#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 2.90 -0.10 1.97 0.02 -1.26 -4.96 135.00 133.57 2k05 s PRO 2 Ca 0.00 1.05 0.02 0.00 0.02 0.00 0.00 61.00 62.09 2k05 s PRO 2 Cb 0.00 -4.32 0.01 0.00 0.02 0.00 0.00 34.50 30.21 2k05 s PRO 2 CO 0.00 -2.39 -0.17 0.54 -0.33 0.00 0.00 177.00 174.65 2k05 s VAL 3 N 8.39 1.62 0.10 3.83 0.11 -1.26 -5.12 120.40 128.06 2k05 s VAL 3 Ca 0.76 -0.74 -0.21 0.00 -2.93 0.00 0.00 61.98 58.86 2k05 s VAL 3 Cb -0.17 -1.45 -0.07 0.00 -1.53 0.00 0.00 36.38 33.16 2k05 s VAL 3 CO 0.27 0.46 0.62 -0.94 -3.33 0.00 0.00 175.10 172.18 2k05 s SER 4 N 0.74 7.15 -0.28 3.54 1.04 -1.26 -5.06 113.70 119.56 2k05 s SER 4 Ca -0.11 1.36 -0.03 0.00 0.48 0.00 0.00 55.95 57.64 2k05 s SER 4 Cb -0.16 -2.39 0.09 0.00 0.10 0.00 0.00 66.02 63.66 2k05 s SER 4 CO 0.02 0.26 0.11 -1.48 0.98 0.00 0.00 173.24 173.13 2k05 s LEU 5 N -1.12 1.09 0.10 2.42 2.34 -1.26 -5.09 118.68 117.16 2k05 s LEU 5 Ca 0.31 -1.32 -0.25 0.00 0.06 0.00 0.00 54.13 52.92 2k05 s LEU 5 Cb -0.20 -0.52 0.08 0.00 -0.56 0.00 0.00 46.19 44.99 2k05 s LEU 5 CO 0.21 -0.42 0.76 -0.44 -1.06 0.00 0.00 176.35 175.40 2k05 s SER 6 N 1.94 -0.43 -0.67 1.48 0.01 -1.26 -5.09 113.70 109.68 2k05 s SER 6 Ca 0.08 -0.07 -0.26 0.00 1.31 0.00 0.00 55.95 57.02 2k05 s SER 6 Cb -0.16 0.51 -0.04 0.00 0.21 0.00 0.00 66.02 66.53 2k05 s SER 6 CO -0.30 -0.84 1.98 -0.31 0.41 0.00 0.00 173.24 174.18 2k05 s TYR 7 N -3.46 1.59 0.21 2.43 2.02 -1.26 -4.90 117.35 113.98 2k05 s TYR 7 Ca 0.04 0.92 0.06 0.00 -0.37 0.00 0.00 57.07 57.72 2k05 s TYR 7 Cb -0.01 -3.98 -0.05 0.00 -0.40 0.00 0.00 41.96 37.52 2k05 s TYR 7 CO -0.09 -2.19 -0.08 1.03 -1.57 0.00 0.00 175.55 172.65 2k05 s ARG 8 N 7.29 1.31 0.19 -0.62 0.52 -1.26 -5.02 118.95 121.36 2k05 s ARG 8 Ca 0.73 -1.61 0.00 0.00 -0.52 0.00 0.00 55.73 54.33 2k05 s ARG 8 Cb -0.12 -0.89 -0.04 0.00 0.52 0.00 0.00 34.95 34.42 2k05 s ARG 8 CO 0.16 0.07 0.36 0.00 0.02 0.00 0.00 175.30 175.91 2k05 h PRO 10 N 2.03 -0.44 -5.75 0.00 0.11 -1.99 -3.43 132.00 122.53 2k05 h PRO 10 Ca -0.48 0.03 -0.65 0.00 0.11 0.00 0.00 66.00 65.01 2k05 h PRO 10 Cb 1.19 0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.34 2k05 h PRO 10 CO 0.68 -0.29 -0.48 0.00 -0.21 0.00 0.00 178.00 177.70 2k05 n ARG 12 N 1.36 0.63 -4.09 0.00 0.00 -1.26 -4.90 116.66 108.40 2k05 n ARG 12 Ca -0.14 0.11 -0.12 0.00 -0.00 0.00 0.00 57.85 57.69 2k05 n ARG 12 Cb 0.54 -1.74 -0.11 0.00 0.00 0.00 0.00 32.46 31.15 2k05 n ARG 12 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2k05 s PHE 13 N -3.08 0.71 -0.05 -0.14 0.08 -1.26 -5.16 117.98 109.08 2k05 s PHE 13 Ca -0.04 -0.62 0.01 0.00 0.12 0.00 0.00 56.93 56.40 2k05 s PHE 13 Cb 0.09 -0.42 0.02 0.00 -0.57 0.00 0.00 43.02 42.14 2k05 s PHE 13 CO 0.82 -0.11 -0.04 -0.59 -0.10 0.00 0.00 175.22 175.21 2k05 s PHE 14 N -2.00 0.74 0.49 0.36 -0.12 -1.26 -4.72 117.98 111.46 2k05 s PHE 14 Ca -0.04 -0.21 -0.23 0.00 -0.05 0.00 0.00 56.93 56.40 2k05 s PHE 14 Cb -0.06 -0.69 -0.06 0.00 -0.63 0.00 0.00 43.02 41.57 2k05 s PHE 14 CO -0.01 -0.22 1.28 -1.21 -0.05 0.00 0.00 175.22 175.01 2k05 s GLU 15 N 1.13 3.49 0.00 1.99 8.01 0.33 -4.21 118.70 129.45 2k05 s GLU 15 Ca -0.08 2.06 0.00 0.00 0.01 0.00 0.00 54.97 56.97 2k05 s GLU 15 Cb -0.14 -2.39 0.00 0.00 -4.31 0.00 0.00 34.13 27.29 2k05 s GLU 15 CO -0.01 -0.85 0.58 0.45 0.01 0.00 0.00 175.26 175.43 2k05 n SER 16 N -0.65 0.98 -3.42 -0.19 2.88 -1.26 -0.65 113.62 111.31 2k05 n SER 16 Ca 0.08 -1.33 -0.26 0.00 -1.33 0.00 0.00 58.87 56.03 2k05 n SER 16 Cb 0.46 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.83 2k05 n SER 16 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2k05 n HIS 17 N -0.16 0.89 -4.31 0.66 8.25 -1.26 -5.04 115.22 114.24 2k05 n HIS 17 Ca 0.00 -3.73 -0.24 0.00 -0.26 0.00 0.00 57.72 53.49 2k05 n HIS 17 Cb 0.21 -0.25 -0.12 0.00 1.12 0.00 0.00 29.99 30.95 2k05 n HIS 17 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2k05 s VAL 18 N -1.12 1.80 -0.14 1.59 1.01 -1.26 -5.11 120.40 117.17 2k05 s VAL 18 Ca 0.34 -1.64 -0.19 0.00 0.00 0.00 0.00 61.98 60.48 2k05 s VAL 18 Cb 0.09 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 2k05 s VAL 18 CO -0.13 -0.09 0.54 0.00 0.00 0.00 0.00 175.10 175.42 2k05 s ALA 19 N -1.32 3.47 0.39 5.51 0.00 -1.26 -4.95 121.76 123.60 2k05 s ALA 19 Ca 0.09 -0.19 0.08 0.00 0.00 0.00 0.00 51.96 51.94 2k05 s ALA 19 Cb -0.09 -2.77 0.82 0.00 0.00 0.00 0.00 23.12 21.08 2k05 s ALA 19 CO 0.05 -0.18 1.98 -0.09 0.00 0.00 0.00 175.76 177.52 2k05 h ARG 20 N 6.98 0.63 0.00 0.00 1.12 -1.99 -0.83 114.38 120.28 2k05 h ARG 20 Ca -0.38 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.45 2k05 h ARG 20 Cb 1.17 -0.14 0.00 0.00 -0.01 0.00 0.00 29.97 30.99 2k05 h ARG 20 CO 0.75 0.42 -0.16 0.00 -3.11 0.00 0.00 179.97 177.87 2k05 n ALA 21 N -2.47 2.63 0.98 2.80 0.00 -1.26 -3.81 120.51 119.38 2k05 n ALA 21 Ca 0.09 -0.15 0.11 0.00 0.00 0.00 0.00 53.44 53.49 2k05 n ALA 21 Cb 0.23 -1.37 0.01 0.00 0.00 0.00 0.00 19.45 18.32 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 -1.68 2.13 -4.85 0.00 5.15 -0.33 -4.91 115.26 110.77 2k05 n ASN 22 Ca 0.06 -1.57 -0.36 0.00 -0.60 0.00 0.00 54.58 52.11 2k05 n ASN 22 Cb 0.36 0.42 -0.06 0.00 -0.53 0.00 0.00 39.78 39.97 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 -2.37 5.00 -0.07 3.44 -7.23 -1.16 -1.52 120.40 116.49 2k05 s VAL 23 Ca 0.19 0.74 -0.01 0.00 -1.81 0.00 0.00 61.98 61.09 2k05 s VAL 23 Cb 0.18 -3.71 -0.26 0.00 0.56 0.00 0.00 36.38 33.15 2k05 s VAL 23 CO 0.52 0.42 0.57 0.50 -0.31 0.00 0.00 175.10 176.80 2k05 h LYS 24 N 4.15 0.20 -2.09 4.82 3.64 0.09 -3.41 116.57 123.97 2k05 h LYS 24 Ca -0.50 -0.34 0.22 0.00 -1.27 0.00 0.00 60.65 58.76 2k05 h LYS 24 Cb 1.21 0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 33.06 2k05 h LYS 24 CO 0.64 1.00 0.58 -3.38 -2.27 0.00 0.00 179.45 176.02 2k05 s HIS 25 N -2.58 -0.10 -0.10 1.91 -3.43 -1.13 -4.95 115.29 104.90 2k05 s HIS 25 Ca -0.14 -0.15 0.02 0.00 -0.80 0.00 0.00 55.06 53.99 2k05 s HIS 25 Cb 0.07 0.61 -0.01 0.00 -1.43 0.00 0.00 32.58 31.82 2k05 s HIS 25 CO 0.81 -0.68 -0.16 -0.51 -2.00 0.00 0.00 174.74 172.20 2k05 s LEU 26 N -2.96 2.55 -0.16 5.38 1.43 -1.26 -2.77 118.68 120.89 2k05 s LEU 26 Ca 0.13 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2k05 s LEU 26 Cb 0.00 -1.54 0.03 0.00 0.03 0.00 0.00 46.19 44.70 2k05 s LEU 26 CO 0.01 0.21 -0.14 -0.75 0.23 0.00 0.00 176.35 175.90 2k05 s LYS 27 N 0.10 2.36 -0.26 1.70 2.20 0.14 -4.95 119.74 121.03 2k05 s LYS 27 Ca -0.07 -0.65 -0.09 0.00 -0.36 0.00 0.00 55.97 54.80 2k05 s LYS 27 Cb -0.15 -2.23 -0.04 0.00 -1.51 0.00 0.00 37.83 33.90 2k05 s LYS 27 CO 0.05 -0.26 0.12 0.42 -0.36 0.00 0.00 175.35 175.32 2k05 s ILE 28 N 1.44 4.79 -0.02 5.43 1.01 -1.26 -0.24 121.20 132.36 2k05 s ILE 28 Ca 0.04 -0.01 0.07 0.00 0.00 0.00 0.00 60.65 60.75 2k05 s ILE 28 Cb -0.13 -3.26 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 2k05 s ILE 28 CO -0.11 0.31 -0.24 -0.76 0.00 0.00 0.00 174.94 174.15 2k05 s LEU 29 N 1.59 2.04 -0.20 2.97 1.02 -0.36 -4.95 118.68 120.79 2k05 s LEU 29 Ca 0.06 -0.43 0.01 0.00 0.02 0.00 0.00 54.13 53.79 2k05 s LEU 29 Cb -0.15 -1.22 0.04 0.00 0.02 0.00 0.00 46.19 44.87 2k05 s LEU 29 CO 0.07 0.28 -0.12 0.21 0.02 0.00 0.00 176.35 176.81 2k05 s ASN 30 N -0.51 3.38 0.29 2.29 3.84 -1.26 -1.74 114.94 121.23 2k05 s ASN 30 Ca 0.08 -0.86 0.09 0.00 0.21 0.00 0.00 52.86 52.37 2k05 s ASN 30 Cb -0.09 -1.29 -0.04 0.00 -0.55 0.00 0.00 41.25 39.28 2k05 s ASN 30 CO -0.01 -0.12 0.07 0.42 -2.79 0.00 0.00 177.10 174.68 2k05 s THR 31 N 1.37 3.46 0.21 -5.21 -4.23 -1.26 -5.04 115.64 104.94 2k05 s THR 31 Ca -0.00 -1.77 -0.09 0.00 -1.18 0.00 0.00 61.69 58.65 2k05 s THR 31 Cb -0.16 -2.97 0.31 0.00 1.34 0.00 0.00 72.50 71.02 2k05 s THR 31 CO -0.09 -0.31 1.26 -2.65 -0.54 0.00 0.00 174.62 172.30 2k05 n PRO 32 N -1.02 -0.12 -0.26 3.99 -0.02 -1.26 -1.30 135.00 135.01 2k05 n PRO 32 Ca -0.06 1.26 0.08 0.00 -2.02 0.00 0.00 63.50 62.77 2k05 n PRO 32 Cb 0.60 -1.88 0.19 0.00 -0.02 0.00 0.00 33.50 32.39 2k05 n PRO 32 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2k05 n ASN 33 N -5.28 3.14 -4.30 2.55 5.15 -1.26 -5.00 115.26 110.26 2k05 n ASN 33 Ca 0.11 -2.85 -0.20 0.00 -0.60 0.00 0.00 54.58 51.04 2k05 n ASN 33 Cb 0.38 -0.43 -0.11 0.00 -0.53 0.00 0.00 39.78 39.08 2k05 n ASN 33 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k05 n ALA 35 N 0.35 0.00 -2.23 0.00 0.00 -1.26 -4.11 120.51 113.26 2k05 n ALA 35 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 2k05 n ALA 35 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 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 1.04 3.06 -0.29 0.00 2.00 -0.71 -4.68 119.66 120.07 2k05 s GLN 37 Ca 0.63 -0.83 -0.09 0.00 -2.00 0.00 0.00 55.36 53.06 2k05 s GLN 37 Cb -0.35 -2.47 -0.02 0.00 0.80 0.00 0.00 33.01 30.97 2k05 s GLN 37 CO 0.30 -0.01 0.14 0.42 -0.50 0.00 0.00 175.29 175.64 2k05 s ILE 38 N 0.82 4.67 -0.19 -2.34 -1.09 -1.20 -1.22 121.20 120.65 2k05 s ILE 38 Ca -0.07 -0.25 -0.04 0.00 -2.23 0.00 0.00 60.65 58.07 2k05 s ILE 38 Cb -0.15 -3.31 -0.02 0.00 -1.58 0.00 0.00 42.46 37.40 2k05 s ILE 38 CO -0.02 0.16 -0.03 -0.69 -1.23 0.00 0.00 174.94 173.14 2k05 s VAL 39 N 1.64 3.72 -0.02 2.92 1.01 0.67 0.40 120.40 130.73 2k05 s VAL 39 Ca 0.06 -0.40 0.04 0.00 0.00 0.00 0.00 61.98 61.68 2k05 s VAL 39 Cb -0.16 -2.66 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2k05 s VAL 39 CO 0.07 0.45 -0.14 0.00 0.00 0.00 0.00 175.10 175.47 2k05 s ALA 40 N 0.88 1.24 -0.18 5.51 0.00 0.92 0.25 121.76 130.39 2k05 s ALA 40 Ca -0.00 -0.59 -0.08 0.00 0.00 0.00 0.00 51.96 51.29 2k05 s ALA 40 Cb -0.14 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 2k05 s ALA 40 CO 0.01 0.26 0.09 1.03 0.00 0.00 0.00 175.76 177.15 2k05 s ARG 41 N -0.11 3.93 0.59 0.00 0.52 -1.12 -0.06 118.95 122.71 2k05 s ARG 41 Ca 0.01 -0.29 -0.17 0.00 -0.52 0.00 0.00 55.73 54.76 2k05 s ARG 41 Cb -0.08 -3.25 -0.04 0.00 0.52 0.00 0.00 34.95 32.11 2k05 s ARG 41 CO 0.00 0.36 1.09 -0.51 0.02 0.00 0.00 175.30 176.26 2k05 s LEU 42 N 0.14 3.56 0.66 2.53 2.01 -0.47 0.72 118.68 127.83 2k05 s LEU 42 Ca 0.06 1.97 -0.17 0.00 0.01 0.00 0.00 54.13 56.00 2k05 s LEU 42 Cb -0.12 -4.55 -0.11 0.00 0.01 0.00 0.00 46.19 41.41 2k05 s LEU 42 CO -0.00 -1.29 -0.00 0.29 1.01 0.00 0.00 176.35 176.36 2k05 n LYS 43 N -1.86 0.13 -1.54 1.70 5.02 -0.58 -4.39 118.16 116.65 2k05 n LYS 43 Ca 0.10 0.06 -0.34 0.00 -2.02 0.00 0.00 58.31 56.11 2k05 n LYS 43 Cb 0.52 -1.30 -0.08 0.00 -0.02 0.00 0.00 35.03 34.16 2k05 n LYS 43 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2k05 n ASN 44 N 1.72 1.52 0.00 4.39 5.15 -1.26 -2.15 115.26 124.62 2k05 n ASN 44 Ca 0.07 -0.45 0.00 0.00 -0.60 0.00 0.00 54.58 53.60 2k05 n ASN 44 Cb 0.49 -1.36 0.00 0.00 -0.53 0.00 0.00 39.78 38.38 2k05 n ASN 44 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2k05 n ASN 45 N 14.31 0.00 -3.56 1.20 5.15 -1.26 -5.14 115.26 125.95 2k05 n ASN 45 Ca 0.48 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 54.34 2k05 n ASN 45 Cb 0.38 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.67 2k05 n ASN 45 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2k05 n ASN 46 N 0.00 1.04 -0.59 1.20 4.13 -0.91 -5.14 115.26 114.99 2k05 n ASN 46 Ca 0.00 -1.78 0.00 0.00 1.68 0.00 0.00 54.58 54.48 2k05 n ASN 46 Cb 0.00 -0.27 0.00 0.00 -1.54 0.00 0.00 39.78 37.97 2k05 n ASN 46 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 2k05 n ARG 47 N -1.80 3.02 -3.72 3.52 -4.01 -1.26 -4.68 116.66 107.73 2k05 n ARG 47 Ca 0.09 0.00 -0.37 0.00 -1.04 0.00 0.00 57.85 56.53 2k05 n ARG 47 Cb 0.33 0.00 -0.07 0.00 -3.04 0.00 0.00 32.46 29.69 2k05 n ARG 47 CO 0.00 0.00 0.00 1.14 -3.04 0.00 0.00 177.63 175.73 2k05 s GLN 48 N 0.66 3.81 0.17 2.89 0.00 -1.26 -1.37 119.66 124.56 2k05 s GLN 48 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 55.36 55.43 2k05 s GLN 48 Cb 0.00 -3.28 -0.04 0.00 0.00 0.00 0.00 33.01 29.69 2k05 s GLN 48 CO 0.00 0.58 -0.13 0.14 0.00 0.00 0.00 175.29 175.88 2k05 s VAL 49 N -0.53 1.44 -0.19 3.63 -7.23 0.92 -4.98 120.40 113.48 2k05 s VAL 49 Ca 0.16 -2.08 -0.08 0.00 -1.81 0.00 0.00 61.98 58.17 2k05 s VAL 49 Cb -0.13 -1.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 2k05 s VAL 49 CO 0.05 -0.63 0.08 0.00 -0.31 0.00 0.00 175.10 174.29 2k05 s ILE 51 N 0.32 3.60 -0.20 0.00 1.01 0.16 0.12 121.20 126.22 2k05 s ILE 51 Ca 0.05 -0.51 -0.29 0.00 0.00 0.00 0.00 60.65 59.90 2k05 s ILE 51 Cb -0.12 -2.48 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 2k05 s ILE 51 CO -0.00 0.58 1.77 -0.62 0.00 0.00 0.00 174.94 176.67 2k05 s ASP 52 N -0.61 6.19 0.00 3.58 2.15 0.18 -3.28 116.67 124.88 2k05 s ASP 52 Ca 0.09 1.75 0.11 0.00 0.43 0.00 0.00 52.55 54.93 2k05 s ASP 52 Cb -0.12 -2.53 0.56 0.00 -0.30 0.00 0.00 42.92 40.54 2k05 s ASP 52 CO 0.02 -1.39 1.19 -0.81 -0.17 0.00 0.00 175.17 174.01 2k05 n PRO 53 N 7.90 0.20 -0.28 4.34 -0.04 -1.26 -1.58 135.00 144.27 2k05 n PRO 53 Ca 0.21 0.14 0.11 0.00 -0.04 0.00 0.00 63.50 63.92 2k05 n PRO 53 Cb 0.45 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.67 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 -1.21 2.61 -2.09 0.54 5.02 -1.26 -4.32 118.16 117.45 2k05 n LYS 54 Ca 0.06 -2.44 -0.39 0.00 -2.02 0.00 0.00 58.31 53.52 2k05 n LYS 54 Cb 0.07 -1.51 -0.01 0.00 -0.02 0.00 0.00 35.03 33.56 2k05 n LYS 54 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2k05 s LEU 55 N -1.17 4.20 0.23 -0.35 1.43 -0.62 -4.83 118.68 117.58 2k05 s LEU 55 Ca 0.42 2.60 -0.06 0.00 -1.03 0.00 0.00 54.13 56.06 2k05 s LEU 55 Cb 0.23 -3.93 0.36 0.00 0.03 0.00 0.00 46.19 42.87 2k05 s LEU 55 CO 0.31 -0.84 1.79 0.50 0.23 0.00 0.00 176.35 178.33 2k05 h LYS 56 N 2.63 0.65 0.00 1.70 1.63 -1.91 0.27 116.57 121.54 2k05 h LYS 56 Ca -0.49 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.17 2k05 h LYS 56 Cb 1.25 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.72 2k05 h LYS 56 CO 0.62 0.43 -0.44 0.11 -3.45 0.00 0.00 179.45 176.72 2k05 h TRP 57 N 0.67 0.00 -0.27 1.91 5.08 -1.97 0.14 115.95 121.50 2k05 h TRP 57 Ca 0.37 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 60.22 2k05 h TRP 57 Cb 0.37 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.53 2k05 h TRP 57 CO -0.09 0.44 -0.28 0.82 -1.28 0.00 0.00 178.44 178.05 2k05 h ILE 58 N 0.00 1.31 -0.24 0.12 1.08 -1.30 0.10 117.51 118.58 2k05 h ILE 58 Ca -0.00 -1.45 0.06 0.00 -0.39 0.00 0.00 64.86 63.07 2k05 h ILE 58 Cb 0.86 1.63 -0.06 0.00 -3.07 0.00 0.00 36.82 36.19 2k05 h ILE 58 CO 0.06 0.46 -0.13 1.56 -0.69 0.00 0.00 178.15 179.41 2k05 h GLN 59 N 0.38 -0.09 -0.26 2.37 1.08 -0.13 0.10 115.11 118.57 2k05 h GLN 59 Ca 0.04 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 2k05 h GLN 59 Cb 0.85 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.28 2k05 h GLN 59 CO 0.07 -0.06 0.15 0.93 -0.95 0.00 0.00 178.83 178.97 2k05 h GLU 60 N -0.10 0.36 -0.09 1.46 4.39 -0.91 -0.66 114.58 119.04 2k05 h GLU 60 Ca 0.13 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 2k05 h GLU 60 Cb 0.29 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2k05 h GLU 60 CO -0.31 0.31 0.06 -0.92 -1.16 0.00 0.00 179.01 176.98 2k05 h TYR 61 N 0.32 0.13 0.08 4.33 3.20 -0.24 -1.86 116.97 122.91 2k05 h TYR 61 Ca 0.09 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 2k05 h TYR 61 Cb 0.04 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 2k05 h TYR 61 CO -0.04 0.14 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.50 2k05 h LEU 62 N 0.08 -0.12 -1.33 2.82 3.38 -0.73 -0.63 115.31 118.79 2k05 h LEU 62 Ca 0.03 0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.17 2k05 h LEU 62 Cb 0.05 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 2k05 h LEU 62 CO -0.01 -0.08 0.58 -0.33 0.09 0.00 0.00 178.44 178.70 2k05 h GLU 63 N -0.12 0.60 0.13 1.13 5.08 -0.90 -1.63 114.58 118.87 2k05 h GLU 63 Ca -0.01 -0.04 -0.29 0.00 -1.00 0.00 0.00 59.36 58.02 2k05 h GLU 63 Cb 0.10 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 2k05 h GLU 63 CO 0.01 0.40 -1.50 1.57 -1.00 0.00 0.00 179.01 178.48 2k05 h LYS 64 N 0.62 0.27 0.00 2.33 2.10 -1.13 -3.34 116.57 117.42 2k05 h LYS 64 Ca 0.46 -0.47 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 2k05 h LYS 64 Cb 0.85 0.17 -0.00 0.00 -0.90 0.00 0.00 32.23 32.35 2k05 h LYS 64 CO -0.21 1.22 -0.06 0.00 -2.00 0.00 0.00 179.45 178.40 2k05 h LEU 66 N 0.00 0.80 -1.52 0.00 7.12 -1.41 -0.37 115.31 119.92 2k05 h LEU 66 Ca -0.00 0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.07 2k05 h LEU 66 Cb 0.21 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.25 2k05 h LEU 66 CO 0.01 0.39 0.00 0.59 -0.13 0.00 0.00 178.44 179.30 2k05 n ASN 67 N -4.71 2.25 0.00 1.25 4.13 -0.95 -5.13 115.26 112.10 2k05 n ASN 67 Ca 0.18 -1.87 0.00 0.00 1.68 0.00 0.00 54.58 54.57 2k05 n ASN 67 Cb 0.39 -0.20 0.00 0.00 -1.54 0.00 0.00 39.78 38.42 2k05 n ASN 67 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83