#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 4.13 0.07 1.97 0.02 -1.26 -5.01 135.00 134.92 2k04 s PRO 2 Ca 0.00 1.96 0.05 0.00 0.02 0.00 0.00 61.00 63.03 2k04 s PRO 2 Cb 0.00 -3.93 -0.04 0.00 0.02 0.00 0.00 34.50 30.55 2k04 s PRO 2 CO 0.00 -0.88 -0.06 0.14 -0.33 0.00 0.00 177.00 175.87 2k04 s VAL 3 N 4.08 3.66 -1.31 3.83 -7.23 -1.26 -5.03 120.40 117.14 2k04 s VAL 3 Ca 0.68 -1.02 -0.17 0.00 -1.81 0.00 0.00 61.98 59.66 2k04 s VAL 3 Cb -0.29 -2.68 0.07 0.00 0.56 0.00 0.00 36.38 34.04 2k04 s VAL 3 CO 0.25 0.21 1.78 -1.20 -0.31 0.00 0.00 175.10 175.83 2k04 n SER 4 N 0.94 4.84 0.00 4.85 7.64 -1.26 -3.85 113.62 126.78 2k04 n SER 4 Ca -0.13 -2.92 0.00 0.00 1.01 0.00 0.00 58.87 56.83 2k04 n SER 4 Cb 0.52 -1.73 0.00 0.00 -1.01 0.00 0.00 64.21 61.99 2k04 n SER 4 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2k04 n LEU 5 N 7.99 1.28 -4.93 -3.43 0.00 -1.26 -5.01 117.00 111.63 2k04 n LEU 5 Ca 0.49 0.00 -0.25 0.00 0.00 0.00 0.00 56.01 56.25 2k04 n LEU 5 Cb 0.45 0.00 0.04 0.00 0.00 0.00 0.00 43.42 43.91 2k04 n LEU 5 CO 0.78 0.18 0.49 -0.94 0.00 0.00 0.00 177.39 177.90 2k04 s SER 6 N -4.44 5.38 -0.56 1.96 1.04 -1.25 -5.01 113.70 110.83 2k04 s SER 6 Ca 0.00 0.48 -0.24 0.00 0.48 0.00 0.00 55.95 56.67 2k04 s SER 6 Cb 0.00 -1.41 0.04 0.00 0.10 0.00 0.00 66.02 64.76 2k04 s SER 6 CO 0.00 -1.16 0.95 -0.31 0.98 0.00 0.00 173.24 173.70 2k04 s TYR 7 N -2.96 2.78 -0.17 5.02 2.02 -1.26 -4.96 117.35 117.81 2k04 s TYR 7 Ca 0.55 -0.04 -0.00 0.00 -0.37 0.00 0.00 57.07 57.21 2k04 s TYR 7 Cb -0.10 -4.10 0.04 0.00 -0.40 0.00 0.00 41.96 37.39 2k04 s TYR 7 CO 0.43 -1.38 -0.08 0.50 -1.57 0.00 0.00 175.55 173.45 2k04 s ARG 8 N 3.99 1.70 -0.16 -0.62 6.06 -1.26 -5.04 118.95 123.62 2k04 s ARG 8 Ca 0.30 -0.60 -0.07 0.00 -2.50 0.00 0.00 55.73 52.86 2k04 s ARG 8 Cb -0.13 -2.11 -0.04 0.00 0.06 0.00 0.00 34.95 32.73 2k04 s ARG 8 CO 0.19 -0.40 0.09 0.00 -2.50 0.00 0.00 175.30 172.68 2k04 h PRO 10 N 6.06 0.95 -6.00 0.00 0.13 -1.99 -3.36 132.00 127.79 2k04 h PRO 10 Ca -0.44 -0.06 -0.49 0.00 -0.87 0.00 0.00 66.00 64.14 2k04 h PRO 10 Cb 1.18 -0.21 -0.04 0.00 0.13 0.00 0.00 31.00 32.06 2k04 h PRO 10 CO 0.67 0.63 1.26 0.00 -0.23 0.00 0.00 178.00 180.33 2k04 h ARG 12 N 13.95 0.38 -4.62 0.00 2.43 -2.00 -3.45 114.38 121.08 2k04 h ARG 12 Ca -0.22 -0.55 -0.23 0.00 -0.81 0.00 0.00 59.98 58.17 2k04 h ARG 12 Cb 1.13 0.19 -0.16 0.00 -0.42 0.00 0.00 29.97 30.71 2k04 h ARG 12 CO 1.23 1.23 -0.70 -0.06 -1.51 0.00 0.00 179.97 180.15 2k04 s PHE 13 N -2.87 0.83 0.00 2.20 0.08 -1.26 -5.16 117.98 111.80 2k04 s PHE 13 Ca -0.06 -0.85 0.03 0.00 0.12 0.00 0.00 56.93 56.17 2k04 s PHE 13 Cb 0.07 -0.49 -0.01 0.00 -0.57 0.00 0.00 43.02 42.02 2k04 s PHE 13 CO 0.89 -0.15 -0.09 -0.59 -0.10 0.00 0.00 175.22 175.19 2k04 s PHE 14 N -3.22 0.76 -0.54 0.36 -0.12 -1.26 -4.67 117.98 109.28 2k04 s PHE 14 Ca 0.08 -0.19 -0.28 0.00 -0.05 0.00 0.00 56.93 56.48 2k04 s PHE 14 Cb 0.03 -0.48 0.03 0.00 -0.63 0.00 0.00 43.02 41.96 2k04 s PHE 14 CO -0.04 -0.01 1.18 -1.21 -0.05 0.00 0.00 175.22 175.09 2k04 s GLU 15 N -0.41 3.58 -0.12 1.99 8.01 0.32 -4.79 118.70 127.29 2k04 s GLU 15 Ca 0.02 0.36 -0.09 0.00 0.01 0.00 0.00 54.97 55.27 2k04 s GLU 15 Cb -0.04 -3.98 -0.05 0.00 -4.31 0.00 0.00 34.13 25.75 2k04 s GLU 15 CO -0.00 -1.59 0.20 -1.54 0.01 0.00 0.00 175.26 172.34 2k04 s SER 16 N 2.83 6.44 -1.29 -0.19 1.04 -1.26 -1.70 113.70 119.58 2k04 s SER 16 Ca 0.45 0.52 -0.01 0.00 0.48 0.00 0.00 55.95 57.40 2k04 s SER 16 Cb -0.07 -2.12 0.00 0.00 0.10 0.00 0.00 66.02 63.93 2k04 s SER 16 CO 0.28 0.33 0.08 1.41 0.98 0.00 0.00 173.24 176.32 2k04 n HIS 17 N 2.35 -0.87 -1.46 5.02 8.25 -1.26 -4.97 115.22 122.28 2k04 n HIS 17 Ca -0.18 0.07 -0.35 0.00 -0.26 0.00 0.00 57.72 57.01 2k04 n HIS 17 Cb 0.54 -3.27 0.09 0.00 1.12 0.00 0.00 29.99 28.47 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 -2.81 2.26 -0.16 1.59 0.11 -1.26 -4.93 120.40 115.19 2k04 s VAL 18 Ca 0.04 0.13 -0.26 0.00 -2.93 0.00 0.00 61.98 58.96 2k04 s VAL 18 Cb -0.02 -2.75 -0.01 0.00 -1.53 0.00 0.00 36.38 32.07 2k04 s VAL 18 CO 0.05 -0.06 0.85 0.00 -3.33 0.00 0.00 175.10 172.61 2k04 s ALA 19 N -1.90 3.51 0.19 1.54 0.00 -1.26 -4.90 121.76 118.94 2k04 s ALA 19 Ca 0.75 0.07 0.28 0.00 0.00 0.00 0.00 51.96 53.07 2k04 s ALA 19 Cb -0.30 -3.25 1.21 0.00 0.00 0.00 0.00 23.12 20.77 2k04 s ALA 19 CO 0.45 -0.64 1.94 -0.09 0.00 0.00 0.00 175.76 177.41 2k04 h ARG 20 N 7.30 0.00 0.00 0.00 2.43 -1.95 -1.64 114.38 120.52 2k04 h ARG 20 Ca -0.29 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 2k04 h ARG 20 Cb 1.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 2k04 h ARG 20 CO 0.84 0.13 0.00 0.00 -1.51 0.00 0.00 179.97 179.43 2k04 h ALA 21 N 1.87 1.00 -0.00 2.80 0.00 -2.02 -2.12 119.26 120.78 2k04 h ALA 21 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k04 h ALA 21 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2k04 h ALA 21 CO 0.02 0.00 -0.68 -1.71 0.00 0.00 0.00 179.25 176.88 2k04 n ASN 22 N -2.42 1.10 -4.84 0.00 5.15 -0.63 -4.96 115.26 108.67 2k04 n ASN 22 Ca 0.01 -1.05 -0.38 0.00 -0.60 0.00 0.00 54.58 52.56 2k04 n ASN 22 Cb 0.19 0.84 -0.06 0.00 -0.53 0.00 0.00 39.78 40.22 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 -2.45 5.14 -0.19 3.44 0.11 -0.80 -0.74 120.40 124.91 2k04 s VAL 23 Ca 0.09 0.70 -0.12 0.00 -2.93 0.00 0.00 61.98 59.72 2k04 s VAL 23 Cb 0.13 -3.65 -0.21 0.00 -1.53 0.00 0.00 36.38 31.13 2k04 s VAL 23 CO 0.63 0.57 0.16 0.29 -3.33 0.00 0.00 175.10 173.42 2k04 n LYS 24 N 1.96 0.66 -3.68 1.54 5.02 0.01 -4.79 118.16 118.87 2k04 n LYS 24 Ca -0.15 0.36 -0.04 0.00 -2.02 0.00 0.00 58.31 56.46 2k04 n LYS 24 Cb 0.53 -1.67 -0.01 0.00 -0.02 0.00 0.00 35.03 33.85 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 -2.48 -0.16 -0.08 2.13 -3.43 -1.11 -5.03 115.29 105.13 2k04 s HIS 25 Ca -0.28 -0.08 0.03 0.00 -0.80 0.00 0.00 55.06 53.92 2k04 s HIS 25 Cb 0.08 0.60 -0.02 0.00 -1.43 0.00 0.00 32.58 31.81 2k04 s HIS 25 CO 0.66 -0.67 -0.15 -0.51 -2.00 0.00 0.00 174.74 172.06 2k04 s LEU 26 N -2.84 2.66 -0.23 5.38 1.02 -1.26 -1.00 118.68 122.41 2k04 s LEU 26 Ca 0.11 -0.27 -0.03 0.00 0.02 0.00 0.00 54.13 53.96 2k04 s LEU 26 Cb -0.00 -1.55 0.01 0.00 0.02 0.00 0.00 46.19 44.66 2k04 s LEU 26 CO -0.01 0.28 -0.07 -0.75 0.02 0.00 0.00 176.35 175.82 2k04 s LYS 27 N -0.32 3.15 -0.24 1.70 2.20 0.13 -4.97 119.74 121.39 2k04 s LYS 27 Ca 0.02 -0.77 -0.09 0.00 -0.36 0.00 0.00 55.97 54.78 2k04 s LYS 27 Cb -0.13 -2.95 -0.04 0.00 -1.51 0.00 0.00 37.83 33.20 2k04 s LYS 27 CO 0.03 -0.27 0.12 0.42 -0.36 0.00 0.00 175.35 175.28 2k04 s ILE 28 N 1.41 4.88 -0.30 5.43 1.01 -1.26 0.02 121.20 132.39 2k04 s ILE 28 Ca 0.04 0.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.69 2k04 s ILE 28 Cb -0.15 -3.28 0.12 0.00 0.01 0.00 0.00 42.46 39.16 2k04 s ILE 28 CO -0.05 0.34 0.21 -1.48 0.00 0.00 0.00 174.94 173.96 2k04 s LEU 29 N 1.28 0.27 -0.59 2.97 0.05 0.55 -5.00 118.68 118.19 2k04 s LEU 29 Ca 0.06 -1.21 -0.26 0.00 0.05 0.00 0.00 54.13 52.77 2k04 s LEU 29 Cb -0.14 0.00 0.04 0.00 -2.05 0.00 0.00 46.19 44.04 2k04 s LEU 29 CO 0.05 -0.40 1.07 0.21 -0.55 0.00 0.00 176.35 176.73 2k04 s ASN 30 N 2.05 6.33 0.16 1.48 3.04 -1.26 -3.92 114.94 122.83 2k04 s ASN 30 Ca 0.10 -0.28 -0.22 0.00 0.04 0.00 0.00 52.86 52.50 2k04 s ASN 30 Cb -0.16 -2.49 -0.08 0.00 -1.54 0.00 0.00 41.25 36.99 2k04 s ASN 30 CO -0.30 -1.41 0.71 0.42 -3.04 0.00 0.00 177.10 173.48 2k04 s THR 31 N 4.50 4.51 0.29 -5.21 -4.23 -1.26 -4.98 115.64 109.27 2k04 s THR 31 Ca 0.34 1.46 0.02 0.00 -1.18 0.00 0.00 61.69 62.33 2k04 s THR 31 Cb -0.11 -4.00 0.34 0.00 1.34 0.00 0.00 72.50 70.07 2k04 s THR 31 CO 0.20 0.44 1.62 1.55 -0.54 0.00 0.00 174.62 177.89 2k04 h PRO 32 N 4.12 0.12 -0.01 3.99 0.13 -1.94 -0.04 132.00 138.37 2k04 h PRO 32 Ca -0.48 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2k04 h PRO 32 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k04 h PRO 32 CO 0.65 0.08 -0.07 -1.71 -0.23 0.00 0.00 178.00 176.72 2k04 n ASN 33 N -5.32 1.22 -4.36 1.44 2.85 -1.26 -4.91 115.26 104.92 2k04 n ASN 33 Ca 0.22 -1.26 -0.19 0.00 -0.11 0.00 0.00 54.58 53.23 2k04 n ASN 33 Cb 0.71 0.03 -0.10 0.00 1.24 0.00 0.00 39.78 41.65 2k04 n ASN 33 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k04 n ALA 35 N -0.42 0.00 -1.70 0.00 0.00 -1.26 -4.40 120.51 112.73 2k04 n ALA 35 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.93 2k04 n ALA 35 Cb 0.61 0.00 -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 1.41 0.84 -0.03 0.00 0.74 -1.25 -4.65 119.66 116.72 2k04 s GLN 37 Ca 0.77 -0.13 0.06 0.00 0.05 0.00 0.00 55.36 56.11 2k04 s GLN 37 Cb -0.55 -0.83 -0.01 0.00 1.10 0.00 0.00 33.01 32.72 2k04 s GLN 37 CO 0.35 -0.05 -0.21 0.42 -0.55 0.00 0.00 175.29 175.24 2k04 s ILE 38 N 0.79 1.72 -0.13 -2.34 1.01 -1.26 -0.33 121.20 120.66 2k04 s ILE 38 Ca -0.11 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.66 2k04 s ILE 38 Cb -0.14 -1.44 -0.00 0.00 0.01 0.00 0.00 42.46 40.89 2k04 s ILE 38 CO 0.00 0.49 -0.19 -0.69 0.00 0.00 0.00 174.94 174.55 2k04 s VAL 39 N -0.28 2.46 -0.14 2.92 1.01 0.10 0.71 120.40 127.20 2k04 s VAL 39 Ca 0.02 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 2k04 s VAL 39 Cb -0.11 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 2k04 s VAL 39 CO 0.01 0.54 -0.02 0.00 0.00 0.00 0.00 175.10 175.63 2k04 s ALA 40 N 0.53 3.10 -0.23 5.51 0.00 0.82 0.22 121.76 131.71 2k04 s ALA 40 Ca -0.12 -0.81 -0.12 0.00 0.00 0.00 0.00 51.96 50.91 2k04 s ALA 40 Cb -0.16 -1.55 -0.05 0.00 0.00 0.00 0.00 23.12 21.36 2k04 s ALA 40 CO 0.04 0.32 0.24 0.50 0.00 0.00 0.00 175.76 176.86 2k04 s ARG 41 N -0.00 4.10 0.53 0.00 3.52 -0.17 -1.39 118.95 125.54 2k04 s ARG 41 Ca 0.02 -0.12 0.02 0.00 -0.13 0.00 0.00 55.73 55.52 2k04 s ARG 41 Cb -0.13 -3.54 0.03 0.00 -1.56 0.00 0.00 34.95 29.75 2k04 s ARG 41 CO 0.02 0.02 0.75 -0.51 -0.81 0.00 0.00 175.30 174.77 2k04 s LEU 42 N 1.17 3.32 1.04 -0.88 1.43 0.15 -0.81 118.68 124.09 2k04 s LEU 42 Ca 0.11 -0.07 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 2k04 s LEU 42 Cb -0.14 -2.84 0.23 0.00 0.03 0.00 0.00 46.19 43.47 2k04 s LEU 42 CO 0.06 -1.10 1.24 -0.54 0.23 0.00 0.00 176.35 176.24 2k04 s LYS 43 N -4.71 0.03 -0.75 1.70 1.02 0.08 -4.62 119.74 112.49 2k04 s LYS 43 Ca 0.57 -0.25 -0.26 0.00 0.02 0.00 0.00 55.97 56.06 2k04 s LYS 43 Cb -0.10 -1.76 -0.05 0.00 -0.52 0.00 0.00 37.83 35.40 2k04 s LYS 43 CO 0.38 -2.85 2.00 1.21 -0.92 0.00 0.00 175.35 175.17 2k04 s ASN 44 N -4.49 4.99 0.00 2.83 2.47 -1.26 -1.83 114.94 117.65 2k04 s ASN 44 Ca 0.72 -0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.91 2k04 s ASN 44 Cb -0.07 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 2k04 s ASN 44 CO 0.54 -2.75 0.00 -3.20 -3.72 0.00 0.00 177.10 167.97 2k04 n ASN 45 N 14.22 0.00 -1.68 -4.21 5.15 -1.26 -5.13 115.26 122.34 2k04 n ASN 45 Ca 0.34 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 54.31 2k04 n ASN 45 Cb 0.49 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.74 2k04 n ASN 45 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2k04 n ASN 46 N 0.00 1.22 0.00 1.20 4.13 -0.76 -5.14 115.26 115.92 2k04 n ASN 46 Ca 0.00 -1.07 0.00 0.00 1.68 0.00 0.00 54.58 55.19 2k04 n ASN 46 Cb 0.00 0.03 0.00 0.00 -1.54 0.00 0.00 39.78 38.27 2k04 n ASN 46 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2k04 n ARG 47 N -0.03 0.00 -4.04 3.52 3.00 -1.26 -4.56 116.66 113.28 2k04 n ARG 47 Ca -0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.85 57.72 2k04 n ARG 47 Cb 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.36 2k04 n ARG 47 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2k04 s GLN 48 N 0.00 0.45 0.06 5.56 -0.21 -1.26 0.30 119.66 124.56 2k04 s GLN 48 Ca 0.00 -0.66 0.01 0.00 0.02 0.00 0.00 55.36 54.73 2k04 s GLN 48 Cb 0.00 -0.19 -0.03 0.00 1.00 0.00 0.00 33.01 33.78 2k04 s GLN 48 CO 0.00 0.03 -0.05 0.14 -2.12 0.00 0.00 175.29 173.29 2k04 s VAL 49 N -1.27 0.44 -0.17 1.09 -7.23 -0.48 -4.96 120.40 107.82 2k04 s VAL 49 Ca -0.10 -1.57 -0.08 0.00 -1.81 0.00 0.00 61.98 58.42 2k04 s VAL 49 Cb -0.09 -1.20 -0.04 0.00 0.56 0.00 0.00 36.38 35.60 2k04 s VAL 49 CO -0.00 -0.75 0.08 0.00 -0.31 0.00 0.00 175.10 174.12 2k04 s ILE 51 N 0.11 4.46 -0.45 0.00 -1.09 0.22 0.12 121.20 124.57 2k04 s ILE 51 Ca 0.06 -0.65 -0.28 0.00 -2.23 0.00 0.00 60.65 57.55 2k04 s ILE 51 Cb -0.12 -3.08 0.00 0.00 -1.58 0.00 0.00 42.46 37.68 2k04 s ILE 51 CO 0.00 0.24 1.51 -0.62 -1.23 0.00 0.00 174.94 174.84 2k04 s ASP 52 N -2.01 6.13 -0.12 3.58 -1.08 -0.69 -4.14 116.67 118.33 2k04 s ASP 52 Ca 0.25 0.72 0.01 0.00 -0.52 0.00 0.00 52.55 53.01 2k04 s ASP 52 Cb -0.12 -2.54 0.17 0.00 -1.46 0.00 0.00 42.92 38.98 2k04 s ASP 52 CO 0.17 -1.63 1.28 -0.81 0.52 0.00 0.00 175.17 174.70 2k04 n PRO 53 N 8.38 1.33 0.00 4.34 -0.04 -1.26 -2.78 135.00 144.97 2k04 n PRO 53 Ca 0.17 -0.79 0.00 0.00 -0.04 0.00 0.00 63.50 62.83 2k04 n PRO 53 Cb 0.48 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 0.11 -0.66 -2.06 0.54 5.02 -1.26 -4.80 118.16 115.05 2k04 n LYS 54 Ca 0.16 -0.42 -0.41 0.00 -2.02 0.00 0.00 58.31 55.62 2k04 n LYS 54 Cb 0.80 -0.92 -0.02 0.00 -0.02 0.00 0.00 35.03 34.87 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 -0.05 4.40 0.28 -0.35 1.43 -1.12 -4.87 118.68 118.41 2k04 s LEU 55 Ca 0.00 2.70 -0.02 0.00 -1.03 0.00 0.00 54.13 55.78 2k04 s LEU 55 Cb 0.00 -3.64 0.43 0.00 0.03 0.00 0.00 46.19 43.01 2k04 s LEU 55 CO 0.00 -0.62 1.92 0.50 0.23 0.00 0.00 176.35 178.38 2k04 h LYS 56 N 4.03 1.12 0.00 1.70 3.64 -1.96 0.13 116.57 125.23 2k04 h LYS 56 Ca -0.48 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 58.75 2k04 h LYS 56 Cb 1.22 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 2k04 h LYS 56 CO 0.70 0.74 -0.38 0.11 -2.27 0.00 0.00 179.45 178.35 2k04 h TRP 57 N 1.15 0.00 -0.09 1.91 5.08 -1.98 0.43 115.95 122.45 2k04 h TRP 57 Ca 0.38 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 60.27 2k04 h TRP 57 Cb 0.06 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.22 2k04 h TRP 57 CO -0.00 0.38 -0.28 0.82 -1.28 0.00 0.00 178.44 178.08 2k04 h ILE 58 N 0.00 1.40 0.05 0.12 1.08 -1.44 -1.49 117.51 117.24 2k04 h ILE 58 Ca -0.00 -1.62 -0.00 0.00 -0.39 0.00 0.00 64.86 62.84 2k04 h ILE 58 Cb 0.79 2.21 0.00 0.00 -3.07 0.00 0.00 36.82 36.76 2k04 h ILE 58 CO 0.05 0.47 -0.03 1.56 -0.69 0.00 0.00 178.15 179.51 2k04 h GLN 59 N -0.11 -0.07 -0.80 2.37 1.08 -0.51 0.14 115.11 117.22 2k04 h GLN 59 Ca -0.01 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.22 2k04 h GLN 59 Cb 0.90 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 28.30 2k04 h GLN 59 CO 0.06 -0.02 0.51 0.93 -0.95 0.00 0.00 178.83 179.36 2k04 h GLU 60 N -0.10 0.98 -0.06 1.46 4.39 -1.01 -0.50 114.58 119.73 2k04 h GLU 60 Ca -0.01 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.63 2k04 h GLU 60 Cb 0.08 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 28.50 2k04 h GLU 60 CO 0.01 0.65 0.04 -0.92 -1.16 0.00 0.00 179.01 177.63 2k04 h TYR 61 N 1.01 0.08 -0.21 4.33 3.20 -0.53 -0.25 116.97 124.60 2k04 h TYR 61 Ca 0.31 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.23 2k04 h TYR 61 Cb -0.02 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.17 2k04 h TYR 61 CO -0.03 0.08 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.38 2k04 h LEU 62 N 0.06 -0.41 -1.12 2.82 3.38 -0.44 -1.66 115.31 117.93 2k04 h LEU 62 Ca 0.02 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.12 2k04 h LEU 62 Cb 0.02 0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 2k04 h LEU 62 CO -0.00 -0.16 0.60 -0.33 0.09 0.00 0.00 178.44 178.63 2k04 h GLU 63 N -0.11 1.12 0.00 1.13 5.08 -0.59 -2.12 114.58 119.09 2k04 h GLU 63 Ca 0.12 -0.07 -0.19 0.00 -1.00 0.00 0.00 59.36 58.22 2k04 h GLU 63 Cb 0.29 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2k04 h GLU 63 CO -0.28 0.74 -0.89 0.87 -1.00 0.00 0.00 179.01 178.44 2k04 h LYS 64 N 1.15 0.02 0.00 2.33 1.79 -0.81 -3.20 116.57 117.84 2k04 h LYS 64 Ca 0.36 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.80 2k04 h LYS 64 Cb 0.00 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.66 2k04 h LYS 64 CO -0.11 0.90 -0.03 0.00 -1.08 0.00 0.00 179.45 179.13 2k04 h LEU 66 N 0.00 0.37 -5.93 0.00 -0.00 -1.53 -3.36 115.31 104.87 2k04 h LEU 66 Ca -0.00 0.11 0.10 0.00 -0.00 0.00 0.00 57.88 58.09 2k04 h LEU 66 Cb 0.05 0.06 -0.20 0.00 -0.00 0.00 0.00 40.66 40.57 2k04 h LEU 66 CO 0.00 -0.02 -0.23 0.21 -0.00 0.00 0.00 178.44 178.40 2k04 s ASN 67 N -4.97 -1.05 0.00 -0.43 3.84 -0.99 -5.18 114.94 106.17 2k04 s ASN 67 Ca -0.08 -0.00 0.00 0.00 0.21 0.00 0.00 52.86 52.99 2k04 s ASN 67 Cb 0.27 1.60 0.00 0.00 -0.55 0.00 0.00 41.25 42.57 2k04 s ASN 67 CO 0.81 -0.18 0.00 2.29 -2.79 0.00 0.00 177.10 177.23