#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 3.13 -0.03 0.44 -2.24 -1.26 -3.91 114.28 110.41 2k92 n THR 2 Ca 0.00 -2.17 -0.07 0.00 -2.27 0.00 0.00 64.05 59.53 2k92 n THR 2 Cb 0.00 -1.79 -0.02 0.00 -2.10 0.00 0.00 70.33 66.41 2k92 n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k92 n ILE 3 N 1.70 0.48 -0.03 2.28 0.00 -1.26 -4.59 119.36 117.94 2k92 n ILE 3 Ca 0.45 -0.06 -0.11 0.00 0.00 0.00 0.00 62.75 63.03 2k92 n ILE 3 Cb 0.74 -1.62 -0.09 0.00 0.00 0.00 0.00 39.64 38.67 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 -0.26 -0.05 -0.54 9.51 4.11 -1.96 -0.44 114.58 124.95 2k92 h GLU 4 Ca -0.17 0.00 0.16 0.00 0.07 0.00 0.00 59.36 59.42 2k92 h GLU 4 Cb 1.08 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 2k92 h GLU 4 CO -0.10 0.58 0.77 1.05 0.07 0.00 0.00 179.01 181.38 2k92 h GLU 5 N -0.92 0.00 0.01 1.06 4.11 -1.88 0.98 114.58 117.95 2k92 h GLU 5 Ca -0.01 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 59.07 2k92 h GLU 5 Cb 0.65 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.84 2k92 h GLU 5 CO 0.01 0.00 -2.23 0.54 0.07 0.00 0.00 179.01 177.40 2k92 n ARG 6 N -3.29 0.68 -0.03 1.06 1.74 -1.21 -4.33 116.66 111.28 2k92 n ARG 6 Ca 0.11 0.12 -0.10 0.00 -0.77 0.00 0.00 57.85 57.20 2k92 n ARG 6 Cb 0.96 -1.60 -0.04 0.00 -1.02 0.00 0.00 32.46 30.76 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 0.01 0.24 -0.84 1.55 2.07 0.27 0.11 116.25 119.66 2k92 h VAL 7 Ca -0.49 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.24 2k92 h VAL 7 Cb 2.11 0.24 -0.14 0.00 -1.52 0.00 0.00 31.29 31.97 2k92 h VAL 7 CO 0.02 0.00 0.10 0.11 0.02 0.00 0.00 177.57 177.82 2k92 h LYS 8 N -0.38 0.12 0.42 1.57 6.56 -1.59 0.26 116.57 123.53 2k92 h LYS 8 Ca 0.11 -0.01 -0.01 0.00 -1.06 0.00 0.00 60.65 59.68 2k92 h LYS 8 Cb 0.56 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.19 2k92 h LYS 8 CO -0.40 0.08 -0.27 -0.22 -2.06 0.00 0.00 179.45 176.58 2k92 h LYS 9 N 0.13 -0.64 -0.75 3.15 3.64 -1.08 1.58 116.57 122.59 2k92 h LYS 9 Ca 0.50 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 60.06 2k92 h LYS 9 Cb 0.96 0.15 -0.14 0.00 -0.41 0.00 0.00 32.23 32.78 2k92 h LYS 9 CO -0.71 -0.43 -0.26 0.82 -2.27 0.00 0.00 179.45 176.61 2k92 h ILE 10 N -0.67 0.18 0.00 2.00 2.04 0.14 1.67 117.51 122.87 2k92 h ILE 10 Ca -0.04 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.72 2k92 h ILE 10 Cb 0.55 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2k92 h ILE 10 CO 0.04 0.00 -0.43 0.40 0.00 0.00 0.00 178.15 178.16 2k92 h ILE 11 N -0.05 1.01 0.00 -0.67 1.08 -0.61 1.62 117.51 119.90 2k92 h ILE 11 Ca 0.33 -1.67 -0.00 0.00 -0.39 0.00 0.00 64.86 63.13 2k92 h ILE 11 Cb 0.57 1.98 -0.00 0.00 -3.07 0.00 0.00 36.82 36.30 2k92 h ILE 11 CO -0.79 0.42 -0.00 1.23 -0.69 0.00 0.00 178.15 178.32 2k92 h GLY 12 N 2.03 0.00 0.00 5.37 0.00 1.29 -3.15 103.07 108.62 2k92 h GLY 12 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2k92 h GLY 12 CO 0.06 0.00 -0.52 -1.06 0.00 0.00 0.00 176.54 175.01 2k92 n GLN 13 N -3.10 0.22 -0.20 4.80 1.13 0.41 -1.38 117.38 119.27 2k92 n GLN 13 Ca 0.02 0.09 -0.05 0.00 -1.94 0.00 0.00 57.00 55.11 2k92 n GLN 13 Cb 0.38 -0.88 -0.05 0.00 0.11 0.00 0.00 30.24 29.80 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 -0.41 -0.01 -0.24 -1.09 1.08 0.22 1.44 115.11 116.10 2k92 h GLN 14 Ca -0.03 0.00 0.07 0.00 -1.45 0.00 0.00 58.65 57.24 2k92 h GLN 14 Cb 0.49 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 2k92 h GLN 14 CO -0.02 -0.00 0.18 -0.07 -0.95 0.00 0.00 178.83 177.97 2k92 h LEU 15 N -0.01 0.00 -1.78 1.46 3.38 -1.58 -3.46 115.31 113.33 2k92 h LEU 15 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2k92 h LEU 15 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2k92 h LEU 15 CO -0.45 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.69 2k92 n GLY 16 N -1.57 -0.76 0.00 0.83 0.00 0.49 -4.89 105.19 99.29 2k92 n GLY 16 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2k92 n GLY 16 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2k92 n VAL 17 N -0.18 0.00 -2.33 1.61 0.24 -0.48 -4.98 118.33 112.21 2k92 n VAL 17 Ca 0.00 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.05 2k92 n VAL 17 Cb 0.00 0.00 0.11 0.00 -1.47 0.00 0.00 33.84 32.48 2k92 n VAL 17 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2k92 s LYS 18 N -1.98 1.62 -0.83 7.34 3.01 -1.26 -4.60 119.74 123.05 2k92 s LYS 18 Ca 0.00 -0.69 0.01 0.00 -1.01 0.00 0.00 55.97 54.28 2k92 s LYS 18 Cb 0.00 -2.18 0.34 0.00 -1.01 0.00 0.00 37.83 34.98 2k92 s LYS 18 CO 0.00 -1.58 1.54 0.00 0.51 0.00 0.00 175.35 175.82 2k92 n GLN 19 N -3.05 4.28 0.00 1.68 10.64 -1.26 -4.42 117.38 125.25 2k92 n GLN 19 Ca 0.13 -4.56 0.00 0.00 -1.83 0.00 0.00 57.00 50.74 2k92 n GLN 19 Cb 0.60 -2.36 0.00 0.00 -0.86 0.00 0.00 30.24 27.62 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 -0.21 0.00 0.00 2.61 1.02 -1.26 -4.88 120.64 117.91 2k92 n GLU 20 Ca 0.43 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.63 2k92 n GLU 20 Cb 0.33 -0.00 0.31 0.00 -0.02 0.00 0.00 31.44 32.06 2k92 n GLU 20 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2k92 n GLU 21 N -2.00 0.06 -2.34 3.49 1.02 -1.26 -4.66 120.64 114.95 2k92 n GLU 21 Ca 0.00 0.23 -0.43 0.00 -0.02 0.00 0.00 57.16 56.94 2k92 n GLU 21 Cb 0.00 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 29.90 2k92 n GLU 21 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2k92 s VAL 22 N -2.86 4.10 0.00 2.62 1.01 -1.26 -4.98 120.40 119.02 2k92 s VAL 22 Ca 0.09 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.43 2k92 s VAL 22 Cb 0.09 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2k92 s VAL 22 CO 0.24 -0.09 0.00 0.35 0.00 0.00 0.00 175.10 175.60 2k92 n THR 23 N 5.17 0.00 -2.38 3.92 -2.24 -1.26 -5.07 114.28 112.42 2k92 n THR 23 Ca 0.14 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.93 2k92 n THR 23 Cb 0.45 -0.01 0.06 0.00 -2.10 0.00 0.00 70.33 68.73 2k92 n THR 23 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2k92 n ASN 24 N 0.00 1.53 -2.66 3.42 6.94 -1.26 -4.66 115.26 118.56 2k92 n ASN 24 Ca 0.00 -2.47 -0.03 0.00 -0.02 0.00 0.00 54.58 52.06 2k92 n ASN 24 Cb 0.00 -0.38 0.11 0.00 -2.36 0.00 0.00 39.78 37.14 2k92 n ASN 24 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2k92 n ASN 25 N -0.11 -1.20 -3.62 0.53 2.85 -1.26 -4.34 115.26 108.12 2k92 n ASN 25 Ca 0.11 -1.78 -0.15 0.00 -0.11 0.00 0.00 54.58 52.65 2k92 n ASN 25 Cb 0.98 1.02 -0.14 0.00 1.24 0.00 0.00 39.78 42.88 2k92 n ASN 25 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k92 s ALA 26 N 0.05 -0.42 -0.54 5.20 0.00 -1.26 -5.05 121.76 119.75 2k92 s ALA 26 Ca 0.22 0.70 -0.23 0.00 0.00 0.00 0.00 51.96 52.64 2k92 s ALA 26 Cb 0.28 -1.06 -0.21 0.00 0.00 0.00 0.00 23.12 22.13 2k92 s ALA 26 CO -0.17 -0.76 1.82 0.43 0.00 0.00 0.00 175.76 177.07 2k92 n SER 27 N 5.34 2.12 -0.24 0.00 7.64 -1.26 -4.07 113.62 123.15 2k92 n SER 27 Ca -0.06 -2.60 0.02 0.00 1.01 0.00 0.00 58.87 57.25 2k92 n SER 27 Cb 0.50 -0.92 0.06 0.00 -1.01 0.00 0.00 64.21 62.84 2k92 n SER 27 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2k92 n PHE 28 N 7.71 0.14 0.00 1.43 3.01 -1.03 0.21 117.46 128.93 2k92 n PHE 28 Ca 0.47 0.81 0.00 0.00 1.01 0.00 0.00 57.45 59.74 2k92 n PHE 28 Cb 0.39 -0.82 0.00 0.00 -0.01 0.00 0.00 39.48 39.03 2k92 n PHE 28 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 2k92 n VAL 29 N -5.03 0.00 0.13 -4.37 0.24 -1.19 0.19 118.33 108.30 2k92 n VAL 29 Ca 0.09 0.60 -0.12 0.00 -2.04 0.00 0.00 64.34 62.87 2k92 n VAL 29 Cb 0.30 -1.07 -0.07 0.00 -1.47 0.00 0.00 33.84 31.53 2k92 n VAL 29 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2k92 h GLU 30 N 0.00 -0.36 -0.37 7.34 4.22 -1.71 0.88 114.58 124.59 2k92 h GLU 30 Ca 0.00 0.02 0.03 0.00 0.08 0.00 0.00 59.36 59.50 2k92 h GLU 30 Cb 0.00 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 2k92 h GLU 30 CO 0.00 -0.01 -0.22 -3.47 -2.18 0.00 0.00 179.01 173.13 2k92 n ASP 31 N -5.05 -0.39 0.00 1.04 -0.08 0.57 -4.10 116.55 108.53 2k92 n ASP 31 Ca -0.08 1.18 0.00 0.00 -1.51 0.00 0.00 54.79 54.37 2k92 n ASP 31 Cb 0.26 -0.34 0.00 0.00 2.34 0.00 0.00 41.12 43.38 2k92 n ASP 31 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2k92 n LEU 32 N -3.82 0.60 0.00 -2.67 4.32 0.19 -4.95 117.00 110.66 2k92 n LEU 32 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.00 2k92 n LEU 32 Cb 0.10 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.90 2k92 n LEU 32 CO -0.06 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.72 2k92 n GLY 33 N 2.83 -0.55 2.34 -0.72 0.00 0.51 -4.94 105.19 104.66 2k92 n GLY 33 Ca 0.00 0.75 -0.26 0.00 0.00 0.00 0.00 46.02 46.51 2k92 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k92 n ALA 34 N 0.00 2.75 -1.73 4.61 0.00 -0.49 -4.86 120.51 120.79 2k92 n ALA 34 Ca 0.00 -3.17 0.05 0.00 0.00 0.00 0.00 53.44 50.32 2k92 n ALA 34 Cb 0.00 -0.77 0.18 0.00 0.00 0.00 0.00 19.45 18.87 2k92 n ALA 34 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2k92 n ASP 35 N 2.49 1.69 0.05 0.00 2.03 -1.26 -4.39 116.55 117.16 2k92 n ASP 35 Ca 0.28 -3.65 0.00 0.00 0.52 0.00 0.00 54.79 51.93 2k92 n ASP 35 Cb 0.49 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2k92 n ASP 35 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2k92 n SER 36 N -0.90 -0.81 -2.29 1.67 7.64 -1.26 -4.94 113.62 112.72 2k92 n SER 36 Ca 0.18 0.20 -0.28 0.00 1.01 0.00 0.00 58.87 59.98 2k92 n SER 36 Cb 0.76 1.06 0.02 0.00 -1.01 0.00 0.00 64.21 65.04 2k92 n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k92 n LEU 37 N -2.73 5.42 0.00 -3.43 -0.00 -1.26 -4.67 117.00 110.33 2k92 n LEU 37 Ca 0.00 -4.86 0.00 0.00 -0.00 0.00 0.00 56.01 51.15 2k92 n LEU 37 Cb 0.00 -0.52 0.00 0.00 -0.00 0.00 0.00 43.42 42.90 2k92 n LEU 37 CO 0.00 2.05 0.00 -0.67 -0.00 0.00 0.00 177.39 178.77 2k92 n ASP 38 N -0.64 0.00 -0.05 1.45 -0.08 -1.26 -3.48 116.55 112.48 2k92 n ASP 38 Ca 0.45 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.59 2k92 n ASP 38 Cb 0.76 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 44.10 2k92 n ASP 38 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k92 h THR 39 N 0.00 1.71 -1.83 5.18 1.03 -1.88 0.18 112.91 117.31 2k92 h THR 39 Ca 0.00 -2.17 0.54 0.00 -0.01 0.00 0.00 66.41 64.76 2k92 h THR 39 Cb 0.00 3.18 -0.08 0.00 -1.07 0.00 0.00 68.15 70.18 2k92 h THR 39 CO 0.00 0.57 1.30 0.52 -0.01 0.00 0.00 175.52 177.90 2k92 n VAL 40 N -4.61 -0.03 -0.07 0.00 0.31 -1.26 0.11 118.33 112.79 2k92 n VAL 40 Ca -0.10 1.45 -0.07 0.00 -0.01 0.00 0.00 64.34 65.62 2k92 n VAL 40 Cb 0.47 -2.42 -0.02 0.00 -0.91 0.00 0.00 33.84 30.96 2k92 n VAL 40 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2k92 n GLU 41 N -3.92 0.41 -0.35 5.55 4.71 -1.22 -4.24 120.64 121.58 2k92 n GLU 41 Ca 0.42 0.16 0.15 0.00 -0.01 0.00 0.00 57.16 57.88 2k92 n GLU 41 Cb 1.88 -1.21 0.29 0.00 -1.01 0.00 0.00 31.44 31.40 2k92 n GLU 41 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 2k92 h LEU 42 N -0.77 -0.50 -0.04 -4.62 6.46 0.37 0.24 115.31 116.46 2k92 h LEU 42 Ca 0.00 0.29 0.01 0.00 -0.12 0.00 0.00 57.88 58.06 2k92 h LEU 42 Cb 0.77 0.50 -0.03 0.00 -0.73 0.00 0.00 40.66 41.17 2k92 h LEU 42 CO 0.00 -0.37 -0.24 0.58 -0.62 0.00 0.00 178.44 177.80 2k92 h VAL 43 N 0.00 0.00 -0.66 1.05 2.07 0.64 1.16 116.25 120.51 2k92 h VAL 43 Ca 0.61 0.00 0.12 0.00 0.82 0.00 0.00 66.70 68.24 2k92 h VAL 43 Cb 1.25 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.89 2k92 h VAL 43 CO -0.94 0.00 -0.32 0.24 0.02 0.00 0.00 177.57 176.58 2k92 h MET 44 N -0.27 -0.11 0.05 1.57 2.86 -0.75 2.10 114.93 120.37 2k92 h MET 44 Ca 0.01 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2k92 h MET 44 Cb 0.30 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 2k92 h MET 44 CO -0.18 -0.08 -0.03 0.00 1.06 0.00 0.00 176.91 177.68 2k92 h ALA 45 N 1.16 -0.89 -0.29 6.32 0.00 -0.51 1.34 119.26 126.40 2k92 h ALA 45 Ca 0.26 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.24 2k92 h ALA 45 Cb 0.55 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2k92 h ALA 45 CO -0.73 -0.89 0.57 -0.07 0.00 0.00 0.00 179.25 178.14 2k92 h LEU 46 N -0.08 0.00 0.01 0.00 3.38 0.18 0.34 115.31 119.14 2k92 h LEU 46 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2k92 h LEU 46 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2k92 h LEU 46 CO 0.00 0.00 -0.00 -0.33 0.09 0.00 0.00 178.44 178.20 2k92 h GLU 47 N 0.00 -0.01 -0.47 1.13 4.39 0.46 -3.27 114.58 116.81 2k92 h GLU 47 Ca 0.14 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 2k92 h GLU 47 Cb 1.28 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.91 2k92 h GLU 47 CO -0.00 0.82 0.24 0.93 -1.16 0.00 0.00 179.01 179.84 2k92 h GLU 48 N -0.95 0.65 -0.16 2.33 4.39 0.53 0.15 114.58 121.52 2k92 h GLU 48 Ca -0.00 -0.07 0.05 0.00 0.34 0.00 0.00 59.36 59.68 2k92 h GLU 48 Cb 0.83 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.34 2k92 h GLU 48 CO 0.00 0.50 0.15 1.49 -1.16 0.00 0.00 179.01 179.99 2k92 h GLU 49 N 0.66 0.00 0.00 2.33 4.57 -0.66 -3.43 114.58 118.05 2k92 h GLU 49 Ca 0.17 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 2k92 h GLU 49 Cb 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 2k92 h GLU 49 CO -0.03 0.00 0.00 1.19 -1.18 0.00 0.00 179.01 178.99 2k92 n PHE 50 N -4.09 0.00 0.00 0.92 3.72 -0.27 -5.10 117.46 112.64 2k92 n PHE 50 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 2k92 n PHE 50 Cb 0.27 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 2k92 n PHE 50 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2k92 n ASP 51 N -0.78 0.00 -3.02 4.37 10.43 0.37 -4.97 116.55 122.95 2k92 n ASP 51 Ca 0.00 0.00 0.03 0.00 2.57 0.00 0.00 54.79 57.39 2k92 n ASP 51 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 2k92 n ASP 51 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 2k92 s THR 52 N 0.00 -0.43 -0.68 -3.53 -1.32 -1.26 -5.02 115.64 103.40 2k92 s THR 52 Ca 0.00 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.22 2k92 s THR 52 Cb 0.00 -0.21 -0.23 0.00 -1.51 0.00 0.00 72.50 70.55 2k92 s THR 52 CO 0.00 0.00 1.86 -1.84 -2.21 0.00 0.00 174.62 172.43 2k92 n GLU 53 N 4.52 0.75 -1.46 7.08 0.00 -1.26 -4.48 120.64 125.79 2k92 n GLU 53 Ca 0.08 -1.68 -0.46 0.00 0.00 0.00 0.00 57.16 55.10 2k92 n GLU 53 Cb 0.59 -3.17 -0.09 0.00 0.00 0.00 0.00 31.44 28.77 2k92 n GLU 53 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.13 178.64 2k92 n ILE 54 N 7.34 0.06 -2.53 3.84 0.13 -1.26 -4.87 119.36 122.08 2k92 n ILE 54 Ca 0.46 -0.27 -0.37 0.00 -1.10 0.00 0.00 62.75 61.47 2k92 n ILE 54 Cb 0.44 -1.43 -0.04 0.00 -0.84 0.00 0.00 39.64 37.76 2k92 n ILE 54 CO 0.00 0.00 0.00 -2.16 2.80 0.00 0.00 176.55 177.19 2k92 s PRO 55 N 7.36 4.23 0.30 9.51 0.04 -1.26 -4.72 135.00 150.47 2k92 s PRO 55 Ca 1.16 1.56 0.06 0.00 0.04 0.00 0.00 61.00 63.82 2k92 s PRO 55 Cb -0.90 -2.65 0.82 0.00 0.04 0.00 0.00 34.50 31.81 2k92 s PRO 55 CO 0.46 -0.09 1.67 -0.44 0.04 0.00 0.00 177.00 178.65 2k92 h ASP 56 N 2.71 0.29 -1.00 6.66 5.19 -1.95 1.64 116.42 129.96 2k92 h ASP 56 Ca -0.48 0.18 0.23 0.00 -0.62 0.00 0.00 57.03 56.33 2k92 h ASP 56 Cb 1.22 0.17 -0.10 0.00 0.18 0.00 0.00 39.33 40.80 2k92 h ASP 56 CO 0.63 -0.08 0.63 -0.08 -3.12 0.00 0.00 179.24 177.22 2k92 h GLU 57 N 0.33 0.53 0.00 3.56 4.57 -1.99 0.31 114.58 121.88 2k92 h GLU 57 Ca 0.61 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.75 2k92 h GLU 57 Cb 1.24 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.71 2k92 h GLU 57 CO -0.59 0.35 -1.50 0.39 -1.18 0.00 0.00 179.01 176.48 2k92 n GLU 58 N -4.69 0.39 0.16 1.92 1.02 0.35 -4.11 120.64 115.67 2k92 n GLU 58 Ca 0.24 -0.10 0.01 0.00 -0.02 0.00 0.00 57.16 57.29 2k92 n GLU 58 Cb 0.73 -1.53 0.24 0.00 -0.02 0.00 0.00 31.44 30.86 2k92 n GLU 58 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k92 h ALA 59 N 2.41 1.03 0.00 0.62 0.00 0.53 -2.25 119.26 121.60 2k92 h ALA 59 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2k92 h ALA 59 Cb 0.80 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2k92 h ALA 59 CO 0.00 0.66 0.00 -1.91 0.00 0.00 0.00 179.25 178.00 2k92 n GLU 60 N -3.77 0.07 -0.00 0.00 2.13 0.53 -0.93 120.64 118.67 2k92 n GLU 60 Ca -0.01 0.25 0.10 0.00 0.66 0.00 0.00 57.16 58.16 2k92 n GLU 60 Cb 0.56 -1.50 -0.13 0.00 0.27 0.00 0.00 31.44 30.64 2k92 n GLU 60 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2k92 n LYS 61 N -1.42 0.46 -0.60 5.31 4.81 -0.85 -4.09 118.16 121.79 2k92 n LYS 61 Ca 0.04 -0.08 0.08 0.00 -0.87 0.00 0.00 58.31 57.48 2k92 n LYS 61 Cb 0.13 -1.47 0.32 0.00 0.02 0.00 0.00 35.03 34.02 2k92 n LYS 61 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 2k92 n ILE 62 N -1.80 2.24 -0.41 3.15 -5.35 -0.11 -4.65 119.36 112.43 2k92 n ILE 62 Ca 0.01 -1.52 0.34 0.00 -0.27 0.00 0.00 62.75 61.30 2k92 n ILE 62 Cb 0.41 -0.12 0.55 0.00 -1.74 0.00 0.00 39.64 38.75 2k92 n ILE 62 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 2k92 n THR 63 N 0.25 -0.15 -0.24 7.28 -2.24 -1.04 -4.12 114.28 114.03 2k92 n THR 63 Ca 0.23 1.34 0.00 0.00 -2.27 0.00 0.00 64.05 63.35 2k92 n THR 63 Cb 0.95 -2.20 0.00 0.00 -2.10 0.00 0.00 70.33 66.98 2k92 n THR 63 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2k92 n THR 64 N -4.06 0.00 0.00 4.28 -2.24 -1.26 -2.47 114.28 108.54 2k92 n THR 64 Ca 0.32 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.10 2k92 n THR 64 Cb 1.30 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 2k92 n THR 64 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2k92 n VAL 65 N 0.00 0.00 -0.09 2.28 0.31 -1.26 -4.63 118.33 114.95 2k92 n VAL 65 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 2k92 n VAL 65 Cb 0.00 -0.94 -0.00 0.00 -0.91 0.00 0.00 33.84 31.99 2k92 n VAL 65 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2k92 h GLN 66 N 0.00 -0.13 -0.98 5.55 4.15 -1.83 0.23 115.11 122.10 2k92 h GLN 66 Ca 0.00 0.01 0.22 0.00 0.77 0.00 0.00 58.65 59.65 2k92 h GLN 66 Cb 0.96 0.03 -0.09 0.00 0.21 0.00 0.00 27.48 28.60 2k92 h GLN 66 CO 0.00 -0.09 0.63 0.00 -1.93 0.00 0.00 178.83 177.44 2k92 h ALA 67 N 1.08 2.06 0.00 3.38 0.00 -1.86 1.95 119.26 125.87 2k92 h ALA 67 Ca 0.17 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2k92 h ALA 67 Cb 0.39 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2k92 h ALA 67 CO -0.41 -0.41 -0.06 0.00 0.00 0.00 0.00 179.25 178.37 2k92 h ALA 68 N 1.62 1.10 0.00 0.00 0.00 -0.81 0.14 119.26 121.31 2k92 h ALA 68 Ca 0.54 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.37 2k92 h ALA 68 Cb 1.20 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2k92 h ALA 68 CO -0.27 0.07 -0.49 0.82 0.00 0.00 0.00 179.25 179.39 2k92 h ILE 69 N 0.00 0.15 0.00 0.00 5.03 0.35 -3.04 117.51 120.00 2k92 h ILE 69 Ca -0.00 -1.17 0.00 0.00 -0.12 0.00 0.00 64.86 63.57 2k92 h ILE 69 Cb 0.34 0.34 0.00 0.00 -3.03 0.00 0.00 36.82 34.46 2k92 h ILE 69 CO 0.01 0.05 0.18 -0.78 -0.68 0.00 0.00 178.15 176.93 2k92 h ASP 70 N -1.00 0.00 0.09 1.72 3.58 -0.47 0.26 116.42 120.60 2k92 h ASP 70 Ca -0.04 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.27 2k92 h ASP 70 Cb 0.52 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.58 2k92 h ASP 70 CO -0.02 0.00 -0.63 0.22 -2.88 0.00 0.00 179.24 175.92 2k92 h TYR 71 N 0.00 0.34 0.00 0.28 3.20 -0.84 0.22 116.97 120.16 2k92 h TYR 71 Ca 0.00 -0.25 0.00 0.00 3.14 0.00 0.00 58.73 61.62 2k92 h TYR 71 Cb 0.37 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.63 2k92 h TYR 71 CO 0.00 1.24 0.00 0.82 -1.64 0.00 0.00 178.16 178.58 2k92 h ILE 72 N -0.59 0.00 0.02 1.81 1.08 -0.86 -2.82 117.51 116.15 2k92 h ILE 72 Ca -0.12 -0.60 -0.33 0.00 -0.39 0.00 0.00 64.86 63.42 2k92 h ILE 72 Cb 1.43 1.59 -0.05 0.00 -3.07 0.00 0.00 36.82 36.72 2k92 h ILE 72 CO 0.08 0.00 -1.95 0.59 -0.69 0.00 0.00 178.15 176.18 2k92 n ASN 73 N -3.03 0.99 0.01 1.72 3.02 0.70 -3.61 115.26 115.07 2k92 n ASN 73 Ca 0.02 0.26 0.06 0.00 -0.03 0.00 0.00 54.58 54.89 2k92 n ASN 73 Cb 0.35 -0.02 0.28 0.00 -0.61 0.00 0.00 39.78 39.78 2k92 n ASN 73 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k92 n GLY 74 N 1.72 -0.94 0.11 7.41 0.00 0.77 -2.49 105.19 111.77 2k92 n GLY 74 Ca -0.25 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 2k92 n GLY 74 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2k92 n HIS 75 N -1.57 0.72 -3.65 1.61 -0.00 -1.11 -4.68 115.22 106.53 2k92 n HIS 75 Ca 0.03 0.31 -0.32 0.00 0.46 0.00 0.00 57.72 58.20 2k92 n HIS 75 Cb 0.14 -1.00 -0.08 0.00 -0.12 0.00 0.00 29.99 28.93 2k92 n HIS 75 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2k92 n GLN 76 N -4.42 2.45 0.00 1.57 3.00 -1.13 -5.14 117.38 113.71 2k92 n GLN 76 Ca -0.33 -4.53 0.07 0.00 -0.01 0.00 0.00 57.00 52.20 2k92 n GLN 76 Cb 0.66 -2.35 0.06 0.00 0.00 0.00 0.00 30.24 28.61 2k92 n GLN 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06