#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ofb s SER 5 N 1.48 5.09 0.19 0.00 0.15 -1.26 -4.71 113.70 114.65 2ofb s SER 5 Ca 0.06 0.03 0.23 0.00 0.70 0.00 0.00 55.95 56.97 2ofb s SER 5 Cb -0.18 -1.63 0.91 0.00 -1.71 0.00 0.00 66.02 63.41 2ofb s SER 5 CO -0.17 0.27 1.71 0.18 1.20 0.00 0.00 173.24 176.43 2ofb n LEU 6 N 2.84 0.56 -4.61 3.45 4.77 -1.26 -4.81 117.00 117.93 2ofb n LEU 6 Ca -0.18 0.61 -0.50 0.00 -0.03 0.00 0.00 56.01 55.91 2ofb n LEU 6 Cb 0.53 -0.50 -0.05 0.00 -2.33 0.00 0.00 43.42 41.07 2ofb n LEU 6 CO 0.31 -0.38 0.96 0.41 -1.33 0.00 0.00 177.39 177.36 2ofb n THR 7 N -2.08 0.11 0.00 -5.08 -1.04 -1.26 -4.55 114.28 100.37 2ofb n THR 7 Ca 0.04 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2ofb n THR 7 Cb 0.28 -1.01 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 2ofb n THR 7 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ofb n GLY 8 N 2.68 0.60 3.70 3.41 0.00 -0.26 -4.94 105.19 110.37 2ofb n GLY 8 Ca 0.18 -2.17 -0.35 0.00 0.00 0.00 0.00 46.02 43.67 2ofb n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ofb s LYS 9 N -0.79 3.08 0.05 1.61 1.02 -1.26 -0.82 119.74 122.63 2ofb s LYS 9 Ca 0.00 -0.38 0.03 0.00 0.02 0.00 0.00 55.97 55.64 2ofb s LYS 9 Cb 0.00 -2.85 -0.03 0.00 -0.52 0.00 0.00 37.83 34.43 2ofb s LYS 9 CO 0.00 0.68 -0.10 -1.58 -0.92 0.00 0.00 175.35 173.43 2ofb s TRP 10 N -0.82 0.87 0.15 3.18 0.52 0.00 -0.88 118.94 121.96 2ofb s TRP 10 Ca 0.13 -0.48 0.09 0.00 0.02 0.00 0.00 56.10 55.86 2ofb s TRP 10 Cb -0.11 -0.51 -0.04 0.00 -1.15 0.00 0.00 33.47 31.66 2ofb s TRP 10 CO 0.02 -0.03 -0.22 0.99 0.02 0.00 0.00 176.95 177.74 2ofb s THR 11 N -1.33 1.96 0.52 2.01 2.01 -0.11 -1.23 115.64 119.47 2ofb s THR 11 Ca -0.07 -1.80 0.03 0.00 0.31 0.00 0.00 61.69 60.15 2ofb s THR 11 Cb -0.10 -1.84 -0.00 0.00 0.01 0.00 0.00 72.50 70.57 2ofb s THR 11 CO 0.01 -0.14 0.11 0.54 -0.69 0.00 0.00 174.62 174.46 2ofb s ASN 12 N -2.35 4.27 0.56 3.53 2.20 -0.61 -1.32 114.94 121.23 2ofb s ASN 12 Ca 0.14 -1.53 0.37 0.00 -0.94 0.00 0.00 52.86 50.90 2ofb s ASN 12 Cb -0.08 0.45 1.81 0.00 -2.00 0.00 0.00 41.25 41.43 2ofb s ASN 12 CO 0.06 -0.90 2.11 -0.55 -2.94 0.00 0.00 177.10 174.88 2ofb h ASN 13 N 1.20 0.00 0.27 3.54 -1.07 -1.79 -0.76 115.58 116.96 2ofb h ASN 13 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.95 2ofb h ASN 13 Cb 1.31 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.56 2ofb h ASN 13 CO 0.70 0.00 -0.26 0.18 0.07 0.00 0.00 177.43 178.12 2ofb n LEU 14 N -2.95 0.95 0.00 6.14 4.77 -1.26 -4.95 117.00 119.70 2ofb n LEU 14 Ca -0.01 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 2ofb n LEU 14 Cb 0.17 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2ofb n LEU 14 CO 0.22 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2ofb n GLY 15 N 1.35 0.66 3.75 -0.72 0.00 -0.29 -4.74 105.19 105.21 2ofb n GLY 15 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2ofb n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ofb s SER 16 N -2.95 4.74 -0.04 1.61 0.01 -1.26 -4.64 113.70 111.17 2ofb s SER 16 Ca 0.00 2.09 0.04 0.00 1.31 0.00 0.00 55.95 59.39 2ofb s SER 16 Cb 0.00 -2.56 -0.00 0.00 0.21 0.00 0.00 66.02 63.67 2ofb s SER 16 CO 0.00 -1.88 -0.17 -0.63 0.41 0.00 0.00 173.24 170.97 2ofb s ILE 17 N -2.29 1.43 0.09 1.44 1.01 -0.46 -1.57 121.20 120.84 2ofb s ILE 17 Ca 0.68 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 60.66 2ofb s ILE 17 Cb -0.23 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.98 2ofb s ILE 17 CO 0.44 0.41 -0.12 0.00 0.00 0.00 0.00 174.94 175.67 2ofb s MET 18 N 0.06 0.83 -0.13 2.79 0.23 -0.37 -0.32 119.30 122.40 2ofb s MET 18 Ca -0.04 -1.05 0.00 0.00 -1.03 0.00 0.00 55.69 53.57 2ofb s MET 18 Cb -0.12 -0.67 0.02 0.00 -1.53 0.00 0.00 34.83 32.54 2ofb s MET 18 CO 0.02 0.13 -0.12 0.99 -2.03 0.00 0.00 175.02 174.01 2ofb s THR 19 N -1.87 1.39 -0.13 3.16 2.01 -0.14 -0.82 115.64 119.23 2ofb s THR 19 Ca 0.02 -0.53 -0.02 0.00 0.31 0.00 0.00 61.69 61.47 2ofb s THR 19 Cb -0.06 -1.32 -0.02 0.00 0.01 0.00 0.00 72.50 71.11 2ofb s THR 19 CO 0.01 0.43 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.67 2ofb s ILE 20 N 1.42 3.59 0.00 1.82 1.01 0.00 -1.01 121.20 128.04 2ofb s ILE 20 Ca 0.02 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.20 2ofb s ILE 20 Cb -0.13 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 39.80 2ofb s ILE 20 CO -0.08 0.52 0.00 0.54 0.00 0.00 0.00 174.94 175.92 2ofb n ARG 21 N 3.33 1.26 -1.82 2.79 1.74 -0.05 -1.10 116.66 122.81 2ofb n ARG 21 Ca -0.18 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.49 2ofb n ARG 21 Cb 0.53 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.95 2ofb n ARG 21 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ofb s ALA 22 N -3.59 3.73 -0.15 7.54 0.00 -1.26 -4.25 121.76 123.78 2ofb s ALA 22 Ca 0.00 1.53 -0.22 0.00 0.00 0.00 0.00 51.96 53.27 2ofb s ALA 22 Cb 0.00 -3.63 -0.03 0.00 0.00 0.00 0.00 23.12 19.46 2ofb s ALA 22 CO 0.00 -0.94 0.65 0.08 0.00 0.00 0.00 175.76 175.55 2ofb s VAL 23 N -0.01 5.03 0.67 0.00 1.01 -1.26 -4.52 120.40 121.32 2ofb s VAL 23 Ca 0.63 1.28 -0.07 0.00 0.00 0.00 0.00 61.98 63.81 2ofb s VAL 23 Cb -0.47 -3.98 0.15 0.00 0.00 0.00 0.00 36.38 32.08 2ofb s VAL 23 CO 0.47 0.17 0.92 -0.46 0.00 0.00 0.00 175.10 176.20 2ofb n ASN 24 N 4.55 0.53 0.16 3.32 0.23 -0.39 -4.87 115.26 118.79 2ofb n ASN 24 Ca -0.01 -1.61 0.13 0.00 -0.53 0.00 0.00 54.58 52.56 2ofb n ASN 24 Cb 0.50 -0.66 0.49 0.00 -2.08 0.00 0.00 39.78 38.03 2ofb n ASN 24 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2ofb h SER 25 N -0.95 0.00 0.94 0.53 4.64 -1.98 -0.97 113.55 115.77 2ofb h SER 25 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2ofb h SER 25 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2ofb h SER 25 CO 0.25 0.00 -0.20 0.54 -0.87 0.00 0.00 176.83 176.56 2ofb n ARG 26 N -2.47 0.08 -0.33 4.77 5.12 -1.26 -4.94 116.66 117.63 2ofb n ARG 26 Ca 0.03 0.05 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 2ofb n ARG 26 Cb 0.31 -1.57 0.00 0.00 -1.16 0.00 0.00 32.46 30.03 2ofb n ARG 26 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ofb n GLY 27 N 1.45 0.71 3.78 -0.13 0.00 -0.37 -4.78 105.19 105.85 2ofb n GLY 27 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 2ofb n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ofb s GLU 28 N -0.67 4.30 0.02 1.61 2.02 -1.26 -0.47 118.70 124.25 2ofb s GLU 28 Ca 0.00 1.51 -0.12 0.00 0.02 0.00 0.00 54.97 56.38 2ofb s GLU 28 Cb 0.00 -2.67 0.01 0.00 0.10 0.00 0.00 34.13 31.58 2ofb s GLU 28 CO 0.00 -0.02 0.26 -0.59 0.02 0.00 0.00 175.26 174.93 2ofb s PHE 29 N -1.59 -0.07 0.38 1.61 -0.12 -0.35 -1.26 117.98 116.58 2ofb s PHE 29 Ca 0.55 -0.01 0.05 0.00 -0.05 0.00 0.00 56.93 57.46 2ofb s PHE 29 Cb -0.23 0.05 -0.06 0.00 -0.63 0.00 0.00 43.02 42.15 2ofb s PHE 29 CO 0.28 -0.43 0.04 -0.08 -0.05 0.00 0.00 175.22 174.99 2ofb s THR 30 N -2.05 1.42 -1.48 -4.49 -1.32 -1.26 -1.08 115.64 105.38 2ofb s THR 30 Ca -0.09 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.39 2ofb s THR 30 Cb -0.03 -2.75 0.00 0.00 -1.51 0.00 0.00 72.50 68.21 2ofb s THR 30 CO -0.01 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 2ofb n GLY 31 N -0.88 -0.79 3.19 6.08 0.00 -0.94 -0.87 105.19 110.98 2ofb n GLY 31 Ca -0.06 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.02 2ofb n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ofb s THR 32 N -3.00 0.94 -0.06 2.61 -4.23 -0.18 -1.59 115.64 110.13 2ofb s THR 32 Ca 0.00 -1.75 -0.01 0.00 -1.18 0.00 0.00 61.69 58.75 2ofb s THR 32 Cb 0.00 -1.48 0.03 0.00 1.34 0.00 0.00 72.50 72.38 2ofb s THR 32 CO 0.00 -0.63 0.00 -0.47 -0.54 0.00 0.00 174.62 172.98 2ofb s TYR 33 N -2.75 0.54 -0.43 3.99 6.14 0.63 -0.97 117.35 124.49 2ofb s TYR 33 Ca 0.08 -0.09 -0.04 0.00 0.64 0.00 0.00 57.07 57.66 2ofb s TYR 33 Cb -0.01 -0.68 0.12 0.00 0.42 0.00 0.00 41.96 41.81 2ofb s TYR 33 CO -0.01 -0.26 0.25 -1.17 0.64 0.00 0.00 175.55 175.00 2ofb s LEU 34 N 1.70 5.35 0.28 6.97 2.96 0.56 -1.75 118.68 134.76 2ofb s LEU 34 Ca 0.00 -2.06 -0.29 0.00 -0.22 0.00 0.00 54.13 51.56 2ofb s LEU 34 Cb -0.13 -1.87 -0.10 0.00 0.50 0.00 0.00 46.19 44.60 2ofb s LEU 34 CO -0.04 -0.56 1.10 0.28 -1.32 0.00 0.00 176.35 175.81 2ofb s THR 35 N 1.11 3.49 -0.39 3.68 -1.32 -1.26 -1.35 115.64 119.60 2ofb s THR 35 Ca 0.08 1.50 0.22 0.00 -1.21 0.00 0.00 61.69 62.29 2ofb s THR 35 Cb -0.23 -3.96 0.31 0.00 -1.51 0.00 0.00 72.50 67.11 2ofb s THR 35 CO -0.04 0.36 1.60 0.00 -2.21 0.00 0.00 174.62 174.33 2ofb h ALA 36 N 3.83 0.96 -3.00 11.08 0.00 -1.85 -3.47 119.26 126.81 2ofb h ALA 36 Ca -0.47 -0.05 -0.36 0.00 0.00 0.00 0.00 54.91 54.03 2ofb h ALA 36 Cb 1.21 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 18.80 2ofb h ALA 36 CO 0.67 0.07 -0.75 0.14 0.00 0.00 0.00 179.25 179.38 2ofb s VAL 37 N -3.19 1.02 0.23 0.00 -7.23 -1.26 -5.01 120.40 104.96 2ofb s VAL 37 Ca 0.06 -1.50 -0.22 0.00 -1.81 0.00 0.00 61.98 58.51 2ofb s VAL 37 Cb 0.05 -1.23 0.04 0.00 0.56 0.00 0.00 36.38 35.80 2ofb s VAL 37 CO 0.68 -0.42 0.71 0.00 -0.31 0.00 0.00 175.10 175.76 2ofb s ALA 38 N -1.94 -1.37 0.30 1.32 0.00 -1.26 -4.99 121.76 113.83 2ofb s ALA 38 Ca 0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 51.96 51.95 2ofb s ALA 38 Cb -0.06 0.83 0.51 0.00 0.00 0.00 0.00 23.12 24.40 2ofb s ALA 38 CO 0.01 -0.96 1.93 0.22 0.00 0.00 0.00 175.76 176.96 2ofb h ASP 39 N 2.00 0.92 -3.27 0.00 3.58 -2.02 -3.30 116.42 114.32 2ofb h ASP 39 Ca -0.23 -0.00 -0.61 0.00 0.42 0.00 0.00 57.03 56.60 2ofb h ASP 39 Cb 1.26 -0.20 -0.40 0.00 1.72 0.00 0.00 39.33 41.71 2ofb h ASP 39 CO 0.27 0.61 -0.73 0.20 -2.88 0.00 0.00 179.24 176.72 2ofb s ASN 40 N -6.11 3.62 0.59 2.28 0.01 -1.26 -5.00 114.94 109.07 2ofb s ASN 40 Ca -0.11 -3.06 0.37 0.00 -0.71 0.00 0.00 52.86 49.34 2ofb s ASN 40 Cb 0.19 -1.14 1.81 0.00 0.41 0.00 0.00 41.25 42.52 2ofb s ASN 40 CO 0.80 -0.20 2.16 1.55 -1.51 0.00 0.00 177.10 179.90 2ofb h PRO 41 N 6.17 0.00 0.00 -0.60 0.13 -1.95 -1.29 132.00 134.46 2ofb h PRO 41 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2ofb h PRO 41 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2ofb h PRO 41 CO 0.54 0.03 0.00 0.78 -0.23 0.00 0.00 178.00 179.12 2ofb h GLY 42 N 0.96 0.00 -0.84 1.56 0.00 -1.94 -2.54 103.07 100.27 2ofb h GLY 42 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ofb h GLY 42 CO 0.00 0.00 -0.35 0.70 0.00 0.00 0.00 176.54 176.89 2ofb n ASN 43 N -2.64 1.93 -4.73 0.19 3.02 -0.49 -5.00 115.26 107.54 2ofb n ASN 43 Ca -0.01 -1.45 -0.42 0.00 -0.03 0.00 0.00 54.58 52.67 2ofb n ASN 43 Cb 0.14 0.32 -0.03 0.00 -0.61 0.00 0.00 39.78 39.61 2ofb n ASN 43 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2ofb n ILE 44 N 0.03 0.36 -4.14 2.41 5.41 -0.96 -4.77 119.36 117.71 2ofb n ILE 44 Ca 0.11 -0.09 -0.12 0.00 1.00 0.00 0.00 62.75 63.65 2ofb n ILE 44 Cb 0.46 -1.97 -0.11 0.00 -0.71 0.00 0.00 39.64 37.31 2ofb n ILE 44 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2ofb s THR 45 N 0.75 0.72 0.24 1.39 -4.23 -1.26 -5.09 115.64 108.15 2ofb s THR 45 Ca 0.71 -1.63 -0.31 0.00 -1.18 0.00 0.00 61.69 59.27 2ofb s THR 45 Cb -0.50 -1.32 -0.13 0.00 1.34 0.00 0.00 72.50 71.88 2ofb s THR 45 CO 0.38 -0.66 1.42 -0.11 -0.54 0.00 0.00 174.62 175.11 2ofb n LEU 46 N 0.51 3.15 -4.14 4.79 7.94 -1.26 -4.68 117.00 123.30 2ofb n LEU 46 Ca -0.16 1.14 -0.19 0.00 -1.11 0.00 0.00 56.01 55.69 2ofb n LEU 46 Cb 0.58 -1.43 -0.13 0.00 0.53 0.00 0.00 43.42 42.97 2ofb n LEU 46 CO 0.27 -0.46 -0.46 -0.44 -1.11 0.00 0.00 177.39 175.19 2ofb s SER 47 N 0.32 1.60 0.43 1.96 0.01 -0.71 -4.71 113.70 112.60 2ofb s SER 47 Ca 0.68 -0.50 -0.20 0.00 1.31 0.00 0.00 55.95 57.25 2ofb s SER 47 Cb -0.65 -0.08 -0.10 0.00 0.21 0.00 0.00 66.02 65.40 2ofb s SER 47 CO 0.49 -0.01 0.93 -2.16 0.41 0.00 0.00 173.24 172.90 2ofb s PRO 48 N -1.32 4.17 0.13 12.44 0.04 -1.25 -0.27 135.00 148.94 2ofb s PRO 48 Ca -0.00 1.05 0.06 0.00 0.04 0.00 0.00 61.00 62.14 2ofb s PRO 48 Cb -0.08 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 2ofb s PRO 48 CO 0.01 -0.04 -0.13 -0.48 0.04 0.00 0.00 177.00 176.40 2ofb s LEU 49 N -3.27 2.43 -0.14 -3.56 0.05 -0.62 -1.86 118.68 111.71 2ofb s LEU 49 Ca 0.61 -0.85 -0.07 0.00 0.05 0.00 0.00 54.13 53.87 2ofb s LEU 49 Cb -0.09 -0.50 0.05 0.00 -2.05 0.00 0.00 46.19 43.60 2ofb s LEU 49 CO 0.16 -0.18 0.33 -0.22 -0.55 0.00 0.00 176.35 175.88 2ofb s LEU 50 N -2.58 0.17 0.00 1.48 2.96 -0.58 -2.21 118.68 117.92 2ofb s LEU 50 Ca 0.10 0.71 -0.06 0.00 -0.22 0.00 0.00 54.13 54.66 2ofb s LEU 50 Cb -0.04 1.04 0.02 0.00 0.50 0.00 0.00 46.19 47.72 2ofb s LEU 50 CO 0.03 -0.18 0.36 0.61 -1.32 0.00 0.00 176.35 175.85 2ofb n GLY 51 N 4.22 1.77 2.83 7.98 0.00 -0.24 -1.10 105.19 120.66 2ofb n GLY 51 Ca -0.24 -1.23 -0.14 0.00 0.00 0.00 0.00 46.02 44.41 2ofb n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ofb s ILE 52 N -2.57 0.06 0.29 -0.61 1.01 -0.40 -1.21 121.20 117.76 2ofb s ILE 52 Ca 0.10 0.07 0.09 0.00 0.00 0.00 0.00 60.65 60.91 2ofb s ILE 52 Cb -0.02 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.28 2ofb s ILE 52 CO 0.07 0.07 0.02 0.00 0.00 0.00 0.00 174.94 175.11 2ofb s GLN 53 N 0.57 2.28 0.44 2.79 -2.07 0.38 -1.43 119.66 122.63 2ofb s GLN 53 Ca -0.05 -1.48 -0.22 0.00 -1.82 0.00 0.00 55.36 51.79 2ofb s GLN 53 Cb -0.08 -2.13 -0.09 0.00 -1.09 0.00 0.00 33.01 29.62 2ofb s GLN 53 CO -0.01 0.30 1.02 -1.01 -1.32 0.00 0.00 175.29 174.27 2ofb s HIS 54 N -2.37 3.16 -0.23 9.60 3.76 -0.71 -4.25 115.29 124.25 2ofb s HIS 54 Ca 0.33 1.61 -0.01 0.00 -0.15 0.00 0.00 55.06 56.84 2ofb s HIS 54 Cb -0.05 -3.04 -0.14 0.00 1.11 0.00 0.00 32.58 30.45 2ofb s HIS 54 CO 0.20 -0.61 -0.22 1.63 -0.85 0.00 0.00 174.74 174.89 2ofb n LYS 55 N -0.58 0.56 0.07 1.40 4.76 -1.26 -4.64 118.16 118.48 2ofb n LYS 55 Ca 0.07 0.15 -0.17 0.00 -2.87 0.00 0.00 58.31 55.49 2ofb n LYS 55 Cb 0.52 -1.44 -0.09 0.00 -1.84 0.00 0.00 35.03 32.18 2ofb n LYS 55 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ofb h ARG 56 N -0.15 0.52 -6.90 1.97 3.08 -1.98 -3.46 114.38 107.46 2ofb h ARG 56 Ca -0.53 -0.61 -0.53 0.00 0.07 0.00 0.00 59.98 58.38 2ofb h ARG 56 Cb 1.75 0.19 0.08 0.00 0.08 0.00 0.00 29.97 32.06 2ofb h ARG 56 CO -0.13 1.23 0.66 0.00 -1.07 0.00 0.00 179.97 180.66 2ofb s ALA 57 N -3.16 3.47 0.26 0.04 0.00 -1.26 -4.92 121.76 116.18 2ofb s ALA 57 Ca -0.07 1.31 0.15 0.00 0.00 0.00 0.00 51.96 53.34 2ofb s ALA 57 Cb 0.07 -3.50 0.60 0.00 0.00 0.00 0.00 23.12 20.29 2ofb s ALA 57 CO 0.90 -0.75 1.72 0.66 0.00 0.00 0.00 175.76 178.29 2ofb h SER 58 N 3.19 0.00 -2.47 0.00 4.64 -1.95 -3.33 113.55 113.62 2ofb h SER 58 Ca -0.49 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.23 2ofb h SER 58 Cb 1.23 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.91 2ofb h SER 58 CO 0.65 0.46 -0.68 0.00 -0.87 0.00 0.00 176.83 176.38 2ofb n GLN 59 N -3.76 1.87 -2.36 4.77 6.02 -1.26 -2.58 117.38 120.08 2ofb n GLN 59 Ca -0.01 -4.30 -0.36 0.00 -0.01 0.00 0.00 57.00 52.32 2ofb n GLN 59 Cb 0.52 -2.08 -0.02 0.00 1.02 0.00 0.00 30.24 29.68 2ofb n GLN 59 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2ofb s PRO 60 N -1.77 3.74 0.61 -1.09 0.04 -1.25 -4.59 135.00 130.68 2ofb s PRO 60 Ca 0.34 1.62 -0.10 0.00 0.04 0.00 0.00 61.00 62.90 2ofb s PRO 60 Cb 0.08 -2.28 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 2ofb s PRO 60 CO -0.09 -0.53 0.99 0.99 0.04 0.00 0.00 177.00 178.39 2ofb s THR 61 N -1.69 4.38 0.25 1.26 2.01 -1.26 -1.50 115.64 119.08 2ofb s THR 61 Ca 0.65 0.58 -0.22 0.00 0.31 0.00 0.00 61.69 63.02 2ofb s THR 61 Cb -0.24 -3.74 0.03 0.00 0.01 0.00 0.00 72.50 68.56 2ofb s THR 61 CO 0.29 -0.91 0.72 0.72 -0.69 0.00 0.00 174.62 174.74 2ofb s PHE 62 N -3.12 -0.24 0.05 4.92 -0.12 -0.48 -1.73 117.98 117.25 2ofb s PHE 62 Ca 0.54 -0.16 -0.10 0.00 -0.05 0.00 0.00 56.93 57.16 2ofb s PHE 62 Cb -0.11 0.68 0.00 0.00 -0.63 0.00 0.00 43.02 42.97 2ofb s PHE 62 CO 0.51 -1.14 0.20 0.20 -0.05 0.00 0.00 175.22 174.94 2ofb s GLY 63 N -2.89 0.03 0.08 1.99 0.00 -0.51 -1.96 107.32 104.07 2ofb s GLY 63 Ca 0.09 -0.33 -0.15 0.00 0.00 0.00 0.00 44.72 44.33 2ofb s GLY 63 CO 0.03 -0.51 0.37 -0.11 0.00 0.00 0.00 173.10 172.88 2ofb s PHE 64 N -2.82 -0.17 -0.10 1.90 -0.12 -0.25 -1.28 117.98 115.14 2ofb s PHE 64 Ca -0.03 -0.05 0.00 0.00 -0.05 0.00 0.00 56.93 56.81 2ofb s PHE 64 Cb 0.00 0.18 -0.02 0.00 -0.63 0.00 0.00 43.02 42.55 2ofb s PHE 64 CO -0.05 -0.61 -0.09 0.99 -0.05 0.00 0.00 175.22 175.40 2ofb s THR 65 N -3.19 3.43 -0.25 -4.49 2.01 -0.26 -0.99 115.64 111.90 2ofb s THR 65 Ca -0.01 -0.56 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 2ofb s THR 65 Cb 0.01 -2.42 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 2ofb s THR 65 CO -0.07 0.56 0.03 -0.69 -0.69 0.00 0.00 174.62 173.75 2ofb s VAL 66 N -0.23 3.86 -0.59 3.82 1.01 0.38 -1.52 120.40 127.13 2ofb s VAL 66 Ca 0.02 -0.41 -0.21 0.00 0.00 0.00 0.00 61.98 61.38 2ofb s VAL 66 Cb -0.13 -2.83 0.07 0.00 0.00 0.00 0.00 36.38 33.50 2ofb s VAL 66 CO 0.03 0.32 0.79 -2.28 0.00 0.00 0.00 175.10 173.95 2ofb s HIS 67 N 1.53 2.89 0.15 5.22 5.65 -0.78 -2.35 115.29 127.60 2ofb s HIS 67 Ca 0.05 -0.62 -0.31 0.00 0.25 0.00 0.00 55.06 54.43 2ofb s HIS 67 Cb -0.15 -3.98 -0.09 0.00 -1.18 0.00 0.00 32.58 27.17 2ofb s HIS 67 CO 0.01 -1.34 1.51 -1.58 -0.65 0.00 0.00 174.74 172.69 2ofb s TRP 68 N 3.23 3.11 -2.31 3.88 0.52 -1.25 -3.82 118.94 122.30 2ofb s TRP 68 Ca 0.18 0.72 0.28 0.00 0.02 0.00 0.00 56.10 57.30 2ofb s TRP 68 Cb -0.19 -3.85 1.30 0.00 -1.15 0.00 0.00 33.47 29.57 2ofb s TRP 68 CO 0.10 -3.10 1.88 0.09 0.02 0.00 0.00 176.95 175.94 2ofb n ASN 69 N 3.99 0.99 0.00 2.95 4.13 -1.26 -3.75 115.26 122.31 2ofb n ASN 69 Ca 0.13 -1.36 0.00 0.00 1.68 0.00 0.00 54.58 55.03 2ofb n ASN 69 Cb 0.40 -0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.63 2ofb n ASN 69 CO 0.00 0.00 0.00 2.22 0.28 0.00 0.00 177.26 179.76 2ofb n PHE 70 N -0.22 0.00 -3.88 3.10 -1.74 -1.26 -4.99 117.46 108.47 2ofb n PHE 70 Ca 0.20 -0.22 -0.09 0.00 -0.56 0.00 0.00 57.45 56.77 2ofb n PHE 70 Cb 0.27 -0.02 -0.08 0.00 1.52 0.00 0.00 39.48 41.16 2ofb n PHE 70 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 2ofb s SER 71 N -0.44 0.12 0.00 5.98 0.15 -1.25 -4.97 113.70 113.28 2ofb s SER 71 Ca 0.00 -0.54 0.30 0.00 0.70 0.00 0.00 55.95 56.41 2ofb s SER 71 Cb 0.00 0.29 1.50 0.00 -1.71 0.00 0.00 66.02 66.10 2ofb s SER 71 CO 0.00 -0.62 2.01 -0.62 1.20 0.00 0.00 173.24 175.21 2ofb n GLU 72 N 0.38 0.80 -2.03 5.44 -0.58 -1.26 -4.65 120.64 118.73 2ofb n GLU 72 Ca -0.17 -0.16 -0.29 0.00 -0.42 0.00 0.00 57.16 56.12 2ofb n GLU 72 Cb 0.60 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 30.03 2ofb n GLU 72 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2ofb s SER 73 N -2.31 5.19 0.00 1.62 1.04 -1.26 -4.44 113.70 113.53 2ofb s SER 73 Ca 0.35 0.88 0.01 0.00 0.48 0.00 0.00 55.95 57.68 2ofb s SER 73 Cb 0.21 -1.63 -0.01 0.00 0.10 0.00 0.00 66.02 64.69 2ofb s SER 73 CO 0.43 -1.44 -0.03 -0.89 0.98 0.00 0.00 173.24 172.29 2ofb s THR 74 N -3.32 0.19 -0.01 2.02 2.01 -0.58 -3.80 115.64 112.16 2ofb s THR 74 Ca 0.58 -0.25 0.06 0.00 0.31 0.00 0.00 61.69 62.40 2ofb s THR 74 Cb -0.11 -0.20 -0.03 0.00 0.01 0.00 0.00 72.50 72.18 2ofb s THR 74 CO 0.49 -0.04 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.29 2ofb s THR 75 N -0.29 2.58 -0.02 -0.82 2.01 -0.99 -0.51 115.64 117.60 2ofb s THR 75 Ca -0.02 -1.03 0.06 0.00 0.31 0.00 0.00 61.69 61.02 2ofb s THR 75 Cb -0.02 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.47 2ofb s THR 75 CO -0.00 0.50 -0.20 0.68 -0.69 0.00 0.00 174.62 174.92 2ofb s VAL 76 N -0.75 2.62 0.00 3.82 -7.23 -0.19 -0.47 120.40 118.20 2ofb s VAL 76 Ca 0.12 -0.98 0.08 0.00 -1.81 0.00 0.00 61.98 59.39 2ofb s VAL 76 Cb -0.10 -2.01 -0.02 0.00 0.56 0.00 0.00 36.38 34.81 2ofb s VAL 76 CO 0.01 0.52 -0.25 -0.36 -0.31 0.00 0.00 175.10 174.71 2ofb s PHE 77 N -0.73 2.25 0.02 2.82 0.40 -0.16 -1.29 117.98 121.29 2ofb s PHE 77 Ca 0.12 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 56.03 2ofb s PHE 77 Cb -0.10 -1.42 -0.02 0.00 0.51 0.00 0.00 43.02 41.99 2ofb s PHE 77 CO 0.01 0.01 -0.04 -0.08 0.70 0.00 0.00 175.22 175.82 2ofb s THR 78 N -0.66 0.18 0.00 0.64 -1.32 -0.35 -1.09 115.64 113.04 2ofb s THR 78 Ca 0.10 -0.90 0.00 0.00 -1.21 0.00 0.00 61.69 59.68 2ofb s THR 78 Cb -0.10 -0.31 0.00 0.00 -1.51 0.00 0.00 72.50 70.58 2ofb s THR 78 CO -0.00 -0.46 0.00 0.61 -2.21 0.00 0.00 174.62 172.56 2ofb n GLY 79 N 1.64 0.72 2.97 6.08 0.00 -0.83 -1.19 105.19 114.58 2ofb n GLY 79 Ca -0.23 -0.65 -0.14 0.00 0.00 0.00 0.00 46.02 45.00 2ofb n GLY 79 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ofb s GLN 80 N 0.28 0.37 -0.31 1.61 0.74 -0.72 -1.38 119.66 120.25 2ofb s GLN 80 Ca 0.00 -0.35 -0.17 0.00 0.05 0.00 0.00 55.36 54.89 2ofb s GLN 80 Cb 0.00 -0.26 -0.02 0.00 1.10 0.00 0.00 33.01 33.83 2ofb s GLN 80 CO 0.00 0.06 0.47 0.00 -0.55 0.00 0.00 175.29 175.27 2ofb s PHE 82 N 2.27 3.31 -0.18 0.00 0.08 -0.22 -3.83 117.98 119.41 2ofb s PHE 82 Ca 0.18 0.27 -0.02 0.00 0.12 0.00 0.00 56.93 57.48 2ofb s PHE 82 Cb -0.16 -1.80 -0.01 0.00 -0.57 0.00 0.00 43.02 40.49 2ofb s PHE 82 CO 0.11 0.56 -0.09 0.42 -0.10 0.00 0.00 175.22 176.13 2ofb s ILE 83 N -1.05 3.12 0.77 0.64 1.01 -1.26 -1.47 121.20 122.96 2ofb s ILE 83 Ca 0.18 -0.60 -0.06 0.00 0.00 0.00 0.00 60.65 60.17 2ofb s ILE 83 Cb -0.12 -2.37 0.16 0.00 0.01 0.00 0.00 42.46 40.14 2ofb s ILE 83 CO 0.08 0.47 1.05 -0.90 0.00 0.00 0.00 174.94 175.64 2ofb n ASP 84 N 4.34 0.78 0.33 3.58 5.68 -0.33 -4.89 116.55 126.03 2ofb n ASP 84 Ca -0.19 -1.81 0.22 0.00 -0.50 0.00 0.00 54.79 52.51 2ofb n ASP 84 Cb 0.51 -0.74 1.10 0.00 -1.14 0.00 0.00 41.12 40.86 2ofb n ASP 84 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 2ofb h ARG 85 N 0.00 0.00 -0.29 0.11 0.11 -2.00 -0.71 114.38 111.60 2ofb h ARG 85 Ca -0.34 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.74 2ofb h ARG 85 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 2ofb h ARG 85 CO 0.31 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.47 2ofb n ASN 86 N -3.10 3.02 0.00 0.08 5.03 -1.26 -4.96 115.26 114.07 2ofb n ASN 86 Ca -0.02 -1.93 0.00 0.00 0.87 0.00 0.00 54.58 53.50 2ofb n ASN 86 Cb 0.12 -0.18 0.00 0.00 -1.02 0.00 0.00 39.78 38.70 2ofb n ASN 86 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2ofb n GLY 87 N 1.41 0.62 3.74 7.41 0.00 -0.27 -5.04 105.19 113.06 2ofb n GLY 87 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2ofb n GLY 87 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ofb s LYS 88 N -0.17 4.70 -0.13 1.61 2.20 -1.26 -4.75 119.74 121.95 2ofb s LYS 88 Ca 0.00 1.56 -0.05 0.00 -0.36 0.00 0.00 55.97 57.12 2ofb s LYS 88 Cb 0.00 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.97 2ofb s LYS 88 CO 0.00 0.24 0.06 -1.21 -0.36 0.00 0.00 175.35 174.08 2ofb s GLU 89 N -0.48 3.42 -0.03 4.03 2.02 -1.26 -1.19 118.70 125.21 2ofb s GLU 89 Ca 0.46 -0.31 0.03 0.00 0.02 0.00 0.00 54.97 55.17 2ofb s GLU 89 Cb -0.26 -3.03 0.00 0.00 0.10 0.00 0.00 34.13 30.93 2ofb s GLU 89 CO 0.33 0.59 -0.11 0.08 0.02 0.00 0.00 175.26 176.17 2ofb s VAL 90 N -0.53 0.91 -0.31 2.63 1.01 -0.54 -4.39 120.40 119.18 2ofb s VAL 90 Ca 0.10 -0.43 -0.15 0.00 0.00 0.00 0.00 61.98 61.50 2ofb s VAL 90 Cb -0.12 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 2ofb s VAL 90 CO 0.02 0.28 0.38 -0.76 0.00 0.00 0.00 175.10 175.02 2ofb s LEU 91 N 0.17 4.24 -0.28 3.92 1.43 -0.18 -1.05 118.68 126.93 2ofb s LEU 91 Ca -0.03 0.02 -0.14 0.00 -1.03 0.00 0.00 54.13 52.94 2ofb s LEU 91 Cb -0.09 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 2ofb s LEU 91 CO 0.01 -0.28 0.33 -0.54 0.23 0.00 0.00 176.35 176.10 2ofb s LYS 92 N 2.07 3.92 0.12 1.70 -0.14 -0.70 -1.07 119.74 125.64 2ofb s LYS 92 Ca 0.14 -0.12 0.05 0.00 -1.36 0.00 0.00 55.97 54.67 2ofb s LYS 92 Cb -0.16 -3.68 -0.04 0.00 -1.68 0.00 0.00 37.83 32.27 2ofb s LYS 92 CO 0.11 -0.30 -0.12 0.95 -0.76 0.00 0.00 175.35 175.24 2ofb s THR 93 N 1.99 1.15 0.17 2.17 -4.23 -0.32 -1.76 115.64 114.82 2ofb s THR 93 Ca 0.13 -1.76 0.10 0.00 -1.18 0.00 0.00 61.69 58.97 2ofb s THR 93 Cb -0.16 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.11 2ofb s THR 93 CO 0.10 -0.54 -0.22 -0.04 -0.54 0.00 0.00 174.62 173.39 2ofb s MET 94 N -2.95 1.39 0.05 3.99 -1.94 -0.34 -1.44 119.30 118.07 2ofb s MET 94 Ca 0.09 -1.45 0.00 0.00 -1.71 0.00 0.00 55.69 52.63 2ofb s MET 94 Cb -0.03 -1.61 -0.03 0.00 2.01 0.00 0.00 34.83 35.17 2ofb s MET 94 CO 0.01 0.34 -0.04 1.67 -0.01 0.00 0.00 175.02 177.00 2ofb s TRP 95 N -1.75 0.55 -0.07 -0.03 1.48 -0.16 -1.21 118.94 117.75 2ofb s TRP 95 Ca 0.17 -0.86 0.04 0.00 -1.06 0.00 0.00 56.10 54.39 2ofb s TRP 95 Cb -0.07 -0.37 -0.00 0.00 -1.16 0.00 0.00 33.47 31.86 2ofb s TRP 95 CO 0.08 -0.26 -0.20 -0.51 -4.06 0.00 0.00 176.95 172.00 2ofb s LEU 96 N -2.49 1.94 -0.24 -4.66 1.43 -0.41 -1.94 118.68 112.31 2ofb s LEU 96 Ca 0.01 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2ofb s LEU 96 Cb 0.02 -1.15 0.03 0.00 0.03 0.00 0.00 46.19 45.11 2ofb s LEU 96 CO -0.06 0.15 -0.08 -0.22 0.23 0.00 0.00 176.35 176.38 2ofb s LEU 97 N 0.20 3.08 -0.31 1.79 2.96 -0.06 -1.02 118.68 125.32 2ofb s LEU 97 Ca -0.10 -0.85 -0.17 0.00 -0.22 0.00 0.00 54.13 52.79 2ofb s LEU 97 Cb -0.15 -1.64 -0.02 0.00 0.50 0.00 0.00 46.19 44.88 2ofb s LEU 97 CO 0.05 -0.11 0.45 -0.60 -1.32 0.00 0.00 176.35 174.81 2ofb s ARG 98 N 1.32 3.80 0.38 1.98 6.06 0.33 -0.90 118.95 131.91 2ofb s ARG 98 Ca 0.00 -0.07 -0.09 0.00 -2.50 0.00 0.00 55.73 53.07 2ofb s ARG 98 Cb -0.16 -3.74 -0.06 0.00 0.06 0.00 0.00 34.95 31.05 2ofb s ARG 98 CO -0.05 -0.47 0.72 -1.54 -2.50 0.00 0.00 175.30 171.46 2ofb s SER 99 N 1.69 6.50 -0.19 -2.12 1.04 0.18 -1.52 113.70 119.27 2ofb s SER 99 Ca 0.17 1.03 -0.25 0.00 0.48 0.00 0.00 55.95 57.38 2ofb s SER 99 Cb -0.16 -2.28 -0.01 0.00 0.10 0.00 0.00 66.02 63.67 2ofb s SER 99 CO 0.11 -0.36 0.81 -0.55 0.98 0.00 0.00 173.24 174.23 2ofb s SER 100 N -3.19 6.90 0.36 7.02 0.15 -1.26 -4.87 113.70 118.82 2ofb s SER 100 Ca 0.49 1.11 0.08 0.00 0.70 0.00 0.00 55.95 58.33 2ofb s SER 100 Cb -0.10 -2.44 -0.05 0.00 -1.71 0.00 0.00 66.02 61.72 2ofb s SER 100 CO 0.31 -0.41 0.14 0.68 1.20 0.00 0.00 173.24 175.16 2ofb s VAL 101 N 2.25 2.71 0.16 4.45 -7.23 -1.26 -5.04 120.40 116.45 2ofb s VAL 101 Ca 0.36 -1.74 -0.09 0.00 -1.81 0.00 0.00 61.98 58.71 2ofb s VAL 101 Cb -0.16 -2.95 -0.03 0.00 0.56 0.00 0.00 36.38 33.80 2ofb s VAL 101 CO 0.11 -0.12 1.51 -1.13 -0.31 0.00 0.00 175.10 175.16 2ofb h ASN 102 N 1.54 0.92 -5.03 4.85 -1.24 -1.97 -3.47 115.58 111.17 2ofb h ASN 102 Ca -0.43 -0.41 0.03 0.00 0.71 0.00 0.00 56.30 56.20 2ofb h ASN 102 Cb 1.25 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 40.02 2ofb h ASN 102 CO 0.66 1.18 0.28 1.51 -1.29 0.00 0.00 177.43 179.77 2ofb s ASP 103 N -6.84 -0.10 0.57 1.15 1.47 -1.26 -5.06 116.67 106.61 2ofb s ASP 103 Ca -0.10 -0.90 0.35 0.00 1.18 0.00 0.00 52.55 53.08 2ofb s ASP 103 Cb 0.12 0.78 1.68 0.00 -0.34 0.00 0.00 42.92 45.15 2ofb s ASP 103 CO 0.87 -1.50 2.11 -0.29 0.68 0.00 0.00 175.17 177.04 2ofb h ILE 104 N 2.00 0.16 0.00 2.11 2.10 -2.02 -1.87 117.51 120.00 2ofb h ILE 104 Ca -0.27 -0.40 0.00 0.00 1.08 0.00 0.00 64.86 65.27 2ofb h ILE 104 Cb 1.25 1.34 0.00 0.00 -1.09 0.00 0.00 36.82 38.31 2ofb h ILE 104 CO 0.33 0.04 0.00 0.77 -1.08 0.00 0.00 178.15 178.21 2ofb h SER 105 N 0.00 0.00 -0.09 2.19 4.64 -2.00 -1.89 113.55 116.40 2ofb h SER 105 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ofb h SER 105 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2ofb h SER 105 CO 0.01 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.75 2ofb n TYR 106 N -2.90 0.08 -0.26 4.77 4.01 -0.70 -4.62 117.16 117.55 2ofb n TYR 106 Ca -0.01 -0.04 0.12 0.00 -0.16 0.00 0.00 57.90 57.82 2ofb n TYR 106 Cb 0.19 -0.00 0.39 0.00 -0.31 0.00 0.00 39.34 39.61 2ofb n TYR 106 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 2ofb h ASP 107 N 4.55 0.62 -0.43 7.72 3.58 -1.43 -2.31 116.42 128.73 2ofb h ASP 107 Ca 0.00 0.04 0.12 0.00 0.42 0.00 0.00 57.03 57.60 2ofb h ASP 107 Cb 0.97 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.92 2ofb h ASP 107 CO 0.00 0.32 0.31 4.11 -2.88 0.00 0.00 179.24 181.09 2ofb h TRP 108 N 0.66 0.04 -0.64 0.28 5.08 -1.82 -2.19 115.95 117.37 2ofb h TRP 108 Ca 0.44 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.41 2ofb h TRP 108 Cb 0.73 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 26.87 2ofb h TRP 108 CO -0.00 0.02 0.00 0.36 -1.28 0.00 0.00 178.44 177.54 2ofb n LYS 109 N -4.42 3.66 0.00 0.12 2.85 -0.87 -4.64 118.16 114.86 2ofb n LYS 109 Ca 0.07 -2.87 0.12 0.00 -1.05 0.00 0.00 58.31 54.59 2ofb n LYS 109 Cb 0.48 -1.86 0.20 0.00 -0.65 0.00 0.00 35.03 33.20 2ofb n LYS 109 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ofb n ALA 110 N 1.11 3.47 -4.01 0.58 0.00 -0.82 -4.87 120.51 115.98 2ofb n ALA 110 Ca 0.25 -0.48 -0.31 0.00 0.00 0.00 0.00 53.44 52.91 2ofb n ALA 110 Cb 0.87 -1.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.16 2ofb n ALA 110 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2ofb s THR 111 N -2.64 1.76 0.31 0.00 2.01 -1.26 -0.65 115.64 115.19 2ofb s THR 111 Ca 0.19 -1.19 -0.08 0.00 0.31 0.00 0.00 61.69 60.91 2ofb s THR 111 Cb 0.18 -1.87 -0.06 0.00 0.01 0.00 0.00 72.50 70.76 2ofb s THR 111 CO 0.60 0.09 0.63 -0.76 -0.69 0.00 0.00 174.62 174.49 2ofb s LEU 112 N 1.32 4.01 0.07 4.42 1.43 -0.08 -4.92 118.68 124.94 2ofb s LEU 112 Ca -0.04 0.92 0.06 0.00 -1.03 0.00 0.00 54.13 54.04 2ofb s LEU 112 Cb -0.17 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.27 2ofb s LEU 112 CO -0.07 -0.23 -0.16 0.54 0.23 0.00 0.00 176.35 176.66 2ofb s VAL 113 N -2.11 1.25 0.00 -1.59 0.11 -1.26 -0.88 120.40 115.92 2ofb s VAL 113 Ca 0.48 -1.31 0.00 0.00 -2.93 0.00 0.00 61.98 58.21 2ofb s VAL 113 Cb -0.11 -1.17 0.00 0.00 -1.53 0.00 0.00 36.38 33.57 2ofb s VAL 113 CO 0.28 -0.15 0.00 0.61 -3.33 0.00 0.00 175.10 172.50 2ofb n GLY 114 N 1.33 1.31 3.37 6.54 0.00 -0.82 -5.00 105.19 111.92 2ofb n GLY 114 Ca -0.20 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.72 2ofb n GLY 114 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ofb s TYR 115 N -5.86 1.72 -0.19 1.61 -0.85 -1.26 -0.99 117.35 111.53 2ofb s TYR 115 Ca 0.00 -0.80 -0.20 0.00 -0.52 0.00 0.00 57.07 55.55 2ofb s TYR 115 Cb 0.00 -0.98 0.05 0.00 0.38 0.00 0.00 41.96 41.42 2ofb s TYR 115 CO 0.00 0.12 0.55 -0.80 -1.52 0.00 0.00 175.55 173.90 2ofb s ASN 116 N -3.36 -0.56 -0.14 -0.18 0.02 -0.52 -4.90 114.94 105.30 2ofb s ASN 116 Ca 0.28 1.03 -0.02 0.00 -1.02 0.00 0.00 52.86 53.13 2ofb s ASN 116 Cb 0.04 1.04 -0.02 0.00 0.02 0.00 0.00 41.25 42.34 2ofb s ASN 116 CO 0.09 -0.24 -0.09 0.20 0.02 0.00 0.00 177.10 177.09 2ofb s ASN 117 N 0.09 4.36 -0.03 -1.22 0.01 -1.26 -1.17 114.94 115.72 2ofb s ASN 117 Ca -0.02 -0.24 0.06 0.00 -0.71 0.00 0.00 52.86 51.95 2ofb s ASN 117 Cb -0.04 -1.69 -0.02 0.00 0.41 0.00 0.00 41.25 39.91 2ofb s ASN 117 CO 0.02 0.17 -0.20 -0.36 -1.51 0.00 0.00 177.10 175.22 2ofb s PHE 118 N 0.35 2.53 0.23 2.20 0.08 -0.23 -2.24 117.98 120.90 2ofb s PHE 118 Ca -0.08 -0.28 0.05 0.00 0.12 0.00 0.00 56.93 56.74 2ofb s PHE 118 Cb -0.15 -1.55 -0.05 0.00 -0.57 0.00 0.00 43.02 40.69 2ofb s PHE 118 CO 0.04 0.11 -0.05 0.95 -0.10 0.00 0.00 175.22 176.17 2ofb s THR 119 N -0.71 1.33 0.32 0.64 -4.23 -0.43 -1.01 115.64 111.56 2ofb s THR 119 Ca 0.11 -2.09 -0.28 0.00 -1.18 0.00 0.00 61.69 58.26 2ofb s THR 119 Cb -0.10 -2.29 -0.09 0.00 1.34 0.00 0.00 72.50 71.35 2ofb s THR 119 CO 0.00 -0.40 1.15 -0.13 -0.54 0.00 0.00 174.62 174.71 2ofb s ARG 120 N -3.78 4.43 -0.37 3.99 0.52 -1.26 -0.93 118.95 121.55 2ofb s ARG 120 Ca 0.27 1.87 -0.26 0.00 -0.52 0.00 0.00 55.73 57.09 2ofb s ARG 120 Cb 0.04 -3.01 0.01 0.00 0.52 0.00 0.00 34.95 32.51 2ofb s ARG 120 CO 0.09 -0.00 0.91 -1.17 0.02 0.00 0.00 175.30 175.15 2ofb s LEU 121 N -1.82 4.01 0.00 2.53 2.96 -0.06 -4.77 118.68 121.53 2ofb s LEU 121 Ca 0.49 0.57 0.00 0.00 -0.22 0.00 0.00 54.13 54.96 2ofb s LEU 121 Cb -0.32 -3.24 0.00 0.00 0.50 0.00 0.00 46.19 43.12 2ofb s LEU 121 CO 0.42 -0.85 0.00 -1.20 -1.32 0.00 0.00 176.35 173.40