#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 1.46 -3.54 1.97 -0.04 -1.26 -4.96 135.00 128.64 2k04 n PRO 2 Ca 0.00 0.53 -0.29 0.00 -0.04 0.00 0.00 63.50 63.70 2k04 n PRO 2 Cb 0.00 -2.25 -0.12 0.00 -0.04 0.00 0.00 33.50 31.09 2k04 n PRO 2 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2k04 s VAL 3 N 2.51 0.57 -0.17 0.52 1.01 -1.26 -5.10 120.40 118.48 2k04 s VAL 3 Ca 0.91 -2.02 -0.30 0.00 0.00 0.00 0.00 61.98 60.57 2k04 s VAL 3 Cb -0.92 -1.41 0.14 0.00 0.00 0.00 0.00 36.38 34.19 2k04 s VAL 3 CO 0.55 -0.97 1.08 -0.94 0.00 0.00 0.00 175.10 174.82 2k04 s SER 4 N 0.80 -0.28 0.17 3.32 1.04 -1.26 -5.15 113.70 112.34 2k04 s SER 4 Ca 0.18 0.24 -0.12 0.00 0.48 0.00 0.00 55.95 56.73 2k04 s SER 4 Cb -0.22 0.24 -0.07 0.00 0.10 0.00 0.00 66.02 66.07 2k04 s SER 4 CO 0.00 -0.30 0.54 -1.48 0.98 0.00 0.00 173.24 172.98 2k04 s LEU 5 N -1.38 4.28 0.04 2.42 0.05 -1.26 -5.09 118.68 117.75 2k04 s LEU 5 Ca 0.02 1.00 0.02 0.00 0.05 0.00 0.00 54.13 55.22 2k04 s LEU 5 Cb -0.01 -3.39 -0.02 0.00 -2.05 0.00 0.00 46.19 40.72 2k04 s LEU 5 CO -0.02 0.05 -0.06 -0.44 -0.55 0.00 0.00 176.35 175.32 2k04 s SER 6 N -1.94 0.70 -0.21 1.48 0.01 -1.26 -5.01 113.70 107.48 2k04 s SER 6 Ca 0.41 -0.58 0.15 0.00 1.31 0.00 0.00 55.95 57.24 2k04 s SER 6 Cb -0.14 0.06 0.67 0.00 0.21 0.00 0.00 66.02 66.83 2k04 s SER 6 CO 0.20 -0.26 1.58 -1.22 0.41 0.00 0.00 173.24 173.95 2k04 n TYR 7 N 1.37 1.50 -4.18 2.43 4.02 -1.26 -3.41 117.16 117.63 2k04 n TYR 7 Ca -0.22 -0.80 -0.22 0.00 -0.01 0.00 0.00 57.90 56.64 2k04 n TYR 7 Cb 0.55 -0.41 -0.06 0.00 -0.02 0.00 0.00 39.34 39.40 2k04 n TYR 7 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2k04 s ARG 8 N -2.79 2.56 -0.09 -0.72 0.52 -1.26 -4.65 118.95 112.52 2k04 s ARG 8 Ca 0.48 -1.29 -0.11 0.00 -0.52 0.00 0.00 55.73 54.29 2k04 s ARG 8 Cb 0.38 -2.33 -0.05 0.00 0.52 0.00 0.00 34.95 33.47 2k04 s ARG 8 CO 0.12 0.33 0.25 0.00 0.02 0.00 0.00 175.30 176.02 2k04 h PRO 10 N 5.26 -0.90 -5.14 0.00 0.13 -1.99 -3.39 132.00 125.97 2k04 h PRO 10 Ca -0.51 0.06 -0.62 0.00 -0.87 0.00 0.00 66.00 64.07 2k04 h PRO 10 Cb 1.21 0.21 -0.15 0.00 0.13 0.00 0.00 31.00 32.40 2k04 h PRO 10 CO 0.63 -0.60 -0.51 0.00 -0.23 0.00 0.00 178.00 177.28 2k04 h ARG 12 N 7.29 0.33 -5.49 0.00 2.43 -2.03 -3.43 114.38 113.49 2k04 h ARG 12 Ca -0.38 -0.46 -0.67 0.00 -0.81 0.00 0.00 59.98 57.66 2k04 h ARG 12 Cb 1.17 0.15 -0.28 0.00 -0.42 0.00 0.00 29.97 30.59 2k04 h ARG 12 CO 0.68 1.17 -0.80 -0.06 -1.51 0.00 0.00 179.97 179.45 2k04 s PHE 13 N -2.77 2.72 0.10 2.20 0.08 -1.26 -5.12 117.98 113.93 2k04 s PHE 13 Ca -0.14 -0.67 0.06 0.00 0.12 0.00 0.00 56.93 56.31 2k04 s PHE 13 Cb 0.02 -1.78 -0.03 0.00 -0.57 0.00 0.00 43.02 40.66 2k04 s PHE 13 CO 0.82 -0.21 -0.16 -0.59 -0.10 0.00 0.00 175.22 174.98 2k04 s PHE 14 N 0.19 1.45 -0.34 0.36 -0.12 -1.26 -4.95 117.98 113.31 2k04 s PHE 14 Ca -0.09 -0.48 -0.28 0.00 -0.05 0.00 0.00 56.93 56.03 2k04 s PHE 14 Cb -0.16 -0.79 -0.02 0.00 -0.63 0.00 0.00 43.02 41.43 2k04 s PHE 14 CO 0.06 0.13 1.84 -1.21 -0.05 0.00 0.00 175.22 175.99 2k04 s GLU 15 N -2.10 3.27 0.00 1.99 8.01 0.93 -4.78 118.70 126.03 2k04 s GLU 15 Ca 0.04 1.43 0.00 0.00 0.01 0.00 0.00 54.97 56.45 2k04 s GLU 15 Cb -0.08 -4.22 0.00 0.00 -4.31 0.00 0.00 34.13 25.51 2k04 s GLU 15 CO 0.03 -1.93 0.08 0.43 0.01 0.00 0.00 175.26 173.88 2k04 n SER 16 N 10.56 0.00 -4.42 -0.19 7.64 -1.26 -1.81 113.62 124.14 2k04 n SER 16 Ca 0.23 0.08 -0.45 0.00 1.01 0.00 0.00 58.87 59.75 2k04 n SER 16 Cb 0.47 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.65 2k04 n SER 16 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 2k04 s HIS 17 N -0.16 3.32 0.68 1.43 0.00 -1.26 -3.89 115.29 115.41 2k04 s HIS 17 Ca 0.00 -1.61 -0.12 0.00 -3.00 0.00 0.00 55.06 50.32 2k04 s HIS 17 Cb 0.00 -4.17 0.01 0.00 -4.00 0.00 0.00 32.58 24.41 2k04 s HIS 17 CO 0.00 -1.36 1.07 0.54 -1.00 0.00 0.00 174.74 173.99 2k04 s VAL 18 N 1.95 3.75 -0.23 -5.38 0.11 -1.26 -4.97 120.40 114.37 2k04 s VAL 18 Ca 0.30 0.66 -0.29 0.00 -2.93 0.00 0.00 61.98 59.72 2k04 s VAL 18 Cb -0.06 -3.26 0.01 0.00 -1.53 0.00 0.00 36.38 31.54 2k04 s VAL 18 CO -0.09 -0.65 1.03 0.00 -3.33 0.00 0.00 175.10 172.06 2k04 s ALA 19 N -2.79 3.68 0.24 1.54 0.00 -1.26 -4.88 121.76 118.29 2k04 s ALA 19 Ca 0.61 0.16 0.24 0.00 0.00 0.00 0.00 51.96 52.97 2k04 s ALA 19 Cb -0.16 -3.54 1.05 0.00 0.00 0.00 0.00 23.12 20.48 2k04 s ALA 19 CO 0.49 -1.05 1.89 -0.09 0.00 0.00 0.00 175.76 177.00 2k04 h ARG 20 N 7.48 0.00 0.00 0.00 2.43 -1.94 -0.14 114.38 122.21 2k04 h ARG 20 Ca -0.19 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 2k04 h ARG 20 Cb 1.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2k04 h ARG 20 CO 0.98 0.22 0.00 0.00 -1.51 0.00 0.00 179.97 179.65 2k04 n ALA 21 N -2.26 1.84 0.39 2.80 0.00 -1.26 -2.54 120.51 119.47 2k04 n ALA 21 Ca -0.01 -0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.41 2k04 n ALA 21 Cb 0.38 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.54 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 -1.48 1.21 -4.88 0.00 5.15 -0.10 -4.95 115.26 110.20 2k04 n ASN 22 Ca 0.05 -1.10 -0.34 0.00 -0.60 0.00 0.00 54.58 52.58 2k04 n ASN 22 Cb 0.20 0.41 -0.05 0.00 -0.53 0.00 0.00 39.78 39.81 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 -1.19 5.22 -0.13 3.44 0.11 -0.97 0.08 120.40 126.97 2k04 s VAL 23 Ca 0.08 0.21 0.19 0.00 -2.93 0.00 0.00 61.98 59.53 2k04 s VAL 23 Cb 0.07 -3.60 -0.27 0.00 -1.53 0.00 0.00 36.38 31.05 2k04 s VAL 23 CO 0.21 0.28 0.28 0.29 -3.33 0.00 0.00 175.10 172.83 2k04 n LYS 24 N 0.86 0.67 -3.60 1.54 5.02 -0.54 -4.73 118.16 117.39 2k04 n LYS 24 Ca -0.09 -0.06 0.02 0.00 -2.02 0.00 0.00 58.31 56.16 2k04 n LYS 24 Cb 0.52 -1.55 -0.01 0.00 -0.02 0.00 0.00 35.03 33.98 2k04 n LYS 24 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2k04 s HIS 25 N -2.89 -0.03 0.16 2.13 -3.43 -1.26 -5.05 115.29 104.92 2k04 s HIS 25 Ca -0.09 -0.02 0.09 0.00 -0.80 0.00 0.00 55.06 54.25 2k04 s HIS 25 Cb 0.09 0.52 -0.04 0.00 -1.43 0.00 0.00 32.58 31.72 2k04 s HIS 25 CO 0.86 -0.16 -0.16 -0.51 -2.00 0.00 0.00 174.74 172.77 2k04 s LEU 26 N -2.83 2.75 -0.09 5.38 1.43 -1.26 -3.44 118.68 120.62 2k04 s LEU 26 Ca 0.14 -0.64 -0.02 0.00 -1.03 0.00 0.00 54.13 52.58 2k04 s LEU 26 Cb 0.05 -1.50 0.03 0.00 0.03 0.00 0.00 46.19 44.80 2k04 s LEU 26 CO -0.05 0.13 0.01 -0.75 0.23 0.00 0.00 176.35 175.93 2k04 s LYS 27 N -2.56 0.55 -0.13 1.70 2.20 0.13 -4.97 119.74 116.66 2k04 s LYS 27 Ca 0.21 0.06 -0.05 0.00 -0.36 0.00 0.00 55.97 55.83 2k04 s LYS 27 Cb -0.09 -1.10 -0.04 0.00 -1.51 0.00 0.00 37.83 35.09 2k04 s LYS 27 CO 0.12 -0.36 0.06 0.42 -0.36 0.00 0.00 175.35 175.24 2k04 s ILE 28 N 1.98 4.80 -0.08 5.43 1.01 -1.26 -0.08 121.20 132.99 2k04 s ILE 28 Ca 0.04 -0.05 -0.15 0.00 0.00 0.00 0.00 60.65 60.49 2k04 s ILE 28 Cb -0.13 -3.09 0.03 0.00 0.01 0.00 0.00 42.46 39.28 2k04 s ILE 28 CO -0.06 0.56 0.38 -1.48 0.00 0.00 0.00 174.94 174.34 2k04 s LEU 29 N -0.47 0.58 -0.22 2.97 0.05 -0.08 -5.01 118.68 116.49 2k04 s LEU 29 Ca 0.10 0.47 0.01 0.00 0.05 0.00 0.00 54.13 54.76 2k04 s LEU 29 Cb -0.12 1.39 0.05 0.00 -2.05 0.00 0.00 46.19 45.47 2k04 s LEU 29 CO 0.02 -0.31 -0.08 0.21 -0.55 0.00 0.00 176.35 175.64 2k04 s ASN 30 N -0.57 3.75 0.26 1.48 2.47 -1.26 -0.81 114.94 120.25 2k04 s ASN 30 Ca -0.07 -1.09 -0.24 0.00 0.42 0.00 0.00 52.86 51.88 2k04 s ASN 30 Cb -0.04 -1.25 -0.09 0.00 -1.45 0.00 0.00 41.25 38.42 2k04 s ASN 30 CO 0.03 -0.19 0.83 0.42 -3.72 0.00 0.00 177.10 174.47 2k04 s THR 31 N 1.35 4.37 -1.28 -5.21 -4.23 -1.26 -4.92 115.64 104.45 2k04 s THR 31 Ca -0.04 1.61 0.00 0.00 -1.18 0.00 0.00 61.69 62.07 2k04 s THR 31 Cb -0.18 -3.99 0.00 0.00 1.34 0.00 0.00 72.50 69.67 2k04 s THR 31 CO -0.07 0.24 0.00 -2.65 -0.54 0.00 0.00 174.62 171.61 2k04 n PRO 32 N 0.83 0.00 0.00 3.99 -0.02 -1.22 -1.17 135.00 137.41 2k04 n PRO 32 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 2k04 n PRO 32 Cb 0.50 -0.96 0.00 0.00 -0.02 0.00 0.00 33.50 33.02 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 -0.08 0.00 -4.24 2.55 5.15 -1.26 -4.94 115.26 112.44 2k04 n ASN 33 Ca 0.00 -1.00 -0.14 0.00 -0.60 0.00 0.00 54.58 52.84 2k04 n ASN 33 Cb 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 2k04 n ASN 33 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k04 n ALA 35 N -0.20 -0.35 -1.70 0.00 0.00 -1.26 -4.44 120.51 112.56 2k04 n ALA 35 Ca -0.09 -0.18 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 2k04 n ALA 35 Cb 0.62 -0.01 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 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 2.21 2.43 -0.24 0.00 -1.52 0.01 -4.59 119.66 117.96 2k04 s GLN 37 Ca 0.79 -1.29 -0.08 0.00 -1.95 0.00 0.00 55.36 52.84 2k04 s GLN 37 Cb -0.48 -3.26 -0.03 0.00 -0.22 0.00 0.00 33.01 29.02 2k04 s GLN 37 CO 0.35 -0.66 0.08 0.42 -0.25 0.00 0.00 175.29 175.23 2k04 s ILE 38 N 1.27 4.51 -0.05 1.08 1.01 -1.26 -0.91 121.20 126.86 2k04 s ILE 38 Ca -0.04 -0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.54 2k04 s ILE 38 Cb -0.20 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 39.15 2k04 s ILE 38 CO -0.01 0.36 -0.16 -0.69 0.00 0.00 0.00 174.94 174.44 2k04 s VAL 39 N 1.36 2.89 -0.02 2.92 1.01 0.88 0.45 120.40 129.89 2k04 s VAL 39 Ca 0.05 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.26 2k04 s VAL 39 Cb -0.15 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.13 2k04 s VAL 39 CO 0.04 0.58 -0.01 0.00 0.00 0.00 0.00 175.10 175.72 2k04 s ALA 40 N -0.60 0.27 -0.16 5.51 0.00 0.98 0.21 121.76 127.96 2k04 s ALA 40 Ca 0.09 0.07 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 2k04 s ALA 40 Cb -0.11 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.75 2k04 s ALA 40 CO 0.01 -0.02 0.27 0.50 0.00 0.00 0.00 175.76 176.51 2k04 s ARG 41 N 0.61 4.20 0.95 0.00 3.52 -1.22 -0.83 118.95 126.18 2k04 s ARG 41 Ca -0.06 0.05 -0.11 0.00 -0.13 0.00 0.00 55.73 55.48 2k04 s ARG 41 Cb -0.09 -3.41 0.16 0.00 -1.56 0.00 0.00 34.95 30.06 2k04 s ARG 41 CO -0.01 0.29 1.10 -0.51 -0.81 0.00 0.00 175.30 175.36 2k04 s LEU 42 N 0.32 2.32 0.00 -0.88 1.43 -1.19 -1.47 118.68 119.21 2k04 s LEU 42 Ca 0.15 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 55.14 2k04 s LEU 42 Cb -0.13 -4.20 0.00 0.00 0.03 0.00 0.00 46.19 41.89 2k04 s LEU 42 CO 0.03 -3.16 0.50 0.29 0.23 0.00 0.00 176.35 174.24 2k04 n LYS 43 N -4.26 0.00 -0.74 1.70 5.02 0.11 -4.58 118.16 115.42 2k04 n LYS 43 Ca 0.09 0.20 -0.01 0.00 -2.02 0.00 0.00 58.31 56.57 2k04 n LYS 43 Cb 0.53 -1.06 -0.01 0.00 -0.02 0.00 0.00 35.03 34.47 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 -1.11 -0.12 0.04 4.39 5.15 -1.26 -4.94 115.26 117.41 2k04 n ASN 44 Ca 0.00 -1.57 -0.13 0.00 -0.60 0.00 0.00 54.58 52.28 2k04 n ASN 44 Cb 0.00 -0.01 -0.09 0.00 -0.53 0.00 0.00 39.78 39.16 2k04 n ASN 44 CO 0.00 0.00 0.00 -1.13 1.40 0.00 0.00 177.26 177.53 2k04 h ASN 45 N 0.12 -0.08 0.00 1.20 -1.24 -1.90 -3.47 115.58 110.21 2k04 h ASN 45 Ca -0.16 -0.27 0.00 0.00 0.71 0.00 0.00 56.30 56.58 2k04 h ASN 45 Cb 1.29 0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.36 2k04 h ASN 45 CO -0.06 0.23 0.00 -3.20 -1.29 0.00 0.00 177.43 173.11 2k04 n ASN 46 N -4.99 -1.54 -1.10 1.15 2.85 -1.26 -5.18 115.26 105.19 2k04 n ASN 46 Ca -0.08 0.55 0.00 0.00 -0.11 0.00 0.00 54.58 54.94 2k04 n ASN 46 Cb 0.18 1.69 0.00 0.00 1.24 0.00 0.00 39.78 42.89 2k04 n ASN 46 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 2k04 n ARG 47 N -2.95 1.09 -4.09 1.20 1.85 -1.26 -5.09 116.66 107.41 2k04 n ARG 47 Ca 0.00 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.49 2k04 n ARG 47 Cb 0.00 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.33 2k04 n ARG 47 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 2k04 s GLN 48 N -1.30 3.34 0.18 2.89 -0.44 -1.26 -3.18 119.66 119.89 2k04 s GLN 48 Ca 0.00 -0.27 0.08 0.00 -2.50 0.00 0.00 55.36 52.67 2k04 s GLN 48 Cb 0.00 -3.04 -0.04 0.00 -1.64 0.00 0.00 33.01 28.29 2k04 s GLN 48 CO 0.00 0.67 -0.16 0.14 0.50 0.00 0.00 175.29 176.44 2k04 s VAL 49 N -0.76 1.75 -0.08 1.34 -7.23 -0.01 -4.92 120.40 110.49 2k04 s VAL 49 Ca 0.13 -2.01 0.01 0.00 -1.81 0.00 0.00 61.98 58.29 2k04 s VAL 49 Cb -0.12 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.91 2k04 s VAL 49 CO 0.03 -0.43 -0.08 0.00 -0.31 0.00 0.00 175.10 174.30 2k04 s ILE 51 N -0.57 3.44 -0.27 0.00 -1.09 0.17 -0.05 121.20 122.84 2k04 s ILE 51 Ca 0.08 -1.29 -0.29 0.00 -2.23 0.00 0.00 60.65 56.92 2k04 s ILE 51 Cb -0.12 -2.63 0.00 0.00 -1.58 0.00 0.00 42.46 38.13 2k04 s ILE 51 CO 0.02 0.07 1.24 -0.62 -1.23 0.00 0.00 174.94 174.43 2k04 s ASP 52 N -2.34 6.79 0.00 3.58 -1.08 -0.75 -4.05 116.67 118.83 2k04 s ASP 52 Ca 0.23 1.29 0.00 0.00 -0.52 0.00 0.00 52.55 53.55 2k04 s ASP 52 Cb -0.11 -2.54 0.02 0.00 -1.46 0.00 0.00 42.92 38.84 2k04 s ASP 52 CO 0.15 -0.96 0.86 -0.81 0.52 0.00 0.00 175.17 174.92 2k04 n PRO 53 N 7.05 0.84 -0.15 4.34 -0.04 -1.26 -2.62 135.00 143.16 2k04 n PRO 53 Ca 0.14 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.65 2k04 n PRO 53 Cb 0.46 -1.01 0.13 0.00 -0.04 0.00 0.00 33.50 33.04 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 -0.51 2.78 -1.70 0.54 4.01 -1.26 -4.71 118.16 117.31 2k04 n LYS 54 Ca 0.00 -1.94 -0.42 0.00 -0.51 0.00 0.00 58.31 55.45 2k04 n LYS 54 Cb 0.00 -1.23 0.00 0.00 -0.51 0.00 0.00 35.03 33.29 2k04 n LYS 54 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2k04 n LEU 55 N 0.38 3.79 -0.23 -0.35 4.77 -1.08 -4.79 117.00 119.50 2k04 n LEU 55 Ca 0.10 1.15 -0.03 0.00 -0.03 0.00 0.00 56.01 57.20 2k04 n LEU 55 Cb 0.39 -1.49 0.08 0.00 -2.33 0.00 0.00 43.42 40.07 2k04 n LEU 55 CO 0.07 -0.58 1.11 0.50 -1.33 0.00 0.00 177.39 177.16 2k04 h LYS 56 N 2.29 0.73 0.00 3.23 3.11 -1.95 0.20 116.57 124.18 2k04 h LYS 56 Ca -0.47 -0.04 -0.07 0.00 -2.81 0.00 0.00 60.65 57.25 2k04 h LYS 56 Cb 1.29 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 32.34 2k04 h LYS 56 CO 0.61 0.48 -0.34 0.11 -2.81 0.00 0.00 179.45 177.50 2k04 h TRP 57 N 0.75 0.00 -0.02 1.91 5.08 -1.99 -1.35 115.95 120.32 2k04 h TRP 57 Ca 0.28 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.24 2k04 h TRP 57 Cb 0.09 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.25 2k04 h TRP 57 CO -0.06 0.34 -0.02 0.82 -1.28 0.00 0.00 178.44 178.24 2k04 h ILE 58 N 0.00 1.37 -0.26 0.12 1.08 -1.53 -0.53 117.51 117.76 2k04 h ILE 58 Ca -0.00 -1.13 0.06 0.00 -0.39 0.00 0.00 64.86 63.40 2k04 h ILE 58 Cb 0.71 2.08 -0.06 0.00 -3.07 0.00 0.00 36.82 36.48 2k04 h ILE 58 CO 0.04 0.30 -0.11 1.56 -0.69 0.00 0.00 178.15 179.25 2k04 h GLN 59 N -0.39 -0.07 -0.12 2.37 1.08 -0.41 0.14 115.11 117.71 2k04 h GLN 59 Ca 0.00 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 57.25 2k04 h GLN 59 Cb 0.50 0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.90 2k04 h GLN 59 CO 0.01 -0.04 -0.12 0.93 -0.95 0.00 0.00 178.83 178.65 2k04 h GLU 60 N -0.07 -0.14 -0.40 1.46 4.39 -1.28 0.94 114.58 119.48 2k04 h GLU 60 Ca 0.14 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.87 2k04 h GLU 60 Cb 0.28 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.93 2k04 h GLU 60 CO -0.31 -0.09 0.22 -0.92 -1.16 0.00 0.00 179.01 176.74 2k04 h TYR 61 N -0.15 0.41 0.17 4.33 5.03 -0.23 -0.52 116.97 126.01 2k04 h TYR 61 Ca 0.09 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.40 2k04 h TYR 61 Cb 0.27 -0.13 0.00 0.00 1.55 0.00 0.00 36.73 38.43 2k04 h TYR 61 CO -0.24 0.23 -0.08 -0.07 -1.32 0.00 0.00 178.16 176.68 2k04 h LEU 62 N 0.44 -0.19 -1.73 2.82 3.38 -0.44 -2.63 115.31 116.96 2k04 h LEU 62 Ca 0.16 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.16 2k04 h LEU 62 Cb 0.04 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2k04 h LEU 62 CO -0.09 -0.13 0.22 -0.33 0.09 0.00 0.00 178.44 178.20 2k04 h GLU 63 N -0.23 0.35 0.00 1.13 5.08 -0.25 -2.14 114.58 118.51 2k04 h GLU 63 Ca -0.02 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.12 2k04 h GLU 63 Cb 0.18 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 2k04 h GLU 63 CO 0.04 0.23 -0.98 0.87 -1.00 0.00 0.00 179.01 178.16 2k04 h LYS 64 N 0.36 0.00 -0.33 2.33 1.79 -0.98 -3.27 116.57 116.46 2k04 h LYS 64 Ca 0.13 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.60 2k04 h LYS 64 Cb 0.09 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 2k04 h LYS 64 CO -0.03 0.86 0.17 0.00 -1.08 0.00 0.00 179.45 179.37 2k04 h LEU 66 N 0.46 0.86 0.03 0.00 -0.00 -1.61 -3.12 115.31 111.94 2k04 h LEU 66 Ca 0.12 0.07 -0.33 0.00 -0.00 0.00 0.00 57.88 57.74 2k04 h LEU 66 Cb 0.03 -0.10 -0.04 0.00 -0.00 0.00 0.00 40.66 40.55 2k04 h LEU 66 CO -0.02 0.40 -1.81 0.59 -0.00 0.00 0.00 178.44 177.60 2k04 n ASN 67 N -4.67 1.96 0.00 -0.43 5.03 -0.58 -5.19 115.26 111.38 2k04 n ASN 67 Ca 0.21 0.30 0.01 0.00 0.87 0.00 0.00 54.58 55.96 2k04 n ASN 67 Cb 0.44 -0.86 0.04 0.00 -1.02 0.00 0.00 39.78 38.38 2k04 n ASN 67 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72