#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2whu h VAL 3 N 0.00 0.56 -3.59 2.46 2.07 -1.99 -3.38 116.25 112.39 2whu h VAL 3 Ca 0.00 -0.04 -0.71 0.00 0.82 0.00 0.00 66.70 66.77 2whu h VAL 3 Cb 0.00 0.43 -0.26 0.00 -1.52 0.00 0.00 31.29 29.93 2whu h VAL 3 CO 0.00 0.02 -0.53 -0.63 0.02 0.00 0.00 177.57 176.45 2whu s ILE 4 N -6.16 4.27 0.96 4.57 1.01 -1.26 -4.96 121.20 119.63 2whu s ILE 4 Ca -0.13 -1.05 -0.12 0.00 0.00 0.00 0.00 60.65 59.35 2whu s ILE 4 Cb 0.17 -3.44 0.16 0.00 0.01 0.00 0.00 42.46 39.37 2whu s ILE 4 CO 0.73 -0.27 1.09 0.00 0.00 0.00 0.00 174.94 176.49 2whu s ALA 5 N 1.48 1.19 -0.09 9.38 0.00 -1.26 -4.97 121.76 127.49 2whu s ALA 5 Ca 0.01 -0.24 -0.26 0.00 0.00 0.00 0.00 51.96 51.46 2whu s ALA 5 Cb -0.20 -3.15 -0.22 0.00 0.00 0.00 0.00 23.12 19.55 2whu s ALA 5 CO 0.05 -2.64 0.93 0.87 0.00 0.00 0.00 175.76 174.97 2whu h LYS 6 N -1.76 -0.02 -6.08 0.00 1.57 -1.97 -3.40 116.57 104.92 2whu h LYS 6 Ca -0.52 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 57.66 2whu h LYS 6 Cb 1.31 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.58 2whu h LYS 6 CO 0.56 0.72 -0.26 -1.14 -0.57 0.00 0.00 179.45 178.77 2whu s GLN 7 N -3.02 3.75 0.11 3.15 2.00 -1.26 -3.41 119.66 120.97 2whu s GLN 7 Ca -0.17 0.16 -0.24 0.00 -2.00 0.00 0.00 55.36 53.11 2whu s GLN 7 Cb -0.01 -3.02 0.07 0.00 0.80 0.00 0.00 33.01 30.84 2whu s GLN 7 CO 0.65 0.58 0.60 -1.64 -0.50 0.00 0.00 175.29 174.98 2whu s MET 8 N -1.83 1.21 0.48 1.67 -1.94 -0.97 -4.97 119.30 112.95 2whu s MET 8 Ca 0.32 -0.32 0.02 0.00 -1.71 0.00 0.00 55.69 54.00 2whu s MET 8 Cb -0.14 0.56 -0.03 0.00 2.01 0.00 0.00 34.83 37.23 2whu s MET 8 CO 0.17 -0.50 0.02 0.95 -0.01 0.00 0.00 175.02 175.66 2whu s THR 9 N -3.16 1.23 0.16 2.05 -4.23 -0.01 -1.50 115.64 110.18 2whu s THR 9 Ca -0.02 -2.00 -0.23 0.00 -1.18 0.00 0.00 61.69 58.26 2whu s THR 9 Cb -0.01 -2.32 0.07 0.00 1.34 0.00 0.00 72.50 71.58 2whu s THR 9 CO -0.08 0.00 0.66 -0.72 -0.54 0.00 0.00 174.62 173.94 2whu s TYR 10 N -2.89 -0.46 -0.04 3.99 -0.85 -0.54 -1.06 117.35 115.50 2whu s TYR 10 Ca 0.13 0.22 0.03 0.00 -0.52 0.00 0.00 57.07 56.92 2whu s TYR 10 Cb 0.03 0.58 0.00 0.00 0.38 0.00 0.00 41.96 42.96 2whu s TYR 10 CO 0.07 -0.87 -0.11 0.21 -1.52 0.00 0.00 175.55 173.33 2whu s LYS 11 N -3.68 1.25 -0.02 -3.49 2.47 -0.08 -0.76 119.74 115.42 2whu s LYS 11 Ca 0.03 -0.39 0.04 0.00 -1.56 0.00 0.00 55.97 54.10 2whu s LYS 11 Cb -0.02 -1.13 -0.01 0.00 -1.46 0.00 0.00 37.83 35.22 2whu s LYS 11 CO -0.09 0.13 -0.14 0.54 0.16 0.00 0.00 175.35 175.94 2whu s VAL 12 N 0.23 1.16 -0.13 4.02 0.11 -1.06 -1.48 120.40 123.26 2whu s VAL 12 Ca -0.05 -0.61 -0.00 0.00 -2.93 0.00 0.00 61.98 58.38 2whu s VAL 12 Cb -0.10 -0.97 -0.02 0.00 -1.53 0.00 0.00 36.38 33.76 2whu s VAL 12 CO 0.01 0.33 -0.11 -0.31 -3.33 0.00 0.00 175.10 171.69 2whu s TYR 13 N -0.25 2.84 -0.05 1.54 1.51 0.49 0.26 117.35 123.69 2whu s TYR 13 Ca 0.04 -0.53 0.00 0.00 -1.01 0.00 0.00 57.07 55.57 2whu s TYR 13 Cb -0.07 -1.85 0.02 0.00 -0.11 0.00 0.00 41.96 39.96 2whu s TYR 13 CO -0.00 -0.14 -0.02 1.41 -1.11 0.00 0.00 175.55 175.69 2whu s MET 14 N 0.24 0.62 -0.00 -0.62 1.75 0.19 0.62 119.30 122.10 2whu s MET 14 Ca -0.08 0.01 0.02 0.00 -1.25 0.00 0.00 55.69 54.39 2whu s MET 14 Cb -0.15 -0.78 -0.01 0.00 2.84 0.00 0.00 34.83 36.73 2whu s MET 14 CO 0.05 -0.16 -0.07 -1.54 -0.65 0.00 0.00 175.02 172.65 2whu s SER 15 N 1.25 0.81 0.16 1.11 1.04 -0.17 -0.30 113.70 117.60 2whu s SER 15 Ca -0.06 -0.15 -0.23 0.00 0.48 0.00 0.00 55.95 55.99 2whu s SER 15 Cb -0.13 -0.08 0.08 0.00 0.10 0.00 0.00 66.02 65.98 2whu s SER 15 CO -0.02 0.07 1.08 -0.83 0.98 0.00 0.00 173.24 174.51 2whu s GLY 16 N -0.26 0.10 -0.14 7.32 0.00 -1.10 -0.71 107.32 112.53 2whu s GLY 16 Ca 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 44.72 44.41 2whu s GLY 16 CO -0.00 3.15 -0.05 -1.59 0.00 0.00 0.00 173.10 174.61 2whu s THR 17 N -2.08 0.97 -0.28 0.90 2.01 -0.81 -1.28 115.64 115.06 2whu s THR 17 Ca 0.24 -0.46 -0.03 0.00 0.31 0.00 0.00 61.69 61.75 2whu s THR 17 Cb -0.02 -1.13 0.03 0.00 0.01 0.00 0.00 72.50 71.39 2whu s THR 17 CO 0.05 0.18 0.00 -0.69 -0.69 0.00 0.00 174.62 173.46 2whu s VAL 18 N 1.70 3.21 -1.24 3.82 1.01 0.78 -0.47 120.40 129.22 2whu s VAL 18 Ca 0.02 -1.08 -0.12 0.00 0.00 0.00 0.00 61.98 60.80 2whu s VAL 18 Cb -0.14 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2whu s VAL 18 CO -0.08 0.05 0.67 0.59 0.00 0.00 0.00 175.10 176.33 2whu n ASN 19 N 4.71 -3.35 0.00 3.32 3.02 0.81 -1.82 115.26 121.94 2whu n ASN 19 Ca -0.15 -0.99 0.00 0.00 -0.03 0.00 0.00 54.58 53.41 2whu n ASN 19 Cb 0.46 -3.38 0.00 0.00 -0.61 0.00 0.00 39.78 36.25 2whu n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2whu n GLY 20 N -1.75 0.00 3.78 7.41 0.00 -1.26 -4.96 105.19 108.40 2whu n GLY 20 Ca -0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 2whu n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2whu s HIS 21 N -0.95 3.89 0.00 1.61 5.04 -0.76 -5.06 115.29 119.07 2whu s HIS 21 Ca 0.00 1.59 0.04 0.00 -1.54 0.00 0.00 55.06 55.15 2whu s HIS 21 Cb 0.00 -2.73 -0.03 0.00 0.04 0.00 0.00 32.58 29.85 2whu s HIS 21 CO 0.00 0.52 -0.09 -0.47 -2.34 0.00 0.00 174.74 172.36 2whu s TYR 22 N -1.15 2.82 0.26 3.88 5.04 -1.26 -0.15 117.35 126.79 2whu s TYR 22 Ca 0.35 -0.08 -0.16 0.00 -2.44 0.00 0.00 57.07 54.74 2whu s TYR 22 Cb -0.23 -1.59 0.00 0.00 0.35 0.00 0.00 41.96 40.50 2whu s TYR 22 CO 0.25 0.34 0.57 -0.59 -1.34 0.00 0.00 175.55 174.78 2whu s PHE 23 N -0.96 0.16 -0.04 4.97 -0.12 -0.40 -4.44 117.98 117.14 2whu s PHE 23 Ca 0.16 -0.56 -0.02 0.00 -0.05 0.00 0.00 56.93 56.47 2whu s PHE 23 Cb -0.11 0.38 0.03 0.00 -0.63 0.00 0.00 43.02 42.70 2whu s PHE 23 CO 0.06 -1.09 0.09 -1.21 -0.05 0.00 0.00 175.22 173.03 2whu s GLU 24 N -3.98 0.04 -0.04 1.99 2.02 0.36 -2.72 118.70 116.37 2whu s GLU 24 Ca 0.18 0.27 0.06 0.00 0.02 0.00 0.00 54.97 55.50 2whu s GLU 24 Cb -0.03 -0.18 -0.01 0.00 0.10 0.00 0.00 34.13 34.02 2whu s GLU 24 CO 0.08 -0.15 -0.22 0.08 0.02 0.00 0.00 175.26 175.08 2whu s VAL 25 N 0.99 1.78 -0.10 2.63 1.01 0.59 0.00 120.40 127.30 2whu s VAL 25 Ca -0.08 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 60.98 2whu s VAL 25 Cb -0.11 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.79 2whu s VAL 25 CO -0.04 0.50 -0.12 -1.61 0.00 0.00 0.00 175.10 173.83 2whu s GLU 26 N -0.25 1.84 0.15 2.72 2.02 -1.02 0.52 118.70 124.68 2whu s GLU 26 Ca 0.01 -0.42 0.05 0.00 0.02 0.00 0.00 54.97 54.63 2whu s GLU 26 Cb -0.11 -1.64 -0.04 0.00 0.10 0.00 0.00 34.13 32.44 2whu s GLU 26 CO 0.02 -0.10 0.09 0.20 0.02 0.00 0.00 175.26 175.48 2whu s GLY 27 N 1.10 1.78 -0.14 -1.39 0.00 0.14 -2.83 107.32 105.99 2whu s GLY 27 Ca -0.06 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.46 2whu s GLY 27 CO -0.02 -1.21 -0.11 0.99 0.00 0.00 0.00 173.10 172.75 2whu s ASP 28 N -2.88 2.53 0.25 1.64 1.01 -1.16 -2.55 116.67 115.51 2whu s ASP 28 Ca 0.29 -0.45 0.01 0.00 0.71 0.00 0.00 52.55 53.12 2whu s ASP 28 Cb -0.10 -1.03 -0.05 0.00 1.01 0.00 0.00 42.92 42.75 2whu s ASP 28 CO 0.22 -0.09 0.12 -0.83 0.21 0.00 0.00 175.17 174.79 2whu s GLY 29 N 1.58 1.73 -0.05 0.21 0.00 0.06 -1.61 107.32 109.24 2whu s GLY 29 Ca 0.04 -1.81 -0.30 0.00 0.00 0.00 0.00 44.72 42.65 2whu s GLY 29 CO -0.09 -1.55 0.73 -1.59 0.00 0.00 0.00 173.10 170.60 2whu s LYS 30 N -4.02 1.00 0.00 2.90 -2.85 -0.92 -1.47 119.74 114.38 2whu s LYS 30 Ca 0.38 0.16 0.00 0.00 -1.00 0.00 0.00 55.97 55.51 2whu s LYS 30 Cb 0.07 0.47 0.00 0.00 -2.06 0.00 0.00 37.83 36.31 2whu s LYS 30 CO 0.14 -0.33 0.00 0.41 0.10 0.00 0.00 175.35 175.67 2whu n GLY 31 N 0.74 0.14 3.39 0.59 0.00 -0.56 -1.39 105.19 108.10 2whu n GLY 31 Ca -0.17 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 2whu n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2whu s LYS 32 N -2.00 2.90 0.53 1.61 1.02 -1.03 -2.28 119.74 120.48 2whu s LYS 32 Ca 0.00 -1.24 0.31 0.00 0.02 0.00 0.00 55.97 55.06 2whu s LYS 32 Cb 0.00 -3.99 1.33 0.00 -0.52 0.00 0.00 37.83 34.66 2whu s LYS 32 CO 0.00 -0.90 1.98 -1.35 -0.92 0.00 0.00 175.35 174.16 2whu h PRO 33 N 8.63 0.00 -0.00 -1.68 0.11 -1.77 -1.81 132.00 135.47 2whu h PRO 33 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2whu h PRO 33 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2whu h PRO 33 CO 0.79 0.07 -0.37 0.66 -0.21 0.00 0.00 178.00 178.95 2whu n TYR 34 N -3.23 0.00 0.33 0.65 4.01 -1.26 -3.67 117.16 113.99 2whu n TYR 34 Ca -0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 2whu n TYR 34 Cb 0.31 -0.28 -0.07 0.00 -0.31 0.00 0.00 39.34 38.99 2whu n TYR 34 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2whu n GLU 35 N -1.40 0.44 -1.37 -0.72 -0.58 -0.73 -4.47 120.64 111.81 2whu n GLU 35 Ca 0.07 -0.06 -0.05 0.00 -0.42 0.00 0.00 57.16 56.70 2whu n GLU 35 Cb 0.33 -1.59 -0.02 0.00 -0.57 0.00 0.00 31.44 29.59 2whu n GLU 35 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2whu n GLY 36 N 1.32 0.65 3.60 0.62 0.00 -0.88 -4.51 105.19 105.99 2whu n GLY 36 Ca -0.00 -0.78 -0.25 0.00 0.00 0.00 0.00 46.02 44.98 2whu n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2whu s GLU 37 N -2.86 2.14 -0.28 1.61 2.02 -1.22 -0.27 118.70 119.85 2whu s GLU 37 Ca 0.00 -1.35 -0.28 0.00 0.02 0.00 0.00 54.97 53.36 2whu s GLU 37 Cb 0.00 -2.15 0.19 0.00 0.10 0.00 0.00 34.13 32.27 2whu s GLU 37 CO 0.00 0.40 1.34 1.14 0.02 0.00 0.00 175.26 178.17 2whu s GLN 38 N -3.20 0.11 0.41 1.61 -2.07 -1.12 -2.48 119.66 112.92 2whu s GLN 38 Ca 0.28 0.05 0.07 0.00 -1.82 0.00 0.00 55.36 53.94 2whu s GLN 38 Cb -0.08 0.05 -0.08 0.00 -1.09 0.00 0.00 33.01 31.82 2whu s GLN 38 CO 0.17 -0.03 0.02 0.95 -1.32 0.00 0.00 175.29 175.08 2whu s THR 39 N -0.75 2.03 -0.28 3.63 -4.23 -0.48 -1.94 115.64 113.61 2whu s THR 39 Ca 0.08 -1.99 -0.21 0.00 -1.18 0.00 0.00 61.69 58.39 2whu s THR 39 Cb -0.02 -2.99 0.09 0.00 1.34 0.00 0.00 72.50 70.93 2whu s THR 39 CO -0.09 -0.01 0.81 0.54 -0.54 0.00 0.00 174.62 175.33 2whu s VAL 40 N -2.70 0.00 -0.39 2.29 0.11 0.39 -2.17 120.40 117.93 2whu s VAL 40 Ca 0.35 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 59.33 2whu s VAL 40 Cb 0.09 -1.00 0.07 0.00 -1.53 0.00 0.00 36.38 34.01 2whu s VAL 40 CO 0.18 0.00 0.20 -0.54 -3.33 0.00 0.00 175.10 171.62 2whu s LYS 41 N 0.89 2.54 0.63 1.54 1.02 -0.63 -1.58 119.74 124.15 2whu s LYS 41 Ca -0.04 -1.42 -0.05 0.00 0.02 0.00 0.00 55.97 54.49 2whu s LYS 41 Cb -0.05 -3.66 0.04 0.00 -0.52 0.00 0.00 37.83 33.64 2whu s LYS 41 CO -0.09 -0.88 0.92 -0.51 -0.92 0.00 0.00 175.35 173.87 2whu s LEU 42 N 1.38 3.06 -0.01 3.17 2.01 -0.91 -2.99 118.68 124.39 2whu s LEU 42 Ca 0.02 0.45 -0.01 0.00 0.01 0.00 0.00 54.13 54.59 2whu s LEU 42 Cb -0.22 -3.20 0.00 0.00 0.01 0.00 0.00 46.19 42.78 2whu s LEU 42 CO 0.02 -1.32 0.04 -0.89 1.01 0.00 0.00 176.35 175.21 2whu s THR 43 N -3.05 0.02 -0.04 5.49 2.01 -1.13 -3.51 115.64 115.42 2whu s THR 43 Ca 0.57 -0.13 -0.24 0.00 0.31 0.00 0.00 61.69 62.20 2whu s THR 43 Cb -0.11 -0.10 -0.04 0.00 0.01 0.00 0.00 72.50 72.26 2whu s THR 43 CO 0.43 -0.07 0.74 -0.69 -0.69 0.00 0.00 174.62 174.34 2whu s VAL 44 N -0.20 4.97 0.00 3.82 1.01 -1.25 -2.42 120.40 126.32 2whu s VAL 44 Ca -0.02 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.49 2whu s VAL 44 Cb -0.02 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.29 2whu s VAL 44 CO -0.00 0.27 0.05 0.35 0.00 0.00 0.00 175.10 175.77 2whu n THR 45 N 3.57 0.00 -3.36 3.92 -2.24 0.10 -4.78 114.28 111.50 2whu n THR 45 Ca -0.01 -0.35 0.02 0.00 -2.27 0.00 0.00 64.05 61.44 2whu n THR 45 Cb 0.51 1.05 -0.04 0.00 -2.10 0.00 0.00 70.33 69.75 2whu n THR 45 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2whu s LYS 46 N -0.60 0.28 0.00 -0.78 2.20 -1.20 -4.92 119.74 114.72 2whu s LYS 46 Ca 0.00 0.67 0.00 0.00 -0.36 0.00 0.00 55.97 56.28 2whu s LYS 46 Cb 0.00 0.40 0.00 0.00 -1.51 0.00 0.00 37.83 36.72 2whu s LYS 46 CO 0.00 -0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.27 2whu n GLY 47 N 5.03 0.74 3.76 5.54 0.00 -1.26 0.13 105.19 119.13 2whu n GLY 47 Ca -0.08 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 2whu n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2whu s GLY 48 N -2.35 2.86 0.75 -0.02 0.00 -1.26 -3.85 107.32 103.44 2whu s GLY 48 Ca 0.00 1.11 -0.06 0.00 0.00 0.00 0.00 44.72 45.77 2whu s GLY 48 CO 0.00 1.84 1.05 2.56 0.00 0.00 0.00 173.10 178.55 2whu s PRO 49 N -1.19 1.77 0.24 2.90 0.05 -1.26 -5.12 135.00 132.39 2whu s PRO 49 Ca 0.50 -0.57 -0.27 0.00 0.05 0.00 0.00 61.00 60.71 2whu s PRO 49 Cb -0.37 -2.18 -0.09 0.00 0.05 0.00 0.00 34.50 31.92 2whu s PRO 49 CO 0.45 -1.49 0.88 -0.51 0.05 0.00 0.00 177.00 176.39 2whu s LEU 50 N -5.30 4.53 -0.04 -3.56 1.43 -1.25 -4.95 118.68 109.54 2whu s LEU 50 Ca 0.64 1.80 0.12 0.00 -1.03 0.00 0.00 54.13 55.66 2whu s LEU 50 Cb -0.08 -3.63 0.42 0.00 0.03 0.00 0.00 46.19 42.93 2whu s LEU 50 CO 0.46 0.10 1.30 -0.81 0.23 0.00 0.00 176.35 177.63 2whu n PRO 51 N 1.21 2.40 -0.54 1.29 -0.04 -1.26 -4.92 135.00 133.14 2whu n PRO 51 Ca -0.02 -1.67 0.00 0.00 -0.04 0.00 0.00 63.50 61.77 2whu n PRO 51 Cb 0.49 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 2whu n PRO 51 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2whu n PHE 52 N 0.68 -0.21 -3.16 0.54 1.16 -1.26 -4.80 117.46 110.40 2whu n PHE 52 Ca 0.15 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.31 2whu n PHE 52 Cb 0.50 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.30 2whu n PHE 52 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2whu s ALA 53 N -1.44 3.43 0.35 1.98 0.00 -1.00 -4.84 121.76 120.23 2whu s ALA 53 Ca 0.00 -1.03 0.19 0.00 0.00 0.00 0.00 51.96 51.12 2whu s ALA 53 Cb 0.00 -3.16 1.26 0.00 0.00 0.00 0.00 23.12 21.22 2whu s ALA 53 CO 0.00 -1.44 1.52 1.87 0.00 0.00 0.00 175.76 177.72 2whu n TRP 54 N 5.99 1.09 0.29 0.00 -0.00 -1.26 -1.60 117.44 121.95 2whu n TRP 54 Ca -0.03 1.14 0.12 0.00 -0.00 0.00 0.00 57.50 58.74 2whu n TRP 54 Cb 0.48 -1.52 0.66 0.00 -0.00 0.00 0.00 31.31 30.94 2whu n TRP 54 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 177.69 177.25 2whu h ASP 55 N 0.00 0.00 0.98 5.87 3.32 -1.96 -0.89 116.42 123.75 2whu h ASP 55 Ca 0.80 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.70 2whu h ASP 55 Cb 2.10 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.63 2whu h ASP 55 CO -0.76 0.00 -0.71 0.16 -1.72 0.00 0.00 179.24 176.21 2whu h ILE 56 N 0.00 1.35 0.08 0.35 3.07 -1.72 -3.26 117.51 117.39 2whu h ILE 56 Ca 0.00 -2.58 -0.34 0.00 1.55 0.00 0.00 64.86 63.49 2whu h ILE 56 Cb 0.71 2.45 -0.03 0.00 -0.27 0.00 0.00 36.82 39.68 2whu h ILE 56 CO 0.00 0.70 -1.89 0.18 -1.05 0.00 0.00 178.15 176.09 2whu n LEU 57 N -3.46 2.01 -0.35 0.16 4.77 -0.35 -4.50 117.00 115.27 2whu n LEU 57 Ca 0.00 0.29 0.23 0.00 -0.03 0.00 0.00 56.01 56.50 2whu n LEU 57 Cb 0.75 -0.66 0.48 0.00 -2.33 0.00 0.00 43.42 41.66 2whu n LEU 57 CO 0.43 0.69 1.17 0.77 -1.33 0.00 0.00 177.39 179.12 2whu h SER 58 N 0.05 0.52 -0.37 -1.43 4.64 -1.56 1.48 113.55 116.87 2whu h SER 58 Ca -0.37 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2whu h SER 58 Cb 2.03 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 64.19 2whu h SER 58 CO 0.09 -0.01 0.00 -0.81 -0.87 0.00 0.00 176.83 175.23 2whu n PRO 59 N -4.86 2.53 0.00 4.77 -0.04 -1.26 -2.88 135.00 133.26 2whu n PRO 59 Ca 0.29 -1.63 0.11 0.00 -0.04 0.00 0.00 63.50 62.24 2whu n PRO 59 Cb 0.93 -1.60 0.11 0.00 -0.04 0.00 0.00 33.50 32.90 2whu n PRO 59 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2whu n GLN 60 N 0.55 0.00 -3.12 0.54 3.00 0.51 -4.96 117.38 113.90 2whu n GLN 60 Ca 0.15 -0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.73 2whu n GLN 60 Cb 0.55 -1.50 -0.01 0.00 0.00 0.00 0.00 30.24 29.28 2whu n GLN 60 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2whu n LEU 61 N -1.50 5.86 0.00 1.08 4.77 -1.14 -4.98 117.00 121.10 2whu n LEU 61 Ca 0.05 -5.24 0.00 0.00 -0.03 0.00 0.00 56.01 50.79 2whu n LEU 61 Cb 0.33 -1.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 2whu n LEU 61 CO 0.38 1.73 0.00 -0.24 -1.33 0.00 0.00 177.39 177.93 2whu n SER 65 N 1.37 0.00 -0.34 -1.43 2.88 -1.26 -5.02 113.62 109.81 2whu n SER 65 Ca 0.26 0.00 0.20 0.00 -1.33 0.00 0.00 58.87 58.00 2whu n SER 65 Cb 0.35 0.00 0.42 0.00 -0.75 0.00 0.00 64.21 64.23 2whu n SER 65 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2whu h ILE 66 N 0.00 0.47 -1.82 2.46 1.08 -2.01 -1.89 117.51 115.80 2whu h ILE 66 Ca 0.00 -0.17 0.53 0.00 -0.39 0.00 0.00 64.86 64.83 2whu h ILE 66 Cb 0.00 -0.07 -0.07 0.00 -3.07 0.00 0.00 36.82 33.61 2whu h ILE 66 CO 0.00 0.09 1.31 -0.65 -0.69 0.00 0.00 178.15 178.21 2whu h PRO 67 N 0.50 0.00 -2.64 2.37 0.11 -1.98 -2.84 132.00 127.52 2whu h PRO 67 Ca 0.67 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 66.12 2whu h PRO 67 Cb 1.38 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.41 2whu h PRO 67 CO -0.49 0.00 2.51 1.19 -0.21 0.00 0.00 178.00 181.00 2whu n PHE 68 N -3.98 2.27 -3.85 0.65 3.01 -0.71 -4.81 117.46 110.04 2whu n PHE 68 Ca 0.41 -2.74 -0.30 0.00 1.01 0.00 0.00 57.45 55.82 2whu n PHE 68 Cb 1.86 -1.99 -0.15 0.00 -0.01 0.00 0.00 39.48 39.20 2whu n PHE 68 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2whu s THR 69 N -0.05 1.58 -0.44 4.37 2.01 -1.08 -3.97 115.64 118.06 2whu s THR 69 Ca 0.61 -2.06 -0.39 0.00 0.31 0.00 0.00 61.69 60.16 2whu s THR 69 Cb 0.21 -2.16 -0.15 0.00 0.01 0.00 0.00 72.50 70.41 2whu s THR 69 CO -0.09 -0.69 2.19 1.17 -0.69 0.00 0.00 174.62 176.51 2whu n LYS 70 N 4.31 0.58 -4.02 4.92 4.81 -0.96 -4.83 118.16 122.97 2whu n LYS 70 Ca 0.02 0.15 -0.22 0.00 -0.87 0.00 0.00 58.31 57.40 2whu n LYS 70 Cb 0.40 -2.03 -0.04 0.00 0.02 0.00 0.00 35.03 33.38 2whu n LYS 70 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2whu s TYR 71 N 6.89 2.97 0.00 5.64 1.51 -1.26 -2.24 117.35 130.86 2whu s TYR 71 Ca 1.15 -0.21 0.03 0.00 -1.01 0.00 0.00 57.07 57.02 2whu s TYR 71 Cb -1.14 -1.55 -0.03 0.00 -0.11 0.00 0.00 41.96 39.13 2whu s TYR 71 CO 0.56 0.39 -0.05 -1.25 -1.11 0.00 0.00 175.55 174.09 2whu s PRO 72 N -3.88 2.61 0.19 -1.71 0.04 -1.26 -5.00 135.00 125.99 2whu s PRO 72 Ca 0.36 -0.70 -0.03 0.00 0.04 0.00 0.00 61.00 60.68 2whu s PRO 72 Cb -0.07 -2.54 0.38 0.00 0.04 0.00 0.00 34.50 32.31 2whu s PRO 72 CO 0.25 0.61 1.04 0.39 0.04 0.00 0.00 177.00 179.33 2whu n GLU 73 N 1.51 -0.06 0.24 4.56 1.02 -1.26 0.86 120.64 127.52 2whu n GLU 73 Ca -0.15 1.02 0.16 0.00 -0.02 0.00 0.00 57.16 58.18 2whu n GLU 73 Cb 0.53 -1.56 0.71 0.00 -0.02 0.00 0.00 31.44 31.09 2whu n GLU 73 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 2whu h ASP 74 N 0.00 0.00 -3.28 1.62 2.03 -2.03 -3.41 116.42 111.34 2whu h ASP 74 Ca 0.35 0.00 -0.73 0.00 -0.73 0.00 0.00 57.03 55.92 2whu h ASP 74 Cb 0.61 0.00 -0.28 0.00 -0.83 0.00 0.00 39.33 38.83 2whu h ASP 74 CO -0.67 0.00 -0.37 -0.63 -1.03 0.00 0.00 179.24 176.55 2whu s ILE 75 N -3.64 4.47 -0.16 4.15 1.01 0.25 -5.01 121.20 122.27 2whu s ILE 75 Ca 0.01 -1.62 -0.14 0.00 0.00 0.00 0.00 60.65 58.90 2whu s ILE 75 Cb 0.09 -3.87 -0.06 0.00 0.01 0.00 0.00 42.46 38.63 2whu s ILE 75 CO 0.47 -0.74 0.65 -2.65 0.00 0.00 0.00 174.94 172.67 2whu n PRO 76 N 4.99 0.00 -2.68 2.79 -0.02 -1.26 -4.67 135.00 134.16 2whu n PRO 76 Ca -0.10 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 60.96 2whu n PRO 76 Cb 0.41 -0.48 -0.01 0.00 -0.02 0.00 0.00 33.50 33.40 2whu n PRO 76 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2whu s ASP 77 N 1.73 6.73 0.39 2.55 -1.08 -1.26 -4.37 116.67 121.35 2whu s ASP 77 Ca 0.37 -2.13 0.17 0.00 -0.52 0.00 0.00 52.55 50.45 2whu s ASP 77 Cb -0.48 -2.52 1.08 0.00 -1.46 0.00 0.00 42.92 39.54 2whu s ASP 77 CO 0.22 -1.21 1.76 0.22 0.52 0.00 0.00 175.17 176.68 2whu h TYR 78 N 8.46 0.71 0.00 -5.34 3.20 -1.86 0.57 116.97 122.72 2whu h TYR 78 Ca 0.30 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.20 2whu h TYR 78 Cb 0.94 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.01 2whu h TYR 78 CO 1.29 0.05 -0.00 0.74 -1.64 0.00 0.00 178.16 178.60 2whu h PHE 79 N 0.41 -0.00 0.00 -3.82 0.04 -1.95 -2.94 116.94 108.68 2whu h PHE 79 Ca 0.61 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.36 2whu h PHE 79 Cb 1.50 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.65 2whu h PHE 79 CO -0.00 0.85 -0.12 0.87 -0.60 0.00 0.00 178.31 179.31 2whu h LYS 80 N -0.88 0.00 -0.25 1.51 1.57 -1.79 -2.61 116.57 114.11 2whu h LYS 80 Ca -0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 2whu h LYS 80 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2whu h LYS 80 CO 0.00 0.12 -0.61 1.96 -0.57 0.00 0.00 179.45 180.35 2whu h GLN 81 N 0.00 0.86 -0.03 3.15 4.20 -0.82 -3.27 115.11 119.20 2whu h GLN 81 Ca -0.00 -0.59 0.01 0.00 0.06 0.00 0.00 58.65 58.13 2whu h GLN 81 Cb 0.33 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 2whu h GLN 81 CO 0.02 1.22 0.04 0.66 -0.67 0.00 0.00 178.83 180.09 2whu h SER 82 N 0.64 0.00 -4.19 1.46 4.64 -1.28 -3.44 113.55 111.38 2whu h SER 82 Ca -0.01 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.81 2whu h SER 82 Cb 1.23 0.00 0.15 0.00 -0.31 0.00 0.00 62.40 63.47 2whu h SER 82 CO 0.13 0.00 0.27 -0.36 -0.87 0.00 0.00 176.83 176.00 2whu s PHE 83 N -4.53 2.26 -1.07 4.77 0.40 -1.24 -1.59 117.98 116.98 2whu s PHE 83 Ca -0.05 1.50 0.18 0.00 -0.60 0.00 0.00 56.93 57.96 2whu s PHE 83 Cb 0.15 -3.14 0.79 0.00 0.51 0.00 0.00 43.02 41.33 2whu s PHE 83 CO 0.52 -2.27 1.57 -0.35 0.70 0.00 0.00 175.22 175.39 2whu n PRO 84 N -3.83 0.04 0.26 0.24 -0.04 -1.26 -4.73 135.00 125.68 2whu n PRO 84 Ca 0.09 0.18 -0.15 0.00 -0.04 0.00 0.00 63.50 63.58 2whu n PRO 84 Cb 0.53 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 2whu n PRO 84 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2whu h GLU 85 N 0.00 -0.64 0.00 0.54 3.07 -1.88 -3.37 114.58 112.29 2whu h GLU 85 Ca 0.00 0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 2whu h GLU 85 Cb 0.29 0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2whu h GLU 85 CO 0.00 -0.35 0.00 0.41 -1.40 0.00 0.00 179.01 177.67 2whu n GLY 86 N -0.81 -1.50 3.40 -3.84 0.00 -0.62 -4.67 105.19 97.15 2whu n GLY 86 Ca -0.11 -1.73 -0.11 0.00 0.00 0.00 0.00 46.02 44.07 2whu n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2whu s TYR 87 N 0.00 0.76 0.11 1.61 -0.85 -1.01 0.20 117.35 118.16 2whu s TYR 87 Ca 0.00 -1.05 0.08 0.00 -0.52 0.00 0.00 57.07 55.58 2whu s TYR 87 Cb 0.00 -0.18 -0.04 0.00 0.38 0.00 0.00 41.96 42.12 2whu s TYR 87 CO 0.00 -0.82 -0.20 0.95 -1.52 0.00 0.00 175.55 173.96 2whu s THR 88 N -4.09 1.67 0.03 -3.49 -4.23 0.20 0.13 115.64 105.87 2whu s THR 88 Ca 0.31 -1.56 -0.00 0.00 -1.18 0.00 0.00 61.69 59.25 2whu s THR 88 Cb 0.03 -1.55 -0.03 0.00 1.34 0.00 0.00 72.50 72.30 2whu s THR 88 CO 0.10 -0.10 -0.03 -1.66 -0.54 0.00 0.00 174.62 172.39 2whu s TRP 89 N -1.26 0.37 -0.13 3.99 1.48 -0.79 0.92 118.94 123.52 2whu s TRP 89 Ca 0.07 -0.68 -0.02 0.00 -1.06 0.00 0.00 56.10 54.41 2whu s TRP 89 Cb -0.10 -0.27 -0.03 0.00 -1.16 0.00 0.00 33.47 31.92 2whu s TRP 89 CO 0.04 -0.23 -0.06 -1.21 -4.06 0.00 0.00 176.95 171.43 2whu s GLU 90 N -2.17 3.38 0.07 3.25 0.41 0.01 -1.74 118.70 121.91 2whu s GLU 90 Ca -0.09 -0.55 0.07 0.00 -0.41 0.00 0.00 54.97 54.00 2whu s GLU 90 Cb -0.05 -2.79 -0.03 0.00 -1.78 0.00 0.00 34.13 29.48 2whu s GLU 90 CO -0.03 0.36 -0.20 0.50 -0.49 0.00 0.00 175.26 175.40 2whu s ARG 91 N 0.02 1.20 0.00 1.61 3.52 0.71 -0.68 118.95 125.34 2whu s ARG 91 Ca -0.00 -1.04 0.05 0.00 -0.13 0.00 0.00 55.73 54.61 2whu s ARG 91 Cb -0.14 -1.38 -0.02 0.00 -1.56 0.00 0.00 34.95 31.86 2whu s ARG 91 CO 0.03 0.33 -0.16 -1.54 -0.81 0.00 0.00 175.30 173.16 2whu s SER 92 N -1.56 1.85 -0.65 -2.12 1.04 0.52 -0.23 113.70 112.55 2whu s SER 92 Ca 0.06 -0.34 0.05 0.00 0.48 0.00 0.00 55.95 56.20 2whu s SER 92 Cb -0.09 -0.18 0.19 0.00 0.10 0.00 0.00 66.02 66.03 2whu s SER 92 CO 0.03 0.16 0.53 0.23 0.98 0.00 0.00 173.24 175.17 2whu n MET 93 N 2.45 1.76 -2.46 4.02 2.81 0.11 -1.74 117.12 124.07 2whu n MET 93 Ca -0.15 -4.35 -0.39 0.00 -1.81 0.00 0.00 57.70 51.00 2whu n MET 93 Cb 0.55 -2.18 -0.03 0.00 -0.71 0.00 0.00 33.22 30.84 2whu n MET 93 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2whu s ASN 94 N -1.50 6.19 1.03 7.83 0.01 -0.43 -3.18 114.94 124.89 2whu s ASN 94 Ca 0.29 -1.11 -0.13 0.00 -0.71 0.00 0.00 52.86 51.20 2whu s ASN 94 Cb 0.01 -2.57 0.21 0.00 0.41 0.00 0.00 41.25 39.31 2whu s ASN 94 CO -0.14 -1.79 1.10 -0.36 -1.51 0.00 0.00 177.10 174.40 2whu s PHE 95 N 6.04 1.90 -0.03 2.20 0.08 -1.03 -1.07 117.98 126.08 2whu s PHE 95 Ca 0.49 0.91 -0.25 0.00 0.12 0.00 0.00 56.93 58.19 2whu s PHE 95 Cb -0.03 -3.30 -0.20 0.00 -0.57 0.00 0.00 43.02 38.93 2whu s PHE 95 CO -0.04 -3.06 1.17 1.05 -0.10 0.00 0.00 175.22 174.25 2whu h GLU 96 N -2.01 -0.06 -2.00 0.44 4.11 -1.81 -3.20 114.58 110.05 2whu h GLU 96 Ca -0.54 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 58.80 2whu h GLU 96 Cb 1.33 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.56 2whu h GLU 96 CO 0.55 0.44 -0.20 -0.40 0.07 0.00 0.00 179.01 179.47 2whu n ASP 97 N -4.87 5.27 0.00 3.06 5.75 -1.26 -4.82 116.55 119.68 2whu n ASP 97 Ca -0.09 -2.44 0.00 0.00 -0.01 0.00 0.00 54.79 52.25 2whu n ASP 97 Cb 0.27 -1.27 0.00 0.00 -1.03 0.00 0.00 41.12 39.08 2whu n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2whu n GLY 98 N 2.01 0.00 3.68 6.12 0.00 -1.21 -4.72 105.19 111.08 2whu n GLY 98 Ca 0.22 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.80 2whu n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2whu n ALA 99 N 0.78 1.20 -3.20 4.61 0.00 -1.24 -4.82 120.51 117.84 2whu n ALA 99 Ca 0.00 0.40 -0.21 0.00 0.00 0.00 0.00 53.44 53.62 2whu n ALA 99 Cb 0.00 -2.27 -0.16 0.00 0.00 0.00 0.00 19.45 17.02 2whu n ALA 99 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2whu s VAL 100 N -0.29 0.86 -0.19 0.00 1.01 -0.96 -2.46 120.40 118.37 2whu s VAL 100 Ca 0.65 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 62.27 2whu s VAL 100 Cb -0.63 -0.78 0.04 0.00 0.00 0.00 0.00 36.38 35.01 2whu s VAL 100 CO 0.52 0.28 -0.11 0.00 0.00 0.00 0.00 175.10 175.79 2whu s THR 102 N 1.43 5.12 0.02 0.00 -4.23 -0.63 0.07 115.64 117.43 2whu s THR 102 Ca 0.00 0.36 0.01 0.00 -1.18 0.00 0.00 61.69 60.89 2whu s THR 102 Cb -0.15 -3.63 -0.01 0.00 1.34 0.00 0.00 72.50 70.04 2whu s THR 102 CO -0.09 0.26 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.52 2whu s VAL 103 N -1.43 0.25 0.01 2.29 1.01 0.68 -1.65 120.40 121.57 2whu s VAL 103 Ca 0.34 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2whu s VAL 103 Cb -0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 2whu s VAL 103 CO 0.19 -0.27 -0.02 -0.94 0.00 0.00 0.00 175.10 174.06 2whu s SER 104 N -0.99 0.15 0.00 3.32 1.04 -0.51 -0.21 113.70 116.50 2whu s SER 104 Ca -0.08 -0.27 -0.04 0.00 0.48 0.00 0.00 55.95 56.04 2whu s SER 104 Cb -0.07 0.05 -0.00 0.00 0.10 0.00 0.00 66.02 66.10 2whu s SER 104 CO -0.00 -0.16 0.06 0.21 0.98 0.00 0.00 173.24 174.33 2whu s ASN 105 N -0.79 0.08 -0.09 7.02 2.47 -0.71 -1.62 114.94 121.29 2whu s ASN 105 Ca -0.08 -0.22 0.04 0.00 0.42 0.00 0.00 52.86 53.02 2whu s ASN 105 Cb -0.05 0.16 -0.01 0.00 -1.45 0.00 0.00 41.25 39.90 2whu s ASN 105 CO -0.01 -0.26 -0.23 -0.62 -3.72 0.00 0.00 177.10 172.27 2whu s ASP 106 N -1.05 3.20 -0.08 -4.21 -1.08 -0.11 -1.88 116.67 111.47 2whu s ASP 106 Ca -0.11 -0.51 0.03 0.00 -0.52 0.00 0.00 52.55 51.43 2whu s ASP 106 Cb -0.07 -1.23 -0.02 0.00 -1.46 0.00 0.00 42.92 40.14 2whu s ASP 106 CO 0.00 0.19 -0.15 -0.44 0.52 0.00 0.00 175.17 175.29 2whu s SER 107 N 0.15 3.90 0.00 -0.34 0.01 0.35 -1.12 113.70 116.65 2whu s SER 107 Ca -0.12 -0.28 0.00 0.00 1.31 0.00 0.00 55.95 56.86 2whu s SER 107 Cb -0.16 -1.10 0.00 0.00 0.21 0.00 0.00 66.02 64.96 2whu s SER 107 CO 0.07 0.27 0.00 -1.54 0.41 0.00 0.00 173.24 172.45 2whu n SER 108 N 2.80 0.00 -3.96 2.44 3.41 -0.75 -2.40 113.62 115.17 2whu n SER 108 Ca -0.18 -0.56 -0.09 0.00 -0.26 0.00 0.00 58.87 57.78 2whu n SER 108 Cb 0.52 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.40 2whu n SER 108 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2whu s ILE 109 N -2.87 0.09 -0.39 -1.33 2.07 -1.26 -1.10 121.20 116.41 2whu s ILE 109 Ca 0.00 -1.40 0.07 0.00 -1.41 0.00 0.00 60.65 57.91 2whu s ILE 109 Cb 0.00 -1.74 0.18 0.00 0.13 0.00 0.00 42.46 41.02 2whu s ILE 109 CO 0.00 -0.40 0.57 -1.58 -1.91 0.00 0.00 174.94 171.62 2whu s GLN 110 N -3.95 0.76 7.65 3.50 2.00 0.33 -4.88 119.66 125.08 2whu s GLN 110 Ca 0.15 -0.33 0.00 0.00 -2.00 0.00 0.00 55.36 53.18 2whu s GLN 110 Cb 0.04 -0.07 0.00 0.00 0.80 0.00 0.00 33.01 33.78 2whu s GLN 110 CO -0.02 -1.18 0.00 0.41 -0.50 0.00 0.00 175.29 173.99 2whu n GLY 111 N 4.45 2.62 2.22 2.59 0.00 -1.26 -2.01 105.19 113.80 2whu n GLY 111 Ca 0.11 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 2whu n GLY 111 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2whu n ASN 112 N 8.25 5.07 -3.82 1.61 3.02 -1.26 -4.93 115.26 123.21 2whu n ASN 112 Ca 0.00 -3.61 -0.13 0.00 -0.03 0.00 0.00 54.58 50.81 2whu n ASN 112 Cb 0.00 -0.88 -0.14 0.00 -0.61 0.00 0.00 39.78 38.14 2whu n ASN 112 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2whu s PHE 114 N 0.48 3.36 -0.14 0.00 0.08 -0.23 -0.51 117.98 121.03 2whu s PHE 114 Ca -0.04 -0.02 0.01 0.00 0.12 0.00 0.00 56.93 57.00 2whu s PHE 114 Cb -0.05 -1.74 0.02 0.00 -0.57 0.00 0.00 43.02 40.67 2whu s PHE 114 CO -0.02 0.26 -0.15 0.42 -0.10 0.00 0.00 175.22 175.64 2whu s ILE 115 N -2.09 1.56 -0.13 0.64 1.01 -0.25 -0.91 121.20 121.03 2whu s ILE 115 Ca 0.38 -0.64 -0.04 0.00 0.00 0.00 0.00 60.65 60.35 2whu s ILE 115 Cb -0.09 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.89 2whu s ILE 115 CO 0.31 0.46 -0.00 -0.31 0.00 0.00 0.00 174.94 175.39 2whu s TYR 116 N 1.33 3.12 -0.29 3.97 2.02 -0.55 -1.81 117.35 125.15 2whu s TYR 116 Ca 0.01 -0.03 -0.02 0.00 -0.37 0.00 0.00 57.07 56.67 2whu s TYR 116 Cb -0.13 -1.91 0.04 0.00 -0.40 0.00 0.00 41.96 39.56 2whu s TYR 116 CO -0.08 0.21 -0.01 1.21 -1.57 0.00 0.00 175.55 175.30 2whu s ASN 117 N -0.14 4.78 -0.10 2.29 3.84 -0.28 -0.38 114.94 124.95 2whu s ASN 117 Ca 0.04 -1.18 0.02 0.00 0.21 0.00 0.00 52.86 51.95 2whu s ASN 117 Cb -0.13 -1.70 0.02 0.00 -0.55 0.00 0.00 41.25 38.89 2whu s ASN 117 CO 0.02 -0.23 -0.14 0.54 -2.79 0.00 0.00 177.10 174.50 2whu s VAL 118 N 1.27 1.42 -0.12 -5.21 0.11 0.20 -0.94 120.40 117.14 2whu s VAL 118 Ca -0.04 -0.60 -0.00 0.00 -2.93 0.00 0.00 61.98 58.41 2whu s VAL 118 Cb -0.19 -1.31 -0.02 0.00 -1.53 0.00 0.00 36.38 33.33 2whu s VAL 118 CO -0.02 0.43 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.52 2whu s LYS 119 N 1.00 3.27 -0.06 1.54 1.02 -0.64 -1.00 119.74 124.87 2whu s LYS 119 Ca -0.07 -0.66 0.03 0.00 0.02 0.00 0.00 55.97 55.30 2whu s LYS 119 Cb -0.15 -2.63 0.00 0.00 -0.52 0.00 0.00 37.83 34.54 2whu s LYS 119 CO -0.01 0.30 -0.16 -1.50 -0.92 0.00 0.00 175.35 173.05 2whu s ILE 120 N 0.15 1.39 -0.15 2.17 2.07 0.12 -1.43 121.20 125.52 2whu s ILE 120 Ca -0.06 -0.66 0.00 0.00 -1.41 0.00 0.00 60.65 58.52 2whu s ILE 120 Cb -0.15 -1.22 0.02 0.00 0.13 0.00 0.00 42.46 41.24 2whu s ILE 120 CO 0.04 0.41 -0.14 -0.55 -1.91 0.00 0.00 174.94 172.79 2whu s SER 121 N 0.31 2.69 -0.03 4.50 0.15 -0.66 -1.92 113.70 118.74 2whu s SER 121 Ca -0.10 -0.49 0.02 0.00 0.70 0.00 0.00 55.95 56.09 2whu s SER 121 Cb -0.14 -1.18 0.01 0.00 -1.71 0.00 0.00 66.02 63.00 2whu s SER 121 CO 0.04 -0.06 -0.09 -0.83 1.20 0.00 0.00 173.24 173.50 2whu s GLY 122 N 1.49 0.55 0.04 9.45 0.00 0.38 -1.60 107.32 117.63 2whu s GLY 122 Ca 0.05 -0.32 -0.01 0.00 0.00 0.00 0.00 44.72 44.44 2whu s GLY 122 CO -0.11 -0.02 -0.03 -1.83 0.00 0.00 0.00 173.10 171.12 2whu s GLU 123 N 0.31 0.54 -0.60 2.90 -1.05 -0.85 0.28 118.70 120.23 2whu s GLU 123 Ca -0.05 -1.06 -0.00 0.00 -0.15 0.00 0.00 54.97 53.70 2whu s GLU 123 Cb -0.10 0.19 0.00 0.00 -0.44 0.00 0.00 34.13 33.78 2whu s GLU 123 CO 0.01 -0.10 0.05 0.09 0.95 0.00 0.00 175.26 176.26 2whu n ASN 124 N 0.48 -2.80 -4.64 0.83 5.03 -1.26 -2.27 115.26 110.64 2whu n ASN 124 Ca -0.17 -0.03 -0.43 0.00 0.87 0.00 0.00 54.58 54.83 2whu n ASN 124 Cb 0.60 -2.04 -0.03 0.00 -1.02 0.00 0.00 39.78 37.29 2whu n ASN 124 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2whu s PHE 125 N -2.45 1.75 -0.08 3.10 0.08 -1.26 -3.66 117.98 115.46 2whu s PHE 125 Ca 0.02 0.23 -0.39 0.00 0.12 0.00 0.00 56.93 56.91 2whu s PHE 125 Cb -0.01 -4.01 -0.17 0.00 -0.57 0.00 0.00 43.02 38.26 2whu s PHE 125 CO 0.03 -3.94 1.45 -2.30 -0.10 0.00 0.00 175.22 170.36 2whu n PRO 126 N 7.65 0.90 0.14 0.24 -0.02 -1.26 -4.86 135.00 137.78 2whu n PRO 126 Ca 0.20 0.33 0.12 0.00 -2.02 0.00 0.00 63.50 62.13 2whu n PRO 126 Cb 0.44 -1.95 0.50 0.00 -0.02 0.00 0.00 33.50 32.46 2whu n PRO 126 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2whu n PRO 127 N 3.37 0.21 -0.03 0.52 -0.02 -1.26 -0.47 135.00 137.32 2whu n PRO 127 Ca 0.22 0.42 -0.07 0.00 -2.02 0.00 0.00 63.50 62.06 2whu n PRO 127 Cb 0.14 -1.89 -0.13 0.00 -0.02 0.00 0.00 33.50 31.59 2whu n PRO 127 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2whu n ASN 128 N -2.29 0.63 -3.23 2.55 3.02 -1.26 -4.67 115.26 110.00 2whu n ASN 128 Ca 0.02 0.29 -0.29 0.00 -0.03 0.00 0.00 54.58 54.57 2whu n ASN 128 Cb 0.25 0.31 0.03 0.00 -0.61 0.00 0.00 39.78 39.75 2whu n ASN 128 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2whu n GLY 129 N 1.56 -3.47 0.16 7.41 0.00 0.38 -4.47 105.19 106.77 2whu n GLY 129 Ca -0.19 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2whu n GLY 129 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2whu h PRO 130 N -0.62 0.01 0.33 1.61 0.13 -1.96 -2.40 132.00 129.10 2whu h PRO 130 Ca -0.35 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.77 2whu h PRO 130 Cb 1.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 2whu h PRO 130 CO 0.22 0.53 -0.20 0.28 -0.23 0.00 0.00 178.00 178.60 2whu h VAL 131 N 0.01 0.58 0.00 1.56 2.07 -1.88 0.13 116.25 118.71 2whu h VAL 131 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2whu h VAL 131 Cb 0.93 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 2whu h VAL 131 CO 0.07 0.00 -0.01 0.24 0.02 0.00 0.00 177.57 177.89 2whu h MET 132 N -0.51 0.00 -0.29 1.57 2.86 -1.72 -2.48 114.93 114.36 2whu h MET 132 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2whu h MET 132 Cb 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 2whu h MET 132 CO 0.04 0.01 0.00 1.04 1.06 0.00 0.00 176.91 179.06 2whu n GLN 133 N -3.11 2.01 -3.71 1.72 1.13 -0.72 -4.77 117.38 109.93 2whu n GLN 133 Ca -0.00 -1.53 -0.24 0.00 -1.94 0.00 0.00 57.00 53.28 2whu n GLN 133 Cb 0.26 -1.42 0.03 0.00 0.11 0.00 0.00 30.24 29.22 2whu n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2whu n LYS 134 N 0.75 -3.37 -0.10 -1.09 5.02 -0.30 -4.91 118.16 114.15 2whu n LYS 134 Ca 0.17 0.55 -0.12 0.00 -2.02 0.00 0.00 58.31 56.89 2whu n LYS 134 Cb 0.42 -4.81 -0.14 0.00 -0.02 0.00 0.00 35.03 30.48 2whu n LYS 134 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2whu n LYS 135 N -4.19 0.79 -0.69 1.97 4.76 0.30 -5.02 118.16 116.07 2whu n LYS 135 Ca -0.23 0.04 -0.31 0.00 -2.87 0.00 0.00 58.31 54.95 2whu n LYS 135 Cb 0.65 -1.49 0.18 0.00 -1.84 0.00 0.00 35.03 32.53 2whu n LYS 135 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2whu s THR 136 N -2.47 2.10 -0.15 -0.18 -4.23 -1.26 -2.52 115.64 106.93 2whu s THR 136 Ca -0.17 0.03 0.23 0.00 -1.18 0.00 0.00 61.69 60.60 2whu s THR 136 Cb 0.07 -2.08 0.47 0.00 1.34 0.00 0.00 72.50 72.30 2whu s THR 136 CO 0.71 -0.04 1.14 0.00 -0.54 0.00 0.00 174.62 175.89 2whu n GLN 137 N -4.32 1.04 0.00 3.99 6.02 0.54 -4.77 117.38 119.89 2whu n GLN 137 Ca 0.10 -2.88 0.00 0.00 -0.01 0.00 0.00 57.00 54.21 2whu n GLN 137 Cb 0.52 -0.94 0.00 0.00 1.02 0.00 0.00 30.24 30.84 2whu n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2whu n GLY 138 N -0.15 2.10 3.85 1.08 0.00 -1.26 -4.76 105.19 106.05 2whu n GLY 138 Ca 0.08 -2.06 -0.33 0.00 0.00 0.00 0.00 46.02 43.71 2whu n GLY 138 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2whu s TRP 139 N -2.16 3.43 0.27 1.61 0.52 -1.26 -2.02 118.94 119.33 2whu s TRP 139 Ca 0.00 0.29 -0.30 0.00 0.02 0.00 0.00 56.10 56.12 2whu s TRP 139 Cb 0.00 -1.79 -0.09 0.00 -1.15 0.00 0.00 33.47 30.44 2whu s TRP 139 CO 0.00 0.61 1.05 -1.21 0.02 0.00 0.00 176.95 177.41 2whu s GLU 140 N -1.82 4.71 0.21 4.98 0.41 -0.82 -4.68 118.70 121.69 2whu s GLU 140 Ca 0.25 1.70 -0.17 0.00 -0.41 0.00 0.00 54.97 56.34 2whu s GLU 140 Cb -0.12 -3.22 -0.11 0.00 -1.78 0.00 0.00 34.13 28.89 2whu s GLU 140 CO 0.16 0.31 0.20 -2.30 -0.49 0.00 0.00 175.26 173.14 2whu n PRO 141 N 1.30 0.00 -3.93 0.39 -0.02 -1.26 -4.75 135.00 126.72 2whu n PRO 141 Ca -0.01 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.36 2whu n PRO 141 Cb 0.45 -0.69 -0.01 0.00 -0.02 0.00 0.00 33.50 33.23 2whu n PRO 141 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2whu s SER 142 N -0.69 0.24 -0.20 2.55 1.04 -0.60 -4.99 113.70 111.06 2whu s SER 142 Ca 0.42 -1.15 -0.05 0.00 0.48 0.00 0.00 55.95 55.65 2whu s SER 142 Cb -0.53 0.73 0.10 0.00 0.10 0.00 0.00 66.02 66.42 2whu s SER 142 CO 0.41 -1.43 0.36 -0.89 0.98 0.00 0.00 173.24 172.67 2whu s THR 143 N -3.03 -0.56 -0.17 2.02 2.01 -1.26 -0.32 115.64 114.33 2whu s THR 143 Ca 0.21 0.11 -0.07 0.00 0.31 0.00 0.00 61.69 62.24 2whu s THR 143 Cb -0.03 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2whu s THR 143 CO 0.13 0.01 0.07 -0.70 -0.69 0.00 0.00 174.62 173.44 2whu s GLU 144 N 2.53 3.89 -0.42 4.92 2.12 -0.71 -4.40 118.70 126.64 2whu s GLU 144 Ca 0.04 -0.31 -0.12 0.00 0.36 0.00 0.00 54.97 54.93 2whu s GLU 144 Cb -0.13 -3.21 0.05 0.00 0.26 0.00 0.00 34.13 31.11 2whu s GLU 144 CO -0.13 0.35 0.29 1.03 -0.54 0.00 0.00 175.26 176.27 2whu s ARG 145 N 0.15 2.83 0.25 4.30 0.52 0.10 -0.66 118.95 126.44 2whu s ARG 145 Ca 0.05 -1.26 0.08 0.00 -0.52 0.00 0.00 55.73 54.08 2whu s ARG 145 Cb -0.12 -3.90 -0.04 0.00 0.52 0.00 0.00 34.95 31.41 2whu s ARG 145 CO 0.00 -0.88 0.13 -0.51 0.02 0.00 0.00 175.30 174.06 2whu s LEU 146 N 1.56 3.61 0.18 2.53 1.02 0.85 -2.51 118.68 125.92 2whu s LEU 146 Ca 0.03 -0.36 -0.20 0.00 0.02 0.00 0.00 54.13 53.62 2whu s LEU 146 Cb -0.22 -2.15 0.04 0.00 0.02 0.00 0.00 46.19 43.88 2whu s LEU 146 CO 0.06 -0.01 0.56 0.72 0.02 0.00 0.00 176.35 177.70 2whu s PHE 147 N -2.14 -0.31 -0.75 0.29 -0.12 -0.84 -0.75 117.98 113.36 2whu s PHE 147 Ca 0.32 0.01 -0.15 0.00 -0.05 0.00 0.00 56.93 57.06 2whu s PHE 147 Cb -0.08 0.48 0.19 0.00 -0.63 0.00 0.00 43.02 42.99 2whu s PHE 147 CO 0.23 -0.90 0.70 0.00 -0.05 0.00 0.00 175.22 175.19 2whu s ALA 148 N -3.82 3.96 -0.25 1.99 0.00 -1.26 -1.88 121.76 120.49 2whu s ALA 148 Ca 0.05 -3.10 -0.13 0.00 0.00 0.00 0.00 51.96 48.78 2whu s ALA 148 Cb -0.01 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 2whu s ALA 148 CO -0.07 -2.21 0.30 0.50 0.00 0.00 0.00 175.76 174.28 2whu s ARG 149 N 0.59 4.04 -0.98 0.00 3.52 -1.08 -4.77 118.95 120.27 2whu s ARG 149 Ca 0.14 -0.06 -0.14 0.00 -0.13 0.00 0.00 55.73 55.54 2whu s ARG 149 Cb -0.16 -3.61 0.02 0.00 -1.56 0.00 0.00 34.95 29.64 2whu s ARG 149 CO -0.06 -0.14 0.65 -0.25 -0.81 0.00 0.00 175.30 174.69 2whu n ASP 150 N 4.90 -4.82 0.00 -2.12 8.00 -1.26 -0.87 116.55 120.38 2whu n ASP 150 Ca -0.11 -1.04 0.00 0.00 0.71 0.00 0.00 54.79 54.36 2whu n ASP 150 Cb 0.51 -2.01 0.00 0.00 -0.02 0.00 0.00 41.12 39.60 2whu n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2whu n GLY 151 N -1.81 0.68 2.44 0.44 0.00 -1.26 -4.91 105.19 100.76 2whu n GLY 151 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 2whu n GLY 151 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2whu n MET 152 N -1.78 0.25 -3.58 1.61 2.81 -0.05 -4.51 117.12 111.87 2whu n MET 152 Ca 0.00 -1.75 -0.27 0.00 -1.81 0.00 0.00 57.70 53.87 2whu n MET 152 Cb 0.00 -0.38 -0.16 0.00 -0.71 0.00 0.00 33.22 31.97 2whu n MET 152 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 2whu s LEU 153 N 0.00 0.42 0.26 4.03 2.96 -0.21 -2.65 118.68 123.49 2whu s LEU 153 Ca 0.41 -0.90 -0.30 0.00 -0.22 0.00 0.00 54.13 53.12 2whu s LEU 153 Cb -0.02 -0.28 -0.09 0.00 0.50 0.00 0.00 46.19 46.29 2whu s LEU 153 CO 0.27 -0.39 0.99 -0.63 -1.32 0.00 0.00 176.35 175.27 2whu s ILE 154 N 2.12 3.90 0.09 6.68 -1.09 -0.79 0.14 121.20 132.26 2whu s ILE 154 Ca 0.05 1.91 0.05 0.00 -2.23 0.00 0.00 60.65 60.42 2whu s ILE 154 Cb -0.16 -4.21 -0.03 0.00 -1.58 0.00 0.00 42.46 36.48 2whu s ILE 154 CO -0.21 0.45 -0.12 -0.83 -1.23 0.00 0.00 174.94 172.99 2whu s GLY 155 N -1.11 0.89 -0.15 6.18 0.00 0.80 -1.98 107.32 111.95 2whu s GLY 155 Ca 0.42 -1.12 -0.08 0.00 0.00 0.00 0.00 44.72 43.94 2whu s GLY 155 CO 0.34 -1.17 0.35 -1.31 0.00 0.00 0.00 173.10 171.31 2whu s ASN 156 N -2.14 -0.43 -0.08 1.64 0.01 -1.05 -1.29 114.94 111.61 2whu s ASN 156 Ca 0.03 0.76 -0.06 0.00 -0.71 0.00 0.00 52.86 52.88 2whu s ASN 156 Cb -0.06 0.65 0.03 0.00 0.41 0.00 0.00 41.25 42.27 2whu s ASN 156 CO 0.02 -0.18 0.20 -0.62 -1.51 0.00 0.00 177.10 175.00 2whu s ASP 157 N 1.31 -0.21 -0.36 -1.22 -1.08 -1.11 0.01 116.67 114.02 2whu s ASP 157 Ca -0.09 0.41 -0.05 0.00 -0.52 0.00 0.00 52.55 52.30 2whu s ASP 157 Cb -0.09 0.38 0.06 0.00 -1.46 0.00 0.00 42.92 41.82 2whu s ASP 157 CO -0.11 -0.09 0.12 -0.31 0.52 0.00 0.00 175.17 175.30 2whu s TYR 158 N 0.43 3.34 0.40 -5.34 2.02 -1.26 -0.63 117.35 116.31 2whu s TYR 158 Ca -0.03 -1.78 0.06 0.00 -0.37 0.00 0.00 57.07 54.96 2whu s TYR 158 Cb -0.04 -2.55 0.06 0.00 -0.40 0.00 0.00 41.96 39.03 2whu s TYR 158 CO -0.02 -0.82 0.48 -1.33 -1.57 0.00 0.00 175.55 172.29 2whu n MET 159 N 4.73 0.78 -3.64 -0.62 2.81 0.12 -4.84 117.12 116.45 2whu n MET 159 Ca -0.10 -2.25 -0.05 0.00 -1.81 0.00 0.00 57.70 53.49 2whu n MET 159 Cb 0.43 -0.04 -0.07 0.00 -0.71 0.00 0.00 33.22 32.84 2whu n MET 159 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2whu s ALA 160 N -2.51 -2.18 -0.20 3.04 0.00 -1.26 -2.44 121.76 116.22 2whu s ALA 160 Ca 0.36 1.93 -0.06 0.00 0.00 0.00 0.00 51.96 54.19 2whu s ALA 160 Cb -0.03 -1.64 -0.03 0.00 0.00 0.00 0.00 23.12 21.42 2whu s ALA 160 CO 0.23 -0.24 0.03 -0.51 0.00 0.00 0.00 175.76 175.27 2whu s LEU 161 N 0.56 3.49 -0.77 0.00 1.43 0.19 -1.95 118.68 121.62 2whu s LEU 161 Ca -0.00 -0.10 -0.28 0.00 -1.03 0.00 0.00 54.13 52.72 2whu s LEU 161 Cb -0.04 -1.89 -0.16 0.00 0.03 0.00 0.00 46.19 44.13 2whu s LEU 161 CO -0.11 0.09 2.54 0.29 0.23 0.00 0.00 176.35 179.40 2whu n LYS 162 N 4.07 0.47 -2.06 1.70 5.02 -0.86 -1.81 118.16 124.69 2whu n LYS 162 Ca -0.17 -0.04 -0.41 0.00 -2.02 0.00 0.00 58.31 55.67 2whu n LYS 162 Cb 0.52 -2.40 -0.02 0.00 -0.02 0.00 0.00 35.03 33.10 2whu n LYS 162 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2whu s LEU 163 N 10.23 4.39 0.06 -0.35 1.43 -1.12 0.20 118.68 133.53 2whu s LEU 163 Ca 1.18 2.61 -0.33 0.00 -1.03 0.00 0.00 54.13 56.56 2whu s LEU 163 Cb -0.73 -3.62 -0.12 0.00 0.03 0.00 0.00 46.19 41.75 2whu s LEU 163 CO 0.38 -0.66 1.76 1.21 0.23 0.00 0.00 176.35 179.26 2whu n GLU 164 N 2.34 2.33 0.00 1.70 2.13 -1.05 -2.48 120.64 125.61 2whu n GLU 164 Ca 0.06 0.85 0.00 0.00 0.66 0.00 0.00 57.16 58.73 2whu n GLU 164 Cb 0.41 -2.68 0.00 0.00 0.27 0.00 0.00 31.44 29.44 2whu n GLU 164 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2whu n GLY 165 N 3.98 1.26 0.89 8.31 0.00 -1.26 -4.75 105.19 113.62 2whu n GLY 165 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2whu n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whu n GLY 166 N 0.00 1.11 0.00 -0.02 0.00 -1.04 -5.03 105.19 100.21 2whu n GLY 166 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2whu n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whu n GLY 167 N -2.00 -1.18 3.08 -0.02 0.00 -1.25 -4.91 105.19 98.90 2whu n GLY 167 Ca 0.00 -1.64 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 2whu n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2whu s HIS 168 N -0.80 -0.50 -0.37 1.61 3.76 -1.26 -2.79 115.29 114.94 2whu s HIS 168 Ca 0.00 1.08 -0.26 0.00 -0.15 0.00 0.00 55.06 55.73 2whu s HIS 168 Cb 0.00 0.06 0.02 0.00 1.11 0.00 0.00 32.58 33.77 2whu s HIS 168 CO 0.00 -0.36 0.92 -0.47 -0.85 0.00 0.00 174.74 173.98 2whu s TYR 169 N 2.23 3.07 0.32 1.40 5.04 -0.75 -4.88 117.35 123.78 2whu s TYR 169 Ca -0.02 0.74 -0.09 0.00 -2.44 0.00 0.00 57.07 55.26 2whu s TYR 169 Cb -0.12 -3.66 -0.07 0.00 0.35 0.00 0.00 41.96 38.47 2whu s TYR 169 CO -0.10 -0.84 0.65 -0.51 -1.34 0.00 0.00 175.55 173.41 2whu s LEU 170 N 3.48 4.01 -0.15 6.97 1.43 -1.26 0.54 118.68 133.70 2whu s LEU 170 Ca 0.38 0.98 -0.09 0.00 -1.03 0.00 0.00 54.13 54.37 2whu s LEU 170 Cb -0.12 -3.80 0.05 0.00 0.03 0.00 0.00 46.19 42.35 2whu s LEU 170 CO 0.19 -0.23 0.36 0.00 0.23 0.00 0.00 176.35 176.90 2whu s GLU 172 N 1.13 4.40 -0.17 0.00 2.12 -0.23 0.11 118.70 126.06 2whu s GLU 172 Ca -0.08 0.77 -0.06 0.00 0.36 0.00 0.00 54.97 55.97 2whu s GLU 172 Cb -0.08 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 30.86 2whu s GLU 172 CO -0.09 0.16 0.01 -0.06 -0.54 0.00 0.00 175.26 174.74 2whu s PHE 173 N 0.52 3.15 -0.22 5.30 0.40 0.20 -1.32 117.98 126.01 2whu s PHE 173 Ca 0.34 -0.09 0.02 0.00 -0.60 0.00 0.00 56.93 56.59 2whu s PHE 173 Cb -0.17 -2.02 0.04 0.00 0.51 0.00 0.00 43.02 41.38 2whu s PHE 173 CO 0.16 0.08 -0.13 0.15 0.70 0.00 0.00 175.22 176.18 2whu s LYS 174 N 0.33 2.34 -0.12 0.44 1.02 -0.71 -2.74 119.74 120.30 2whu s LYS 174 Ca -0.00 -1.03 0.02 0.00 0.02 0.00 0.00 55.97 54.98 2whu s LYS 174 Cb -0.13 -2.63 0.01 0.00 -0.52 0.00 0.00 37.83 34.56 2whu s LYS 174 CO 0.01 -0.43 -0.19 -1.12 -0.92 0.00 0.00 175.35 172.71 2whu s SER 175 N 1.26 2.74 -0.22 2.83 0.01 -0.41 -0.36 113.70 119.55 2whu s SER 175 Ca -0.03 -0.50 -0.06 0.00 1.31 0.00 0.00 55.95 56.67 2whu s SER 175 Cb -0.17 -1.25 -0.02 0.00 0.21 0.00 0.00 66.02 64.79 2whu s SER 175 CO -0.08 0.05 0.02 -0.89 0.41 0.00 0.00 173.24 172.75 2whu s THR 176 N 0.85 4.01 -0.17 1.44 2.01 0.15 0.28 115.64 124.21 2whu s THR 176 Ca -0.08 -0.29 -0.05 0.00 0.31 0.00 0.00 61.69 61.58 2whu s THR 176 Cb -0.15 -2.83 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 2whu s THR 176 CO -0.01 0.40 0.00 -0.31 -0.69 0.00 0.00 174.62 174.01 2whu s TYR 177 N 1.25 3.10 -0.18 4.92 2.02 0.12 -0.81 117.35 127.76 2whu s TYR 177 Ca 0.04 -0.20 0.01 0.00 -0.37 0.00 0.00 57.07 56.54 2whu s TYR 177 Cb -0.15 -2.02 0.04 0.00 -0.40 0.00 0.00 41.96 39.43 2whu s TYR 177 CO 0.02 -0.01 -0.11 0.21 -1.57 0.00 0.00 175.55 174.09 2whu s LYS 178 N 0.47 2.04 0.55 -0.62 2.20 0.26 -1.04 119.74 123.61 2whu s LYS 178 Ca -0.01 -0.74 -0.15 0.00 -0.36 0.00 0.00 55.97 54.71 2whu s LYS 178 Cb -0.14 -2.30 -0.06 0.00 -1.51 0.00 0.00 37.83 33.82 2whu s LYS 178 CO 0.02 -0.38 1.01 0.00 -0.36 0.00 0.00 175.35 175.63 2whu s ALA 179 N 1.44 3.02 -2.28 3.13 0.00 -1.26 0.61 121.76 126.42 2whu s ALA 179 Ca 0.00 0.15 0.21 0.00 0.00 0.00 0.00 51.96 52.32 2whu s ALA 179 Cb -0.15 -3.13 0.52 0.00 0.00 0.00 0.00 23.12 20.37 2whu s ALA 179 CO -0.09 -0.44 1.45 1.63 0.00 0.00 0.00 175.76 178.31 2whu n LYS 180 N -1.94 2.35 -3.72 0.00 5.02 0.13 -4.80 118.16 115.20 2whu n LYS 180 Ca 0.07 -2.06 -0.14 0.00 -2.02 0.00 0.00 58.31 54.15 2whu n LYS 180 Cb 0.54 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 33.98 2whu n LYS 180 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2whu s LYS 181 N -1.43 0.66 -0.26 1.97 -2.85 -1.26 -5.00 119.74 111.57 2whu s LYS 181 Ca 0.39 0.12 -0.24 0.00 -1.00 0.00 0.00 55.97 55.24 2whu s LYS 181 Cb 0.21 0.30 -0.10 0.00 -2.06 0.00 0.00 37.83 36.19 2whu s LYS 181 CO 0.30 -0.16 0.91 -2.30 0.10 0.00 0.00 175.35 174.19 2whu n PRO 182 N 1.74 0.00 -4.44 1.78 -0.02 -1.26 -4.91 135.00 127.89 2whu n PRO 182 Ca -0.18 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.08 2whu n PRO 182 Cb 0.56 -0.77 -0.10 0.00 -0.02 0.00 0.00 33.50 33.17 2whu n PRO 182 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2whu s VAL 183 N 2.02 1.92 0.09 -1.45 -7.23 -1.26 -5.04 120.40 109.46 2whu s VAL 183 Ca 0.57 -2.21 -0.31 0.00 -1.81 0.00 0.00 61.98 58.22 2whu s VAL 183 Cb -0.77 -2.37 -0.10 0.00 0.56 0.00 0.00 36.38 33.70 2whu s VAL 183 CO 0.40 -0.36 1.85 -0.13 -0.31 0.00 0.00 175.10 176.54 2whu s ARG 184 N -3.65 4.14 0.15 4.82 0.52 -1.26 -4.96 118.95 118.71 2whu s ARG 184 Ca 0.29 2.57 -0.30 0.00 -0.52 0.00 0.00 55.73 57.77 2whu s ARG 184 Cb 0.01 -3.75 -0.07 0.00 0.52 0.00 0.00 34.95 31.66 2whu s ARG 184 CO 0.12 -0.86 1.01 -1.64 0.02 0.00 0.00 175.30 173.94 2whu s MET 185 N 3.20 4.68 0.68 3.54 -1.94 -1.26 -4.69 119.30 123.51 2whu s MET 185 Ca 0.82 1.55 -0.11 0.00 -1.71 0.00 0.00 55.69 56.24 2whu s MET 185 Cb -0.44 -3.33 -0.00 0.00 2.01 0.00 0.00 34.83 33.07 2whu s MET 185 CO 0.37 0.20 1.07 -1.25 -0.01 0.00 0.00 175.02 175.41 2whu s PRO 186 N -0.28 3.07 0.64 2.03 0.04 -1.26 -4.75 135.00 134.49 2whu s PRO 186 Ca 0.47 0.52 -0.08 0.00 0.04 0.00 0.00 61.00 61.95 2whu s PRO 186 Cb -0.26 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.25 2whu s PRO 186 CO 0.32 -0.89 0.98 0.20 0.04 0.00 0.00 177.00 177.65 2whu s GLY 187 N -4.31 1.62 0.14 0.56 0.00 -1.26 -4.52 107.32 99.55 2whu s GLY 187 Ca 0.57 -0.59 -0.15 0.00 0.00 0.00 0.00 44.72 44.55 2whu s GLY 187 CO 0.52 -0.26 0.25 -2.13 0.00 0.00 0.00 173.10 171.48 2whu n ARG 188 N -2.77 0.00 -3.77 2.90 3.00 -1.26 -4.81 116.66 109.94 2whu n ARG 188 Ca 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 57.90 2whu n ARG 188 Cb 0.58 -0.58 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2whu n ARG 188 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 2whu s HIS 189 N -0.66 -0.03 0.09 -0.14 -3.43 0.07 -4.24 115.29 106.96 2whu s HIS 189 Ca 0.36 -0.20 0.02 0.00 -0.80 0.00 0.00 55.06 54.44 2whu s HIS 189 Cb -0.50 0.61 -0.04 0.00 -1.43 0.00 0.00 32.58 31.22 2whu s HIS 189 CO 0.33 -0.58 -0.07 -1.21 -2.00 0.00 0.00 174.74 171.21 2whu s GLU 190 N -2.54 0.80 -0.15 -0.38 2.02 0.28 -0.10 118.70 118.62 2whu s GLU 190 Ca 0.18 -1.24 -0.02 0.00 0.02 0.00 0.00 54.97 53.91 2whu s GLU 190 Cb 0.01 -0.26 0.05 0.00 0.10 0.00 0.00 34.13 34.02 2whu s GLU 190 CO 0.01 0.00 0.00 0.42 0.02 0.00 0.00 175.26 175.71 2whu s ILE 191 N -3.20 0.61 -0.21 -1.63 1.01 0.16 -1.36 121.20 116.59 2whu s ILE 191 Ca 0.08 -0.35 -0.21 0.00 0.00 0.00 0.00 60.65 60.17 2whu s ILE 191 Cb 0.02 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.54 2whu s ILE 191 CO -0.03 0.02 0.65 -1.81 0.00 0.00 0.00 174.94 173.77 2whu s ASP 192 N 1.84 6.69 0.19 3.58 1.01 -0.11 -1.73 116.67 128.14 2whu s ASP 192 Ca 0.01 0.84 0.09 0.00 0.71 0.00 0.00 52.55 54.21 2whu s ASP 192 Cb -0.15 -2.36 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 2whu s ASP 192 CO -0.07 -0.31 -0.12 -0.13 0.21 0.00 0.00 175.17 174.75 2whu s ARG 193 N 2.08 1.98 0.00 8.23 0.52 0.56 -2.33 118.95 129.99 2whu s ARG 193 Ca 0.29 -1.34 0.04 0.00 -0.52 0.00 0.00 55.73 54.20 2whu s ARG 193 Cb -0.16 -2.10 -0.01 0.00 0.52 0.00 0.00 34.95 33.21 2whu s ARG 193 CO 0.10 0.42 -0.11 0.21 0.02 0.00 0.00 175.30 175.94 2whu s LYS 194 N -2.88 0.89 -0.22 3.54 2.20 -1.01 -1.56 119.74 120.69 2whu s LYS 194 Ca 0.25 -0.46 -0.04 0.00 -0.36 0.00 0.00 55.97 55.36 2whu s LYS 194 Cb -0.08 -0.86 0.11 0.00 -1.51 0.00 0.00 37.83 35.49 2whu s LYS 194 CO 0.15 0.23 0.37 -1.17 -0.36 0.00 0.00 175.35 174.57 2whu s LEU 195 N -0.42 -0.58 0.01 5.43 2.96 -1.26 -1.37 118.68 123.44 2whu s LEU 195 Ca 0.03 0.47 0.03 0.00 -0.22 0.00 0.00 54.13 54.44 2whu s LEU 195 Cb -0.05 1.11 -0.01 0.00 0.50 0.00 0.00 46.19 47.74 2whu s LEU 195 CO -0.00 -0.27 -0.08 -1.81 -1.32 0.00 0.00 176.35 172.86 2whu s ASP 196 N 2.54 0.95 0.04 3.68 1.01 -1.04 -4.23 116.67 119.62 2whu s ASP 196 Ca 0.07 -0.23 -0.30 0.00 0.71 0.00 0.00 52.55 52.80 2whu s ASP 196 Cb -0.14 -0.08 -0.08 0.00 1.01 0.00 0.00 42.92 43.63 2whu s ASP 196 CO -0.14 0.04 1.82 -0.69 0.21 0.00 0.00 175.17 176.41 2whu s VAL 197 N -0.42 3.07 -0.56 -1.27 1.01 -1.26 -2.99 120.40 117.97 2whu s VAL 197 Ca 0.01 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.27 2whu s VAL 197 Cb -0.04 -3.17 0.41 0.00 0.00 0.00 0.00 36.38 33.58 2whu s VAL 197 CO -0.00 -0.02 1.54 0.35 0.00 0.00 0.00 175.10 176.97 2whu n THR 198 N 5.26 2.95 0.00 3.92 -2.24 0.19 -4.96 114.28 119.40 2whu n THR 198 Ca 0.18 -4.29 0.00 0.00 -2.27 0.00 0.00 64.05 57.68 2whu n THR 198 Cb 0.41 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.42 2whu n THR 198 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2whu n SER 199 N -0.62 0.00 -3.63 3.42 3.41 -1.24 -4.80 113.62 110.16 2whu n SER 199 Ca 0.48 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 59.06 2whu n SER 199 Cb 0.60 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.53 2whu n SER 199 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 2whu s HIS 200 N -2.51 -0.04 0.59 7.33 -3.43 -1.26 -0.49 115.29 115.48 2whu s HIS 200 Ca 0.00 0.03 -0.11 0.00 -0.80 0.00 0.00 55.06 54.18 2whu s HIS 200 Cb 0.00 0.50 -0.04 0.00 -1.43 0.00 0.00 32.58 31.61 2whu s HIS 200 CO 0.00 -0.06 1.00 0.54 -2.00 0.00 0.00 174.74 174.22 2whu s ASN 201 N -1.95 6.28 0.32 7.38 2.20 0.42 -4.96 114.94 124.63 2whu s ASN 201 Ca 0.11 1.39 0.03 0.00 -0.94 0.00 0.00 52.86 53.45 2whu s ASN 201 Cb -0.01 -2.45 0.55 0.00 -2.00 0.00 0.00 41.25 37.34 2whu s ASN 201 CO -0.03 -0.80 1.87 0.03 -2.94 0.00 0.00 177.10 175.22 2whu h ARG 202 N -0.10 0.62 -0.04 3.55 3.08 -2.01 -1.30 114.38 118.17 2whu h ARG 202 Ca -0.45 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.48 2whu h ARG 202 Cb 1.19 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2whu h ARG 202 CO 0.62 0.60 0.00 -0.40 -1.07 0.00 0.00 179.97 179.72 2whu n ASP 203 N -4.29 1.18 0.00 7.04 5.75 -1.26 -4.95 116.55 120.02 2whu n ASP 203 Ca 0.02 -1.45 0.00 0.00 -0.01 0.00 0.00 54.79 53.35 2whu n ASP 203 Cb 0.23 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 2whu n ASP 203 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2whu n TYR 204 N -0.06 0.00 1.12 2.11 4.02 -0.49 -4.32 117.16 119.54 2whu n TYR 204 Ca 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.08 2whu n TYR 204 Cb 0.29 -0.33 0.00 0.00 -0.02 0.00 0.00 39.34 39.28 2whu n TYR 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2whu n THR 205 N -2.66 0.00 -3.64 -0.72 -2.24 -1.26 -4.48 114.28 99.29 2whu n THR 205 Ca 0.00 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.73 2whu n THR 205 Cb 0.07 -0.35 -0.07 0.00 -2.10 0.00 0.00 70.33 67.88 2whu n THR 205 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2whu s SER 206 N -0.36 -0.85 0.06 3.42 0.01 -1.26 -3.97 113.70 110.76 2whu s SER 206 Ca 0.00 1.34 -0.04 0.00 1.31 0.00 0.00 55.95 58.56 2whu s SER 206 Cb 0.00 1.41 -0.03 0.00 0.21 0.00 0.00 66.02 67.62 2whu s SER 206 CO 0.00 -0.21 0.05 -0.69 0.41 0.00 0.00 173.24 172.80 2whu s VAL 207 N 1.67 0.19 -0.07 3.43 1.01 -1.23 -0.44 120.40 124.97 2whu s VAL 207 Ca -0.09 -1.57 -0.07 0.00 0.00 0.00 0.00 61.98 60.25 2whu s VAL 207 Cb -0.05 -1.44 0.02 0.00 0.00 0.00 0.00 36.38 34.91 2whu s VAL 207 CO -0.19 -0.87 0.20 -1.61 0.00 0.00 0.00 175.10 172.63 2whu s GLU 208 N -3.86 0.26 0.09 2.72 2.02 0.36 -2.13 118.70 118.15 2whu s GLU 208 Ca 0.06 0.22 0.03 0.00 0.02 0.00 0.00 54.97 55.30 2whu s GLU 208 Cb 0.07 0.12 -0.04 0.00 0.10 0.00 0.00 34.13 34.38 2whu s GLU 208 CO -0.10 -0.04 -0.09 -0.65 0.02 0.00 0.00 175.26 174.40 2whu s GLN 209 N -0.02 0.81 0.09 1.61 -0.21 -0.61 0.52 119.66 121.85 2whu s GLN 209 Ca -0.01 -1.15 0.02 0.00 0.02 0.00 0.00 55.36 54.24 2whu s GLN 209 Cb -0.02 -0.44 -0.04 0.00 1.00 0.00 0.00 33.01 33.51 2whu s GLN 209 CO 0.00 0.06 -0.07 0.00 -2.12 0.00 0.00 175.29 173.16 2whu s GLU 211 N -3.47 1.28 -0.00 0.00 2.12 -0.82 -2.49 118.70 115.33 2whu s GLU 211 Ca 0.09 -1.11 0.00 0.00 0.36 0.00 0.00 54.97 54.31 2whu s GLU 211 Cb 0.03 0.43 0.00 0.00 0.26 0.00 0.00 34.13 34.85 2whu s GLU 211 CO -0.03 -0.50 -0.00 -1.50 -0.54 0.00 0.00 175.26 172.68 2whu s ILE 212 N -3.95 0.03 -0.19 -3.70 -1.16 -0.47 -2.78 121.20 108.97 2whu s ILE 212 Ca 0.16 0.01 -0.04 0.00 -0.51 0.00 0.00 60.65 60.27 2whu s ILE 212 Cb 0.01 -0.05 0.09 0.00 0.61 0.00 0.00 42.46 43.13 2whu s ILE 212 CO 0.01 0.02 0.31 0.00 -2.81 0.00 0.00 174.94 172.47 2whu s ALA 213 N 0.16 -0.73 0.07 1.50 0.00 0.63 -2.42 121.76 120.98 2whu s ALA 213 Ca -0.01 0.85 0.04 0.00 0.00 0.00 0.00 51.96 52.84 2whu s ALA 213 Cb -0.02 -1.32 -0.03 0.00 0.00 0.00 0.00 23.12 21.75 2whu s ALA 213 CO -0.00 -0.97 -0.12 0.42 0.00 0.00 0.00 175.76 175.08 2whu s ILE 214 N 2.46 0.98 -0.02 0.00 1.01 -0.98 -2.26 121.20 122.39 2whu s ILE 214 Ca 0.05 -1.34 0.05 0.00 0.00 0.00 0.00 60.65 59.41 2whu s ILE 214 Cb -0.14 -1.05 -0.01 0.00 0.01 0.00 0.00 42.46 41.27 2whu s ILE 214 CO -0.12 -0.32 -0.16 0.00 0.00 0.00 0.00 174.94 174.33 2whu s ALA 215 N -1.54 1.39 0.28 9.38 0.00 -0.95 -0.94 121.76 129.38 2whu s ALA 215 Ca -0.02 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.24 2whu s ALA 215 Cb -0.09 -0.39 0.01 0.00 0.00 0.00 0.00 23.12 22.66 2whu s ALA 215 CO 0.02 0.31 0.39 2.89 0.00 0.00 0.00 175.76 179.37 2whu n ARG 216 N 2.82 0.57 -2.15 0.00 1.85 -0.46 -4.51 116.66 114.77 2whu n ARG 216 Ca -0.16 -2.20 -0.29 0.00 -1.00 0.00 0.00 57.85 54.20 2whu n ARG 216 Cb 0.54 2.14 0.02 0.00 -1.05 0.00 0.00 32.46 34.10 2whu n ARG 216 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 2whu s HIS 217 N -3.36 3.47 0.00 2.89 3.76 -1.26 -0.56 115.29 120.23 2whu s HIS 217 Ca 0.23 1.00 0.00 0.00 -0.15 0.00 0.00 55.06 56.14 2whu s HIS 217 Cb -0.01 -2.71 0.00 0.00 1.11 0.00 0.00 32.58 30.97 2whu s HIS 217 CO 0.16 -0.73 0.00 0.43 -0.85 0.00 0.00 174.74 173.75 2whu n SER 218 N -2.66 0.00 0.00 1.40 7.64 -1.26 -4.58 113.62 114.15 2whu n SER 218 Ca 0.05 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.80 2whu n SER 218 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2whu n SER 218 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03