#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f91 s VAL 17 N 0.00 5.37 0.00 1.39 1.01 0.32 -4.09 120.40 124.40 2f91 s VAL 17 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.27 2f91 s VAL 17 Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2f91 s VAL 17 CO 0.00 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2f91 n GLY 18 N 3.64 0.44 1.05 4.51 0.00 -1.22 -1.72 105.19 111.90 2f91 n GLY 18 Ca -0.15 -0.77 -0.06 0.00 0.00 0.00 0.00 46.02 45.05 2f91 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f91 n GLY 19 N -2.94 1.20 3.35 -0.02 0.00 -1.26 -4.90 105.19 100.62 2f91 n GLY 19 Ca 0.00 -2.05 -0.18 0.00 0.00 0.00 0.00 46.02 43.80 2f91 n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2f91 s THR 20 N -0.39 0.93 0.26 2.61 -4.23 0.03 -4.94 115.64 109.91 2f91 s THR 20 Ca 0.17 -2.02 -0.30 0.00 -1.18 0.00 0.00 61.69 58.37 2f91 s THR 20 Cb -0.01 -2.51 -0.09 0.00 1.34 0.00 0.00 72.50 71.23 2f91 s THR 20 CO 0.11 -0.18 1.24 -1.81 -0.54 0.00 0.00 174.62 173.45 2f91 s ASP 21 N -3.34 6.98 0.83 3.99 1.01 -1.26 -1.03 116.67 123.85 2f91 s ASP 21 Ca 0.32 2.43 -0.12 0.00 0.71 0.00 0.00 52.55 55.90 2f91 s ASP 21 Cb 0.07 -2.63 0.09 0.00 1.01 0.00 0.00 42.92 41.47 2f91 s ASP 21 CO 0.11 -0.41 1.11 0.00 0.21 0.00 0.00 175.17 176.20 2f91 s ALA 22 N -0.61 2.10 0.07 5.23 0.00 -0.02 -4.79 121.76 123.73 2f91 s ALA 22 Ca 0.51 -0.32 0.06 0.00 0.00 0.00 0.00 51.96 52.20 2f91 s ALA 22 Cb -0.36 -3.08 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 2f91 s ALA 22 CO 0.43 -1.91 -0.08 0.99 0.00 0.00 0.00 175.76 175.19 2f91 s THR 23 N -3.20 3.50 0.17 0.00 2.01 -1.26 -4.87 115.64 111.99 2f91 s THR 23 Ca 0.62 -1.07 -0.34 0.00 0.31 0.00 0.00 61.69 61.21 2f91 s THR 23 Cb -0.14 -2.60 -0.14 0.00 0.01 0.00 0.00 72.50 69.63 2f91 s THR 23 CO 0.54 0.22 1.59 -0.11 -0.69 0.00 0.00 174.62 176.17 2f91 n LEU 24 N 1.01 3.21 0.00 4.42 7.94 -1.26 -1.34 117.00 130.99 2f91 n LEU 24 Ca -0.14 1.08 0.00 0.00 -1.11 0.00 0.00 56.01 55.84 2f91 n LEU 24 Cb 0.52 -1.45 0.00 0.00 0.53 0.00 0.00 43.42 43.03 2f91 n LEU 24 CO 0.33 -0.23 0.00 0.61 -1.11 0.00 0.00 177.39 176.99 2f91 n GLY 25 N 3.44 1.57 0.28 -3.96 0.00 -1.26 -4.89 105.19 100.37 2f91 n GLY 25 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 2f91 n GLY 25 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2f91 h GLU 26 N 2.98 0.97 -2.22 1.61 4.81 -1.53 -3.35 114.58 117.85 2f91 h GLU 26 Ca 0.00 -0.39 -0.59 0.00 -0.13 0.00 0.00 59.36 58.25 2f91 h GLU 26 Cb 0.00 -0.04 -0.41 0.00 0.63 0.00 0.00 28.75 28.92 2f91 h GLU 26 CO 0.00 1.07 -0.74 1.19 -0.73 0.00 0.00 179.01 179.79 2f91 n PHE 27 N -4.12 2.38 0.41 0.92 3.72 -1.26 -4.95 117.46 114.57 2f91 n PHE 27 Ca 0.01 -3.98 0.08 0.00 -0.05 0.00 0.00 57.45 53.50 2f91 n PHE 27 Cb 0.44 -0.48 0.34 0.00 -0.94 0.00 0.00 39.48 38.84 2f91 n PHE 27 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2f91 n PRO 28 N 1.15 0.06 0.00 -1.08 -0.04 -1.26 -1.86 135.00 131.98 2f91 n PRO 28 Ca 0.27 0.34 0.12 0.00 -0.04 0.00 0.00 63.50 64.19 2f91 n PRO 28 Cb 0.44 -1.62 0.33 0.00 -0.04 0.00 0.00 33.50 32.61 2f91 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2f91 n TYR 29 N -1.73 0.00 -2.35 0.54 0.18 -1.11 -1.92 117.16 110.77 2f91 n TYR 29 Ca 0.03 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.39 2f91 n TYR 29 Cb 0.17 -0.29 -0.03 0.00 -0.38 0.00 0.00 39.34 38.80 2f91 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 2f91 s GLN 30 N -2.97 4.44 0.12 -3.48 2.00 -0.78 -1.28 119.66 117.72 2f91 s GLN 30 Ca 0.12 1.88 0.09 0.00 -2.00 0.00 0.00 55.36 55.46 2f91 s GLN 30 Cb 0.18 -3.27 -0.04 0.00 0.80 0.00 0.00 33.01 30.68 2f91 s GLN 30 CO 0.66 -0.21 -0.18 -0.51 -0.50 0.00 0.00 175.29 174.55 2f91 s LEU 31 N 0.40 2.68 -0.22 3.68 1.43 -0.10 -4.42 118.68 122.13 2f91 s LEU 31 Ca 0.57 -0.58 -0.13 0.00 -1.03 0.00 0.00 54.13 52.96 2f91 s LEU 31 Cb -0.32 -1.52 -0.05 0.00 0.03 0.00 0.00 46.19 44.33 2f91 s LEU 31 CO 0.33 0.17 0.26 -0.55 0.23 0.00 0.00 176.35 176.79 2f91 s SER 32 N -2.17 6.26 -0.32 2.29 0.15 -0.60 -2.26 113.70 117.05 2f91 s SER 32 Ca 0.18 0.29 -0.11 0.00 0.70 0.00 0.00 55.95 57.01 2f91 s SER 32 Cb -0.10 -2.16 -0.02 0.00 -1.71 0.00 0.00 66.02 62.03 2f91 s SER 32 CO 0.10 0.02 0.20 0.12 1.20 0.00 0.00 173.24 174.88 2f91 s PHE 33 N 1.09 3.21 0.11 3.44 5.36 -0.17 -0.51 117.98 130.51 2f91 s PHE 33 Ca 0.12 -0.23 0.09 0.00 -0.96 0.00 0.00 56.93 55.95 2f91 s PHE 33 Cb -0.14 -2.41 -0.04 0.00 -0.34 0.00 0.00 43.02 40.09 2f91 s PHE 33 CO 0.05 -0.34 -0.22 -0.65 -1.46 0.00 0.00 175.22 172.60 2f91 s GLN 34 N 1.70 1.19 -0.05 10.12 -0.21 0.02 -1.52 119.66 130.91 2f91 s GLN 34 Ca 0.06 -1.21 0.05 0.00 0.02 0.00 0.00 55.36 54.28 2f91 s GLN 34 Cb -0.17 -1.50 -0.02 0.00 1.00 0.00 0.00 33.01 32.32 2f91 s GLN 34 CO 0.09 0.35 -0.19 -1.83 -2.12 0.00 0.00 175.29 171.59 2f91 s GLU 35 N -1.95 2.53 -0.16 2.91 -1.05 -0.18 -1.32 118.70 119.48 2f91 s GLU 35 Ca 0.08 -0.80 -0.11 0.00 -0.15 0.00 0.00 54.97 53.99 2f91 s GLU 35 Cb -0.10 -2.28 -0.05 0.00 -0.44 0.00 0.00 34.13 31.26 2f91 s GLU 35 CO 0.05 0.50 0.21 0.95 0.95 0.00 0.00 175.26 177.92 2f91 s THR 36 N -0.44 5.37 0.34 1.83 -4.23 -0.59 -0.26 115.64 117.66 2f91 s THR 36 Ca 0.05 0.36 0.03 0.00 -1.18 0.00 0.00 61.69 60.95 2f91 s THR 36 Cb -0.12 -3.53 -0.04 0.00 1.34 0.00 0.00 72.50 70.15 2f91 s THR 36 CO 0.02 0.46 0.11 -0.36 -0.54 0.00 0.00 174.62 174.30 2f91 s PHE 37 N 0.07 1.77 -0.01 3.99 0.08 -0.05 -4.91 117.98 118.92 2f91 s PHE 37 Ca 0.13 -1.18 -0.33 0.00 0.12 0.00 0.00 56.93 55.67 2f91 s PHE 37 Cb -0.12 -1.11 -0.12 0.00 -0.57 0.00 0.00 43.02 41.11 2f91 s PHE 37 CO 0.02 -0.25 1.84 -0.89 -0.10 0.00 0.00 175.22 175.85 2f91 n ILE 37 N -0.71 0.50 -0.41 0.64 5.41 -1.26 -1.86 119.36 121.66 2f91 n ILE 37 Ca -0.03 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.63 2f91 n ILE 37 Cb 0.66 -1.92 0.00 0.00 -0.71 0.00 0.00 39.64 37.67 2f91 n ILE 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2f91 n GLY 37 N 4.25 1.92 3.54 7.39 0.00 -1.26 -4.99 105.19 116.05 2f91 n GLY 37 Ca 0.21 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 2f91 n GLY 37 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2f91 s PHE 37 N -3.31 -0.31 -0.19 1.61 -0.12 -0.78 -5.12 117.98 109.75 2f91 s PHE 37 Ca 0.00 0.15 -0.05 0.00 -0.05 0.00 0.00 56.93 56.98 2f91 s PHE 37 Cb 0.00 0.55 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 2f91 s PHE 37 CO 0.00 -0.59 0.01 -1.12 -0.05 0.00 0.00 175.22 173.47 2f91 s SER 38 N -2.56 4.99 -0.24 1.98 0.01 -1.26 -0.87 113.70 115.75 2f91 s SER 38 Ca 0.06 -0.13 -0.03 0.00 1.31 0.00 0.00 55.95 57.16 2f91 s SER 38 Cb -0.01 -1.85 0.02 0.00 0.21 0.00 0.00 66.02 64.39 2f91 s SER 38 CO -0.07 0.10 -0.05 0.12 0.41 0.00 0.00 173.24 173.75 2f91 s PHE 39 N 0.78 3.03 0.03 2.43 5.36 0.64 -4.93 117.98 125.33 2f91 s PHE 39 Ca 0.01 -1.36 -0.30 0.00 -0.96 0.00 0.00 56.93 54.31 2f91 s PHE 39 Cb -0.14 -2.08 -0.07 0.00 -0.34 0.00 0.00 43.02 40.38 2f91 s PHE 39 CO 0.02 -0.68 1.67 -1.58 -1.46 0.00 0.00 175.22 173.20 2f91 s HIS 40 N 1.38 2.20 0.00 10.12 5.65 -1.26 -1.01 115.29 132.37 2f91 s HIS 40 Ca 0.02 0.23 0.00 0.00 0.25 0.00 0.00 55.06 55.56 2f91 s HIS 40 Cb -0.16 -3.96 0.00 0.00 -1.18 0.00 0.00 32.58 27.28 2f91 s HIS 40 CO -0.04 -3.96 0.00 1.97 -0.65 0.00 0.00 174.74 172.06 2f91 n PHE 41 N 6.22 0.00 -3.67 3.88 1.16 -0.57 -4.99 117.46 119.49 2f91 n PHE 41 Ca 0.17 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.64 2f91 n PHE 41 Cb 0.41 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.24 2f91 n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2f91 s GLY 43 N -2.82 1.79 0.32 0.00 0.00 0.10 -1.00 107.32 105.71 2f91 s GLY 43 Ca 0.04 -1.62 -0.19 0.00 0.00 0.00 0.00 44.72 42.95 2f91 s GLY 43 CO -0.11 -1.18 0.75 0.00 0.00 0.00 0.00 173.10 172.56 2f91 s ALA 44 N -2.92 -1.04 0.01 3.20 0.00 -0.96 -3.52 121.76 116.53 2f91 s ALA 44 Ca 0.62 -0.48 0.03 0.00 0.00 0.00 0.00 51.96 52.13 2f91 s ALA 44 Cb -0.07 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 23.81 2f91 s ALA 44 CO 0.41 -1.02 -0.11 -1.12 0.00 0.00 0.00 175.76 173.92 2f91 s SER 45 N -2.98 1.26 -0.10 0.00 0.01 -0.31 -0.92 113.70 110.66 2f91 s SER 45 Ca 0.13 -0.30 -0.30 0.00 1.31 0.00 0.00 55.95 56.79 2f91 s SER 45 Cb -0.06 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.05 2f91 s SER 45 CO 0.09 0.06 1.19 -0.63 0.41 0.00 0.00 173.24 174.35 2f91 s ILE 46 N -0.53 4.35 -0.23 1.44 1.01 -0.40 -0.65 121.20 126.19 2f91 s ILE 46 Ca 0.02 1.65 -0.16 0.00 0.00 0.00 0.00 60.65 62.15 2f91 s ILE 46 Cb -0.06 -4.06 -0.17 0.00 0.01 0.00 0.00 42.46 38.18 2f91 s ILE 46 CO 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 174.94 174.89 2f91 n TYR 47 N 5.64 0.63 -3.39 3.97 9.36 -0.25 -1.88 117.16 131.24 2f91 n TYR 47 Ca 0.12 0.25 -0.00 0.00 3.32 0.00 0.00 57.90 61.58 2f91 n TYR 47 Cb 0.46 -1.07 -0.00 0.00 -0.63 0.00 0.00 39.34 38.10 2f91 n TYR 47 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2f91 n ASN 48 N -4.22 -0.01 0.23 2.98 0.23 -1.02 -4.69 115.26 108.75 2f91 n ASN 48 Ca -0.41 -1.01 0.16 0.00 -0.53 0.00 0.00 54.58 52.78 2f91 n ASN 48 Cb 0.80 0.02 0.66 0.00 -2.08 0.00 0.00 39.78 39.19 2f91 n ASN 48 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2f91 h GLU 49 N 0.00 0.00 -0.01 -3.83 9.09 -1.98 -3.02 114.58 114.84 2f91 h GLU 49 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2f91 h GLU 49 Cb 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 2f91 h GLU 49 CO 0.00 0.00 -0.15 0.09 0.05 0.00 0.00 179.01 179.00 2f91 n ASN 50 N -2.76 1.15 -3.90 3.06 3.02 -1.26 -0.75 115.26 113.81 2f91 n ASN 50 Ca 0.01 -1.07 -0.15 0.00 -0.03 0.00 0.00 54.58 53.33 2f91 n ASN 50 Cb 0.25 0.42 -0.15 0.00 -0.61 0.00 0.00 39.78 39.69 2f91 n ASN 50 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2f91 s TYR 51 N -1.14 0.29 0.14 3.10 2.02 -1.14 -1.06 117.35 119.56 2f91 s TYR 51 Ca 0.07 -0.04 0.08 0.00 -0.37 0.00 0.00 57.07 56.81 2f91 s TYR 51 Cb 0.07 -0.23 -0.04 0.00 -0.40 0.00 0.00 41.96 41.36 2f91 s TYR 51 CO 0.20 -0.03 -0.12 0.00 -1.57 0.00 0.00 175.55 174.03 2f91 s ALA 52 N 0.15 2.88 -0.16 3.71 0.00 -0.24 -1.09 121.76 127.01 2f91 s ALA 52 Ca -0.01 -1.36 -0.05 0.00 0.00 0.00 0.00 51.96 50.54 2f91 s ALA 52 Cb -0.04 -0.77 -0.03 0.00 0.00 0.00 0.00 23.12 22.28 2f91 s ALA 52 CO -0.00 0.56 0.00 0.42 0.00 0.00 0.00 175.76 176.74 2f91 s ILE 53 N -1.39 4.28 0.09 0.00 1.01 0.18 -0.76 121.20 124.61 2f91 s ILE 53 Ca 0.22 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.66 2f91 s ILE 53 Cb -0.10 -2.89 -0.00 0.00 0.01 0.00 0.00 42.46 39.47 2f91 s ILE 53 CO 0.13 0.49 0.10 1.07 0.00 0.00 0.00 174.94 176.73 2f91 n THR 54 N 3.43 0.00 -2.89 2.92 5.66 -0.29 -1.16 114.28 121.95 2f91 n THR 54 Ca -0.17 -0.61 -0.33 0.00 -3.05 0.00 0.00 64.05 59.89 2f91 n THR 54 Cb 0.52 0.32 -0.07 0.00 -1.55 0.00 0.00 70.33 69.56 2f91 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2f91 s ALA 55 N -2.20 3.13 0.22 1.79 0.00 -1.26 -1.45 121.76 121.98 2f91 s ALA 55 Ca 0.10 0.33 -0.07 0.00 0.00 0.00 0.00 51.96 52.33 2f91 s ALA 55 Cb 0.00 -3.07 0.19 0.00 0.00 0.00 0.00 23.12 20.25 2f91 s ALA 55 CO 0.07 0.18 1.79 0.78 0.00 0.00 0.00 175.76 178.58 2f91 h GLY 56 N 2.16 1.25 2.00 0.00 0.00 -1.69 -2.86 103.07 103.92 2f91 h GLY 56 Ca -0.48 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.17 2f91 h GLY 56 CO 0.62 0.64 0.00 -2.39 0.00 0.00 0.00 176.54 175.41 2f91 n HIS 57 N -4.28 0.83 0.31 5.60 1.44 -1.26 -1.53 115.22 116.34 2f91 n HIS 57 Ca 0.07 0.33 0.16 0.00 -2.01 0.00 0.00 57.72 56.27 2f91 n HIS 57 Cb 0.19 -1.03 0.65 0.00 0.12 0.00 0.00 29.99 29.92 2f91 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2f91 n VAL 59 N -2.85 0.00 -1.65 0.00 0.24 -0.72 -5.06 118.33 108.29 2f91 n VAL 59 Ca 0.01 -0.27 -0.51 0.00 -2.04 0.00 0.00 64.34 61.53 2f91 n VAL 59 Cb 0.28 0.80 -0.05 0.00 -1.47 0.00 0.00 33.84 33.39 2f91 n VAL 59 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2f91 n TYR 60 N -0.94 2.00 0.00 6.34 9.36 -0.58 -4.85 117.16 128.48 2f91 n TYR 60 Ca 0.00 0.39 0.00 0.00 3.32 0.00 0.00 57.90 61.61 2f91 n TYR 60 Cb 0.00 -2.48 0.00 0.00 -0.63 0.00 0.00 39.34 36.23 2f91 n TYR 60 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2f91 n GLY 60 N 3.48 0.61 3.14 2.98 0.00 -1.26 -5.06 105.19 109.09 2f91 n GLY 60 Ca 0.20 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2f91 n GLY 60 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2f91 s ASP 60 N -1.12 5.52 0.30 1.61 -1.08 -1.26 -5.22 116.67 115.41 2f91 s ASP 60 Ca 0.00 -2.71 0.01 0.00 -0.52 0.00 0.00 52.55 49.33 2f91 s ASP 60 Cb 0.00 -1.92 0.48 0.00 -1.46 0.00 0.00 42.92 40.02 2f91 s ASP 60 CO 0.00 -0.44 1.86 1.88 0.52 0.00 0.00 175.17 178.99 2f91 h TYR 60 N 7.31 0.76 0.00 -5.34 0.05 -1.94 -0.44 116.97 117.36 2f91 h TYR 60 Ca -0.02 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.70 2f91 h TYR 60 Cb 0.98 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 38.50 2f91 h TYR 60 CO 0.75 0.64 -0.54 0.39 -1.05 0.00 0.00 178.16 178.35 2f91 n GLU 60 N -4.29 0.24 -3.11 4.88 -0.58 -1.26 -1.08 120.64 115.44 2f91 n GLU 60 Ca 0.03 0.08 -0.18 0.00 -0.42 0.00 0.00 57.16 56.68 2f91 n GLU 60 Cb 0.21 -1.66 -0.02 0.00 -0.57 0.00 0.00 31.44 29.40 2f91 n GLU 60 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2f91 n ASN 60 N -2.01 0.06 -4.77 1.62 3.02 -0.63 -4.79 115.26 107.76 2f91 n ASN 60 Ca 0.04 -3.03 -0.40 0.00 -0.03 0.00 0.00 54.58 51.16 2f91 n ASN 60 Cb 0.42 -0.17 -0.02 0.00 -0.61 0.00 0.00 39.78 39.40 2f91 n ASN 60 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2f91 s PRO 61 N -1.61 4.19 -0.07 3.52 0.04 -0.27 -4.75 135.00 136.05 2f91 s PRO 61 Ca 0.36 2.07 0.03 0.00 0.04 0.00 0.00 61.00 63.50 2f91 s PRO 61 Cb 0.29 -2.89 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 2f91 s PRO 61 CO -0.09 -0.28 -0.14 -1.12 0.04 0.00 0.00 177.00 175.41 2f91 s SER 62 N -0.75 4.03 -1.27 6.66 0.01 -1.26 -4.73 113.70 116.39 2f91 s SER 62 Ca 0.53 -0.23 -0.03 0.00 1.31 0.00 0.00 55.95 57.53 2f91 s SER 62 Cb -0.36 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 64.83 2f91 s SER 62 CO 0.47 0.30 0.40 0.61 0.41 0.00 0.00 173.24 175.44 2f91 n GLY 63 N 2.61 -0.28 3.28 3.44 0.00 -1.26 -4.94 105.19 108.04 2f91 n GLY 63 Ca -0.17 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 2f91 n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f91 s LEU 64 N -5.29 2.05 0.10 0.99 1.43 -1.26 -1.54 118.68 115.15 2f91 s LEU 64 Ca 0.20 -0.44 -0.11 0.00 -1.03 0.00 0.00 54.13 52.74 2f91 s LEU 64 Cb -0.09 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.88 2f91 s LEU 64 CO 0.25 0.29 0.27 0.00 0.23 0.00 0.00 176.35 177.39 2f91 s GLN 65 N -0.51 0.93 0.18 1.70 -2.07 -0.44 -1.29 119.66 118.16 2f91 s GLN 65 Ca 0.08 -0.87 0.08 0.00 -1.82 0.00 0.00 55.36 52.82 2f91 s GLN 65 Cb -0.10 0.39 -0.04 0.00 -1.09 0.00 0.00 33.01 32.17 2f91 s GLN 65 CO -0.00 -0.33 -0.03 0.96 -1.32 0.00 0.00 175.29 174.57 2f91 s ILE 66 N -3.84 3.54 -0.17 3.63 -5.25 0.10 -0.80 121.20 118.41 2f91 s ILE 66 Ca 0.04 -1.52 0.01 0.00 -0.99 0.00 0.00 60.65 58.19 2f91 s ILE 66 Cb 0.04 -2.78 0.03 0.00 2.95 0.00 0.00 42.46 42.70 2f91 s ILE 66 CO -0.11 -0.12 -0.13 -0.69 -1.79 0.00 0.00 174.94 172.10 2f91 s VAL 67 N -1.75 1.60 0.24 8.37 1.01 0.34 -1.14 120.40 129.07 2f91 s VAL 67 Ca 0.27 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.51 2f91 s VAL 67 Cb -0.09 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 2f91 s VAL 67 CO 0.18 0.34 0.37 0.00 0.00 0.00 0.00 175.10 175.98 2f91 s ALA 68 N 1.45 3.92 -1.27 5.51 0.00 0.03 -1.56 121.76 129.83 2f91 s ALA 68 Ca 0.03 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 50.78 2f91 s ALA 68 Cb -0.14 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.23 2f91 s ALA 68 CO -0.10 0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.31 2f91 n GLY 69 N -1.40 0.62 3.89 0.00 0.00 -1.26 -0.89 105.19 106.15 2f91 n GLY 69 Ca -0.09 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 2f91 n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2f91 s GLU 70 N -3.88 3.56 0.05 1.61 2.56 -1.26 -3.31 118.70 118.02 2f91 s GLU 70 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.97 54.85 2f91 s GLU 70 Cb 0.00 -3.06 0.00 0.00 2.00 0.00 0.00 34.13 33.07 2f91 s GLU 70 CO 0.00 0.64 0.00 -0.11 -0.56 0.00 0.00 175.26 175.23 2f91 n LEU 71 N 0.99 0.09 -4.35 2.70 7.94 -1.26 -4.94 117.00 118.17 2f91 n LEU 71 Ca -0.10 0.07 -0.37 0.00 -1.11 0.00 0.00 56.01 54.50 2f91 n LEU 71 Cb 0.53 0.02 -0.13 0.00 0.53 0.00 0.00 43.42 44.37 2f91 n LEU 71 CO 0.42 -0.56 -0.28 -0.62 -1.11 0.00 0.00 177.39 175.24 2f91 s ASP 72 N -4.68 5.07 0.57 1.96 -1.08 -1.26 -1.40 116.67 115.85 2f91 s ASP 72 Ca 0.00 -0.65 0.33 0.00 -0.52 0.00 0.00 52.55 51.71 2f91 s ASP 72 Cb 0.00 -1.87 1.68 0.00 -1.46 0.00 0.00 42.92 41.27 2f91 s ASP 72 CO 0.00 -0.17 2.13 0.24 0.52 0.00 0.00 175.17 177.89 2f91 h MET 73 N 8.22 0.00 -0.09 4.34 2.86 -1.53 -2.64 114.93 126.10 2f91 h MET 73 Ca -0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 2f91 h MET 73 Cb 1.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.79 2f91 h MET 73 CO 0.60 0.06 0.00 -1.13 1.06 0.00 0.00 176.91 177.50 2f91 n SER 74 N -3.35 2.97 -3.81 1.22 3.41 -1.26 -4.79 113.62 108.00 2f91 n SER 74 Ca -0.01 -1.96 -0.18 0.00 -0.26 0.00 0.00 58.87 56.45 2f91 n SER 74 Cb 0.21 -0.04 -0.17 0.00 -0.26 0.00 0.00 64.21 63.95 2f91 n SER 74 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2f91 s VAL 75 N -1.91 0.23 -0.59 -3.33 0.11 -0.99 -5.11 120.40 108.80 2f91 s VAL 75 Ca 0.31 0.09 -0.28 0.00 -2.93 0.00 0.00 61.98 59.17 2f91 s VAL 75 Cb 0.21 -0.34 0.02 0.00 -1.53 0.00 0.00 36.38 34.74 2f91 s VAL 75 CO 0.30 0.17 1.31 0.20 -3.33 0.00 0.00 175.10 173.76 2f91 s ASN 76 N 1.23 6.26 0.00 3.54 0.02 -1.26 -4.63 114.94 120.09 2f91 s ASN 76 Ca -0.07 0.11 0.26 0.00 -1.02 0.00 0.00 52.86 52.14 2f91 s ASN 76 Cb -0.13 -2.55 0.60 0.00 0.02 0.00 0.00 41.25 39.19 2f91 s ASN 76 CO -0.02 -1.64 1.47 -0.62 0.02 0.00 0.00 177.10 176.31 2f91 n GLU 77 N 8.67 0.36 0.00 -0.60 4.71 -1.26 -4.96 120.64 127.56 2f91 n GLU 77 Ca 0.10 -0.21 0.00 0.00 -0.01 0.00 0.00 57.16 57.03 2f91 n GLU 77 Cb 0.49 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.43 2f91 n GLU 77 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2f91 n GLY 78 N 1.43 0.67 0.65 0.62 0.00 -1.26 -4.91 105.19 102.39 2f91 n GLY 78 Ca 0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.18 2f91 n GLY 78 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2f91 n SER 79 N 0.00 2.41 -4.75 1.61 3.41 -1.26 -4.99 113.62 110.05 2f91 n SER 79 Ca 0.00 -1.69 -0.41 0.00 -0.26 0.00 0.00 58.87 56.51 2f91 n SER 79 Cb 0.00 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 2f91 n SER 79 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2f91 s GLU 80 N -1.26 4.38 -0.21 4.33 8.01 -1.21 -4.15 118.70 128.59 2f91 s GLU 80 Ca 0.20 2.10 0.01 0.00 0.01 0.00 0.00 54.97 57.29 2f91 s GLU 80 Cb 0.13 -3.15 0.05 0.00 -4.31 0.00 0.00 34.13 26.85 2f91 s GLU 80 CO 0.20 -0.22 -0.08 -0.65 0.01 0.00 0.00 175.26 174.51 2f91 s GLN 81 N -0.64 1.82 -0.24 1.61 -0.21 -0.07 -4.97 119.66 116.96 2f91 s GLN 81 Ca 0.54 -0.86 -0.11 0.00 0.02 0.00 0.00 55.36 54.95 2f91 s GLN 81 Cb -0.38 -2.43 -0.05 0.00 1.00 0.00 0.00 33.01 31.15 2f91 s GLN 81 CO 0.42 -0.49 0.18 0.42 -2.12 0.00 0.00 175.29 173.70 2f91 s ILE 82 N 1.42 5.34 -0.04 1.08 1.01 -1.26 -0.79 121.20 127.96 2f91 s ILE 82 Ca -0.03 0.21 0.01 0.00 0.00 0.00 0.00 60.65 60.84 2f91 s ILE 82 Cb -0.17 -3.52 0.02 0.00 0.01 0.00 0.00 42.46 38.80 2f91 s ILE 82 CO -0.07 0.32 -0.02 -0.63 0.00 0.00 0.00 174.94 174.54 2f91 s ILE 83 N 1.20 0.36 0.58 2.92 1.01 -0.29 -4.99 121.20 121.98 2f91 s ILE 83 Ca 0.08 -0.01 -0.18 0.00 0.00 0.00 0.00 60.65 60.54 2f91 s ILE 83 Cb -0.14 -0.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.86 2f91 s ILE 83 CO 0.06 0.19 1.12 0.42 0.00 0.00 0.00 174.94 176.73 2f91 s THR 84 N 1.03 3.22 -0.10 2.92 -4.23 -1.26 -0.73 115.64 116.49 2f91 s THR 84 Ca -0.10 0.70 -0.25 0.00 -1.18 0.00 0.00 61.69 60.86 2f91 s THR 84 Cb -0.14 -3.24 -0.03 0.00 1.34 0.00 0.00 72.50 70.43 2f91 s THR 84 CO -0.01 -0.22 0.78 -0.69 -0.54 0.00 0.00 174.62 173.94 2f91 s VAL 85 N -1.95 4.96 -0.13 2.29 1.01 -0.41 -0.61 120.40 125.56 2f91 s VAL 85 Ca 0.71 1.57 0.20 0.00 0.00 0.00 0.00 61.98 64.46 2f91 s VAL 85 Cb -0.23 -4.10 -0.29 0.00 0.00 0.00 0.00 36.38 31.77 2f91 s VAL 85 CO 0.31 0.15 0.25 -1.54 0.00 0.00 0.00 175.10 174.27 2f91 n SER 86 N 4.39 0.02 -3.71 3.32 3.41 0.25 -4.71 113.62 116.59 2f91 n SER 86 Ca 0.02 0.01 -0.14 0.00 -0.26 0.00 0.00 58.87 58.49 2f91 n SER 86 Cb 0.50 1.40 -0.09 0.00 -0.26 0.00 0.00 64.21 65.77 2f91 n SER 86 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2f91 s LYS 87 N -2.93 0.66 -0.12 4.33 -0.14 -1.09 -4.39 119.74 116.05 2f91 s LYS 87 Ca -0.09 0.17 0.00 0.00 -1.36 0.00 0.00 55.97 54.69 2f91 s LYS 87 Cb 0.09 0.30 -0.02 0.00 -1.68 0.00 0.00 37.83 36.53 2f91 s LYS 87 CO 0.86 -0.16 -0.13 0.42 -0.76 0.00 0.00 175.35 175.59 2f91 s ILE 88 N -0.71 3.08 -0.50 2.17 1.01 -0.24 -0.92 121.20 125.10 2f91 s ILE 88 Ca -0.08 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 59.93 2f91 s ILE 88 Cb -0.04 -2.29 0.13 0.00 0.01 0.00 0.00 42.46 40.27 2f91 s ILE 88 CO 0.04 0.53 0.26 -0.63 0.00 0.00 0.00 174.94 175.13 2f91 s ILE 89 N 0.27 2.86 0.06 2.92 1.01 0.06 -4.69 121.20 123.68 2f91 s ILE 89 Ca -0.09 -2.95 -0.23 0.00 0.00 0.00 0.00 60.65 57.38 2f91 s ILE 89 Cb -0.15 -2.97 -0.06 0.00 0.01 0.00 0.00 42.46 39.29 2f91 s ILE 89 CO 0.05 -0.77 0.70 -0.22 0.00 0.00 0.00 174.94 174.70 2f91 s LEU 90 N 0.10 4.48 0.07 2.97 2.96 -1.26 -0.59 118.68 127.41 2f91 s LEU 90 Ca 0.15 1.39 -0.35 0.00 -0.22 0.00 0.00 54.13 55.10 2f91 s LEU 90 Cb -0.23 -3.13 -0.14 0.00 0.50 0.00 0.00 46.19 43.19 2f91 s LEU 90 CO -0.03 0.10 1.58 1.57 -1.32 0.00 0.00 176.35 178.26 2f91 n HIS 91 N 2.42 2.06 0.53 5.38 -0.00 -0.97 -4.83 115.22 119.81 2f91 n HIS 91 Ca -0.05 0.34 0.10 0.00 -0.00 0.00 0.00 57.72 58.12 2f91 n HIS 91 Cb 0.50 -2.50 0.43 0.00 -0.00 0.00 0.00 29.99 28.42 2f91 n HIS 91 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2f91 n GLU 92 N 3.87 0.10 -0.59 1.57 -0.58 -1.26 -1.49 120.64 122.26 2f91 n GLU 92 Ca 0.19 0.28 0.08 0.00 -0.42 0.00 0.00 57.16 57.30 2f91 n GLU 92 Cb 0.25 -1.68 0.31 0.00 -0.57 0.00 0.00 31.44 29.75 2f91 n GLU 92 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2f91 n ASN 93 N -1.87 4.48 -4.62 1.62 5.03 -1.26 -5.00 115.26 113.64 2f91 n ASN 93 Ca 0.04 -2.97 -0.47 0.00 0.87 0.00 0.00 54.58 52.04 2f91 n ASN 93 Cb 0.24 -0.59 -0.03 0.00 -1.02 0.00 0.00 39.78 38.38 2f91 n ASN 93 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 2f91 n PHE 94 N -0.12 1.69 -3.83 3.10 7.35 -0.56 -4.63 117.46 120.46 2f91 n PHE 94 Ca 0.23 0.57 -0.36 0.00 -0.76 0.00 0.00 57.45 57.13 2f91 n PHE 94 Cb 0.99 -2.36 -0.13 0.00 0.35 0.00 0.00 39.48 38.33 2f91 n PHE 94 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2f91 s ASP 95 N 0.08 5.00 0.52 -2.13 -1.08 -0.73 -4.98 116.67 113.35 2f91 s ASP 95 Ca 0.70 -1.03 0.30 0.00 -0.52 0.00 0.00 52.55 52.00 2f91 s ASP 95 Cb -0.75 -1.80 1.38 0.00 -1.46 0.00 0.00 42.92 40.29 2f91 s ASP 95 CO 0.52 -0.25 2.01 0.10 0.52 0.00 0.00 175.17 178.07 2f91 h TYR 96 N 8.14 0.00 0.00 -5.34 -0.00 -1.93 0.12 116.97 117.95 2f91 h TYR 96 Ca -0.26 0.00 -0.11 0.00 0.00 0.00 0.00 58.73 58.36 2f91 h TYR 96 Cb 1.09 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.81 2f91 h TYR 96 CO 0.60 0.11 -0.78 -0.91 -0.00 0.00 0.00 178.16 177.17 2f91 h ASN 97 N 0.00 0.00 0.38 0.10 -0.26 -1.98 -3.41 115.58 110.41 2f91 h ASN 97 Ca -0.00 -0.33 0.00 0.00 -0.56 0.00 0.00 56.30 55.41 2f91 h ASN 97 Cb 0.46 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.72 2f91 h ASN 97 CO 0.01 1.11 -0.57 0.18 -1.06 0.00 0.00 177.43 177.10 2f91 n LEU 98 N -4.54 0.66 -1.38 1.61 4.77 -1.22 -4.96 117.00 111.94 2f91 n LEU 98 Ca -0.19 -0.12 -0.12 0.00 -0.03 0.00 0.00 56.01 55.55 2f91 n LEU 98 Cb 0.46 -0.19 -0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2f91 n LEU 98 CO 0.16 0.16 -0.14 0.18 -1.33 0.00 0.00 177.39 176.42 2f91 n LEU 99 N -1.40 -1.59 -4.77 2.23 4.77 0.40 -5.00 117.00 111.63 2f91 n LEU 99 Ca 0.06 -0.02 -0.39 0.00 -0.03 0.00 0.00 56.01 55.62 2f91 n LEU 99 Cb 0.34 -1.88 -0.01 0.00 -2.33 0.00 0.00 43.42 39.54 2f91 n LEU 99 CO 0.36 -0.10 0.93 -0.62 -1.33 0.00 0.00 177.39 176.63 2f91 s ASP 100 N -2.50 6.32 -1.37 -1.43 2.15 -1.25 -3.56 116.67 115.02 2f91 s ASP 100 Ca 0.01 2.59 -0.05 0.00 0.43 0.00 0.00 52.55 55.53 2f91 s ASP 100 Cb -0.01 -2.63 0.03 0.00 -0.30 0.00 0.00 42.92 40.01 2f91 s ASP 100 CO 0.02 -0.84 0.84 0.59 -0.17 0.00 0.00 175.17 175.61 2f91 n ASN 101 N 0.07 -2.69 -4.20 -0.34 3.02 -1.26 -1.78 115.26 108.08 2f91 n ASN 101 Ca 0.04 -0.77 -0.43 0.00 -0.03 0.00 0.00 54.58 53.39 2f91 n ASN 101 Cb 0.44 -4.15 0.00 0.00 -0.61 0.00 0.00 39.78 35.47 2f91 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2f91 n ASP 102 N -2.99 4.61 -3.72 6.41 2.03 -1.23 -4.27 116.55 117.39 2f91 n ASP 102 Ca -0.17 -2.92 -0.14 0.00 0.52 0.00 0.00 54.79 52.08 2f91 n ASP 102 Cb 0.62 -1.67 -0.09 0.00 -0.72 0.00 0.00 41.12 39.26 2f91 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2f91 s ILE 103 N 3.22 0.02 0.05 5.18 2.07 -1.26 -3.59 121.20 126.88 2f91 s ILE 103 Ca 0.49 -0.17 -0.09 0.00 -1.41 0.00 0.00 60.65 59.47 2f91 s ILE 103 Cb 0.07 -0.65 0.00 0.00 0.13 0.00 0.00 42.46 42.02 2f91 s ILE 103 CO 0.00 -0.09 0.20 -0.55 -1.91 0.00 0.00 174.94 172.59 2f91 s SER 104 N -0.48 0.05 0.08 4.50 0.15 -0.53 -2.29 113.70 115.17 2f91 s SER 104 Ca -0.06 -0.42 0.02 0.00 0.70 0.00 0.00 55.95 56.19 2f91 s SER 104 Cb -0.03 0.30 -0.04 0.00 -1.71 0.00 0.00 66.02 64.54 2f91 s SER 104 CO 0.03 -0.59 0.11 -0.76 1.20 0.00 0.00 173.24 173.22 2f91 s LEU 105 N -2.24 3.91 -0.22 3.45 1.43 0.24 -1.13 118.68 124.12 2f91 s LEU 105 Ca -0.03 0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.10 2f91 s LEU 105 Cb 0.00 -2.58 0.02 0.00 0.03 0.00 0.00 46.19 43.66 2f91 s LEU 105 CO -0.05 0.17 -0.11 -0.76 0.23 0.00 0.00 176.35 175.83 2f91 s LEU 106 N -2.42 2.74 -0.03 1.79 1.43 0.06 -0.76 118.68 121.49 2f91 s LEU 106 Ca 0.30 -0.70 -0.24 0.00 -1.03 0.00 0.00 54.13 52.47 2f91 s LEU 106 Cb -0.12 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 2f91 s LEU 106 CO 0.23 -0.06 0.71 -0.75 0.23 0.00 0.00 176.35 176.72 2f91 s LYS 107 N 1.34 4.44 0.17 1.70 2.20 -0.09 -1.08 119.74 128.41 2f91 s LYS 107 Ca 0.03 0.93 -0.07 0.00 -0.36 0.00 0.00 55.97 56.50 2f91 s LYS 107 Cb -0.15 -3.41 -0.06 0.00 -1.51 0.00 0.00 37.83 32.70 2f91 s LYS 107 CO -0.07 0.16 0.44 -0.51 -0.36 0.00 0.00 175.35 175.01 2f91 s LEU 108 N 0.43 4.24 0.51 5.43 1.43 -0.22 -0.58 118.68 129.92 2f91 s LEU 108 Ca 0.37 0.72 0.32 0.00 -1.03 0.00 0.00 54.13 54.51 2f91 s LEU 108 Cb -0.19 -3.41 1.23 0.00 0.03 0.00 0.00 46.19 43.85 2f91 s LEU 108 CO 0.20 0.02 1.92 0.77 0.23 0.00 0.00 176.35 179.49 2f91 h SER 109 N 2.79 0.00 -5.46 2.29 4.64 -1.17 -3.43 113.55 113.21 2f91 h SER 109 Ca -0.46 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.66 2f91 h SER 109 Cb 1.17 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.15 2f91 h SER 109 CO 0.71 0.00 -0.32 -0.83 -0.87 0.00 0.00 176.83 175.52 2f91 s GLY 110 N -4.12 1.16 0.25 -0.77 0.00 -1.26 -5.04 107.32 97.54 2f91 s GLY 110 Ca 0.02 -1.37 -0.23 0.00 0.00 0.00 0.00 44.72 43.14 2f91 s GLY 110 CO 0.54 -1.02 0.82 -0.56 0.00 0.00 0.00 173.10 172.88 2f91 s SER 111 N -3.14 7.22 0.59 1.64 0.01 -1.26 -4.81 113.70 113.96 2f91 s SER 111 Ca 0.31 1.62 -0.18 0.00 1.31 0.00 0.00 55.95 59.01 2f91 s SER 111 Cb 0.02 -2.50 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 2f91 s SER 111 CO 0.14 0.02 1.17 -0.76 0.41 0.00 0.00 173.24 174.22 2f91 s LEU 112 N -1.87 3.64 -0.34 2.44 1.43 0.07 -5.03 118.68 119.02 2f91 s LEU 112 Ca 0.45 2.27 -0.13 0.00 -1.03 0.00 0.00 54.13 55.68 2f91 s LEU 112 Cb -0.18 -4.59 -0.02 0.00 0.03 0.00 0.00 46.19 41.43 2f91 s LEU 112 CO 0.23 -1.51 0.24 -0.89 0.23 0.00 0.00 176.35 174.65 2f91 s THR 113 N -1.77 5.29 0.26 5.49 2.01 -1.26 -4.86 115.64 120.80 2f91 s THR 113 Ca 0.74 -0.20 -0.23 0.00 0.31 0.00 0.00 61.69 62.32 2f91 s THR 113 Cb -0.27 -3.71 -0.09 0.00 0.01 0.00 0.00 72.50 68.44 2f91 s THR 113 CO 0.33 -0.00 0.82 -0.36 -0.69 0.00 0.00 174.62 174.71 2f91 s PHE 114 N 1.73 3.68 0.00 4.92 0.08 -1.26 -4.82 117.98 122.31 2f91 s PHE 114 Ca 0.06 1.57 0.00 0.00 0.12 0.00 0.00 56.93 58.68 2f91 s PHE 114 Cb -0.17 -2.75 0.00 0.00 -0.57 0.00 0.00 43.02 39.52 2f91 s PHE 114 CO 0.11 0.29 0.00 0.27 -0.10 0.00 0.00 175.22 175.79 2f91 n ASN 115 N 0.69 0.00 0.26 1.36 0.23 -0.10 -4.97 115.26 112.74 2f91 n ASN 115 Ca -0.01 -0.61 0.14 0.00 -0.53 0.00 0.00 54.58 53.58 2f91 n ASN 115 Cb 0.51 0.00 0.71 0.00 -2.08 0.00 0.00 39.78 38.92 2f91 n ASN 115 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2f91 h ASP 116 N 0.00 0.00 -0.02 0.53 3.32 -1.99 -2.89 116.42 115.38 2f91 h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2f91 h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2f91 h ASP 116 CO 0.00 0.11 -0.27 0.59 -1.72 0.00 0.00 179.24 177.95 2f91 n ASN 117 N -3.43 1.99 -3.58 6.45 3.02 -1.26 -4.64 115.26 113.81 2f91 n ASN 117 Ca -0.01 -1.49 -0.22 0.00 -0.03 0.00 0.00 54.58 52.83 2f91 n ASN 117 Cb 0.27 0.34 -0.15 0.00 -0.61 0.00 0.00 39.78 39.63 2f91 n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2f91 s VAL 118 N -1.94 -0.19 -0.07 2.41 1.01 -1.09 -4.10 120.40 116.43 2f91 s VAL 118 Ca 0.17 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.80 2f91 s VAL 118 Cb 0.15 -0.55 0.09 0.00 0.00 0.00 0.00 36.38 36.07 2f91 s VAL 118 CO 0.39 -0.18 0.78 0.00 0.00 0.00 0.00 175.10 176.10 2f91 s ALA 119 N 2.23 -1.81 0.72 5.51 0.00 -0.81 -0.92 121.76 126.68 2f91 s ALA 119 Ca 0.04 1.33 -0.13 0.00 0.00 0.00 0.00 51.96 53.19 2f91 s ALA 119 Cb -0.15 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.87 2f91 s ALA 119 CO -0.09 -0.40 1.12 -2.14 0.00 0.00 0.00 175.76 174.25 2f91 s PRO 120 N -1.45 2.44 -0.18 0.00 0.02 -1.26 -2.75 135.00 131.82 2f91 s PRO 120 Ca -0.07 1.40 -0.09 0.00 0.02 0.00 0.00 61.00 62.27 2f91 s PRO 120 Cb -0.00 -1.90 -0.05 0.00 0.02 0.00 0.00 34.50 32.57 2f91 s PRO 120 CO 0.05 -1.53 0.12 -1.50 -0.33 0.00 0.00 177.00 173.80 2f91 s ILE 121 N -2.45 5.29 0.49 2.83 2.07 -0.79 -4.78 121.20 123.86 2f91 s ILE 121 Ca 0.67 0.14 -0.22 0.00 -1.41 0.00 0.00 60.65 59.82 2f91 s ILE 121 Cb -0.21 -3.38 -0.06 0.00 0.13 0.00 0.00 42.46 38.94 2f91 s ILE 121 CO 0.47 0.49 1.24 0.00 -1.91 0.00 0.00 174.94 175.23 2f91 s ALA 122 N 0.02 2.92 0.56 1.50 0.00 -1.26 -4.75 121.76 120.75 2f91 s ALA 122 Ca 0.09 1.10 -0.14 0.00 0.00 0.00 0.00 51.96 53.00 2f91 s ALA 122 Cb -0.11 -3.46 -0.06 0.00 0.00 0.00 0.00 23.12 19.48 2f91 s ALA 122 CO -0.00 -0.95 1.00 -0.51 0.00 0.00 0.00 175.76 175.30 2f91 s LEU 123 N -3.22 3.47 0.97 0.00 1.43 -1.26 -0.84 118.68 119.23 2f91 s LEU 123 Ca 0.67 1.52 -0.14 0.00 -1.03 0.00 0.00 54.13 55.15 2f91 s LEU 123 Cb -0.33 -4.49 0.17 0.00 0.03 0.00 0.00 46.19 41.56 2f91 s LEU 123 CO 0.40 -0.71 1.16 -2.16 0.23 0.00 0.00 176.35 175.26 2f91 s PRO 124 N -4.49 0.68 0.47 1.29 0.04 -1.26 -4.84 135.00 126.88 2f91 s PRO 124 Ca 0.58 0.15 -0.22 0.00 0.04 0.00 0.00 61.00 61.54 2f91 s PRO 124 Cb -0.10 -1.80 -0.07 0.00 0.04 0.00 0.00 34.50 32.56 2f91 s PRO 124 CO 0.40 -2.48 1.14 -1.21 0.04 0.00 0.00 177.00 174.89 2f91 s GLU 125 N -5.37 3.72 0.22 4.56 2.02 -1.26 -4.94 118.70 117.65 2f91 s GLU 125 Ca 0.66 1.69 -0.32 0.00 0.02 0.00 0.00 54.97 57.03 2f91 s GLU 125 Cb -0.13 -2.32 -0.14 0.00 0.10 0.00 0.00 34.13 31.64 2f91 s GLU 125 CO 0.54 -0.56 1.39 0.94 0.02 0.00 0.00 175.26 177.58 2f91 n GLN 126 N -0.63 1.88 -0.27 1.61 -0.06 -1.26 -1.51 117.38 117.14 2f91 n GLN 126 Ca 0.08 0.67 0.00 0.00 -2.00 0.00 0.00 57.00 55.75 2f91 n GLN 126 Cb 0.49 -2.32 0.00 0.00 -4.06 0.00 0.00 30.24 24.35 2f91 n GLN 126 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2f91 n GLY 127 N 2.29 1.91 3.77 1.69 0.00 -0.02 -5.02 105.19 109.81 2f91 n GLY 127 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2f91 n GLY 127 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2f91 s HIS 128 N -3.08 2.68 -0.52 1.61 5.65 -0.57 -4.96 115.29 116.10 2f91 s HIS 128 Ca 0.00 1.26 -0.20 0.00 0.25 0.00 0.00 55.06 56.37 2f91 s HIS 128 Cb 0.00 -3.91 0.06 0.00 -1.18 0.00 0.00 32.58 27.55 2f91 s HIS 128 CO 0.00 -2.68 0.66 0.99 -0.65 0.00 0.00 174.74 173.06 2f91 s THR 129 N -1.15 4.82 0.56 0.89 2.01 -1.26 -4.75 115.64 116.76 2f91 s THR 129 Ca 0.54 -0.46 -0.21 0.00 0.31 0.00 0.00 61.69 61.87 2f91 s THR 129 Cb -0.44 -4.34 -0.04 0.00 0.01 0.00 0.00 72.50 67.69 2f91 s THR 129 CO 0.59 -0.86 1.28 0.00 -0.69 0.00 0.00 174.62 174.94 2f91 s ALA 130 N 2.76 2.71 0.33 7.40 0.00 -1.26 -5.03 121.76 128.67 2f91 s ALA 130 Ca 0.16 1.18 -0.12 0.00 0.00 0.00 0.00 51.96 53.18 2f91 s ALA 130 Cb -0.19 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.44 2f91 s ALA 130 CO 0.12 -1.24 0.62 -0.08 0.00 0.00 0.00 175.76 175.17 2f91 s THR 131 N -1.42 0.00 0.00 0.00 -1.32 -1.26 -5.07 115.64 106.57 2f91 s THR 131 Ca 0.73 -1.27 0.00 0.00 -1.21 0.00 0.00 61.69 59.95 2f91 s THR 131 Cb -0.36 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 68.11 2f91 s THR 131 CO 0.41 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.43 2f91 n GLY 134 N -0.49 -1.23 3.77 6.08 0.00 -1.26 -4.27 105.19 107.78 2f91 n GLY 134 Ca -0.03 -1.56 -0.39 0.00 0.00 0.00 0.00 46.02 44.03 2f91 n GLY 134 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2f91 s ASP 135 N -2.07 6.24 0.23 1.61 1.01 -1.26 -3.95 116.67 118.48 2f91 s ASP 135 Ca 0.00 2.59 0.07 0.00 0.71 0.00 0.00 52.55 55.92 2f91 s ASP 135 Cb 0.00 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 2f91 s ASP 135 CO 0.00 -0.89 -0.11 0.68 0.21 0.00 0.00 175.17 175.06 2f91 s VAL 136 N -1.31 1.64 -0.16 -1.27 -7.23 0.35 -4.64 120.40 107.78 2f91 s VAL 136 Ca 0.59 -2.17 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 2f91 s VAL 136 Cb -0.36 -2.18 0.01 0.00 0.56 0.00 0.00 36.38 34.40 2f91 s VAL 136 CO 0.46 -0.49 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.94 2f91 s ILE 137 N -3.03 2.32 -0.12 -0.62 1.01 -0.37 -1.21 121.20 119.19 2f91 s ILE 137 Ca 0.25 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 60.00 2f91 s ILE 137 Cb 0.01 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 2f91 s ILE 137 CO 0.08 0.53 -0.06 -0.69 0.00 0.00 0.00 174.94 174.80 2f91 s VAL 138 N 0.92 3.74 0.07 2.92 1.01 -0.15 -0.84 120.40 128.07 2f91 s VAL 138 Ca -0.04 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.55 2f91 s VAL 138 Cb -0.15 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 2f91 s VAL 138 CO -0.03 0.54 -0.12 0.42 0.00 0.00 0.00 175.10 175.91 2f91 s THR 139 N -0.15 0.97 0.00 3.92 -4.23 -1.15 -1.21 115.64 113.79 2f91 s THR 139 Ca 0.02 -1.30 0.00 0.00 -1.18 0.00 0.00 61.69 59.23 2f91 s THR 139 Cb -0.13 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.71 2f91 s THR 139 CO 0.03 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.42 2f91 n GLY 140 N 1.23 -0.69 1.19 3.99 0.00 -0.66 -4.36 105.19 105.89 2f91 n GLY 140 Ca -0.21 -1.18 0.08 0.00 0.00 0.00 0.00 46.02 44.71 2f91 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2f91 n TRP 141 N -0.62 1.29 -0.54 1.61 8.01 -1.26 -1.83 117.44 124.09 2f91 n TRP 141 Ca 0.00 -0.83 -0.29 0.00 -1.31 0.00 0.00 57.50 55.06 2f91 n TRP 141 Cb 0.00 -0.38 0.26 0.00 -2.01 0.00 0.00 31.31 29.19 2f91 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2f91 s GLY 142 N -1.60 1.49 0.68 6.99 0.00 -1.24 -4.31 107.32 109.32 2f91 s GLY 142 Ca 0.46 -0.49 -0.17 0.00 0.00 0.00 0.00 44.72 44.53 2f91 s GLY 142 CO 0.11 0.36 1.22 -0.51 0.00 0.00 0.00 173.10 174.28 2f91 s THR 143 N -2.44 2.40 -2.70 0.90 -4.23 0.20 -2.80 115.64 106.96 2f91 s THR 143 Ca 0.69 0.22 0.26 0.00 -1.18 0.00 0.00 61.69 61.67 2f91 s THR 143 Cb -0.19 -2.91 0.39 0.00 1.34 0.00 0.00 72.50 71.13 2f91 s THR 143 CO 0.61 -0.08 1.53 0.35 -0.54 0.00 0.00 174.62 176.49 2f91 n THR 144 N -2.26 0.00 -3.60 3.99 -2.24 -0.40 -1.03 114.28 108.74 2f91 n THR 144 Ca 0.14 -0.35 -0.11 0.00 -2.27 0.00 0.00 64.05 61.45 2f91 n THR 144 Cb 0.50 0.93 -0.04 0.00 -2.10 0.00 0.00 70.33 69.61 2f91 n THR 144 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2f91 s SER 145 N -2.01 -0.29 0.13 3.42 1.04 -1.26 -4.39 113.70 110.34 2f91 s SER 145 Ca 0.33 -0.23 -0.31 0.00 0.48 0.00 0.00 55.95 56.22 2f91 s SER 145 Cb 0.21 0.49 -0.11 0.00 0.10 0.00 0.00 66.02 66.71 2f91 s SER 145 CO 0.32 -0.85 1.83 -0.70 0.98 0.00 0.00 173.24 174.82 2f91 s GLU 146 N -3.66 4.13 -0.27 4.02 2.12 -1.26 -1.40 118.70 122.39 2f91 s GLU 146 Ca 0.02 2.60 0.00 0.00 0.36 0.00 0.00 54.97 57.95 2f91 s GLU 146 Cb 0.01 -3.55 0.00 0.00 0.26 0.00 0.00 34.13 30.85 2f91 s GLU 146 CO -0.11 -0.84 0.00 0.41 -0.54 0.00 0.00 175.26 174.18 2f91 n GLY 147 N 4.22 0.56 0.00 -1.50 0.00 -1.26 -4.99 105.19 102.22 2f91 n GLY 147 Ca 0.18 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2f91 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f91 n GLY 148 N -1.97 1.89 3.95 -0.02 0.00 -0.49 -5.13 105.19 103.42 2f91 n GLY 148 Ca -0.03 -1.98 -0.23 0.00 0.00 0.00 0.00 46.02 43.78 2f91 n GLY 148 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2f91 s ASN 149 N -1.00 6.33 -0.13 1.61 0.01 -1.26 -4.84 114.94 115.66 2f91 s ASN 149 Ca 0.00 0.21 -0.03 0.00 -0.71 0.00 0.00 52.86 52.33 2f91 s ASN 149 Cb 0.00 -1.93 -0.03 0.00 0.41 0.00 0.00 41.25 39.70 2f91 s ASN 149 CO 0.00 -0.10 -0.00 0.42 -1.51 0.00 0.00 177.10 175.91 2f91 s THR 151 N -2.01 4.25 0.34 1.60 -4.23 -1.26 -1.28 115.64 113.06 2f91 s THR 151 Ca 0.36 -0.25 -0.17 0.00 -1.18 0.00 0.00 61.69 60.45 2f91 s THR 151 Cb -0.10 -2.84 -0.09 0.00 1.34 0.00 0.00 72.50 70.81 2f91 s THR 151 CO 0.31 0.54 0.79 -2.16 -0.54 0.00 0.00 174.62 173.56 2f91 s PRO 152 N -0.23 4.09 0.26 3.99 0.04 -1.26 -4.98 135.00 136.91 2f91 s PRO 152 Ca 0.05 0.81 0.16 0.00 0.04 0.00 0.00 61.00 62.06 2f91 s PRO 152 Cb -0.12 -2.41 0.06 0.00 0.04 0.00 0.00 34.50 32.07 2f91 s PRO 152 CO 0.02 0.13 1.38 -0.44 0.04 0.00 0.00 177.00 178.12 2f91 h ASP 153 N 2.26 0.00 -3.37 6.66 5.19 -1.93 -3.45 116.42 121.78 2f91 h ASP 153 Ca -0.48 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.33 2f91 h ASP 153 Cb 1.18 0.00 -0.11 0.00 0.18 0.00 0.00 39.33 40.58 2f91 h ASP 153 CO 0.64 0.46 -0.29 -0.69 -3.12 0.00 0.00 179.24 176.24 2f91 s VAL 154 N -2.98 5.27 0.11 -1.35 1.01 -1.26 -1.21 120.40 119.99 2f91 s VAL 154 Ca 0.03 0.58 -0.36 0.00 0.00 0.00 0.00 61.98 62.24 2f91 s VAL 154 Cb 0.08 -3.66 -0.17 0.00 0.00 0.00 0.00 36.38 32.63 2f91 s VAL 154 CO 0.75 0.34 1.24 -0.11 0.00 0.00 0.00 175.10 177.32 2f91 n LEU 155 N 3.91 1.37 -4.69 3.92 7.94 -0.49 -4.86 117.00 124.09 2f91 n LEU 155 Ca -0.11 1.13 -0.29 0.00 -1.11 0.00 0.00 56.01 55.63 2f91 n LEU 155 Cb 0.52 -1.17 -0.08 0.00 0.53 0.00 0.00 43.42 43.22 2f91 n LEU 155 CO 0.40 -1.26 -0.33 -1.10 -1.11 0.00 0.00 177.39 173.99 2f91 s GLN 156 N 0.12 2.55 0.07 1.96 -1.52 -0.76 -0.84 119.66 121.25 2f91 s GLN 156 Ca 0.81 -0.87 0.08 0.00 -1.95 0.00 0.00 55.36 53.43 2f91 s GLN 156 Cb -0.95 -2.52 -0.03 0.00 -0.22 0.00 0.00 33.01 29.28 2f91 s GLN 156 CO 0.50 0.53 -0.21 -1.59 -0.25 0.00 0.00 175.29 174.26 2f91 s LYS 157 N -2.44 1.28 -0.03 2.91 -2.85 -0.20 -1.65 119.74 116.76 2f91 s LYS 157 Ca 0.26 -1.05 -0.04 0.00 -1.00 0.00 0.00 55.97 54.14 2f91 s LYS 157 Cb -0.11 -1.47 0.01 0.00 -2.06 0.00 0.00 37.83 34.19 2f91 s LYS 157 CO 0.19 0.36 0.10 0.54 0.10 0.00 0.00 175.35 176.64 2f91 s VAL 158 N -0.96 0.02 -0.15 1.79 0.11 -0.35 -0.79 120.40 120.06 2f91 s VAL 158 Ca 0.07 -0.16 -0.11 0.00 -2.93 0.00 0.00 61.98 58.85 2f91 s VAL 158 Cb -0.09 -0.21 -0.05 0.00 -1.53 0.00 0.00 36.38 34.50 2f91 s VAL 158 CO 0.03 -0.09 0.21 -0.89 -3.33 0.00 0.00 175.10 171.03 2f91 s THR 159 N -0.25 5.36 0.02 5.04 2.01 -1.26 -0.97 115.64 125.59 2f91 s THR 159 Ca -0.03 0.38 -0.06 0.00 0.31 0.00 0.00 61.69 62.29 2f91 s THR 159 Cb -0.02 -3.53 -0.01 0.00 0.01 0.00 0.00 72.50 68.94 2f91 s THR 159 CO 0.00 0.47 0.10 0.68 -0.69 0.00 0.00 174.62 175.18 2f91 s VAL 160 N 0.01 0.11 0.46 3.82 -7.23 -0.35 -4.97 120.40 112.27 2f91 s VAL 160 Ca 0.14 -0.94 -0.12 0.00 -1.81 0.00 0.00 61.98 59.25 2f91 s VAL 160 Cb -0.12 -0.69 -0.06 0.00 0.56 0.00 0.00 36.38 36.06 2f91 s VAL 160 CO 0.03 -0.52 0.86 -2.16 -0.31 0.00 0.00 175.10 173.00 2f91 s PRO 161 N -2.11 3.80 0.43 4.82 0.04 -1.26 -0.50 135.00 140.23 2f91 s PRO 161 Ca -0.09 0.63 -0.22 0.00 0.04 0.00 0.00 61.00 61.36 2f91 s PRO 161 Cb -0.04 -2.28 -0.10 0.00 0.04 0.00 0.00 34.50 32.12 2f91 s PRO 161 CO -0.02 -0.16 0.99 -0.51 0.04 0.00 0.00 177.00 177.33 2f91 s LEU 162 N -4.08 3.97 -0.13 -3.56 1.43 -1.25 -1.73 118.68 113.33 2f91 s LEU 162 Ca 0.54 1.81 0.02 0.00 -1.03 0.00 0.00 54.13 55.47 2f91 s LEU 162 Cb -0.10 -4.46 0.00 0.00 0.03 0.00 0.00 46.19 41.66 2f91 s LEU 162 CO 0.34 -0.47 -0.19 -0.69 0.23 0.00 0.00 176.35 175.56 2f91 s VAL 163 N -2.01 2.37 0.74 -1.59 1.01 -0.04 -4.88 120.40 116.00 2f91 s VAL 163 Ca 0.62 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 61.56 2f91 s VAL 163 Cb -0.13 -1.96 0.03 0.00 0.00 0.00 0.00 36.38 34.31 2f91 s VAL 163 CO 0.18 0.54 1.10 -1.54 0.00 0.00 0.00 175.10 175.37 2f91 n SER 164 N 3.85 0.92 -0.29 3.32 3.41 -1.26 -3.96 113.62 119.61 2f91 n SER 164 Ca -0.19 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 2f91 n SER 164 Cb 0.52 -1.47 0.13 0.00 -0.26 0.00 0.00 64.21 63.14 2f91 n SER 164 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2f91 h ASP 165 N -0.34 0.75 -0.53 4.04 3.32 -1.95 0.12 116.42 121.84 2f91 h ASP 165 Ca -0.48 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.52 2f91 h ASP 165 Cb 1.32 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 2f91 h ASP 165 CO 0.47 0.48 0.04 -0.33 -1.72 0.00 0.00 179.24 178.18 2f91 h GLU 166 N 0.89 0.90 -0.61 3.56 4.39 -1.97 -0.30 114.58 121.45 2f91 h GLU 166 Ca 0.35 -0.27 -0.05 0.00 0.34 0.00 0.00 59.36 59.73 2f91 h GLU 166 Cb 0.18 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.72 2f91 h GLU 166 CO -0.18 0.91 0.16 -0.44 -1.16 0.00 0.00 179.01 178.31 2f91 h ASP 167 N 0.78 0.90 -0.09 1.42 3.32 -1.80 -3.00 116.42 117.95 2f91 h ASP 167 Ca 0.15 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 2f91 h ASP 167 Cb 0.48 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2f91 h ASP 167 CO 0.02 0.89 -0.07 0.00 -1.72 0.00 0.00 179.24 178.36 2f91 h ARG 169 N 0.34 0.00 0.00 0.00 3.08 -0.92 -0.35 114.38 116.54 2f91 h ARG 169 Ca 0.07 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 2f91 h ARG 169 Cb 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.39 2f91 h ARG 169 CO 0.02 0.15 -0.15 0.00 -1.07 0.00 0.00 179.97 178.92 2f91 h ALA 170 N 1.85 1.52 0.18 0.04 0.00 -1.38 0.14 119.26 121.61 2f91 h ALA 170 Ca -0.00 -0.13 -0.32 0.00 0.00 0.00 0.00 54.91 54.45 2f91 h ALA 170 Cb 0.38 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.15 2f91 h ALA 170 CO 0.02 0.18 -1.60 -0.44 0.00 0.00 0.00 179.25 177.42 2f91 h ASP 171 N 0.00 0.58 0.00 0.00 3.32 -1.20 -3.42 116.42 115.70 2f91 h ASP 171 Ca -0.00 -0.92 0.00 0.00 0.02 0.00 0.00 57.03 56.13 2f91 h ASP 171 Cb 0.31 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2f91 h ASP 171 CO 0.02 1.72 -0.77 -1.22 -1.72 0.00 0.00 179.24 177.27 2f91 n TYR 172 N -3.72 0.00 0.00 4.55 4.01 -0.82 -5.07 117.16 116.11 2f91 n TYR 172 Ca -0.23 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 2f91 n TYR 172 Cb 1.02 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.98 2f91 n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2f91 n GLY 173 N 1.57 2.62 0.24 2.72 0.00 0.47 -4.67 105.19 108.13 2f91 n GLY 173 Ca 0.00 -1.61 -0.09 0.00 0.00 0.00 0.00 46.02 44.32 2f91 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f91 h ALA 173 N 0.00 -0.10 -0.00 4.61 0.00 -1.93 -2.61 119.26 119.24 2f91 h ALA 173 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2f91 h ALA 173 Cb 0.00 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2f91 h ALA 173 CO 0.00 -0.64 -0.19 -0.25 0.00 0.00 0.00 179.25 178.18 2f91 n ASP 174 N -5.35 0.52 0.09 0.00 8.00 -1.26 -3.57 116.55 114.98 2f91 n ASP 174 Ca -0.02 -0.44 -0.11 0.00 0.71 0.00 0.00 54.79 54.93 2f91 n ASP 174 Cb 0.26 -0.03 -0.09 0.00 -0.02 0.00 0.00 41.12 41.24 2f91 n ASP 174 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2f91 h GLU 175 N 0.52 0.19 -4.62 -1.24 4.57 -1.74 -3.40 114.58 108.86 2f91 h GLU 175 Ca 0.00 -0.28 -0.71 0.00 -1.18 0.00 0.00 59.36 57.19 2f91 h GLU 175 Cb 0.43 0.10 -0.20 0.00 -0.16 0.00 0.00 28.75 28.91 2f91 h GLU 175 CO 0.00 1.08 -0.32 0.42 -1.18 0.00 0.00 179.01 179.01 2f91 s ILE 176 N -2.87 5.18 0.47 2.32 -1.09 -1.17 -5.04 121.20 119.00 2f91 s ILE 176 Ca -0.03 -0.59 -0.06 0.00 -2.23 0.00 0.00 60.65 57.74 2f91 s ILE 176 Cb 0.09 -4.00 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 2f91 s ILE 176 CO 0.85 -0.40 0.79 -0.76 -1.23 0.00 0.00 174.94 174.20 2f91 s LEU 177 N 1.87 3.64 0.43 2.97 1.43 -1.26 -4.94 118.68 122.83 2f91 s LEU 177 Ca 0.08 0.99 0.12 0.00 -1.03 0.00 0.00 54.13 54.29 2f91 s LEU 177 Cb -0.19 -3.93 1.00 0.00 0.03 0.00 0.00 46.19 43.10 2f91 s LEU 177 CO 0.11 -0.56 2.00 0.44 0.23 0.00 0.00 176.35 178.57 2f91 h ASP 178 N 0.38 0.38 0.00 2.29 5.19 -1.98 -0.61 116.42 122.08 2f91 h ASP 178 Ca -0.47 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 2f91 h ASP 178 Cb 1.20 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.63 2f91 h ASP 178 CO 0.62 0.24 0.00 -1.54 -3.12 0.00 0.00 179.24 175.44 2f91 n SER 179 N -4.47 0.00 -4.76 6.45 3.41 -1.26 -4.69 113.62 108.29 2f91 n SER 179 Ca 0.08 -1.65 -0.26 0.00 -0.26 0.00 0.00 58.87 56.78 2f91 n SER 179 Cb 0.29 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.18 2f91 n SER 179 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2f91 s MET 180 N -2.00 2.76 -0.02 4.33 -1.94 -0.24 -0.64 119.30 121.56 2f91 s MET 180 Ca 0.01 -0.96 0.02 0.00 -1.71 0.00 0.00 55.69 53.05 2f91 s MET 180 Cb 0.00 -2.55 0.00 0.00 2.01 0.00 0.00 34.83 34.29 2f91 s MET 180 CO 0.01 0.47 -0.08 -1.50 -0.01 0.00 0.00 175.02 173.90 2f91 s ILE 181 N -1.79 0.69 -0.02 2.53 2.07 0.50 -4.70 121.20 120.47 2f91 s ILE 181 Ca 0.30 -0.33 -0.02 0.00 -1.41 0.00 0.00 60.65 59.19 2f91 s ILE 181 Cb -0.10 -0.61 -0.04 0.00 0.13 0.00 0.00 42.46 41.85 2f91 s ILE 181 CO 0.22 0.21 0.10 0.00 -1.91 0.00 0.00 174.94 173.56 2f91 s ALA 183 N -1.17 -0.66 0.00 0.00 0.00 -0.34 -0.86 121.76 118.73 2f91 s ALA 183 Ca 0.22 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.03 2f91 s ALA 183 Cb -0.12 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.49 2f91 s ALA 183 CO 0.13 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.15 2f91 n GLY 184 N 3.27 2.10 3.76 0.00 0.00 -0.70 -1.20 105.19 112.41 2f91 n GLY 184 Ca -0.16 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.47 2f91 n GLY 184 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2f91 s VAL 185 N -2.00 4.60 0.47 1.61 -7.23 -1.26 -4.41 120.40 112.18 2f91 s VAL 185 Ca 0.00 -0.41 0.13 0.00 -1.81 0.00 0.00 61.98 59.89 2f91 s VAL 185 Cb 0.00 -3.07 0.29 0.00 0.56 0.00 0.00 36.38 34.15 2f91 s VAL 185 CO 0.00 0.39 2.08 1.55 -0.31 0.00 0.00 175.10 178.81 2f91 h PRO 186 N 4.29 0.26 0.00 4.82 0.13 -2.00 -0.83 132.00 138.68 2f91 h PRO 186 Ca -0.49 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2f91 h PRO 186 Cb 1.18 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2f91 h PRO 186 CO 0.60 0.17 0.00 -0.85 -0.23 0.00 0.00 178.00 177.70 2f91 n GLU 186 N -4.49 0.71 -0.40 0.86 0.00 -1.26 -2.49 120.64 113.57 2f91 n GLU 186 Ca 0.02 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.24 2f91 n GLU 186 Cb 0.15 -1.50 -0.01 0.00 0.00 0.00 0.00 31.44 30.08 2f91 n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2f91 n GLY 186 N 1.06 -1.91 0.00 -1.84 0.00 -0.32 -4.36 105.19 97.82 2f91 n GLY 186 Ca 0.19 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.89 2f91 n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f91 n GLY 187 N -1.52 0.18 2.78 -0.02 0.00 0.11 -4.82 105.19 101.91 2f91 n GLY 187 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2f91 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f91 s LYS 188 N -0.93 0.67 0.01 1.61 1.02 -1.26 -3.37 119.74 117.49 2f91 s LYS 188 Ca 0.00 0.06 -0.29 0.00 0.02 0.00 0.00 55.97 55.76 2f91 s LYS 188 Cb 0.00 -1.07 0.11 0.00 -0.52 0.00 0.00 37.83 36.35 2f91 s LYS 188 CO 0.00 -0.32 1.16 0.34 -0.92 0.00 0.00 175.35 175.61 2f91 s ASP 189 N 1.95 -0.12 0.80 2.83 -1.08 -0.70 -4.49 116.67 115.85 2f91 s ASP 189 Ca 0.05 -0.19 -0.11 0.00 -0.52 0.00 0.00 52.55 51.78 2f91 s ASP 189 Cb -0.12 0.27 0.08 0.00 -1.46 0.00 0.00 42.92 41.69 2f91 s ASP 189 CO -0.06 -0.49 1.16 -0.94 0.52 0.00 0.00 175.17 175.36 2f91 s SER 190 N -2.83 4.49 0.10 -0.34 1.04 -1.26 -0.52 113.70 114.37 2f91 s SER 190 Ca 0.12 0.69 -0.03 0.00 0.48 0.00 0.00 55.95 57.21 2f91 s SER 190 Cb 0.02 -1.19 0.01 0.00 0.10 0.00 0.00 66.02 64.97 2f91 s SER 190 CO -0.03 -1.89 0.19 0.00 0.98 0.00 0.00 173.24 172.49 2f91 n GLN 192 N -0.14 2.68 -0.00 0.00 3.00 -1.26 -1.04 117.38 120.62 2f91 n GLN 192 Ca -0.02 0.97 0.00 0.00 -0.01 0.00 0.00 57.00 57.95 2f91 n GLN 192 Cb 0.15 -2.84 0.00 0.00 0.00 0.00 0.00 30.24 27.55 2f91 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2f91 n GLY 193 N 4.11 0.11 0.03 1.08 0.00 -1.26 -0.63 105.19 108.63 2f91 n GLY 193 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2f91 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f91 n ASP 194 N 0.00 0.60 -4.51 1.61 8.00 -0.21 -3.67 116.55 118.37 2f91 n ASP 194 Ca 0.00 -0.26 -0.50 0.00 0.71 0.00 0.00 54.79 54.74 2f91 n ASP 194 Cb 0.00 0.91 -0.04 0.00 -0.02 0.00 0.00 41.12 41.97 2f91 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2f91 n SER 195 N -1.95 0.27 0.00 -2.24 7.64 -1.26 -1.49 113.62 114.60 2f91 n SER 195 Ca 0.02 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.04 2f91 n SER 195 Cb 0.44 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 2f91 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2f91 n GLY 196 N 1.81 2.86 3.95 0.23 0.00 -0.29 0.02 105.19 113.78 2f91 n GLY 196 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2f91 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2f91 s GLY 197 N -1.96 1.75 0.20 -0.02 0.00 -0.55 -3.52 107.32 103.22 2f91 s GLY 197 Ca 0.00 -1.28 -0.19 0.00 0.00 0.00 0.00 44.72 43.25 2f91 s GLY 197 CO 0.00 -0.63 0.69 2.56 0.00 0.00 0.00 173.10 175.72 2f91 s PRO 198 N -5.60 4.20 -0.26 2.90 0.04 -1.26 -0.96 135.00 134.07 2f91 s PRO 198 Ca 0.70 0.80 -0.05 0.00 0.04 0.00 0.00 61.00 62.48 2f91 s PRO 198 Cb -0.05 -2.91 -0.00 0.00 0.04 0.00 0.00 34.50 31.57 2f91 s PRO 198 CO 0.49 0.42 0.03 -1.17 0.04 0.00 0.00 177.00 176.82 2f91 s LEU 199 N -1.92 3.44 -0.16 -3.56 0.20 -0.12 -2.91 118.68 113.65 2f91 s LEU 199 Ca 0.41 -0.55 -0.04 0.00 0.69 0.00 0.00 54.13 54.64 2f91 s LEU 199 Cb -0.17 -1.82 -0.03 0.00 -0.43 0.00 0.00 46.19 43.74 2f91 s LEU 199 CO 0.21 -0.11 -0.04 0.00 -0.29 0.00 0.00 176.35 176.12 2f91 s ALA 200 N 1.49 3.01 0.43 5.97 0.00 -0.02 -1.08 121.76 131.56 2f91 s ALA 200 Ca 0.04 -0.82 0.07 0.00 0.00 0.00 0.00 51.96 51.25 2f91 s ALA 200 Cb -0.16 -1.56 -0.03 0.00 0.00 0.00 0.00 23.12 21.37 2f91 s ALA 200 CO 0.00 0.22 0.26 0.00 0.00 0.00 0.00 175.76 176.24 2f91 s ALA 201 N 0.36 3.84 0.00 0.00 0.00 -0.33 -1.24 121.76 124.39 2f91 s ALA 201 Ca -0.04 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.03 2f91 s ALA 201 Cb -0.14 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.40 2f91 s ALA 201 CO 0.03 -0.22 0.75 -1.13 0.00 0.00 0.00 175.76 175.19 2f91 n SER 202 N -1.39 -0.00 0.09 0.00 3.41 -1.26 -1.47 113.62 112.99 2f91 n SER 202 Ca -0.00 -1.49 0.08 0.00 -0.26 0.00 0.00 58.87 57.20 2f91 n SER 202 Cb 0.64 -0.09 0.39 0.00 -0.26 0.00 0.00 64.21 64.88 2f91 n SER 202 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2f91 n ASP 203 N 0.01 0.37 -0.33 4.04 5.75 -1.26 -1.87 116.55 123.26 2f91 n ASP 203 Ca -0.00 0.63 0.14 0.00 -0.01 0.00 0.00 54.79 55.55 2f91 n ASP 203 Cb 0.60 -0.69 0.64 0.00 -1.03 0.00 0.00 41.12 40.64 2f91 n ASP 203 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2f91 n THR 204 N -1.95 0.02 -0.44 2.12 -2.24 -1.26 -4.88 114.28 105.64 2f91 n THR 204 Ca 0.01 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2f91 n THR 204 Cb 0.12 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 2f91 n THR 204 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f91 n GLY 205 N 1.11 0.73 3.13 3.38 0.00 -0.78 -5.06 105.19 107.70 2f91 n GLY 205 Ca 0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.12 2f91 n GLY 205 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2f91 s SER 206 N -2.77 0.07 0.20 1.61 1.04 -1.24 -5.09 113.70 107.51 2f91 s SER 206 Ca 0.00 -0.34 -0.30 0.00 0.48 0.00 0.00 55.95 55.79 2f91 s SER 206 Cb 0.00 0.24 -0.08 0.00 0.10 0.00 0.00 66.02 66.27 2f91 s SER 206 CO 0.00 -0.46 1.16 -0.89 0.98 0.00 0.00 173.24 174.03 2f91 s THR 207 N -2.05 3.63 0.11 2.02 2.01 -1.26 -4.22 115.64 115.89 2f91 s THR 207 Ca -0.09 1.42 -0.09 0.00 0.31 0.00 0.00 61.69 63.24 2f91 s THR 207 Cb -0.04 -3.90 -0.00 0.00 0.01 0.00 0.00 72.50 68.56 2f91 s THR 207 CO -0.02 0.25 0.22 -0.72 -0.69 0.00 0.00 174.62 173.66 2f91 s TYR 208 N -0.26 0.23 -0.52 4.92 -0.85 -0.54 -4.32 117.35 116.01 2f91 s TYR 208 Ca 0.51 -0.64 -0.28 0.00 -0.52 0.00 0.00 57.07 56.14 2f91 s TYR 208 Cb -0.32 -0.06 0.03 0.00 0.38 0.00 0.00 41.96 41.99 2f91 s TYR 208 CO 0.37 -0.59 1.12 -1.17 -1.52 0.00 0.00 175.55 173.75 2f91 s LEU 209 N -2.89 3.65 -0.13 -3.49 2.96 -0.02 -1.19 118.68 117.57 2f91 s LEU 209 Ca 0.09 0.24 0.20 0.00 -0.22 0.00 0.00 54.13 54.43 2f91 s LEU 209 Cb 0.04 -3.32 -0.28 0.00 0.50 0.00 0.00 46.19 43.13 2f91 s LEU 209 CO -0.08 -1.31 0.24 0.00 -1.32 0.00 0.00 176.35 173.89 2f91 n ALA 210 N 7.95 2.02 -2.91 5.97 0.00 -0.24 -4.28 120.51 129.01 2f91 n ALA 210 Ca 0.09 -1.01 -0.10 0.00 0.00 0.00 0.00 53.44 52.43 2f91 n ALA 210 Cb 0.49 -0.42 -0.06 0.00 0.00 0.00 0.00 19.45 19.46 2f91 n ALA 210 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2f91 s GLY 211 N -5.10 0.24 -0.10 0.00 0.00 -0.72 -1.47 107.32 100.17 2f91 s GLY 211 Ca -0.09 -0.62 0.02 0.00 0.00 0.00 0.00 44.72 44.02 2f91 s GLY 211 CO 0.86 -0.63 -0.15 -0.42 0.00 0.00 0.00 173.10 172.77 2f91 s ILE 212 N -3.92 1.43 0.15 0.90 1.01 -0.61 -0.95 121.20 119.21 2f91 s ILE 212 Ca 0.13 -0.61 -0.33 0.00 0.00 0.00 0.00 60.65 59.84 2f91 s ILE 212 Cb 0.02 -1.31 -0.13 0.00 0.01 0.00 0.00 42.46 41.05 2f91 s ILE 212 CO -0.02 0.43 1.64 0.52 0.00 0.00 0.00 174.94 177.51 2f91 n VAL 213 N 4.16 0.06 0.03 2.92 0.31 -0.13 -1.08 118.33 124.60 2f91 n VAL 213 Ca -0.19 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 2f91 n VAL 213 Cb 0.51 -1.68 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 2f91 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2f91 n SER 214 N 3.87 0.26 -3.73 4.52 2.88 -0.81 -1.14 113.62 119.47 2f91 n SER 214 Ca 0.17 0.09 -0.08 0.00 -1.33 0.00 0.00 58.87 57.72 2f91 n SER 214 Cb 0.30 -0.04 -0.02 0.00 -0.75 0.00 0.00 64.21 63.71 2f91 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2f91 s TRP 215 N -1.35 -0.04 0.01 0.66 1.48 -0.62 -4.94 118.94 114.14 2f91 s TRP 215 Ca 0.00 -0.44 -0.29 0.00 -1.06 0.00 0.00 56.10 54.31 2f91 s TRP 215 Cb 0.00 0.64 0.11 0.00 -1.16 0.00 0.00 33.47 33.06 2f91 s TRP 215 CO 0.00 -1.25 1.25 0.20 -4.06 0.00 0.00 176.95 173.09 2f91 s GLY 216 N -2.96 -0.31 -0.46 3.67 0.00 -1.26 -0.62 107.32 105.37 2f91 s GLY 216 Ca 0.14 0.46 -0.22 0.00 0.00 0.00 0.00 44.72 45.09 2f91 s GLY 216 CO 0.08 1.43 0.74 -0.47 0.00 0.00 0.00 173.10 174.88 2f91 s TYR 217 N -2.37 3.00 0.00 1.90 5.04 -1.26 -4.91 117.35 118.75 2f91 s TYR 217 Ca 0.18 0.01 0.00 0.00 -2.44 0.00 0.00 57.07 54.82 2f91 s TYR 217 Cb 0.03 -3.58 0.00 0.00 0.35 0.00 0.00 41.96 38.76 2f91 s TYR 217 CO -0.02 -0.99 0.00 0.41 -1.34 0.00 0.00 175.55 173.61 2f91 n GLY 218 N 5.03 1.16 3.00 8.97 0.00 -1.26 -4.65 105.19 117.44 2f91 n GLY 218 Ca 0.00 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.29 2f91 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f91 n ALA 220 N 3.31 -0.28 -1.78 0.00 0.00 -1.26 -4.56 120.51 115.93 2f91 n ALA 220 Ca -0.16 0.30 -0.37 0.00 0.00 0.00 0.00 53.44 53.21 2f91 n ALA 220 Cb 0.57 -1.90 -0.04 0.00 0.00 0.00 0.00 19.45 18.08 2f91 n ALA 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2f91 s ARG 221 N -3.58 4.21 0.21 0.00 0.52 -1.26 -0.71 118.95 118.34 2f91 s ARG 221 Ca 0.00 1.57 -0.32 0.00 -0.52 0.00 0.00 55.73 56.46 2f91 s ARG 221 Cb 0.00 -2.63 -0.13 0.00 0.52 0.00 0.00 34.95 32.71 2f91 s ARG 221 CO 0.00 -0.12 1.56 -2.30 0.02 0.00 0.00 175.30 174.46 2f91 n PRO 222 N 0.09 2.29 -0.99 3.54 -0.02 -1.26 -2.10 135.00 136.55 2f91 n PRO 222 Ca 0.04 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 2f91 n PRO 222 Cb 0.49 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 2f91 n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f91 n GLY 223 N 3.00 0.80 2.64 -1.23 0.00 -1.04 -4.92 105.19 104.44 2f91 n GLY 223 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2f91 n GLY 223 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2f91 s TYR 224 N -3.20 2.08 0.81 1.61 2.02 -0.89 -4.73 117.35 115.04 2f91 s TYR 224 Ca 0.00 -2.63 -0.12 0.00 -0.37 0.00 0.00 57.07 53.95 2f91 s TYR 224 Cb 0.00 -1.74 0.08 0.00 -0.40 0.00 0.00 41.96 39.90 2f91 s TYR 224 CO 0.00 -0.73 1.15 -2.14 -1.57 0.00 0.00 175.55 172.26 2f91 s PRO 225 N -0.26 1.79 0.58 -1.71 0.02 -1.26 -4.32 135.00 129.84 2f91 s PRO 225 Ca 0.25 1.50 -0.18 0.00 0.02 0.00 0.00 61.00 62.58 2f91 s PRO 225 Cb -0.08 -1.82 -0.04 0.00 0.02 0.00 0.00 34.50 32.58 2f91 s PRO 225 CO -0.12 -2.05 1.14 0.20 -0.33 0.00 0.00 177.00 175.85 2f91 s GLY 227 N -2.68 2.56 -0.06 0.52 0.00 -0.34 -4.67 107.32 102.65 2f91 s GLY 227 Ca 0.67 0.81 0.05 0.00 0.00 0.00 0.00 44.72 46.26 2f91 s GLY 227 CO 0.53 1.17 -0.23 0.14 0.00 0.00 0.00 173.10 174.71 2f91 s VAL 228 N -1.85 2.29 0.04 1.40 1.01 0.21 -1.20 120.40 122.30 2f91 s VAL 228 Ca 0.73 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 61.76 2f91 s VAL 228 Cb -0.24 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2f91 s VAL 228 CO 0.31 0.57 -0.12 -0.31 0.00 0.00 0.00 175.10 175.55 2f91 s TYR 229 N -0.24 1.01 0.11 5.22 2.02 0.20 -1.59 117.35 124.08 2f91 s TYR 229 Ca -0.01 -0.38 -0.31 0.00 -0.37 0.00 0.00 57.07 56.00 2f91 s TYR 229 Cb -0.13 -0.59 -0.08 0.00 -0.40 0.00 0.00 41.96 40.76 2f91 s TYR 229 CO 0.03 0.01 1.40 0.99 -1.57 0.00 0.00 175.55 176.40 2f91 s THR 230 N -1.00 3.29 -0.47 -0.71 2.01 -0.24 -0.37 115.64 118.15 2f91 s THR 230 Ca -0.02 0.92 -0.24 0.00 0.31 0.00 0.00 61.69 62.66 2f91 s THR 230 Cb -0.08 -3.59 0.03 0.00 0.01 0.00 0.00 72.50 68.87 2f91 s THR 230 CO 0.01 0.07 0.86 -0.70 -0.69 0.00 0.00 174.62 174.17 2f91 s GLU 231 N 1.13 3.44 0.42 4.92 2.12 0.19 -1.57 118.70 129.35 2f91 s GLU 231 Ca 0.65 -0.04 0.09 0.00 0.36 0.00 0.00 54.97 56.03 2f91 s GLU 231 Cb -0.37 -3.95 0.91 0.00 0.26 0.00 0.00 34.13 30.97 2f91 s GLU 231 CO 0.30 -1.21 2.03 0.28 -0.54 0.00 0.00 175.26 176.11 2f91 h VAL 232 N 6.03 1.11 0.00 3.70 2.07 -1.53 -2.20 116.25 125.43 2f91 h VAL 232 Ca -0.25 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2f91 h VAL 232 Cb 1.08 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2f91 h VAL 232 CO 1.00 0.13 0.00 0.77 0.02 0.00 0.00 177.57 179.49 2f91 h SER 233 N 0.35 0.00 1.20 0.57 4.64 -1.84 0.10 113.55 118.57 2f91 h SER 233 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2f91 h SER 233 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2f91 h SER 233 CO -0.01 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.73 2f91 n TYR 234 N -2.45 0.44 -0.77 4.77 4.02 -0.82 -0.84 117.16 121.50 2f91 n TYR 234 Ca 0.00 0.13 0.03 0.00 -0.01 0.00 0.00 57.90 58.05 2f91 n TYR 234 Cb 0.15 -0.71 0.04 0.00 -0.02 0.00 0.00 39.34 38.81 2f91 n TYR 234 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 2f91 n HIS 235 N -1.86 0.00 -0.13 -0.72 8.25 0.32 -4.80 115.22 116.28 2f91 n HIS 235 Ca 0.06 -0.49 -0.09 0.00 -0.26 0.00 0.00 57.72 56.94 2f91 n HIS 235 Cb 0.38 -0.07 -0.01 0.00 1.12 0.00 0.00 29.99 31.40 2f91 n HIS 235 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2f91 h VAL 236 N 1.48 1.20 -0.56 1.59 2.07 -1.63 -0.18 116.25 120.23 2f91 h VAL 236 Ca 0.00 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 66.85 2f91 h VAL 236 Cb 0.86 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 2f91 h VAL 236 CO 0.00 0.22 0.16 0.44 0.02 0.00 0.00 177.57 178.42 2f91 h ASP 237 N 0.48 0.78 -0.36 0.57 3.32 -1.90 -0.92 116.42 118.39 2f91 h ASP 237 Ca 0.13 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2f91 h ASP 237 Cb 0.21 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2f91 h ASP 237 CO -0.01 0.75 0.22 -0.25 -1.72 0.00 0.00 179.24 178.23 2f91 h TRP 238 N 0.82 0.47 -0.34 4.55 7.01 -1.80 -1.18 115.95 125.48 2f91 h TRP 238 Ca 0.18 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.17 2f91 h TRP 238 Cb 0.26 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.15 2f91 h TRP 238 CO 0.02 0.33 0.16 0.82 -2.79 0.00 0.00 178.44 176.97 2f91 h ILE 239 N 0.47 1.17 -0.34 2.65 2.04 -0.39 -1.97 117.51 121.14 2f91 h ILE 239 Ca 0.13 -0.48 -0.07 0.00 1.00 0.00 0.00 64.86 65.44 2f91 h ILE 239 Cb -0.01 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2f91 h ILE 239 CO -0.03 0.18 -0.07 0.11 0.00 0.00 0.00 178.15 178.34 2f91 h LYS 240 N 0.41 0.56 0.00 2.37 1.57 -1.06 -0.49 116.57 119.93 2f91 h LYS 240 Ca 0.12 -0.15 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 2f91 h LYS 240 Cb 0.13 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2f91 h LYS 240 CO -0.01 0.64 -0.40 0.00 -0.57 0.00 0.00 179.45 179.11 2f91 h ALA 241 N 1.41 1.09 0.00 3.86 0.00 -0.93 -3.30 119.26 121.38 2f91 h ALA 241 Ca 0.10 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2f91 h ALA 241 Cb 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2f91 h ALA 241 CO 0.02 0.50 -1.57 0.09 0.00 0.00 0.00 179.25 178.28 2f91 n ASN 242 N -3.70 0.78 -3.67 0.00 3.02 -0.77 -4.60 115.26 106.32 2f91 n ASN 242 Ca -0.01 -0.26 -0.41 0.00 -0.03 0.00 0.00 54.58 53.87 2f91 n ASN 242 Cb 0.48 1.62 -0.00 0.00 -0.61 0.00 0.00 39.78 41.27 2f91 n ASN 242 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2f91 n ALA 243 N -1.95 6.05 -0.54 5.41 0.00 -0.24 -5.07 120.51 124.18 2f91 n ALA 243 Ca -0.02 -4.07 0.00 0.00 0.00 0.00 0.00 53.44 49.35 2f91 n ALA 243 Cb 0.43 -3.09 0.00 0.00 0.00 0.00 0.00 19.45 16.79 2f91 n ALA 243 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78