#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k05 s PRO 2 N 0.00 3.20 -0.65 -1.58 0.04 -1.26 -5.03 135.00 129.72 2k05 s PRO 2 Ca 0.00 -0.18 -0.22 0.00 0.04 0.00 0.00 61.00 60.64 2k05 s PRO 2 Cb 0.00 -2.45 0.07 0.00 0.04 0.00 0.00 34.50 32.16 2k05 s PRO 2 CO 0.00 -0.31 0.94 0.08 0.04 0.00 0.00 177.00 177.75 2k05 s VAL 3 N -2.68 4.37 -0.26 -0.36 1.01 -1.26 -4.97 120.40 116.26 2k05 s VAL 3 Ca 0.48 -0.41 -0.00 0.00 0.00 0.00 0.00 61.98 62.05 2k05 s VAL 3 Cb -0.10 -4.66 0.07 0.00 0.00 0.00 0.00 36.38 31.69 2k05 s VAL 3 CO 0.41 -1.42 0.01 -0.94 0.00 0.00 0.00 175.10 173.16 2k05 s SER 4 N 3.66 3.78 -0.22 3.32 1.04 -1.26 -5.09 113.70 118.94 2k05 s SER 4 Ca 0.21 -1.31 0.00 0.00 0.48 0.00 0.00 55.95 55.33 2k05 s SER 4 Cb -0.17 -1.02 0.03 0.00 0.10 0.00 0.00 66.02 64.96 2k05 s SER 4 CO 0.10 -0.31 -0.13 -0.76 0.98 0.00 0.00 173.24 173.12 2k05 s LEU 5 N 1.50 2.82 0.25 2.42 1.43 -1.26 -5.09 118.68 120.75 2k05 s LEU 5 Ca 0.01 -0.89 -0.11 0.00 -1.03 0.00 0.00 54.13 52.11 2k05 s LEU 5 Cb -0.18 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 2k05 s LEU 5 CO -0.12 -0.09 0.44 -0.44 0.23 0.00 0.00 176.35 176.38 2k05 s SER 6 N 1.27 -0.02 -0.97 2.29 0.01 -1.26 -5.08 113.70 109.95 2k05 s SER 6 Ca 0.00 -1.01 -0.22 0.00 1.31 0.00 0.00 55.95 56.03 2k05 s SER 6 Cb -0.16 0.57 0.07 0.00 0.21 0.00 0.00 66.02 66.71 2k05 s SER 6 CO -0.08 -1.12 1.34 -0.31 0.41 0.00 0.00 173.24 173.48 2k05 s TYR 7 N -3.97 2.67 0.05 2.43 2.02 -1.26 -4.92 117.35 114.36 2k05 s TYR 7 Ca 0.25 -0.92 0.02 0.00 -0.37 0.00 0.00 57.07 56.04 2k05 s TYR 7 Cb 0.00 -4.57 -0.03 0.00 -0.40 0.00 0.00 41.96 36.96 2k05 s TYR 7 CO 0.10 -1.82 -0.07 1.03 -1.57 0.00 0.00 175.55 173.22 2k05 s ARG 8 N 4.41 0.54 -0.16 -0.62 1.81 -1.26 -5.05 118.95 118.61 2k05 s ARG 8 Ca 0.41 -0.83 -0.07 0.00 -1.72 0.00 0.00 55.73 53.52 2k05 s ARG 8 Cb -0.02 -0.19 -0.04 0.00 -0.45 0.00 0.00 34.95 34.25 2k05 s ARG 8 CO -0.08 0.02 0.07 0.00 -0.68 0.00 0.00 175.30 174.63 2k05 h PRO 10 N 6.20 -1.02 -4.91 0.00 0.13 -2.00 -3.37 132.00 127.03 2k05 h PRO 10 Ca -0.42 0.07 -0.64 0.00 -0.87 0.00 0.00 66.00 64.14 2k05 h PRO 10 Cb 1.18 0.23 -0.18 0.00 0.13 0.00 0.00 31.00 32.36 2k05 h PRO 10 CO 0.67 -0.68 -0.54 0.00 -0.23 0.00 0.00 178.00 177.21 2k05 h ARG 12 N 8.34 0.00 -5.23 0.00 9.65 -2.02 -3.43 114.38 121.69 2k05 h ARG 12 Ca -0.36 0.00 -0.43 0.00 -1.10 0.00 0.00 59.98 58.09 2k05 h ARG 12 Cb 1.19 0.00 -0.25 0.00 -1.39 0.00 0.00 29.97 29.52 2k05 h ARG 12 CO 0.56 0.52 -0.79 -0.06 2.80 0.00 0.00 179.97 183.00 2k05 s PHE 13 N -3.14 1.16 0.06 2.20 0.08 -1.26 -5.14 117.98 111.94 2k05 s PHE 13 Ca 0.02 -0.35 0.03 0.00 0.12 0.00 0.00 56.93 56.75 2k05 s PHE 13 Cb 0.09 -0.69 -0.03 0.00 -0.57 0.00 0.00 43.02 41.82 2k05 s PHE 13 CO 0.73 0.02 -0.09 -0.59 -0.10 0.00 0.00 175.22 175.20 2k05 s PHE 14 N -0.83 0.82 0.40 0.36 -0.12 -1.26 -4.74 117.98 112.61 2k05 s PHE 14 Ca 0.01 -0.55 -0.12 0.00 -0.05 0.00 0.00 56.93 56.22 2k05 s PHE 14 Cb -0.08 -0.48 -0.07 0.00 -0.63 0.00 0.00 43.02 41.76 2k05 s PHE 14 CO 0.01 -0.06 0.78 -1.21 -0.05 0.00 0.00 175.22 174.69 2k05 s GLU 15 N -1.95 3.83 0.17 1.99 8.01 0.24 -4.89 118.70 126.11 2k05 s GLU 15 Ca -0.05 0.54 0.00 0.00 0.01 0.00 0.00 54.97 55.47 2k05 s GLU 15 Cb -0.08 -2.38 0.00 0.00 -4.31 0.00 0.00 34.13 27.36 2k05 s GLU 15 CO 0.00 -0.01 0.00 0.43 0.01 0.00 0.00 175.26 175.69 2k05 n SER 16 N -1.13 0.57 -1.75 -0.19 7.64 -1.26 -1.87 113.62 115.62 2k05 n SER 16 Ca 0.03 0.28 -0.11 0.00 1.01 0.00 0.00 58.87 60.08 2k05 n SER 16 Cb 0.54 -0.03 0.03 0.00 -1.01 0.00 0.00 64.21 63.74 2k05 n SER 16 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2k05 n HIS 17 N -3.47 1.04 -2.40 1.43 -0.00 -1.26 -4.83 115.22 105.72 2k05 n HIS 17 Ca 0.00 -1.63 -0.32 0.00 -0.00 0.00 0.00 57.72 55.77 2k05 n HIS 17 Cb 0.01 -0.80 -0.03 0.00 -0.00 0.00 0.00 29.99 29.17 2k05 n HIS 17 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2k05 s VAL 18 N -1.53 4.56 -0.03 3.57 0.11 -1.26 -5.01 120.40 120.81 2k05 s VAL 18 Ca 0.21 1.16 -0.18 0.00 -2.93 0.00 0.00 61.98 60.23 2k05 s VAL 18 Cb 0.16 -3.73 -0.05 0.00 -1.53 0.00 0.00 36.38 31.23 2k05 s VAL 18 CO -0.00 -0.70 0.52 0.00 -3.33 0.00 0.00 175.10 171.59 2k05 s ALA 19 N -2.64 3.54 0.28 1.54 0.00 -1.26 -4.95 121.76 118.27 2k05 s ALA 19 Ca 0.58 -0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.47 2k05 s ALA 19 Cb -0.10 -2.63 0.62 0.00 0.00 0.00 0.00 23.12 21.01 2k05 s ALA 19 CO 0.32 0.22 1.75 -0.09 0.00 0.00 0.00 175.76 177.96 2k05 h ARG 20 N 5.60 0.58 0.00 0.00 9.65 -1.95 -0.59 114.38 127.67 2k05 h ARG 20 Ca -0.46 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 2k05 h ARG 20 Cb 1.20 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.65 2k05 h ARG 20 CO 0.69 0.38 -0.11 0.00 2.80 0.00 0.00 179.97 183.73 2k05 n ALA 21 N -2.42 2.57 0.82 2.80 0.00 -1.26 -3.63 120.51 119.39 2k05 n ALA 21 Ca 0.19 -0.15 0.10 0.00 0.00 0.00 0.00 53.44 53.59 2k05 n ALA 21 Cb 0.51 -1.40 -0.11 0.00 0.00 0.00 0.00 19.45 18.45 2k05 n ALA 21 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k05 n ASN 22 N -1.57 0.81 -4.93 0.00 5.15 -0.26 -4.93 115.26 109.53 2k05 n ASN 22 Ca 0.07 -0.78 -0.27 0.00 -0.60 0.00 0.00 54.58 52.99 2k05 n ASN 22 Cb 0.35 1.14 -0.03 0.00 -0.53 0.00 0.00 39.78 40.71 2k05 n ASN 22 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2k05 s VAL 23 N -3.09 5.16 -0.12 3.44 -7.23 -1.05 -1.02 120.40 116.49 2k05 s VAL 23 Ca 0.05 -0.31 -0.20 0.00 -1.81 0.00 0.00 61.98 59.71 2k05 s VAL 23 Cb 0.16 -3.75 -0.26 0.00 0.56 0.00 0.00 36.38 33.08 2k05 s VAL 23 CO 0.87 -0.26 0.60 0.11 -0.31 0.00 0.00 175.10 176.11 2k05 h LYS 24 N 1.74 0.17 -2.35 4.82 1.57 -0.38 -3.43 116.57 118.72 2k05 h LYS 24 Ca -0.48 -0.29 0.22 0.00 -1.87 0.00 0.00 60.65 58.24 2k05 h LYS 24 Cb 1.20 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 33.56 2k05 h LYS 24 CO 0.66 1.14 0.68 -3.38 -0.57 0.00 0.00 179.45 177.99 2k05 s HIS 25 N -2.40 0.04 0.05 -1.35 -3.43 -1.26 -5.02 115.29 101.93 2k05 s HIS 25 Ca -0.20 -0.34 0.07 0.00 -0.80 0.00 0.00 55.06 53.79 2k05 s HIS 25 Cb 0.03 0.65 -0.03 0.00 -1.43 0.00 0.00 32.58 31.79 2k05 s HIS 25 CO 0.73 -0.70 -0.19 -0.51 -2.00 0.00 0.00 174.74 172.08 2k05 s LEU 26 N -3.47 2.59 -0.06 5.38 1.02 -1.26 -3.79 118.68 119.08 2k05 s LEU 26 Ca 0.23 -0.46 -0.03 0.00 0.02 0.00 0.00 54.13 53.90 2k05 s LEU 26 Cb -0.02 -1.50 0.04 0.00 0.02 0.00 0.00 46.19 44.73 2k05 s LEU 26 CO 0.03 0.25 0.07 -0.75 0.02 0.00 0.00 176.35 175.96 2k05 s LYS 27 N -1.51 -0.05 -0.11 1.70 2.20 0.67 -4.95 119.74 117.69 2k05 s LYS 27 Ca 0.15 0.30 -0.01 0.00 -0.36 0.00 0.00 55.97 56.05 2k05 s LYS 27 Cb -0.10 -0.74 -0.03 0.00 -1.51 0.00 0.00 37.83 35.45 2k05 s LYS 27 CO 0.06 -0.39 -0.05 0.42 -0.36 0.00 0.00 175.35 175.03 2k05 s ILE 28 N 2.17 3.86 0.02 5.43 1.01 -1.26 0.80 121.20 133.23 2k05 s ILE 28 Ca 0.04 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2k05 s ILE 28 Cb -0.13 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.69 2k05 s ILE 28 CO -0.04 0.55 -0.04 -0.76 0.00 0.00 0.00 174.94 174.66 2k05 s LEU 29 N -0.31 2.23 -0.18 2.97 1.02 0.26 -5.01 118.68 119.65 2k05 s LEU 29 Ca 0.05 -0.47 0.01 0.00 0.02 0.00 0.00 54.13 53.73 2k05 s LEU 29 Cb -0.12 0.04 0.03 0.00 0.02 0.00 0.00 46.19 46.16 2k05 s LEU 29 CO 0.02 -0.26 -0.13 0.21 0.02 0.00 0.00 176.35 176.22 2k05 s ASN 30 N -1.38 3.16 0.09 2.29 2.47 -1.26 -0.84 114.94 119.46 2k05 s ASN 30 Ca -0.14 -0.74 -0.03 0.00 0.42 0.00 0.00 52.86 52.37 2k05 s ASN 30 Cb -0.09 -1.25 -0.05 0.00 -1.45 0.00 0.00 41.25 38.40 2k05 s ASN 30 CO -0.01 -0.10 0.29 0.42 -3.72 0.00 0.00 177.10 173.99 2k05 s THR 31 N 1.40 5.28 0.00 -5.21 -4.23 -1.26 -4.97 115.64 106.65 2k05 s THR 31 Ca 0.01 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.42 2k05 s THR 31 Cb -0.15 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.08 2k05 s THR 31 CO -0.09 0.13 0.82 -0.81 -0.54 0.00 0.00 174.62 174.13 2k05 n PRO 32 N 0.35 0.74 0.00 3.99 -0.04 -1.26 -2.77 135.00 136.01 2k05 n PRO 32 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 2k05 n PRO 32 Cb 0.52 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 2k05 n PRO 32 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2k05 n ASN 33 N 0.73 0.00 -4.41 3.54 4.05 -1.26 -5.05 115.26 112.86 2k05 n ASN 33 Ca 0.00 0.00 -0.21 0.00 0.45 0.00 0.00 54.58 54.82 2k05 n ASN 33 Cb 0.37 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 41.28 2k05 n ASN 33 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2k05 n ALA 35 N -0.52 -3.54 -1.84 0.00 0.00 -1.26 -4.34 120.51 109.00 2k05 n ALA 35 Ca -0.06 -1.36 -0.42 0.00 0.00 0.00 0.00 53.44 51.60 2k05 n ALA 35 Cb 0.62 -1.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.21 2k05 n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k05 s GLN 37 N 1.67 3.41 -0.26 0.00 -1.52 -0.02 -4.44 119.66 118.50 2k05 s GLN 37 Ca 0.74 -0.61 -0.05 0.00 -1.95 0.00 0.00 55.36 53.48 2k05 s GLN 37 Cb -0.45 -3.10 -0.00 0.00 -0.22 0.00 0.00 33.01 29.24 2k05 s GLN 37 CO 0.32 -0.22 0.02 0.42 -0.25 0.00 0.00 175.29 175.59 2k05 s ILE 38 N 1.51 3.72 -0.14 1.08 1.01 -1.22 -0.57 121.20 126.58 2k05 s ILE 38 Ca 0.06 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 60.13 2k05 s ILE 38 Cb -0.15 -2.80 -0.02 0.00 0.01 0.00 0.00 42.46 39.50 2k05 s ILE 38 CO -0.02 0.26 -0.07 -0.69 0.00 0.00 0.00 174.94 174.43 2k05 s VAL 39 N 1.50 3.63 0.05 2.92 1.01 0.24 0.74 120.40 130.48 2k05 s VAL 39 Ca 0.04 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.63 2k05 s VAL 39 Cb -0.16 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 2k05 s VAL 39 CO -0.00 0.51 -0.19 0.00 0.00 0.00 0.00 175.10 175.42 2k05 s ALA 40 N 0.31 1.61 -0.17 5.51 0.00 0.15 -0.23 121.76 128.94 2k05 s ALA 40 Ca -0.06 -1.02 -0.12 0.00 0.00 0.00 0.00 51.96 50.77 2k05 s ALA 40 Cb -0.15 -0.29 -0.05 0.00 0.00 0.00 0.00 23.12 22.64 2k05 s ALA 40 CO 0.04 0.35 0.22 1.03 0.00 0.00 0.00 175.76 177.39 2k05 s ARG 41 N -1.24 4.16 0.29 0.00 3.00 -1.25 -0.00 118.95 123.90 2k05 s ARG 41 Ca 0.06 -0.04 -0.29 0.00 0.00 0.00 0.00 55.73 55.46 2k05 s ARG 41 Cb -0.09 -3.40 -0.10 0.00 0.00 0.00 0.00 34.95 31.37 2k05 s ARG 41 CO 0.02 0.32 1.11 -0.51 0.00 0.00 0.00 175.30 176.24 2k05 s LEU 42 N 0.26 4.53 0.00 2.53 1.43 -1.06 0.38 118.68 126.75 2k05 s LEU 42 Ca 0.13 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 55.52 2k05 s LEU 42 Cb -0.12 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.45 2k05 s LEU 42 CO 0.02 -0.17 0.67 0.29 0.23 0.00 0.00 176.35 177.38 2k05 n LYS 43 N 1.13 0.00 -2.57 1.70 5.02 -0.19 -4.24 118.16 119.01 2k05 n LYS 43 Ca -0.01 0.17 -0.42 0.00 -2.02 0.00 0.00 58.31 56.03 2k05 n LYS 43 Cb 0.45 -1.17 -0.01 0.00 -0.02 0.00 0.00 35.03 34.27 2k05 n LYS 43 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2k05 s ASN 44 N -2.00 6.71 -0.28 4.39 2.47 -1.26 -4.57 114.94 120.39 2k05 s ASN 44 Ca 0.00 -2.08 -0.24 0.00 0.42 0.00 0.00 52.86 50.95 2k05 s ASN 44 Cb 0.00 -2.58 0.04 0.00 -1.45 0.00 0.00 41.25 37.26 2k05 s ASN 44 CO 0.00 -1.30 0.42 -3.20 -3.72 0.00 0.00 177.10 169.29 2k05 n ASN 45 N 8.62 -5.95 -0.95 -4.21 5.15 -1.26 -5.00 115.26 111.66 2k05 n ASN 45 Ca 0.43 0.07 0.00 0.00 -0.60 0.00 0.00 54.58 54.49 2k05 n ASN 45 Cb 0.48 -1.71 0.00 0.00 -0.53 0.00 0.00 39.78 38.02 2k05 n ASN 45 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2k05 n ASN 46 N 0.37 0.00 -4.81 1.20 2.85 -1.26 -5.14 115.26 108.47 2k05 n ASN 46 Ca -0.05 -0.95 -0.22 0.00 -0.11 0.00 0.00 54.58 53.25 2k05 n ASN 46 Cb 0.61 0.00 0.09 0.00 1.24 0.00 0.00 39.78 41.72 2k05 n ASN 46 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k05 s ARG 47 N -1.84 1.87 -0.01 1.20 1.04 -1.26 -4.68 118.95 115.26 2k05 s ARG 47 Ca 0.00 -1.40 -0.07 0.00 -1.04 0.00 0.00 55.73 53.22 2k05 s ARG 47 Cb 0.00 -2.46 -0.05 0.00 -2.04 0.00 0.00 34.95 30.40 2k05 s ARG 47 CO 0.00 -1.26 0.27 1.14 -0.04 0.00 0.00 175.30 175.40 2k05 s GLN 48 N -4.97 3.60 0.12 3.89 -2.07 -1.26 -2.56 119.66 116.41 2k05 s GLN 48 Ca 0.65 -0.03 0.09 0.00 -1.82 0.00 0.00 55.36 54.25 2k05 s GLN 48 Cb -0.05 -3.10 -0.04 0.00 -1.09 0.00 0.00 33.01 28.73 2k05 s GLN 48 CO 0.43 0.67 -0.18 0.14 -1.32 0.00 0.00 175.29 175.02 2k05 s VAL 49 N -1.24 2.81 -0.18 3.63 -7.23 0.99 -4.96 120.40 114.22 2k05 s VAL 49 Ca 0.26 -1.54 -0.05 0.00 -1.81 0.00 0.00 61.98 58.84 2k05 s VAL 49 Cb -0.13 -2.29 -0.03 0.00 0.56 0.00 0.00 36.38 34.49 2k05 s VAL 49 CO 0.14 0.09 0.00 0.00 -0.31 0.00 0.00 175.10 175.02 2k05 s ILE 51 N 0.67 4.24 0.07 0.00 1.01 0.23 0.81 121.20 128.22 2k05 s ILE 51 Ca -0.00 -0.63 -0.31 0.00 0.00 0.00 0.00 60.65 59.71 2k05 s ILE 51 Cb -0.14 -2.92 -0.06 0.00 0.01 0.00 0.00 42.46 39.35 2k05 s ILE 51 CO 0.02 0.33 1.22 -0.62 0.00 0.00 0.00 174.94 175.89 2k05 s ASP 52 N -1.71 7.05 0.00 3.58 2.15 -0.78 -3.40 116.67 123.55 2k05 s ASP 52 Ca 0.21 2.06 0.00 0.00 0.43 0.00 0.00 52.55 55.25 2k05 s ASP 52 Cb -0.12 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 2k05 s ASP 52 CO 0.12 -0.49 0.70 -0.81 -0.17 0.00 0.00 175.17 174.52 2k05 n PRO 53 N 3.90 0.77 -0.97 4.34 -0.04 -1.26 -2.08 135.00 139.66 2k05 n PRO 53 Ca 0.09 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.58 2k05 n PRO 53 Cb 0.46 -1.07 0.15 0.00 -0.04 0.00 0.00 33.50 33.00 2k05 n PRO 53 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k05 n LYS 54 N -0.39 1.42 0.00 0.54 5.02 -1.26 -4.76 118.16 118.73 2k05 n LYS 54 Ca 0.00 -3.11 0.00 0.00 -2.02 0.00 0.00 58.31 53.18 2k05 n LYS 54 Cb 0.03 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 2k05 n LYS 54 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2k05 n LEU 55 N -0.73 0.00 0.03 -0.35 0.00 -0.89 -5.04 117.00 110.03 2k05 n LEU 55 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 56.01 56.18 2k05 n LEU 55 Cb 0.81 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 44.23 2k05 n LEU 55 CO -0.00 0.00 -0.06 1.17 0.00 0.00 0.00 177.39 178.50 2k05 n LYS 56 N 0.00 0.04 0.26 1.96 4.81 -1.26 -4.61 118.16 119.37 2k05 n LYS 56 Ca 0.00 0.02 0.12 0.00 -0.87 0.00 0.00 58.31 57.57 2k05 n LYS 56 Cb 0.00 -0.52 0.73 0.00 0.02 0.00 0.00 35.03 35.26 2k05 n LYS 56 CO 0.00 0.00 0.00 0.11 1.17 0.00 0.00 177.40 178.68 2k05 h TRP 57 N -0.08 0.00 -0.15 5.64 5.08 -1.97 -2.01 115.95 122.45 2k05 h TRP 57 Ca 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.96 2k05 h TRP 57 Cb 0.08 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.23 2k05 h TRP 57 CO -0.04 0.10 0.06 0.82 -1.28 0.00 0.00 178.44 178.10 2k05 h ILE 58 N 0.00 1.17 0.09 0.12 1.08 -1.91 -1.92 117.51 116.14 2k05 h ILE 58 Ca -0.00 -0.50 0.00 0.00 -0.39 0.00 0.00 64.86 63.97 2k05 h ILE 58 Cb 0.23 1.21 -0.01 0.00 -3.07 0.00 0.00 36.82 35.19 2k05 h ILE 58 CO 0.01 0.16 -0.08 1.56 -0.69 0.00 0.00 178.15 179.11 2k05 h GLN 59 N 0.08 -0.17 -0.71 2.37 1.08 -1.62 0.92 115.11 117.07 2k05 h GLN 59 Ca 0.05 0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.21 2k05 h GLN 59 Cb 0.19 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.63 2k05 h GLN 59 CO -0.00 -0.11 0.25 0.93 -0.95 0.00 0.00 178.83 178.94 2k05 h GLU 60 N -0.18 1.06 -0.36 1.46 4.39 -1.62 -2.43 114.58 116.90 2k05 h GLU 60 Ca -0.00 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.49 2k05 h GLU 60 Cb 0.16 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 2k05 h GLU 60 CO -0.01 0.89 0.18 -0.92 -1.16 0.00 0.00 179.01 177.99 2k05 h TYR 61 N 1.03 0.51 -0.20 4.33 3.20 -0.42 -1.24 116.97 124.18 2k05 h TYR 61 Ca 0.23 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.13 2k05 h TYR 61 Cb 0.24 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 2k05 h TYR 61 CO 0.02 0.43 -0.08 -0.07 -1.64 0.00 0.00 178.16 176.82 2k05 h LEU 62 N 0.45 -0.28 -1.44 2.82 3.38 -0.59 -0.91 115.31 118.73 2k05 h LEU 62 Ca 0.12 0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.22 2k05 h LEU 62 Cb 0.10 0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2k05 h LEU 62 CO -0.02 -0.11 0.43 -0.33 0.09 0.00 0.00 178.44 178.51 2k05 h GLU 63 N -0.05 0.67 -0.14 1.13 5.08 -1.16 -1.27 114.58 118.84 2k05 h GLU 63 Ca 0.11 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 2k05 h GLU 63 Cb 0.21 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2k05 h GLU 63 CO -0.24 0.44 -0.16 0.87 -1.00 0.00 0.00 179.01 178.93 2k05 h LYS 64 N 0.69 0.35 -0.02 2.33 1.79 0.02 -2.46 116.57 119.27 2k05 h LYS 64 Ca 0.28 -0.19 -0.05 0.00 -2.18 0.00 0.00 60.65 58.51 2k05 h LYS 64 Cb 0.23 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 2k05 h LYS 64 CO -0.09 0.75 -0.23 0.00 -1.08 0.00 0.00 179.45 178.80 2k05 h LEU 66 N 0.03 0.00 -0.53 0.00 6.46 -1.00 -3.11 115.31 117.16 2k05 h LEU 66 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2k05 h LEU 66 Cb 0.43 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.36 2k05 h LEU 66 CO 0.03 0.23 -0.14 0.59 -0.62 0.00 0.00 178.44 178.53 2k05 n ASN 67 N -4.04 0.79 0.00 1.25 4.13 -0.69 -5.08 115.26 111.61 2k05 n ASN 67 Ca -0.02 -0.89 0.06 0.00 1.68 0.00 0.00 54.58 55.40 2k05 n ASN 67 Cb 0.30 0.57 0.34 0.00 -1.54 0.00 0.00 39.78 39.46 2k05 n ASN 67 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83