#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1msa n ASN 2 N 0.00 1.64 -4.21 1.67 6.94 -1.25 -0.30 115.26 119.75 1msa n ASN 2 Ca 0.00 -1.32 -0.29 0.00 -0.02 0.00 0.00 54.58 52.95 1msa n ASN 2 Cb 0.00 0.14 -0.16 0.00 -2.36 0.00 0.00 39.78 37.40 1msa n ASN 2 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1msa s ILE 3 N -0.99 1.74 -0.28 1.53 1.01 -1.26 -0.34 121.20 122.61 1msa s ILE 3 Ca 0.11 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.87 1msa s ILE 3 Cb 0.08 -1.47 0.06 0.00 0.01 0.00 0.00 42.46 41.15 1msa s ILE 3 CO 0.16 0.49 -0.07 -0.22 0.00 0.00 0.00 174.94 175.30 1msa s LEU 4 N -0.21 3.66 0.38 2.97 2.96 0.44 -4.97 118.68 123.91 1msa s LEU 4 Ca 0.00 -1.45 -0.24 0.00 -0.22 0.00 0.00 54.13 52.22 1msa s LEU 4 Cb -0.11 -1.59 -0.10 0.00 0.50 0.00 0.00 46.19 44.89 1msa s LEU 4 CO 0.02 -0.22 0.95 -0.31 -1.32 0.00 0.00 176.35 175.46 1msa s TYR 5 N 1.11 3.50 0.24 5.38 1.51 -1.26 -0.22 117.35 127.61 1msa s TYR 5 Ca -0.06 1.70 -0.31 0.00 -1.01 0.00 0.00 57.07 57.38 1msa s TYR 5 Cb -0.20 -2.89 -0.13 0.00 -0.11 0.00 0.00 41.96 38.63 1msa s TYR 5 CO -0.05 0.05 1.41 -1.13 -1.11 0.00 0.00 175.55 174.72 1msa n SER 6 N -0.04 2.78 0.00 2.29 3.41 0.30 -0.68 113.62 121.69 1msa n SER 6 Ca 0.04 1.14 0.00 0.00 -0.26 0.00 0.00 58.87 59.80 1msa n SER 6 Cb 0.52 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.04 1msa n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1msa n GLY 7 N 2.14 0.60 3.93 5.00 0.00 0.22 -4.88 105.19 112.22 1msa n GLY 7 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1msa n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1msa s GLU 8 N -0.96 3.43 0.03 1.61 2.02 0.14 -4.96 118.70 120.02 1msa s GLU 8 Ca 0.00 -0.54 0.05 0.00 0.02 0.00 0.00 54.97 54.50 1msa s GLU 8 Cb 0.00 -2.99 -0.02 0.00 0.10 0.00 0.00 34.13 31.22 1msa s GLU 8 CO 0.00 0.55 -0.16 0.99 0.02 0.00 0.00 175.26 176.67 1msa s THR 9 N -1.66 1.25 -0.31 3.63 2.01 -1.26 -1.71 115.64 117.60 1msa s THR 9 Ca 0.35 -0.98 -0.06 0.00 0.31 0.00 0.00 61.69 61.31 1msa s THR 9 Cb -0.12 -1.11 0.03 0.00 0.01 0.00 0.00 72.50 71.31 1msa s THR 9 CO 0.28 0.11 0.07 -0.76 -0.69 0.00 0.00 174.62 173.63 1msa s LEU 10 N -1.00 3.96 0.95 4.42 1.43 0.90 -4.95 118.68 124.39 1msa s LEU 10 Ca 0.04 -0.93 -0.13 0.00 -1.03 0.00 0.00 54.13 52.08 1msa s LEU 10 Cb -0.08 -1.84 0.16 0.00 0.03 0.00 0.00 46.19 44.46 1msa s LEU 10 CO 0.01 -0.24 1.13 -0.44 0.23 0.00 0.00 176.35 177.04 1msa s SER 11 N 1.43 3.17 0.25 2.29 0.01 -1.26 -0.62 113.70 118.96 1msa s SER 11 Ca 0.00 0.97 -0.31 0.00 1.31 0.00 0.00 55.95 57.92 1msa s SER 11 Cb -0.18 -1.54 -0.13 0.00 0.21 0.00 0.00 66.02 64.38 1msa s SER 11 CO 0.02 -2.76 1.47 0.35 0.41 0.00 0.00 173.24 172.72 1msa n THR 12 N -3.91 0.95 -0.13 1.44 -2.24 -1.09 -0.99 114.28 108.30 1msa n THR 12 Ca 0.07 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1msa n THR 12 Cb 0.59 -1.62 0.00 0.00 -2.10 0.00 0.00 70.33 67.20 1msa n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1msa n GLY 13 N 2.20 1.84 3.89 3.38 0.00 0.28 -4.94 105.19 111.83 1msa n GLY 13 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1msa n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1msa s GLU 14 N -0.31 3.70 0.24 1.61 2.02 -0.17 -4.88 118.70 120.91 1msa s GLU 14 Ca 0.00 0.13 -0.15 0.00 0.02 0.00 0.00 54.97 54.96 1msa s GLU 14 Cb 0.00 -2.63 0.01 0.00 0.10 0.00 0.00 34.13 31.61 1msa s GLU 14 CO 0.00 0.23 0.53 -0.59 0.02 0.00 0.00 175.26 175.45 1msa s PHE 15 N -2.02 0.17 -0.02 1.61 -0.12 -1.26 -1.95 117.98 114.39 1msa s PHE 15 Ca 0.46 -0.55 -0.01 0.00 -0.05 0.00 0.00 56.93 56.78 1msa s PHE 15 Cb -0.11 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.56 1msa s PHE 15 CO 0.27 -1.02 0.08 -0.51 -0.05 0.00 0.00 175.22 173.99 1msa s LEU 16 N -2.97 3.91 0.03 -1.99 1.43 -0.03 -4.48 118.68 114.58 1msa s LEU 16 Ca 0.18 0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 53.41 1msa s LEU 16 Cb -0.02 -2.22 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 1msa s LEU 16 CO 0.06 0.29 0.05 0.54 0.23 0.00 0.00 176.35 177.53 1msa s ASN 17 N -1.59 0.22 -0.30 2.29 4.22 0.60 -0.44 114.94 119.93 1msa s ASN 17 Ca 0.21 -0.56 -0.08 0.00 -2.14 0.00 0.00 52.86 50.29 1msa s ASN 17 Cb -0.12 0.19 0.17 0.00 1.28 0.00 0.00 41.25 42.78 1msa s ASN 17 CO 0.12 -0.46 0.81 -0.47 -2.04 0.00 0.00 177.10 175.06 1msa s TYR 18 N -2.41 -1.09 0.00 1.54 6.14 -0.69 -3.81 117.35 117.04 1msa s TYR 18 Ca -0.07 1.37 0.00 0.00 0.64 0.00 0.00 57.07 59.02 1msa s TYR 18 Cb -0.03 0.46 0.00 0.00 0.42 0.00 0.00 41.96 42.82 1msa s TYR 18 CO -0.04 -0.58 0.00 0.41 0.64 0.00 0.00 175.55 175.98 1msa n GLY 19 N 5.36 3.88 0.85 8.97 0.00 -1.26 -0.91 105.19 122.09 1msa n GLY 19 Ca -0.06 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.07 1msa n GLY 19 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1msa n SER 20 N 7.16 2.51 -4.75 1.61 3.41 -1.26 -4.88 113.62 117.42 1msa n SER 20 Ca 0.00 -1.88 -0.37 0.00 -0.26 0.00 0.00 58.87 56.36 1msa n SER 20 Cb 0.00 -0.21 -0.07 0.00 -0.26 0.00 0.00 64.21 63.67 1msa n SER 20 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1msa s PHE 21 N -1.57 3.52 -0.07 7.33 0.08 -0.09 -0.19 117.98 126.99 1msa s PHE 21 Ca 0.35 0.72 0.00 0.00 0.12 0.00 0.00 56.93 58.12 1msa s PHE 21 Cb 0.19 -2.36 0.02 0.00 -0.57 0.00 0.00 43.02 40.30 1msa s PHE 21 CO 0.27 0.31 -0.05 0.08 -0.10 0.00 0.00 175.22 175.72 1msa s VAL 22 N 0.20 0.67 -0.45 -0.44 1.01 -0.57 -1.70 120.40 119.11 1msa s VAL 22 Ca 0.20 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 1msa s VAL 22 Cb -0.14 -0.71 0.12 0.00 0.00 0.00 0.00 36.38 35.65 1msa s VAL 22 CO 0.07 0.28 0.29 0.12 0.00 0.00 0.00 175.10 175.85 1msa s PHE 23 N 1.27 3.51 -0.02 5.22 5.36 0.41 -0.60 117.98 133.11 1msa s PHE 23 Ca -0.05 -2.17 0.06 0.00 -0.96 0.00 0.00 56.93 53.81 1msa s PHE 23 Cb -0.14 -3.37 -0.02 0.00 -0.34 0.00 0.00 43.02 39.15 1msa s PHE 23 CO -0.02 -0.98 -0.19 -1.50 -1.46 0.00 0.00 175.22 171.07 1msa s ILE 24 N 1.18 2.64 -0.89 3.12 2.07 -0.39 -0.86 121.20 128.07 1msa s ILE 24 Ca 0.08 -0.94 -0.17 0.00 -1.41 0.00 0.00 60.65 58.20 1msa s ILE 24 Cb -0.24 -2.01 0.15 0.00 0.13 0.00 0.00 42.46 40.50 1msa s ILE 24 CO -0.03 0.55 1.02 -0.32 -1.91 0.00 0.00 174.94 174.25 1msa s MET 25 N -0.79 3.58 1.00 3.50 -2.45 -0.82 -1.95 119.30 121.36 1msa s MET 25 Ca 0.11 -1.94 -0.12 0.00 -1.25 0.00 0.00 55.69 52.50 1msa s MET 25 Cb -0.10 -4.76 0.19 0.00 1.25 0.00 0.00 34.83 31.41 1msa s MET 25 CO 0.01 -1.64 1.08 -0.65 1.05 0.00 0.00 175.02 174.87 1msa s GLN 26 N 2.00 0.40 0.47 4.11 -0.21 -0.85 0.98 119.66 126.56 1msa s GLN 26 Ca 0.28 0.85 0.27 0.00 0.02 0.00 0.00 55.36 56.77 1msa s GLN 26 Cb -0.07 -1.71 1.00 0.00 1.00 0.00 0.00 33.01 33.24 1msa s GLN 26 CO -0.09 -2.84 1.85 0.93 -2.12 0.00 0.00 175.29 173.03 1msa h GLU 27 N -1.98 0.00 -0.21 2.91 4.39 -1.92 -2.90 114.58 114.88 1msa h GLU 27 Ca -0.53 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.17 1msa h GLU 27 Cb 1.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 1msa h GLU 27 CO 0.52 0.15 0.00 -0.40 -1.16 0.00 0.00 179.01 178.12 1msa n ASP 28 N -3.28 1.39 -0.06 1.42 5.75 -1.26 -2.24 116.55 118.27 1msa n ASP 28 Ca 0.01 -1.83 -0.01 0.00 -0.01 0.00 0.00 54.79 52.95 1msa n ASP 28 Cb 0.40 -0.13 -0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1msa n ASP 28 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1msa s ASN 30 N -2.34 6.44 -0.48 0.00 2.47 -1.26 -4.28 114.94 115.48 1msa s ASN 30 Ca 0.00 0.51 -0.15 0.00 0.42 0.00 0.00 52.86 53.64 1msa s ASN 30 Cb 0.00 -2.19 0.08 0.00 -1.45 0.00 0.00 41.25 37.69 1msa s ASN 30 CO 0.00 0.07 0.41 -0.22 -3.72 0.00 0.00 177.10 173.63 1msa s LEU 31 N 0.63 5.71 0.03 3.21 2.96 -1.26 -2.01 118.68 127.94 1msa s LEU 31 Ca 0.17 -1.43 0.05 0.00 -0.22 0.00 0.00 54.13 52.71 1msa s LEU 31 Cb -0.13 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.35 1msa s LEU 31 CO 0.05 -0.68 -0.12 -0.69 -1.32 0.00 0.00 176.35 173.58 1msa s VAL 32 N 1.62 3.23 -0.32 1.68 1.01 -0.82 -1.86 120.40 124.93 1msa s VAL 32 Ca 0.04 -0.99 -0.08 0.00 0.00 0.00 0.00 61.98 60.94 1msa s VAL 32 Cb -0.25 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.75 1msa s VAL 32 CO 0.06 0.35 0.12 -0.22 0.00 0.00 0.00 175.10 175.41 1msa s LEU 33 N -1.47 4.13 -0.01 3.92 2.96 0.55 -1.26 118.68 127.49 1msa s LEU 33 Ca 0.16 -0.79 0.01 0.00 -0.22 0.00 0.00 54.13 53.29 1msa s LEU 33 Cb -0.11 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 1msa s LEU 33 CO 0.07 -0.25 0.01 -0.31 -1.32 0.00 0.00 176.35 174.55 1msa s TYR 34 N 1.52 3.10 -0.48 5.38 2.02 0.23 0.77 117.35 129.89 1msa s TYR 34 Ca 0.02 0.10 -0.01 0.00 -0.37 0.00 0.00 57.07 56.82 1msa s TYR 34 Cb -0.18 -1.69 0.13 0.00 -0.40 0.00 0.00 41.96 39.82 1msa s TYR 34 CO 0.04 0.47 0.26 0.34 -1.57 0.00 0.00 175.55 175.09 1msa s ASP 35 N -1.47 5.06 1.53 2.29 -1.08 0.93 -1.52 116.67 122.42 1msa s ASP 35 Ca 0.19 -2.43 0.00 0.00 -0.52 0.00 0.00 52.55 49.78 1msa s ASP 35 Cb -0.12 -1.78 0.00 0.00 -1.46 0.00 0.00 42.92 39.56 1msa s ASP 35 CO 0.09 -0.43 0.00 0.52 0.52 0.00 0.00 175.17 175.88 1msa n VAL 36 N 4.01 0.00 0.27 1.11 0.31 0.73 -1.88 118.33 122.88 1msa n VAL 36 Ca 0.03 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.47 1msa n VAL 36 Cb 0.39 0.00 0.19 0.00 -0.91 0.00 0.00 33.84 33.52 1msa n VAL 36 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1msa n ASP 37 N 10.00 3.31 -4.50 4.52 5.75 -1.26 -4.91 116.55 129.46 1msa n ASP 37 Ca 0.00 -1.95 -0.37 0.00 -0.01 0.00 0.00 54.79 52.46 1msa n ASP 37 Cb 0.00 -0.23 -0.12 0.00 -1.03 0.00 0.00 41.12 39.74 1msa n ASP 37 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1msa s LYS 38 N -1.40 3.76 -0.13 0.11 2.20 -0.79 -5.06 119.74 118.43 1msa s LYS 38 Ca 0.35 -0.42 -0.29 0.00 -0.36 0.00 0.00 55.97 55.25 1msa s LYS 38 Cb 0.21 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 33.04 1msa s LYS 38 CO 0.29 -0.19 1.54 -1.25 -0.36 0.00 0.00 175.35 175.38 1msa s PRO 39 N 1.67 4.09 -0.07 4.03 0.04 -1.26 -0.05 135.00 143.46 1msa s PRO 39 Ca 0.07 1.91 0.18 0.00 0.04 0.00 0.00 61.00 63.19 1msa s PRO 39 Cb -0.15 -3.94 -0.23 0.00 0.04 0.00 0.00 34.50 30.22 1msa s PRO 39 CO 0.06 -0.93 0.44 -0.89 0.04 0.00 0.00 177.00 175.73 1msa n ILE 40 N 5.69 1.07 -3.52 0.56 2.08 0.23 -4.93 119.36 120.55 1msa n ILE 40 Ca 0.17 -0.73 -0.18 0.00 0.56 0.00 0.00 62.75 62.57 1msa n ILE 40 Cb 0.44 -0.51 -0.06 0.00 -0.75 0.00 0.00 39.64 38.76 1msa n ILE 40 CO 0.00 0.00 0.00 0.86 0.56 0.00 0.00 176.55 177.97 1msa s TRP 41 N -2.84 -0.65 0.04 1.39 -0.00 -1.10 -4.99 118.94 110.78 1msa s TRP 41 Ca -0.07 1.09 -0.18 0.00 -0.00 0.00 0.00 56.10 56.94 1msa s TRP 41 Cb 0.09 0.42 0.04 0.00 -0.00 0.00 0.00 33.47 34.01 1msa s TRP 41 CO 0.84 -0.62 0.42 0.00 -0.00 0.00 0.00 176.95 177.59 1msa s ALA 42 N -1.30 -1.03 -0.62 5.86 0.00 -1.26 -0.33 121.76 123.08 1msa s ALA 42 Ca -0.10 0.33 0.25 0.00 0.00 0.00 0.00 51.96 52.43 1msa s ALA 42 Cb -0.00 0.35 0.66 0.00 0.00 0.00 0.00 23.12 24.13 1msa s ALA 42 CO 0.09 -0.46 1.72 1.79 0.00 0.00 0.00 175.76 178.90 1msa h THR 43 N 3.00 0.00 -3.65 0.00 1.35 -1.75 -3.48 112.91 108.38 1msa h THR 43 Ca -0.31 -0.65 -0.26 0.00 -0.55 0.00 0.00 66.41 64.64 1msa h THR 43 Cb 1.21 1.64 0.07 0.00 -1.73 0.00 0.00 68.15 69.34 1msa h THR 43 CO 0.43 0.00 -0.42 0.59 -0.25 0.00 0.00 175.52 175.88 1msa n ASN 44 N -2.56 -4.69 -1.19 5.36 3.02 -1.26 -4.93 115.26 109.01 1msa n ASN 44 Ca 0.05 -0.28 0.08 0.00 -0.03 0.00 0.00 54.58 54.40 1msa n ASN 44 Cb 0.46 -3.39 0.30 0.00 -0.61 0.00 0.00 39.78 36.53 1msa n ASN 44 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1msa n THR 45 N -4.09 2.31 -1.76 3.41 -2.24 -1.26 -5.01 114.28 105.63 1msa n THR 45 Ca -0.03 -1.66 -0.42 0.00 -2.27 0.00 0.00 64.05 59.68 1msa n THR 45 Cb 0.56 -0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.57 1msa n THR 45 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1msa s GLY 46 N -1.51 1.30 0.00 3.38 0.00 -1.26 -2.19 107.32 107.05 1msa s GLY 46 Ca 0.45 1.51 0.00 0.00 0.00 0.00 0.00 44.72 46.68 1msa s GLY 46 CO 0.12 2.90 0.00 0.61 0.00 0.00 0.00 173.10 176.73 1msa n GLY 47 N 4.00 1.23 0.03 0.20 0.00 0.57 -4.90 105.19 106.32 1msa n GLY 47 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1msa n GLY 47 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1msa n LEU 48 N 0.00 0.18 0.00 0.99 4.77 -0.93 -4.93 117.00 117.09 1msa n LEU 48 Ca 0.00 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 1msa n LEU 48 Cb 0.00 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 1msa n LEU 48 CO 0.00 -0.16 0.00 -0.24 -1.33 0.00 0.00 177.39 175.66 1msa n SER 49 N -1.68 0.00 -3.85 -1.43 2.88 -1.26 -5.11 113.62 103.17 1msa n SER 49 Ca 0.05 -0.16 -0.12 0.00 -1.33 0.00 0.00 58.87 57.32 1msa n SER 49 Cb 0.29 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.66 1msa n SER 49 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1msa s ARG 50 N 0.53 0.55 -1.38 -1.46 1.81 -1.26 -4.29 118.95 113.45 1msa s ARG 50 Ca 0.00 -0.39 -0.07 0.00 -1.72 0.00 0.00 55.73 53.55 1msa s ARG 50 Cb 0.00 0.23 0.03 0.00 -0.45 0.00 0.00 34.95 34.76 1msa s ARG 50 CO 0.00 -0.14 0.98 0.43 -0.68 0.00 0.00 175.30 175.89 1msa n SER 51 N 1.32 -3.99 -4.77 0.23 7.64 -0.95 -4.37 113.62 108.73 1msa n SER 51 Ca -0.22 -0.69 -0.30 0.00 1.01 0.00 0.00 58.87 58.67 1msa n SER 51 Cb 0.56 -4.46 0.12 0.00 -1.01 0.00 0.00 64.21 59.42 1msa n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1msa s PHE 53 N -3.11 0.95 -0.19 0.00 -0.71 -0.03 -2.66 117.98 112.23 1msa s PHE 53 Ca 0.62 -0.51 -0.06 0.00 -1.04 0.00 0.00 56.93 55.95 1msa s PHE 53 Cb -0.16 -0.55 -0.03 0.00 -1.21 0.00 0.00 43.02 41.08 1msa s PHE 53 CO 0.55 -0.01 0.02 -1.17 -1.34 0.00 0.00 175.22 173.26 1msa s LEU 54 N -1.78 3.47 -0.14 -1.99 2.96 0.21 -0.40 118.68 121.02 1msa s LEU 54 Ca -0.04 -0.08 0.02 0.00 -0.22 0.00 0.00 54.13 53.80 1msa s LEU 54 Cb -0.09 -1.87 0.02 0.00 0.50 0.00 0.00 46.19 44.74 1msa s LEU 54 CO 0.01 0.12 -0.18 -0.55 -1.32 0.00 0.00 176.35 174.44 1msa s SER 55 N 0.65 2.81 -0.55 3.68 0.15 0.82 -0.07 113.70 121.19 1msa s SER 55 Ca 0.01 -0.53 -0.19 0.00 0.70 0.00 0.00 55.95 55.94 1msa s SER 55 Cb -0.14 -1.28 0.08 0.00 -1.71 0.00 0.00 66.02 62.98 1msa s SER 55 CO 0.02 0.02 0.67 -0.32 1.20 0.00 0.00 173.24 174.83 1msa s MET 56 N 1.08 3.08 0.67 5.44 1.75 -0.69 -0.96 119.30 129.67 1msa s MET 56 Ca -0.03 -1.10 -0.09 0.00 -1.25 0.00 0.00 55.69 53.22 1msa s MET 56 Cb -0.14 -4.18 0.02 0.00 2.84 0.00 0.00 34.83 33.36 1msa s MET 56 CO -0.05 -1.39 1.03 -0.65 -0.65 0.00 0.00 175.02 173.31 1msa s GLN 57 N 2.69 2.79 0.00 4.11 -0.21 -0.35 0.73 119.66 129.42 1msa s GLN 57 Ca 0.13 0.25 0.26 0.00 0.02 0.00 0.00 55.36 56.02 1msa s GLN 57 Cb -0.22 -2.11 1.09 0.00 1.00 0.00 0.00 33.01 32.77 1msa s GLN 57 CO 0.09 -0.97 1.82 0.25 -2.12 0.00 0.00 175.29 174.36 1msa n THR 58 N -2.88 0.24 0.77 -0.19 -2.24 -1.26 -2.41 114.28 106.32 1msa n THR 58 Ca 0.06 0.06 0.10 0.00 -2.27 0.00 0.00 64.05 62.00 1msa n THR 58 Cb 0.58 -0.62 0.29 0.00 -2.10 0.00 0.00 70.33 68.47 1msa n THR 58 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1msa n ASP 59 N -1.51 2.44 0.00 3.42 5.75 -1.26 0.24 116.55 125.63 1msa n ASP 59 Ca 0.06 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 52.98 1msa n ASP 59 Cb 0.30 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 1msa n ASP 59 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1msa n GLY 60 N 1.28 0.95 3.74 6.12 0.00 -1.01 0.11 105.19 116.38 1msa n GLY 60 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1msa n GLY 60 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1msa s ASN 61 N -3.03 6.97 -0.39 1.61 2.47 -1.26 -4.39 114.94 116.93 1msa s ASN 61 Ca 0.00 1.16 -0.13 0.00 0.42 0.00 0.00 52.86 54.31 1msa s ASN 61 Cb 0.00 -2.38 0.02 0.00 -1.45 0.00 0.00 41.25 37.44 1msa s ASN 61 CO 0.00 0.01 0.25 -0.22 -3.72 0.00 0.00 177.10 173.41 1msa s LEU 62 N 0.26 4.85 0.00 3.21 2.96 -1.26 -1.22 118.68 127.49 1msa s LEU 62 Ca 0.33 -0.91 0.08 0.00 -0.22 0.00 0.00 54.13 53.41 1msa s LEU 62 Cb -0.18 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.41 1msa s LEU 62 CO 0.17 -0.40 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.88 1msa s VAL 63 N 1.62 1.89 -0.33 1.68 1.01 -0.14 -1.05 120.40 125.07 1msa s VAL 63 Ca 0.03 -1.10 -0.13 0.00 0.00 0.00 0.00 61.98 60.78 1msa s VAL 63 Cb -0.19 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 1msa s VAL 63 CO 0.08 0.46 0.25 -0.69 0.00 0.00 0.00 175.10 175.20 1msa s VAL 64 N -0.63 5.27 0.14 2.92 1.01 0.08 -0.13 120.40 129.06 1msa s VAL 64 Ca 0.09 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 61.99 1msa s VAL 64 Cb -0.09 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1msa s VAL 64 CO -0.00 0.01 0.06 -0.31 0.00 0.00 0.00 175.10 174.86 1msa s TYR 65 N 1.77 3.05 0.57 5.22 2.02 0.47 -0.52 117.35 129.92 1msa s TYR 65 Ca 0.07 -0.03 0.02 0.00 -0.37 0.00 0.00 57.07 56.76 1msa s TYR 65 Cb -0.17 -1.50 0.05 0.00 -0.40 0.00 0.00 41.96 39.94 1msa s TYR 65 CO 0.11 0.51 0.79 0.54 -1.57 0.00 0.00 175.55 175.93 1msa s ASN 66 N -2.77 5.12 0.51 2.29 2.20 -0.53 -0.85 114.94 120.91 1msa s ASN 66 Ca 0.29 -0.21 0.25 0.00 -0.94 0.00 0.00 52.86 52.25 1msa s ASN 66 Cb -0.11 -0.57 1.36 0.00 -2.00 0.00 0.00 41.25 39.93 1msa s ASN 66 CO 0.21 -1.25 1.94 -0.65 -2.94 0.00 0.00 177.10 174.41 1msa h PRO 67 N 0.04 0.08 -0.05 3.55 0.11 -1.76 0.19 132.00 134.15 1msa h PRO 67 Ca -0.40 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1msa h PRO 67 Cb 1.29 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1msa h PRO 67 CO 0.48 0.05 0.00 0.43 -0.21 0.00 0.00 178.00 178.75 1msa n SER 68 N -4.37 0.84 -0.20 -2.05 7.64 -1.26 -4.91 113.62 109.31 1msa n SER 68 Ca 0.14 -1.42 -0.02 0.00 1.01 0.00 0.00 58.87 58.57 1msa n SER 68 Cb 0.71 -0.03 -0.01 0.00 -1.01 0.00 0.00 64.21 63.88 1msa n SER 68 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1msa n ASN 69 N -0.29 -2.75 -4.72 6.43 3.02 0.65 -5.03 115.26 112.57 1msa n ASN 69 Ca 0.18 0.04 -0.37 0.00 -0.03 0.00 0.00 54.58 54.40 1msa n ASN 69 Cb 0.22 -0.98 -0.07 0.00 -0.61 0.00 0.00 39.78 38.35 1msa n ASN 69 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1msa s LYS 70 N -2.77 4.27 0.24 3.52 2.20 -1.26 -4.81 119.74 121.14 1msa s LYS 70 Ca 0.00 0.19 -0.30 0.00 -0.36 0.00 0.00 55.97 55.50 1msa s LYS 70 Cb 0.00 -3.44 -0.10 0.00 -1.51 0.00 0.00 37.83 32.78 1msa s LYS 70 CO 0.00 0.19 1.46 -1.25 -0.36 0.00 0.00 175.35 175.40 1msa s PRO 71 N 0.58 4.25 -0.00 4.03 0.05 -1.26 -1.46 135.00 141.19 1msa s PRO 71 Ca 0.19 2.33 0.04 0.00 0.05 0.00 0.00 61.00 63.60 1msa s PRO 71 Cb -0.14 -3.11 -0.05 0.00 0.05 0.00 0.00 34.50 31.26 1msa s PRO 71 CO 0.06 -0.46 0.13 -0.89 0.05 0.00 0.00 177.00 175.89 1msa n ILE 72 N 2.53 0.00 -3.59 0.56 5.41 0.32 -4.92 119.36 119.66 1msa n ILE 72 Ca 0.08 -0.29 -0.08 0.00 1.00 0.00 0.00 62.75 63.46 1msa n ILE 72 Cb 0.40 0.77 -0.05 0.00 -0.71 0.00 0.00 39.64 40.06 1msa n ILE 72 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 176.55 177.41 1msa s TRP 73 N -1.70 -0.28 0.03 1.39 -0.00 -1.20 -4.99 118.94 112.18 1msa s TRP 73 Ca 0.00 0.46 -0.24 0.00 -0.00 0.00 0.00 56.10 56.32 1msa s TRP 73 Cb 0.03 0.47 0.06 0.00 -0.00 0.00 0.00 33.47 34.02 1msa s TRP 73 CO 0.15 -0.28 0.56 0.00 -0.00 0.00 0.00 176.95 177.38 1msa s ALA 74 N -1.25 -1.44 0.09 5.86 0.00 -1.26 -0.74 121.76 123.01 1msa s ALA 74 Ca 0.01 0.77 0.29 0.00 0.00 0.00 0.00 51.96 53.03 1msa s ALA 74 Cb -0.01 0.31 1.13 0.00 0.00 0.00 0.00 23.12 24.56 1msa s ALA 74 CO -0.01 -0.48 1.90 0.66 0.00 0.00 0.00 175.76 177.83 1msa h SER 75 N 2.83 0.00 -3.98 0.00 4.64 -1.47 -3.47 113.55 112.10 1msa h SER 75 Ca -0.30 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.79 1msa h SER 75 Cb 1.20 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.38 1msa h SER 75 CO 0.40 0.09 -0.42 0.59 -0.87 0.00 0.00 176.83 176.62 1msa n ASN 76 N -3.22 -4.01 -0.29 4.97 5.03 -1.26 -4.94 115.26 111.54 1msa n ASN 76 Ca 0.01 -0.34 0.08 0.00 0.87 0.00 0.00 54.58 55.20 1msa n ASN 76 Cb 0.37 -3.24 0.17 0.00 -1.02 0.00 0.00 39.78 36.05 1msa n ASN 76 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1msa n THR 77 N -3.74 2.02 -1.83 3.41 -2.24 -1.26 -5.04 114.28 105.60 1msa n THR 77 Ca -0.04 -2.56 -0.41 0.00 -2.27 0.00 0.00 64.05 58.77 1msa n THR 77 Cb 0.55 -0.24 -0.01 0.00 -2.10 0.00 0.00 70.33 68.52 1msa n THR 77 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1msa s GLY 78 N -2.94 2.32 0.00 3.38 0.00 -1.26 -4.03 107.32 104.79 1msa s GLY 78 Ca 0.35 1.52 0.00 0.00 0.00 0.00 0.00 44.72 46.59 1msa s GLY 78 CO 0.00 2.44 0.00 0.61 0.00 0.00 0.00 173.10 176.15 1msa n GLY 79 N 1.82 2.75 3.73 0.20 0.00 0.31 -4.93 105.19 109.07 1msa n GLY 79 Ca 0.06 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1msa n GLY 79 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1msa s GLN 80 N 3.98 4.28 0.11 1.61 0.74 -1.26 -4.79 119.66 124.34 1msa s GLN 80 Ca 0.00 2.23 -0.31 0.00 0.05 0.00 0.00 55.36 57.33 1msa s GLN 80 Cb 0.00 -3.16 -0.08 0.00 1.10 0.00 0.00 33.01 30.86 1msa s GLN 80 CO 0.00 -0.45 1.46 -0.80 -0.55 0.00 0.00 175.29 174.96 1msa s ASN 81 N 0.72 6.74 0.00 6.67 0.01 -1.26 -4.42 114.94 123.40 1msa s ASN 81 Ca 0.63 2.40 0.00 0.00 -0.71 0.00 0.00 52.86 55.17 1msa s ASN 81 Cb -0.40 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.67 1msa s ASN 81 CO 0.37 -0.73 0.00 0.61 -1.51 0.00 0.00 177.10 175.84 1msa n GLY 82 N 3.62 1.65 3.40 0.66 0.00 0.14 -4.98 105.19 109.68 1msa n GLY 82 Ca 0.13 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 1msa n GLY 82 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1msa s ASN 83 N 2.00 4.81 0.27 1.61 0.01 -1.26 -4.65 114.94 117.72 1msa s ASN 83 Ca 0.00 -0.27 0.07 0.00 -0.71 0.00 0.00 52.86 51.95 1msa s ASN 83 Cb 0.00 -1.85 -0.06 0.00 0.41 0.00 0.00 41.25 39.75 1msa s ASN 83 CO 0.00 -0.02 -0.08 -0.31 -1.51 0.00 0.00 177.10 175.18 1msa s TYR 84 N 1.52 1.93 -0.03 2.20 1.51 -1.26 -3.00 117.35 120.22 1msa s TYR 84 Ca 0.06 -0.67 -0.02 0.00 -1.01 0.00 0.00 57.07 55.43 1msa s TYR 84 Cb -0.15 -1.07 0.01 0.00 -0.11 0.00 0.00 41.96 40.65 1msa s TYR 84 CO 0.01 0.31 0.06 0.14 -1.11 0.00 0.00 175.55 174.96 1msa s VAL 85 N -2.99 -0.02 -0.29 0.71 -7.23 -0.89 -0.54 120.40 109.15 1msa s VAL 85 Ca 0.29 0.06 -0.09 0.00 -1.81 0.00 0.00 61.98 60.43 1msa s VAL 85 Cb 0.03 -0.10 -0.01 0.00 0.56 0.00 0.00 36.38 36.86 1msa s VAL 85 CO 0.11 0.02 0.12 0.00 -0.31 0.00 0.00 175.10 175.05 1msa s ILE 87 N 1.59 2.95 -0.71 0.00 1.01 0.10 -0.42 121.20 125.72 1msa s ILE 87 Ca 0.05 -0.69 -0.21 0.00 0.00 0.00 0.00 60.65 59.79 1msa s ILE 87 Cb -0.17 -2.24 0.09 0.00 0.01 0.00 0.00 42.46 40.15 1msa s ILE 87 CO 0.05 0.52 0.98 -0.22 0.00 0.00 0.00 174.94 176.27 1msa s LEU 88 N 0.50 4.60 0.89 2.97 2.96 0.54 -2.07 118.68 129.07 1msa s LEU 88 Ca -0.09 -1.25 -0.12 0.00 -0.22 0.00 0.00 54.13 52.45 1msa s LEU 88 Cb -0.16 -2.41 0.13 0.00 0.50 0.00 0.00 46.19 44.25 1msa s LEU 88 CO 0.04 -1.34 1.10 -1.10 -1.32 0.00 0.00 176.35 173.74 1msa s GLN 89 N 3.68 1.31 0.46 1.98 -0.21 -0.21 -4.85 119.66 121.82 1msa s GLN 89 Ca 0.24 0.59 0.29 0.00 0.02 0.00 0.00 55.36 56.49 1msa s GLN 89 Cb -0.15 -1.83 1.00 0.00 1.00 0.00 0.00 33.01 33.03 1msa s GLN 89 CO 0.06 -2.15 1.84 1.57 -2.12 0.00 0.00 175.29 174.48 1msa h LYS 90 N -1.47 0.00 -0.20 2.91 2.10 -1.95 -2.64 116.57 115.32 1msa h LYS 90 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1msa h LYS 90 Cb 1.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.63 1msa h LYS 90 CO 0.58 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.63 1msa n ASP 91 N -2.94 1.57 0.00 7.07 5.75 -1.26 -4.90 116.55 121.84 1msa n ASP 91 Ca 0.02 -1.77 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 1msa n ASP 91 Cb 0.37 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 1msa n ASP 91 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1msa n ARG 92 N 0.28 0.00 -3.57 0.11 0.63 -1.00 -5.04 116.66 108.08 1msa n ARG 92 Ca 0.15 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.72 1msa n ARG 92 Cb 0.30 -2.59 -0.06 0.00 0.45 0.00 0.00 32.46 30.56 1msa n ARG 92 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1msa s ASN 93 N -2.18 6.68 -0.30 6.15 3.84 -1.26 -4.88 114.94 122.99 1msa s ASN 93 Ca 0.00 0.82 -0.07 0.00 0.21 0.00 0.00 52.86 53.82 1msa s ASN 93 Cb 0.00 -2.19 0.01 0.00 -0.55 0.00 0.00 41.25 38.51 1msa s ASN 93 CO 0.00 0.23 0.10 -0.69 -2.79 0.00 0.00 177.10 173.94 1msa s VAL 94 N -1.29 4.11 0.05 -5.21 1.01 -1.26 -1.04 120.40 116.77 1msa s VAL 94 Ca 0.30 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.70 1msa s VAL 94 Cb -0.15 -3.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 1msa s VAL 94 CO 0.16 0.07 -0.16 -0.69 0.00 0.00 0.00 175.10 174.48 1msa s VAL 95 N 1.53 1.30 -0.20 2.92 1.01 -0.88 -4.96 120.40 121.11 1msa s VAL 95 Ca 0.03 -1.11 -0.07 0.00 0.00 0.00 0.00 61.98 60.83 1msa s VAL 95 Cb -0.17 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1msa s VAL 95 CO 0.03 0.03 0.05 -0.63 0.00 0.00 0.00 175.10 174.58 1msa s ILE 96 N -0.89 4.45 0.10 2.22 1.01 -1.26 -0.72 121.20 126.10 1msa s ILE 96 Ca 0.03 -0.14 0.10 0.00 0.00 0.00 0.00 60.65 60.64 1msa s ILE 96 Cb -0.08 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 1msa s ILE 96 CO 0.02 0.42 -0.26 -0.31 0.00 0.00 0.00 174.94 174.81 1msa s TYR 97 N 0.80 2.32 0.00 3.97 1.51 -0.62 -4.99 117.35 120.33 1msa s TYR 97 Ca 0.03 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.70 1msa s TYR 97 Cb -0.14 -1.30 0.00 0.00 -0.11 0.00 0.00 41.96 40.41 1msa s TYR 97 CO 0.02 0.27 0.00 0.41 -1.11 0.00 0.00 175.55 175.14 1msa n GLY 98 N 1.21 2.36 0.00 0.71 0.00 -1.26 -2.10 105.19 106.11 1msa n GLY 98 Ca -0.18 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.96 1msa n GLY 98 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1msa n THR 99 N -0.78 0.00 -2.45 2.61 -2.24 -1.26 -5.08 114.28 105.08 1msa n THR 99 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 1msa n THR 99 Cb 0.00 -1.63 -0.03 0.00 -2.10 0.00 0.00 70.33 66.56 1msa n THR 99 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1msa s ASP 100 N -1.00 7.14 -0.15 3.42 -4.77 -1.16 -4.94 116.67 115.21 1msa s ASP 100 Ca 0.00 2.05 0.18 0.00 -3.30 0.00 0.00 52.55 51.48 1msa s ASP 100 Cb 0.00 -2.59 -0.26 0.00 -1.09 0.00 0.00 42.92 38.99 1msa s ASP 100 CO 0.00 -0.38 0.23 0.54 0.70 0.00 0.00 175.17 176.26 1msa n ARG 101 N 3.30 0.68 -3.54 2.11 5.12 -1.26 -5.01 116.66 118.06 1msa n ARG 101 Ca 0.06 -0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.84 1msa n ARG 101 Cb 0.46 -1.56 -0.05 0.00 -1.16 0.00 0.00 32.46 30.15 1msa n ARG 101 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 1msa s TRP 102 N -2.69 -0.49 0.06 -1.55 -0.00 -1.26 -5.18 118.94 107.84 1msa s TRP 102 Ca -0.09 0.58 -0.21 0.00 -0.00 0.00 0.00 56.10 56.38 1msa s TRP 102 Cb 0.08 0.39 0.05 0.00 -0.00 0.00 0.00 33.47 33.98 1msa s TRP 102 CO 0.84 -0.67 0.49 0.00 -0.00 0.00 0.00 176.95 177.61 1msa s ALA 103 N -2.38 -1.23 -0.60 5.86 0.00 -1.26 -5.03 121.76 117.12 1msa s ALA 103 Ca -0.06 0.45 0.25 0.00 0.00 0.00 0.00 51.96 52.60 1msa s ALA 103 Cb -0.01 0.45 0.51 0.00 0.00 0.00 0.00 23.12 24.07 1msa s ALA 103 CO -0.01 -0.53 1.55 1.79 0.00 0.00 0.00 175.76 178.56 1msa h THR 104 N 2.72 0.00 -4.85 0.00 1.35 -2.06 -3.48 112.91 106.60 1msa h THR 104 Ca -0.31 -0.65 -0.27 0.00 -0.55 0.00 0.00 66.41 64.63 1msa h THR 104 Cb 1.22 1.49 0.13 0.00 -1.73 0.00 0.00 68.15 69.26 1msa h THR 104 CO 0.42 0.00 -0.59 0.61 -0.25 0.00 0.00 175.52 175.71 1msa n GLY 105 N 1.26 -0.19 0.56 5.82 0.00 -1.26 -4.94 105.19 106.43 1msa n GLY 105 Ca 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.11 1msa n GLY 105 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1msa n THR 106 N -3.66 2.18 -2.96 2.61 -2.24 -1.26 -5.05 114.28 103.91 1msa n THR 106 Ca -0.18 -3.01 -0.31 0.00 -2.27 0.00 0.00 64.05 58.28 1msa n THR 106 Cb 0.62 -0.25 -0.04 0.00 -2.10 0.00 0.00 70.33 68.55 1msa n THR 106 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1msa s HIS 107 N -3.17 3.43 0.00 4.78 -3.43 -1.26 -5.10 115.29 110.54 1msa s HIS 107 Ca 0.38 1.13 0.00 0.00 -0.80 0.00 0.00 55.06 55.77 1msa s HIS 107 Cb 0.36 -2.49 0.00 0.00 -1.43 0.00 0.00 32.58 29.01 1msa s HIS 107 CO -0.04 -0.03 0.00 0.25 -2.00 0.00 0.00 174.74 172.91 1msa n THR 108 N -0.92 0.00 -0.34 -5.38 -2.24 -1.26 -5.25 114.28 98.88 1msa n THR 108 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1msa n THR 108 Cb 0.54 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1msa n THR 108 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11