#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i56 n SER 35 N 0.00 5.30 0.19 4.04 7.64 -1.26 -4.62 113.62 124.91 3i56 n SER 35 Ca 0.00 -3.77 0.13 0.00 1.01 0.00 0.00 58.87 56.24 3i56 n SER 35 Cb 0.00 -0.60 0.36 0.00 -1.01 0.00 0.00 64.21 62.96 3i56 n SER 35 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3i56 h GLY 36 N 1.89 0.00 2.00 0.23 0.00 -1.96 -3.02 103.07 102.21 3i56 h GLY 36 Ca 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.69 3i56 h GLY 36 CO 0.95 0.00 -0.27 0.07 0.00 0.00 0.00 176.54 177.29 3i56 h ARG 37 N 0.00 0.00 0.00 4.80 0.11 -2.04 -2.79 114.38 114.46 3i56 h ARG 37 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3i56 h ARG 37 Cb 0.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.85 3i56 h ARG 37 CO 0.00 0.27 0.00 1.19 0.10 0.00 0.00 179.97 181.53 3i56 n PHE 38 N -3.66 0.91 -0.40 4.08 0.99 -1.14 -5.00 117.46 113.24 3i56 n PHE 38 Ca -0.01 0.29 0.00 0.00 -0.00 0.00 0.00 57.45 57.73 3i56 n PHE 38 Cb 0.39 -0.97 0.00 0.00 -1.00 0.00 0.00 39.48 37.90 3i56 n PHE 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3i56 n GLY 39 N 0.98 3.03 1.13 1.37 0.00 -1.06 -2.16 105.19 108.49 3i56 n GLY 39 Ca 0.05 -0.22 0.12 0.00 0.00 0.00 0.00 46.02 45.96 3i56 n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i56 n ALA 40 N 11.43 2.42 -2.04 4.61 0.00 -1.26 -4.95 120.51 130.73 3i56 n ALA 40 Ca 0.00 -1.01 -0.26 0.00 0.00 0.00 0.00 53.44 52.17 3i56 n ALA 40 Cb 0.00 -0.91 0.04 0.00 0.00 0.00 0.00 19.45 18.58 3i56 n ALA 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3i56 s ARG 41 N -1.42 2.75 0.00 0.00 0.52 -0.92 -4.59 118.95 115.29 3i56 s ARG 41 Ca 0.40 -0.06 0.00 0.00 -0.52 0.00 0.00 55.73 55.55 3i56 s ARG 41 Cb 0.23 -2.25 0.00 0.00 0.52 0.00 0.00 34.95 33.45 3i56 s ARG 41 CO 0.31 -0.83 0.00 0.66 0.02 0.00 0.00 175.30 175.46 3i56 n TYR 42 N -2.67 0.00 0.00 -0.53 4.02 -1.26 -4.93 117.16 111.79 3i56 n TYR 42 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 3i56 n TYR 42 Cb 0.58 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 3i56 n TYR 42 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3i56 n GLY 43 N -0.68 0.27 0.00 2.72 0.00 -1.26 -4.63 105.19 101.61 3i56 n GLY 43 Ca 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.27 3i56 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i56 n ARG 44 N 0.40 0.00 -0.12 1.61 1.74 -1.26 -2.83 116.66 116.20 3i56 n ARG 44 Ca 0.00 0.80 -0.09 0.00 -0.77 0.00 0.00 57.85 57.78 3i56 n ARG 44 Cb 0.00 -1.46 -0.04 0.00 -1.02 0.00 0.00 32.46 29.95 3i56 n ARG 44 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3i56 h VAL 45 N 0.00 0.14 -0.11 1.55 2.07 -1.98 -0.77 116.25 117.15 3i56 h VAL 45 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 3i56 h VAL 45 Cb 0.00 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 29.85 3i56 h VAL 45 CO 0.00 0.00 -0.22 0.28 0.02 0.00 0.00 177.57 177.65 3i56 h SER 46 N -0.32 -0.69 1.63 0.57 0.02 -1.82 -0.93 113.55 112.02 3i56 h SER 46 Ca 0.14 0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.16 3i56 h SER 46 Cb 0.58 0.31 -0.01 0.00 0.14 0.00 0.00 62.40 63.42 3i56 h SER 46 CO -0.56 -0.28 -0.20 0.08 -1.14 0.00 0.00 176.83 174.73 3i56 h ARG 47 N -0.30 0.00 -0.23 3.45 0.11 -1.39 -2.61 114.38 113.41 3i56 h ARG 47 Ca 0.09 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 60.01 3i56 h ARG 47 Cb 0.43 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.52 3i56 h ARG 47 CO -0.28 0.20 -0.51 -0.09 0.10 0.00 0.00 179.97 179.39 3i56 h ARG 48 N 0.00 0.76 0.00 0.08 2.43 -0.84 -2.13 114.38 114.68 3i56 h ARG 48 Ca -0.00 -0.50 -0.07 0.00 -0.81 0.00 0.00 59.98 58.59 3i56 h ARG 48 Cb 1.07 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.68 3i56 h ARG 48 CO 0.03 1.13 -0.35 0.00 -1.51 0.00 0.00 179.97 179.27 3i56 h ARG 49 N 0.50 0.00 0.00 0.20 3.08 -1.11 -1.83 114.38 115.22 3i56 h ARG 49 Ca 0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.79 3i56 h ARG 49 Cb 1.12 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.19 3i56 h ARG 49 CO 0.11 0.35 -1.03 0.28 -1.07 0.00 0.00 179.97 178.61 3i56 h VAL 50 N 0.00 1.30 -0.29 2.04 2.07 -1.34 -2.23 116.25 117.80 3i56 h VAL 50 Ca -0.00 -2.29 -0.03 0.00 0.82 0.00 0.00 66.70 65.19 3i56 h VAL 50 Cb 0.84 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.99 3i56 h VAL 50 CO 0.05 0.70 0.05 0.00 0.02 0.00 0.00 177.57 178.39 3i56 h ALA 51 N 0.46 0.39 0.04 1.67 0.00 -1.20 -0.40 119.26 120.23 3i56 h ALA 51 Ca -0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 3i56 h ALA 51 Cb 1.68 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.36 3i56 h ALA 51 CO 0.20 0.07 -0.02 0.93 0.00 0.00 0.00 179.25 180.43 3i56 h GLU 52 N 0.30 -0.05 -0.35 0.00 5.08 -1.39 0.25 114.58 118.43 3i56 h GLU 52 Ca 0.09 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 3i56 h GLU 52 Cb 0.33 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3i56 h GLU 52 CO 0.00 0.14 -0.19 0.82 -1.00 0.00 0.00 179.01 178.78 3i56 h ILE 53 N -0.24 1.26 0.00 3.13 2.04 -1.41 -2.30 117.51 119.99 3i56 h ILE 53 Ca -0.01 -1.24 0.00 0.00 1.00 0.00 0.00 64.86 64.61 3i56 h ILE 53 Cb 0.22 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 3i56 h ILE 53 CO 0.01 0.41 -0.01 -0.33 0.00 0.00 0.00 178.15 178.23 3i56 h GLU 54 N 0.58 0.00 -0.04 2.37 5.08 -0.99 -2.20 114.58 119.37 3i56 h GLU 54 Ca 0.09 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 3i56 h GLU 54 Cb 0.65 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.91 3i56 h GLU 54 CO 0.05 0.00 -0.37 1.03 -1.00 0.00 0.00 179.01 178.72 3i56 h SER 55 N 0.00 0.40 0.72 1.42 0.87 -0.63 -1.39 113.55 114.95 3i56 h SER 55 Ca 0.00 -0.69 -0.04 0.00 -1.23 0.00 0.00 61.79 59.83 3i56 h SER 55 Cb 0.99 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.83 3i56 h SER 55 CO 0.00 1.03 -0.19 -0.08 -0.53 0.00 0.00 176.83 177.06 3i56 h GLU 56 N -0.20 0.00 0.13 2.24 4.81 -1.42 -2.57 114.58 117.57 3i56 h GLU 56 Ca -0.03 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.92 3i56 h GLU 56 Cb 1.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3i56 h GLU 56 CO 0.07 0.19 -1.30 1.98 -0.73 0.00 0.00 179.01 179.23 3i56 h MET 57 N 0.00 0.27 -0.19 1.92 4.05 -1.32 -3.28 114.93 116.37 3i56 h MET 57 Ca -0.00 -0.46 0.00 0.00 -0.28 0.00 0.00 59.70 58.96 3i56 h MET 57 Cb 0.60 0.17 0.00 0.00 -0.80 0.00 0.00 31.60 31.57 3i56 h MET 57 CO 0.02 1.20 0.00 0.09 0.23 0.00 0.00 176.91 178.45 3i56 n ASN 58 N -3.52 1.43 -4.55 1.39 3.02 -0.53 -4.80 115.26 107.70 3i56 n ASN 58 Ca -0.10 -1.78 -0.29 0.00 -0.03 0.00 0.00 54.58 52.38 3i56 n ASN 58 Cb 1.03 -0.13 0.17 0.00 -0.61 0.00 0.00 39.78 40.25 3i56 n ASN 58 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3i56 s GLU 59 N -1.75 0.40 -0.30 3.52 2.02 -1.00 -5.00 118.70 116.59 3i56 s GLU 59 Ca 0.27 0.27 -0.24 0.00 0.02 0.00 0.00 54.97 55.29 3i56 s GLU 59 Cb 0.14 -1.76 0.00 0.00 0.10 0.00 0.00 34.13 32.62 3i56 s GLU 59 CO 0.21 -2.70 0.80 -0.51 0.02 0.00 0.00 175.26 173.08 3i56 s ASP 60 N -3.83 6.68 -0.09 -0.19 1.01 -1.26 -4.92 116.67 114.06 3i56 s ASP 60 Ca 0.66 0.70 -0.00 0.00 0.71 0.00 0.00 52.55 54.62 3i56 s ASP 60 Cb -0.15 -2.41 -0.03 0.00 1.01 0.00 0.00 42.92 41.34 3i56 s ASP 60 CO 0.55 -0.61 -0.07 -1.00 0.21 0.00 0.00 175.17 174.26 3i56 s HIS 61 N 2.96 2.95 0.18 4.23 3.76 -1.26 -4.99 115.29 123.12 3i56 s HIS 61 Ca 0.33 -0.11 -0.30 0.00 -0.15 0.00 0.00 55.06 54.82 3i56 s HIS 61 Cb -0.14 -1.78 -0.08 0.00 1.11 0.00 0.00 32.58 31.68 3i56 s HIS 61 CO 0.12 0.20 1.24 0.00 -0.85 0.00 0.00 174.74 175.45 3i56 s ALA 62 N -0.42 3.47 0.10 -1.40 0.00 -1.26 -2.46 121.76 119.78 3i56 s ALA 62 Ca 0.06 1.00 -0.30 0.00 0.00 0.00 0.00 51.96 52.72 3i56 s ALA 62 Cb -0.12 -3.44 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 3i56 s ALA 62 CO 0.02 -0.44 0.96 0.00 0.00 0.00 0.00 175.76 176.31 3i56 n PRO 64 N 2.93 0.42 0.00 0.00 -0.02 -1.26 -2.37 135.00 134.70 3i56 n PRO 64 Ca 0.03 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 3i56 n PRO 64 Cb 0.49 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.47 3i56 n PRO 64 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3i56 n ASN 65 N -1.16 0.00 0.10 2.55 5.15 -1.26 -4.88 115.26 115.76 3i56 n ASN 65 Ca 0.11 0.00 -0.23 0.00 -0.60 0.00 0.00 54.58 53.87 3i56 n ASN 65 Cb 0.11 -0.19 -0.14 0.00 -0.53 0.00 0.00 39.78 39.03 3i56 n ASN 65 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3i56 n GLY 67 N 1.45 0.60 3.80 0.00 0.00 -1.00 -5.02 105.19 105.03 3i56 n GLY 67 Ca -0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 3i56 n GLY 67 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i56 s GLU 68 N -0.64 4.14 -1.17 1.61 8.01 -1.26 -4.41 118.70 124.98 3i56 s GLU 68 Ca 0.00 1.26 -0.08 0.00 0.01 0.00 0.00 54.97 56.15 3i56 s GLU 68 Cb 0.00 -2.26 -0.12 0.00 -4.31 0.00 0.00 34.13 27.44 3i56 s GLU 68 CO 0.00 -0.13 2.91 -0.25 0.01 0.00 0.00 175.26 177.80 3i56 n ASP 69 N -0.54 7.32 -1.35 -0.19 9.92 -1.26 -1.65 116.55 128.80 3i56 n ASP 69 Ca 0.07 -2.49 -0.04 0.00 -0.53 0.00 0.00 54.79 51.80 3i56 n ASP 69 Cb 0.53 -1.43 0.11 0.00 -0.64 0.00 0.00 41.12 39.69 3i56 n ASP 69 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3i56 n ARG 70 N 3.46 2.02 -3.72 -1.24 1.74 -1.12 -4.43 116.66 113.36 3i56 n ARG 70 Ca 0.65 -3.42 -0.36 0.00 -0.77 0.00 0.00 57.85 53.95 3i56 n ARG 70 Cb 0.34 -1.61 -0.07 0.00 -1.02 0.00 0.00 32.46 30.10 3i56 n ARG 70 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3i56 s VAL 71 N -3.28 5.40 0.15 1.55 1.01 -1.03 -0.82 120.40 123.39 3i56 s VAL 71 Ca 0.41 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.73 3i56 s VAL 71 Cb 0.38 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 3i56 s VAL 71 CO -0.05 0.47 -0.17 -1.81 0.00 0.00 0.00 175.10 173.54 3i56 s ASP 72 N 0.10 2.44 0.20 3.32 1.01 -0.01 -4.20 116.67 119.54 3i56 s ASP 72 Ca 0.11 -0.85 -0.26 0.00 0.71 0.00 0.00 52.55 52.26 3i56 s ASP 72 Cb -0.12 -0.13 -0.08 0.00 1.01 0.00 0.00 42.92 43.60 3i56 s ASP 72 CO 0.00 -0.08 0.83 -0.60 0.21 0.00 0.00 175.17 175.53 3i56 s ARG 73 N -2.78 4.62 -0.07 8.23 3.52 -1.26 -0.68 118.95 130.53 3i56 s ARG 73 Ca 0.14 1.24 0.13 0.00 -0.13 0.00 0.00 55.73 57.10 3i56 s ARG 73 Cb -0.05 -3.21 -0.19 0.00 -1.56 0.00 0.00 34.95 29.94 3i56 s ARG 73 CO 0.05 0.53 0.19 1.04 -0.81 0.00 0.00 175.30 176.30 3i56 n GLN 74 N 1.43 1.08 -3.05 5.12 1.13 0.16 -4.91 117.38 118.33 3i56 n GLN 74 Ca -0.04 -0.07 0.00 0.00 -1.94 0.00 0.00 57.00 54.95 3i56 n GLN 74 Cb 0.48 -1.33 0.00 0.00 0.11 0.00 0.00 30.24 29.51 3i56 n GLN 74 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3i56 n GLY 75 N 1.94 -0.61 3.56 1.08 0.00 -1.18 -4.98 105.19 105.00 3i56 n GLY 75 Ca -0.11 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 44.89 3i56 n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i56 s THR 76 N -3.00 3.41 0.00 2.61 2.01 -1.26 -2.79 115.64 116.61 3i56 s THR 76 Ca 0.00 0.30 0.00 0.00 0.31 0.00 0.00 61.69 62.30 3i56 s THR 76 Cb 0.00 -3.87 0.00 0.00 0.01 0.00 0.00 72.50 68.64 3i56 s THR 76 CO 0.00 -0.78 0.00 0.61 -0.69 0.00 0.00 174.62 173.76 3i56 n GLY 77 N 5.61 1.79 3.63 4.40 0.00 -1.24 -4.99 105.19 114.39 3i56 n GLY 77 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 3i56 n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i56 s ILE 78 N -2.54 5.19 0.05 -0.61 1.01 -1.12 -1.72 121.20 121.45 3i56 s ILE 78 Ca 0.00 0.61 0.08 0.00 0.00 0.00 0.00 60.65 61.34 3i56 s ILE 78 Cb 0.00 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.74 3i56 s ILE 78 CO 0.00 0.19 -0.23 0.26 0.00 0.00 0.00 174.94 175.16 3i56 s TRP 79 N 1.79 2.01 -0.06 3.97 0.52 -0.17 0.41 118.94 127.42 3i56 s TRP 79 Ca 0.16 -0.39 -0.08 0.00 0.02 0.00 0.00 56.10 55.81 3i56 s TRP 79 Cb -0.15 -1.20 0.02 0.00 -1.15 0.00 0.00 33.47 30.99 3i56 s TRP 79 CO 0.09 0.11 0.22 -1.14 0.02 0.00 0.00 176.95 176.24 3i56 s GLN 80 N -1.21 0.35 -0.14 4.98 0.74 0.14 0.18 119.66 124.70 3i56 s GLN 80 Ca 0.09 0.11 -0.23 0.00 0.05 0.00 0.00 55.36 55.39 3i56 s GLN 80 Cb -0.09 0.16 -0.03 0.00 1.10 0.00 0.00 33.01 34.15 3i56 s GLN 80 CO 0.02 -0.07 0.70 0.00 -0.55 0.00 0.00 175.29 175.39 3i56 n SER 82 N 4.54 2.56 0.00 0.00 3.41 0.00 -1.89 113.62 122.25 3i56 n SER 82 Ca -0.00 -2.31 0.00 0.00 -0.26 0.00 0.00 58.87 56.30 3i56 n SER 82 Cb 0.50 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 3i56 n SER 82 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i56 n TYR 83 N 0.14 0.00 1.46 7.33 9.36 -1.26 -4.86 117.16 129.33 3i56 n TYR 83 Ca 0.10 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.46 3i56 n TYR 83 Cb 0.60 0.06 0.51 0.00 -0.63 0.00 0.00 39.34 39.87 3i56 n TYR 83 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3i56 n ASP 85 N -0.01 -4.93 -4.64 0.00 8.00 -0.79 -4.96 116.55 109.23 3i56 n ASP 85 Ca 0.18 0.12 -0.42 0.00 0.71 0.00 0.00 54.79 55.37 3i56 n ASP 85 Cb 0.35 -2.85 -0.03 0.00 -0.02 0.00 0.00 41.12 38.57 3i56 n ASP 85 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3i56 s TYR 86 N -1.73 1.63 -0.28 1.24 5.04 -1.26 -4.68 117.35 117.32 3i56 s TYR 86 Ca 0.00 0.17 -0.09 0.00 -2.44 0.00 0.00 57.07 54.71 3i56 s TYR 86 Cb 0.00 -4.04 -0.03 0.00 0.35 0.00 0.00 41.96 38.24 3i56 s TYR 86 CO 0.00 -4.16 0.13 0.21 -1.34 0.00 0.00 175.55 170.40 3i56 s LYS 87 N 4.84 3.68 0.24 4.97 2.20 -1.26 -1.52 119.74 132.90 3i56 s LYS 87 Ca 0.83 -0.48 0.01 0.00 -0.36 0.00 0.00 55.97 55.97 3i56 s LYS 87 Cb -0.34 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.43 3i56 s LYS 87 CO 0.34 -0.24 0.10 -0.59 -0.36 0.00 0.00 175.35 174.60 3i56 s PHE 88 N 1.67 1.46 -0.10 4.03 -0.12 0.13 -4.99 117.98 120.04 3i56 s PHE 88 Ca 0.06 -1.22 -0.14 0.00 -0.05 0.00 0.00 56.93 55.58 3i56 s PHE 88 Cb -0.16 -0.83 -0.05 0.00 -0.63 0.00 0.00 43.02 41.36 3i56 s PHE 88 CO 0.07 -0.40 0.34 0.95 -0.05 0.00 0.00 175.22 176.13 3i56 s THR 89 N -3.84 5.23 0.00 -4.49 -4.23 -1.26 -0.99 115.64 106.06 3i56 s THR 89 Ca 0.38 0.66 0.00 0.00 -1.18 0.00 0.00 61.69 61.55 3i56 s THR 89 Cb 0.08 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 70.26 3i56 s THR 89 CO 0.13 0.46 0.00 0.61 -0.54 0.00 0.00 174.62 175.28 3i56 n GLY 90 N 2.77 5.24 0.21 3.99 0.00 -0.70 -4.97 105.19 111.73 3i56 n GLY 90 Ca -0.13 -1.18 -0.02 0.00 0.00 0.00 0.00 46.02 44.70 3i56 n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i56 n GLY 91 N 0.00 -1.35 0.11 -0.02 0.00 0.14 -4.79 105.19 99.27 3i56 n GLY 91 Ca 0.00 -1.64 -0.17 0.00 0.00 0.00 0.00 46.02 44.22 3i56 n GLY 91 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3i56 h SER 92 N -0.25 0.45 0.00 1.61 0.02 -1.94 -3.28 113.55 110.16 3i56 h SER 92 Ca -0.02 -0.49 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 3i56 h SER 92 Cb 0.07 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.46 3i56 h SER 92 CO 0.02 1.39 0.00 -1.22 -1.14 0.00 0.00 176.83 175.88 3i56 n TYR 93 N -3.54 0.00 -4.56 3.45 4.02 -1.26 -3.87 117.16 111.40 3i56 n TYR 93 Ca -0.10 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.54 3i56 n TYR 93 Cb 1.03 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 40.22 3i56 n TYR 93 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3i56 s LYS 94 N -0.29 1.33 0.31 -0.72 1.02 -1.26 -3.96 119.74 116.18 3i56 s LYS 94 Ca 0.00 -1.00 0.17 0.00 0.02 0.00 0.00 55.97 55.16 3i56 s LYS 94 Cb 0.00 -1.49 0.13 0.00 -0.52 0.00 0.00 37.83 35.95 3i56 s LYS 94 CO 0.00 0.37 1.47 -1.00 -0.92 0.00 0.00 175.35 175.27 3i56 h PRO 95 N 4.66 0.00 -3.96 -1.68 0.13 -1.93 0.39 132.00 129.60 3i56 h PRO 95 Ca -0.44 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.23 3i56 h PRO 95 Cb 1.16 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.93 3i56 h PRO 95 CO 0.43 0.36 -0.78 -1.21 -0.23 0.00 0.00 178.00 176.57 3i56 s GLU 96 N -3.03 1.00 0.16 0.86 2.02 -1.26 -3.54 118.70 114.91 3i56 s GLU 96 Ca 0.05 -0.07 -0.04 0.00 0.02 0.00 0.00 54.97 54.93 3i56 s GLU 96 Cb 0.07 -1.18 -0.05 0.00 0.10 0.00 0.00 34.13 33.07 3i56 s GLU 96 CO 0.73 -0.24 0.39 0.95 0.02 0.00 0.00 175.26 177.10 3i56 s THR 97 N 1.67 5.17 0.59 3.63 -4.23 -1.26 -4.89 115.64 116.31 3i56 s THR 97 Ca 0.02 -0.04 0.29 0.00 -1.18 0.00 0.00 61.69 60.77 3i56 s THR 97 Cb -0.13 -3.65 0.37 0.00 1.34 0.00 0.00 72.50 70.43 3i56 s THR 97 CO -0.05 -0.02 1.99 -0.65 -0.54 0.00 0.00 174.62 175.35 3i56 h PRO 98 N 2.60 0.00 0.00 3.99 0.11 -2.01 0.19 132.00 136.88 3i56 h PRO 98 Ca -0.46 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 3i56 h PRO 98 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3i56 h PRO 98 CO 0.71 0.00 -0.69 0.78 -0.21 0.00 0.00 178.00 178.59 3i56 h GLY 99 N 0.00 0.00 2.00 -0.55 0.00 -2.01 -3.32 103.07 99.19 3i56 h GLY 99 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.34 3i56 h GLY 99 CO -0.00 0.00 -0.65 -1.33 0.00 0.00 0.00 176.54 174.56 3i56 h GLY 100 N 3.90 0.00 2.00 4.60 0.00 -1.02 -3.21 103.07 109.33 3i56 h GLY 100 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 3i56 h GLY 100 CO 0.01 0.00 -0.04 0.50 0.00 0.00 0.00 176.54 177.02 3i56 h LYS 101 N 0.00 0.00 0.00 4.80 1.57 -1.56 -3.13 116.57 118.25 3i56 h LYS 101 Ca -0.01 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 3i56 h LYS 101 Cb 1.49 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.79 3i56 h LYS 101 CO 0.08 0.04 -0.29 1.15 -0.57 0.00 0.00 179.45 179.86 3i56 h THR 102 N 0.00 0.57 -0.53 -0.16 2.02 -1.65 -3.28 112.91 109.88 3i56 h THR 102 Ca -0.00 -1.50 -0.07 0.00 0.77 0.00 0.00 66.41 65.61 3i56 h THR 102 Cb 0.88 2.05 -0.02 0.00 -1.74 0.00 0.00 68.15 69.31 3i56 h THR 102 CO 0.01 0.28 0.05 0.58 0.37 0.00 0.00 175.52 176.81 3i56 h VAL 103 N 0.00 1.26 -0.64 3.16 2.07 -1.66 -3.17 116.25 117.27 3i56 h VAL 103 Ca -0.00 -1.02 0.04 0.00 0.82 0.00 0.00 66.70 66.54 3i56 h VAL 103 Cb 1.02 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 3i56 h VAL 103 CO 0.04 0.36 0.39 0.03 0.02 0.00 0.00 177.57 178.41 3i56 h ARG 104 N 0.79 0.72 -0.09 1.57 3.08 -1.73 -3.29 114.38 115.44 3i56 h ARG 104 Ca 0.16 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.18 3i56 h ARG 104 Cb 0.46 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 3i56 h ARG 104 CO 0.02 0.48 -0.30 0.00 -1.07 0.00 0.00 179.97 179.09 3i56 h ARG 105 N 0.74 -0.30 0.00 0.04 3.08 -1.70 -3.54 114.38 112.71 3i56 h ARG 105 Ca 0.27 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.34 3i56 h ARG 105 Cb 0.07 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3i56 h ARG 105 CO -0.13 -0.20 0.00 -1.13 -1.07 0.00 0.00 179.97 177.44