0.00 41.25 40.09 2k04 s ASN 44 CO 0.57 -0.51 0.00 -3.20 -3.72 0.00 0.00 177.10 170.24 2k04 n ASN 45 N -1.00 0.00 0.00 -4.21 2.85 -1.26 -4.70 115.26 106.94 2k04 n ASN 45 Ca -0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2k04 n ASN 45 Cb 0.60 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.62 2k04 n ASN 45 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2k04 n ASN 46 N 3.49 0.00 -2.52 1.20 5.15 -1.26 -5.12 115.26 116.21 2k04 n ASN 46 Ca 0.00 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.97 2k04 n ASN 46 Cb 0.00 0.00 0.01 0.00 -0.53 0.00 0.00 39.78 39.26 2k04 n ASN 46 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 2k04 n ARG 47 N 0.00 0.34 -3.71 1.20 -4.01 -1.26 -5.14 116.66 104.08 2k04 n ARG 47 Ca 0.00 -0.83 -0.36 0.00 -1.04 0.00 0.00 57.85 55.61 2k04 n ARG 47 Cb 0.00 1.16 -0.07 0.00 -3.04 0.00 0.00 32.46 30.51 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 -2.03 3.91 0.20 2.89 0.00 -1.26 -3.80 119.66 119.57 2k04 s GLN 48 Ca 0.15 -0.05 0.08 0.00 -0.00 0.00 0.00 55.36 55.54 2k04 s GLN 48 Cb -0.01 -3.32 -0.04 0.00 0.00 0.00 0.00 33.01 29.64 2k04 s GLN 48 CO 0.03 0.50 0.02 0.14 0.00 0.00 0.00 175.29 175.97 2k04 s VAL 49 N -0.26 3.74 0.12 3.63 -7.23 0.26 -4.95 120.40 115.71 2k04 s VAL 49 Ca 0.14 -1.53 0.03 0.00 -1.81 0.00 0.00 61.98 58.81 2k04 s VAL 49 Cb -0.12 -2.92 -0.04 0.00 0.56 0.00 0.00 36.38 33.86 2k04 s VAL 49 CO 0.03 -0.19 0.16 0.00 -0.31 0.00 0.00 175.10 174.79 2k04 s ILE 51 N -1.60 2.03 -0.07 0.00 -1.09 0.76 0.74 121.20 121.99 2k04 s ILE 51 Ca 0.32 -1.32 -0.30 0.00 -2.23 0.00 0.00 60.65 57.12 2k04 s ILE 51 Cb -0.11 -1.74 -0.03 0.00 -1.58 0.00 0.00 42.46 39.00 2k04 s ILE 51 CO 0.25 0.36 1.21 -0.62 -1.23 0.00 0.00 174.94 174.90 2k04 s ASP 52 N -1.16 7.04 0.00 3.58 -1.08 -0.58 -3.57 116.67 120.90 2k04 s ASP 52 Ca 0.11 1.81 0.10 0.00 -0.52 0.00 0.00 52.55 54.04 2k04 s ASP 52 Cb -0.10 -2.56 0.59 0.00 -1.46 0.00 0.00 42.92 39.40 2k04 s ASP 52 CO 0.02 -0.60 1.05 -0.81 0.52 0.00 0.00 175.17 175.34 2k04 n PRO 53 N 5.33 0.54 -0.08 4.34 -0.04 -1.26 -2.57 135.00 141.26 2k04 n PRO 53 Ca 0.11 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.60 2k04 n PRO 53 Cb 0.46 -1.29 0.07 0.00 -0.04 0.00 0.00 33.50 32.70 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 -0.79 2.88 -1.92 0.54 5.02 -1.26 -4.59 118.16 118.04 2k04 n LYS 54 Ca 0.07 -1.79 -0.37 0.00 -2.02 0.00 0.00 58.31 54.21 2k04 n LYS 54 Cb 0.03 -1.14 0.04 0.00 -0.02 0.00 0.00 35.03 33.94 2k04 n LYS 54 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2k04 s LEU 55 N -1.13 3.67 0.18 -0.35 1.43 -1.06 -4.77 118.68 116.65 2k04 s LEU 55 Ca 0.11 2.49 -0.13 0.00 -1.03 0.00 0.00 54.13 55.57 2k04 s LEU 55 Cb 0.07 -4.56 0.15 0.00 0.03 0.00 0.00 46.19 41.88 2k04 s LEU 55 CO 0.06 -1.69 1.75 0.50 0.23 0.00 0.00 176.35 177.20 2k04 h LYS 56 N 0.89 0.32 0.00 1.70 1.63 -1.95 0.52 116.57 119.68 2k04 h LYS 56 Ca -0.51 -0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 59.18 2k04 h LYS 56 Cb 1.31 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.85 2k04 h LYS 56 CO 0.55 0.21 -0.45 0.11 -3.45 0.00 0.00 179.45 176.42 2k04 h TRP 57 N 0.33 0.00 -0.17 1.91 5.08 -1.98 -1.86 115.95 119.26 2k04 h TRP 57 Ca 0.23 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 60.01 2k04 h TRP 57 Cb 0.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.40 2k04 h TRP 57 CO -0.16 0.45 -0.66 0.82 -1.28 0.00 0.00 178.44 177.60 2k04 h ILE 58 N 0.00 1.31 0.03 0.12 1.08 -1.57 -0.69 117.51 117.79 2k04 h ILE 58 Ca -0.00 -1.92 0.01 0.00 -0.39 0.00 0.00 64.86 62.55 2k04 h ILE 58 Cb 0.84 1.89 -0.01 0.00 -3.07 0.00 0.00 36.82 36.46 2k04 h ILE 58 CO 0.06 0.60 -0.07 1.56 -0.69 0.00 0.00 178.15 179.61 2k04 h GLN 59 N 0.47 -0.13 -0.78 2.37 1.08 0.34 0.19 115.11 118.65 2k04 h GLN 59 Ca -0.02 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2k04 h GLN 59 Cb 1.25 0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 28.68 2k04 h GLN 59 CO 0.13 -0.09 0.47 0.93 -0.95 0.00 0.00 178.83 179.32 2k04 h GLU 60 N -0.14 1.06 0.36 1.46 4.39 -1.34 0.28 114.58 120.64 2k04 h GLU 60 Ca 0.02 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 2k04 h GLU 60 Cb 0.16 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 2k04 h GLU 60 CO -0.05 0.75 -0.17 -0.92 -1.16 0.00 0.00 179.01 177.45 2k04 h TYR 61 N 1.07 -0.45 -0.23 4.33 5.03 -0.47 0.29 116.97 126.55 2k04 h TYR 61 Ca 0.28 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.58 2k04 h TYR 61 Cb -0.04 0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.38 2k04 h TYR 61 CO -0.01 -0.26 0.13 -0.07 -1.32 0.00 0.00 178.16 176.63 2k04 h LEU 62 N -0.51 0.28 -1.17 2.82 3.38 -0.42 0.02 115.31 119.71 2k04 h LEU 62 Ca -0.05 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 2k04 h LEU 62 Cb 0.39 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2k04 h LEU 62 CO 0.08 0.26 -0.26 -0.33 0.09 0.00 0.00 178.44 178.29 2k04 h GLU 63 N 0.27 0.25 0.00 1.13 5.08 -0.27 -3.17 114.58 117.88 2k04 h GLU 63 Ca 0.08 -0.08 -0.24 0.00 -1.00 0.00 0.00 59.36 58.11 2k04 h GLU 63 Cb 0.04 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2k04 h GLU 63 CO -0.01 0.50 -1.69 1.63 -1.00 0.00 0.00 179.01 178.43 2k04 n LYS 64 N -4.16 0.64 0.00 2.33 4.76 0.10 -4.20 118.16 117.63 2k04 n LYS 64 Ca -0.01 0.21 0.05 0.00 -2.87 0.00 0.00 58.31 55.69 2k04 n LYS 64 Cb 0.37 -1.76 0.26 0.00 -1.84 0.00 0.00 35.03 32.06 2k04 n LYS 64 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k04 h LEU 66 N 0.00 0.73 0.00 0.00 -0.00 -1.73 -3.39 115.31 110.91 2k04 h LEU 66 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 2k04 h LEU 66 Cb 0.02 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 40.55 2k04 h LEU 66 CO 0.00 0.47 -0.57 0.59 -0.00 0.00 0.00 178.44 178.93 2k04 n ASN 67 N -4.68 2.62 0.00 -0.43 3.02 -1.10 -5.22 115.26 109.47 2k04 n ASN 67 Ca 0.10 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.74 2k04 n ASN 67 Cb 0.16 0.17 0.51 0.00 -0.61 0.00 0.00 39.78 40.01 2k04 n ASN 67 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93