#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 1.38 -2.16 1.97 -0.04 -1.26 -4.90 135.00 129.99 2k04 n PRO 2 Ca 0.00 0.49 -0.42 0.00 -0.04 0.00 0.00 63.50 63.53 2k04 n PRO 2 Cb 0.00 -2.13 -0.03 0.00 -0.04 0.00 0.00 33.50 31.30 2k04 n PRO 2 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k04 s VAL 3 N 0.40 3.57 0.29 0.52 0.11 -1.26 -5.01 120.40 119.03 2k04 s VAL 3 Ca 0.80 0.96 -0.01 0.00 -2.93 0.00 0.00 61.98 60.80 2k04 s VAL 3 Cb -0.87 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 30.32 2k04 s VAL 3 CO 0.46 -0.01 0.51 -0.44 -3.33 0.00 0.00 175.10 172.29 2k04 s SER 4 N 2.05 6.36 0.00 3.54 0.01 -1.26 -4.22 113.70 120.18 2k04 s SER 4 Ca 0.66 0.52 0.00 0.00 1.31 0.00 0.00 55.95 58.44 2k04 s SER 4 Cb -0.33 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 63.84 2k04 s SER 4 CO 0.28 -0.20 0.00 -0.11 0.41 0.00 0.00 173.24 173.62 2k04 n LEU 5 N -1.23 0.15 -4.10 2.44 7.94 -1.26 -4.99 117.00 115.95 2k04 n LEU 5 Ca -0.04 0.00 -0.19 0.00 -1.11 0.00 0.00 56.01 54.67 2k04 n LEU 5 Cb 0.55 -0.52 -0.14 0.00 0.53 0.00 0.00 43.42 43.84 2k04 n LEU 5 CO 0.48 -0.11 -0.45 -0.44 -1.11 0.00 0.00 177.39 175.76 2k04 s SER 6 N -2.41 1.44 -0.32 1.96 0.01 -1.26 -5.09 113.70 108.02 2k04 s SER 6 Ca 0.00 -0.36 -0.29 0.00 1.31 0.00 0.00 55.95 56.61 2k04 s SER 6 Cb 0.00 -0.11 -0.01 0.00 0.21 0.00 0.00 66.02 66.11 2k04 s SER 6 CO 0.00 0.05 1.62 -0.31 0.41 0.00 0.00 173.24 175.01 2k04 s TYR 7 N -0.66 2.10 -0.35 2.43 1.51 -1.26 -4.79 117.35 116.32 2k04 s TYR 7 Ca 0.02 0.62 -0.07 0.00 -1.01 0.00 0.00 57.07 56.63 2k04 s TYR 7 Cb -0.07 -4.12 0.04 0.00 -0.11 0.00 0.00 41.96 37.70 2k04 s TYR 7 CO 0.01 -2.63 0.12 1.03 -1.11 0.00 0.00 175.55 172.97 2k04 s ARG 8 N 5.10 2.62 0.06 -0.62 0.52 -1.26 -5.00 118.95 120.37 2k04 s ARG 8 Ca 0.71 -1.20 0.09 0.00 -0.52 0.00 0.00 55.73 54.81 2k04 s ARG 8 Cb -0.21 -3.50 -0.03 0.00 0.52 0.00 0.00 34.95 31.73 2k04 s ARG 8 CO 0.32 -0.69 -0.26 0.00 0.02 0.00 0.00 175.30 174.68 2k04 h PRO 10 N 4.55 0.49 0.00 0.00 0.10 -1.99 -3.44 132.00 131.71 2k04 h PRO 10 Ca -0.48 -0.03 -0.42 0.00 0.10 0.00 0.00 66.00 65.17 2k04 h PRO 10 Cb 1.15 -0.11 0.04 0.00 0.10 0.00 0.00 31.00 32.18 2k04 h PRO 10 CO 0.43 0.32 -0.02 0.00 0.10 0.00 0.00 178.00 178.83 2k04 n ARG 12 N -2.24 0.89 -4.13 0.00 0.00 -1.26 -5.02 116.66 104.88 2k04 n ARG 12 Ca 0.14 -0.08 -0.09 0.00 -0.00 0.00 0.00 57.85 57.82 2k04 n ARG 12 Cb 0.52 -1.22 -0.10 0.00 -0.00 0.00 0.00 32.46 31.66 2k04 n ARG 12 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 2k04 s PHE 13 N -2.65 0.72 -0.05 2.89 -0.12 -1.26 -5.14 117.98 112.36 2k04 s PHE 13 Ca -0.03 -1.01 0.00 0.00 -0.05 0.00 0.00 56.93 55.85 2k04 s PHE 13 Cb 0.07 -0.46 0.02 0.00 -0.63 0.00 0.00 43.02 42.03 2k04 s PHE 13 CO 0.47 -0.28 -0.02 -0.59 -0.05 0.00 0.00 175.22 174.74 2k04 s PHE 14 N -3.79 0.65 -0.50 3.49 -0.71 -1.26 -4.43 117.98 111.43 2k04 s PHE 14 Ca 0.10 -0.16 -0.28 0.00 -1.04 0.00 0.00 56.93 55.55 2k04 s PHE 14 Cb 0.07 -0.65 0.03 0.00 -1.21 0.00 0.00 43.02 41.26 2k04 s PHE 14 CO -0.07 -0.21 1.11 -1.21 -1.34 0.00 0.00 175.22 173.50 2k04 s GLU 15 N 1.20 3.63 0.17 1.99 0.41 0.33 -4.83 118.70 121.60 2k04 s GLU 15 Ca -0.07 0.40 0.05 0.00 -0.41 0.00 0.00 54.97 54.94 2k04 s GLU 15 Cb -0.14 -3.94 -0.00 0.00 -1.78 0.00 0.00 34.13 28.27 2k04 s GLU 15 CO -0.02 -1.43 1.39 0.77 -0.49 0.00 0.00 175.26 175.48 2k04 h SER 16 N 9.28 0.13 -3.47 -0.19 0.02 -1.96 -3.19 113.55 114.17 2k04 h SER 16 Ca -0.24 -0.11 -0.62 0.00 -0.84 0.00 0.00 61.79 59.99 2k04 h SER 16 Cb 1.06 -0.04 -0.40 0.00 0.14 0.00 0.00 62.40 63.16 2k04 h SER 16 CO 1.12 0.94 -0.73 -1.00 -1.14 0.00 0.00 176.83 176.02 2k04 s HIS 17 N -3.12 2.55 0.19 3.45 3.76 -1.26 -4.86 115.29 116.01 2k04 s HIS 17 Ca -0.01 -2.37 0.10 0.00 -0.15 0.00 0.00 55.06 52.63 2k04 s HIS 17 Cb 0.10 -2.23 -0.04 0.00 1.11 0.00 0.00 32.58 31.52 2k04 s HIS 17 CO 0.81 -0.88 -0.20 0.54 -0.85 0.00 0.00 174.74 174.16 2k04 s VAL 18 N 1.06 2.10 -0.05 -0.90 0.11 -1.26 -5.11 120.40 116.35 2k04 s VAL 18 Ca 0.12 -2.05 -0.23 0.00 -2.93 0.00 0.00 61.98 56.89 2k04 s VAL 18 Cb -0.19 -2.02 -0.04 0.00 -1.53 0.00 0.00 36.38 32.59 2k04 s VAL 18 CO -0.14 -0.27 0.69 0.00 -3.33 0.00 0.00 175.10 172.05 2k04 s ALA 19 N -2.02 3.36 0.35 1.54 0.00 -1.26 -4.92 121.76 118.81 2k04 s ALA 19 Ca 0.20 0.13 0.11 0.00 0.00 0.00 0.00 51.96 52.39 2k04 s ALA 19 Cb -0.06 -2.92 0.64 0.00 0.00 0.00 0.00 23.12 20.78 2k04 s ALA 19 CO 0.09 -0.05 1.80 -0.09 0.00 0.00 0.00 175.76 177.51 2k04 h ARG 20 N 6.49 0.08 0.00 0.00 2.43 -1.99 -2.07 114.38 119.33 2k04 h ARG 20 Ca -0.42 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2k04 h ARG 20 Cb 1.20 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2k04 h ARG 20 CO 0.74 0.44 0.00 0.00 -1.51 0.00 0.00 179.97 179.65 2k04 n ALA 21 N -2.47 1.28 0.12 2.80 0.00 -1.26 -1.68 120.51 119.30 2k04 n ALA 21 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.44 2k04 n ALA 21 Cb 0.42 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.75 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 -1.61 1.28 -4.80 0.00 5.15 -0.79 -4.95 115.26 109.55 2k04 n ASN 22 Ca 0.01 -1.16 -0.37 0.00 -0.60 0.00 0.00 54.58 52.46 2k04 n ASN 22 Cb 0.08 -0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.26 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 -0.27 5.18 -0.18 3.44 0.11 -0.67 -0.68 120.40 127.32 2k04 s VAL 23 Ca 0.04 0.70 -0.02 0.00 -2.93 0.00 0.00 61.98 59.76 2k04 s VAL 23 Cb 0.02 -3.67 -0.22 0.00 -1.53 0.00 0.00 36.38 30.99 2k04 s VAL 23 CO 0.04 0.50 0.09 1.17 -3.33 0.00 0.00 175.10 173.57 2k04 n LYS 24 N 2.55 0.71 -3.53 1.54 4.81 -0.42 -4.50 118.16 119.32 2k04 n LYS 24 Ca -0.13 0.21 -0.07 0.00 -0.87 0.00 0.00 58.31 57.44 2k04 n LYS 24 Cb 0.52 -1.62 -0.02 0.00 0.02 0.00 0.00 35.03 33.93 2k04 n LYS 24 CO 0.00 0.00 0.00 -3.38 1.17 0.00 0.00 177.40 175.19 2k04 s HIS 25 N -2.54 -0.28 0.05 5.64 -3.43 -1.23 -4.97 115.29 108.53 2k04 s HIS 25 Ca -0.28 0.19 0.08 0.00 -0.80 0.00 0.00 55.06 54.24 2k04 s HIS 25 Cb 0.08 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 31.72 2k04 s HIS 25 CO 0.69 -0.44 -0.19 -0.51 -2.00 0.00 0.00 174.74 172.29 2k04 s LEU 26 N -2.35 2.56 -0.23 5.38 1.02 -1.26 -2.90 118.68 120.89 2k04 s LEU 26 Ca 0.06 -0.46 -0.03 0.00 0.02 0.00 0.00 54.13 53.72 2k04 s LEU 26 Cb -0.01 -1.49 0.01 0.00 0.02 0.00 0.00 46.19 44.72 2k04 s LEU 26 CO -0.07 0.25 -0.06 -0.75 0.02 0.00 0.00 176.35 175.74 2k04 s LYS 27 N -1.47 3.10 -0.12 1.70 2.20 0.13 -4.94 119.74 120.33 2k04 s LYS 27 Ca 0.14 -0.80 -0.04 0.00 -0.36 0.00 0.00 55.97 54.91 2k04 s LYS 27 Cb -0.10 -2.98 -0.03 0.00 -1.51 0.00 0.00 37.83 33.20 2k04 s LYS 27 CO 0.05 -0.30 0.02 0.42 -0.36 0.00 0.00 175.35 175.19 2k04 s ILE 28 N 1.40 4.48 -0.01 5.43 1.01 -1.26 -0.74 121.20 131.51 2k04 s ILE 28 Ca 0.03 -0.17 -0.11 0.00 0.00 0.00 0.00 60.65 60.41 2k04 s ILE 28 Cb -0.15 -2.94 0.01 0.00 0.01 0.00 0.00 42.46 39.39 2k04 s ILE 28 CO -0.04 0.55 0.22 -1.48 0.00 0.00 0.00 174.94 174.19 2k04 s LEU 29 N -0.40 1.23 -0.31 2.97 0.05 -0.56 -4.99 118.68 116.67 2k04 s LEU 29 Ca 0.08 -0.05 0.03 0.00 0.05 0.00 0.00 54.13 54.24 2k04 s LEU 29 Cb -0.12 0.94 0.08 0.00 -2.05 0.00 0.00 46.19 45.04 2k04 s LEU 29 CO 0.02 -0.39 -0.00 0.21 -0.55 0.00 0.00 176.35 175.63 2k04 s ASN 30 N -1.30 4.68 0.57 1.48 2.47 -1.26 -0.88 114.94 120.68 2k04 s ASN 30 Ca -0.14 -1.85 -0.14 0.00 0.42 0.00 0.00 52.86 51.15 2k04 s ASN 30 Cb -0.06 -1.61 -0.06 0.00 -1.45 0.00 0.00 41.25 38.07 2k04 s ASN 30 CO 0.03 -0.31 1.01 0.42 -3.72 0.00 0.00 177.10 174.52 2k04 s THR 31 N 0.99 4.62 0.58 -5.21 -4.23 -1.26 -4.97 115.64 106.17 2k04 s THR 31 Ca 0.03 1.05 0.35 0.00 -1.18 0.00 0.00 61.69 61.94 2k04 s THR 31 Cb -0.20 -3.79 0.38 0.00 1.34 0.00 0.00 72.50 70.23 2k04 s THR 31 CO -0.07 -0.91 2.27 1.55 -0.54 0.00 0.00 174.62 176.92 2k04 h PRO 32 N 0.31 0.00 0.00 3.99 0.13 -1.95 -3.23 132.00 131.25 2k04 h PRO 32 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2k04 h PRO 32 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k04 h PRO 32 CO 0.62 0.02 -0.43 -1.71 -0.23 0.00 0.00 178.00 176.26 2k04 n ASN 33 N -3.54 0.27 -4.25 1.44 4.05 -1.26 -5.05 115.26 106.91 2k04 n ASN 33 Ca -0.03 -2.10 -0.14 0.00 0.45 0.00 0.00 54.58 52.76 2k04 n ASN 33 Cb 0.10 -0.22 -0.10 0.00 1.23 0.00 0.00 39.78 40.79 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 -0.21 0.00 -1.88 0.00 0.00 -1.26 -4.08 120.51 113.08 2k04 n ALA 35 Ca -0.10 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.12 2k04 n ALA 35 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.00 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 7.58 4.43 -0.12 0.00 2.00 -0.06 -4.45 119.66 129.04 2k04 s GLN 37 Ca 0.77 1.82 0.02 0.00 -2.00 0.00 0.00 55.36 55.97 2k04 s GLN 37 Cb -0.07 -3.32 -0.00 0.00 0.80 0.00 0.00 33.01 30.41 2k04 s GLN 37 CO 0.05 -0.25 -0.20 0.42 -0.50 0.00 0.00 175.29 174.81 2k04 s ILE 38 N 0.91 2.39 -0.14 -2.34 1.01 -1.24 -1.49 121.20 120.28 2k04 s ILE 38 Ca 0.59 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 60.35 2k04 s ILE 38 Cb -0.31 -1.95 -0.01 0.00 0.01 0.00 0.00 42.46 40.20 2k04 s ILE 38 CO 0.30 0.54 -0.15 -0.69 0.00 0.00 0.00 174.94 174.95 2k04 s VAL 39 N 0.47 2.78 -0.10 2.92 1.01 0.08 0.41 120.40 127.96 2k04 s VAL 39 Ca -0.14 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.11 2k04 s VAL 39 Cb -0.17 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.06 2k04 s VAL 39 CO 0.06 0.52 -0.12 0.00 0.00 0.00 0.00 175.10 175.55 2k04 s ALA 40 N 0.64 1.49 -0.16 5.51 0.00 0.14 0.19 121.76 129.58 2k04 s ALA 40 Ca -0.08 -0.61 -0.13 0.00 0.00 0.00 0.00 51.96 51.14 2k04 s ALA 40 Cb -0.16 -0.80 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 2k04 s ALA 40 CO 0.03 -0.14 0.26 0.50 0.00 0.00 0.00 175.76 176.41 2k04 s ARG 41 N 1.13 4.19 0.50 0.00 3.52 -1.14 -0.63 118.95 126.52 2k04 s ARG 41 Ca -0.05 0.04 -0.22 0.00 -0.13 0.00 0.00 55.73 55.37 2k04 s ARG 41 Cb -0.14 -3.40 -0.07 0.00 -1.56 0.00 0.00 34.95 29.77 2k04 s ARG 41 CO -0.03 0.30 1.14 1.28 -0.81 0.00 0.00 175.30 177.18 2k04 n LEU 42 N 3.41 3.96 0.02 -0.88 7.99 -1.23 -1.30 117.00 128.96 2k04 n LEU 42 Ca -0.13 0.97 -0.03 0.00 -0.01 0.00 0.00 56.01 56.81 2k04 n LEU 42 Cb 0.52 -1.45 -0.02 0.00 -0.11 0.00 0.00 43.42 42.36 2k04 n LEU 42 CO 0.39 -1.18 0.50 0.11 -1.51 0.00 0.00 177.39 175.70 2k04 h LYS 43 N 1.34 -0.13 -3.00 3.23 1.57 -1.13 -3.39 116.57 115.06 2k04 h LYS 43 Ca -0.48 0.01 -0.59 0.00 -1.87 0.00 0.00 60.65 57.72 2k04 h LYS 43 Cb 1.33 0.03 -0.40 0.00 0.08 0.00 0.00 32.23 33.27 2k04 h LYS 43 CO 0.56 -0.08 -0.77 1.21 -0.57 0.00 0.00 179.45 179.79 2k04 s ASN 44 N -2.84 3.55 0.10 0.86 2.47 -1.26 -4.92 114.94 112.89 2k04 s ASN 44 Ca -0.03 -2.22 -0.26 0.00 0.42 0.00 0.00 52.86 50.77 2k04 s ASN 44 Cb 0.01 -0.80 0.08 0.00 -1.45 0.00 0.00 41.25 39.09 2k04 s ASN 44 CO 0.11 -0.32 0.88 0.21 -3.72 0.00 0.00 177.10 174.26 2k04 s ASN 45 N 0.91 -0.29 0.00 -4.21 3.84 -1.26 -5.05 114.94 108.88 2k04 s ASN 45 Ca 0.16 -0.21 0.28 0.00 0.21 0.00 0.00 52.86 53.29 2k04 s ASN 45 Cb -0.22 0.47 1.02 0.00 -0.55 0.00 0.00 41.25 41.97 2k04 s ASN 45 CO -0.07 -0.82 1.76 0.59 -2.79 0.00 0.00 177.10 175.77 2k04 n ASN 46 N -0.37 0.28 -4.87 -4.21 4.13 -1.26 -4.85 115.26 104.11 2k04 n ASN 46 Ca -0.08 -0.03 -0.24 0.00 1.68 0.00 0.00 54.58 55.91 2k04 n ASN 46 Cb 0.61 -0.15 -0.02 0.00 -1.54 0.00 0.00 39.78 38.68 2k04 n ASN 46 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2k04 s ARG 47 N -2.85 2.35 -0.06 3.52 0.52 -1.26 -5.09 118.95 116.09 2k04 s ARG 47 Ca 0.17 -1.80 0.02 0.00 -0.52 0.00 0.00 55.73 53.60 2k04 s ARG 47 Cb 0.19 -2.20 0.01 0.00 0.52 0.00 0.00 34.95 33.48 2k04 s ARG 47 CO 0.57 -0.38 -0.10 -1.14 0.02 0.00 0.00 175.30 174.26 2k04 s GLN 48 N -4.17 1.46 0.17 3.54 0.74 -1.26 -3.56 119.66 116.58 2k04 s GLN 48 Ca 0.41 -0.34 0.10 0.00 0.05 0.00 0.00 55.36 55.58 2k04 s GLN 48 Cb -0.02 -1.25 -0.04 0.00 1.10 0.00 0.00 33.01 32.80 2k04 s GLN 48 CO 0.24 0.01 -0.22 0.14 -0.55 0.00 0.00 175.29 174.92 2k04 s VAL 49 N 0.67 2.10 -0.05 1.34 -7.23 0.20 -4.97 120.40 112.45 2k04 s VAL 49 Ca -0.13 -1.93 -0.02 0.00 -1.81 0.00 0.00 61.98 58.09 2k04 s VAL 49 Cb -0.15 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 34.79 2k04 s VAL 49 CO 0.03 -0.17 0.07 0.00 -0.31 0.00 0.00 175.10 174.72 2k04 s ILE 51 N -1.06 2.08 -0.11 0.00 -1.09 0.17 0.12 121.20 121.31 2k04 s ILE 51 Ca 0.18 -1.83 -0.25 0.00 -2.23 0.00 0.00 60.65 56.52 2k04 s ILE 51 Cb -0.12 -1.91 -0.03 0.00 -1.58 0.00 0.00 42.46 38.82 2k04 s ILE 51 CO 0.08 -0.09 0.79 -0.62 -1.23 0.00 0.00 174.94 173.87 2k04 s ASP 52 N -2.34 7.00 0.17 3.58 2.15 -1.20 -3.66 116.67 122.37 2k04 s ASP 52 Ca 0.15 1.22 0.20 0.00 0.43 0.00 0.00 52.55 54.55 2k04 s ASP 52 Cb -0.08 -2.45 0.86 0.00 -0.30 0.00 0.00 42.92 40.95 2k04 s ASP 52 CO 0.07 -0.27 1.63 -0.81 -0.17 0.00 0.00 175.17 175.61 2k04 n PRO 53 N 4.53 0.13 -0.00 4.34 -0.04 -1.26 -2.74 135.00 139.96 2k04 n PRO 53 Ca 0.02 0.37 0.15 0.00 -0.04 0.00 0.00 63.50 64.00 2k04 n PRO 53 Cb 0.50 -1.75 0.65 0.00 -0.04 0.00 0.00 33.50 32.86 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 -2.00 1.46 -1.74 0.54 5.02 -1.26 -4.25 118.16 115.94 2k04 n LYS 54 Ca 0.02 -0.67 -0.42 0.00 -2.02 0.00 0.00 58.31 55.22 2k04 n LYS 54 Cb 0.21 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.73 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 -0.18 4.19 -0.21 -0.35 4.77 -1.11 -4.80 117.00 119.32 2k04 n LEU 55 Ca 0.20 1.20 -0.07 0.00 -0.03 0.00 0.00 56.01 57.32 2k04 n LEU 55 Cb 0.28 -1.56 0.08 0.00 -2.33 0.00 0.00 43.42 39.89 2k04 n LEU 55 CO 0.17 -0.09 0.91 0.50 -1.33 0.00 0.00 177.39 177.55 2k04 h LYS 56 N 3.25 1.03 0.00 3.23 3.11 -1.92 0.34 116.57 125.62 2k04 h LYS 56 Ca -0.48 -0.27 -0.06 0.00 -2.81 0.00 0.00 60.65 57.03 2k04 h LYS 56 Cb 1.25 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 32.35 2k04 h LYS 56 CO 0.67 0.95 -0.29 0.11 -2.81 0.00 0.00 179.45 178.08 2k04 h TRP 57 N 0.97 0.00 0.04 1.91 5.08 -1.97 -0.67 115.95 121.31 2k04 h TRP 57 Ca 0.19 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 60.16 2k04 h TRP 57 Cb 0.42 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.58 2k04 h TRP 57 CO 0.03 0.29 -0.02 0.82 -1.28 0.00 0.00 178.44 178.29 2k04 h ILE 58 N 0.00 1.37 -0.34 0.12 1.08 -1.46 -2.44 117.51 115.83 2k04 h ILE 58 Ca -0.00 -1.48 0.07 0.00 -0.39 0.00 0.00 64.86 63.06 2k04 h ILE 58 Cb 0.64 2.33 -0.07 0.00 -3.07 0.00 0.00 36.82 36.65 2k04 h ILE 58 CO 0.04 0.37 -0.11 1.56 -0.69 0.00 0.00 178.15 179.31 2k04 h GLN 59 N -0.72 -0.04 -0.63 2.37 1.08 -0.17 -0.02 115.11 116.99 2k04 h GLN 59 Ca -0.01 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2k04 h GLN 59 Cb 0.64 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.04 2k04 h GLN 59 CO 0.01 -0.02 0.39 0.93 -0.95 0.00 0.00 178.83 179.18 2k04 h GLU 60 N -0.04 0.85 -0.48 1.46 4.39 -1.23 -1.24 114.58 118.29 2k04 h GLU 60 Ca 0.17 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 59.81 2k04 h GLU 60 Cb 0.29 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 2k04 h GLU 60 CO -0.37 0.60 0.30 -0.92 -1.16 0.00 0.00 179.01 177.46 2k04 h TYR 61 N 0.85 0.56 -0.18 4.33 3.20 -0.78 0.93 116.97 125.88 2k04 h TYR 61 Ca 0.23 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.16 2k04 h TYR 61 Cb -0.03 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.01 2k04 h TYR 61 CO -0.02 0.33 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.66 2k04 h LEU 62 N 0.60 -0.34 -0.53 2.82 3.38 -0.74 -2.32 115.31 118.19 2k04 h LEU 62 Ca 0.19 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2k04 h LEU 62 Cb -0.01 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2k04 h LEU 62 CO -0.07 -0.14 0.34 -0.33 0.09 0.00 0.00 178.44 178.34 2k04 h GLU 63 N -0.09 0.70 -0.01 1.13 5.08 -0.18 -2.74 114.58 118.46 2k04 h GLU 63 Ca 0.10 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 2k04 h GLU 63 Cb 0.25 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2k04 h GLU 63 CO -0.24 0.47 -0.46 0.87 -1.00 0.00 0.00 179.01 178.65 2k04 h LYS 64 N 0.71 0.03 -0.26 2.33 1.79 -0.72 -2.23 116.57 118.22 2k04 h LYS 64 Ca 0.19 -0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.68 2k04 h LYS 64 Cb -0.07 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.56 2k04 h LYS 64 CO -0.04 0.49 0.18 0.00 -1.08 0.00 0.00 179.45 179.00 2k04 h LEU 66 N 0.23 0.00 0.00 0.00 -0.00 -1.39 -1.51 115.31 112.64 2k04 h LEU 66 Ca 0.11 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.83 2k04 h LEU 66 Cb 0.16 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.79 2k04 h LEU 66 CO -0.02 0.00 -1.43 -3.20 -0.00 0.00 0.00 178.44 173.78 2k04 n ASN 67 N -4.10 0.81 -0.47 -0.43 4.05 -0.22 -5.17 115.26 109.73 2k04 n ASN 67 Ca -0.03 0.35 0.14 0.00 0.45 0.00 0.00 54.58 55.50 2k04 n ASN 67 Cb 0.10 0.25 0.53 0.00 1.23 0.00 0.00 39.78 41.89 2k04 n ASN 67 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50