#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oa3 s SER 3 N 0.00 -0.45 0.00 8.00 0.15 -0.69 -5.02 113.70 115.69 1oa3 s SER 3 Ca 0.00 0.56 0.09 0.00 0.70 0.00 0.00 55.95 57.30 1oa3 s SER 3 Cb 0.00 0.59 0.15 0.00 -1.71 0.00 0.00 66.02 65.05 1oa3 s SER 3 CO 0.00 -0.44 0.98 0.00 1.20 0.00 0.00 173.24 174.98 1oa3 s ASP 5 N -0.87 5.92 0.30 0.00 1.01 -1.26 -4.70 116.67 117.06 1oa3 s ASP 5 Ca 0.14 2.62 0.06 0.00 0.71 0.00 0.00 52.55 56.09 1oa3 s ASP 5 Cb 0.09 -2.63 0.76 0.00 1.01 0.00 0.00 42.92 42.15 1oa3 s ASP 5 CO 0.12 -1.12 1.74 -0.61 0.21 0.00 0.00 175.17 175.52 1oa3 h GLN 6 N 2.11 0.59 -0.14 8.23 4.15 -1.94 -2.54 115.11 125.57 1oa3 h GLN 6 Ca -0.50 -0.04 -0.13 0.00 0.77 0.00 0.00 58.65 58.75 1oa3 h GLN 6 Cb 1.26 -0.13 -0.15 0.00 0.21 0.00 0.00 27.48 28.67 1oa3 h GLN 6 CO 0.60 0.39 -0.66 0.66 -1.93 0.00 0.00 178.83 177.89 1oa3 n TYR 7 N -4.88 0.52 -1.73 3.99 4.01 -1.26 -1.06 117.16 116.75 1oa3 n TYR 7 Ca 0.24 -1.50 -0.40 0.00 -0.16 0.00 0.00 57.90 56.08 1oa3 n TYR 7 Cb 0.63 -0.25 0.03 0.00 -0.31 0.00 0.00 39.34 39.44 1oa3 n TYR 7 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1oa3 n ALA 8 N -0.79 1.60 -2.79 -0.72 0.00 -0.96 -4.82 120.51 112.04 1oa3 n ALA 8 Ca 0.21 0.20 -0.09 0.00 0.00 0.00 0.00 53.44 53.76 1oa3 n ALA 8 Cb 0.81 -2.33 -0.11 0.00 0.00 0.00 0.00 19.45 17.82 1oa3 n ALA 8 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1oa3 s THR 9 N -1.24 0.13 -0.04 0.00 -4.23 -1.26 -1.49 115.64 107.51 1oa3 s THR 9 Ca 0.65 -1.09 0.02 0.00 -1.18 0.00 0.00 61.69 60.10 1oa3 s THR 9 Cb -0.45 -0.58 0.01 0.00 1.34 0.00 0.00 72.50 72.81 1oa3 s THR 9 CO 0.54 -0.60 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.56 1oa3 s PHE 10 N -2.05 1.15 0.04 3.99 0.08 0.12 -4.98 117.98 116.33 1oa3 s PHE 10 Ca -0.10 -0.35 0.09 0.00 0.12 0.00 0.00 56.93 56.69 1oa3 s PHE 10 Cb -0.05 -0.84 -0.03 0.00 -0.57 0.00 0.00 43.02 41.53 1oa3 s PHE 10 CO -0.03 -0.17 -0.26 -1.12 -0.10 0.00 0.00 175.22 173.54 1oa3 s SER 11 N 0.43 3.19 -0.28 1.36 0.01 -1.26 -0.31 113.70 116.85 1oa3 s SER 11 Ca -0.08 -0.56 -0.20 0.00 1.31 0.00 0.00 55.95 56.42 1oa3 s SER 11 Cb -0.12 -0.32 0.09 0.00 0.21 0.00 0.00 66.02 65.88 1oa3 s SER 11 CO 0.02 0.27 0.78 -0.83 0.41 0.00 0.00 173.24 173.88 1oa3 s GLY 12 N -1.16 -0.47 0.00 3.44 0.00 -0.78 -5.03 107.32 103.31 1oa3 s GLY 12 Ca 0.12 2.42 0.00 0.00 0.00 0.00 0.00 44.72 47.26 1oa3 s GLY 12 CO 0.02 2.16 0.00 1.16 0.00 0.00 0.00 173.10 176.43 1oa3 n ASN 13 N 3.48 0.00 -1.00 1.64 0.23 -1.26 -1.06 115.26 117.30 1oa3 n ASN 13 Ca -0.17 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 53.99 1oa3 n ASN 13 Cb 0.57 0.00 0.27 0.00 -2.08 0.00 0.00 39.78 38.54 1oa3 n ASN 13 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1oa3 n GLY 14 N 0.00 1.42 3.75 4.83 0.00 -1.26 -4.96 105.19 108.97 1oa3 n GLY 14 Ca 0.00 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 1oa3 n GLY 14 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oa3 s TYR 15 N -1.45 3.11 -0.05 1.61 2.02 -0.22 -1.43 117.35 120.94 1oa3 s TYR 15 Ca 0.37 0.03 0.02 0.00 -0.37 0.00 0.00 57.07 57.12 1oa3 s TYR 15 Cb 0.21 -1.58 0.02 0.00 -0.40 0.00 0.00 41.96 40.20 1oa3 s TYR 15 CO 0.28 0.51 -0.09 0.42 -1.57 0.00 0.00 175.55 175.10 1oa3 s ILE 16 N -1.40 0.87 -0.16 2.71 1.01 -0.44 -1.87 121.20 121.91 1oa3 s ILE 16 Ca 0.28 -0.33 -0.05 0.00 0.00 0.00 0.00 60.65 60.55 1oa3 s ILE 16 Cb -0.12 -0.82 -0.03 0.00 0.01 0.00 0.00 42.46 41.50 1oa3 s ILE 16 CO 0.21 0.29 -0.01 -0.69 0.00 0.00 0.00 174.94 174.74 1oa3 s VAL 17 N 0.70 4.14 -0.02 2.92 1.01 0.58 -1.17 120.40 128.55 1oa3 s VAL 17 Ca -0.12 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 61.62 1oa3 s VAL 17 Cb -0.15 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.40 1oa3 s VAL 17 CO 0.02 0.48 -0.11 -0.44 0.00 0.00 0.00 175.10 175.05 1oa3 s SER 18 N 0.37 1.37 -0.01 3.32 0.01 0.58 -0.70 113.70 118.64 1oa3 s SER 18 Ca -0.02 -0.21 -0.22 0.00 1.31 0.00 0.00 55.95 56.80 1oa3 s SER 18 Cb -0.14 -0.27 -0.20 0.00 0.21 0.00 0.00 66.02 65.63 1oa3 s SER 18 CO 0.02 0.11 1.18 -1.13 0.41 0.00 0.00 173.24 173.83 1oa3 h ASN 19 N 6.12 0.30 -6.65 2.44 -0.00 -1.54 -1.23 115.58 115.02 1oa3 h ASN 19 Ca -0.33 -0.63 -0.53 0.00 -0.00 0.00 0.00 56.30 54.81 1oa3 h ASN 19 Cb 1.17 -0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 39.39 1oa3 h ASN 19 CO 0.49 0.88 -0.97 -3.20 -0.00 0.00 0.00 177.43 174.64 1oa3 n ASN 20 N -4.52 -3.37 -3.19 1.15 4.05 -1.05 -3.23 115.26 105.10 1oa3 n ASN 20 Ca -0.08 -1.16 -0.36 0.00 0.45 0.00 0.00 54.58 53.43 1oa3 n ASN 20 Cb 0.45 -2.44 -0.04 0.00 1.23 0.00 0.00 39.78 38.98 1oa3 n ASN 20 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1oa3 n LEU 21 N -4.62 8.14 0.26 1.20 4.77 -0.22 -1.44 117.00 125.10 1oa3 n LEU 21 Ca -0.16 -4.37 0.13 0.00 -0.03 0.00 0.00 56.01 51.58 1oa3 n LEU 21 Cb 0.61 -1.48 0.71 0.00 -2.33 0.00 0.00 43.42 40.93 1oa3 n LEU 21 CO 0.73 2.02 0.96 4.11 -1.33 0.00 0.00 177.39 183.89 1oa3 h TRP 22 N 4.61 0.00 -0.27 -1.77 5.08 -1.84 -2.75 115.95 119.01 1oa3 h TRP 22 Ca 0.74 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.70 1oa3 h TRP 22 Cb 0.43 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.58 1oa3 h TRP 22 CO 1.79 0.12 0.00 0.41 -1.28 0.00 0.00 178.44 179.48 1oa3 n GLY 23 N -0.52 4.09 0.38 11.11 0.00 0.56 -4.69 105.19 116.12 1oa3 n GLY 23 Ca -0.01 -1.05 0.15 0.00 0.00 0.00 0.00 46.02 45.10 1oa3 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa3 h ALA 24 N 1.75 2.09 0.00 4.61 0.00 -1.05 -1.55 119.26 125.10 1oa3 h ALA 24 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1oa3 h ALA 24 Cb 1.46 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1oa3 h ALA 24 CO 0.23 -0.30 0.00 0.66 0.00 0.00 0.00 179.25 179.85 1oa3 h SER 25 N 0.45 0.00 0.82 0.00 4.64 -1.86 -2.63 113.55 114.96 1oa3 h SER 25 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1oa3 h SER 25 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1oa3 h SER 25 CO -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.83 1oa3 n ALA 26 N -2.01 2.34 -3.03 5.18 0.00 -0.58 -4.93 120.51 117.48 1oa3 n ALA 26 Ca -0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 53.44 53.32 1oa3 n ALA 26 Cb 0.19 -1.46 -0.00 0.00 0.00 0.00 0.00 19.45 18.18 1oa3 n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oa3 n GLY 27 N 1.32 2.71 3.25 0.00 0.00 -0.99 -2.98 105.19 108.50 1oa3 n GLY 27 Ca 0.09 -1.26 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 1oa3 n GLY 27 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oa3 s SER 28 N -1.07 2.89 0.00 1.61 0.01 -0.33 -4.96 113.70 111.85 1oa3 s SER 28 Ca 0.01 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.80 1oa3 s SER 28 Cb -0.00 -0.67 0.00 0.00 0.21 0.00 0.00 66.02 65.56 1oa3 s SER 28 CO 0.01 0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.51 1oa3 n GLY 29 N 2.85 0.24 3.54 3.44 0.00 -1.26 -1.27 105.19 112.73 1oa3 n GLY 29 Ca -0.17 -1.21 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 1oa3 n GLY 29 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1oa3 s PHE 30 N -4.00 -0.28 -0.05 1.61 -0.12 -0.27 -4.99 117.98 109.88 1oa3 s PHE 30 Ca 0.00 -0.04 -0.04 0.00 -0.05 0.00 0.00 56.93 56.80 1oa3 s PHE 30 Cb 0.00 0.50 0.02 0.00 -0.63 0.00 0.00 43.02 42.91 1oa3 s PHE 30 CO 0.00 -0.94 0.14 0.20 -0.05 0.00 0.00 175.22 174.56 1oa3 s GLY 31 N -2.84 -0.08 0.05 1.99 0.00 -1.26 -1.80 107.32 103.39 1oa3 s GLY 31 Ca 0.06 0.48 0.03 0.00 0.00 0.00 0.00 44.72 45.29 1oa3 s GLY 31 CO -0.05 0.55 -0.09 0.00 0.00 0.00 0.00 173.10 173.51 1oa3 s VAL 33 N -1.46 1.57 -0.14 0.00 -7.23 -0.46 -0.61 120.40 112.07 1oa3 s VAL 33 Ca -0.07 -1.23 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 1oa3 s VAL 33 Cb -0.09 -1.38 0.02 0.00 0.56 0.00 0.00 36.38 35.49 1oa3 s VAL 33 CO 0.01 0.11 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.89 1oa3 s THR 34 N -0.88 1.50 -0.25 5.32 2.01 -0.26 -1.71 115.64 121.37 1oa3 s THR 34 Ca 0.06 -0.59 -0.18 0.00 0.31 0.00 0.00 61.69 61.30 1oa3 s THR 34 Cb -0.09 -1.42 -0.03 0.00 0.01 0.00 0.00 72.50 70.97 1oa3 s THR 34 CO 0.02 0.45 0.49 -0.55 -0.69 0.00 0.00 174.62 174.34 1oa3 s SER 35 N 1.50 6.43 -0.20 3.53 0.15 -1.26 -1.31 113.70 122.54 1oa3 s SER 35 Ca 0.05 0.51 -0.16 0.00 0.70 0.00 0.00 55.95 57.05 1oa3 s SER 35 Cb -0.13 -2.27 -0.11 0.00 -1.71 0.00 0.00 66.02 61.80 1oa3 s SER 35 CO -0.10 -0.25 -0.11 0.52 1.20 0.00 0.00 173.24 174.49 1oa3 n VAL 36 N 5.05 1.50 -3.71 4.45 0.31 -0.39 -4.80 118.33 120.75 1oa3 n VAL 36 Ca -0.05 -0.02 -0.11 0.00 -0.01 0.00 0.00 64.34 64.15 1oa3 n VAL 36 Cb 0.50 -2.14 -0.11 0.00 -0.91 0.00 0.00 33.84 31.18 1oa3 n VAL 36 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1oa3 s SER 37 N -6.57 -0.47 -0.19 4.52 0.15 -0.94 -5.01 113.70 105.19 1oa3 s SER 37 Ca -0.28 0.83 0.13 0.00 0.70 0.00 0.00 55.95 57.33 1oa3 s SER 37 Cb 0.07 0.72 0.41 0.00 -1.71 0.00 0.00 66.02 65.51 1oa3 s SER 37 CO 0.45 -0.18 1.21 0.18 1.20 0.00 0.00 173.24 176.09 1oa3 n LEU 38 N 4.08 2.54 -4.36 3.45 7.99 -1.26 -0.88 117.00 128.55 1oa3 n LEU 38 Ca -0.22 -3.69 -0.40 0.00 -0.01 0.00 0.00 56.01 51.68 1oa3 n LEU 38 Cb 0.55 -0.48 -0.11 0.00 -0.11 0.00 0.00 43.42 43.27 1oa3 n LEU 38 CO 0.10 1.29 -0.16 0.54 -1.51 0.00 0.00 177.39 177.64 1oa3 s ASN 39 N -3.11 5.71 0.00 -1.43 4.22 -1.26 -4.03 114.94 115.04 1oa3 s ASN 39 Ca 0.37 -1.04 0.00 0.00 -2.14 0.00 0.00 52.86 50.05 1oa3 s ASN 39 Cb 0.36 -2.01 0.00 0.00 1.28 0.00 0.00 41.25 40.88 1oa3 s ASN 39 CO -0.07 -0.39 0.00 0.61 -2.04 0.00 0.00 177.10 175.21 1oa3 n GLY 40 N 4.98 2.09 3.77 0.45 0.00 -1.26 -4.84 105.19 110.37 1oa3 n GLY 40 Ca -0.12 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.25 1oa3 n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa3 s ALA 41 N -0.82 3.63 -0.12 4.61 0.00 -1.26 -4.93 121.76 122.88 1oa3 s ALA 41 Ca 0.00 -1.89 -0.04 0.00 0.00 0.00 0.00 51.96 50.03 1oa3 s ALA 41 Cb 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 1oa3 s ALA 41 CO 0.00 -0.06 0.03 0.00 0.00 0.00 0.00 175.76 175.73 1oa3 s ALA 42 N -2.47 3.37 -0.08 0.00 0.00 0.23 -4.34 121.76 118.47 1oa3 s ALA 42 Ca 0.40 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.62 1oa3 s ALA 42 Cb -0.01 -1.66 0.01 0.00 0.00 0.00 0.00 23.12 21.46 1oa3 s ALA 42 CO 0.24 0.46 -0.15 0.45 0.00 0.00 0.00 175.76 176.76 1oa3 s SER 43 N -0.49 2.18 0.06 0.00 0.15 -0.06 -0.71 113.70 114.82 1oa3 s SER 43 Ca 0.09 -0.38 -0.27 0.00 0.70 0.00 0.00 55.95 56.09 1oa3 s SER 43 Cb -0.12 -1.00 0.09 0.00 -1.71 0.00 0.00 66.02 63.28 1oa3 s SER 43 CO 0.02 0.05 0.98 -1.66 1.20 0.00 0.00 173.24 173.83 1oa3 s TRP 44 N 0.67 -0.20 0.03 3.44 1.48 -0.85 -1.26 118.94 122.25 1oa3 s TRP 44 Ca -0.14 -0.01 -0.03 0.00 -1.06 0.00 0.00 56.10 54.86 1oa3 s TRP 44 Cb -0.16 0.59 -0.02 0.00 -1.16 0.00 0.00 33.47 32.72 1oa3 s TRP 44 CO 0.04 -0.64 0.04 -3.38 -4.06 0.00 0.00 176.95 168.95 1oa3 s HIS 45 N -3.10 0.25 -0.10 1.66 -3.43 -0.42 -0.73 115.29 109.42 1oa3 s HIS 45 Ca 0.10 -0.56 0.03 0.00 -0.80 0.00 0.00 55.06 53.82 1oa3 s HIS 45 Cb -0.01 -0.19 -0.01 0.00 -1.43 0.00 0.00 32.58 30.95 1oa3 s HIS 45 CO -0.03 -0.31 -0.18 0.00 -2.00 0.00 0.00 174.74 172.22 1oa3 s ALA 46 N -2.34 2.42 -0.01 -1.38 0.00 0.05 -1.10 121.76 119.40 1oa3 s ALA 46 Ca -0.07 -0.95 0.06 0.00 0.00 0.00 0.00 51.96 51.00 1oa3 s ALA 46 Cb -0.03 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1oa3 s ALA 46 CO -0.04 0.33 -0.20 -0.51 0.00 0.00 0.00 175.76 175.34 1oa3 s ASP 47 N 0.11 2.37 0.18 0.00 1.11 0.22 -0.29 116.67 120.36 1oa3 s ASP 47 Ca -0.09 -0.38 -0.24 0.00 0.18 0.00 0.00 52.55 52.03 1oa3 s ASP 47 Cb -0.15 -0.26 0.05 0.00 1.07 0.00 0.00 42.92 43.63 1oa3 s ASP 47 CO 0.05 0.24 0.78 -1.66 1.18 0.00 0.00 175.17 175.77 1oa3 s TRP 48 N -0.51 -0.27 -0.19 4.23 1.48 -0.06 -0.16 118.94 123.47 1oa3 s TRP 48 Ca 0.08 -0.05 -0.08 0.00 -1.06 0.00 0.00 56.10 54.98 1oa3 s TRP 48 Cb -0.08 0.63 0.07 0.00 -1.16 0.00 0.00 33.47 32.94 1oa3 s TRP 48 CO -0.01 -0.95 0.42 -1.14 -4.06 0.00 0.00 176.95 171.22 1oa3 s GLN 49 N -3.60 0.36 -0.03 3.25 0.74 -0.74 -1.33 119.66 118.31 1oa3 s GLN 49 Ca 0.08 0.92 -0.03 0.00 0.05 0.00 0.00 55.36 56.38 1oa3 s GLN 49 Cb -0.03 0.15 0.01 0.00 1.10 0.00 0.00 33.01 34.24 1oa3 s GLN 49 CO -0.01 -0.20 0.08 -1.58 -0.55 0.00 0.00 175.29 173.03 1oa3 s TRP 50 N 2.00 -0.09 0.08 1.67 0.52 -0.21 -1.11 118.94 121.80 1oa3 s TRP 50 Ca -0.06 0.22 0.03 0.00 0.02 0.00 0.00 56.10 56.31 1oa3 s TRP 50 Cb -0.10 0.03 -0.03 0.00 -1.15 0.00 0.00 33.47 32.21 1oa3 s TRP 50 CO -0.13 -0.05 -0.08 -1.54 0.02 0.00 0.00 176.95 175.17 1oa3 s SER 51 N 0.03 1.17 0.00 2.95 1.04 -0.40 -1.19 113.70 117.30 1oa3 s SER 51 Ca -0.00 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1oa3 s SER 51 Cb -0.01 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1oa3 s SER 51 CO 0.00 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.51 1oa3 n GLY 52 N 0.58 -1.27 3.72 7.32 0.00 -1.26 -1.18 105.19 113.09 1oa3 n GLY 52 Ca -0.16 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 43.99 1oa3 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa3 n GLY 53 N -1.44 -0.65 0.33 -0.02 0.00 -1.16 -4.67 105.19 97.58 1oa3 n GLY 53 Ca 0.00 0.31 0.22 0.00 0.00 0.00 0.00 46.02 46.55 1oa3 n GLY 53 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1oa3 h GLN 54 N -1.82 0.16 -0.27 1.61 5.75 -1.90 -0.21 115.11 118.43 1oa3 h GLN 54 Ca -0.64 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 57.85 1oa3 h GLN 54 Cb 1.36 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.87 1oa3 h GLN 54 CO 0.53 0.10 0.00 0.09 -2.65 0.00 0.00 178.83 176.91 1oa3 n ASN 55 N -5.22 3.85 -4.38 -0.69 3.02 -1.26 -4.74 115.26 105.85 1oa3 n ASN 55 Ca 0.30 -2.95 -0.34 0.00 -0.03 0.00 0.00 54.58 51.56 1oa3 n ASN 55 Cb 0.96 -0.53 -0.14 0.00 -0.61 0.00 0.00 39.78 39.47 1oa3 n ASN 55 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1oa3 s ASN 56 N -1.86 4.36 0.22 6.41 0.02 -0.09 -5.09 114.94 118.92 1oa3 s ASN 56 Ca 0.41 -0.31 -0.30 0.00 -1.02 0.00 0.00 52.86 51.64 1oa3 s ASN 56 Cb 0.33 -1.72 -0.10 0.00 0.02 0.00 0.00 41.25 39.78 1oa3 s ASN 56 CO 0.09 0.08 1.48 -0.69 0.02 0.00 0.00 177.10 178.08 1oa3 s VAL 57 N 0.90 2.64 -0.19 1.60 1.01 -1.26 -4.64 120.40 120.47 1oa3 s VAL 57 Ca -0.01 0.52 0.21 0.00 0.00 0.00 0.00 61.98 62.70 1oa3 s VAL 57 Cb -0.15 -3.33 -0.07 0.00 0.00 0.00 0.00 36.38 32.83 1oa3 s VAL 57 CO 0.01 0.07 0.92 0.29 0.00 0.00 0.00 175.10 176.38 1oa3 n LYS 58 N 2.81 0.62 -3.63 2.72 4.76 -0.48 -4.44 118.16 120.51 1oa3 n LYS 58 Ca 0.09 0.10 0.01 0.00 -2.87 0.00 0.00 58.31 55.63 1oa3 n LYS 58 Cb 0.40 -1.78 -0.01 0.00 -1.84 0.00 0.00 35.03 31.80 1oa3 n LYS 58 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1oa3 s SER 59 N -5.32 -0.07 -0.41 4.39 1.04 -1.26 -0.32 113.70 111.74 1oa3 s SER 59 Ca -0.02 -0.16 0.05 0.00 0.48 0.00 0.00 55.95 56.30 1oa3 s SER 59 Cb 0.10 0.19 0.18 0.00 0.10 0.00 0.00 66.02 66.59 1oa3 s SER 59 CO 0.81 -0.35 0.38 0.00 0.98 0.00 0.00 173.24 175.06 1oa3 n TYR 60 N -0.49 -0.73 -1.93 5.02 9.36 -0.52 -4.10 117.16 123.77 1oa3 n TYR 60 Ca -0.08 -3.37 -0.42 0.00 3.32 0.00 0.00 57.90 57.34 1oa3 n TYR 60 Cb 0.63 0.14 -0.03 0.00 -0.63 0.00 0.00 39.34 39.45 1oa3 n TYR 60 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 1oa3 s GLN 61 N -0.20 4.21 0.19 2.98 -0.21 -1.20 -4.58 119.66 120.85 1oa3 s GLN 61 Ca 0.33 2.36 -0.21 0.00 0.02 0.00 0.00 55.36 57.86 1oa3 s GLN 61 Cb 0.06 -3.30 0.05 0.00 1.00 0.00 0.00 33.01 30.82 1oa3 s GLN 61 CO -0.18 -0.65 0.60 0.54 -2.12 0.00 0.00 175.29 173.47 1oa3 s ASN 62 N 1.58 -0.43 0.00 5.90 4.22 -0.46 -1.99 114.94 123.75 1oa3 s ASN 62 Ca 0.72 -0.23 0.02 0.00 -2.14 0.00 0.00 52.86 51.22 1oa3 s ASN 62 Cb -0.43 0.61 -0.04 0.00 1.28 0.00 0.00 41.25 42.68 1oa3 s ASN 62 CO 0.32 -1.06 -0.03 0.54 -2.04 0.00 0.00 177.10 174.83 1oa3 s VAL 63 N -3.81 3.95 0.14 3.54 0.11 0.23 -0.31 120.40 124.25 1oa3 s VAL 63 Ca 0.05 -0.68 -0.08 0.00 -2.93 0.00 0.00 61.98 58.35 1oa3 s VAL 63 Cb -0.02 -2.74 -0.01 0.00 -1.53 0.00 0.00 36.38 32.08 1oa3 s VAL 63 CO -0.07 0.38 0.22 0.00 -3.33 0.00 0.00 175.10 172.31 1oa3 s GLN 64 N -1.50 1.04 0.16 1.54 -2.07 -0.32 -0.46 119.66 118.05 1oa3 s GLN 64 Ca 0.18 -1.17 0.00 0.00 -1.82 0.00 0.00 55.36 52.56 1oa3 s GLN 64 Cb -0.11 0.35 -0.04 0.00 -1.09 0.00 0.00 33.01 32.11 1oa3 s GLN 64 CO 0.09 -0.36 0.33 0.96 -1.32 0.00 0.00 175.29 175.00 1oa3 s ILE 65 N -3.96 5.26 0.20 3.63 -4.36 -1.05 -1.33 121.20 119.59 1oa3 s ILE 65 Ca 0.15 -0.44 -0.30 0.00 -0.26 0.00 0.00 60.65 59.80 1oa3 s ILE 65 Cb 0.04 -3.72 -0.08 0.00 1.25 0.00 0.00 42.46 39.96 1oa3 s ILE 65 CO -0.02 -0.10 1.10 0.20 0.24 0.00 0.00 174.94 176.36 1oa3 s ASN 66 N -3.06 7.28 -0.49 4.36 0.01 -0.52 -4.66 114.94 117.86 1oa3 s ASN 66 Ca 0.37 2.13 0.08 0.00 -0.71 0.00 0.00 52.86 54.72 1oa3 s ASN 66 Cb -0.11 -2.61 0.27 0.00 0.41 0.00 0.00 41.25 39.21 1oa3 s ASN 66 CO 0.28 -0.19 0.67 -0.38 -1.51 0.00 0.00 177.10 175.97 1oa3 n ILE 67 N 2.09 0.78 -0.34 0.60 5.41 -1.26 -4.98 119.36 121.66 1oa3 n ILE 67 Ca 0.02 -4.66 0.09 0.00 1.00 0.00 0.00 62.75 59.20 1oa3 n ILE 67 Cb 0.46 -1.70 0.25 0.00 -0.71 0.00 0.00 39.64 37.95 1oa3 n ILE 67 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1oa3 h PRO 68 N 3.80 0.80 -4.86 0.38 0.11 -1.98 -3.38 132.00 126.87 1oa3 h PRO 68 Ca 0.12 -0.05 -0.68 0.00 0.11 0.00 0.00 66.00 65.51 1oa3 h PRO 68 Cb 0.78 -0.18 -0.34 0.00 0.11 0.00 0.00 31.00 31.37 1oa3 h PRO 68 CO 0.63 0.53 -0.76 -0.65 -0.21 0.00 0.00 178.00 177.54 1oa3 s GLN 69 N -5.94 2.52 0.26 1.05 -1.52 -1.26 -5.10 119.66 109.67 1oa3 s GLN 69 Ca -0.12 -1.18 -0.29 0.00 -1.95 0.00 0.00 55.36 51.82 1oa3 s GLN 69 Cb 0.23 -2.99 -0.09 0.00 -0.22 0.00 0.00 33.01 29.93 1oa3 s GLN 69 CO 0.80 -0.52 0.96 0.15 -0.25 0.00 0.00 175.29 176.43 1oa3 s LYS 70 N 1.23 4.77 0.06 2.91 -0.14 -1.26 -5.05 119.74 122.25 1oa3 s LYS 70 Ca -0.04 1.48 0.03 0.00 -1.36 0.00 0.00 55.97 56.08 1oa3 s LYS 70 Cb -0.19 -3.16 -0.03 0.00 -1.68 0.00 0.00 37.83 32.78 1oa3 s LYS 70 CO -0.04 0.43 -0.10 1.03 -0.76 0.00 0.00 175.35 175.91 1oa3 s ARG 71 N -1.41 0.68 0.51 1.68 0.52 -1.26 -4.99 118.95 114.68 1oa3 s ARG 71 Ca 0.43 -0.91 -0.21 0.00 -0.52 0.00 0.00 55.73 54.53 1oa3 s ARG 71 Cb -0.25 -0.48 -0.06 0.00 0.52 0.00 0.00 34.95 34.68 1oa3 s ARG 71 CO 0.31 0.09 1.16 0.95 0.02 0.00 0.00 175.30 177.83 1oa3 s THR 72 N -1.62 3.06 0.16 0.02 -4.23 -1.26 -1.78 115.64 109.98 1oa3 s THR 72 Ca -0.04 0.72 -0.17 0.00 -1.18 0.00 0.00 61.69 61.01 1oa3 s THR 72 Cb -0.08 -3.33 0.08 0.00 1.34 0.00 0.00 72.50 70.51 1oa3 s THR 72 CO 0.01 -0.08 1.67 0.58 -0.54 0.00 0.00 174.62 176.25 1oa3 h VAL 73 N 1.47 0.62 0.00 2.29 2.07 -0.92 -1.53 116.25 120.25 1oa3 h VAL 73 Ca -0.50 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1oa3 h VAL 73 Cb 1.26 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1oa3 h VAL 73 CO 0.58 0.00 -0.11 0.78 0.02 0.00 0.00 177.57 178.84 1oa3 h ASN 74 N -0.01 0.00 1.07 0.57 2.35 -1.75 -2.41 115.58 115.41 1oa3 h ASN 74 Ca 0.18 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.84 1oa3 h ASN 74 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1oa3 h ASN 74 CO -0.39 0.11 -0.41 0.77 -1.65 0.00 0.00 177.43 175.86 1oa3 h SER 75 N 0.00 0.00 -3.22 5.81 4.64 -1.59 -3.44 113.55 115.75 1oa3 h SER 75 Ca -0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1oa3 h SER 75 Cb 0.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1oa3 h SER 75 CO 0.01 0.41 0.55 -0.63 -0.87 0.00 0.00 176.83 176.31 1oa3 s ILE 76 N -3.38 4.36 0.10 0.95 1.01 -0.91 -4.95 121.20 118.37 1oa3 s ILE 76 Ca 0.01 1.69 -0.08 0.00 0.00 0.00 0.00 60.65 62.27 1oa3 s ILE 76 Cb 0.10 -4.08 -0.22 0.00 0.01 0.00 0.00 42.46 38.26 1oa3 s ILE 76 CO 0.70 0.09 1.23 1.23 0.00 0.00 0.00 174.94 178.19 1oa3 h GLY 77 N 7.26 0.54 -3.76 6.18 0.00 -1.17 -3.48 103.07 108.64 1oa3 h GLY 77 Ca -0.39 -1.03 -0.05 0.00 0.00 0.00 0.00 47.33 45.86 1oa3 h GLY 77 CO 0.82 0.91 0.16 -1.35 0.00 0.00 0.00 176.54 177.08 1oa3 s SER 78 N -7.19 -0.60 -0.45 0.19 1.04 -1.09 -5.02 113.70 100.57 1oa3 s SER 78 Ca -0.07 0.48 0.09 0.00 0.48 0.00 0.00 55.95 56.93 1oa3 s SER 78 Cb 0.08 0.54 0.31 0.00 0.10 0.00 0.00 66.02 67.05 1oa3 s SER 78 CO 0.89 -0.69 0.72 0.23 0.98 0.00 0.00 173.24 175.37 1oa3 n MET 79 N 0.59 1.56 -2.24 4.02 0.00 -1.26 -1.57 117.12 118.22 1oa3 n MET 79 Ca -0.19 -3.80 -0.35 0.00 0.00 0.00 0.00 57.70 53.36 1oa3 n MET 79 Cb 0.59 -1.76 0.00 0.00 0.00 0.00 0.00 33.22 32.06 1oa3 n MET 79 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1oa3 s PRO 80 N -2.33 3.36 -0.04 0.03 0.04 -1.21 -1.36 135.00 133.49 1oa3 s PRO 80 Ca 0.41 1.65 -0.23 0.00 0.04 0.00 0.00 61.00 62.86 1oa3 s PRO 80 Cb 0.26 -2.03 0.05 0.00 0.04 0.00 0.00 34.50 32.82 1oa3 s PRO 80 CO -0.09 -0.85 0.49 -0.08 0.04 0.00 0.00 177.00 176.51 1oa3 s THR 81 N -1.74 0.03 0.06 1.26 -1.32 -0.17 -2.04 115.64 111.72 1oa3 s THR 81 Ca 0.72 -0.23 0.04 0.00 -1.21 0.00 0.00 61.69 61.01 1oa3 s THR 81 Cb -0.25 -0.80 -0.03 0.00 -1.51 0.00 0.00 72.50 69.91 1oa3 s THR 81 CO 0.28 -0.13 -0.12 0.42 -2.21 0.00 0.00 174.62 172.87 1oa3 s THR 82 N -1.21 0.88 -0.10 5.08 -4.23 -0.62 -1.52 115.64 113.92 1oa3 s THR 82 Ca -0.12 -1.21 -0.08 0.00 -1.18 0.00 0.00 61.69 59.10 1oa3 s THR 82 Cb -0.03 -0.88 0.03 0.00 1.34 0.00 0.00 72.50 72.96 1oa3 s THR 82 CO 0.07 -0.28 0.25 0.00 -0.54 0.00 0.00 174.62 174.11 1oa3 s ALA 83 N -1.31 -0.60 -0.14 3.99 0.00 -0.05 -1.63 121.76 122.02 1oa3 s ALA 83 Ca -0.05 0.77 -0.01 0.00 0.00 0.00 0.00 51.96 52.66 1oa3 s ALA 83 Cb -0.10 -0.46 0.04 0.00 0.00 0.00 0.00 23.12 22.60 1oa3 s ALA 83 CO 0.02 -0.14 -0.01 -1.12 0.00 0.00 0.00 175.76 174.51 1oa3 s SER 84 N 0.39 2.35 0.11 0.00 0.01 0.20 -0.72 113.70 116.05 1oa3 s SER 84 Ca -0.02 -0.47 -0.10 0.00 1.31 0.00 0.00 55.95 56.66 1oa3 s SER 84 Cb -0.04 -0.64 0.00 0.00 0.21 0.00 0.00 66.02 65.56 1oa3 s SER 84 CO -0.02 -0.22 0.25 -1.66 0.41 0.00 0.00 173.24 172.01 1oa3 s TRP 85 N 1.83 0.13 -0.12 2.43 1.48 -0.65 -0.33 118.94 123.70 1oa3 s TRP 85 Ca 0.02 -0.53 -0.18 0.00 -1.06 0.00 0.00 56.10 54.35 1oa3 s TRP 85 Cb -0.14 0.01 0.04 0.00 -1.16 0.00 0.00 33.47 32.22 1oa3 s TRP 85 CO -0.07 -0.61 0.47 -1.54 -4.06 0.00 0.00 176.95 171.14 1oa3 s SER 86 N -2.87 -0.45 0.08 -2.66 1.04 -0.45 -4.69 113.70 103.70 1oa3 s SER 86 Ca 0.07 0.73 0.01 0.00 0.48 0.00 0.00 55.95 57.24 1oa3 s SER 86 Cb 0.04 0.77 -0.04 0.00 0.10 0.00 0.00 66.02 66.89 1oa3 s SER 86 CO -0.09 -0.29 0.21 -0.31 0.98 0.00 0.00 173.24 173.74 1oa3 s TYR 87 N -0.30 3.47 0.01 5.02 2.02 -1.26 -0.99 117.35 125.31 1oa3 s TYR 87 Ca -0.05 0.20 0.00 0.00 -0.37 0.00 0.00 57.07 56.85 1oa3 s TYR 87 Cb -0.03 -1.72 -0.01 0.00 -0.40 0.00 0.00 41.96 39.79 1oa3 s TYR 87 CO 0.03 0.57 -0.02 0.45 -1.57 0.00 0.00 175.55 175.00 1oa3 s SER 88 N -2.66 0.21 0.00 2.29 0.15 -0.65 -5.00 113.70 108.05 1oa3 s SER 88 Ca 0.34 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.67 1oa3 s SER 88 Cb -0.12 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.24 1oa3 s SER 88 CO 0.27 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.14 1oa3 n GLY 89 N 2.12 -0.69 2.97 9.45 0.00 -1.26 -0.63 105.19 117.15 1oa3 n GLY 89 Ca -0.20 -1.31 -0.20 0.00 0.00 0.00 0.00 46.02 44.31 1oa3 n GLY 89 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oa3 s SER 90 N -4.00 1.13 -1.58 1.61 0.01 0.49 -4.82 113.70 106.54 1oa3 s SER 90 Ca 0.00 -0.17 -0.13 0.00 1.31 0.00 0.00 55.95 56.96 1oa3 s SER 90 Cb 0.00 -0.37 0.10 0.00 0.21 0.00 0.00 66.02 65.96 1oa3 s SER 90 CO 0.00 0.04 0.75 0.47 0.41 0.00 0.00 173.24 174.90 1oa3 n ASP 91 N 3.47 -2.90 -4.67 2.44 8.00 -1.26 -1.52 116.55 120.10 1oa3 n ASP 91 Ca -0.20 -0.95 -0.42 0.00 0.71 0.00 0.00 54.79 53.93 1oa3 n ASP 91 Cb 0.54 -3.14 -0.03 0.00 -0.02 0.00 0.00 41.12 38.47 1oa3 n ASP 91 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1oa3 s ILE 92 N -3.46 3.65 -0.45 0.53 1.01 -1.26 -4.03 121.20 117.19 1oa3 s ILE 92 Ca 0.53 0.93 0.04 0.00 0.00 0.00 0.00 60.65 62.14 1oa3 s ILE 92 Cb -0.28 -3.60 0.12 0.00 0.01 0.00 0.00 42.46 38.71 1oa3 s ILE 92 CO 0.89 -0.04 0.19 -0.13 0.00 0.00 0.00 174.94 175.84 1oa3 s ARG 93 N 3.22 1.68 0.15 2.79 0.52 -0.57 -2.99 118.95 123.74 1oa3 s ARG 93 Ca 0.68 -2.25 -0.24 0.00 -0.52 0.00 0.00 55.73 53.40 1oa3 s ARG 93 Cb -0.32 -3.09 0.07 0.00 0.52 0.00 0.00 34.95 32.12 1oa3 s ARG 93 CO 0.27 -1.06 0.71 0.00 0.02 0.00 0.00 175.30 175.23 1oa3 s ALA 94 N 0.24 -1.58 0.48 2.13 0.00 -0.64 -0.64 121.76 121.75 1oa3 s ALA 94 Ca 0.15 0.42 0.05 0.00 0.00 0.00 0.00 51.96 52.58 1oa3 s ALA 94 Cb -0.23 0.77 -0.02 0.00 0.00 0.00 0.00 23.12 23.64 1oa3 s ALA 94 CO -0.04 -0.82 0.17 0.54 0.00 0.00 0.00 175.76 175.61 1oa3 s ASN 95 N -2.74 4.33 -0.15 0.00 2.20 -0.53 -0.75 114.94 117.30 1oa3 s ASN 95 Ca 0.04 -1.34 -0.01 0.00 -0.94 0.00 0.00 52.86 50.61 1oa3 s ASN 95 Cb -0.02 0.09 0.04 0.00 -2.00 0.00 0.00 41.25 39.37 1oa3 s ASN 95 CO -0.07 -0.79 -0.03 -0.69 -2.94 0.00 0.00 177.10 172.58 1oa3 s VAL 96 N -2.75 0.87 -0.08 3.54 1.01 -0.41 -3.52 120.40 119.05 1oa3 s VAL 96 Ca 0.27 -0.45 -0.17 0.00 0.00 0.00 0.00 61.98 61.62 1oa3 s VAL 96 Cb 0.02 -1.09 0.04 0.00 0.00 0.00 0.00 36.38 35.35 1oa3 s VAL 96 CO 0.15 0.11 0.42 0.00 0.00 0.00 0.00 175.10 175.78 1oa3 s ALA 97 N 1.74 -1.05 0.44 5.51 0.00 0.18 -0.85 121.76 127.73 1oa3 s ALA 97 Ca 0.02 0.85 -0.22 0.00 0.00 0.00 0.00 51.96 52.61 1oa3 s ALA 97 Cb -0.15 -0.27 -0.09 0.00 0.00 0.00 0.00 23.12 22.61 1oa3 s ALA 97 CO -0.07 -0.25 1.01 0.71 0.00 0.00 0.00 175.76 177.15 1oa3 s TYR 98 N -0.64 3.20 -0.02 0.00 1.51 0.09 -1.44 117.35 120.04 1oa3 s TYR 98 Ca -0.07 1.62 -0.00 0.00 -1.01 0.00 0.00 57.07 57.60 1oa3 s TYR 98 Cb -0.04 -3.01 0.03 0.00 -0.11 0.00 0.00 41.96 38.84 1oa3 s TYR 98 CO 0.03 -0.50 0.04 0.34 -1.11 0.00 0.00 175.55 174.35 1oa3 s ASP 99 N -1.91 0.11 -0.01 2.29 2.15 -0.27 -1.92 116.67 117.10 1oa3 s ASP 99 Ca 0.62 0.05 -0.00 0.00 0.43 0.00 0.00 52.55 53.65 1oa3 s ASP 99 Cb -0.16 -0.06 0.02 0.00 -0.30 0.00 0.00 42.92 42.42 1oa3 s ASP 99 CO 0.20 -0.14 0.02 -0.76 -0.17 0.00 0.00 175.17 174.32 1oa3 s LEU 100 N 1.13 1.40 -0.06 -1.34 1.02 -0.36 -1.16 118.68 119.32 1oa3 s LEU 100 Ca -0.08 0.03 -0.02 0.00 0.02 0.00 0.00 54.13 54.08 1oa3 s LEU 100 Cb -0.13 -0.04 -0.04 0.00 0.02 0.00 0.00 46.19 46.00 1oa3 s LEU 100 CO -0.03 -0.08 0.03 -0.36 0.02 0.00 0.00 176.35 175.93 1oa3 s PHE 101 N 0.69 3.22 0.10 0.29 0.08 -1.25 -0.63 117.98 120.49 1oa3 s PHE 101 Ca -0.06 0.22 0.05 0.00 0.12 0.00 0.00 56.93 57.26 1oa3 s PHE 101 Cb -0.08 -1.78 -0.03 0.00 -0.57 0.00 0.00 43.02 40.56 1oa3 s PHE 101 CO -0.02 0.52 -0.12 0.95 -0.10 0.00 0.00 175.22 176.45 1oa3 s THR 102 N -1.00 1.10 0.05 0.64 -4.23 -0.52 -0.55 115.64 111.13 1oa3 s THR 102 Ca 0.16 -1.60 -0.14 0.00 -1.18 0.00 0.00 61.69 58.93 1oa3 s THR 102 Cb -0.12 -1.35 0.02 0.00 1.34 0.00 0.00 72.50 72.39 1oa3 s THR 102 CO 0.06 -0.45 0.32 0.00 -0.54 0.00 0.00 174.62 174.02 1oa3 s ALA 103 N -2.11 -0.74 0.17 3.99 0.00 -0.86 -0.67 121.76 121.55 1oa3 s ALA 103 Ca 0.05 0.03 0.19 0.00 0.00 0.00 0.00 51.96 52.23 1oa3 s ALA 103 Cb -0.05 0.36 0.73 0.00 0.00 0.00 0.00 23.12 24.16 1oa3 s ALA 103 CO 0.02 -0.44 1.76 0.00 0.00 0.00 0.00 175.76 177.09 1oa3 h ALA 104 N 3.10 1.02 -2.42 0.00 0.00 -1.89 0.23 119.26 119.29 1oa3 h ALA 104 Ca -0.32 -0.32 -0.64 0.00 0.00 0.00 0.00 54.91 53.63 1oa3 h ALA 104 Cb 1.20 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.79 1oa3 h ALA 104 CO 0.46 0.44 -0.03 1.21 0.00 0.00 0.00 179.25 181.33 1oa3 s ASN 105 N -6.41 6.33 0.35 0.00 3.84 -1.26 -4.77 114.94 113.02 1oa3 s ASN 105 Ca -0.00 -0.02 0.26 0.00 0.21 0.00 0.00 52.86 53.31 1oa3 s ASN 105 Cb 0.11 -2.28 1.22 0.00 -0.55 0.00 0.00 41.25 39.75 1oa3 s ASN 105 CO 0.68 -0.50 1.79 1.55 -2.79 0.00 0.00 177.10 177.83 1oa3 h PRO 106 N 8.47 0.00 -0.69 0.43 0.13 -1.96 -2.04 132.00 136.34 1oa3 h PRO 106 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1oa3 h PRO 106 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1oa3 h PRO 106 CO 0.78 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.64 1oa3 n ASN 107 N -2.43 3.87 -4.70 1.44 3.02 -1.26 -4.86 115.26 110.35 1oa3 n ASN 107 Ca 0.00 -2.00 -0.38 0.00 -0.03 0.00 0.00 54.58 52.18 1oa3 n ASN 107 Cb 0.16 -0.46 0.06 0.00 -0.61 0.00 0.00 39.78 38.94 1oa3 n ASN 107 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1oa3 n HIS 108 N 1.59 1.68 -1.69 3.10 -0.00 -0.77 -4.93 115.22 114.20 1oa3 n HIS 108 Ca 0.23 0.43 -0.39 0.00 0.46 0.00 0.00 57.72 58.46 1oa3 n HIS 108 Cb 0.61 -2.25 0.04 0.00 -0.12 0.00 0.00 29.99 28.28 1oa3 n HIS 108 CO 0.00 0.00 0.00 1.33 0.46 0.00 0.00 176.34 178.13 1oa3 n VAL 109 N -1.70 3.64 1.28 3.57 0.24 -1.26 -4.89 118.33 119.21 1oa3 n VAL 109 Ca 0.14 -0.50 0.08 0.00 -2.04 0.00 0.00 64.34 62.03 1oa3 n VAL 109 Cb 0.47 -1.45 0.31 0.00 -1.47 0.00 0.00 33.84 31.71 1oa3 n VAL 109 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1oa3 n THR 110 N -1.18 0.24 -0.60 3.34 -2.24 -1.26 -3.81 114.28 108.78 1oa3 n THR 110 Ca 0.11 -0.32 0.07 0.00 -2.27 0.00 0.00 64.05 61.65 1oa3 n THR 110 Cb 0.45 0.23 0.23 0.00 -2.10 0.00 0.00 70.33 69.13 1oa3 n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oa3 n TYR 111 N 0.19 0.82 -3.88 4.78 0.18 -1.26 -4.66 117.16 113.33 1oa3 n TYR 111 Ca 0.14 -0.68 -0.04 0.00 1.88 0.00 0.00 57.90 59.19 1oa3 n TYR 111 Cb 0.27 -0.19 0.02 0.00 -0.38 0.00 0.00 39.34 39.06 1oa3 n TYR 111 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1oa3 s SER 112 N -1.39 0.02 0.00 9.48 1.04 -1.25 -5.11 113.70 116.49 1oa3 s SER 112 Ca 0.35 -0.80 -0.00 0.00 0.48 0.00 0.00 55.95 55.98 1oa3 s SER 112 Cb 0.25 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.94 1oa3 s SER 112 CO 0.14 -1.15 0.02 0.61 0.98 0.00 0.00 173.24 173.84 1oa3 n GLY 113 N -0.68 0.71 0.14 7.32 0.00 -1.26 -4.74 105.19 106.66 1oa3 n GLY 113 Ca -0.04 -0.85 -0.06 0.00 0.00 0.00 0.00 46.02 45.08 1oa3 n GLY 113 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1oa3 h ASP 114 N 0.03 0.19 -4.82 1.61 3.32 -1.24 -3.41 116.42 112.10 1oa3 h ASP 114 Ca -0.00 -0.13 -0.24 0.00 0.02 0.00 0.00 57.03 56.67 1oa3 h ASP 114 Cb 0.02 -0.06 -0.21 0.00 0.22 0.00 0.00 39.33 39.30 1oa3 h ASP 114 CO 0.00 0.86 -0.72 -0.31 -1.72 0.00 0.00 179.24 177.35 1oa3 s TYR 115 N -3.45 0.58 -0.08 4.55 1.51 -0.78 -1.50 117.35 118.18 1oa3 s TYR 115 Ca -0.03 -0.54 0.02 0.00 -1.01 0.00 0.00 57.07 55.51 1oa3 s TYR 115 Cb 0.11 -0.36 0.01 0.00 -0.11 0.00 0.00 41.96 41.62 1oa3 s TYR 115 CO 0.80 -0.12 -0.13 -2.00 -1.11 0.00 0.00 175.55 172.99 1oa3 s GLU 116 N -1.72 1.88 -0.20 -0.62 2.12 0.23 -1.44 118.70 118.95 1oa3 s GLU 116 Ca -0.10 -0.46 -0.05 0.00 0.36 0.00 0.00 54.97 54.72 1oa3 s GLU 116 Cb -0.09 -1.59 -0.03 0.00 0.26 0.00 0.00 34.13 32.69 1oa3 s GLU 116 CO -0.00 -0.02 0.01 -1.17 -0.54 0.00 0.00 175.26 173.53 1oa3 s LEU 117 N 0.84 3.31 0.03 2.70 2.96 0.20 -1.08 118.68 127.63 1oa3 s LEU 117 Ca -0.11 -0.18 0.08 0.00 -0.22 0.00 0.00 54.13 53.71 1oa3 s LEU 117 Cb -0.15 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 1oa3 s LEU 117 CO 0.01 0.07 -0.25 -0.04 -1.32 0.00 0.00 176.35 174.83 1oa3 s MET 118 N 0.96 1.74 -0.25 1.98 -1.94 0.37 -1.23 119.30 120.94 1oa3 s MET 118 Ca 0.02 -1.01 -0.00 0.00 -1.71 0.00 0.00 55.69 52.98 1oa3 s MET 118 Cb -0.14 -1.85 0.07 0.00 2.01 0.00 0.00 34.83 34.92 1oa3 s MET 118 CO 0.02 0.48 0.02 0.42 -0.01 0.00 0.00 175.02 175.96 1oa3 s ILE 119 N -0.75 1.13 -0.58 2.53 1.01 -0.81 -0.60 121.20 123.14 1oa3 s ILE 119 Ca 0.10 -1.18 -0.23 0.00 0.00 0.00 0.00 60.65 59.34 1oa3 s ILE 119 Cb -0.10 -1.62 0.05 0.00 0.01 0.00 0.00 42.46 40.80 1oa3 s ILE 119 CO 0.01 -0.33 0.88 0.26 0.00 0.00 0.00 174.94 175.76 1oa3 s TRP 120 N 1.54 2.81 0.03 3.97 0.52 0.41 -0.73 118.94 127.50 1oa3 s TRP 120 Ca 0.01 -0.30 0.12 0.00 0.02 0.00 0.00 56.10 55.96 1oa3 s TRP 120 Cb -0.18 -4.04 0.10 0.00 -1.15 0.00 0.00 33.47 28.20 1oa3 s TRP 120 CO -0.12 -1.38 1.45 -0.07 0.02 0.00 0.00 176.95 176.85 1oa3 h LEU 121 N 10.83 0.00 -8.35 2.99 3.38 -1.29 -1.68 115.31 121.20 1oa3 h LEU 121 Ca -0.27 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.44 1oa3 h LEU 121 Cb 1.08 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.65 1oa3 h LEU 121 CO 1.09 0.67 -0.71 -0.83 0.09 0.00 0.00 178.44 178.75 1oa3 s GLY 122 N -4.53 0.69 -0.29 0.83 0.00 -0.75 -0.22 107.32 103.05 1oa3 s GLY 122 Ca 0.02 -1.13 -0.13 0.00 0.00 0.00 0.00 44.72 43.49 1oa3 s GLY 122 CO 0.76 -1.21 0.74 1.25 0.00 0.00 0.00 173.10 174.64 1oa3 s LYS 123 N -2.91 0.55 -0.04 2.90 2.20 -1.26 -1.29 119.74 119.89 1oa3 s LYS 123 Ca 0.03 1.23 0.05 0.00 -0.36 0.00 0.00 55.97 56.93 1oa3 s LYS 123 Cb -0.01 0.57 -0.01 0.00 -1.51 0.00 0.00 37.83 36.87 1oa3 s LYS 123 CO -0.02 -0.16 -0.20 0.71 -0.36 0.00 0.00 175.35 175.31 1oa3 s TYR 124 N 2.40 1.89 0.00 4.03 2.02 0.07 -4.97 117.35 122.80 1oa3 s TYR 124 Ca -0.07 -0.48 0.00 0.00 -0.37 0.00 0.00 57.07 56.15 1oa3 s TYR 124 Cb -0.09 -1.25 0.00 0.00 -0.40 0.00 0.00 41.96 40.23 1oa3 s TYR 124 CO -0.19 -0.12 0.00 0.41 -1.57 0.00 0.00 175.55 174.08 1oa3 n GLY 125 N 2.89 -3.16 0.00 0.71 0.00 -1.16 -1.62 105.19 102.84 1oa3 n GLY 125 Ca -0.17 -1.85 0.13 0.00 0.00 0.00 0.00 46.02 44.13 1oa3 n GLY 125 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1oa3 n ASP 126 N -0.27 0.00 -4.40 1.61 5.68 -1.26 -4.96 116.55 112.96 1oa3 n ASP 126 Ca 0.00 0.50 -0.32 0.00 -0.50 0.00 0.00 54.79 54.47 1oa3 n ASP 126 Cb 0.00 -0.50 0.17 0.00 -1.14 0.00 0.00 41.12 39.64 1oa3 n ASP 126 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 1oa3 n ILE 127 N -1.50 0.00 -3.94 2.12 -5.35 -1.26 -5.08 119.36 104.35 1oa3 n ILE 127 Ca 0.06 -0.25 -0.09 0.00 -0.27 0.00 0.00 62.75 62.21 1oa3 n ILE 127 Cb 0.31 -0.71 -0.04 0.00 -1.74 0.00 0.00 39.64 37.46 1oa3 n ILE 127 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1oa3 s GLY 128 N -2.07 0.31 0.91 3.28 0.00 -1.26 -5.02 107.32 103.47 1oa3 s GLY 128 Ca 0.59 -0.67 -0.12 0.00 0.00 0.00 0.00 44.72 44.52 1oa3 s GLY 128 CO 0.66 -0.45 1.10 -4.14 0.00 0.00 0.00 173.10 170.27 1oa3 s PRO 129 N -3.98 1.18 0.37 2.90 0.02 -1.26 -4.99 135.00 129.25 1oa3 s PRO 129 Ca 0.18 0.59 -0.27 0.00 0.02 0.00 0.00 61.00 61.52 1oa3 s PRO 129 Cb -0.02 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.58 1oa3 s PRO 129 CO 0.07 -2.23 1.36 0.42 -0.33 0.00 0.00 177.00 176.29 1oa3 s ILE 130 N -3.06 2.48 0.00 2.83 1.01 -1.26 -4.79 121.20 118.41 1oa3 s ILE 130 Ca 0.63 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.74 1oa3 s ILE 130 Cb -0.17 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 39.02 1oa3 s ILE 130 CO 0.56 0.09 0.00 0.61 0.00 0.00 0.00 174.94 176.20 1oa3 n GLY 131 N 0.66 -1.53 3.28 6.18 0.00 -1.26 -4.25 105.19 108.27 1oa3 n GLY 131 Ca 0.02 -1.72 -0.18 0.00 0.00 0.00 0.00 46.02 44.13 1oa3 n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oa3 s SER 132 N -4.00 2.19 0.14 1.61 1.04 -0.68 -4.84 113.70 109.15 1oa3 s SER 132 Ca 0.00 -0.90 -0.30 0.00 0.48 0.00 0.00 55.95 55.23 1oa3 s SER 132 Cb 0.00 -0.09 -0.07 0.00 0.10 0.00 0.00 66.02 65.96 1oa3 s SER 132 CO 0.00 -0.17 1.18 -0.55 0.98 0.00 0.00 173.24 174.68 1oa3 s SER 133 N -2.80 7.12 -0.10 7.02 0.15 -1.26 -1.47 113.70 122.37 1oa3 s SER 133 Ca 0.14 2.12 0.17 0.00 0.70 0.00 0.00 55.95 59.08 1oa3 s SER 133 Cb -0.03 -2.60 0.63 0.00 -1.71 0.00 0.00 66.02 62.31 1oa3 s SER 133 CO 0.04 -0.38 1.54 0.00 1.20 0.00 0.00 173.24 175.65 1oa3 n GLN 134 N 3.02 3.47 0.00 5.44 1.13 0.27 -4.95 117.38 125.76 1oa3 n GLN 134 Ca 0.06 -2.75 0.00 0.00 -1.94 0.00 0.00 57.00 52.37 1oa3 n GLN 134 Cb 0.46 -1.78 0.00 0.00 0.11 0.00 0.00 30.24 29.03 1oa3 n GLN 134 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1oa3 n GLY 135 N 0.82 -2.69 3.91 1.08 0.00 -1.25 -4.87 105.19 102.19 1oa3 n GLY 135 Ca 0.23 -1.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.12 1oa3 n GLY 135 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oa3 s THR 136 N -0.50 5.14 0.04 2.61 -4.23 -1.26 -1.22 115.64 116.22 1oa3 s THR 136 Ca 0.00 -0.10 -0.00 0.00 -1.18 0.00 0.00 61.69 60.41 1oa3 s THR 136 Cb 0.00 -3.69 -0.03 0.00 1.34 0.00 0.00 72.50 70.11 1oa3 s THR 136 CO 0.00 -0.14 -0.04 0.68 -0.54 0.00 0.00 174.62 174.59 1oa3 s VAL 137 N -1.85 0.24 -0.21 2.29 -7.23 0.12 -4.92 120.40 108.85 1oa3 s VAL 137 Ca 0.41 -1.46 -0.06 0.00 -1.81 0.00 0.00 61.98 59.05 1oa3 s VAL 137 Cb -0.11 -1.04 -0.03 0.00 0.56 0.00 0.00 36.38 35.75 1oa3 s VAL 137 CO 0.27 -0.78 0.04 0.20 -0.31 0.00 0.00 175.10 174.53 1oa3 s ASN 138 N -2.34 5.18 -0.03 4.85 0.02 -1.26 -0.24 114.94 121.12 1oa3 s ASN 138 Ca -0.02 -0.11 -0.01 0.00 -1.02 0.00 0.00 52.86 51.71 1oa3 s ASN 138 Cb 0.00 -1.90 0.03 0.00 0.02 0.00 0.00 41.25 39.41 1oa3 s ASN 138 CO -0.06 0.08 0.04 -0.69 0.02 0.00 0.00 177.10 176.49 1oa3 s VAL 139 N 0.93 -0.05 -1.71 1.60 1.01 -0.35 -4.85 120.40 116.98 1oa3 s VAL 139 Ca 0.03 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1oa3 s VAL 139 Cb -0.14 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.09 1oa3 s VAL 139 CO 0.02 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1oa3 n GLY 140 N 4.80 -0.36 2.03 4.51 0.00 -1.26 -2.55 105.19 112.35 1oa3 n GLY 140 Ca -0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 46.02 45.82 1oa3 n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa3 n GLY 141 N -1.00 0.46 3.12 -0.02 0.00 -1.26 -5.03 105.19 101.46 1oa3 n GLY 141 Ca -0.23 -0.52 -0.18 0.00 0.00 0.00 0.00 46.02 45.08 1oa3 n GLY 141 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1oa3 s GLN 142 N -1.05 0.82 -0.06 1.61 0.74 -1.06 -5.14 119.66 115.52 1oa3 s GLN 142 Ca 0.00 -0.76 -0.14 0.00 0.05 0.00 0.00 55.36 54.51 1oa3 s GLN 142 Cb 0.00 -0.79 -0.05 0.00 1.10 0.00 0.00 33.01 33.27 1oa3 s GLN 142 CO 0.00 0.19 0.36 0.99 -0.55 0.00 0.00 175.29 176.28 1oa3 s THR 143 N -0.96 5.16 0.07 -0.34 2.01 -1.26 -1.21 115.64 119.11 1oa3 s THR 143 Ca -0.01 0.71 0.04 0.00 0.31 0.00 0.00 61.69 62.75 1oa3 s THR 143 Cb -0.08 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 1oa3 s THR 143 CO 0.01 0.52 -0.12 0.26 -0.69 0.00 0.00 174.62 174.60 1oa3 s TRP 144 N -0.59 1.09 -0.25 4.92 0.52 0.67 -3.94 118.94 121.36 1oa3 s TRP 144 Ca 0.21 -0.50 -0.16 0.00 0.02 0.00 0.00 56.10 55.68 1oa3 s TRP 144 Cb -0.15 -0.61 -0.04 0.00 -1.15 0.00 0.00 33.47 31.52 1oa3 s TRP 144 CO 0.10 0.02 0.42 0.99 0.02 0.00 0.00 176.95 178.50 1oa3 s THR 145 N -1.48 5.16 -0.15 2.01 2.01 0.69 -0.70 115.64 123.18 1oa3 s THR 145 Ca -0.02 0.69 -0.18 0.00 0.31 0.00 0.00 61.69 62.49 1oa3 s THR 145 Cb -0.09 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 1oa3 s THR 145 CO 0.02 0.17 0.47 -0.22 -0.69 0.00 0.00 174.62 174.36 1oa3 s LEU 146 N 1.90 4.23 0.12 4.42 2.96 -0.36 -0.62 118.68 131.33 1oa3 s LEU 146 Ca 0.18 0.73 0.08 0.00 -0.22 0.00 0.00 54.13 54.90 1oa3 s LEU 146 Cb -0.15 -2.66 -0.04 0.00 0.50 0.00 0.00 46.19 43.84 1oa3 s LEU 146 CO 0.09 -0.05 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.61 1oa3 s TYR 147 N 0.95 2.59 -0.03 5.38 1.51 0.25 0.97 117.35 128.98 1oa3 s TYR 147 Ca 0.24 -0.23 -0.02 0.00 -1.01 0.00 0.00 57.07 56.05 1oa3 s TYR 147 Cb -0.15 -1.36 0.01 0.00 -0.11 0.00 0.00 41.96 40.35 1oa3 s TYR 147 CO 0.09 0.41 0.07 -0.47 -1.11 0.00 0.00 175.55 174.54 1oa3 s TYR 148 N -1.21 -0.07 0.04 2.71 5.04 -0.54 -1.58 117.35 121.75 1oa3 s TYR 148 Ca 0.19 0.20 -0.07 0.00 -2.44 0.00 0.00 57.07 54.96 1oa3 s TYR 148 Cb -0.11 -0.03 0.02 0.00 0.35 0.00 0.00 41.96 42.20 1oa3 s TYR 148 CO 0.11 -0.06 0.31 0.41 -1.34 0.00 0.00 175.55 174.99 1oa3 n GLY 149 N 3.34 0.99 3.35 8.97 0.00 -0.76 -1.69 105.19 119.41 1oa3 n GLY 149 Ca -0.16 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 1oa3 n GLY 149 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oa3 s TYR 150 N -4.50 2.43 -0.49 1.61 1.51 -1.26 -0.75 117.35 115.90 1oa3 s TYR 150 Ca 0.07 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.77 1oa3 s TYR 150 Cb -0.01 -1.54 0.14 0.00 -0.11 0.00 0.00 41.96 40.44 1oa3 s TYR 150 CO 0.01 0.01 0.26 1.21 -1.11 0.00 0.00 175.55 175.93 1oa3 s ASN 151 N -0.61 3.92 0.72 2.29 3.04 0.40 -4.91 114.94 119.80 1oa3 s ASN 151 Ca 0.09 -2.86 0.00 0.00 0.04 0.00 0.00 52.86 50.14 1oa3 s ASN 151 Cb -0.10 -1.29 0.00 0.00 -1.54 0.00 0.00 41.25 38.32 1oa3 s ASN 151 CO -0.00 -0.24 0.00 0.61 -3.04 0.00 0.00 177.10 174.43 1oa3 n GLY 152 N 3.27 2.15 0.00 1.21 0.00 -1.26 -2.26 105.19 108.30 1oa3 n GLY 152 Ca 0.08 -0.54 0.13 0.00 0.00 0.00 0.00 46.02 45.69 1oa3 n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa3 n ALA 153 N 8.81 2.44 -2.70 4.61 0.00 -1.26 -4.78 120.51 127.63 1oa3 n ALA 153 Ca 0.00 -0.16 -0.39 0.00 0.00 0.00 0.00 53.44 52.90 1oa3 n ALA 153 Cb 0.00 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 17.97 1oa3 n ALA 153 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1oa3 s MET 154 N -2.07 4.30 -0.07 0.00 0.00 -0.96 -4.90 119.30 115.60 1oa3 s MET 154 Ca 0.37 0.50 -0.20 0.00 0.00 0.00 0.00 55.69 56.35 1oa3 s MET 154 Cb 0.18 -3.48 -0.04 0.00 0.00 0.00 0.00 34.83 31.48 1oa3 s MET 154 CO 0.31 0.04 0.58 -0.65 0.00 0.00 0.00 175.02 175.29 1oa3 s GLN 155 N 1.00 4.35 -0.17 4.11 -0.21 -0.56 -0.46 119.66 127.73 1oa3 s GLN 155 Ca 0.27 0.66 0.00 0.00 0.02 0.00 0.00 55.36 56.31 1oa3 s GLN 155 Cb -0.15 -3.41 0.01 0.00 1.00 0.00 0.00 33.01 30.46 1oa3 s GLN 155 CO 0.11 0.20 -0.17 0.08 -2.12 0.00 0.00 175.29 173.39 1oa3 s VAL 156 N 0.41 2.42 -0.20 1.09 1.01 0.07 -0.60 120.40 124.59 1oa3 s VAL 156 Ca 0.31 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 1oa3 s VAL 156 Cb -0.17 -2.02 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1oa3 s VAL 156 CO 0.15 0.52 -0.08 -0.31 0.00 0.00 0.00 175.10 175.38 1oa3 s TYR 157 N 1.11 2.92 -0.16 5.22 2.02 -0.24 -1.82 117.35 126.39 1oa3 s TYR 157 Ca 0.00 -1.00 0.02 0.00 -0.37 0.00 0.00 57.07 55.72 1oa3 s TYR 157 Cb -0.14 -2.05 0.02 0.00 -0.40 0.00 0.00 41.96 39.38 1oa3 s TYR 157 CO -0.06 -0.54 -0.21 -1.12 -1.57 0.00 0.00 175.55 172.05 1oa3 s SER 158 N 1.32 3.14 -0.26 2.29 0.01 -0.61 -0.48 113.70 119.10 1oa3 s SER 158 Ca 0.04 -0.63 -0.10 0.00 1.31 0.00 0.00 55.95 56.57 1oa3 s SER 158 Cb -0.14 -1.47 -0.05 0.00 0.21 0.00 0.00 66.02 64.57 1oa3 s SER 158 CO -0.04 0.03 0.16 -0.36 0.41 0.00 0.00 173.24 173.45 1oa3 s PHE 159 N 1.10 3.21 -0.16 2.43 0.40 0.23 -0.58 117.98 124.61 1oa3 s PHE 159 Ca 0.00 0.04 -0.03 0.00 -0.60 0.00 0.00 56.93 56.35 1oa3 s PHE 159 Cb -0.14 -2.33 -0.02 0.00 0.51 0.00 0.00 43.02 41.04 1oa3 s PHE 159 CO -0.08 -0.15 -0.07 0.08 0.70 0.00 0.00 175.22 175.70 1oa3 s VAL 160 N 1.57 3.50 0.86 -0.44 1.01 0.21 -0.44 120.40 126.67 1oa3 s VAL 160 Ca 0.07 -0.49 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 1oa3 s VAL 160 Cb -0.15 -2.53 0.11 0.00 0.00 0.00 0.00 36.38 33.81 1oa3 s VAL 160 CO 0.08 0.49 1.13 0.00 0.00 0.00 0.00 175.10 176.80 1oa3 s ALA 161 N 0.60 1.76 -0.74 5.51 0.00 -0.63 -0.22 121.76 128.04 1oa3 s ALA 161 Ca -0.04 0.51 0.24 0.00 0.00 0.00 0.00 51.96 52.66 1oa3 s ALA 161 Cb -0.15 -3.40 0.35 0.00 0.00 0.00 0.00 23.12 19.92 1oa3 s ALA 161 CO 0.03 -2.40 1.30 1.04 0.00 0.00 0.00 175.76 175.73 1oa3 n GLN 162 N -3.93 0.21 -3.90 0.00 1.13 -1.25 -4.79 117.38 104.85 1oa3 n GLN 162 Ca 0.11 0.05 -0.09 0.00 -1.94 0.00 0.00 57.00 55.12 1oa3 n GLN 162 Cb 0.52 -1.62 -0.06 0.00 0.11 0.00 0.00 30.24 29.19 1oa3 n GLN 162 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1oa3 s SER 163 N -3.84 -0.03 -0.37 1.08 1.04 -1.26 -5.10 113.70 105.23 1oa3 s SER 163 Ca 0.07 -0.77 -0.28 0.00 0.48 0.00 0.00 55.95 55.46 1oa3 s SER 163 Cb 0.15 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 1oa3 s SER 163 CO 0.73 -0.92 1.84 0.20 0.98 0.00 0.00 173.24 176.06 1oa3 s ASN 164 N -2.94 5.75 -1.13 7.02 0.01 -1.26 -4.82 114.94 117.58 1oa3 s ASN 164 Ca 0.15 1.19 -0.15 0.00 -0.71 0.00 0.00 52.86 53.34 1oa3 s ASN 164 Cb 0.02 -2.53 0.17 0.00 0.41 0.00 0.00 41.25 39.33 1oa3 s ASN 164 CO -0.01 -1.84 1.33 -0.89 -1.51 0.00 0.00 177.10 174.18 1oa3 s THR 165 N 7.37 5.04 -0.79 1.60 2.01 0.70 -4.81 115.64 126.75 1oa3 s THR 165 Ca 0.79 -2.44 0.27 0.00 0.31 0.00 0.00 61.69 60.62 1oa3 s THR 165 Cb -0.21 -4.85 0.28 0.00 0.01 0.00 0.00 72.50 67.72 1oa3 s THR 165 CO 0.32 -1.55 1.81 0.35 -0.69 0.00 0.00 174.62 174.85 1oa3 n THR 166 N 4.68 0.46 -3.89 -0.82 -2.24 -1.26 -4.41 114.28 106.80 1oa3 n THR 166 Ca 0.32 -0.21 -0.29 0.00 -2.27 0.00 0.00 64.05 61.61 1oa3 n THR 166 Cb 0.44 -0.57 -0.16 0.00 -2.10 0.00 0.00 70.33 67.93 1oa3 n THR 166 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1oa3 s SER 167 N -4.17 3.02 0.01 3.42 0.15 -1.26 -1.64 113.70 113.23 1oa3 s SER 167 Ca 0.11 -0.76 0.03 0.00 0.70 0.00 0.00 55.95 56.03 1oa3 s SER 167 Cb 0.14 -0.95 -0.01 0.00 -1.71 0.00 0.00 66.02 63.49 1oa3 s SER 167 CO 0.58 -0.20 -0.09 -0.47 1.20 0.00 0.00 173.24 174.26 1oa3 s TYR 168 N 1.60 0.75 -0.03 3.44 5.04 0.10 -5.00 117.35 123.25 1oa3 s TYR 168 Ca -0.00 -0.22 -0.01 0.00 -2.44 0.00 0.00 57.07 54.39 1oa3 s TYR 168 Cb -0.16 -0.47 0.03 0.00 0.35 0.00 0.00 41.96 41.71 1oa3 s TYR 168 CO -0.08 -0.02 0.05 0.45 -1.34 0.00 0.00 175.55 174.62 1oa3 s SER 169 N -0.54 0.51 0.10 4.32 0.15 -1.26 -0.87 113.70 116.10 1oa3 s SER 169 Ca 0.01 0.07 -0.05 0.00 0.70 0.00 0.00 55.95 56.68 1oa3 s SER 169 Cb -0.05 -0.08 0.02 0.00 -1.71 0.00 0.00 66.02 64.20 1oa3 s SER 169 CO 0.00 -0.18 0.26 0.61 1.20 0.00 0.00 173.24 175.13 1oa3 n GLY 170 N 4.66 1.53 2.71 9.45 0.00 -0.58 -5.03 105.19 117.93 1oa3 n GLY 170 Ca -0.17 -1.06 -0.26 0.00 0.00 0.00 0.00 46.02 44.53 1oa3 n GLY 170 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oa3 s ASP 171 N -1.66 2.40 0.64 1.61 -1.08 -1.26 -1.00 116.67 116.33 1oa3 s ASP 171 Ca 0.05 -0.57 0.41 0.00 -0.52 0.00 0.00 52.55 51.92 1oa3 s ASP 171 Cb -0.01 -0.45 2.23 0.00 -1.46 0.00 0.00 42.92 43.22 1oa3 s ASP 171 CO 0.03 -0.29 2.32 0.58 0.52 0.00 0.00 175.17 178.33 1oa3 h VAL 172 N 6.45 0.10 -0.16 1.11 2.07 -1.57 -1.26 116.25 122.99 1oa3 h VAL 172 Ca -0.16 -0.07 0.03 0.00 0.82 0.00 0.00 66.70 67.32 1oa3 h VAL 172 Cb 1.13 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1oa3 h VAL 172 CO 0.30 0.01 0.11 0.11 0.02 0.00 0.00 177.57 178.12 1oa3 h LYS 173 N 0.00 0.06 -0.23 1.57 1.79 -1.93 -1.32 116.57 116.52 1oa3 h LYS 173 Ca -0.00 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.44 1oa3 h LYS 173 Cb 0.06 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 1oa3 h LYS 173 CO 0.00 0.04 0.04 -0.91 -1.08 0.00 0.00 179.45 177.54 1oa3 h ASN 174 N 0.06 0.29 -0.01 0.86 2.35 -1.62 0.42 115.58 117.93 1oa3 h ASN 174 Ca 0.07 -0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 55.66 1oa3 h ASN 174 Cb 0.21 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.52 1oa3 h ASN 174 CO -0.01 0.32 -0.49 -0.26 -1.65 0.00 0.00 177.43 175.34 1oa3 h PHE 175 N 0.32 0.50 -0.86 1.19 -1.00 -1.41 -2.02 116.94 113.67 1oa3 h PHE 175 Ca 0.08 -0.27 -0.00 0.00 2.81 0.00 0.00 57.97 60.59 1oa3 h PHE 175 Cb 0.16 -0.06 -0.04 0.00 3.61 0.00 0.00 35.95 39.62 1oa3 h PHE 175 CO 0.00 1.08 0.53 0.74 -1.61 0.00 0.00 178.31 179.05 1oa3 h PHE 176 N -0.22 1.12 -0.75 -0.55 0.04 -1.22 -1.92 116.94 113.45 1oa3 h PHE 176 Ca -0.06 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.67 1oa3 h PHE 176 Cb 1.21 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.96 1oa3 h PHE 176 CO 0.16 0.74 0.28 -0.91 -0.60 0.00 0.00 178.31 177.98 1oa3 h ASN 177 N 1.18 1.04 -0.31 2.17 2.35 -0.91 0.57 115.58 121.67 1oa3 h ASN 177 Ca 0.31 -0.17 0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1oa3 h ASN 177 Cb -0.07 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.02 1oa3 h ASN 177 CO -0.06 0.93 0.19 0.22 -1.65 0.00 0.00 177.43 177.06 1oa3 h TYR 178 N 1.09 0.36 -0.66 1.19 3.20 -0.90 -0.56 116.97 120.70 1oa3 h TYR 178 Ca 0.25 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.07 1oa3 h TYR 178 Cb 0.23 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 1oa3 h TYR 178 CO 0.02 0.22 0.18 -0.07 -1.64 0.00 0.00 178.16 176.88 1oa3 h LEU 179 N 0.39 0.96 -0.52 2.82 3.38 -0.85 -1.12 115.31 120.37 1oa3 h LEU 179 Ca 0.12 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1oa3 h LEU 179 Cb -0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1oa3 h LEU 179 CO -0.04 0.91 0.10 -0.09 0.09 0.00 0.00 178.44 179.40 1oa3 h ARG 180 N 0.98 0.86 0.00 1.13 2.43 -0.59 0.48 114.38 119.66 1oa3 h ARG 180 Ca 0.21 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1oa3 h ARG 180 Cb 0.31 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1oa3 h ARG 180 CO -0.00 0.83 -0.54 -0.25 -1.51 0.00 0.00 179.97 178.50 1oa3 n ASP 181 N -4.40 0.58 0.00 -3.80 8.00 -0.24 -4.03 116.55 112.66 1oa3 n ASP 181 Ca 0.02 0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.53 1oa3 n ASP 181 Cb 0.25 0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 1oa3 n ASP 181 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1oa3 n ASN 182 N -1.86 2.27 -0.09 -2.24 3.02 -0.44 -4.85 115.26 111.07 1oa3 n ASN 182 Ca 0.04 -0.10 0.02 0.00 -0.03 0.00 0.00 54.58 54.52 1oa3 n ASN 182 Cb 0.40 0.64 0.03 0.00 -0.61 0.00 0.00 39.78 40.24 1oa3 n ASN 182 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1oa3 n LYS 183 N -0.87 1.37 -1.71 3.52 4.76 0.13 -5.01 118.16 120.35 1oa3 n LYS 183 Ca 0.00 -1.35 -0.14 0.00 -2.87 0.00 0.00 58.31 53.95 1oa3 n LYS 183 Cb 0.00 -0.88 -0.04 0.00 -1.84 0.00 0.00 35.03 32.27 1oa3 n LYS 183 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oa3 n GLY 184 N -0.47 0.89 3.69 0.72 0.00 -1.06 -4.96 105.19 104.00 1oa3 n GLY 184 Ca 0.03 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 1oa3 n GLY 184 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1oa3 s TYR 185 N -2.59 2.95 -1.29 1.61 5.04 -1.02 -4.92 117.35 117.13 1oa3 s TYR 185 Ca 0.00 0.89 -0.16 0.00 -2.44 0.00 0.00 57.07 55.36 1oa3 s TYR 185 Cb 0.00 -3.63 0.11 0.00 0.35 0.00 0.00 41.96 38.78 1oa3 s TYR 185 CO 0.00 -2.30 1.71 -1.71 -1.34 0.00 0.00 175.55 171.91 1oa3 n ASN 186 N 5.13 4.93 0.28 4.32 5.15 -1.26 -4.24 115.26 129.57 1oa3 n ASN 186 Ca 0.13 -2.94 0.14 0.00 -0.60 0.00 0.00 54.58 51.30 1oa3 n ASN 186 Cb 0.44 -1.66 0.83 0.00 -0.53 0.00 0.00 39.78 38.85 1oa3 n ASN 186 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1oa3 h ALA 187 N 7.12 1.38 0.00 5.20 0.00 -1.91 -1.39 119.26 129.65 1oa3 h ALA 187 Ca 0.42 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 1oa3 h ALA 187 Cb 0.83 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1oa3 h ALA 187 CO 1.45 0.08 -0.00 0.78 0.00 0.00 0.00 179.25 181.56 1oa3 h GLY 188 N 0.46 0.00 -0.36 0.00 0.00 -1.96 -2.61 103.07 98.60 1oa3 h GLY 188 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1oa3 h GLY 188 CO 0.01 0.00 -0.00 0.61 0.00 0.00 0.00 176.54 177.15 1oa3 n GLY 189 N 0.48 -1.00 3.66 4.60 0.00 -0.60 -4.89 105.19 107.44 1oa3 n GLY 189 Ca 0.02 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1oa3 n GLY 189 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oa3 s GLN 190 N -0.39 3.68 -0.11 1.61 -1.52 -0.75 -4.05 119.66 118.14 1oa3 s GLN 190 Ca 0.05 -0.35 -0.06 0.00 -1.95 0.00 0.00 55.36 53.05 1oa3 s GLN 190 Cb 0.04 -3.09 -0.04 0.00 -0.22 0.00 0.00 33.01 29.70 1oa3 s GLN 190 CO 0.06 0.42 0.12 0.71 -0.25 0.00 0.00 175.29 176.34 1oa3 s TYR 191 N -0.05 3.53 -0.31 0.91 1.51 0.80 -0.82 117.35 122.92 1oa3 s TYR 191 Ca 0.06 0.47 -0.29 0.00 -1.01 0.00 0.00 57.07 56.29 1oa3 s TYR 191 Cb -0.12 -1.91 0.02 0.00 -0.11 0.00 0.00 41.96 39.84 1oa3 s TYR 191 CO 0.01 0.69 1.06 0.08 -1.11 0.00 0.00 175.55 176.29 1oa3 s VAL 192 N -1.03 4.54 -0.12 0.71 1.01 -0.74 -2.03 120.40 122.74 1oa3 s VAL 192 Ca 0.16 1.77 0.19 0.00 0.00 0.00 0.00 61.98 64.09 1oa3 s VAL 192 Cb -0.12 -4.40 -0.23 0.00 0.00 0.00 0.00 36.38 31.63 1oa3 s VAL 192 CO 0.05 -0.43 0.46 0.18 0.00 0.00 0.00 175.10 175.35 1oa3 n LEU 193 N 6.78 0.30 -3.56 3.92 4.77 0.29 -4.51 117.00 124.98 1oa3 n LEU 193 Ca 0.12 0.13 -0.13 0.00 -0.03 0.00 0.00 56.01 56.10 1oa3 n LEU 193 Cb 0.47 0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 41.71 1oa3 n LEU 193 CO 0.58 0.22 0.28 -0.94 -1.33 0.00 0.00 177.39 176.20 1oa3 s SER 194 N -5.29 -0.43 -0.32 -1.43 1.04 -1.22 -4.85 113.70 101.20 1oa3 s SER 194 Ca -0.07 0.08 0.01 0.00 0.48 0.00 0.00 55.95 56.46 1oa3 s SER 194 Cb 0.09 0.50 0.15 0.00 0.10 0.00 0.00 66.02 66.86 1oa3 s SER 194 CO 0.85 -0.77 0.33 -0.47 0.98 0.00 0.00 173.24 174.16 1oa3 s TYR 195 N -2.80 -0.41 0.20 5.02 6.14 -1.26 -3.82 117.35 120.43 1oa3 s TYR 195 Ca -0.03 -0.43 0.07 0.00 0.64 0.00 0.00 57.07 57.32 1oa3 s TYR 195 Cb -0.00 -0.43 -0.05 0.00 0.42 0.00 0.00 41.96 41.90 1oa3 s TYR 195 CO -0.05 -0.94 -0.14 -0.65 0.64 0.00 0.00 175.55 174.42 1oa3 s GLN 196 N 1.98 1.32 -0.12 4.97 -0.21 -0.30 -2.54 119.66 124.75 1oa3 s GLN 196 Ca 0.12 -1.59 -0.07 0.00 0.02 0.00 0.00 55.36 53.85 1oa3 s GLN 196 Cb -0.14 -1.08 0.05 0.00 1.00 0.00 0.00 33.01 32.83 1oa3 s GLN 196 CO -0.21 0.17 0.30 0.12 -2.12 0.00 0.00 175.29 173.55 1oa3 s PHE 197 N -3.00 -0.40 0.00 0.91 5.36 0.39 -1.12 117.98 120.11 1oa3 s PHE 197 Ca 0.22 0.93 0.00 0.00 -0.96 0.00 0.00 56.93 57.12 1oa3 s PHE 197 Cb -0.00 0.12 0.00 0.00 -0.34 0.00 0.00 43.02 42.79 1oa3 s PHE 197 CO 0.07 -0.26 0.00 0.41 -1.46 0.00 0.00 175.22 173.98 1oa3 n GLY 198 N 4.10 1.00 2.90 13.12 0.00 -0.52 -0.60 105.19 125.20 1oa3 n GLY 198 Ca -0.24 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.25 1oa3 n GLY 198 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1oa3 s THR 199 N -1.40 0.22 -0.37 2.61 -1.32 -0.84 -0.65 115.64 113.88 1oa3 s THR 199 Ca 0.00 -0.09 -0.09 0.00 -1.21 0.00 0.00 61.69 60.30 1oa3 s THR 199 Cb 0.00 -0.21 0.04 0.00 -1.51 0.00 0.00 72.50 70.83 1oa3 s THR 199 CO 0.00 0.08 0.18 -1.61 -2.21 0.00 0.00 174.62 171.06 1oa3 s GLU 200 N 0.11 2.69 0.14 7.08 2.02 -1.23 -3.25 118.70 126.27 1oa3 s GLU 200 Ca -0.01 -1.20 -0.02 0.00 0.02 0.00 0.00 54.97 53.76 1oa3 s GLU 200 Cb -0.03 -3.64 -0.05 0.00 0.10 0.00 0.00 34.13 30.51 1oa3 s GLU 200 CO -0.00 -0.74 0.34 -1.25 0.02 0.00 0.00 175.26 173.62 1oa3 s PRO 201 N 1.47 3.54 -0.00 0.39 0.04 -1.26 -1.46 135.00 137.72 1oa3 s PRO 201 Ca 0.01 -0.27 -0.04 0.00 0.04 0.00 0.00 61.00 60.75 1oa3 s PRO 201 Cb -0.20 -2.89 -0.01 0.00 0.04 0.00 0.00 34.50 31.44 1oa3 s PRO 201 CO 0.04 0.48 -0.07 1.19 0.04 0.00 0.00 177.00 178.68 1oa3 n PHE 202 N -0.13 0.00 -4.02 0.56 3.01 0.19 -1.38 117.46 115.68 1oa3 n PHE 202 Ca -0.04 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.33 1oa3 n PHE 202 Cb 0.52 -0.10 -0.08 0.00 -0.01 0.00 0.00 39.48 39.81 1oa3 n PHE 202 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1oa3 s THR 203 N -1.72 0.09 0.00 4.37 -4.23 -1.20 -4.62 115.64 108.32 1oa3 s THR 203 Ca -0.06 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 1oa3 s THR 203 Cb 0.01 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 71.98 1oa3 s THR 203 CO 0.09 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.37 1oa3 n GLY 204 N -0.15 -0.07 2.92 3.99 0.00 -0.33 -1.51 105.19 110.04 1oa3 n GLY 204 Ca -0.07 -2.22 -0.19 0.00 0.00 0.00 0.00 46.02 43.53 1oa3 n GLY 204 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oa3 s SER 205 N -4.00 0.94 0.15 1.61 0.01 -0.57 -1.04 113.70 110.80 1oa3 s SER 205 Ca 0.00 -0.14 -0.24 0.00 1.31 0.00 0.00 55.95 56.88 1oa3 s SER 205 Cb 0.00 -0.39 0.06 0.00 0.21 0.00 0.00 66.02 65.91 1oa3 s SER 205 CO 0.00 -0.02 0.75 -0.83 0.41 0.00 0.00 173.24 173.55 1oa3 s GLY 206 N 0.65 -0.39 -0.10 3.44 0.00 -0.44 -0.38 107.32 110.10 1oa3 s GLY 206 Ca -0.09 0.33 -0.00 0.00 0.00 0.00 0.00 44.72 44.96 1oa3 s GLY 206 CO 0.00 0.11 -0.06 -1.59 0.00 0.00 0.00 173.10 171.56 1oa3 s THR 207 N -3.58 0.86 -0.34 0.90 2.01 0.20 -0.88 115.64 114.81 1oa3 s THR 207 Ca 0.06 -0.20 -0.16 0.00 0.31 0.00 0.00 61.69 61.71 1oa3 s THR 207 Cb -0.02 -0.91 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 1oa3 s THR 207 CO -0.05 0.34 0.40 -0.22 -0.69 0.00 0.00 174.62 174.40 1oa3 s LEU 208 N 1.68 4.38 -0.26 4.42 2.96 0.60 -1.64 118.68 130.82 1oa3 s LEU 208 Ca 0.03 -0.13 -0.13 0.00 -0.22 0.00 0.00 54.13 53.68 1oa3 s LEU 208 Cb -0.13 -2.41 -0.04 0.00 0.50 0.00 0.00 46.19 44.11 1oa3 s LEU 208 CO -0.07 -0.36 0.29 0.21 -1.32 0.00 0.00 176.35 175.10 1oa3 s ASN 209 N 1.73 6.17 -0.45 3.68 2.47 -0.17 -0.77 114.94 127.61 1oa3 s ASN 209 Ca 0.14 0.19 -0.11 0.00 0.42 0.00 0.00 52.86 53.50 1oa3 s ASN 209 Cb -0.16 -2.17 0.09 0.00 -1.45 0.00 0.00 41.25 37.56 1oa3 s ASN 209 CO 0.12 -0.10 0.32 -0.69 -3.72 0.00 0.00 177.10 173.02 1oa3 s VAL 210 N 1.80 4.45 0.21 -5.21 1.01 0.09 -1.34 120.40 121.41 1oa3 s VAL 210 Ca 0.12 -1.45 0.05 0.00 0.00 0.00 0.00 61.98 60.70 1oa3 s VAL 210 Cb -0.16 -3.77 -0.08 0.00 0.00 0.00 0.00 36.38 32.37 1oa3 s VAL 210 CO 0.10 -0.61 1.50 0.00 0.00 0.00 0.00 175.10 176.08 1oa3 h ALA 211 N 8.51 0.74 -2.19 5.51 0.00 -0.93 -2.26 119.26 128.63 1oa3 h ALA 211 Ca -0.24 -0.63 -0.04 0.00 0.00 0.00 0.00 54.91 54.01 1oa3 h ALA 211 Cb 1.09 -0.09 -0.22 0.00 0.00 0.00 0.00 17.79 18.56 1oa3 h ALA 211 CO 0.82 0.83 -0.03 0.45 0.00 0.00 0.00 179.25 181.32 1oa3 s SER 212 N -6.88 -0.76 -0.09 0.00 0.15 -1.06 -4.50 113.70 100.55 1oa3 s SER 212 Ca -0.03 1.31 -0.04 0.00 0.70 0.00 0.00 55.95 57.89 1oa3 s SER 212 Cb 0.11 1.24 0.04 0.00 -1.71 0.00 0.00 66.02 65.71 1oa3 s SER 212 CO 0.80 -0.22 0.20 0.86 1.20 0.00 0.00 173.24 176.08 1oa3 s TRP 213 N 1.10 -0.25 0.08 3.44 -0.00 0.11 -0.62 118.94 122.79 1oa3 s TRP 213 Ca -0.06 0.64 0.04 0.00 -0.00 0.00 0.00 56.10 56.72 1oa3 s TRP 213 Cb -0.05 -0.00 -0.03 0.00 -0.00 0.00 0.00 33.47 33.38 1oa3 s TRP 213 CO -0.11 -0.19 -0.12 0.95 -0.00 0.00 0.00 176.95 177.48 1oa3 s THR 214 N 1.11 0.99 -0.06 5.86 -4.23 -0.65 -0.60 115.64 118.06 1oa3 s THR 214 Ca -0.08 -1.40 -0.30 0.00 -1.18 0.00 0.00 61.69 58.72 1oa3 s THR 214 Cb -0.10 -1.12 0.08 0.00 1.34 0.00 0.00 72.50 72.70 1oa3 s THR 214 CO -0.07 -0.36 0.74 0.00 -0.54 0.00 0.00 174.62 174.39 1oa3 s ALA 215 N -1.70 -1.80 0.14 3.99 0.00 -1.26 -1.59 121.76 119.54 1oa3 s ALA 215 Ca -0.00 1.34 -0.18 0.00 0.00 0.00 0.00 51.96 53.12 1oa3 s ALA 215 Cb -0.08 -0.10 0.04 0.00 0.00 0.00 0.00 23.12 22.99 1oa3 s ALA 215 CO 0.01 -0.38 0.46 -1.54 0.00 0.00 0.00 175.76 174.31 1oa3 s SER 216 N -1.25 -0.32 -0.25 0.00 1.04 -0.86 -4.97 113.70 107.08 1oa3 s SER 216 Ca -0.09 -0.24 -0.01 0.00 0.48 0.00 0.00 55.95 56.10 1oa3 s SER 216 Cb -0.00 0.51 0.03 0.00 0.10 0.00 0.00 66.02 66.66 1oa3 s SER 216 CO 0.07 -0.89 -0.07 -0.63 0.98 0.00 0.00 173.24 172.71 1oa3 s ILE 217 N -3.79 2.78 -0.27 -1.02 1.01 -1.26 -3.32 121.20 115.32 1oa3 s ILE 217 Ca 0.03 -1.11 0.02 0.00 0.00 0.00 0.00 60.65 59.59 1oa3 s ILE 217 Cb 0.01 -2.44 0.02 0.00 0.01 0.00 0.00 42.46 40.06 1oa3 s ILE 217 CO -0.12 0.17 0.57 0.59 0.00 0.00 0.00 174.94 176.15