#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k03 s PRO 2 N 0.00 3.64 0.00 -1.58 0.02 -1.26 -4.93 135.00 130.89 2k03 s PRO 2 Ca 0.00 1.58 0.20 0.00 0.02 0.00 0.00 61.00 62.80 2k03 s PRO 2 Cb 0.00 -2.17 0.58 0.00 0.02 0.00 0.00 34.50 32.93 2k03 s PRO 2 CO 0.00 -0.61 1.46 1.33 -0.33 0.00 0.00 177.00 178.85 2k03 n VAL 3 N -0.91 0.37 -2.80 3.83 0.24 -1.26 -4.93 118.33 112.88 2k03 n VAL 3 Ca 0.09 -0.52 -0.34 0.00 -2.04 0.00 0.00 64.34 61.54 2k03 n VAL 3 Cb 0.50 0.55 -0.07 0.00 -1.47 0.00 0.00 33.84 33.36 2k03 n VAL 3 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2k03 s SER 4 N -1.44 6.97 -0.25 -1.34 1.04 -1.26 -5.07 113.70 112.35 2k03 s SER 4 Ca 0.34 1.72 -0.11 0.00 0.48 0.00 0.00 55.95 58.38 2k03 s SER 4 Cb 0.19 -2.55 0.09 0.00 0.10 0.00 0.00 66.02 63.86 2k03 s SER 4 CO 0.27 -0.34 0.58 -1.48 0.98 0.00 0.00 173.24 173.25 2k03 s LEU 5 N -3.03 -0.81 0.00 2.42 2.34 -1.26 -5.17 118.68 113.16 2k03 s LEU 5 Ca 0.61 1.33 0.01 0.00 0.06 0.00 0.00 54.13 56.13 2k03 s LEU 5 Cb -0.11 1.99 -0.00 0.00 -0.56 0.00 0.00 46.19 47.51 2k03 s LEU 5 CO 0.15 -0.22 0.12 -1.20 -1.06 0.00 0.00 176.35 174.14 2k03 n SER 6 N 4.88 -0.34 -3.93 1.48 7.64 -1.26 -5.07 113.62 117.02 2k03 n SER 6 Ca -0.16 -1.63 -0.42 0.00 1.01 0.00 0.00 58.87 57.67 2k03 n SER 6 Cb 0.53 0.67 0.00 0.00 -1.01 0.00 0.00 64.21 64.41 2k03 n SER 6 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2k03 n TYR 7 N -0.19 3.55 -4.15 1.43 4.02 -1.24 -4.35 117.16 116.23 2k03 n TYR 7 Ca 0.01 -2.92 -0.10 0.00 -0.01 0.00 0.00 57.90 54.88 2k03 n TYR 7 Cb 0.18 -2.32 -0.10 0.00 -0.02 0.00 0.00 39.34 37.09 2k03 n TYR 7 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2k03 s ARG 8 N 2.16 0.79 0.25 -0.72 3.00 -1.22 -4.89 118.95 118.32 2k03 s ARG 8 Ca 0.45 -1.32 -0.02 0.00 0.00 0.00 0.00 55.73 54.84 2k03 s ARG 8 Cb 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 34.95 34.94 2k03 s ARG 8 CO -0.03 -0.07 0.47 0.00 0.00 0.00 0.00 175.30 175.67 2k03 h PRO 10 N 1.70 0.00 -3.67 0.00 0.13 -1.91 -3.42 132.00 124.83 2k03 h PRO 10 Ca -0.48 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.51 2k03 h PRO 10 Cb 1.19 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.13 2k03 h PRO 10 CO 0.66 0.23 -0.52 0.00 -0.23 0.00 0.00 178.00 178.14 2k03 h ARG 12 N 4.06 0.07 -5.27 0.00 2.43 -2.03 -3.45 114.38 110.20 2k03 h ARG 12 Ca -0.32 -0.10 -0.47 0.00 -0.81 0.00 0.00 59.98 58.29 2k03 h ARG 12 Cb 1.19 0.03 -0.28 0.00 -0.42 0.00 0.00 29.97 30.50 2k03 h ARG 12 CO 0.44 0.95 -0.80 -0.06 -1.51 0.00 0.00 179.97 178.99 2k03 s PHE 13 N -2.67 1.22 0.12 2.20 0.08 -1.26 -5.11 117.98 112.57 2k03 s PHE 13 Ca -0.17 -0.27 -0.18 0.00 0.12 0.00 0.00 56.93 56.43 2k03 s PHE 13 Cb -0.01 -0.77 -0.07 0.00 -0.57 0.00 0.00 43.02 41.60 2k03 s PHE 13 CO 0.72 -0.00 0.59 -0.59 -0.10 0.00 0.00 175.22 175.84 2k03 s PHE 14 N -0.50 3.72 -0.37 0.36 -0.12 -1.26 -4.82 117.98 114.99 2k03 s PHE 14 Ca 0.04 1.23 -0.13 0.00 -0.05 0.00 0.00 56.93 58.02 2k03 s PHE 14 Cb -0.06 -2.48 0.01 0.00 -0.63 0.00 0.00 43.02 39.86 2k03 s PHE 14 CO 0.00 0.50 0.24 -2.00 -0.05 0.00 0.00 175.22 173.90 2k03 s GLU 15 N -1.53 3.09 -0.11 1.99 2.12 0.16 -4.71 118.70 119.71 2k03 s GLU 15 Ca 0.34 -0.91 0.00 0.00 0.36 0.00 0.00 54.97 54.76 2k03 s GLU 15 Cb -0.18 -3.81 -0.25 0.00 0.26 0.00 0.00 34.13 30.16 2k03 s GLU 15 CO 0.20 -0.62 0.39 -1.13 -0.54 0.00 0.00 175.26 173.55 2k03 n SER 16 N 5.08 1.68 -4.54 -1.70 3.41 -1.26 -3.78 113.62 112.51 2k03 n SER 16 Ca -0.12 0.23 -0.43 0.00 -0.26 0.00 0.00 58.87 58.29 2k03 n SER 16 Cb 0.48 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 2k03 n SER 16 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2k03 n HIS 17 N -3.31 4.67 -3.92 7.33 8.25 -1.26 -4.83 115.22 122.15 2k03 n HIS 17 Ca -0.29 -2.91 -0.13 0.00 -0.26 0.00 0.00 57.72 54.13 2k03 n HIS 17 Cb 1.05 -2.58 -0.14 0.00 1.12 0.00 0.00 29.99 29.44 2k03 n HIS 17 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2k03 s VAL 18 N 3.85 0.08 -0.13 1.59 0.11 -1.26 -5.15 120.40 119.49 2k03 s VAL 18 Ca 0.52 -0.03 -0.04 0.00 -2.93 0.00 0.00 61.98 59.50 2k03 s VAL 18 Cb 0.03 -0.08 -0.04 0.00 -1.53 0.00 0.00 36.38 34.77 2k03 s VAL 18 CO 0.07 0.03 0.03 0.00 -3.33 0.00 0.00 175.10 171.89 2k03 s ALA 19 N 0.02 3.36 -0.22 1.54 0.00 -1.26 -4.99 121.76 120.20 2k03 s ALA 19 Ca 0.00 -0.77 0.28 0.00 0.00 0.00 0.00 51.96 51.47 2k03 s ALA 19 Cb -0.01 -1.67 1.19 0.00 0.00 0.00 0.00 23.12 22.63 2k03 s ALA 19 CO -0.00 0.43 1.83 0.07 0.00 0.00 0.00 175.76 178.09 2k03 h ARG 20 N 5.75 0.00 0.00 0.00 -0.00 -2.00 -2.04 114.38 116.10 2k03 h ARG 20 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.53 2k03 h ARG 20 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.16 2k03 h ARG 20 CO 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 179.97 180.57 2k03 n ALA 21 N -1.89 1.58 0.42 0.08 0.00 -1.26 -2.15 120.51 117.30 2k03 n ALA 21 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.50 2k03 n ALA 21 Cb 0.23 -1.26 0.03 0.00 0.00 0.00 0.00 19.45 18.45 2k03 n ALA 21 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k03 n ASN 22 N -1.74 1.65 -4.92 0.00 5.15 -0.77 -5.01 115.26 109.63 2k03 n ASN 22 Ca 0.03 -1.32 -0.28 0.00 -0.60 0.00 0.00 54.58 52.40 2k03 n ASN 22 Cb 0.17 0.14 -0.03 0.00 -0.53 0.00 0.00 39.78 39.52 2k03 n ASN 22 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2k03 s VAL 23 N -0.98 5.15 -0.11 3.44 -7.23 -0.91 -1.90 120.40 117.85 2k03 s VAL 23 Ca 0.11 -0.22 0.15 0.00 -1.81 0.00 0.00 61.98 60.21 2k03 s VAL 23 Cb 0.08 -3.73 -0.23 0.00 0.56 0.00 0.00 36.38 33.06 2k03 s VAL 23 CO 0.16 -0.20 0.42 0.29 -0.31 0.00 0.00 175.10 175.45 2k03 n LYS 24 N -0.70 0.66 -3.84 4.82 5.02 0.15 -4.84 118.16 119.43 2k03 n LYS 24 Ca -0.04 0.15 0.01 0.00 -2.02 0.00 0.00 58.31 56.42 2k03 n LYS 24 Cb 0.54 -1.67 0.01 0.00 -0.02 0.00 0.00 35.03 33.88 2k03 n LYS 24 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2k03 s HIS 25 N -2.60 0.00 -0.05 2.13 -3.43 -1.25 -5.01 115.29 105.08 2k03 s HIS 25 Ca -0.07 -0.17 0.05 0.00 -0.80 0.00 0.00 55.06 54.07 2k03 s HIS 25 Cb 0.07 0.58 -0.02 0.00 -1.43 0.00 0.00 32.58 31.78 2k03 s HIS 25 CO 0.83 -0.39 -0.18 -0.51 -2.00 0.00 0.00 174.74 172.49 2k03 s LEU 26 N -3.43 2.52 -0.13 5.38 1.43 -1.26 -3.36 118.68 119.82 2k03 s LEU 26 Ca 0.22 -0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 53.02 2k03 s LEU 26 Cb 0.01 -1.49 0.03 0.00 0.03 0.00 0.00 46.19 44.77 2k03 s LEU 26 CO -0.01 0.32 -0.07 -0.75 0.23 0.00 0.00 176.35 176.07 2k03 s LYS 27 N -0.57 1.54 -0.13 1.70 2.20 -0.10 -4.99 119.74 119.40 2k03 s LYS 27 Ca 0.08 -0.34 -0.00 0.00 -0.36 0.00 0.00 55.97 55.34 2k03 s LYS 27 Cb -0.11 -1.73 -0.02 0.00 -1.51 0.00 0.00 37.83 34.46 2k03 s LYS 27 CO 0.01 -0.31 -0.11 0.42 -0.36 0.00 0.00 175.35 174.99 2k03 s ILE 28 N 1.68 3.21 -0.08 5.43 1.01 -1.26 0.28 121.20 131.46 2k03 s ILE 28 Ca 0.04 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 59.99 2k03 s ILE 28 Cb -0.13 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 40.01 2k03 s ILE 28 CO -0.08 0.53 0.23 -0.76 0.00 0.00 0.00 174.94 174.86 2k03 s LEU 29 N 0.25 1.11 -0.50 2.97 1.02 -0.11 -4.97 118.68 118.45 2k03 s LEU 29 Ca -0.08 0.42 -0.16 0.00 0.02 0.00 0.00 54.13 54.34 2k03 s LEU 29 Cb -0.15 0.82 0.10 0.00 0.02 0.00 0.00 46.19 46.97 2k03 s LEU 29 CO 0.05 -0.11 0.44 0.20 0.02 0.00 0.00 176.35 176.94 2k03 s ASN 30 N -0.02 6.17 0.38 2.29 -0.87 -1.26 -2.67 114.94 118.95 2k03 s ASN 30 Ca -0.01 -1.51 -0.24 0.00 -1.57 0.00 0.00 52.86 49.53 2k03 s ASN 30 Cb -0.02 -2.20 -0.10 0.00 -0.02 0.00 0.00 41.25 38.91 2k03 s ASN 30 CO 0.01 -0.73 0.96 0.42 -2.57 0.00 0.00 177.10 175.18 2k03 s THR 31 N 1.64 4.21 -0.88 1.60 -4.23 -1.26 -4.89 115.64 111.83 2k03 s THR 31 Ca 0.04 1.61 -0.26 0.00 -1.18 0.00 0.00 61.69 61.89 2k03 s THR 31 Cb -0.27 -3.79 -0.17 0.00 1.34 0.00 0.00 72.50 69.62 2k03 s THR 31 CO 0.05 -0.07 2.31 -2.84 -0.54 0.00 0.00 174.62 173.53 2k03 s PRO 32 N -2.60 1.46 0.00 3.99 0.02 -1.26 -1.13 135.00 135.48 2k03 s PRO 32 Ca 0.56 0.19 0.00 0.00 0.02 0.00 0.00 61.00 61.78 2k03 s PRO 32 Cb -0.15 -4.85 0.00 0.00 0.02 0.00 0.00 34.50 29.52 2k03 s PRO 32 CO 0.20 -4.79 0.00 -1.71 -0.33 0.00 0.00 177.00 170.37 2k03 n ASN 33 N 19.00 0.00 -4.39 2.53 5.15 -1.26 -3.40 115.26 132.89 2k03 n ASN 33 Ca 0.45 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 54.23 2k03 n ASN 33 Cb 0.44 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.59 2k03 n ASN 33 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k03 n ALA 35 N -0.47 0.00 -1.67 0.00 0.00 -1.26 -3.98 120.51 113.13 2k03 n ALA 35 Ca -0.07 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 52.92 2k03 n ALA 35 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 2k03 n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k03 s GLN 37 N -0.27 0.62 -0.09 0.00 0.74 -1.09 -4.74 119.66 114.82 2k03 s GLN 37 Ca 0.69 0.91 -0.01 0.00 0.05 0.00 0.00 55.36 57.01 2k03 s GLN 37 Cb -0.65 0.20 -0.03 0.00 1.10 0.00 0.00 33.01 33.62 2k03 s GLN 37 CO 0.48 -0.12 -0.03 0.42 -0.55 0.00 0.00 175.29 175.50 2k03 s ILE 38 N 0.91 4.02 -0.08 -2.34 1.01 -1.17 -0.94 121.20 122.61 2k03 s ILE 38 Ca -0.05 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.28 2k03 s ILE 38 Cb -0.05 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.74 2k03 s ILE 38 CO -0.08 0.59 -0.19 -0.69 0.00 0.00 0.00 174.94 174.57 2k03 s VAL 39 N -0.71 1.65 0.06 2.92 1.01 0.14 0.70 120.40 126.17 2k03 s VAL 39 Ca 0.11 -0.78 0.09 0.00 0.00 0.00 0.00 61.98 61.39 2k03 s VAL 39 Cb -0.11 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 2k03 s VAL 39 CO 0.02 0.47 -0.24 0.00 0.00 0.00 0.00 175.10 175.35 2k03 s ALA 40 N 0.45 2.07 -0.23 5.51 0.00 0.16 -0.92 121.76 128.79 2k03 s ALA 40 Ca -0.16 -1.23 -0.14 0.00 0.00 0.00 0.00 51.96 50.43 2k03 s ALA 40 Cb -0.17 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 2k03 s ALA 40 CO 0.06 0.48 0.33 1.03 0.00 0.00 0.00 175.76 177.65 2k03 s ARG 41 N -1.39 4.09 0.48 0.00 1.81 -1.21 -0.66 118.95 122.06 2k03 s ARG 41 Ca 0.10 0.02 -0.08 0.00 -1.72 0.00 0.00 55.73 54.05 2k03 s ARG 41 Cb -0.10 -3.58 -0.05 0.00 -0.45 0.00 0.00 34.95 30.78 2k03 s ARG 41 CO 0.03 -0.09 0.82 -0.51 -0.68 0.00 0.00 175.30 174.87 2k03 s LEU 42 N 1.49 3.63 0.00 2.53 1.02 -0.42 0.34 118.68 127.26 2k03 s LEU 42 Ca 0.15 1.08 0.00 0.00 0.02 0.00 0.00 54.13 55.38 2k03 s LEU 42 Cb -0.15 -4.03 0.00 0.00 0.02 0.00 0.00 46.19 42.03 2k03 s LEU 42 CO 0.08 -0.57 0.00 0.29 0.02 0.00 0.00 176.35 176.17 2k03 n LYS 43 N -2.03 0.00 -4.25 1.70 5.02 -0.80 -4.71 118.16 113.09 2k03 n LYS 43 Ca 0.02 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.97 2k03 n LYS 43 Cb 0.55 -0.33 -0.12 0.00 -0.02 0.00 0.00 35.03 35.11 2k03 n LYS 43 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2k03 s ASN 44 N -1.70 4.98 0.00 4.39 3.84 -1.26 -4.64 114.94 120.55 2k03 s ASN 44 Ca 0.00 -0.10 0.00 0.00 0.21 0.00 0.00 52.86 52.97 2k03 s ASN 44 Cb 0.00 -1.83 0.00 0.00 -0.55 0.00 0.00 41.25 38.87 2k03 s ASN 44 CO 0.00 0.15 0.00 -3.20 -2.79 0.00 0.00 177.10 171.26 2k03 n ASN 45 N 3.67 0.00 -3.35 -4.21 2.85 -1.26 -4.91 115.26 108.06 2k03 n ASN 45 Ca -0.17 0.00 -0.26 0.00 -0.11 0.00 0.00 54.58 54.03 2k03 n ASN 45 Cb 0.52 0.00 0.23 0.00 1.24 0.00 0.00 39.78 41.78 2k03 n ASN 45 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2k03 n ASN 46 N 1.54 -2.66 0.00 1.20 3.02 -1.26 -5.08 115.26 112.02 2k03 n ASN 46 Ca 0.00 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 2k03 n ASN 46 Cb 0.00 -0.88 0.00 0.00 -0.61 0.00 0.00 39.78 38.29 2k03 n ASN 46 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2k03 n ARG 47 N -4.77 2.96 -3.53 3.52 0.00 -1.26 -4.82 116.66 108.77 2k03 n ARG 47 Ca 0.13 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.61 2k03 n ARG 47 Cb 0.52 0.00 -0.07 0.00 -0.00 0.00 0.00 32.46 32.91 2k03 n ARG 47 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 2k03 s GLN 48 N 1.70 4.16 -0.02 2.89 -2.07 -1.26 -1.30 119.66 123.76 2k03 s GLN 48 Ca 0.00 0.16 0.03 0.00 -1.82 0.00 0.00 55.36 53.73 2k03 s GLN 48 Cb 0.00 -3.38 -0.03 0.00 -1.09 0.00 0.00 33.01 28.51 2k03 s GLN 48 CO 0.00 0.33 -0.07 0.14 -1.32 0.00 0.00 175.29 174.37 2k03 s VAL 49 N 0.16 3.64 0.11 3.63 -7.23 0.17 -4.94 120.40 115.95 2k03 s VAL 49 Ca 0.18 -0.70 -0.28 0.00 -1.81 0.00 0.00 61.98 59.37 2k03 s VAL 49 Cb -0.14 -2.55 -0.06 0.00 0.56 0.00 0.00 36.38 34.19 2k03 s VAL 49 CO 0.06 0.45 0.90 0.00 -0.31 0.00 0.00 175.10 176.20 2k03 s ILE 51 N -0.24 4.04 -0.11 0.00 -1.09 0.22 0.35 121.20 124.36 2k03 s ILE 51 Ca 0.43 -0.36 -0.30 0.00 -2.23 0.00 0.00 60.65 58.20 2k03 s ILE 51 Cb -0.23 -2.68 -0.02 0.00 -1.58 0.00 0.00 42.46 37.95 2k03 s ILE 51 CO 0.28 0.60 1.19 -0.62 -1.23 0.00 0.00 174.94 175.16 2k03 s ASP 52 N -0.86 7.03 0.06 3.58 -1.08 -1.25 -3.07 116.67 121.08 2k03 s ASP 52 Ca 0.13 1.71 0.13 0.00 -0.52 0.00 0.00 52.55 54.00 2k03 s ASP 52 Cb -0.11 -2.55 0.56 0.00 -1.46 0.00 0.00 42.92 39.36 2k03 s ASP 52 CO 0.02 -0.65 1.40 -0.81 0.52 0.00 0.00 175.17 175.65 2k03 n PRO 53 N 5.80 0.04 -0.13 4.34 -0.04 -1.26 -1.42 135.00 142.33 2k03 n PRO 53 Ca 0.12 0.36 0.09 0.00 -0.04 0.00 0.00 63.50 64.03 2k03 n PRO 53 Cb 0.46 -1.59 0.15 0.00 -0.04 0.00 0.00 33.50 32.48 2k03 n PRO 53 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k03 n LYS 54 N -1.66 2.08 -1.75 0.54 5.02 -1.26 -4.52 118.16 116.61 2k03 n LYS 54 Ca 0.02 -1.94 -0.38 0.00 -2.02 0.00 0.00 58.31 53.99 2k03 n LYS 54 Cb 0.13 -1.38 0.05 0.00 -0.02 0.00 0.00 35.03 33.80 2k03 n LYS 54 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2k03 s LEU 55 N -1.27 3.78 0.15 -0.35 1.43 -0.51 -4.73 118.68 117.19 2k03 s LEU 55 Ca 0.28 2.76 -0.27 0.00 -1.03 0.00 0.00 54.13 55.88 2k03 s LEU 55 Cb 0.17 -4.35 0.01 0.00 0.03 0.00 0.00 46.19 42.05 2k03 s LEU 55 CO 0.24 -1.70 1.58 0.50 0.23 0.00 0.00 176.35 177.19 2k03 h LYS 56 N 1.24 -0.31 0.00 1.70 3.64 -1.94 0.27 116.57 121.16 2k03 h LYS 56 Ca -0.51 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 58.82 2k03 h LYS 56 Cb 1.31 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.19 2k03 h LYS 56 CO 0.56 -0.21 -0.33 0.11 -2.27 0.00 0.00 179.45 177.32 2k03 h TRP 57 N -0.32 0.00 -0.30 1.91 5.08 -1.95 -2.58 115.95 117.79 2k03 h TRP 57 Ca 0.14 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 60.03 2k03 h TRP 57 Cb 0.58 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.73 2k03 h TRP 57 CO -0.62 0.33 -0.11 0.82 -1.28 0.00 0.00 178.44 177.59 2k03 h ILE 58 N 0.00 1.29 -0.30 0.12 1.08 -1.44 0.26 117.51 118.52 2k03 h ILE 58 Ca -0.00 -1.18 0.07 0.00 -0.39 0.00 0.00 64.86 63.36 2k03 h ILE 58 Cb 0.70 1.42 -0.07 0.00 -3.07 0.00 0.00 36.82 35.79 2k03 h ILE 58 CO 0.04 0.38 -0.21 1.56 -0.69 0.00 0.00 178.15 179.23 2k03 h GLN 59 N 0.37 -0.17 -0.45 2.37 1.08 -0.16 0.31 115.11 118.46 2k03 h GLN 59 Ca 0.07 0.01 -0.14 0.00 -1.45 0.00 0.00 58.65 57.14 2k03 h GLN 59 Cb 0.62 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.07 2k03 h GLN 59 CO 0.04 -0.12 -0.28 0.93 -0.95 0.00 0.00 178.83 178.45 2k03 h GLU 60 N -0.18 0.99 0.38 1.46 4.39 -1.45 -2.22 114.58 117.95 2k03 h GLU 60 Ca 0.16 -0.46 -0.02 0.00 0.34 0.00 0.00 59.36 59.38 2k03 h GLU 60 Cb 0.42 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2k03 h GLU 60 CO -0.41 1.13 -0.18 -0.92 -1.16 0.00 0.00 179.01 177.47 2k03 h TYR 61 N 0.83 -0.48 0.03 4.33 5.03 0.65 0.25 116.97 127.62 2k03 h TYR 61 Ca 0.09 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.41 2k03 h TYR 61 Cb 0.87 0.16 -0.03 0.00 1.55 0.00 0.00 36.73 39.28 2k03 h TYR 61 CO 0.06 -0.27 -0.14 -0.07 -1.32 0.00 0.00 178.16 176.42 2k03 h LEU 62 N -0.56 -0.41 -1.40 2.82 3.38 -0.50 -1.09 115.31 117.56 2k03 h LEU 62 Ca -0.05 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2k03 h LEU 62 Cb 0.42 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2k03 h LEU 62 CO 0.09 -0.20 0.10 -0.33 0.09 0.00 0.00 178.44 178.18 2k03 h GLU 63 N -0.25 0.50 -0.00 1.13 5.08 -1.19 0.41 114.58 120.25 2k03 h GLU 63 Ca 0.04 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.17 2k03 h GLU 63 Cb 0.30 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2k03 h GLU 63 CO -0.12 0.45 -0.74 1.57 -1.00 0.00 0.00 179.01 179.18 2k03 h LYS 64 N 0.49 0.00 -0.22 2.33 2.10 -0.34 -3.09 116.57 117.84 2k03 h LYS 64 Ca 0.12 -0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.57 2k03 h LYS 64 Cb 0.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 2k03 h LYS 64 CO -0.01 0.74 -0.64 0.00 -2.00 0.00 0.00 179.45 177.54 2k03 h LEU 66 N 0.59 -1.34 0.00 0.00 7.12 -0.14 -2.22 115.31 119.33 2k03 h LEU 66 Ca -0.01 0.22 -0.13 0.00 0.13 0.00 0.00 57.88 58.09 2k03 h LEU 66 Cb 1.25 0.60 -0.02 0.00 -0.53 0.00 0.00 40.66 41.97 2k03 h LEU 66 CO 0.14 -0.35 -1.06 0.78 -0.13 0.00 0.00 178.44 177.82 2k03 h ASN 67 N -0.28 0.00 -0.01 1.25 4.21 -1.65 -3.51 115.58 115.58 2k03 h ASN 67 Ca 0.16 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.67 2k03 h ASN 67 Cb 0.57 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.77 2k03 h ASN 67 CO -0.60 0.49 0.00 0.29 -1.29 0.00 0.00 177.43 176.32