#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g11 s THR 2 N 0.00 1.08 0.30 6.66 2.01 -1.26 -5.15 115.64 119.28 1g11 s THR 2 Ca 0.00 -0.56 0.06 0.00 0.31 0.00 0.00 61.69 61.50 1g11 s THR 2 Cb 0.00 -0.91 -0.02 0.00 0.01 0.00 0.00 72.50 71.58 1g11 s THR 2 CO 0.00 0.31 0.43 -1.48 -0.69 0.00 0.00 174.62 173.19 1g11 s LEU 3 N -0.16 4.10 -0.10 4.42 2.34 -1.26 -5.11 118.68 122.92 1g11 s LEU 3 Ca 0.02 -0.08 0.00 0.00 0.06 0.00 0.00 54.13 54.13 1g11 s LEU 3 Cb -0.07 -2.80 0.02 0.00 -0.56 0.00 0.00 46.19 42.78 1g11 s LEU 3 CO 0.00 -0.30 -0.09 0.00 -1.06 0.00 0.00 176.35 174.90 1g11 s ALA 4 N -2.10 1.31 -0.11 1.48 0.00 -1.26 -5.11 121.76 115.97 1g11 s ALA 4 Ca 0.41 -0.51 -0.30 0.00 0.00 0.00 0.00 51.96 51.57 1g11 s ALA 4 Cb -0.09 -0.79 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 1g11 s ALA 4 CO 0.30 -0.24 1.01 0.34 0.00 0.00 0.00 175.76 177.18 1g11 s ASP 5 N 1.35 7.24 -0.64 0.00 2.15 -1.26 -4.93 116.67 120.58 1g11 s ASP 5 Ca -0.02 1.52 -0.26 0.00 0.43 0.00 0.00 52.55 54.23 1g11 s ASP 5 Cb -0.14 -2.56 -0.11 0.00 -0.30 0.00 0.00 42.92 39.82 1g11 s ASP 5 CO -0.04 -0.46 2.42 0.00 -0.17 0.00 0.00 175.17 176.92 1g11 n GLN 6 N 5.06 0.79 -3.16 4.34 6.02 -1.26 -4.77 117.38 124.40 1g11 n GLN 6 Ca 0.09 -0.45 -0.10 0.00 -0.01 0.00 0.00 57.00 56.53 1g11 n GLN 6 Cb 0.49 -3.59 -0.04 0.00 1.02 0.00 0.00 30.24 28.12 1g11 n GLN 6 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1g11 s ALA 7 N 13.66 -1.11 -0.47 -1.58 0.00 -1.26 -5.01 121.76 125.99 1g11 s ALA 7 Ca 0.95 -0.76 -0.05 0.00 0.00 0.00 0.00 51.96 52.11 1g11 s ALA 7 Cb -0.15 -2.34 0.00 0.00 0.00 0.00 0.00 23.12 20.63 1g11 s ALA 7 CO 0.17 -2.17 2.90 1.28 0.00 0.00 0.00 175.76 177.94 1g11 n LEU 8 N 3.70 6.42 0.00 0.00 7.99 -1.26 -4.95 117.00 128.90 1g11 n LEU 8 Ca 0.16 -3.98 0.00 0.00 -0.01 0.00 0.00 56.01 52.18 1g11 n LEU 8 Cb 0.51 -1.28 0.00 0.00 -0.11 0.00 0.00 43.42 42.54 1g11 n LEU 8 CO 0.04 1.76 0.00 1.57 -1.51 0.00 0.00 177.39 179.25 1g11 n HIS 9 N 1.30 0.00 -0.61 -1.77 -0.00 -1.26 -0.72 115.22 112.16 1g11 n HIS 9 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.22 1g11 n HIS 9 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.58 1g11 n HIS 9 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 1g11 n ASN 10 N 1.42 -1.12 0.00 0.26 5.15 -1.26 -4.84 115.26 114.87 1g11 n ASN 10 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1g11 n ASN 10 Cb 0.00 -0.56 0.00 0.00 -0.53 0.00 0.00 39.78 38.69 1g11 n ASN 10 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1g11 n ASN 11 N 0.00 0.00 -3.57 1.20 5.15 -1.26 -5.12 115.26 111.67 1g11 n ASN 11 Ca 0.00 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.86 1g11 n ASN 11 Cb 0.00 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.20 1g11 n ASN 11 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1g11 s ASN 12 N 0.00 -0.42 0.18 1.20 4.22 -1.20 -4.36 114.94 114.57 1g11 s ASN 12 Ca 0.00 0.45 0.02 0.00 -2.14 0.00 0.00 52.86 51.18 1g11 s ASN 12 Cb 0.00 0.34 -0.01 0.00 1.28 0.00 0.00 41.25 42.87 1g11 s ASN 12 CO 0.00 -0.39 0.06 1.33 -2.04 0.00 0.00 177.10 176.06 1g11 n VAL 13 N 0.74 0.00 -3.13 3.54 0.24 -0.08 -4.77 118.33 114.87 1g11 n VAL 13 Ca -0.12 -1.05 0.04 0.00 -2.04 0.00 0.00 64.34 61.18 1g11 n VAL 13 Cb 0.58 0.36 -0.00 0.00 -1.47 0.00 0.00 33.84 33.31 1g11 n VAL 13 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1g11 s GLY 14 N -2.11 -1.12 -0.39 7.63 0.00 -1.26 -0.82 107.32 109.24 1g11 s GLY 14 Ca 0.08 1.53 -0.29 0.00 0.00 0.00 0.00 44.72 46.04 1g11 s GLY 14 CO 0.06 3.92 1.40 2.56 0.00 0.00 0.00 173.10 181.04 1g11 s PRO 15 N 2.80 3.63 -0.08 2.90 0.04 -0.78 -2.68 135.00 140.83 1g11 s PRO 15 Ca 0.19 1.00 -0.06 0.00 0.04 0.00 0.00 61.00 62.16 1g11 s PRO 15 Cb -0.05 -4.00 -0.04 0.00 0.04 0.00 0.00 34.50 30.45 1g11 s PRO 15 CO -0.23 -1.49 0.17 0.42 0.04 0.00 0.00 177.00 175.91 1g11 s ILE 16 N 5.26 5.45 0.39 0.56 -1.09 0.94 -2.04 121.20 130.67 1g11 s ILE 16 Ca 0.61 0.16 -0.13 0.00 -2.23 0.00 0.00 60.65 59.05 1g11 s ILE 16 Cb -0.14 -3.46 0.05 0.00 -1.58 0.00 0.00 42.46 37.33 1g11 s ILE 16 CO 0.31 0.53 0.74 2.30 -1.23 0.00 0.00 174.94 177.59 1g11 n ILE 17 N 1.67 0.00 -2.48 2.92 -5.35 -0.22 -1.61 119.36 114.29 1g11 n ILE 17 Ca -0.17 -1.12 -0.27 0.00 -0.27 0.00 0.00 62.75 60.92 1g11 n ILE 17 Cb 0.54 1.01 0.02 0.00 -1.74 0.00 0.00 39.64 39.47 1g11 n ILE 17 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1g11 s ARG 18 N -2.21 3.13 0.57 6.28 1.70 -1.26 -0.11 118.95 127.06 1g11 s ARG 18 Ca 0.18 0.06 -0.11 0.00 -0.47 0.00 0.00 55.73 55.39 1g11 s ARG 18 Cb -0.04 -2.31 -0.05 0.00 -0.57 0.00 0.00 34.95 31.98 1g11 s ARG 18 CO 0.13 -0.53 0.98 0.00 -1.08 0.00 0.00 175.30 174.80 1g11 s ALA 19 N -2.90 3.15 0.00 7.88 0.00 -1.15 -3.94 121.76 124.79 1g11 s ALA 19 Ca 0.52 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.36 1g11 s ALA 19 Cb -0.10 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.02 1g11 s ALA 19 CO 0.45 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 176.08 1g11 n GLY 20 N -2.44 0.64 3.65 0.00 0.00 -1.26 -4.95 105.19 100.83 1g11 n GLY 20 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1g11 n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1g11 s ASP 21 N 1.01 -0.02 -1.57 1.61 -1.08 -1.26 -4.94 116.67 110.41 1g11 s ASP 21 Ca 0.00 0.04 0.00 0.00 -0.52 0.00 0.00 52.55 52.07 1g11 s ASP 21 Cb 0.00 0.54 0.00 0.00 -1.46 0.00 0.00 42.92 42.00 1g11 s ASP 21 CO 0.00 -0.01 0.00 0.18 0.52 0.00 0.00 175.17 175.86 1g11 n LEU 22 N 2.30 -1.05 0.01 -1.34 4.77 -1.26 -4.82 117.00 115.61 1g11 n LEU 22 Ca -0.14 0.37 0.13 0.00 -0.03 0.00 0.00 56.01 56.34 1g11 n LEU 22 Cb 0.57 -2.24 0.57 0.00 -2.33 0.00 0.00 43.42 39.98 1g11 n LEU 22 CO 0.04 -0.81 0.93 0.52 -1.33 0.00 0.00 177.39 176.74 1g11 n VAL 23 N -2.54 0.15 -0.00 4.08 0.31 -1.26 -1.99 118.33 117.08 1g11 n VAL 23 Ca -0.15 -0.01 -0.04 0.00 -0.01 0.00 0.00 64.34 64.13 1g11 n VAL 23 Cb 0.50 -0.56 -0.03 0.00 -0.91 0.00 0.00 33.84 32.85 1g11 n VAL 23 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1g11 h GLU 24 N 0.00 -0.11 0.00 5.55 5.08 -1.98 -0.62 114.58 122.51 1g11 h GLU 24 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1g11 h GLU 24 Cb 0.50 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1g11 h GLU 24 CO 0.00 0.10 0.00 -0.35 -1.00 0.00 0.00 179.01 177.76 1g11 n PRO 25 N -4.83 0.06 -0.06 2.33 -0.04 -1.24 -1.61 135.00 129.61 1g11 n PRO 25 Ca -0.03 0.18 -0.22 0.00 -0.04 0.00 0.00 63.50 63.39 1g11 n PRO 25 Cb 0.13 -1.59 -0.12 0.00 -0.04 0.00 0.00 33.50 31.87 1g11 n PRO 25 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1g11 n VAL 26 N -1.71 1.64 0.10 0.52 0.31 -0.84 -2.61 118.33 115.74 1g11 n VAL 26 Ca 0.05 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 1g11 n VAL 26 Cb 0.27 -1.91 0.31 0.00 -0.91 0.00 0.00 33.84 31.60 1g11 n VAL 26 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 1g11 h ILE 27 N -0.56 1.24 -0.12 2.52 6.09 -1.05 0.52 117.51 126.16 1g11 h ILE 27 Ca -0.39 -1.14 -0.17 0.00 -1.37 0.00 0.00 64.86 61.79 1g11 h ILE 27 Cb 1.61 1.43 0.01 0.00 0.47 0.00 0.00 36.82 40.34 1g11 h ILE 27 CO -0.09 0.35 -0.61 -0.08 -3.07 0.00 0.00 178.15 174.65 1g11 h GLU 28 N 0.22 0.61 0.00 2.19 4.81 -1.45 -1.77 114.58 119.20 1g11 h GLU 28 Ca 0.04 -0.51 -0.09 0.00 -0.13 0.00 0.00 59.36 58.66 1g11 h GLU 28 Cb 0.59 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 1g11 h GLU 28 CO 0.04 1.13 -0.45 1.15 -0.73 0.00 0.00 179.01 180.15 1g11 h THR 29 N 0.26 0.95 0.00 0.32 2.02 -1.24 -2.53 112.91 112.69 1g11 h THR 29 Ca -0.04 -1.81 -0.04 0.00 0.77 0.00 0.00 66.41 65.29 1g11 h THR 29 Cb 1.25 2.10 -0.01 0.00 -1.74 0.00 0.00 68.15 69.75 1g11 h THR 29 CO 0.13 0.44 -0.17 0.00 0.37 0.00 0.00 175.52 176.28 1g11 h ALA 30 N 1.55 0.90 0.14 6.16 0.00 0.09 -2.84 119.26 125.26 1g11 h ALA 30 Ca -0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 54.91 54.53 1g11 h ALA 30 Cb 1.06 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.85 1g11 h ALA 30 CO 0.06 0.22 -0.94 0.93 0.00 0.00 0.00 179.25 179.52 1g11 h GLU 31 N 0.00 0.39 -0.50 0.00 5.08 -1.00 -3.27 114.58 115.28 1g11 h GLU 31 Ca -0.00 -0.61 -0.03 0.00 -1.00 0.00 0.00 59.36 57.72 1g11 h GLU 31 Cb 1.05 0.22 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 1g11 h GLU 31 CO 0.02 1.27 0.17 -0.84 -1.00 0.00 0.00 179.01 178.63 1g11 h ILE 32 N -0.17 1.20 -1.01 3.13 3.07 -1.49 -1.74 117.51 120.50 1g11 h ILE 32 Ca -0.16 -0.65 0.14 0.00 1.55 0.00 0.00 64.86 65.75 1g11 h ILE 32 Cb 1.71 0.64 -0.09 0.00 -0.27 0.00 0.00 36.82 38.81 1g11 h ILE 32 CO 0.18 0.25 0.63 -0.78 -1.05 0.00 0.00 178.15 177.37 1g11 h ASP 33 N 0.72 0.88 -2.44 2.16 3.58 -1.55 -3.41 116.42 116.35 1g11 h ASP 33 Ca 0.17 0.06 -0.52 0.00 0.42 0.00 0.00 57.03 57.16 1g11 h ASP 33 Cb 0.19 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.11 1g11 h ASP 33 CO -0.01 0.42 -0.48 0.20 -2.88 0.00 0.00 179.24 176.49 1g11 s ASN 34 N -5.60 6.08 -0.28 2.28 0.02 -0.65 -4.98 114.94 111.81 1g11 s ASN 34 Ca -0.12 0.03 -0.05 0.00 -1.02 0.00 0.00 52.86 51.71 1g11 s ASN 34 Cb 0.23 -1.74 -0.17 0.00 0.02 0.00 0.00 41.25 39.59 1g11 s ASN 34 CO 0.81 0.01 2.75 -0.81 0.02 0.00 0.00 177.10 179.88 1g11 n PRO 35 N -0.82 1.78 -2.34 -0.60 -0.04 -1.26 -4.64 135.00 127.09 1g11 n PRO 35 Ca -0.08 -0.98 -0.41 0.00 -0.04 0.00 0.00 63.50 61.99 1g11 n PRO 35 Cb 0.55 -2.04 0.01 0.00 -0.04 0.00 0.00 33.50 31.98 1g11 n PRO 35 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1g11 n GLY 36 N 2.87 5.70 2.16 0.55 0.00 -1.25 -4.79 105.19 110.43 1g11 n GLY 36 Ca 0.38 -2.33 -0.17 0.00 0.00 0.00 0.00 46.02 43.90 1g11 n GLY 36 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1g11 n LYS 37 N 0.80 2.10 0.00 1.61 2.85 -1.26 -3.55 118.16 120.71 1g11 n LYS 37 Ca 0.54 -1.46 0.00 0.00 -1.05 0.00 0.00 58.31 56.34 1g11 n LYS 37 Cb 0.25 -2.01 0.00 0.00 -0.65 0.00 0.00 35.03 32.63 1g11 n LYS 37 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1g11 n GLU 38 N 1.83 0.00 -4.41 -1.58 0.28 -1.26 -5.16 120.64 110.34 1g11 n GLU 38 Ca 0.43 0.00 -0.27 0.00 -0.16 0.00 0.00 57.16 57.16 1g11 n GLU 38 Cb 0.77 0.00 -0.12 0.00 1.43 0.00 0.00 31.44 33.52 1g11 n GLU 38 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1g11 s ILE 39 N 0.00 2.30 -0.10 3.84 1.09 -1.23 -4.42 121.20 122.68 1g11 s ILE 39 Ca 0.00 -1.96 0.01 0.00 -1.10 0.00 0.00 60.65 57.60 1g11 s ILE 39 Cb 0.00 -2.07 0.02 0.00 -1.06 0.00 0.00 42.46 39.34 1g11 s ILE 39 CO 0.00 -0.07 -0.10 -0.89 -0.10 0.00 0.00 174.94 173.77 1g11 s THR 40 N -1.53 1.13 0.11 2.92 2.01 -1.08 -5.02 115.64 114.18 1g11 s THR 40 Ca 0.19 -0.40 0.00 0.00 0.31 0.00 0.00 61.69 61.79 1g11 s THR 40 Cb -0.08 -1.09 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 1g11 s THR 40 CO 0.09 0.37 0.27 -0.69 -0.69 0.00 0.00 174.62 173.97 1g11 s VAL 41 N 1.27 5.33 -0.43 3.82 1.01 -1.26 -1.28 120.40 128.86 1g11 s VAL 41 Ca -0.03 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.55 1g11 s VAL 41 Cb -0.14 -3.68 0.19 0.00 0.00 0.00 0.00 36.38 32.75 1g11 s VAL 41 CO -0.04 0.01 0.44 -0.62 0.00 0.00 0.00 175.10 174.90 1g11 n GLU 42 N -0.13 0.33 -2.81 2.72 1.02 -0.23 -4.99 120.64 116.55 1g11 n GLU 42 Ca -0.05 -2.96 -0.43 0.00 -0.02 0.00 0.00 57.16 53.70 1g11 n GLU 42 Cb 0.52 -1.57 -0.04 0.00 -0.02 0.00 0.00 31.44 30.34 1g11 n GLU 42 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1g11 s ASP 43 N -0.05 6.44 -0.03 1.62 1.11 -1.26 -2.48 116.67 122.02 1g11 s ASP 43 Ca 0.33 -0.06 -0.00 0.00 0.18 0.00 0.00 52.55 53.00 1g11 s ASP 43 Cb 0.06 -2.45 -0.00 0.00 1.07 0.00 0.00 42.92 41.60 1g11 s ASP 43 CO -0.17 -1.15 -0.00 -0.09 1.18 0.00 0.00 175.17 174.94 1g11 h ARG 44 N 9.20 0.00 0.00 8.23 9.65 -1.93 -3.50 114.38 136.04 1g11 h ARG 44 Ca -0.25 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.63 1g11 h ARG 44 Cb 1.07 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.65 1g11 h ARG 44 CO 1.06 0.00 0.00 0.54 2.80 0.00 0.00 179.97 184.37 1g11 n ARG 45 N -2.71 0.00 0.07 0.20 5.12 -1.26 -4.94 116.66 113.14 1g11 n ARG 45 Ca -0.00 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 1g11 n ARG 45 Cb 0.00 0.00 -0.12 0.00 -1.16 0.00 0.00 32.46 31.18 1g11 n ARG 45 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1g11 h ALA 46 N 0.00 0.31 -2.59 7.54 0.00 -1.98 -3.44 119.26 119.10 1g11 h ALA 46 Ca 0.00 -0.91 -0.19 0.00 0.00 0.00 0.00 54.91 53.81 1g11 h ALA 46 Cb 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.53 1g11 h ALA 46 CO 0.00 1.21 -0.52 0.71 0.00 0.00 0.00 179.25 180.64 1g11 s TYR 47 N -2.70 0.90 -0.15 0.00 2.02 -1.26 -2.95 117.35 113.21 1g11 s TYR 47 Ca 0.00 -1.19 0.01 0.00 -0.37 0.00 0.00 57.07 55.52 1g11 s TYR 47 Cb 0.09 -0.38 0.00 0.00 -0.40 0.00 0.00 41.96 41.27 1g11 s TYR 47 CO 0.83 -0.67 -0.17 0.08 -1.57 0.00 0.00 175.55 174.05 1g11 s VAL 48 N -4.09 2.50 -0.08 0.71 1.01 0.84 -3.08 120.40 118.22 1g11 s VAL 48 Ca 0.31 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1g11 s VAL 48 Cb 0.06 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 1g11 s VAL 48 CO 0.08 0.52 -0.12 -0.60 0.00 0.00 0.00 175.10 174.99 1g11 s ARG 49 N 0.80 2.80 0.04 2.72 3.52 -1.03 -1.06 118.95 126.74 1g11 s ARG 49 Ca -0.06 -0.65 0.05 0.00 -0.13 0.00 0.00 55.73 54.94 1g11 s ARG 49 Cb -0.15 -2.51 -0.02 0.00 -1.56 0.00 0.00 34.95 30.71 1g11 s ARG 49 CO -0.00 0.53 -0.14 0.42 -0.81 0.00 0.00 175.30 175.30 1g11 s ILE 50 N -0.48 1.09 -0.27 4.11 1.01 -0.87 -1.07 121.20 124.74 1g11 s ILE 50 Ca 0.06 -1.04 0.01 0.00 0.00 0.00 0.00 60.65 59.69 1g11 s ILE 50 Cb -0.12 -1.00 0.07 0.00 0.01 0.00 0.00 42.46 41.42 1g11 s ILE 50 CO 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 174.94 174.91 1g11 s ALA 51 N -0.91 2.13 0.27 9.38 0.00 -0.40 -1.86 121.76 130.36 1g11 s ALA 51 Ca 0.01 -1.65 -0.05 0.00 0.00 0.00 0.00 51.96 50.27 1g11 s ALA 51 Cb -0.08 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.42 1g11 s ALA 51 CO 0.01 -1.35 0.54 0.00 0.00 0.00 0.00 175.76 174.96 1g11 s ALA 52 N 1.31 3.63 -0.48 0.00 0.00 -0.00 -2.63 121.76 123.59 1g11 s ALA 52 Ca -0.01 -0.54 0.24 0.00 0.00 0.00 0.00 51.96 51.65 1g11 s ALA 52 Cb -0.19 -2.29 0.98 0.00 0.00 0.00 0.00 23.12 21.62 1g11 s ALA 52 CO -0.09 0.29 1.72 -1.91 0.00 0.00 0.00 175.76 175.78 1g11 n GLU 53 N -0.81 0.21 0.00 0.00 0.00 -1.26 -0.90 120.64 117.88 1g11 n GLU 53 Ca -0.02 0.42 0.00 0.00 0.00 0.00 0.00 57.16 57.56 1g11 n GLU 53 Cb 0.54 -1.88 0.00 0.00 0.00 0.00 0.00 31.44 30.09 1g11 n GLU 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1g11 n GLY 54 N 0.07 1.04 3.49 8.31 0.00 -1.26 -3.26 105.19 113.58 1g11 n GLY 54 Ca 0.02 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1g11 n GLY 54 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1g11 s GLU 55 N 0.00 3.72 0.19 1.61 -1.05 -1.26 -2.77 118.70 119.14 1g11 s GLU 55 Ca 0.00 -0.45 0.01 0.00 -0.15 0.00 0.00 54.97 54.38 1g11 s GLU 55 Cb 0.00 -3.46 -0.05 0.00 -0.44 0.00 0.00 34.13 30.18 1g11 s GLU 55 CO 0.00 -0.21 0.04 -0.51 0.95 0.00 0.00 175.26 175.53 1g11 s LEU 56 N 1.66 1.86 -0.14 1.83 2.01 -0.98 -5.01 118.68 119.92 1g11 s LEU 56 Ca 0.06 -1.25 -0.12 0.00 0.01 0.00 0.00 54.13 52.83 1g11 s LEU 56 Cb -0.16 0.06 0.04 0.00 0.01 0.00 0.00 46.19 46.14 1g11 s LEU 56 CO 0.06 -0.66 0.37 0.27 1.01 0.00 0.00 176.35 177.41 1g11 s ILE 57 N -3.79 -0.00 0.03 -0.59 -5.25 -1.26 -0.75 121.20 109.59 1g11 s ILE 57 Ca 0.29 0.01 0.03 0.00 -0.99 0.00 0.00 60.65 59.99 1g11 s ILE 57 Cb 0.07 -0.53 -0.02 0.00 2.95 0.00 0.00 42.46 44.93 1g11 s ILE 57 CO 0.07 0.01 -0.10 -0.76 -1.79 0.00 0.00 174.94 172.36 1g11 s LEU 58 N 0.34 2.18 0.00 0.37 1.43 -0.05 -4.82 118.68 118.13 1g11 s LEU 58 Ca -0.01 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 1g11 s LEU 58 Cb -0.03 -0.35 0.00 0.00 0.03 0.00 0.00 46.19 45.84 1g11 s LEU 58 CO -0.01 -0.06 0.66 0.35 0.23 0.00 0.00 176.35 177.52 1g11 n THR 59 N 1.91 0.00 -1.09 5.49 -2.24 -1.26 -0.85 114.28 116.24 1g11 n THR 59 Ca -0.19 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.43 1g11 n THR 59 Cb 0.55 0.64 -0.08 0.00 -2.10 0.00 0.00 70.33 69.35 1g11 n THR 59 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1g11 n ARG 60 N 0.00 1.99 0.33 -0.78 3.00 -1.26 -4.46 116.66 115.47 1g11 n ARG 60 Ca 0.00 -1.41 0.21 0.00 -0.00 0.00 0.00 57.85 56.65 1g11 n ARG 60 Cb 0.58 -1.87 1.11 0.00 0.00 0.00 0.00 32.46 32.28 1g11 n ARG 60 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.63 179.20 1g11 h LYS 61 N 2.55 0.00 -0.12 -0.14 -0.00 -1.91 -1.57 116.57 115.37 1g11 h LYS 61 Ca 0.25 0.00 -0.04 0.00 -0.00 0.00 0.00 60.65 60.86 1g11 h LYS 61 Cb 1.10 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.33 1g11 h LYS 61 CO 0.49 0.00 -0.06 1.15 -0.00 0.00 0.00 179.45 181.03 1g11 h THR 62 N 0.00 1.32 -0.37 0.07 2.02 -1.91 0.47 112.91 114.51 1g11 h THR 62 Ca -0.00 -1.10 -0.11 0.00 0.77 0.00 0.00 66.41 65.97 1g11 h THR 62 Cb 0.08 1.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 1g11 h THR 62 CO 0.00 0.32 -0.20 0.25 0.37 0.00 0.00 175.52 176.26 1g11 h LEU 63 N -0.09 0.72 -0.13 2.58 6.46 -1.69 0.68 115.31 123.83 1g11 h LEU 63 Ca 0.03 -0.24 0.00 0.00 -0.12 0.00 0.00 57.88 57.54 1g11 h LEU 63 Cb 0.53 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 40.26 1g11 h LEU 63 CO 0.02 0.91 0.00 -0.62 -0.62 0.00 0.00 178.44 178.13 1g11 n GLU 64 N -4.13 0.25 -0.01 1.25 1.02 -0.75 -1.61 120.64 116.65 1g11 n GLU 64 Ca 0.00 0.25 -0.10 0.00 -0.02 0.00 0.00 57.16 57.30 1g11 n GLU 64 Cb 0.41 -1.82 -0.14 0.00 -0.02 0.00 0.00 31.44 29.87 1g11 n GLU 64 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1g11 h GLU 65 N 0.00 0.03 0.17 3.49 5.08 0.73 -3.38 114.58 120.70 1g11 h GLU 65 Ca 0.00 -0.06 -0.22 0.00 -1.00 0.00 0.00 59.36 58.08 1g11 h GLU 65 Cb 0.67 0.02 0.03 0.00 0.50 0.00 0.00 28.75 29.96 1g11 h GLU 65 CO 0.00 0.60 -0.98 1.96 -1.00 0.00 0.00 179.01 179.59 1g11 h GLN 66 N 0.01 0.36 -1.91 2.33 4.20 -0.82 -1.23 115.11 118.05 1g11 h GLN 66 Ca -0.29 -0.61 0.57 0.00 0.06 0.00 0.00 58.65 58.38 1g11 h GLN 66 Cb 2.01 0.23 -0.09 0.00 0.30 0.00 0.00 27.48 29.93 1g11 h GLN 66 CO 0.08 1.29 1.36 1.28 -0.67 0.00 0.00 178.83 182.17 1g11 n LEU 67 N -4.03 0.03 -2.83 1.46 4.77 -0.64 -2.22 117.00 113.54 1g11 n LEU 67 Ca -0.15 1.06 -0.11 0.00 -0.03 0.00 0.00 56.01 56.78 1g11 n LEU 67 Cb 0.89 -0.53 0.04 0.00 -2.33 0.00 0.00 43.42 41.49 1g11 n LEU 67 CO 0.51 -1.08 0.15 0.61 -1.33 0.00 0.00 177.39 176.26 1g11 n GLY 68 N -1.87 0.86 0.28 -0.72 0.00 -1.23 -4.99 105.19 97.52 1g11 n GLY 68 Ca 0.44 -0.25 0.06 0.00 0.00 0.00 0.00 46.02 46.27 1g11 n GLY 68 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1g11 h ARG 69 N 3.57 0.42 -3.65 1.61 3.08 -0.74 -2.91 114.38 115.75 1g11 h ARG 69 Ca -0.09 -0.03 -0.57 0.00 0.07 0.00 0.00 59.98 59.37 1g11 h ARG 69 Cb 1.03 -0.09 0.02 0.00 0.08 0.00 0.00 29.97 31.00 1g11 h ARG 69 CO 0.29 0.28 2.96 -0.35 -1.07 0.00 0.00 179.97 182.08 1g11 n PRO 70 N -5.02 2.51 0.00 0.04 -0.04 -1.26 -4.71 135.00 126.53 1g11 n PRO 70 Ca 0.15 -1.94 0.00 0.00 -0.04 0.00 0.00 63.50 61.68 1g11 n PRO 70 Cb 0.45 -2.79 0.00 0.00 -0.04 0.00 0.00 33.50 31.12 1g11 n PRO 70 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1g11 n PHE 71 N 5.10 0.00 -3.24 0.54 -1.74 -1.10 -5.19 117.46 111.83 1g11 n PHE 71 Ca 0.56 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.45 1g11 n PHE 71 Cb 0.26 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.26 1g11 n PHE 71 CO 0.00 0.00 0.00 0.09 -0.56 0.00 0.00 176.76 176.29 1g11 n ASN 72 N 0.00 0.00 0.09 5.98 3.02 -1.26 -5.04 115.26 118.05 1g11 n ASN 72 Ca 0.00 -0.91 0.12 0.00 -0.03 0.00 0.00 54.58 53.75 1g11 n ASN 72 Cb 0.00 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.19 1g11 n ASN 72 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 1g11 n MET 73 N 0.00 0.54 0.12 3.52 0.00 -1.26 -3.89 117.12 116.15 1g11 n MET 73 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 57.70 57.83 1g11 n MET 73 Cb 0.00 -1.78 0.42 0.00 0.00 0.00 0.00 33.22 31.85 1g11 n MET 73 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 1g11 h GLN 74 N 0.00 0.25 0.00 3.17 4.15 -2.00 -0.93 115.11 119.75 1g11 h GLN 74 Ca 0.00 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.31 1g11 h GLN 74 Cb 0.94 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.58 1g11 h GLN 74 CO 0.00 0.34 -0.29 1.05 -1.93 0.00 0.00 178.83 177.99 1g11 h GLU 75 N 0.25 0.00 0.36 1.69 -0.00 -1.98 -2.17 114.58 112.72 1g11 h GLU 75 Ca 0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.40 1g11 h GLU 75 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.04 1g11 h GLU 75 CO 0.01 0.29 -0.17 -0.07 -0.00 0.00 0.00 179.01 179.07 1g11 h LEU 76 N 0.00 -0.41 -1.11 3.06 4.07 -1.35 1.44 115.31 121.02 1g11 h LEU 76 Ca -0.00 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.81 1g11 h LEU 76 Cb 0.78 0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.62 1g11 h LEU 76 CO 0.04 -0.05 0.00 -0.08 -1.08 0.00 0.00 178.44 177.27 1g11 h GLU 77 N -0.82 0.00 0.00 1.13 4.81 -1.47 -2.81 114.58 115.42 1g11 h GLU 77 Ca -0.05 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 58.94 1g11 h GLU 77 Cb 0.53 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.87 1g11 h GLU 77 CO 0.08 0.00 -1.32 -0.89 -0.73 0.00 0.00 179.01 176.15 1g11 n ILE 78 N -2.35 1.54 -0.84 2.32 2.08 -0.82 -4.43 119.36 116.85 1g11 n ILE 78 Ca 0.01 -0.05 -0.30 0.00 0.56 0.00 0.00 62.75 62.97 1g11 n ILE 78 Cb 0.17 -2.03 -0.03 0.00 -0.75 0.00 0.00 39.64 36.99 1g11 n ILE 78 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1g11 n ASN 79 N -4.41 3.48 -4.54 4.38 3.02 0.49 -4.81 115.26 112.87 1g11 n ASN 79 Ca -0.33 -2.45 -0.24 0.00 -0.03 0.00 0.00 54.58 51.54 1g11 n ASN 79 Cb 0.70 -1.04 -0.09 0.00 -0.61 0.00 0.00 39.78 38.74 1g11 n ASN 79 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1g11 s LEU 80 N 0.51 2.80 0.05 3.41 1.02 -1.26 -4.16 118.68 121.05 1g11 s LEU 80 Ca 0.45 -0.93 0.00 0.00 0.02 0.00 0.00 54.13 53.66 1g11 s LEU 80 Cb 0.11 -1.28 0.00 0.00 0.02 0.00 0.00 46.19 45.04 1g11 s LEU 80 CO 0.04 -0.01 0.00 0.00 0.02 0.00 0.00 176.35 176.40 1g11 n ALA 81 N -0.73 3.00 -3.61 4.21 0.00 -1.17 -4.45 120.51 117.76 1g11 n ALA 81 Ca -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.35 1g11 n ALA 81 Cb 0.60 0.02 0.01 0.00 0.00 0.00 0.00 19.45 20.08 1g11 n ALA 81 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1g11 n SER 82 N -2.73 -1.43 -3.62 0.00 7.64 -0.63 -4.89 113.62 107.95 1g11 n SER 82 Ca 0.00 -2.19 -0.04 0.00 1.01 0.00 0.00 58.87 57.65 1g11 n SER 82 Cb 0.00 2.44 -0.01 0.00 -1.01 0.00 0.00 64.21 65.63 1g11 n SER 82 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1g11 s PHE 83 N -4.02 -0.08 -0.17 1.43 0.08 -1.26 -0.04 117.98 113.92 1g11 s PHE 83 Ca 0.14 -0.30 0.04 0.00 0.12 0.00 0.00 56.93 56.93 1g11 s PHE 83 Cb -0.03 0.68 -0.13 0.00 -0.57 0.00 0.00 43.02 42.97 1g11 s PHE 83 CO 0.10 -0.97 -0.12 0.00 -0.10 0.00 0.00 175.22 174.14 1g11 n ALA 84 N -0.52 1.62 -2.00 5.36 0.00 -1.09 -4.89 120.51 118.99 1g11 n ALA 84 Ca -0.05 -0.81 0.00 0.00 0.00 0.00 0.00 53.44 52.57 1g11 n ALA 84 Cb 0.60 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1g11 n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g11 n GLY 85 N 2.52 2.38 3.39 0.00 0.00 -1.26 -4.93 105.19 107.29 1g11 n GLY 85 Ca -0.30 -0.26 -0.15 0.00 0.00 0.00 0.00 46.02 45.31 1g11 n GLY 85 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1g11 s GLN 86 N 1.87 1.67 0.28 1.61 -0.21 -1.21 -5.03 119.66 118.65 1g11 s GLN 86 Ca 0.00 -1.73 0.02 0.00 0.02 0.00 0.00 55.36 53.67 1g11 s GLN 86 Cb 0.00 0.38 -0.05 0.00 1.00 0.00 0.00 33.01 34.34 1g11 s GLN 86 CO 0.00 -0.65 0.09 0.96 -2.12 0.00 0.00 175.29 173.57 1g11 s ILE 87 N -3.52 0.71 -0.26 1.08 -5.25 -1.26 -2.77 121.20 109.93 1g11 s ILE 87 Ca 0.34 -2.00 -0.04 0.00 -0.99 0.00 0.00 60.65 57.96 1g11 s ILE 87 Cb 0.02 -2.67 0.15 0.00 2.95 0.00 0.00 42.46 42.90 1g11 s ILE 87 CO 0.19 0.00 0.49 0.00 -1.79 0.00 0.00 174.94 173.83 1g11 s GLN 88 N -3.98 0.45 -0.18 0.37 -2.07 0.18 -4.96 119.66 109.46 1g11 s GLN 88 Ca 0.37 0.89 -0.09 0.00 -1.82 0.00 0.00 55.36 54.70 1g11 s GLN 88 Cb 0.08 0.17 -0.05 0.00 -1.09 0.00 0.00 33.01 32.12 1g11 s GLN 88 CO 0.14 -0.52 0.14 0.00 -1.32 0.00 0.00 175.29 173.73 1g11 s ALA 89 N 2.71 3.73 0.38 2.60 0.00 -1.26 0.19 121.76 130.10 1g11 s ALA 89 Ca 0.11 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.40 1g11 s ALA 89 Cb -0.14 -2.13 0.01 0.00 0.00 0.00 0.00 23.12 20.85 1g11 s ALA 89 CO -0.17 0.26 0.05 -3.47 0.00 0.00 0.00 175.76 172.43 1g11 n ASP 90 N 3.18 0.07 -0.27 0.00 -0.08 -0.34 -4.85 116.55 114.25 1g11 n ASP 90 Ca -0.17 -1.06 0.21 0.00 -1.51 0.00 0.00 54.79 52.26 1g11 n ASP 90 Cb 0.53 -0.03 0.39 0.00 2.34 0.00 0.00 41.12 44.34 1g11 n ASP 90 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1g11 n GLU 91 N -1.09 -0.06 -2.71 -0.67 0.28 -1.26 -2.75 120.64 112.38 1g11 n GLU 91 Ca 0.01 1.18 -0.08 0.00 -0.16 0.00 0.00 57.16 58.11 1g11 n GLU 91 Cb 0.03 -2.02 0.11 0.00 1.43 0.00 0.00 31.44 30.98 1g11 n GLU 91 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1g11 n ASP 92 N -5.00 -1.93 -3.79 -1.84 8.00 -1.26 -5.14 116.55 105.59 1g11 n ASP 92 Ca 0.27 -2.86 -0.11 0.00 0.71 0.00 0.00 54.79 52.80 1g11 n ASP 92 Cb 0.90 1.25 -0.05 0.00 -0.02 0.00 0.00 41.12 43.19 1g11 n ASP 92 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1g11 s GLN 93 N 0.11 1.63 -0.23 -1.24 -0.21 -1.11 -4.39 119.66 114.22 1g11 s GLN 93 Ca 0.22 -1.44 -0.03 0.00 0.02 0.00 0.00 55.36 54.13 1g11 s GLN 93 Cb 0.37 0.44 0.11 0.00 1.00 0.00 0.00 33.01 34.93 1g11 s GLN 93 CO -0.07 -0.67 0.25 -1.50 -2.12 0.00 0.00 175.29 171.18 1g11 s ILE 94 N -3.72 -0.36 0.38 1.08 2.07 -0.03 -1.20 121.20 119.41 1g11 s ILE 94 Ca 0.26 -0.20 0.08 0.00 -1.41 0.00 0.00 60.65 59.38 1g11 s ILE 94 Cb 0.00 -0.76 -0.04 0.00 0.13 0.00 0.00 42.46 41.79 1g11 s ILE 94 CO 0.12 -0.26 0.20 -0.13 -1.91 0.00 0.00 174.94 172.96 1g11 s ARG 95 N 2.35 2.36 0.14 3.50 3.00 0.13 -0.87 118.95 129.56 1g11 s ARG 95 Ca 0.08 -1.63 0.03 0.00 0.00 0.00 0.00 55.73 54.21 1g11 s ARG 95 Cb -0.15 -2.16 -0.04 0.00 0.00 0.00 0.00 34.95 32.59 1g11 s ARG 95 CO -0.17 -0.01 -0.07 -0.06 0.00 0.00 0.00 175.30 174.99 1g11 s PHE 96 N -2.48 1.13 -0.30 -0.53 0.08 0.07 -0.64 117.98 115.30 1g11 s PHE 96 Ca 0.41 -0.87 -0.15 0.00 0.12 0.00 0.00 56.93 56.43 1g11 s PHE 96 Cb -0.01 -0.62 0.18 0.00 -0.57 0.00 0.00 43.02 42.00 1g11 s PHE 96 CO 0.24 -0.06 1.09 1.52 -0.10 0.00 0.00 175.22 177.90 1g11 s TYR 97 N -3.50 -0.47 0.29 0.36 1.13 -1.11 -2.32 117.35 111.73 1g11 s TYR 97 Ca 0.17 0.68 -0.04 0.00 -1.41 0.00 0.00 57.07 56.46 1g11 s TYR 97 Cb 0.04 0.23 0.59 0.00 -1.10 0.00 0.00 41.96 41.72 1g11 s TYR 97 CO -0.01 -0.24 1.57 0.27 -2.51 0.00 0.00 175.55 174.63 1g11 h PHE 98 N 7.59 -0.32 0.00 -3.49 -5.15 -1.78 -3.19 116.94 110.61 1g11 h PHE 98 Ca -0.14 0.08 0.00 0.00 -0.20 0.00 0.00 57.97 57.71 1g11 h PHE 98 Cb 1.14 0.30 0.00 0.00 0.22 0.00 0.00 35.95 37.61 1g11 h PHE 98 CO 0.16 -0.43 0.00 -0.25 -2.00 0.00 0.00 178.31 175.79 1g11 n ASP 99 N -5.57 0.00 0.00 -0.68 8.00 -1.26 -4.02 116.55 113.02 1g11 n ASP 99 Ca 0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.69 1g11 n ASP 99 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.71 1g11 n ASP 99 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1g11 n LYS 100 N 0.00 0.00 -1.43 -1.24 0.00 0.10 -4.06 118.16 111.53 1g11 n LYS 100 Ca 0.00 0.09 -0.61 0.00 0.00 0.00 0.00 58.31 57.79 1g11 n LYS 100 Cb 0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 35.03 34.67 1g11 n LYS 100 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1g11 n THR 101 N -0.34 0.00 0.00 3.15 5.66 -1.26 -5.10 114.28 116.39 1g11 n THR 101 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1g11 n THR 101 Cb 0.00 -0.48 0.00 0.00 -1.55 0.00 0.00 70.33 68.30 1g11 n THR 101 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25