#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oky n PHE 8 N 0.00 0.92 -0.30 -1.77 3.01 -1.26 -4.77 117.46 113.30 2oky n PHE 8 Ca 0.00 -0.79 0.04 0.00 1.01 0.00 0.00 57.45 57.72 2oky n PHE 8 Cb 0.00 -0.26 0.18 0.00 -0.01 0.00 0.00 39.48 39.39 2oky n PHE 8 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2oky h THR 9 N 2.02 0.86 0.00 4.37 1.03 -2.01 -3.38 112.91 115.80 2oky h THR 9 Ca 0.00 -0.26 0.00 0.00 -0.01 0.00 0.00 66.41 66.14 2oky h THR 9 Cb 1.33 0.04 0.00 0.00 -1.07 0.00 0.00 68.15 68.45 2oky h THR 9 CO 0.19 0.14 0.00 0.61 -0.01 0.00 0.00 175.52 176.45 2oky n GLY 10 N -1.32 2.47 3.59 2.99 0.00 -1.26 -4.76 105.19 106.89 2oky n GLY 10 Ca 0.15 -1.32 -0.37 0.00 0.00 0.00 0.00 46.02 44.48 2oky n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oky s VAL 11 N 4.54 5.06 -0.01 1.61 1.01 -1.26 -4.02 120.40 127.33 2oky s VAL 11 Ca 0.00 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.07 2oky s VAL 11 Cb 0.00 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2oky s VAL 11 CO 0.00 0.32 -0.00 -0.69 0.00 0.00 0.00 175.10 174.73 2oky s VAL 12 N 1.36 4.15 0.12 2.92 1.01 -0.00 -4.92 120.40 125.04 2oky s VAL 12 Ca 0.07 -0.59 -0.31 0.00 0.00 0.00 0.00 61.98 61.15 2oky s VAL 12 Cb -0.15 -2.84 -0.07 0.00 0.00 0.00 0.00 36.38 33.32 2oky s VAL 12 CO 0.06 0.39 1.28 -2.16 0.00 0.00 0.00 175.10 174.67 2oky s PRO 13 N -1.52 4.40 -0.08 2.72 0.04 -1.26 -2.40 135.00 136.89 2oky s PRO 13 Ca 0.19 1.94 0.03 0.00 0.04 0.00 0.00 61.00 63.20 2oky s PRO 13 Cb -0.11 -3.27 -0.02 0.00 0.04 0.00 0.00 34.50 31.14 2oky s PRO 13 CO 0.10 -0.29 -0.18 0.42 0.04 0.00 0.00 177.00 177.09 2oky s ILE 14 N 0.73 2.70 -0.07 0.56 1.01 -0.19 -0.84 121.20 125.09 2oky s ILE 14 Ca 0.59 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 60.45 2oky s ILE 14 Cb -0.34 -2.06 0.01 0.00 0.01 0.00 0.00 42.46 40.08 2oky s ILE 14 CO 0.32 0.56 -0.17 -0.22 0.00 0.00 0.00 174.94 175.43 2oky s LEU 15 N -0.15 1.84 -0.18 2.97 2.96 -0.77 -1.52 118.68 123.84 2oky s LEU 15 Ca -0.02 -0.40 -0.00 0.00 -0.22 0.00 0.00 54.13 53.49 2oky s LEU 15 Cb -0.14 -1.06 0.01 0.00 0.50 0.00 0.00 46.19 45.50 2oky s LEU 15 CO 0.04 0.10 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.32 2oky s VAL 16 N 0.45 2.49 -0.23 1.68 1.01 0.63 -1.62 120.40 124.81 2oky s VAL 16 Ca -0.14 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.04 2oky s VAL 16 Cb -0.16 -2.07 0.04 0.00 0.00 0.00 0.00 36.38 34.19 2oky s VAL 16 CO 0.05 0.51 -0.13 -1.61 0.00 0.00 0.00 175.10 173.93 2oky s GLU 17 N 1.15 2.63 -0.23 2.72 0.41 -0.53 -0.22 118.70 124.63 2oky s GLU 17 Ca 0.01 -1.09 0.01 0.00 -0.41 0.00 0.00 54.97 53.49 2oky s GLU 17 Cb -0.14 -2.81 0.04 0.00 -1.78 0.00 0.00 34.13 29.43 2oky s GLU 17 CO -0.06 -0.41 -0.13 -1.17 -0.49 0.00 0.00 175.26 172.99 2oky s LEU 18 N 1.22 2.91 -0.47 1.80 2.96 0.56 0.47 118.68 128.13 2oky s LEU 18 Ca -0.02 -1.01 -0.17 0.00 -0.22 0.00 0.00 54.13 52.71 2oky s LEU 18 Cb -0.17 -1.55 0.06 0.00 0.50 0.00 0.00 46.19 45.03 2oky s LEU 18 CO -0.07 -0.11 0.46 -0.62 -1.32 0.00 0.00 176.35 174.69 2oky s ASP 19 N 1.22 6.17 0.15 3.68 3.68 0.00 -1.08 116.67 130.49 2oky s ASP 19 Ca -0.02 -1.09 0.10 0.00 2.13 0.00 0.00 52.55 53.68 2oky s ASP 19 Cb -0.17 -2.22 -0.04 0.00 -1.45 0.00 0.00 42.92 39.05 2oky s ASP 19 CO -0.08 -0.69 -0.22 -0.83 0.13 0.00 0.00 175.17 173.48 2oky s GLY 20 N 2.44 1.66 -0.33 2.66 0.00 0.72 -1.02 107.32 113.46 2oky s GLY 20 Ca 0.08 -1.48 0.02 0.00 0.00 0.00 0.00 44.72 43.34 2oky s GLY 20 CO 0.09 -1.47 0.37 -0.35 0.00 0.00 0.00 173.10 171.74 2oky s ASP 21 N -2.31 1.06 -0.31 1.64 3.68 -0.59 -0.24 116.67 119.60 2oky s ASP 21 Ca 0.18 -1.00 -0.05 0.00 2.13 0.00 0.00 52.55 53.81 2oky s ASP 21 Cb -0.10 0.72 0.03 0.00 -1.45 0.00 0.00 42.92 42.13 2oky s ASP 21 CO 0.09 -0.32 0.05 -0.69 0.13 0.00 0.00 175.17 174.43 2oky s VAL 22 N 2.02 3.51 -1.22 1.11 1.01 0.05 -1.69 120.40 125.19 2oky s VAL 22 Ca 0.13 -1.07 -0.05 0.00 0.00 0.00 0.00 61.98 60.99 2oky s VAL 22 Cb -0.14 -2.92 0.01 0.00 0.00 0.00 0.00 36.38 33.33 2oky s VAL 22 CO -0.20 -0.05 0.63 0.59 0.00 0.00 0.00 175.10 176.08 2oky n ASN 23 N 4.76 -5.36 0.00 3.32 4.13 0.16 -1.45 115.26 120.82 2oky n ASN 23 Ca -0.14 -0.29 0.00 0.00 1.68 0.00 0.00 54.58 55.83 2oky n ASN 23 Cb 0.45 -4.13 0.00 0.00 -1.54 0.00 0.00 39.78 34.56 2oky n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2oky n GLY 24 N -1.48 2.34 3.63 7.41 0.00 -1.26 -4.95 105.19 110.88 2oky n GLY 24 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 2oky n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2oky s HIS 25 N -1.89 2.41 0.09 1.61 3.76 -0.53 -4.98 115.29 115.76 2oky s HIS 25 Ca 0.00 0.71 -0.09 0.00 -0.15 0.00 0.00 55.06 55.53 2oky s HIS 25 Cb 0.00 -3.91 -0.06 0.00 1.11 0.00 0.00 32.58 29.73 2oky s HIS 25 CO 0.00 -2.34 0.40 0.15 -0.85 0.00 0.00 174.74 172.10 2oky s LYS 26 N 4.33 3.74 0.12 1.40 1.02 -1.26 -0.77 119.74 128.32 2oky s LYS 26 Ca 0.63 0.15 -0.20 0.00 0.02 0.00 0.00 55.97 56.57 2oky s LYS 26 Cb -0.21 -2.97 0.05 0.00 -0.52 0.00 0.00 37.83 34.17 2oky s LYS 26 CO 0.25 0.55 0.49 -0.59 -0.92 0.00 0.00 175.35 175.13 2oky s PHE 27 N -1.43 -0.36 0.05 3.18 -0.71 0.66 -4.96 117.98 114.41 2oky s PHE 27 Ca 0.34 0.16 0.05 0.00 -1.04 0.00 0.00 56.93 56.44 2oky s PHE 27 Cb -0.14 0.37 -0.02 0.00 -1.21 0.00 0.00 43.02 42.02 2oky s PHE 27 CO 0.19 -0.73 -0.14 -1.12 -1.34 0.00 0.00 175.22 172.08 2oky s SER 28 N -2.58 1.62 -0.02 1.98 0.01 -1.26 -0.20 113.70 113.25 2oky s SER 28 Ca 0.00 -0.52 -0.01 0.00 1.31 0.00 0.00 55.95 56.73 2oky s SER 28 Cb 0.00 -0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.17 2oky s SER 28 CO -0.10 -0.02 0.05 -0.69 0.41 0.00 0.00 173.24 172.89 2oky s VAL 29 N -1.04 -0.03 -0.03 3.43 1.01 -0.25 -2.32 120.40 121.18 2oky s VAL 29 Ca -0.00 0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.13 2oky s VAL 29 Cb -0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 36.38 36.20 2oky s VAL 29 CO 0.02 0.04 -0.18 -0.44 0.00 0.00 0.00 175.10 174.54 2oky s SER 30 N 0.53 2.16 0.05 3.32 0.01 -0.89 -0.32 113.70 118.56 2oky s SER 30 Ca -0.04 -0.34 0.01 0.00 1.31 0.00 0.00 55.95 56.88 2oky s SER 30 Cb -0.06 -0.42 -0.03 0.00 0.21 0.00 0.00 66.02 65.72 2oky s SER 30 CO -0.02 0.19 -0.05 -0.83 0.41 0.00 0.00 173.24 172.94 2oky s GLY 31 N -0.20 0.46 0.07 3.44 0.00 0.70 -1.13 107.32 110.66 2oky s GLY 31 Ca 0.02 -0.89 -0.14 0.00 0.00 0.00 0.00 44.72 43.71 2oky s GLY 31 CO 0.01 -0.97 0.31 1.85 0.00 0.00 0.00 173.10 174.30 2oky s GLU 32 N -2.34 0.88 0.00 2.90 2.12 -0.96 -0.27 118.70 121.03 2oky s GLU 32 Ca -0.05 -0.62 0.00 0.00 0.36 0.00 0.00 54.97 54.66 2oky s GLU 32 Cb -0.04 0.38 0.00 0.00 0.26 0.00 0.00 34.13 34.73 2oky s GLU 32 CO -0.03 -0.30 0.00 0.41 -0.54 0.00 0.00 175.26 174.80 2oky n GLY 33 N 0.28 -0.55 3.08 -1.50 0.00 -0.57 -1.92 105.19 104.00 2oky n GLY 33 Ca -0.17 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.04 2oky n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oky s GLU 34 N -1.55 0.52 -0.02 1.61 2.02 -0.55 -1.02 118.70 119.71 2oky s GLU 34 Ca 0.00 -0.81 0.02 0.00 0.02 0.00 0.00 54.97 54.20 2oky s GLU 34 Cb 0.00 0.20 0.00 0.00 0.10 0.00 0.00 34.13 34.43 2oky s GLU 34 CO 0.00 -0.11 -0.06 0.20 0.02 0.00 0.00 175.26 175.30 2oky s GLY 35 N -2.11 0.38 -0.32 -1.39 0.00 -1.01 -1.19 107.32 101.68 2oky s GLY 35 Ca -0.05 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.45 2oky s GLY 35 CO -0.05 -0.06 0.01 -0.35 0.00 0.00 0.00 173.10 172.66 2oky s ASP 36 N 0.15 4.75 0.22 1.64 -1.08 0.62 -0.82 116.67 122.15 2oky s ASP 36 Ca -0.02 -1.76 -0.04 0.00 -0.52 0.00 0.00 52.55 50.21 2oky s ASP 36 Cb -0.06 -1.64 0.20 0.00 -1.46 0.00 0.00 42.92 39.95 2oky s ASP 36 CO -0.00 -0.32 1.64 0.00 0.52 0.00 0.00 175.17 177.01 2oky h ALA 37 N 7.78 0.90 -0.58 3.66 0.00 -1.74 0.46 119.26 129.74 2oky h ALA 37 Ca -0.13 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 2oky h ALA 37 Cb 1.04 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2oky h ALA 37 CO 0.53 0.62 0.02 1.15 0.00 0.00 0.00 179.25 181.57 2oky h THR 38 N 0.69 1.26 -0.12 0.00 2.02 -1.86 -2.55 112.91 112.35 2oky h THR 38 Ca 0.10 -1.09 -0.19 0.00 0.77 0.00 0.00 66.41 66.01 2oky h THR 38 Cb 0.70 0.79 0.01 0.00 -1.74 0.00 0.00 68.15 67.91 2oky h THR 38 CO 0.05 0.39 -0.67 0.22 0.37 0.00 0.00 175.52 175.89 2oky h TYR 39 N 0.91 0.89 -0.23 3.16 5.03 -1.92 -3.46 116.97 121.35 2oky h TYR 39 Ca 0.17 -0.40 0.00 0.00 2.58 0.00 0.00 58.73 61.08 2oky h TYR 39 Cb 0.50 -0.13 0.00 0.00 1.55 0.00 0.00 36.73 38.65 2oky h TYR 39 CO 0.03 1.21 0.00 0.41 -1.32 0.00 0.00 178.16 178.50 2oky n GLY 40 N 0.74 1.11 3.26 1.82 0.00 0.04 -4.83 105.19 107.34 2oky n GLY 40 Ca -0.08 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 2oky n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2oky s LYS 41 N -1.61 1.45 0.04 1.61 2.20 -0.53 -0.75 119.74 122.15 2oky s LYS 41 Ca 0.00 -0.96 0.04 0.00 -0.36 0.00 0.00 55.97 54.69 2oky s LYS 41 Cb 0.00 -1.57 -0.02 0.00 -1.51 0.00 0.00 37.83 34.73 2oky s LYS 41 CO 0.00 0.40 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.77 2oky s LEU 42 N -1.16 2.18 -0.05 5.43 1.43 -0.42 -0.27 118.68 125.82 2oky s LEU 42 Ca 0.08 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.71 2oky s LEU 42 Cb -0.09 -0.40 0.03 0.00 0.03 0.00 0.00 46.19 45.76 2oky s LEU 42 CO 0.02 -0.05 0.06 0.42 0.23 0.00 0.00 176.35 177.03 2oky s THR 43 N -0.95 -0.09 0.12 5.49 -4.23 -0.34 -1.09 115.64 114.55 2oky s THR 43 Ca -0.02 0.37 -0.01 0.00 -1.18 0.00 0.00 61.69 60.85 2oky s THR 43 Cb -0.08 -0.20 -0.04 0.00 1.34 0.00 0.00 72.50 73.52 2oky s THR 43 CO 0.01 0.15 0.03 -0.76 -0.54 0.00 0.00 174.62 173.51 2oky s LEU 44 N 2.16 1.98 -0.02 4.79 1.43 0.27 -1.48 118.68 127.81 2oky s LEU 44 Ca 0.05 -1.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.01 2oky s LEU 44 Cb -0.12 0.21 0.00 0.00 0.03 0.00 0.00 46.19 46.31 2oky s LEU 44 CO -0.04 -0.67 -0.09 -0.75 0.23 0.00 0.00 176.35 175.03 2oky s LYS 45 N -4.00 0.91 -0.02 1.70 2.20 -0.81 -0.51 119.74 119.22 2oky s LYS 45 Ca 0.21 -0.29 0.07 0.00 -0.36 0.00 0.00 55.97 55.59 2oky s LYS 45 Cb 0.07 -0.86 -0.02 0.00 -1.51 0.00 0.00 37.83 35.52 2oky s LYS 45 CO -0.00 0.11 -0.23 -0.06 -0.36 0.00 0.00 175.35 174.81 2oky s PHE 46 N 0.17 2.04 -0.03 4.03 0.08 0.18 -2.25 117.98 122.19 2oky s PHE 46 Ca -0.03 -0.39 0.06 0.00 0.12 0.00 0.00 56.93 56.69 2oky s PHE 46 Cb -0.08 -1.32 -0.01 0.00 -0.57 0.00 0.00 43.02 41.04 2oky s PHE 46 CO 0.00 -0.04 -0.20 0.42 -0.10 0.00 0.00 175.22 175.30 2oky s ILE 47 N -0.52 1.63 -0.34 0.64 -1.09 -0.29 -0.01 121.20 121.23 2oky s ILE 47 Ca 0.08 -0.85 -0.22 0.00 -2.23 0.00 0.00 60.65 57.42 2oky s ILE 47 Cb -0.09 -1.38 0.00 0.00 -1.58 0.00 0.00 42.46 39.42 2oky s ILE 47 CO -0.01 0.46 0.74 0.00 -1.23 0.00 0.00 174.94 174.91 2oky n THR 49 N 5.62 1.89 -0.23 0.00 -2.24 -0.98 -4.00 114.28 114.33 2oky n THR 49 Ca 0.02 -1.04 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 2oky n THR 49 Cb 0.48 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 2oky n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2oky n THR 50 N 0.65 0.00 0.00 4.28 -2.24 -1.26 -4.91 114.28 110.80 2oky n THR 50 Ca 0.21 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2oky n THR 50 Cb 0.89 1.23 0.00 0.00 -2.10 0.00 0.00 70.33 70.36 2oky n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oky n GLY 51 N 0.17 0.36 3.78 3.38 0.00 -1.26 -5.02 105.19 106.61 2oky n GLY 51 Ca 0.00 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.22 2oky n GLY 51 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2oky s LYS 52 N -1.49 4.14 -0.12 1.61 2.47 -1.26 -4.46 119.74 120.63 2oky s LYS 52 Ca 0.00 1.54 -0.23 0.00 -1.56 0.00 0.00 55.97 55.71 2oky s LYS 52 Cb 0.00 -2.54 -0.03 0.00 -1.46 0.00 0.00 37.83 33.81 2oky s LYS 52 CO 0.00 -0.17 0.72 -1.17 0.16 0.00 0.00 175.35 174.89 2oky s LEU 53 N -2.66 4.24 0.03 5.43 2.96 -1.26 -4.96 118.68 122.46 2oky s LEU 53 Ca 0.58 1.11 0.16 0.00 -0.22 0.00 0.00 54.13 55.76 2oky s LEU 53 Cb -0.23 -3.09 0.68 0.00 0.50 0.00 0.00 46.19 44.05 2oky s LEU 53 CO 0.28 -0.23 1.50 -0.81 -1.32 0.00 0.00 176.35 175.78 2oky n PRO 54 N 4.47 0.02 -4.35 0.98 -0.04 -1.26 -4.83 135.00 129.99 2oky n PRO 54 Ca 0.00 0.27 -0.18 0.00 -0.04 0.00 0.00 63.50 63.55 2oky n PRO 54 Cb 0.50 -1.55 -0.10 0.00 -0.04 0.00 0.00 33.50 32.31 2oky n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2oky s VAL 55 N -3.04 1.18 0.41 0.52 -7.23 -1.26 -4.65 120.40 106.33 2oky s VAL 55 Ca 0.07 -2.05 -0.25 0.00 -1.81 0.00 0.00 61.98 57.94 2oky s VAL 55 Cb 0.10 -2.36 -0.08 0.00 0.56 0.00 0.00 36.38 34.60 2oky s VAL 55 CO 0.29 -0.33 1.17 -2.84 -0.31 0.00 0.00 175.10 173.08 2oky s PRO 56 N -3.83 3.98 0.24 4.82 0.02 -1.26 -4.93 135.00 134.05 2oky s PRO 56 Ca 0.28 1.83 -0.05 0.00 0.02 0.00 0.00 61.00 63.09 2oky s PRO 56 Cb 0.05 -2.61 0.35 0.00 0.02 0.00 0.00 34.50 32.31 2oky s PRO 56 CO 0.09 -0.38 1.84 -1.49 -0.33 0.00 0.00 177.00 176.73 2oky h TRP 57 N 2.49 0.95 -0.57 6.54 4.06 -1.96 -2.54 115.95 124.91 2oky h TRP 57 Ca -0.49 0.03 0.08 0.00 2.06 0.00 0.00 58.89 60.57 2oky h TRP 57 Cb 1.24 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 29.06 2oky h TRP 57 CO 0.55 0.46 0.38 -1.35 -3.56 0.00 0.00 178.44 174.92 2oky h PRO 58 N 0.92 0.44 0.00 0.49 0.11 -1.88 -1.00 132.00 131.07 2oky h PRO 58 Ca 0.38 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.46 2oky h PRO 58 Cb 0.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.23 2oky h PRO 58 CO -0.19 0.29 0.00 1.79 -0.21 0.00 0.00 178.00 179.68 2oky h THR 59 N 0.45 0.00 -0.01 -1.15 1.35 -1.84 -2.61 112.91 109.11 2oky h THR 59 Ca 0.26 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 66.00 2oky h THR 59 Cb 0.43 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 2oky h THR 59 CO -0.07 0.00 -0.49 0.18 -0.25 0.00 0.00 175.52 174.89 2oky n LEU 60 N -2.30 1.50 -0.30 3.87 4.77 -0.38 -4.61 117.00 119.55 2oky n LEU 60 Ca 0.00 -0.69 0.03 0.00 -0.03 0.00 0.00 56.01 55.32 2oky n LEU 60 Cb 0.13 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.40 2oky n LEU 60 CO 0.15 0.30 1.16 0.58 -1.33 0.00 0.00 177.39 178.25 2oky h VAL 61 N 1.46 0.92 0.00 4.08 2.07 -1.44 -1.82 116.25 121.52 2oky h VAL 61 Ca 0.00 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 2oky h VAL 61 Cb 0.56 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 2oky h VAL 61 CO 0.00 0.15 -0.32 0.71 0.02 0.00 0.00 177.57 178.13 2oky h THR 62 N 0.83 0.92 0.02 2.57 1.35 -1.81 -3.23 112.91 113.56 2oky h THR 62 Ca 0.41 -1.26 -0.00 0.00 -0.55 0.00 0.00 66.41 65.01 2oky h THR 62 Cb 0.36 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 2oky h THR 62 CO -0.24 0.32 -0.01 0.74 -0.25 0.00 0.00 175.52 176.07 2oky h THR 63 N 0.00 1.46 0.00 6.82 2.02 -1.66 -3.46 112.91 118.10 2oky h THR 63 Ca -0.00 -1.80 0.00 0.00 0.77 0.00 0.00 66.41 65.38 2oky h THR 63 Cb 0.72 2.62 0.00 0.00 -1.74 0.00 0.00 68.15 69.75 2oky h THR 63 CO 0.04 0.44 0.00 0.18 0.37 0.00 0.00 175.52 176.55 2oky n LEU 64 N -4.73 0.00 0.00 2.58 4.77 -0.83 -5.03 117.00 113.77 2oky n LEU 64 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 2oky n LEU 64 Cb 0.36 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2oky n LEU 64 CO 0.31 0.00 0.00 1.33 -1.33 0.00 0.00 177.39 177.70 2oky n VAL 68 N 1.30 0.00 0.32 4.08 0.24 -1.26 -4.97 118.33 118.05 2oky n VAL 68 Ca 0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.33 2oky n VAL 68 Cb 0.00 0.00 0.17 0.00 -1.47 0.00 0.00 33.84 32.54 2oky n VAL 68 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2oky n GLN 69 N 0.00 0.10 0.00 7.34 6.02 -1.26 -1.96 117.38 127.62 2oky n GLN 69 Ca 0.00 0.22 0.07 0.00 -0.01 0.00 0.00 57.00 57.28 2oky n GLN 69 Cb 0.00 -1.50 0.39 0.00 1.02 0.00 0.00 30.24 30.15 2oky n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2oky n PHE 71 N -1.25 0.55 -2.28 0.00 3.72 -0.83 -4.73 117.46 112.65 2oky n PHE 71 Ca 0.08 -0.28 -0.36 0.00 -0.05 0.00 0.00 57.45 56.84 2oky n PHE 71 Cb 0.11 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.64 2oky n PHE 71 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2oky s SER 72 N -1.30 5.98 -0.29 4.37 0.01 -0.77 -4.21 113.70 117.48 2oky s SER 72 Ca 0.37 2.22 -0.20 0.00 1.31 0.00 0.00 55.95 59.66 2oky s SER 72 Cb 0.21 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.83 2oky s SER 72 CO 0.28 -1.04 0.59 -0.60 0.41 0.00 0.00 173.24 172.88 2oky s ARG 73 N -2.99 3.96 -0.30 12.44 3.52 -0.61 -4.81 118.95 130.15 2oky s ARG 73 Ca 0.68 0.31 -0.09 0.00 -0.13 0.00 0.00 55.73 56.50 2oky s ARG 73 Cb -0.26 -3.70 -0.01 0.00 -1.56 0.00 0.00 34.95 29.42 2oky s ARG 73 CO 0.30 -0.49 0.13 0.71 -0.81 0.00 0.00 175.30 175.14 2oky s TYR 74 N 2.50 3.16 0.91 5.12 1.51 -1.26 0.11 117.35 129.39 2oky s TYR 74 Ca 0.24 -0.59 -0.13 0.00 -1.01 0.00 0.00 57.07 55.58 2oky s TYR 74 Cb -0.15 -2.33 0.02 0.00 -0.11 0.00 0.00 41.96 39.39 2oky s TYR 74 CO 0.11 -0.45 0.42 -2.30 -1.11 0.00 0.00 175.55 172.21 2oky n PRO 75 N 4.96 -0.16 -0.34 -1.71 -0.02 -1.26 -4.66 135.00 131.81 2oky n PRO 75 Ca -0.14 -0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.42 2oky n PRO 75 Cb 0.49 -1.84 0.26 0.00 -0.02 0.00 0.00 33.50 32.38 2oky n PRO 75 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2oky h ASP 76 N -1.31 0.78 0.00 2.55 1.82 -2.00 0.30 116.42 118.56 2oky h ASP 76 Ca -0.44 0.07 0.00 0.00 -0.39 0.00 0.00 57.03 56.27 2oky h ASP 76 Cb 1.29 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 41.23 2oky h ASP 76 CO 0.36 0.36 0.00 0.00 -1.61 0.00 0.00 179.24 178.35 2oky n HIS 77 N -4.73 0.00 -0.61 0.28 1.44 -1.26 -2.78 115.22 107.56 2oky n HIS 77 Ca 0.19 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.91 2oky n HIS 77 Cb 0.43 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.55 2oky n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 2oky n MET 78 N -0.52 1.39 -0.34 -1.40 2.81 0.11 -4.83 117.12 114.33 2oky n MET 78 Ca 0.01 -1.06 0.15 0.00 -1.81 0.00 0.00 57.70 54.98 2oky n MET 78 Cb 0.00 -0.77 0.37 0.00 -0.71 0.00 0.00 33.22 32.11 2oky n MET 78 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2oky h LYS 79 N 0.00 0.66 -0.58 0.03 1.79 -1.47 -1.42 116.57 115.58 2oky h LYS 79 Ca 0.00 -0.04 0.13 0.00 -2.18 0.00 0.00 60.65 58.56 2oky h LYS 79 Cb 0.80 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.27 2oky h LYS 79 CO 0.00 0.44 0.40 1.96 -1.08 0.00 0.00 179.45 181.16 2oky h GLN 80 N 0.68 0.23 -0.82 3.15 4.20 -1.88 -2.92 115.11 117.75 2oky h GLN 80 Ca 0.57 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 59.11 2oky h GLN 80 Cb 1.00 -0.05 -0.09 0.00 0.30 0.00 0.00 27.48 28.64 2oky h GLN 80 CO -0.35 0.15 0.20 0.72 -0.67 0.00 0.00 178.83 178.88 2oky n HIS 81 N -4.44 1.81 -3.42 2.96 8.25 -0.53 -4.73 115.22 115.11 2oky n HIS 81 Ca 0.10 -0.92 -0.44 0.00 -0.26 0.00 0.00 57.72 56.20 2oky n HIS 81 Cb 0.48 -0.55 -0.04 0.00 1.12 0.00 0.00 29.99 31.00 2oky n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2oky s ASP 82 N -0.60 6.31 0.01 0.41 2.15 -1.10 -4.64 116.67 119.20 2oky s ASP 82 Ca 0.40 -2.55 -0.24 0.00 0.43 0.00 0.00 52.55 50.59 2oky s ASP 82 Cb 0.32 -2.12 -0.17 0.00 -0.30 0.00 0.00 42.92 40.64 2oky s ASP 82 CO 0.10 -0.58 1.34 0.15 -0.17 0.00 0.00 175.17 176.01 2oky h PHE 83 N 7.82 0.16 -0.59 -5.34 3.04 -1.90 -2.85 116.94 117.28 2oky h PHE 83 Ca 0.01 -0.04 0.12 0.00 3.98 0.00 0.00 57.97 62.04 2oky h PHE 83 Cb 1.03 -0.03 -0.11 0.00 2.56 0.00 0.00 35.95 39.40 2oky h PHE 83 CO 0.90 0.54 -0.09 0.74 -2.02 0.00 0.00 178.31 178.38 2oky h PHE 84 N -0.27 -0.20 -0.09 0.41 0.04 -1.90 -2.01 116.94 112.91 2oky h PHE 84 Ca 0.01 0.05 -0.23 0.00 2.80 0.00 0.00 57.97 60.60 2oky h PHE 84 Cb 0.50 0.18 0.01 0.00 2.20 0.00 0.00 35.95 38.85 2oky h PHE 84 CO 0.08 -0.22 -0.86 0.87 -0.60 0.00 0.00 178.31 177.58 2oky h LYS 85 N 0.04 0.67 0.00 1.51 1.57 -1.85 -3.21 116.57 115.30 2oky h LYS 85 Ca 0.29 -0.60 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 2oky h LYS 85 Cb 0.46 0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 2oky h LYS 85 CO -0.57 1.21 -0.03 0.66 -0.57 0.00 0.00 179.45 180.16 2oky h SER 86 N 0.43 0.00 0.29 0.86 4.64 -1.19 -0.33 113.55 118.26 2oky h SER 86 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2oky h SER 86 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 2oky h SER 86 CO 0.17 0.03 -0.03 0.00 -0.87 0.00 0.00 176.83 176.13 2oky n ALA 87 N -2.34 2.63 -2.21 5.18 0.00 -0.80 -4.79 120.51 118.17 2oky n ALA 87 Ca -0.03 -0.21 -0.30 0.00 0.00 0.00 0.00 53.44 52.90 2oky n ALA 87 Cb 0.12 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.09 2oky n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2oky s MET 88 N -2.32 3.75 0.00 0.00 1.00 -0.13 -0.36 119.30 121.24 2oky s MET 88 Ca 0.36 0.42 0.22 0.00 0.00 0.00 0.00 55.69 56.69 2oky s MET 88 Cb 0.21 -2.41 0.78 0.00 0.00 0.00 0.00 34.83 33.41 2oky s MET 88 CO 0.43 -0.03 1.57 -0.35 0.00 0.00 0.00 175.02 176.63 2oky n PRO 89 N -1.33 1.75 -0.10 2.03 -0.04 -1.26 -4.77 135.00 131.28 2oky n PRO 89 Ca 0.02 -1.13 -0.05 0.00 -0.04 0.00 0.00 63.50 62.30 2oky n PRO 89 Cb 0.54 -1.41 0.14 0.00 -0.04 0.00 0.00 33.50 32.72 2oky n PRO 89 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2oky h GLU 90 N 2.34 0.78 0.00 0.54 3.07 -1.92 -3.22 114.58 116.17 2oky h GLU 90 Ca 0.00 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.62 2oky h GLU 90 Cb 0.51 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 2oky h GLU 90 CO 0.00 0.84 0.00 0.41 -1.40 0.00 0.00 179.01 178.86 2oky n GLY 91 N -0.50 -1.81 3.29 -3.84 0.00 0.51 -4.65 105.19 98.19 2oky n GLY 91 Ca 0.02 -1.75 -0.11 0.00 0.00 0.00 0.00 46.02 44.18 2oky n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2oky s TYR 92 N 0.00 -0.15 -0.22 1.61 -0.85 -0.72 -1.28 117.35 115.74 2oky s TYR 92 Ca 0.00 -0.11 -0.12 0.00 -0.52 0.00 0.00 57.07 56.32 2oky s TYR 92 Cb 0.00 0.18 -0.05 0.00 0.38 0.00 0.00 41.96 42.47 2oky s TYR 92 CO 0.00 -0.62 0.24 0.08 -1.52 0.00 0.00 175.55 173.73 2oky s VAL 93 N -3.37 5.31 -0.26 -3.49 1.01 -0.50 -1.44 120.40 117.66 2oky s VAL 93 Ca 0.00 0.36 -0.08 0.00 0.00 0.00 0.00 61.98 62.27 2oky s VAL 93 Cb 0.01 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 2oky s VAL 93 CO -0.09 0.32 0.10 -1.58 0.00 0.00 0.00 175.10 173.85 2oky s GLN 94 N 1.10 3.66 0.03 2.72 0.74 0.92 -2.72 119.66 126.11 2oky s GLN 94 Ca 0.12 -0.48 0.07 0.00 0.05 0.00 0.00 55.36 55.12 2oky s GLN 94 Cb -0.14 -3.40 -0.03 0.00 1.10 0.00 0.00 33.01 30.55 2oky s GLN 94 CO 0.05 -0.21 -0.21 -1.21 -0.55 0.00 0.00 175.29 173.16 2oky s GLU 95 N 1.63 2.05 0.06 1.67 2.02 -0.99 -0.90 118.70 124.25 2oky s GLU 95 Ca 0.06 -0.98 -0.11 0.00 0.02 0.00 0.00 54.97 53.97 2oky s GLU 95 Cb -0.15 -2.14 0.01 0.00 0.10 0.00 0.00 34.13 31.95 2oky s GLU 95 CO 0.05 0.54 0.23 1.03 0.02 0.00 0.00 175.26 177.13 2oky s ARG 96 N -1.21 0.79 -0.10 1.61 0.52 -0.76 -1.84 118.95 117.95 2oky s ARG 96 Ca 0.13 -0.71 -0.01 0.00 -0.52 0.00 0.00 55.73 54.62 2oky s ARG 96 Cb -0.10 0.33 0.03 0.00 0.52 0.00 0.00 34.95 35.72 2oky s ARG 96 CO 0.03 -0.25 -0.06 0.99 0.02 0.00 0.00 175.30 176.04 2oky s THR 97 N -3.04 0.86 -0.16 0.02 2.01 -0.35 -1.27 115.64 113.71 2oky s THR 97 Ca -0.01 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 61.80 2oky s THR 97 Cb 0.01 -0.91 -0.00 0.00 0.01 0.00 0.00 72.50 71.61 2oky s THR 97 CO -0.06 0.34 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.42 2oky s ILE 98 N 1.75 2.64 -0.25 1.82 1.01 0.62 -0.99 121.20 127.78 2oky s ILE 98 Ca 0.04 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 59.86 2oky s ILE 98 Cb -0.13 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.22 2oky s ILE 98 CO -0.07 0.51 0.03 -0.36 0.00 0.00 0.00 174.94 175.05 2oky s PHE 99 N 0.87 3.06 -0.32 3.97 0.40 -0.62 -0.46 117.98 124.88 2oky s PHE 99 Ca -0.04 -0.83 -0.19 0.00 -0.60 0.00 0.00 56.93 55.27 2oky s PHE 99 Cb -0.15 -2.19 -0.01 0.00 0.51 0.00 0.00 43.02 41.18 2oky s PHE 99 CO -0.01 -0.51 0.56 -0.06 0.70 0.00 0.00 175.22 175.90 2oky s PHE 100 N 1.52 3.20 -0.47 0.36 0.40 -0.59 -0.78 117.98 121.63 2oky s PHE 100 Ca 0.05 0.43 -0.45 0.00 -0.60 0.00 0.00 56.93 56.35 2oky s PHE 100 Cb -0.16 -2.92 -0.19 0.00 0.51 0.00 0.00 43.02 40.26 2oky s PHE 100 CO 0.00 -0.47 1.71 1.17 0.70 0.00 0.00 175.22 178.34 2oky n LYS 101 N 5.78 0.18 -3.57 0.44 3.00 -0.36 -0.10 118.16 123.53 2oky n LYS 101 Ca -0.03 0.06 -0.26 0.00 -0.00 0.00 0.00 58.31 58.08 2oky n LYS 101 Cb 0.49 -1.60 0.01 0.00 0.00 0.00 0.00 35.03 33.93 2oky n LYS 101 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2oky n ASP 102 N 4.82 -4.60 -0.06 3.14 8.00 -1.26 -4.86 116.55 121.73 2oky n ASP 102 Ca 0.34 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 55.29 2oky n ASP 102 Cb -0.03 -3.72 0.00 0.00 -0.02 0.00 0.00 41.12 37.35 2oky n ASP 102 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2oky n ASP 103 N -2.57 0.00 -2.80 -2.24 -0.08 0.86 -4.98 116.55 104.74 2oky n ASP 103 Ca -0.00 -0.06 -0.07 0.00 -1.51 0.00 0.00 54.79 53.14 2oky n ASP 103 Cb 0.55 0.00 0.06 0.00 2.34 0.00 0.00 41.12 44.07 2oky n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2oky n GLY 104 N 0.00 -2.68 3.21 0.27 0.00 -1.21 -4.48 105.19 100.29 2oky n GLY 104 Ca 0.00 -1.43 -0.12 0.00 0.00 0.00 0.00 46.02 44.47 2oky n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oky s ASN 105 N -2.25 0.77 -0.01 1.61 2.20 -1.04 -1.54 114.94 114.68 2oky s ASN 105 Ca 0.18 -1.22 0.04 0.00 -0.94 0.00 0.00 52.86 50.91 2oky s ASN 105 Cb -0.02 0.21 -0.01 0.00 -2.00 0.00 0.00 41.25 39.43 2oky s ASN 105 CO 0.14 -0.67 -0.12 -0.31 -2.94 0.00 0.00 177.10 173.19 2oky s TYR 106 N -3.86 1.10 -0.09 1.54 2.02 0.39 -2.69 117.35 115.76 2oky s TYR 106 Ca 0.26 -0.22 0.03 0.00 -0.37 0.00 0.00 57.07 56.78 2oky s TYR 106 Cb 0.07 -0.71 0.00 0.00 -0.40 0.00 0.00 41.96 40.93 2oky s TYR 106 CO 0.05 -0.02 -0.21 0.15 -1.57 0.00 0.00 175.55 173.95 2oky s LYS 107 N -0.35 2.67 0.03 -0.62 1.02 -0.02 -0.28 119.74 122.19 2oky s LYS 107 Ca 0.04 -0.75 0.05 0.00 0.02 0.00 0.00 55.97 55.34 2oky s LYS 107 Cb -0.05 -2.06 -0.02 0.00 -0.52 0.00 0.00 37.83 35.18 2oky s LYS 107 CO -0.00 0.12 -0.15 0.95 -0.92 0.00 0.00 175.35 175.35 2oky s THR 108 N 0.47 1.17 -0.06 2.17 -4.23 -0.39 -1.33 115.64 113.43 2oky s THR 108 Ca -0.17 -0.95 0.01 0.00 -1.18 0.00 0.00 61.69 59.40 2oky s THR 108 Cb -0.17 -1.04 0.02 0.00 1.34 0.00 0.00 72.50 72.65 2oky s THR 108 CO 0.07 0.08 -0.07 -0.60 -0.54 0.00 0.00 174.62 173.56 2oky s ARG 109 N -1.00 1.18 0.03 3.99 3.52 -0.66 -1.83 118.95 124.17 2oky s ARG 109 Ca 0.03 -0.21 0.01 0.00 -0.13 0.00 0.00 55.73 55.44 2oky s ARG 109 Cb -0.08 -1.12 -0.02 0.00 -1.56 0.00 0.00 34.95 32.18 2oky s ARG 109 CO 0.01 -0.08 -0.05 0.00 -0.81 0.00 0.00 175.30 174.36 2oky s ALA 110 N 1.01 0.38 -0.15 6.12 0.00 -0.08 -0.43 121.76 128.61 2oky s ALA 110 Ca -0.09 -0.60 0.02 0.00 0.00 0.00 0.00 51.96 51.29 2oky s ALA 110 Cb -0.14 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.05 2oky s ALA 110 CO -0.00 -0.05 -0.20 -1.21 0.00 0.00 0.00 175.76 174.30 2oky s GLU 111 N -1.28 2.81 -0.24 0.00 2.02 -0.60 -0.06 118.70 121.36 2oky s GLU 111 Ca -0.10 -0.77 -0.03 0.00 0.02 0.00 0.00 54.97 54.10 2oky s GLU 111 Cb -0.08 -2.34 0.01 0.00 0.10 0.00 0.00 34.13 31.81 2oky s GLU 111 CO -0.00 -0.09 -0.06 0.08 0.02 0.00 0.00 175.26 175.21 2oky s VAL 112 N 1.03 3.04 0.21 2.63 1.01 -0.52 -1.12 120.40 126.68 2oky s VAL 112 Ca -0.03 -0.81 -0.20 0.00 0.00 0.00 0.00 61.98 60.94 2oky s VAL 112 Cb -0.15 -2.47 0.04 0.00 0.00 0.00 0.00 36.38 33.80 2oky s VAL 112 CO -0.05 0.30 0.60 -0.75 0.00 0.00 0.00 175.10 175.20 2oky s LYS 113 N 1.39 1.48 -0.17 2.72 2.20 0.13 -1.76 119.74 125.73 2oky s LYS 113 Ca 0.03 -0.81 -0.23 0.00 -0.36 0.00 0.00 55.97 54.60 2oky s LYS 113 Cb -0.15 0.57 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 2oky s LYS 113 CO -0.04 -0.65 0.74 -0.06 -0.36 0.00 0.00 175.35 174.98 2oky s PHE 114 N -3.86 3.42 -0.52 4.03 0.08 -1.22 -0.17 117.98 119.75 2oky s PHE 114 Ca 0.08 1.13 -0.00 0.00 0.12 0.00 0.00 56.93 58.26 2oky s PHE 114 Cb -0.02 -2.91 0.14 0.00 -0.57 0.00 0.00 43.02 39.65 2oky s PHE 114 CO -0.02 -0.19 0.30 -1.21 -0.10 0.00 0.00 175.22 174.00 2oky s GLU 115 N 1.94 2.17 7.46 0.44 2.02 0.40 -4.96 118.70 128.17 2oky s GLU 115 Ca 0.35 -2.33 0.00 0.00 0.02 0.00 0.00 54.97 53.01 2oky s GLU 115 Cb -0.16 -3.53 0.00 0.00 0.10 0.00 0.00 34.13 30.53 2oky s GLU 115 CO 0.12 -1.11 0.00 0.41 0.02 0.00 0.00 175.26 174.70 2oky n GLY 116 N 3.71 2.70 0.09 -1.39 0.00 -1.26 -2.36 105.19 106.68 2oky n GLY 116 Ca 0.05 -0.26 0.13 0.00 0.00 0.00 0.00 46.02 45.93 2oky n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2oky n ASP 117 N 6.71 0.63 -4.83 1.61 8.00 -1.26 -4.89 116.55 122.51 2oky n ASP 117 Ca 0.00 -0.43 -0.35 0.00 0.71 0.00 0.00 54.79 54.72 2oky n ASP 117 Cb 0.00 0.14 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 2oky n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2oky s THR 118 N -2.80 5.15 -0.28 -3.53 2.01 -0.99 -4.46 115.64 110.73 2oky s THR 118 Ca 0.17 -0.03 -0.19 0.00 0.31 0.00 0.00 61.69 61.95 2oky s THR 118 Cb 0.18 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.40 2oky s THR 118 CO 0.61 0.53 0.55 -0.22 -0.69 0.00 0.00 174.62 175.40 2oky s LEU 119 N -1.25 4.11 -0.10 4.42 2.96 -0.02 -0.45 118.68 128.34 2oky s LEU 119 Ca 0.18 0.44 -0.00 0.00 -0.22 0.00 0.00 54.13 54.53 2oky s LEU 119 Cb -0.12 -2.70 -0.02 0.00 0.50 0.00 0.00 46.19 43.85 2oky s LEU 119 CO 0.08 -0.36 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.96 2oky s VAL 120 N 2.40 3.47 -0.38 1.68 1.01 0.77 -1.85 120.40 127.49 2oky s VAL 120 Ca 0.22 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.67 2oky s VAL 120 Cb -0.15 -2.45 0.11 0.00 0.00 0.00 0.00 36.38 33.89 2oky s VAL 120 CO 0.10 0.55 0.14 0.21 0.00 0.00 0.00 175.10 176.10 2oky s ASN 121 N -0.20 4.98 -0.25 3.32 2.47 -0.64 -0.70 114.94 123.93 2oky s ASN 121 Ca 0.02 -2.15 -0.09 0.00 0.42 0.00 0.00 52.86 51.06 2oky s ASN 121 Cb -0.13 -1.72 -0.04 0.00 -1.45 0.00 0.00 41.25 37.90 2oky s ASN 121 CO 0.03 -0.45 0.12 -0.13 -3.72 0.00 0.00 177.10 172.95 2oky s ARG 122 N 0.94 3.85 0.03 0.43 0.52 -0.27 -1.45 118.95 122.99 2oky s ARG 122 Ca 0.10 -0.38 0.08 0.00 -0.52 0.00 0.00 55.73 55.01 2oky s ARG 122 Cb -0.21 -3.45 -0.02 0.00 0.52 0.00 0.00 34.95 31.79 2oky s ARG 122 CO -0.06 -0.09 -0.24 0.42 0.02 0.00 0.00 175.30 175.35 2oky s ILE 123 N 1.42 1.93 -0.20 1.52 1.01 0.18 -1.56 121.20 125.50 2oky s ILE 123 Ca 0.06 -1.23 -0.02 0.00 0.00 0.00 0.00 60.65 59.46 2oky s ILE 123 Cb -0.15 -1.64 -0.00 0.00 0.01 0.00 0.00 42.46 40.68 2oky s ILE 123 CO 0.06 0.37 -0.09 -1.61 0.00 0.00 0.00 174.94 173.67 2oky s GLU 124 N -1.03 3.31 -0.08 2.79 2.02 0.42 -0.82 118.70 125.32 2oky s GLU 124 Ca 0.10 -0.67 0.04 0.00 0.02 0.00 0.00 54.97 54.45 2oky s GLU 124 Cb -0.09 -2.87 0.00 0.00 0.10 0.00 0.00 34.13 31.27 2oky s GLU 124 CO 0.01 -0.13 -0.20 -1.17 0.02 0.00 0.00 175.26 173.78 2oky s LEU 125 N 1.26 1.95 -0.09 1.80 0.20 -0.18 -1.65 118.68 121.96 2oky s LEU 125 Ca 0.03 -0.46 -0.01 0.00 0.69 0.00 0.00 54.13 54.38 2oky s LEU 125 Cb -0.14 -1.20 0.03 0.00 -0.43 0.00 0.00 46.19 44.45 2oky s LEU 125 CO -0.04 0.14 -0.04 -0.75 -0.29 0.00 0.00 176.35 175.37 2oky s LYS 126 N 0.31 1.09 -0.07 1.98 2.20 -0.44 -1.54 119.74 123.27 2oky s LYS 126 Ca -0.14 -0.09 0.05 0.00 -0.36 0.00 0.00 55.97 55.43 2oky s LYS 126 Cb -0.16 -1.28 -0.00 0.00 -1.51 0.00 0.00 37.83 34.88 2oky s LYS 126 CO 0.06 -0.27 -0.22 0.20 -0.36 0.00 0.00 175.35 174.76 2oky s GLY 127 N 1.77 1.19 0.17 5.54 0.00 -0.68 -0.84 107.32 114.46 2oky s GLY 127 Ca 0.04 -0.89 0.06 0.00 0.00 0.00 0.00 44.72 43.92 2oky s GLY 127 CO -0.06 -0.41 -0.12 -0.26 0.00 0.00 0.00 173.10 172.25 2oky s ILE 128 N 0.13 1.43 -0.76 0.90 -4.36 -1.09 0.40 121.20 117.84 2oky s ILE 128 Ca -0.10 -2.13 0.00 0.00 -0.26 0.00 0.00 60.65 58.16 2oky s ILE 128 Cb -0.15 -1.94 0.00 0.00 1.25 0.00 0.00 42.46 41.62 2oky s ILE 128 CO 0.05 -0.67 0.00 0.47 0.24 0.00 0.00 174.94 175.03 2oky n ASP 129 N -0.28 -3.68 -4.81 4.36 8.00 -1.26 -2.50 116.55 116.38 2oky n ASP 129 Ca -0.09 0.15 -0.36 0.00 0.71 0.00 0.00 54.79 55.19 2oky n ASP 129 Cb 0.61 -2.05 -0.06 0.00 -0.02 0.00 0.00 41.12 39.59 2oky n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2oky s PHE 130 N -2.29 3.66 -0.17 1.24 0.40 -1.26 -3.33 117.98 116.23 2oky s PHE 130 Ca 0.00 1.48 -0.29 0.00 -0.60 0.00 0.00 56.93 57.52 2oky s PHE 130 Cb 0.00 -2.69 -0.02 0.00 0.51 0.00 0.00 43.02 40.82 2oky s PHE 130 CO 0.00 0.31 1.31 0.15 0.70 0.00 0.00 175.22 177.69 2oky s LYS 131 N -1.98 4.20 0.00 0.44 -0.14 -1.26 -4.81 119.74 116.19 2oky s LYS 131 Ca 0.45 1.68 0.00 0.00 -1.36 0.00 0.00 55.97 56.74 2oky s LYS 131 Cb -0.17 -3.80 0.00 0.00 -1.68 0.00 0.00 37.83 32.18 2oky s LYS 131 CO 0.22 -0.76 0.00 0.39 -0.76 0.00 0.00 175.35 174.43 2oky n GLU 132 N 6.73 0.00 -0.03 1.68 -0.58 -1.26 0.13 120.64 127.31 2oky n GLU 132 Ca 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 2oky n GLU 132 Cb 0.45 -0.95 0.00 0.00 -0.57 0.00 0.00 31.44 30.36 2oky n GLU 132 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2oky n ASP 133 N -0.09 0.00 -2.56 1.62 5.75 -1.26 -4.56 116.55 115.44 2oky n ASP 133 Ca 0.00 -1.04 -0.01 0.00 -0.01 0.00 0.00 54.79 53.72 2oky n ASP 133 Cb 0.00 -0.01 0.01 0.00 -1.03 0.00 0.00 41.12 40.09 2oky n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2oky n GLY 134 N 0.00 -2.49 0.14 6.12 0.00 0.35 -4.56 105.19 104.75 2oky n GLY 134 Ca 0.00 -1.44 -0.00 0.00 0.00 0.00 0.00 46.02 44.57 2oky n GLY 134 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2oky h ASN 135 N -1.11 0.00 0.00 1.61 2.35 -1.94 -0.46 115.58 116.04 2oky h ASN 135 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2oky h ASN 135 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2oky h ASN 135 CO 0.01 0.59 0.00 -0.38 -1.65 0.00 0.00 177.43 176.00 2oky n ILE 136 N -3.75 0.00 0.21 2.81 2.08 -1.26 -0.92 119.36 118.53 2oky n ILE 136 Ca -0.01 0.31 0.09 0.00 0.56 0.00 0.00 62.75 63.70 2oky n ILE 136 Cb 0.60 -0.96 0.46 0.00 -0.75 0.00 0.00 39.64 39.00 2oky n ILE 136 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2oky n LEU 137 N -1.48 0.47 -0.59 1.39 4.77 -1.26 -1.04 117.00 119.27 2oky n LEU 137 Ca 0.00 0.69 0.12 0.00 -0.03 0.00 0.00 56.01 56.79 2oky n LEU 137 Cb 0.00 -0.71 0.21 0.00 -2.33 0.00 0.00 43.42 40.59 2oky n LEU 137 CO 0.00 -0.76 0.58 0.61 -1.33 0.00 0.00 177.39 176.50 2oky n GLY 138 N -0.96 0.20 3.31 -0.72 0.00 -0.18 -4.74 105.19 102.11 2oky n GLY 138 Ca -0.00 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.30 2oky n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2oky n HIS 139 N 0.32 -2.47 -0.52 1.61 8.25 -0.21 -4.92 115.22 117.28 2oky n HIS 139 Ca 0.13 0.85 0.06 0.00 -0.26 0.00 0.00 57.72 58.50 2oky n HIS 139 Cb 0.46 -3.93 0.15 0.00 1.12 0.00 0.00 29.99 27.79 2oky n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2oky n LYS 140 N -3.03 2.68 -3.16 -0.41 5.02 -0.10 -4.99 118.16 114.17 2oky n LYS 140 Ca -0.07 -2.26 -0.38 0.00 -2.02 0.00 0.00 58.31 53.58 2oky n LYS 140 Cb 0.59 -1.42 -0.06 0.00 -0.02 0.00 0.00 35.03 34.11 2oky n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2oky s LEU 141 N -1.83 4.49 0.35 -0.35 1.43 -1.25 -1.49 118.68 120.04 2oky s LEU 141 Ca 0.26 1.39 -0.27 0.00 -1.03 0.00 0.00 54.13 54.48 2oky s LEU 141 Cb 0.19 -3.20 -0.09 0.00 0.03 0.00 0.00 46.19 43.11 2oky s LEU 141 CO 0.09 0.18 1.13 -1.61 0.23 0.00 0.00 176.35 176.37 2oky s GLU 142 N -1.40 4.30 -1.37 1.70 2.02 0.11 -4.78 118.70 119.28 2oky s GLU 142 Ca 0.35 1.79 -0.16 0.00 0.02 0.00 0.00 54.97 56.97 2oky s GLU 142 Cb -0.19 -2.85 0.06 0.00 0.10 0.00 0.00 34.13 31.25 2oky s GLU 142 CO 0.22 -0.09 1.96 0.98 0.02 0.00 0.00 175.26 178.34 2oky n TYR 143 N 0.47 4.09 -3.11 1.61 9.36 -1.26 -4.81 117.16 123.52 2oky n TYR 143 Ca 0.02 -2.92 -0.00 0.00 3.32 0.00 0.00 57.90 58.32 2oky n TYR 143 Cb 0.46 -2.56 0.00 0.00 -0.63 0.00 0.00 39.34 36.62 2oky n TYR 143 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2oky n ASN 144 N 7.05 -0.01 -3.61 2.98 0.23 -1.26 -4.89 115.26 115.74 2oky n ASN 144 Ca 0.49 -1.01 -0.10 0.00 -0.53 0.00 0.00 54.58 53.44 2oky n ASN 144 Cb 0.42 0.01 -0.06 0.00 -2.08 0.00 0.00 39.78 38.07 2oky n ASN 144 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 2oky s TYR 145 N -8.25 -0.46 0.48 -2.53 6.14 -1.26 -4.85 117.35 106.62 2oky s TYR 145 Ca 0.00 1.01 0.08 0.00 0.64 0.00 0.00 57.07 58.80 2oky s TYR 145 Cb -0.00 0.39 0.03 0.00 0.42 0.00 0.00 41.96 42.80 2oky s TYR 145 CO 0.00 -0.28 0.55 -0.80 0.64 0.00 0.00 175.55 175.66 2oky s ASN 146 N -0.25 5.18 0.32 4.32 0.01 -1.26 -4.70 114.94 118.56 2oky s ASN 146 Ca 0.01 -0.75 -0.13 0.00 -0.71 0.00 0.00 52.86 51.28 2oky s ASN 146 Cb -0.03 -0.21 -0.08 0.00 0.41 0.00 0.00 41.25 41.33 2oky s ASN 146 CO -0.03 -0.94 0.71 -0.44 -1.51 0.00 0.00 177.10 174.89 2oky s SER 147 N -4.36 6.69 0.08 -1.22 0.01 -1.26 -4.42 113.70 109.22 2oky s SER 147 Ca 0.52 1.18 -0.09 0.00 1.31 0.00 0.00 55.95 58.86 2oky s SER 147 Cb -0.06 -2.33 0.00 0.00 0.21 0.00 0.00 66.02 63.84 2oky s SER 147 CO 0.31 -0.22 0.20 -1.00 0.41 0.00 0.00 173.24 172.95 2oky s HIS 148 N -2.03 0.11 -0.13 2.43 3.76 -1.01 -4.98 115.29 113.43 2oky s HIS 148 Ca 0.52 -0.49 -0.04 0.00 -0.15 0.00 0.00 55.06 54.90 2oky s HIS 148 Cb -0.10 -0.04 -0.03 0.00 1.11 0.00 0.00 32.58 33.52 2oky s HIS 148 CO 0.21 -0.53 0.00 -0.80 -0.85 0.00 0.00 174.74 172.77 2oky s ASN 149 N -2.70 5.20 -0.31 1.40 0.01 -1.26 -0.73 114.94 116.55 2oky s ASN 149 Ca 0.03 0.04 -0.06 0.00 -0.71 0.00 0.00 52.86 52.16 2oky s ASN 149 Cb 0.04 -1.70 0.02 0.00 0.41 0.00 0.00 41.25 40.01 2oky s ASN 149 CO -0.10 0.26 0.08 -0.69 -1.51 0.00 0.00 177.10 175.14 2oky s VAL 150 N -0.17 3.85 -0.16 1.60 1.01 0.10 -4.72 120.40 121.91 2oky s VAL 150 Ca 0.05 -0.85 -0.22 0.00 0.00 0.00 0.00 61.98 60.96 2oky s VAL 150 Cb -0.13 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 2oky s VAL 150 CO 0.02 0.01 0.68 -0.31 0.00 0.00 0.00 175.10 175.50 2oky s TYR 151 N 1.46 3.43 -0.06 5.22 2.02 -0.68 -0.91 117.35 127.84 2oky s TYR 151 Ca 0.01 1.06 0.02 0.00 -0.37 0.00 0.00 57.07 57.79 2oky s TYR 151 Cb -0.18 -2.83 -0.03 0.00 -0.40 0.00 0.00 41.96 38.52 2oky s TYR 151 CO 0.02 -0.12 -0.09 0.42 -1.57 0.00 0.00 175.55 174.22 2oky s ILE 152 N 1.67 3.54 -0.01 2.71 1.09 0.14 -1.60 121.20 128.75 2oky s ILE 152 Ca 0.32 -0.56 0.01 0.00 -1.10 0.00 0.00 60.65 59.32 2oky s ILE 152 Cb -0.16 -2.44 0.01 0.00 -1.06 0.00 0.00 42.46 38.81 2oky s ILE 152 CO 0.12 0.58 -0.03 -0.04 -0.10 0.00 0.00 174.94 175.48 2oky s MET 153 N -0.84 0.37 0.65 2.79 -1.94 -0.46 -2.62 119.30 117.25 2oky s MET 153 Ca 0.12 -0.08 -0.16 0.00 -1.71 0.00 0.00 55.69 53.87 2oky s MET 153 Cb -0.11 -0.41 -0.01 0.00 2.01 0.00 0.00 34.83 36.31 2oky s MET 153 CO 0.02 0.01 1.13 0.00 -0.01 0.00 0.00 175.02 176.16 2oky s ALA 154 N 0.32 2.47 -0.48 3.03 0.00 -1.25 -0.09 121.76 125.76 2oky s ALA 154 Ca -0.03 0.64 0.03 0.00 0.00 0.00 0.00 51.96 52.61 2oky s ALA 154 Cb -0.06 -3.35 0.16 0.00 0.00 0.00 0.00 23.12 19.87 2oky s ALA 154 CO -0.01 -1.25 0.35 0.34 0.00 0.00 0.00 175.76 175.19 2oky s ASP 155 N -2.35 2.88 0.23 0.00 3.68 0.13 -4.62 116.67 116.62 2oky s ASP 155 Ca 0.69 -3.09 -0.06 0.00 2.13 0.00 0.00 52.55 52.22 2oky s ASP 155 Cb -0.22 -0.86 0.34 0.00 -1.45 0.00 0.00 42.92 40.73 2oky s ASP 155 CO 0.39 -0.18 1.80 0.11 0.13 0.00 0.00 175.17 177.42 2oky h LYS 156 N 5.94 0.70 -0.91 4.34 1.57 -1.94 -1.60 116.57 124.66 2oky h LYS 156 Ca 0.16 -0.04 0.20 0.00 -1.87 0.00 0.00 60.65 59.10 2oky h LYS 156 Cb 0.88 -0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.96 2oky h LYS 156 CO 0.47 0.46 0.60 1.96 -0.57 0.00 0.00 179.45 182.37 2oky h GLN 157 N 0.72 0.42 -0.54 3.15 1.08 -1.94 -0.81 115.11 117.19 2oky h GLN 157 Ca 0.36 -0.03 -0.15 0.00 -1.45 0.00 0.00 58.65 57.39 2oky h GLN 157 Cb 0.31 -0.10 -0.09 0.00 -0.05 0.00 0.00 27.48 27.56 2oky h GLN 157 CO -0.23 0.28 0.13 1.63 -0.95 0.00 0.00 178.83 179.69 2oky n LYS 158 N -4.53 3.23 -3.57 1.46 5.02 -0.65 -4.94 118.16 114.19 2oky n LYS 158 Ca 0.20 -3.05 -0.24 0.00 -2.02 0.00 0.00 58.31 53.20 2oky n LYS 158 Cb 0.69 -2.05 -0.06 0.00 -0.02 0.00 0.00 35.03 33.59 2oky n LYS 158 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2oky n ASN 159 N -0.40 -0.27 -0.16 4.39 5.15 -0.31 -4.74 115.26 118.93 2oky n ASN 159 Ca 0.34 -0.81 0.00 0.00 -0.60 0.00 0.00 54.58 53.51 2oky n ASN 159 Cb 1.19 -1.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 2oky n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2oky n GLY 160 N -1.45 3.28 3.39 8.20 0.00 -0.91 -4.32 105.19 113.36 2oky n GLY 160 Ca -0.07 -0.93 -0.20 0.00 0.00 0.00 0.00 46.02 44.83 2oky n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2oky s ILE 161 N -2.64 1.66 -0.11 -0.61 -4.36 -0.39 0.20 121.20 114.95 2oky s ILE 161 Ca 0.00 -2.16 0.03 0.00 -0.26 0.00 0.00 60.65 58.26 2oky s ILE 161 Cb 0.00 -2.26 0.01 0.00 1.25 0.00 0.00 42.46 41.46 2oky s ILE 161 CO 0.00 -0.44 -0.22 -0.75 0.24 0.00 0.00 174.94 173.78 2oky s LYS 162 N -3.69 2.86 0.03 0.37 2.20 0.87 -1.21 119.74 121.17 2oky s LYS 162 Ca 0.26 -0.81 0.08 0.00 -0.36 0.00 0.00 55.97 55.15 2oky s LYS 162 Cb 0.02 -2.25 -0.03 0.00 -1.51 0.00 0.00 37.83 34.07 2oky s LYS 162 CO 0.09 0.08 -0.25 0.08 -0.36 0.00 0.00 175.35 174.99 2oky s VAL 163 N 0.59 1.99 0.01 4.02 1.01 0.13 -1.35 120.40 126.80 2oky s VAL 163 Ca -0.13 -1.28 -0.03 0.00 0.00 0.00 0.00 61.98 60.54 2oky s VAL 163 Cb -0.17 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 2oky s VAL 163 CO 0.04 0.37 0.04 0.20 0.00 0.00 0.00 175.10 175.74 2oky s ASN 164 N -1.09 0.12 -0.26 3.32 0.01 -0.62 -1.60 114.94 114.82 2oky s ASN 164 Ca 0.10 -0.30 -0.38 0.00 -0.71 0.00 0.00 52.86 51.58 2oky s ASN 164 Cb -0.10 0.14 0.16 0.00 0.41 0.00 0.00 41.25 41.85 2oky s ASN 164 CO 0.01 -0.27 1.38 0.72 -1.51 0.00 0.00 177.10 177.44 2oky s PHE 165 N -1.16 -0.02 -0.07 2.20 -0.71 -1.18 -1.68 117.98 115.36 2oky s PHE 165 Ca -0.13 0.01 0.03 0.00 -1.04 0.00 0.00 56.93 55.80 2oky s PHE 165 Cb -0.07 0.50 0.01 0.00 -1.21 0.00 0.00 43.02 42.24 2oky s PHE 165 CO -0.00 -0.03 -0.17 0.15 -1.34 0.00 0.00 175.22 173.83 2oky s LYS 166 N -2.06 2.15 -0.13 1.99 1.02 -1.26 -0.46 119.74 120.99 2oky s LYS 166 Ca 0.12 -0.60 -0.05 0.00 0.02 0.00 0.00 55.97 55.46 2oky s LYS 166 Cb 0.00 -1.72 -0.04 0.00 -0.52 0.00 0.00 37.83 35.55 2oky s LYS 166 CO -0.03 0.12 0.05 0.42 -0.92 0.00 0.00 175.35 175.00 2oky s ILE 167 N 0.43 4.73 -0.42 2.17 -1.09 -0.87 -4.92 121.20 121.21 2oky s ILE 167 Ca -0.14 -0.08 -0.13 0.00 -2.23 0.00 0.00 60.65 58.07 2oky s ILE 167 Cb -0.16 -3.06 0.05 0.00 -1.58 0.00 0.00 42.46 37.71 2oky s ILE 167 CO 0.05 0.56 0.30 -0.13 -1.23 0.00 0.00 174.94 174.49 2oky s ARG 168 N -0.45 2.88 -0.22 2.79 0.52 -1.26 -1.72 118.95 121.50 2oky s ARG 168 Ca 0.09 -1.20 -0.10 0.00 -0.52 0.00 0.00 55.73 54.00 2oky s ARG 168 Cb -0.12 -3.94 -0.05 0.00 0.52 0.00 0.00 34.95 31.36 2oky s ARG 168 CO 0.02 -0.85 0.15 -1.01 0.02 0.00 0.00 175.30 173.63 2oky s HIS 169 N 1.60 3.36 0.15 -0.53 3.76 0.17 -4.53 115.29 119.26 2oky s HIS 169 Ca 0.04 0.28 -0.28 0.00 -0.15 0.00 0.00 55.06 54.95 2oky s HIS 169 Cb -0.21 -2.23 -0.07 0.00 1.11 0.00 0.00 32.58 31.18 2oky s HIS 169 CO 0.07 0.16 0.88 -0.80 -0.85 0.00 0.00 174.74 174.21 2oky s ASN 170 N 0.75 7.47 -0.08 1.40 0.01 -1.26 0.25 114.94 123.48 2oky s ASN 170 Ca 0.08 1.75 -0.04 0.00 -0.71 0.00 0.00 52.86 53.94 2oky s ASN 170 Cb -0.12 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 38.94 2oky s ASN 170 CO 0.02 0.07 0.10 -0.63 -1.51 0.00 0.00 177.10 175.15 2oky s ILE 171 N -0.59 5.12 0.12 0.60 1.01 -0.48 0.08 121.20 127.06 2oky s ILE 171 Ca 0.41 -0.02 -0.21 0.00 0.00 0.00 0.00 60.65 60.83 2oky s ILE 171 Cb -0.24 -3.25 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 2oky s ILE 171 CO 0.29 0.55 1.10 -0.62 0.00 0.00 0.00 174.94 176.25 2oky n GLU 172 N 1.79 -0.30 0.00 2.79 1.02 -0.56 -0.03 120.64 125.35 2oky n GLU 172 Ca -0.18 1.08 0.00 0.00 -0.02 0.00 0.00 57.16 58.04 2oky n GLU 172 Cb 0.54 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 2oky n GLU 172 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2oky n ASP 173 N -4.91 0.00 0.00 1.62 5.68 -1.26 -4.77 116.55 112.91 2oky n ASP 173 Ca 0.02 0.12 0.00 0.00 -0.50 0.00 0.00 54.79 54.42 2oky n ASP 173 Cb 0.19 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 2oky n ASP 173 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2oky n GLY 174 N -1.05 0.47 3.77 6.12 0.00 0.96 -5.07 105.19 110.37 2oky n GLY 174 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2oky n GLY 174 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2oky n SER 175 N 0.00 1.13 -4.31 1.61 2.88 -1.25 -4.86 113.62 108.83 2oky n SER 175 Ca 0.00 -2.01 -0.27 0.00 -1.33 0.00 0.00 58.87 55.26 2oky n SER 175 Cb 0.00 -0.68 -0.14 0.00 -0.75 0.00 0.00 64.21 62.64 2oky n SER 175 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2oky s VAL 176 N -3.12 1.92 -0.29 2.46 1.01 -1.26 -1.38 120.40 119.73 2oky s VAL 176 Ca 0.66 -1.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 2oky s VAL 176 Cb -0.03 -1.68 0.05 0.00 0.00 0.00 0.00 36.38 34.71 2oky s VAL 176 CO 0.44 0.18 -0.02 -1.58 0.00 0.00 0.00 175.10 174.12 2oky s GLN 177 N -1.50 2.41 0.37 2.72 2.00 0.14 -4.93 119.66 120.87 2oky s GLN 177 Ca 0.10 -1.27 -0.12 0.00 -2.00 0.00 0.00 55.36 52.06 2oky s GLN 177 Cb -0.10 -3.14 -0.07 0.00 0.80 0.00 0.00 33.01 30.50 2oky s GLN 177 CO 0.03 -0.61 0.75 -0.51 -0.50 0.00 0.00 175.29 174.45 2oky s LEU 178 N 1.23 3.93 -0.27 3.68 1.02 -1.26 -0.66 118.68 126.35 2oky s LEU 178 Ca -0.06 1.18 -0.04 0.00 0.02 0.00 0.00 54.13 55.24 2oky s LEU 178 Cb -0.20 -4.03 0.10 0.00 0.02 0.00 0.00 46.19 42.09 2oky s LEU 178 CO -0.02 -0.32 0.16 0.00 0.02 0.00 0.00 176.35 176.20 2oky s ALA 179 N -2.21 0.38 -0.30 4.21 0.00 -0.70 -1.23 121.76 121.93 2oky s ALA 179 Ca 0.52 -0.83 -0.29 0.00 0.00 0.00 0.00 51.96 51.37 2oky s ALA 179 Cb -0.10 -1.42 0.01 0.00 0.00 0.00 0.00 23.12 21.61 2oky s ALA 179 CO 0.26 -1.59 1.12 0.34 0.00 0.00 0.00 175.76 175.88 2oky s ASP 180 N 2.16 6.91 -0.18 0.00 3.68 0.04 -2.06 116.67 127.23 2oky s ASP 180 Ca 0.08 1.16 -0.09 0.00 2.13 0.00 0.00 52.55 55.83 2oky s ASP 180 Cb -0.16 -2.54 -0.05 0.00 -1.45 0.00 0.00 42.92 38.73 2oky s ASP 180 CO -0.32 -0.88 0.11 -1.00 0.13 0.00 0.00 175.17 173.21 2oky s HIS 181 N 3.70 3.40 -0.16 -5.34 3.76 0.40 -1.59 115.29 119.44 2oky s HIS 181 Ca 0.48 0.30 0.01 0.00 -0.15 0.00 0.00 55.06 55.69 2oky s HIS 181 Cb -0.14 -2.09 0.01 0.00 1.11 0.00 0.00 32.58 31.47 2oky s HIS 181 CO 0.15 0.34 -0.17 0.71 -0.85 0.00 0.00 174.74 174.92 2oky s TYR 182 N 0.08 2.77 0.00 1.40 1.51 -0.16 -3.09 117.35 119.85 2oky s TYR 182 Ca 0.08 -1.29 0.01 0.00 -1.01 0.00 0.00 57.07 54.86 2oky s TYR 182 Cb -0.11 -1.90 -0.00 0.00 -0.11 0.00 0.00 41.96 39.83 2oky s TYR 182 CO -0.00 -0.62 -0.02 -1.14 -1.11 0.00 0.00 175.55 172.66 2oky s GLN 183 N 1.02 0.18 0.02 -0.62 0.74 -0.63 -1.21 119.66 119.16 2oky s GLN 183 Ca -0.02 -0.15 0.02 0.00 0.05 0.00 0.00 55.36 55.26 2oky s GLN 183 Cb -0.15 -0.13 -0.01 0.00 1.10 0.00 0.00 33.01 33.82 2oky s GLN 183 CO -0.05 0.03 -0.07 1.14 -0.55 0.00 0.00 175.29 175.79 2oky s GLN 184 N -0.25 0.54 -0.06 1.67 -2.07 -0.77 0.22 119.66 118.94 2oky s GLN 184 Ca -0.01 -0.47 0.02 0.00 -1.82 0.00 0.00 55.36 53.08 2oky s GLN 184 Cb -0.02 -0.45 0.01 0.00 -1.09 0.00 0.00 33.01 31.47 2oky s GLN 184 CO -0.00 0.11 -0.11 -0.80 -1.32 0.00 0.00 175.29 173.17 2oky s ASN 185 N -0.77 1.59 -0.02 12.60 -0.87 -0.35 -2.35 114.94 124.77 2oky s ASN 185 Ca -0.02 -0.26 0.03 0.00 -1.57 0.00 0.00 52.86 51.04 2oky s ASN 185 Cb -0.06 -0.73 -0.00 0.00 -0.02 0.00 0.00 41.25 40.44 2oky s ASN 185 CO 0.00 0.02 -0.10 0.42 -2.57 0.00 0.00 177.10 174.87 2oky s THR 186 N 0.67 0.85 0.61 1.60 -4.23 -1.10 -1.27 115.64 112.77 2oky s THR 186 Ca -0.13 -0.44 -0.19 0.00 -1.18 0.00 0.00 61.69 59.75 2oky s THR 186 Cb -0.15 -0.72 -0.03 0.00 1.34 0.00 0.00 72.50 72.94 2oky s THR 186 CO 0.03 0.25 1.26 -2.16 -0.54 0.00 0.00 174.62 173.46 2oky s PRO 187 N -0.09 2.83 -0.08 3.99 0.04 -1.26 -1.41 135.00 139.01 2oky s PRO 187 Ca 0.01 1.98 0.15 0.00 0.04 0.00 0.00 61.00 63.19 2oky s PRO 187 Cb -0.06 -1.94 -0.23 0.00 0.04 0.00 0.00 34.50 32.31 2oky s PRO 187 CO -0.00 -1.36 0.48 -0.89 0.04 0.00 0.00 177.00 175.27 2oky n ILE 188 N -1.63 1.46 -2.95 0.56 5.41 -0.41 -4.80 119.36 117.01 2oky n ILE 188 Ca 0.14 -0.80 -0.18 0.00 1.00 0.00 0.00 62.75 62.91 2oky n ILE 188 Cb 0.48 -0.80 0.01 0.00 -0.71 0.00 0.00 39.64 38.63 2oky n ILE 188 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2oky s GLY 189 N -5.19 1.93 0.00 7.39 0.00 -1.26 -5.01 107.32 105.18 2oky s GLY 189 Ca -0.06 -1.61 0.25 0.00 0.00 0.00 0.00 44.72 43.29 2oky s GLY 189 CO 0.83 -1.42 1.40 1.22 0.00 0.00 0.00 173.10 175.12 2oky n ASP 190 N -1.93 0.94 -4.66 1.64 9.92 -1.26 -4.94 116.55 116.27 2oky n ASP 190 Ca 0.08 -0.74 -0.30 0.00 -0.53 0.00 0.00 54.79 53.30 2oky n ASP 190 Cb 0.59 0.30 0.17 0.00 -0.64 0.00 0.00 41.12 41.54 2oky n ASP 190 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2oky s GLY 191 N -2.73 1.65 -0.13 0.44 0.00 -1.26 -4.94 107.32 100.35 2oky s GLY 191 Ca 0.17 0.31 -0.29 0.00 0.00 0.00 0.00 44.72 44.91 2oky s GLY 191 CO 0.62 0.79 1.12 2.56 0.00 0.00 0.00 173.10 178.19 2oky s PRO 192 N -4.69 4.33 0.39 2.90 0.04 -1.26 -5.05 135.00 131.66 2oky s PRO 192 Ca 0.66 1.52 0.08 0.00 0.04 0.00 0.00 61.00 63.29 2oky s PRO 192 Cb -0.22 -3.61 -0.01 0.00 0.04 0.00 0.00 34.50 30.70 2oky s PRO 192 CO 0.59 -0.50 0.43 0.14 0.04 0.00 0.00 177.00 177.70 2oky s VAL 193 N 2.61 3.18 -0.11 -0.36 -7.23 -1.26 -4.98 120.40 112.25 2oky s VAL 193 Ca 0.51 -1.19 -0.23 0.00 -1.81 0.00 0.00 61.98 59.26 2oky s VAL 193 Cb -0.20 -3.11 -0.03 0.00 0.56 0.00 0.00 36.38 33.60 2oky s VAL 193 CO 0.16 -0.06 0.70 -0.76 -0.31 0.00 0.00 175.10 174.82 2oky s LEU 194 N -4.17 4.26 -0.28 1.32 1.43 -1.26 -5.03 118.68 114.95 2oky s LEU 194 Ca 0.48 1.10 -0.09 0.00 -1.03 0.00 0.00 54.13 54.59 2oky s LEU 194 Cb -0.07 -3.05 -0.03 0.00 0.03 0.00 0.00 46.19 43.08 2oky s LEU 194 CO 0.30 -0.19 0.14 -0.76 0.23 0.00 0.00 176.35 176.07 2oky s LEU 195 N 1.22 3.86 0.84 1.79 1.43 -1.26 -4.18 118.68 122.37 2oky s LEU 195 Ca 0.35 -0.28 -0.12 0.00 -1.03 0.00 0.00 54.13 53.05 2oky s LEU 195 Cb -0.17 -2.01 0.12 0.00 0.03 0.00 0.00 46.19 44.16 2oky s LEU 195 CO 0.15 -0.10 1.19 -2.16 0.23 0.00 0.00 176.35 175.66 2oky s PRO 196 N 1.65 1.58 0.18 1.29 0.04 -1.26 -4.93 135.00 133.55 2oky s PRO 196 Ca 0.06 -0.17 -0.01 0.00 0.04 0.00 0.00 61.00 60.93 2oky s PRO 196 Cb -0.16 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 2oky s PRO 196 CO 0.07 -1.79 0.36 -0.51 0.04 0.00 0.00 177.00 175.17 2oky s ASP 197 N -4.67 6.39 -0.17 6.66 -0.00 -1.26 -3.82 116.67 119.79 2oky s ASP 197 Ca 0.66 0.39 -0.38 0.00 -0.00 0.00 0.00 52.55 53.22 2oky s ASP 197 Cb -0.08 -2.01 -0.15 0.00 -0.00 0.00 0.00 42.92 40.68 2oky s ASP 197 CO 0.49 -0.01 1.74 0.59 -0.00 0.00 0.00 175.17 177.99 2oky n ASN 198 N -0.48 2.66 -2.12 0.27 4.13 -1.26 -4.86 115.26 113.60 2oky n ASN 198 Ca -0.05 1.05 -0.07 0.00 1.68 0.00 0.00 54.58 57.19 2oky n ASN 198 Cb 0.53 -1.22 0.00 0.00 -1.54 0.00 0.00 39.78 37.55 2oky n ASN 198 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2oky n HIS 199 N 5.40 -1.46 -4.15 3.10 1.44 -1.08 -4.80 115.22 113.67 2oky n HIS 199 Ca 0.24 -1.24 -0.11 0.00 -2.01 0.00 0.00 57.72 54.60 2oky n HIS 199 Cb 0.19 0.45 -0.09 0.00 0.12 0.00 0.00 29.99 30.66 2oky n HIS 199 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 2oky s TYR 200 N -4.43 0.96 -0.13 -1.40 1.13 -0.30 -0.68 117.35 112.50 2oky s TYR 200 Ca 0.13 -1.22 0.02 0.00 -1.41 0.00 0.00 57.07 54.59 2oky s TYR 200 Cb -0.02 -0.40 0.00 0.00 -1.10 0.00 0.00 41.96 40.44 2oky s TYR 200 CO 0.10 -0.69 -0.20 -0.51 -2.51 0.00 0.00 175.55 171.73 2oky s LEU 201 N -3.12 2.22 -0.43 -3.49 1.43 -0.08 0.16 118.68 115.37 2oky s LEU 201 Ca 0.34 -0.55 -0.22 0.00 -1.03 0.00 0.00 54.13 52.67 2oky s LEU 201 Cb 0.06 -1.47 0.02 0.00 0.03 0.00 0.00 46.19 44.83 2oky s LEU 201 CO 0.10 0.10 0.72 -0.55 0.23 0.00 0.00 176.35 176.95 2oky s SER 202 N 0.68 6.39 -0.11 2.29 0.15 -0.75 -0.72 113.70 121.63 2oky s SER 202 Ca -0.10 -0.15 -0.04 0.00 0.70 0.00 0.00 55.95 56.37 2oky s SER 202 Cb -0.16 -2.36 -0.04 0.00 -1.71 0.00 0.00 66.02 61.76 2oky s SER 202 CO 0.01 -0.83 0.05 0.42 1.20 0.00 0.00 173.24 174.09 2oky s THR 203 N 3.06 4.69 -0.03 6.45 -4.23 0.09 -2.49 115.64 123.18 2oky s THR 203 Ca 0.27 -0.10 0.03 0.00 -1.18 0.00 0.00 61.69 60.71 2oky s THR 203 Cb -0.13 -3.01 0.00 0.00 1.34 0.00 0.00 72.50 70.70 2oky s THR 203 CO 0.20 0.59 -0.11 -1.10 -0.54 0.00 0.00 174.62 173.66 2oky s GLN 204 N -0.73 1.12 -0.04 3.99 -0.21 -0.28 -2.41 119.66 121.11 2oky s GLN 204 Ca 0.12 -0.37 0.03 0.00 0.02 0.00 0.00 55.36 55.16 2oky s GLN 204 Cb -0.12 -1.03 0.00 0.00 1.00 0.00 0.00 33.01 32.87 2oky s GLN 204 CO 0.02 0.15 -0.12 0.00 -2.12 0.00 0.00 175.29 173.22 2oky s ALA 206 N 0.22 1.13 -0.13 0.00 0.00 -0.83 -4.45 121.76 117.70 2oky s ALA 206 Ca -0.05 -0.39 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 2oky s ALA 206 Cb -0.11 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.23 2oky s ALA 206 CO 0.01 -0.26 -0.00 -0.51 0.00 0.00 0.00 175.76 175.00 2oky s LEU 207 N 1.44 3.49 0.00 0.00 1.43 -1.26 -2.18 118.68 121.60 2oky s LEU 207 Ca -0.01 0.03 0.06 0.00 -1.03 0.00 0.00 54.13 53.18 2oky s LEU 207 Cb -0.13 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 2oky s LEU 207 CO -0.04 0.27 0.20 -1.54 0.23 0.00 0.00 176.35 175.47 2oky n SER 208 N 2.88 -0.17 -4.08 2.29 3.41 0.30 -4.92 113.62 113.33 2oky n SER 208 Ca -0.18 -2.77 -0.21 0.00 -0.26 0.00 0.00 58.87 55.46 2oky n SER 208 Cb 0.53 1.24 -0.15 0.00 -0.26 0.00 0.00 64.21 65.57 2oky n SER 208 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2oky s LYS 209 N -3.13 0.97 -0.63 4.33 -0.14 -1.26 -1.92 119.74 117.96 2oky s LYS 209 Ca 0.29 -0.47 -0.22 0.00 -1.36 0.00 0.00 55.97 54.21 2oky s LYS 209 Cb 0.01 -0.94 0.07 0.00 -1.68 0.00 0.00 37.83 35.29 2oky s LYS 209 CO 0.20 0.25 0.92 0.34 -0.76 0.00 0.00 175.35 176.31 2oky s ASP 210 N -0.38 6.20 0.40 2.83 2.15 -1.26 -4.93 116.67 121.68 2oky s ASP 210 Ca 0.04 -0.92 0.12 0.00 0.43 0.00 0.00 52.55 52.22 2oky s ASP 210 Cb -0.05 -2.41 0.63 0.00 -0.30 0.00 0.00 42.92 40.79 2oky s ASP 210 CO -0.00 -1.36 1.24 1.55 -0.17 0.00 0.00 175.17 176.43 2oky h PRO 211 N 9.47 0.00 0.00 4.34 0.13 -2.04 0.42 132.00 144.32 2oky h PRO 211 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2oky h PRO 211 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2oky h PRO 211 CO 1.15 0.00 -0.71 0.09 -0.23 0.00 0.00 178.00 178.30 2oky n ASN 212 N -2.14 0.67 -4.73 1.44 3.02 -1.26 -4.89 115.26 107.37 2oky n ASN 212 Ca -0.01 -0.47 -0.40 0.00 -0.03 0.00 0.00 54.58 53.67 2oky n ASN 212 Cb 0.48 0.54 -0.05 0.00 -0.61 0.00 0.00 39.78 40.14 2oky n ASN 212 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2oky s GLU 213 N -3.02 4.45 -0.18 3.52 2.56 0.15 -4.96 118.70 121.21 2oky s GLU 213 Ca 0.09 0.93 0.03 0.00 0.00 0.00 0.00 54.97 56.03 2oky s GLU 213 Cb 0.17 -3.42 -0.22 0.00 2.00 0.00 0.00 34.13 32.66 2oky s GLU 213 CO 0.76 0.13 0.11 1.63 -0.56 0.00 0.00 175.26 177.33 2oky n LYS 214 N 3.51 0.69 -0.94 4.30 4.76 -1.26 -4.94 118.16 124.27 2oky n LYS 214 Ca -0.02 0.17 -0.30 0.00 -2.87 0.00 0.00 58.31 55.30 2oky n LYS 214 Cb 0.51 -1.61 0.15 0.00 -1.84 0.00 0.00 35.03 32.24 2oky n LYS 214 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2oky s ARG 215 N -2.54 1.16 0.04 1.97 0.52 -1.26 -4.93 118.95 113.92 2oky s ARG 215 Ca -0.23 1.19 -0.31 0.00 -0.52 0.00 0.00 55.73 55.87 2oky s ARG 215 Cb 0.08 -1.77 -0.06 0.00 0.52 0.00 0.00 34.95 33.71 2oky s ARG 215 CO 0.72 -2.41 1.39 0.34 0.02 0.00 0.00 175.30 175.35 2oky s ASP 216 N -3.02 6.85 0.26 0.23 -1.08 -1.26 -4.92 116.67 113.73 2oky s ASP 216 Ca 0.65 2.18 -0.14 0.00 -0.52 0.00 0.00 52.55 54.71 2oky s ASP 216 Cb -0.20 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.69 2oky s ASP 216 CO 0.58 -0.69 0.53 -1.38 0.52 0.00 0.00 175.17 174.73 2oky s HIS 217 N 1.93 0.27 -0.08 -5.34 -3.43 -1.26 0.11 115.29 107.49 2oky s HIS 217 Ca 0.64 -0.65 -0.04 0.00 -0.80 0.00 0.00 55.06 54.22 2oky s HIS 217 Cb -0.33 0.29 0.04 0.00 -1.43 0.00 0.00 32.58 31.15 2oky s HIS 217 CO 0.28 -1.05 0.18 1.41 -2.00 0.00 0.00 174.74 173.56 2oky s MET 218 N -3.97 0.11 -0.25 -0.38 1.75 0.99 -4.97 119.30 112.58 2oky s MET 218 Ca 0.20 0.46 -0.09 0.00 -1.25 0.00 0.00 55.69 55.01 2oky s MET 218 Cb -0.02 -0.18 -0.04 0.00 2.84 0.00 0.00 34.83 37.44 2oky s MET 218 CO 0.09 -0.20 0.12 0.08 -0.65 0.00 0.00 175.02 174.46 2oky s VAL 219 N 1.46 4.86 -0.09 10.11 1.01 -0.81 0.47 120.40 137.42 2oky s VAL 219 Ca -0.06 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.95 2oky s VAL 219 Cb -0.11 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 33.01 2oky s VAL 219 CO -0.07 0.33 -0.14 -0.22 0.00 0.00 0.00 175.10 175.00 2oky s LEU 220 N 1.39 1.68 -0.02 3.92 2.96 0.33 -0.54 118.68 128.39 2oky s LEU 220 Ca 0.06 -0.37 0.07 0.00 -0.22 0.00 0.00 54.13 53.68 2oky s LEU 220 Cb -0.15 -0.97 -0.02 0.00 0.50 0.00 0.00 46.19 45.55 2oky s LEU 220 CO 0.06 0.03 -0.25 -0.76 -1.32 0.00 0.00 176.35 174.11 2oky s LEU 221 N 0.83 2.05 -0.02 -0.68 1.02 -0.93 0.96 118.68 121.92 2oky s LEU 221 Ca -0.11 -0.45 -0.02 0.00 0.02 0.00 0.00 54.13 53.58 2oky s LEU 221 Cb -0.15 -1.28 0.00 0.00 0.02 0.00 0.00 46.19 44.78 2oky s LEU 221 CO 0.01 0.30 0.05 -0.70 0.02 0.00 0.00 176.35 176.03 2oky s GLU 222 N -0.54 0.08 -0.24 1.70 2.12 -0.25 -1.95 118.70 119.60 2oky s GLU 222 Ca 0.08 0.04 0.01 0.00 0.36 0.00 0.00 54.97 55.46 2oky s GLU 222 Cb -0.10 0.04 0.04 0.00 0.26 0.00 0.00 34.13 34.37 2oky s GLU 222 CO -0.01 -0.01 -0.10 -0.06 -0.54 0.00 0.00 175.26 174.54 2oky s PHE 223 N -0.05 3.11 -0.07 5.30 0.08 -0.42 -1.30 117.98 124.64 2oky s PHE 223 Ca -0.01 -1.93 0.02 0.00 0.12 0.00 0.00 56.93 55.13 2oky s PHE 223 Cb -0.01 -1.98 0.02 0.00 -0.57 0.00 0.00 43.02 40.48 2oky s PHE 223 CO 0.00 -0.82 -0.10 0.08 -0.10 0.00 0.00 175.22 174.28 2oky s VAL 224 N 1.22 1.01 -0.07 -0.44 1.01 0.07 -1.13 120.40 122.07 2oky s VAL 224 Ca -0.03 -0.39 -0.00 0.00 0.00 0.00 0.00 61.98 61.56 2oky s VAL 224 Cb -0.18 -0.95 0.03 0.00 0.00 0.00 0.00 36.38 35.28 2oky s VAL 224 CO -0.06 0.33 -0.02 -0.89 0.00 0.00 0.00 175.10 174.46 2oky s THR 225 N 0.85 0.51 0.16 3.92 2.01 -1.04 -1.58 115.64 120.47 2oky s THR 225 Ca -0.11 -0.01 -0.31 0.00 0.31 0.00 0.00 61.69 61.57 2oky s THR 225 Cb -0.15 -0.61 -0.09 0.00 0.01 0.00 0.00 72.50 71.66 2oky s THR 225 CO 0.01 0.26 1.49 0.00 -0.69 0.00 0.00 174.62 175.69 2oky s ALA 226 N 1.59 3.69 0.10 7.40 0.00 0.12 -1.81 121.76 132.85 2oky s ALA 226 Ca -0.00 1.27 0.02 0.00 0.00 0.00 0.00 51.96 53.25 2oky s ALA 226 Cb -0.13 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.40 2oky s ALA 226 CO -0.04 -0.71 0.07 0.00 0.00 0.00 0.00 175.76 175.08 2oky n ALA 227 N 3.75 0.20 -0.93 0.00 0.00 0.42 -4.47 120.51 119.49 2oky n ALA 227 Ca 0.12 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2oky n ALA 227 Cb 0.40 0.44 0.00 0.00 0.00 0.00 0.00 19.45 20.29 2oky n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oky n GLY 228 N 0.25 0.49 0.00 0.00 0.00 -1.26 -1.15 105.19 103.52 2oky n GLY 228 Ca 0.01 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2oky n GLY 228 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71