#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k92 n THR 2 N 0.00 3.04 -0.06 0.44 5.66 -1.26 -3.92 114.28 118.17 2k92 n THR 2 Ca 0.00 -1.82 -0.13 0.00 -3.05 0.00 0.00 64.05 59.04 2k92 n THR 2 Cb 0.00 -1.88 -0.04 0.00 -1.55 0.00 0.00 70.33 66.85 2k92 n THR 2 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k92 n ILE 3 N 2.06 0.99 -0.01 1.09 0.00 -1.26 -4.24 119.36 118.00 2k92 n ILE 3 Ca 0.43 -0.09 -0.17 0.00 0.00 0.00 0.00 62.75 62.92 2k92 n ILE 3 Cb 0.82 -1.79 -0.12 0.00 0.00 0.00 0.00 39.64 38.54 2k92 n ILE 3 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 176.55 177.60 2k92 h GLU 4 N -0.55 0.24 0.00 9.51 4.11 -1.96 0.21 114.58 126.14 2k92 h GLU 4 Ca -0.29 -0.30 -0.00 0.00 0.07 0.00 0.00 59.36 58.84 2k92 h GLU 4 Cb 1.13 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2k92 h GLU 4 CO -0.17 1.06 -0.02 1.05 0.07 0.00 0.00 179.01 180.99 2k92 h GLU 5 N -0.45 0.00 0.00 1.06 4.11 -1.86 -0.91 114.58 116.53 2k92 h GLU 5 Ca -0.07 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.35 2k92 h GLU 5 Cb 1.24 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 2k92 h GLU 5 CO 0.09 0.02 -1.97 0.54 0.07 0.00 0.00 179.01 177.76 2k92 n ARG 6 N -3.29 0.66 -0.29 1.06 1.74 -1.21 -4.27 116.66 111.07 2k92 n ARG 6 Ca -0.02 -0.18 -0.05 0.00 -0.77 0.00 0.00 57.85 56.83 2k92 n ARG 6 Cb 0.14 -1.54 0.07 0.00 -1.02 0.00 0.00 32.46 30.12 2k92 n ARG 6 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2k92 h VAL 7 N 0.00 1.25 -0.70 1.55 2.07 0.87 -1.20 116.25 120.09 2k92 h VAL 7 Ca -0.02 -0.70 0.17 0.00 0.82 0.00 0.00 66.70 66.97 2k92 h VAL 7 Cb 1.06 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 2k92 h VAL 7 CO 0.00 0.30 0.48 0.11 0.02 0.00 0.00 177.57 178.48 2k92 h LYS 8 N 1.13 0.22 0.53 1.57 6.56 -1.68 -0.68 116.57 124.22 2k92 h LYS 8 Ca 0.28 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.83 2k92 h LYS 8 Cb 0.11 -0.05 0.01 0.00 -0.57 0.00 0.00 32.23 31.73 2k92 h LYS 8 CO -0.04 0.14 -0.26 -0.22 -2.06 0.00 0.00 179.45 177.02 2k92 h LYS 9 N 0.23 -0.69 -0.65 3.15 1.63 -1.44 1.68 116.57 120.48 2k92 h LYS 9 Ca 0.34 0.05 0.11 0.00 -0.85 0.00 0.00 60.65 60.30 2k92 h LYS 9 Cb 1.02 0.16 -0.12 0.00 -0.60 0.00 0.00 32.23 32.68 2k92 h LYS 9 CO -0.07 -0.45 -0.34 0.82 -3.45 0.00 0.00 179.45 175.96 2k92 h ILE 10 N -0.73 0.15 0.00 2.00 2.04 -1.08 1.79 117.51 121.68 2k92 h ILE 10 Ca -0.07 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 2k92 h ILE 10 Cb 0.56 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2k92 h ILE 10 CO 0.12 0.00 -0.32 0.40 0.00 0.00 0.00 178.15 178.35 2k92 h ILE 11 N -0.13 0.81 0.00 -0.67 1.08 -1.25 1.40 117.51 118.74 2k92 h ILE 11 Ca 0.25 -1.33 -0.08 0.00 -0.39 0.00 0.00 64.86 63.32 2k92 h ILE 11 Cb 0.56 1.82 -0.01 0.00 -3.07 0.00 0.00 36.82 36.12 2k92 h ILE 11 CO -0.73 0.31 -0.36 1.23 -0.69 0.00 0.00 178.15 177.92 2k92 h GLY 12 N 1.89 0.00 0.00 5.37 0.00 1.15 -3.06 103.07 108.42 2k92 h GLY 12 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2k92 h GLY 12 CO 0.04 0.00 -1.06 -1.06 0.00 0.00 0.00 176.54 174.47 2k92 n GLN 13 N -3.43 0.40 -0.15 4.80 1.13 0.52 -1.94 117.38 118.71 2k92 n GLN 13 Ca 0.00 0.16 -0.06 0.00 -1.94 0.00 0.00 57.00 55.16 2k92 n GLN 13 Cb 0.53 -1.19 -0.05 0.00 0.11 0.00 0.00 30.24 29.64 2k92 n GLN 13 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 2k92 h GLN 14 N -0.73 -0.08 0.28 -1.09 1.08 0.17 -2.54 115.11 112.20 2k92 h GLN 14 Ca -0.12 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 2k92 h GLN 14 Cb 0.90 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.34 2k92 h GLN 14 CO -0.07 -0.06 -0.24 -0.07 -0.95 0.00 0.00 178.83 177.44 2k92 h LEU 15 N -0.09 -0.66 0.00 1.46 3.38 -1.67 -3.48 115.31 114.26 2k92 h LEU 15 Ca 0.06 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2k92 h LEU 15 Cb 0.25 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2k92 h LEU 15 CO -0.41 -0.34 0.00 0.61 0.09 0.00 0.00 178.44 178.40 2k92 n GLY 16 N -1.28 0.21 3.23 0.83 0.00 -0.96 -4.95 105.19 102.27 2k92 n GLY 16 Ca -0.06 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 2k92 n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k92 s VAL 17 N 0.00 0.34 1.10 1.61 1.01 -0.82 -5.03 120.40 118.61 2k92 s VAL 17 Ca 0.00 -1.97 -0.16 0.00 0.00 0.00 0.00 61.98 59.84 2k92 s VAL 17 Cb 0.00 -2.33 0.24 0.00 0.00 0.00 0.00 36.38 34.29 2k92 s VAL 17 CO 0.00 -0.23 1.13 -0.54 0.00 0.00 0.00 175.10 175.46 2k92 s LYS 18 N -4.04 -0.40 -0.07 2.72 3.01 -1.26 -4.48 119.74 115.21 2k92 s LYS 18 Ca 0.31 0.08 0.14 0.00 -1.01 0.00 0.00 55.97 55.48 2k92 s LYS 18 Cb 0.07 -1.68 0.52 0.00 -1.01 0.00 0.00 37.83 35.73 2k92 s LYS 18 CO 0.08 -3.20 1.39 0.00 0.51 0.00 0.00 175.35 174.14 2k92 n GLN 19 N -4.42 2.90 -0.03 1.68 10.64 -1.26 -3.64 117.38 123.25 2k92 n GLN 19 Ca 0.11 -2.06 -0.04 0.00 -1.83 0.00 0.00 57.00 53.17 2k92 n GLN 19 Cb 0.59 -1.69 -0.04 0.00 -0.86 0.00 0.00 30.24 28.24 2k92 n GLN 19 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2k92 n GLU 20 N 0.80 1.34 0.13 2.61 1.02 -1.26 -4.56 120.64 120.71 2k92 n GLU 20 Ca 0.19 0.02 0.13 0.00 -0.02 0.00 0.00 57.16 57.48 2k92 n GLU 20 Cb 0.65 -1.15 0.37 0.00 -0.02 0.00 0.00 31.44 31.29 2k92 n GLU 20 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2k92 h GLU 21 N 0.00 0.00 -5.75 3.49 4.39 -1.96 -3.43 114.58 111.32 2k92 h GLU 21 Ca -0.16 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 58.96 2k92 h GLU 21 Cb 1.29 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.87 2k92 h GLU 21 CO -0.01 0.00 -0.15 0.08 -1.16 0.00 0.00 179.01 177.77 2k92 s VAL 22 N -3.14 5.17 0.30 3.13 1.01 -1.24 -4.95 120.40 120.68 2k92 s VAL 22 Ca 0.09 0.93 -0.07 0.00 0.00 0.00 0.00 61.98 62.94 2k92 s VAL 22 Cb 0.11 -3.80 -0.00 0.00 0.00 0.00 0.00 36.38 32.68 2k92 s VAL 22 CO 0.60 0.35 0.46 0.42 0.00 0.00 0.00 175.10 176.93 2k92 s THR 23 N 0.47 0.00 -1.25 3.92 -4.23 -1.26 -4.94 115.64 108.35 2k92 s THR 23 Ca 0.25 -1.54 -0.12 0.00 -1.18 0.00 0.00 61.69 59.11 2k92 s THR 23 Cb -0.15 -2.48 0.16 0.00 1.34 0.00 0.00 72.50 71.38 2k92 s THR 23 CO 0.10 0.00 1.66 -0.46 -0.54 0.00 0.00 174.62 175.39 2k92 n ASN 24 N -0.92 5.13 0.00 3.99 6.94 -1.26 -3.36 115.26 125.78 2k92 n ASN 24 Ca -0.00 -3.03 0.00 0.00 -0.02 0.00 0.00 54.58 51.52 2k92 n ASN 24 Cb 0.62 -1.54 0.00 0.00 -2.36 0.00 0.00 39.78 36.50 2k92 n ASN 24 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 2k92 n ASN 25 N 4.92 0.00 -4.74 0.53 6.94 -1.26 -4.76 115.26 116.88 2k92 n ASN 25 Ca 0.39 0.00 -0.37 0.00 -0.02 0.00 0.00 54.58 54.57 2k92 n ASN 25 Cb 0.40 0.00 0.05 0.00 -2.36 0.00 0.00 39.78 37.86 2k92 n ASN 25 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2k92 s ALA 26 N 0.00 2.63 -0.79 -2.53 0.00 -1.22 -4.89 121.76 114.97 2k92 s ALA 26 Ca 0.00 1.22 0.02 0.00 0.00 0.00 0.00 51.96 53.20 2k92 s ALA 26 Cb 0.00 -3.53 0.19 0.00 0.00 0.00 0.00 23.12 19.78 2k92 s ALA 26 CO 0.00 -1.38 0.62 -1.12 0.00 0.00 0.00 175.76 173.87 2k92 s SER 27 N -1.23 5.31 0.44 0.00 0.01 -1.26 -3.52 113.70 113.45 2k92 s SER 27 Ca 0.76 -3.83 0.33 0.00 1.31 0.00 0.00 55.95 54.52 2k92 s SER 27 Cb -0.37 -1.75 1.50 0.00 0.21 0.00 0.00 66.02 65.61 2k92 s SER 27 CO 0.42 -0.12 1.58 2.19 0.41 0.00 0.00 173.24 177.72 2k92 h PHE 28 N 5.61 0.50 0.00 2.43 -5.15 -1.93 0.70 116.94 119.10 2k92 h PHE 28 Ca 0.16 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.95 2k92 h PHE 28 Cb 0.77 -0.12 0.00 0.00 0.22 0.00 0.00 35.95 36.83 2k92 h PHE 28 CO 0.70 -0.28 0.00 1.33 -2.00 0.00 0.00 178.31 178.07 2k92 n VAL 29 N -4.72 0.00 -0.06 0.88 0.24 -1.26 0.19 118.33 113.60 2k92 n VAL 29 Ca 0.40 0.82 -0.21 0.00 -2.04 0.00 0.00 64.34 63.31 2k92 n VAL 29 Cb 1.57 -1.29 -0.13 0.00 -1.47 0.00 0.00 33.84 32.52 2k92 n VAL 29 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2k92 n GLU 30 N -0.71 0.69 -0.34 7.34 0.00 -0.91 -2.35 120.64 124.36 2k92 n GLU 30 Ca 0.00 0.27 -0.09 0.00 0.00 0.00 0.00 57.16 57.34 2k92 n GLU 30 Cb 0.00 -1.65 -0.08 0.00 0.00 0.00 0.00 31.44 29.71 2k92 n GLU 30 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 2k92 h ASP 31 N -0.16 -1.82 0.00 4.31 3.58 0.28 -3.38 116.42 119.23 2k92 h ASP 31 Ca -0.48 0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.25 2k92 h ASP 31 Cb 1.88 0.80 0.00 0.00 1.72 0.00 0.00 39.33 43.73 2k92 h ASP 31 CO -0.04 -0.20 0.00 0.18 -2.88 0.00 0.00 179.24 176.30 2k92 n LEU 32 N -4.90 0.10 0.00 2.28 4.77 -1.00 -4.96 117.00 113.29 2k92 n LEU 32 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2k92 n LEU 32 Cb 0.22 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 2k92 n LEU 32 CO -0.13 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.54 2k92 n GLY 33 N 2.74 -0.20 3.06 -0.72 0.00 0.49 -4.96 105.19 105.59 2k92 n GLY 33 Ca 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 46.02 46.67 2k92 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k92 s ALA 34 N 0.00 -1.80 -0.19 4.61 0.00 -0.99 -4.90 121.76 118.48 2k92 s ALA 34 Ca 0.00 -0.18 0.13 0.00 0.00 0.00 0.00 51.96 51.91 2k92 s ALA 34 Cb 0.00 -2.55 0.43 0.00 0.00 0.00 0.00 23.12 21.00 2k92 s ALA 34 CO 0.00 -2.20 1.21 -0.25 0.00 0.00 0.00 175.76 174.52 2k92 n ASP 35 N 4.25 2.06 0.00 0.00 8.00 -1.26 -4.39 116.55 125.21 2k92 n ASP 35 Ca 0.12 -3.58 0.00 0.00 0.71 0.00 0.00 54.79 52.04 2k92 n ASP 35 Cb 0.54 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 2k92 n ASP 35 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2k92 n SER 36 N -0.83 0.00 -1.75 -2.24 2.88 -1.26 -4.89 113.62 105.53 2k92 n SER 36 Ca 0.20 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.60 2k92 n SER 36 Cb 0.79 0.08 0.12 0.00 -0.75 0.00 0.00 64.21 64.45 2k92 n SER 36 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2k92 n LEU 37 N -2.10 5.27 0.00 2.46 4.77 -1.26 -4.37 117.00 121.77 2k92 n LEU 37 Ca 0.00 -2.77 0.00 0.00 -0.03 0.00 0.00 56.01 53.21 2k92 n LEU 37 Cb 0.00 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.38 2k92 n LEU 37 CO 0.00 0.82 0.06 -0.67 -1.33 0.00 0.00 177.39 176.27 2k92 n ASP 38 N -0.48 0.00 -0.01 -1.43 2.03 -1.26 -3.91 116.55 111.49 2k92 n ASP 38 Ca 0.36 0.12 -0.09 0.00 0.52 0.00 0.00 54.79 55.70 2k92 n ASP 38 Cb 1.21 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 41.54 2k92 n ASP 38 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 2k92 h THR 39 N 0.00 0.90 -0.17 5.18 2.02 -1.89 -2.10 112.91 116.84 2k92 h THR 39 Ca 0.00 -1.45 0.02 0.00 0.77 0.00 0.00 66.41 65.75 2k92 h THR 39 Cb 0.00 1.62 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 2k92 h THR 39 CO 0.00 0.27 -0.10 0.52 0.37 0.00 0.00 175.52 176.58 2k92 n VAL 40 N -4.80 -0.12 0.22 3.16 0.31 -1.26 0.12 118.33 115.97 2k92 n VAL 40 Ca -0.06 1.42 -0.15 0.00 -0.01 0.00 0.00 64.34 65.53 2k92 n VAL 40 Cb 0.26 -1.85 -0.07 0.00 -0.91 0.00 0.00 33.84 31.26 2k92 n VAL 40 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2k92 h GLU 41 N 0.00 -0.66 -0.97 5.55 5.08 -1.72 -2.07 114.58 119.79 2k92 h GLU 41 Ca 0.03 0.04 0.27 0.00 -1.00 0.00 0.00 59.36 58.70 2k92 h GLU 41 Cb 0.07 0.15 -0.18 0.00 0.50 0.00 0.00 28.75 29.29 2k92 h GLU 41 CO -0.16 -0.44 0.03 -0.11 -1.00 0.00 0.00 179.01 177.33 2k92 n LEU 42 N -5.44 -0.11 -0.04 1.33 0.00 -0.11 0.39 117.00 113.03 2k92 n LEU 42 Ca -0.10 1.65 -0.12 0.00 0.00 0.00 0.00 56.01 57.45 2k92 n LEU 42 Cb 0.34 -0.61 -0.08 0.00 0.00 0.00 0.00 43.42 43.07 2k92 n LEU 42 CO 0.29 -1.68 0.50 0.58 0.00 0.00 0.00 177.39 177.09 2k92 h VAL 43 N 0.00 0.00 -0.49 1.96 2.07 0.17 1.03 116.25 120.99 2k92 h VAL 43 Ca 0.59 0.00 0.08 0.00 0.82 0.00 0.00 66.70 68.20 2k92 h VAL 43 Cb 1.23 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.90 2k92 h VAL 43 CO -0.91 0.00 -0.40 0.24 0.02 0.00 0.00 177.57 176.52 2k92 h MET 44 N -0.43 -0.25 0.29 1.57 2.86 0.01 2.43 114.93 121.41 2k92 h MET 44 Ca 0.04 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 2k92 h MET 44 Cb 0.54 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 2k92 h MET 44 CO -0.40 -0.17 -0.25 0.00 1.06 0.00 0.00 176.91 177.15 2k92 h ALA 45 N 0.63 -0.99 -0.01 6.32 0.00 -0.56 1.56 119.26 126.21 2k92 h ALA 45 Ca 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2k92 h ALA 45 Cb 0.57 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2k92 h ALA 45 CO -0.62 -1.00 0.30 -0.07 0.00 0.00 0.00 179.25 177.86 2k92 h LEU 46 N -0.53 0.00 0.00 0.00 3.38 0.16 0.54 115.31 118.85 2k92 h LEU 46 Ca -0.04 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2k92 h LEU 46 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2k92 h LEU 46 CO -0.01 0.00 -0.23 -0.33 0.09 0.00 0.00 178.44 177.96 2k92 h GLU 47 N 0.00 0.00 -0.70 1.13 5.08 0.61 -2.81 114.58 117.89 2k92 h GLU 47 Ca 0.00 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.48 2k92 h GLU 47 Cb 0.60 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.81 2k92 h GLU 47 CO -0.00 0.98 0.46 0.93 -1.00 0.00 0.00 179.01 180.39 2k92 h GLU 48 N -1.00 0.45 0.00 2.33 4.39 0.43 1.50 114.58 122.68 2k92 h GLU 48 Ca -0.06 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.61 2k92 h GLU 48 Cb 1.04 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 2k92 h GLU 48 CO -0.04 0.30 0.00 -1.91 -1.16 0.00 0.00 179.01 176.20 2k92 n GLU 49 N -4.48 0.00 -0.11 2.33 0.00 -0.48 -4.67 120.64 113.24 2k92 n GLU 49 Ca 0.12 0.35 -0.24 0.00 0.00 0.00 0.00 57.16 57.39 2k92 n GLU 49 Cb 0.43 -1.10 -0.11 0.00 0.00 0.00 0.00 31.44 30.66 2k92 n GLU 49 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2k92 n PHE 50 N -1.56 0.60 -1.11 4.31 3.01 -1.07 -5.08 117.46 116.56 2k92 n PHE 50 Ca 0.00 0.23 0.00 0.00 1.01 0.00 0.00 57.45 58.69 2k92 n PHE 50 Cb 0.00 -1.06 0.00 0.00 -0.01 0.00 0.00 39.48 38.41 2k92 n PHE 50 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2k92 n ASP 51 N -4.18 -1.48 -0.16 4.37 -0.08 0.51 -4.99 116.55 110.54 2k92 n ASP 51 Ca -0.41 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 52.87 2k92 n ASP 51 Cb 0.82 -0.74 0.00 0.00 2.34 0.00 0.00 41.12 43.54 2k92 n ASP 51 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 2k92 n THR 52 N -0.29 0.00 -2.55 5.18 5.66 -1.26 -5.02 114.28 116.01 2k92 n THR 52 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2k92 n THR 52 Cb 0.00 0.79 0.00 0.00 -1.55 0.00 0.00 70.33 69.57 2k92 n THR 52 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2k92 n GLU 53 N 0.00 -0.23 -2.57 1.09 0.28 -1.26 -4.76 120.64 113.18 2k92 n GLU 53 Ca 0.00 0.60 -0.43 0.00 -0.16 0.00 0.00 57.16 57.17 2k92 n GLU 53 Cb 0.56 -0.74 -0.02 0.00 1.43 0.00 0.00 31.44 32.67 2k92 n GLU 53 CO 0.00 0.00 0.00 -1.50 -0.16 0.00 0.00 177.13 175.47 2k92 s ILE 54 N -0.73 4.31 0.39 3.84 1.10 -1.26 -5.00 121.20 123.85 2k92 s ILE 54 Ca 0.00 1.44 -0.24 0.00 -0.51 0.00 0.00 60.65 61.34 2k92 s ILE 54 Cb 0.00 -4.43 -0.09 0.00 0.15 0.00 0.00 42.46 38.09 2k92 s ILE 54 CO 0.00 -0.68 1.06 -2.16 -2.11 0.00 0.00 174.94 171.05 2k92 s PRO 55 N 4.09 4.19 0.15 3.50 0.04 -1.26 -4.79 135.00 140.91 2k92 s PRO 55 Ca 0.49 1.55 -0.18 0.00 0.04 0.00 0.00 61.00 62.90 2k92 s PRO 55 Cb -0.11 -2.59 0.04 0.00 0.04 0.00 0.00 34.50 31.88 2k92 s PRO 55 CO 0.23 -0.13 1.72 0.38 0.04 0.00 0.00 177.00 179.25 2k92 h ASP 56 N 2.59 -0.05 -0.90 6.66 2.03 -1.94 1.21 116.42 126.01 2k92 h ASP 56 Ca -0.48 0.06 0.26 0.00 -0.73 0.00 0.00 57.03 56.14 2k92 h ASP 56 Cb 1.22 0.09 -0.04 0.00 -0.83 0.00 0.00 39.33 39.77 2k92 h ASP 56 CO 0.63 0.01 0.89 1.05 -1.03 0.00 0.00 179.24 180.78 2k92 h GLU 57 N 0.13 0.00 0.00 4.15 -0.00 -1.99 1.80 114.58 118.67 2k92 h GLU 57 Ca 0.14 0.00 -0.07 0.00 -0.00 0.00 0.00 59.36 59.44 2k92 h GLU 57 Cb 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.91 2k92 h GLU 57 CO -0.22 0.00 -1.79 -1.91 -0.00 0.00 0.00 179.01 175.10 2k92 n GLU 58 N -3.62 0.77 -0.37 1.06 0.00 0.36 -4.27 120.64 114.56 2k92 n GLU 58 Ca 0.19 -0.11 0.08 0.00 0.00 0.00 0.00 57.16 57.33 2k92 n GLU 58 Cb 1.19 -1.37 0.26 0.00 0.00 0.00 0.00 31.44 31.52 2k92 n GLU 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2k92 n ALA 59 N -2.17 2.65 -0.02 4.31 0.00 0.39 -3.78 120.51 121.89 2k92 n ALA 59 Ca -0.08 -1.09 0.07 0.00 0.00 0.00 0.00 53.44 52.34 2k92 n ALA 59 Cb 0.55 -0.98 -0.16 0.00 0.00 0.00 0.00 19.45 18.85 2k92 n ALA 59 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2k92 n GLU 60 N 1.02 0.66 0.09 0.00 1.02 0.52 -3.99 120.64 119.97 2k92 n GLU 60 Ca 0.19 -0.16 0.12 0.00 -0.02 0.00 0.00 57.16 57.29 2k92 n GLU 60 Cb 0.58 -1.50 0.15 0.00 -0.02 0.00 0.00 31.44 30.66 2k92 n GLU 60 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 2k92 h LYS 61 N 0.00 0.00 0.10 3.49 2.10 -1.79 -3.35 116.57 117.13 2k92 h LYS 61 Ca -0.08 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.56 2k92 h LYS 61 Cb 1.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.48 2k92 h LYS 61 CO 0.00 0.00 -0.05 -0.84 -2.00 0.00 0.00 179.45 176.57 2k92 h ILE 62 N 0.00 0.60 -3.09 0.07 3.07 -1.72 -3.46 117.51 112.98 2k92 h ILE 62 Ca 0.00 -1.26 -0.08 0.00 1.55 0.00 0.00 64.86 65.07 2k92 h ILE 62 Cb 0.84 1.09 -0.02 0.00 -0.27 0.00 0.00 36.82 38.46 2k92 h ILE 62 CO 0.00 0.19 -0.09 1.07 -1.05 0.00 0.00 178.15 178.27 2k92 n THR 63 N -4.83 -0.09 -3.86 0.16 5.66 -1.26 -4.77 114.28 105.29 2k92 n THR 63 Ca -0.05 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.85 2k92 n THR 63 Cb 0.20 -0.47 0.01 0.00 -1.55 0.00 0.00 70.33 68.52 2k92 n THR 63 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2k92 s THR 64 N -1.73 0.00 -0.18 1.09 -4.23 -1.26 -4.42 115.64 104.91 2k92 s THR 64 Ca 0.00 -1.11 -0.21 0.00 -1.18 0.00 0.00 61.69 59.19 2k92 s THR 64 Cb 0.00 -2.74 -0.18 0.00 1.34 0.00 0.00 72.50 70.92 2k92 s THR 64 CO 0.00 0.00 0.30 0.58 -0.54 0.00 0.00 174.62 174.96 2k92 h VAL 65 N 2.02 1.00 -0.64 2.29 2.07 -1.80 -3.30 116.25 117.89 2k92 h VAL 65 Ca -0.30 -2.05 0.12 0.00 0.82 0.00 0.00 66.70 65.28 2k92 h VAL 65 Cb 1.25 2.19 -0.12 0.00 -1.52 0.00 0.00 31.29 33.09 2k92 h VAL 65 CO 0.38 0.34 -0.30 -0.61 0.02 0.00 0.00 177.57 177.40 2k92 h GLN 66 N -1.00 -0.12 -0.87 1.57 4.15 -1.86 1.06 115.11 118.04 2k92 h GLN 66 Ca -0.22 0.01 0.19 0.00 0.77 0.00 0.00 58.65 59.40 2k92 h GLN 66 Cb 1.10 0.03 -0.06 0.00 0.21 0.00 0.00 27.48 28.75 2k92 h GLN 66 CO -0.13 -0.08 0.58 0.00 -1.93 0.00 0.00 178.83 177.27 2k92 h ALA 67 N 1.17 2.15 0.00 3.38 0.00 -1.86 1.67 119.26 125.77 2k92 h ALA 67 Ca 0.26 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2k92 h ALA 67 Cb 0.55 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2k92 h ALA 67 CO -0.71 -0.42 0.00 0.00 0.00 0.00 0.00 179.25 178.13 2k92 n ALA 68 N -2.51 1.31 -0.12 0.00 0.00 0.36 -1.07 120.51 118.48 2k92 n ALA 68 Ca 0.18 0.05 -0.26 0.00 0.00 0.00 0.00 53.44 53.42 2k92 n ALA 68 Cb 0.64 -1.21 -0.11 0.00 0.00 0.00 0.00 19.45 18.78 2k92 n ALA 68 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2k92 n ILE 69 N -1.81 1.54 0.32 0.00 5.41 0.56 -3.26 119.36 122.12 2k92 n ILE 69 Ca 0.01 -0.36 0.20 0.00 1.00 0.00 0.00 62.75 63.60 2k92 n ILE 69 Cb 0.10 -1.83 1.11 0.00 -0.71 0.00 0.00 39.64 38.31 2k92 n ILE 69 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 2k92 h ASP 70 N -0.75 0.00 0.00 4.38 1.82 -0.75 0.34 116.42 121.45 2k92 h ASP 70 Ca -0.59 0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 55.97 2k92 h ASP 70 Cb 1.63 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.63 2k92 h ASP 70 CO -0.29 0.00 -0.43 0.22 -1.61 0.00 0.00 179.24 177.14 2k92 h TYR 71 N 0.00 0.00 0.00 0.28 3.20 -1.26 -1.85 116.97 117.34 2k92 h TYR 71 Ca -0.00 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 2k92 h TYR 71 Cb 0.02 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 2k92 h TYR 71 CO 0.00 1.12 -0.00 0.82 -1.64 0.00 0.00 178.16 178.46 2k92 h ILE 72 N -1.00 0.71 0.14 1.81 1.08 -1.40 -0.46 117.51 118.39 2k92 h ILE 72 Ca -0.12 -0.01 -0.30 0.00 -0.39 0.00 0.00 64.86 64.04 2k92 h ILE 72 Cb 1.07 1.01 0.00 0.00 -3.07 0.00 0.00 36.82 35.82 2k92 h ILE 72 CO -0.07 0.00 -1.46 0.78 -0.69 0.00 0.00 178.15 176.71 2k92 h ASN 73 N 0.00 0.46 0.00 1.72 2.35 -1.04 -3.23 115.58 115.83 2k92 h ASN 73 Ca -0.00 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 55.18 2k92 h ASN 73 Cb 0.01 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.23 2k92 h ASN 73 CO 0.00 1.47 0.06 1.23 -1.65 0.00 0.00 177.43 178.53 2k92 h GLY 74 N 1.46 0.00 -4.87 2.83 0.00 -0.20 -1.75 103.07 100.54 2k92 h GLY 74 Ca -0.22 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.54 2k92 h GLY 74 CO 0.19 0.00 -0.75 1.42 0.00 0.00 0.00 176.54 177.39 2k92 n HIS 75 N -2.44 3.35 -3.14 5.60 8.25 -1.05 -4.86 115.22 120.94 2k92 n HIS 75 Ca -0.02 -3.42 -0.22 0.00 -0.26 0.00 0.00 57.72 53.80 2k92 n HIS 75 Cb 0.10 -0.25 -0.06 0.00 1.12 0.00 0.00 29.99 30.90 2k92 n HIS 75 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2k92 n GLN 76 N -0.34 0.68 0.00 -0.41 -0.06 -0.66 -5.00 117.38 111.59 2k92 n GLN 76 Ca 0.34 -3.01 0.00 0.00 -2.00 0.00 0.00 57.00 52.33 2k92 n GLN 76 Cb 0.58 -1.28 0.00 0.00 -4.06 0.00 0.00 30.24 25.48 2k92 n GLN 76 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86