#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 3.60 -0.35 1.97 0.04 -1.26 -5.07 135.00 133.93 2k04 s PRO 2 Ca 0.00 -0.04 0.04 0.00 0.04 0.00 0.00 61.00 61.03 2k04 s PRO 2 Cb 0.00 -2.62 0.16 0.00 0.04 0.00 0.00 34.50 32.08 2k04 s PRO 2 CO 0.00 0.16 0.43 0.54 0.04 0.00 0.00 177.00 178.17 2k04 s VAL 3 N -2.19 -0.55 -0.40 -0.36 0.11 -1.26 -5.12 120.40 110.63 2k04 s VAL 3 Ca 0.43 -0.57 -0.18 0.00 -2.93 0.00 0.00 61.98 58.73 2k04 s VAL 3 Cb -0.10 -0.66 0.01 0.00 -1.53 0.00 0.00 36.38 34.09 2k04 s VAL 3 CO 0.32 -0.38 0.52 -0.44 -3.33 0.00 0.00 175.10 171.80 2k04 s SER 4 N 1.89 6.28 -1.07 3.54 0.01 -1.26 -4.97 113.70 118.11 2k04 s SER 4 Ca 0.14 -0.32 -0.15 0.00 1.31 0.00 0.00 55.95 56.94 2k04 s SER 4 Cb -0.12 -2.27 0.18 0.00 0.21 0.00 0.00 66.02 64.02 2k04 s SER 4 CO -0.14 -0.59 1.23 -0.76 0.41 0.00 0.00 173.24 173.40 2k04 s LEU 5 N 2.42 5.39 0.00 2.44 1.02 -1.26 -4.82 118.68 123.87 2k04 s LEU 5 Ca 0.18 -2.76 -0.03 0.00 0.02 0.00 0.00 54.13 51.53 2k04 s LEU 5 Cb -0.16 -2.36 0.01 0.00 0.02 0.00 0.00 46.19 43.71 2k04 s LEU 5 CO 0.15 -0.76 0.19 -1.20 0.02 0.00 0.00 176.35 174.75 2k04 n SER 6 N 5.35 -0.55 -4.43 2.29 7.64 -1.26 -5.04 113.62 117.62 2k04 n SER 6 Ca 0.29 -1.40 -0.43 0.00 1.01 0.00 0.00 58.87 58.34 2k04 n SER 6 Cb 0.45 0.92 -0.00 0.00 -1.01 0.00 0.00 64.21 64.56 2k04 n SER 6 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2k04 n TYR 7 N -0.13 4.47 -4.44 1.43 4.02 -1.26 -4.89 117.16 116.35 2k04 n TYR 7 Ca -0.02 -2.86 -0.22 0.00 -0.01 0.00 0.00 57.90 54.79 2k04 n TYR 7 Cb 0.15 -2.63 -0.10 0.00 -0.02 0.00 0.00 39.34 36.74 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 4.06 1.59 0.43 -0.72 1.81 -1.26 -4.62 118.95 120.24 2k04 s ARG 8 Ca 0.53 -1.82 0.01 0.00 -1.72 0.00 0.00 55.73 52.73 2k04 s ARG 8 Cb 0.06 -1.17 -0.00 0.00 -0.45 0.00 0.00 34.95 33.39 2k04 s ARG 8 CO 0.05 0.01 0.64 0.00 -0.68 0.00 0.00 175.30 175.32 2k04 h PRO 10 N 0.47 0.00 -6.24 0.00 0.13 -1.95 -3.46 132.00 120.95 2k04 h PRO 10 Ca -0.46 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.22 2k04 h PRO 10 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2k04 h PRO 10 CO 0.57 0.90 -0.40 0.00 -0.23 0.00 0.00 178.00 178.84 2k04 h ARG 12 N 1.07 0.17 -5.53 0.00 1.12 -2.04 -3.47 114.38 105.71 2k04 h ARG 12 Ca -0.49 -0.30 -0.45 0.00 -1.11 0.00 0.00 59.98 57.63 2k04 h ARG 12 Cb 1.24 0.11 -0.14 0.00 -0.01 0.00 0.00 29.97 31.17 2k04 h ARG 12 CO 0.58 1.14 -0.72 -0.06 -3.11 0.00 0.00 179.97 177.80 2k04 s PHE 13 N -2.43 1.73 0.08 2.20 0.08 -1.26 -5.16 117.98 113.23 2k04 s PHE 13 Ca -0.21 -0.61 0.06 0.00 0.12 0.00 0.00 56.93 56.29 2k04 s PHE 13 Cb 0.04 -0.85 -0.03 0.00 -0.57 0.00 0.00 43.02 41.61 2k04 s PHE 13 CO 0.73 0.32 -0.17 -0.59 -0.10 0.00 0.00 175.22 175.42 2k04 s PHE 14 N -3.00 1.42 -0.09 0.36 -0.71 -1.26 -4.74 117.98 109.95 2k04 s PHE 14 Ca 0.24 -0.45 -0.06 0.00 -1.04 0.00 0.00 56.93 55.62 2k04 s PHE 14 Cb 0.00 -0.79 -0.04 0.00 -1.21 0.00 0.00 43.02 40.98 2k04 s PHE 14 CO 0.08 0.11 0.14 -1.21 -1.34 0.00 0.00 175.22 173.00 2k04 s GLU 15 N -1.85 3.40 -0.09 1.99 0.41 0.23 -4.87 118.70 117.92 2k04 s GLU 15 Ca 0.01 -0.20 -0.09 0.00 -0.41 0.00 0.00 54.97 54.29 2k04 s GLU 15 Cb -0.10 -3.14 -0.03 0.00 -1.78 0.00 0.00 34.13 29.08 2k04 s GLU 15 CO 0.03 0.75 -0.18 0.45 -0.49 0.00 0.00 175.26 175.82 2k04 n SER 16 N 1.74 0.99 -4.48 -0.19 2.88 -1.26 -0.24 113.62 113.06 2k04 n SER 16 Ca -0.18 0.17 -0.44 0.00 -1.33 0.00 0.00 58.87 57.09 2k04 n SER 16 Cb 0.54 -0.62 -0.01 0.00 -0.75 0.00 0.00 64.21 63.37 2k04 n SER 16 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2k04 s HIS 17 N -1.98 3.23 0.05 0.66 5.65 -1.26 -4.56 115.29 117.07 2k04 s HIS 17 Ca -0.15 -1.73 0.03 0.00 0.25 0.00 0.00 55.06 53.46 2k04 s HIS 17 Cb 0.02 -4.37 -0.04 0.00 -1.18 0.00 0.00 32.58 27.01 2k04 s HIS 17 CO 0.22 -1.51 0.02 0.08 -0.65 0.00 0.00 174.74 172.91 2k04 s VAL 18 N 2.46 4.24 -0.19 0.89 1.01 -1.26 -5.07 120.40 122.47 2k04 s VAL 18 Ca 0.40 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 2k04 s VAL 18 Cb -0.03 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 2k04 s VAL 18 CO -0.03 0.23 1.35 0.00 0.00 0.00 0.00 175.10 176.65 2k04 s ALA 19 N -1.24 3.54 -0.16 5.51 0.00 -1.26 -4.89 121.76 123.27 2k04 s ALA 19 Ca 0.24 0.42 0.29 0.00 0.00 0.00 0.00 51.96 52.91 2k04 s ALA 19 Cb -0.12 -3.70 1.22 0.00 0.00 0.00 0.00 23.12 20.53 2k04 s ALA 19 CO 0.16 -1.42 1.86 -0.09 0.00 0.00 0.00 175.76 176.27 2k04 h ARG 20 N 8.87 0.00 0.00 0.00 1.12 -1.97 -0.92 114.38 121.47 2k04 h ARG 20 Ca -0.28 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.59 2k04 h ARG 20 Cb 1.11 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.07 2k04 h ARG 20 CO 0.99 0.00 -0.22 0.00 -3.11 0.00 0.00 179.97 177.62 2k04 n ALA 21 N -1.94 2.73 -0.47 2.80 0.00 -1.26 -3.92 120.51 118.45 2k04 n ALA 21 Ca 0.01 -0.17 0.08 0.00 0.00 0.00 0.00 53.44 53.36 2k04 n ALA 21 Cb 0.26 -1.33 0.26 0.00 0.00 0.00 0.00 19.45 18.64 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 -1.73 3.83 -4.49 0.00 5.15 -0.35 -4.93 115.26 112.74 2k04 n ASN 22 Ca 0.06 -2.29 -0.28 0.00 -0.60 0.00 0.00 54.58 51.47 2k04 n ASN 22 Cb 0.37 -0.43 -0.11 0.00 -0.53 0.00 0.00 39.78 39.08 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 -1.53 2.76 -0.20 3.44 0.11 -1.23 0.10 120.40 123.84 2k04 s VAL 23 Ca 0.39 -1.73 0.13 0.00 -2.93 0.00 0.00 61.98 57.85 2k04 s VAL 23 Cb 0.24 -2.31 -0.22 0.00 -1.53 0.00 0.00 36.38 32.56 2k04 s VAL 23 CO 0.21 -0.03 0.00 0.29 -3.33 0.00 0.00 175.10 172.24 2k04 n LYS 24 N 0.41 0.86 -3.71 1.54 5.02 0.91 -4.71 118.16 118.47 2k04 n LYS 24 Ca -0.13 0.02 0.03 0.00 -2.02 0.00 0.00 58.31 56.21 2k04 n LYS 24 Cb 0.55 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 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 -2.46 -0.01 0.05 2.13 -3.43 -1.25 -5.05 115.29 105.27 2k04 s HIS 25 Ca -0.14 -0.06 0.07 0.00 -0.80 0.00 0.00 55.06 54.13 2k04 s HIS 25 Cb 0.06 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 31.71 2k04 s HIS 25 CO 0.72 -0.18 -0.18 -0.51 -2.00 0.00 0.00 174.74 172.59 2k04 s LEU 26 N -3.24 2.64 -0.17 5.38 1.43 -1.26 -2.56 118.68 120.90 2k04 s LEU 26 Ca 0.19 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2k04 s LEU 26 Cb 0.04 -1.53 0.03 0.00 0.03 0.00 0.00 46.19 44.76 2k04 s LEU 26 CO -0.04 0.24 -0.16 -0.75 0.23 0.00 0.00 176.35 175.87 2k04 s LYS 27 N -1.56 2.56 -0.14 1.70 2.20 0.36 -4.97 119.74 119.90 2k04 s LYS 27 Ca 0.15 -0.76 -0.05 0.00 -0.36 0.00 0.00 55.97 54.96 2k04 s LYS 27 Cb -0.11 -2.39 -0.04 0.00 -1.51 0.00 0.00 37.83 33.79 2k04 s LYS 27 CO 0.06 -0.27 0.02 0.42 -0.36 0.00 0.00 175.35 175.23 2k04 s ILE 28 N 1.37 4.47 -0.15 5.43 1.01 -1.26 -0.40 121.20 131.66 2k04 s ILE 28 Ca 0.03 -0.16 -0.06 0.00 0.00 0.00 0.00 60.65 60.46 2k04 s ILE 28 Cb -0.14 -2.95 0.07 0.00 0.01 0.00 0.00 42.46 39.45 2k04 s ILE 28 CO -0.11 0.53 0.32 -0.22 0.00 0.00 0.00 174.94 175.46 2k04 s LEU 29 N -0.12 -0.18 -0.35 2.97 0.20 0.14 -5.02 118.68 116.32 2k04 s LEU 29 Ca 0.05 0.72 -0.18 0.00 0.69 0.00 0.00 54.13 55.41 2k04 s LEU 29 Cb -0.12 0.97 -0.00 0.00 -0.43 0.00 0.00 46.19 46.60 2k04 s LEU 29 CO 0.02 -0.21 0.52 0.21 -0.29 0.00 0.00 176.35 176.59 2k04 s ASN 30 N 2.01 6.33 0.46 3.68 2.47 -1.26 -1.16 114.94 127.47 2k04 s ASN 30 Ca -0.04 0.00 -0.02 0.00 0.42 0.00 0.00 52.86 53.23 2k04 s ASN 30 Cb -0.11 -2.27 -0.01 0.00 -1.45 0.00 0.00 41.25 37.41 2k04 s ASN 30 CO -0.10 -0.48 0.71 0.42 -3.72 0.00 0.00 177.10 173.93 2k04 s THR 31 N 2.41 4.24 -0.08 -5.21 -4.23 -1.25 -4.96 115.64 106.55 2k04 s THR 31 Ca 0.19 -0.30 -0.25 0.00 -1.18 0.00 0.00 61.69 60.15 2k04 s THR 31 Cb -0.15 -3.59 -0.28 0.00 1.34 0.00 0.00 72.50 69.82 2k04 s THR 31 CO 0.13 -0.47 0.89 -0.65 -0.54 0.00 0.00 174.62 173.98 2k04 h PRO 32 N 0.32 0.17 0.00 3.99 0.11 -1.92 -3.37 132.00 131.31 2k04 h PRO 32 Ca -0.47 -0.26 0.00 0.00 0.11 0.00 0.00 66.00 65.38 2k04 h PRO 32 Cb 1.24 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2k04 h PRO 32 CO 0.59 1.08 0.00 -1.71 -0.21 0.00 0.00 178.00 177.76 2k04 n ASN 33 N -4.38 0.62 -4.17 -2.05 5.15 -1.26 -4.78 115.26 104.39 2k04 n ASN 33 Ca -0.11 0.58 -0.11 0.00 -0.60 0.00 0.00 54.58 54.33 2k04 n ASN 33 Cb 0.63 -0.74 -0.10 0.00 -0.53 0.00 0.00 39.78 39.04 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 -0.06 -4.11 -1.70 0.00 0.00 -1.26 -3.93 120.51 109.46 2k04 n ALA 35 Ca -0.12 -1.62 -0.44 0.00 0.00 0.00 0.00 53.44 51.27 2k04 n ALA 35 Cb 0.61 -0.12 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 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 -0.11 1.19 -0.08 0.00 2.00 -0.31 -4.58 119.66 117.77 2k04 s GLN 37 Ca 0.69 -0.82 0.03 0.00 -2.00 0.00 0.00 55.36 53.26 2k04 s GLN 37 Cb -0.59 -1.25 0.01 0.00 0.80 0.00 0.00 33.01 31.98 2k04 s GLN 37 CO 0.46 0.32 -0.17 0.42 -0.50 0.00 0.00 175.29 175.82 2k04 s ILE 38 N -0.77 1.53 -0.12 -2.34 1.01 -1.22 -0.69 121.20 118.61 2k04 s ILE 38 Ca 0.05 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 60.01 2k04 s ILE 38 Cb -0.08 -1.36 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 2k04 s ILE 38 CO 0.01 0.44 -0.18 0.54 0.00 0.00 0.00 174.94 175.75 2k04 s VAL 39 N 0.54 2.58 0.02 2.92 0.11 0.46 0.89 120.40 127.92 2k04 s VAL 39 Ca -0.16 -0.83 0.03 0.00 -2.93 0.00 0.00 61.98 58.09 2k04 s VAL 39 Cb -0.17 -2.05 -0.04 0.00 -1.53 0.00 0.00 36.38 32.60 2k04 s VAL 39 CO 0.06 0.54 -0.05 0.00 -3.33 0.00 0.00 175.10 172.32 2k04 s ALA 40 N 0.37 3.09 -0.17 1.54 0.00 0.42 -0.49 121.76 126.52 2k04 s ALA 40 Ca -0.14 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 50.71 2k04 s ALA 40 Cb -0.17 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 2k04 s ALA 40 CO 0.07 0.63 0.04 1.03 0.00 0.00 0.00 175.76 177.53 2k04 s ARG 41 N -1.62 3.88 0.49 0.00 0.52 -1.06 -1.23 118.95 119.93 2k04 s ARG 41 Ca 0.19 -0.38 -0.08 0.00 -0.52 0.00 0.00 55.73 54.94 2k04 s ARG 41 Cb -0.11 -3.14 -0.04 0.00 0.52 0.00 0.00 34.95 32.17 2k04 s ARG 41 CO 0.10 0.29 0.83 -0.51 0.02 0.00 0.00 175.30 176.03 2k04 s LEU 42 N 0.30 3.60 0.00 2.53 1.43 0.28 -0.07 118.68 126.76 2k04 s LEU 42 Ca 0.02 1.08 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 2k04 s LEU 42 Cb -0.13 -4.03 0.00 0.00 0.03 0.00 0.00 46.19 42.06 2k04 s LEU 42 CO 0.01 -0.59 0.00 0.29 0.23 0.00 0.00 176.35 176.29 2k04 n LYS 43 N -2.11 0.00 -0.04 1.70 5.02 0.11 -4.65 118.16 118.19 2k04 n LYS 43 Ca 0.02 0.23 -0.10 0.00 -2.02 0.00 0.00 58.31 56.44 2k04 n LYS 43 Cb 0.55 -0.69 -0.03 0.00 -0.02 0.00 0.00 35.03 34.83 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 -1.87 0.90 -4.54 4.39 4.05 -1.26 -4.90 115.26 112.02 2k04 n ASN 44 Ca 0.00 0.15 -0.42 0.00 0.45 0.00 0.00 54.58 54.76 2k04 n ASN 44 Cb 0.00 -0.35 -0.03 0.00 1.23 0.00 0.00 39.78 40.62 2k04 n ASN 44 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 2k04 s ASN 45 N -5.97 6.27 0.20 1.20 2.47 -1.26 -4.84 114.94 113.01 2k04 s ASN 45 Ca -0.14 -0.37 0.00 0.00 0.42 0.00 0.00 52.86 52.77 2k04 s ASN 45 Cb 0.05 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.34 2k04 s ASN 45 CO 0.19 -1.57 0.00 0.59 -3.72 0.00 0.00 177.10 172.59 2k04 n ASN 46 N 8.50 -1.00 0.00 -4.21 3.02 -1.26 -4.89 115.26 115.42 2k04 n ASN 46 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 2k04 n ASN 46 Cb 0.48 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 2k04 n ASN 46 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2k04 n ARG 47 N -0.26 0.00 -4.03 3.52 3.00 -1.26 -4.55 116.66 113.07 2k04 n ARG 47 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.85 57.68 2k04 n ARG 47 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.31 2k04 n ARG 47 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 2k04 s GLN 48 N -0.99 0.32 0.09 5.56 -2.07 -1.26 0.10 119.66 121.41 2k04 s GLN 48 Ca 0.00 -0.07 0.02 0.00 -1.82 0.00 0.00 55.36 53.50 2k04 s GLN 48 Cb 0.00 -0.36 -0.04 0.00 -1.09 0.00 0.00 33.01 31.52 2k04 s GLN 48 CO 0.00 0.01 -0.08 0.14 -1.32 0.00 0.00 175.29 174.04 2k04 s VAL 49 N 0.28 0.75 -0.08 3.63 -7.23 -0.36 -4.98 120.40 112.41 2k04 s VAL 49 Ca -0.03 -1.73 -0.05 0.00 -1.81 0.00 0.00 61.98 58.36 2k04 s VAL 49 Cb -0.06 -1.44 -0.04 0.00 0.56 0.00 0.00 36.38 35.41 2k04 s VAL 49 CO -0.01 -0.71 0.13 0.00 -0.31 0.00 0.00 175.10 174.19 2k04 s ILE 51 N -1.10 2.39 -0.16 0.00 -1.09 0.26 0.76 121.20 122.26 2k04 s ILE 51 Ca 0.18 -1.45 -0.29 0.00 -2.23 0.00 0.00 60.65 56.86 2k04 s ILE 51 Cb -0.12 -2.00 -0.01 0.00 -1.58 0.00 0.00 42.46 38.75 2k04 s ILE 51 CO 0.08 0.26 1.22 -0.62 -1.23 0.00 0.00 174.94 174.65 2k04 s ASP 52 N -1.59 6.99 0.00 3.58 2.15 0.66 -3.37 116.67 125.09 2k04 s ASP 52 Ca 0.14 1.66 0.19 0.00 0.43 0.00 0.00 52.55 54.96 2k04 s ASP 52 Cb -0.10 -2.54 1.12 0.00 -0.30 0.00 0.00 42.92 41.10 2k04 s ASP 52 CO 0.05 -0.72 1.55 -0.81 -0.17 0.00 0.00 175.17 175.07 2k04 n PRO 53 N 6.36 0.55 -0.26 4.34 -0.04 -1.26 -2.57 135.00 142.12 2k04 n PRO 53 Ca 0.13 0.02 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 2k04 n PRO 53 Cb 0.45 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.67 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 -1.05 2.60 -1.71 0.54 5.02 -1.26 -4.46 118.16 117.84 2k04 n LYS 54 Ca 0.14 -2.45 -0.38 0.00 -2.02 0.00 0.00 58.31 53.60 2k04 n LYS 54 Cb 0.08 -1.54 0.06 0.00 -0.02 0.00 0.00 35.03 33.61 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 1.57 5.42 -0.27 -0.35 4.77 -1.06 -4.76 117.00 122.31 2k04 n LEU 55 Ca 0.21 0.86 -0.05 0.00 -0.03 0.00 0.00 56.01 57.00 2k04 n LEU 55 Cb 0.62 -1.52 0.06 0.00 -2.33 0.00 0.00 43.42 40.24 2k04 n LEU 55 CO 0.16 -1.09 1.13 0.50 -1.33 0.00 0.00 177.39 176.76 2k04 h LYS 56 N 0.73 1.03 0.00 3.23 1.63 -1.93 0.37 116.57 121.63 2k04 h LYS 56 Ca -0.50 -0.11 -0.07 0.00 -0.85 0.00 0.00 60.65 59.12 2k04 h LYS 56 Cb 1.34 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.75 2k04 h LYS 56 CO 0.53 0.76 -0.31 0.11 -3.45 0.00 0.00 179.45 177.09 2k04 h TRP 57 N 1.03 0.00 -0.06 1.91 5.08 -1.98 -2.11 115.95 119.82 2k04 h TRP 57 Ca 0.27 0.00 -0.24 0.00 1.08 0.00 0.00 58.89 59.99 2k04 h TRP 57 Cb 0.01 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.18 2k04 h TRP 57 CO -0.00 0.31 -0.92 0.82 -1.28 0.00 0.00 178.44 177.37 2k04 h ILE 58 N 0.00 1.30 -0.05 0.12 1.08 -1.60 -2.38 117.51 115.98 2k04 h ILE 58 Ca -0.00 -2.16 0.03 0.00 -0.39 0.00 0.00 64.86 62.34 2k04 h ILE 58 Cb 0.65 2.22 -0.04 0.00 -3.07 0.00 0.00 36.82 36.58 2k04 h ILE 58 CO 0.04 0.67 -0.17 1.56 -0.69 0.00 0.00 178.15 179.56 2k04 h GLN 59 N 0.43 -0.24 -0.44 2.37 1.08 0.28 0.69 115.11 119.28 2k04 h GLN 59 Ca -0.09 0.02 -0.13 0.00 -1.45 0.00 0.00 58.65 57.00 2k04 h GLN 59 Cb 1.56 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 29.03 2k04 h GLN 59 CO 0.18 -0.16 -0.24 0.93 -0.95 0.00 0.00 178.83 178.59 2k04 h GLU 60 N -0.25 0.91 -0.08 1.46 4.39 -1.50 -0.19 114.58 119.32 2k04 h GLU 60 Ca 0.07 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.38 2k04 h GLU 60 Cb 0.34 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2k04 h GLU 60 CO -0.19 1.05 0.05 -0.92 -1.16 0.00 0.00 179.01 177.83 2k04 h TYR 61 N 0.78 0.10 -0.03 4.33 5.03 -0.93 0.03 116.97 126.28 2k04 h TYR 61 Ca 0.10 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.40 2k04 h TYR 61 Cb 0.80 -0.03 -0.00 0.00 1.55 0.00 0.00 36.73 39.05 2k04 h TYR 61 CO 0.05 0.07 -0.02 -0.07 -1.32 0.00 0.00 178.16 176.87 2k04 h LEU 62 N 0.09 0.06 -0.50 2.82 3.38 -0.76 -1.08 115.31 119.33 2k04 h LEU 62 Ca 0.03 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.58 2k04 h LEU 62 Cb 0.00 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2k04 h LEU 62 CO -0.01 0.51 0.25 -0.33 0.09 0.00 0.00 178.44 178.95 2k04 h GLU 63 N -0.39 0.48 0.00 1.13 5.08 -0.94 -2.71 114.58 117.23 2k04 h GLU 63 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2k04 h GLU 63 Cb 0.49 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2k04 h GLU 63 CO 0.01 0.31 -0.64 1.63 -1.00 0.00 0.00 179.01 179.32 2k04 n LYS 64 N -4.89 0.14 0.07 2.33 4.76 -0.01 -4.06 118.16 116.50 2k04 n LYS 64 Ca 0.04 0.02 -0.11 0.00 -2.87 0.00 0.00 58.31 55.39 2k04 n LYS 64 Cb 0.13 -1.57 -0.05 0.00 -1.84 0.00 0.00 35.03 31.70 2k04 n LYS 64 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k04 n LEU 66 N -5.34 0.59 0.16 0.00 -0.00 -1.24 -2.07 117.00 109.11 2k04 n LEU 66 Ca -0.05 0.60 0.08 0.00 -0.00 0.00 0.00 56.01 56.64 2k04 n LEU 66 Cb 0.25 -0.46 0.08 0.00 -0.00 0.00 0.00 43.42 43.29 2k04 n LEU 66 CO 0.24 -0.32 0.48 -1.13 -0.00 0.00 0.00 177.39 176.66 2k04 h ASN 67 N 0.00 0.00 0.00 1.45 -0.73 -1.52 -3.53 115.58 111.24 2k04 h ASN 67 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2k04 h ASN 67 Cb 0.52 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.11 2k04 h ASN 67 CO 0.00 0.19 0.00 0.29 -0.37 0.00 0.00 177.43 177.54