#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2win n PRO 2 N 0.00 1.90 -3.78 -1.46 -0.02 -1.26 -4.79 135.00 125.60 2win n PRO 2 Ca 0.00 0.67 -0.37 0.00 -2.02 0.00 0.00 63.50 61.78 2win n PRO 2 Cb 0.00 -2.62 -0.13 0.00 -0.02 0.00 0.00 33.50 30.73 2win n PRO 2 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2win s MET 3 N 4.59 2.93 -0.43 -0.52 1.75 -0.41 -4.92 119.30 122.29 2win s MET 3 Ca 0.97 -0.96 -0.14 0.00 -1.25 0.00 0.00 55.69 54.30 2win s MET 3 Cb -0.72 -3.35 0.05 0.00 2.84 0.00 0.00 34.83 33.65 2win s MET 3 CO 0.51 -0.50 0.32 0.71 -0.65 0.00 0.00 175.02 175.42 2win s TYR 4 N 1.45 3.25 0.31 4.11 2.02 -1.26 -0.55 117.35 126.69 2win s TYR 4 Ca 0.01 -0.85 0.07 0.00 -0.37 0.00 0.00 57.07 55.94 2win s TYR 4 Cb -0.18 -2.83 -0.03 0.00 -0.40 0.00 0.00 41.96 38.52 2win s TYR 4 CO 0.02 -0.70 0.27 -1.54 -1.57 0.00 0.00 175.55 172.02 2win s SER 5 N 2.07 5.36 -0.10 2.29 1.04 -1.25 -1.21 113.70 121.90 2win s SER 5 Ca 0.04 -0.42 -0.09 0.00 0.48 0.00 0.00 55.95 55.96 2win s SER 5 Cb -0.21 -1.10 0.03 0.00 0.10 0.00 0.00 66.02 64.84 2win s SER 5 CO 0.08 -0.27 0.27 -0.51 0.98 0.00 0.00 173.24 173.79 2win s ILE 6 N -2.26 -0.00 -0.06 -1.02 1.10 0.66 -2.89 121.20 116.73 2win s ILE 6 Ca 0.39 0.00 0.01 0.00 -0.51 0.00 0.00 60.65 60.54 2win s ILE 6 Cb -0.06 -0.38 0.02 0.00 0.15 0.00 0.00 42.46 42.18 2win s ILE 6 CO 0.26 0.00 -0.05 -0.63 -2.11 0.00 0.00 174.94 172.41 2win s ILE 7 N 0.17 0.68 0.08 2.00 1.01 -1.04 -1.94 121.20 122.16 2win s ILE 7 Ca -0.00 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.51 2win s ILE 7 Cb -0.02 -0.72 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 2win s ILE 7 CO 0.00 0.28 -0.07 0.42 0.00 0.00 0.00 174.94 175.57 2win s THR 8 N 1.21 0.66 0.35 2.92 -4.23 -1.11 -1.88 115.64 113.56 2win s THR 8 Ca -0.06 -1.63 -0.26 0.00 -1.18 0.00 0.00 61.69 58.57 2win s THR 8 Cb -0.14 -1.30 -0.13 0.00 1.34 0.00 0.00 72.50 72.28 2win s THR 8 CO -0.02 -0.68 0.92 -2.65 -0.54 0.00 0.00 174.62 171.65 2win n PRO 9 N 0.51 1.18 -0.01 3.99 -0.02 -1.26 -1.12 135.00 138.27 2win n PRO 9 Ca -0.16 0.42 0.15 0.00 -2.02 0.00 0.00 63.50 61.89 2win n PRO 9 Cb 0.58 -1.82 0.60 0.00 -0.02 0.00 0.00 33.50 32.84 2win n PRO 9 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 2win h ASN 10 N 1.62 0.17 -3.27 2.55 -0.00 -1.63 -3.39 115.58 111.64 2win h ASN 10 Ca -0.41 0.00 -0.44 0.00 -0.00 0.00 0.00 56.30 55.46 2win h ASN 10 Cb 1.35 -0.03 -0.38 0.00 -0.00 0.00 0.00 38.32 39.26 2win h ASN 10 CO 0.58 0.10 -0.77 -0.63 -0.00 0.00 0.00 177.43 176.71 2win s ILE 11 N -5.20 0.40 0.67 2.57 1.01 -1.26 -4.12 121.20 115.27 2win s ILE 11 Ca -0.06 0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.58 2win s ILE 11 Cb 0.19 -0.54 0.00 0.00 0.01 0.00 0.00 42.46 42.13 2win s ILE 11 CO 0.73 0.26 1.05 -0.76 0.00 0.00 0.00 174.94 176.22 2win s LEU 12 N 1.89 3.02 0.09 2.97 1.43 0.08 -4.89 118.68 123.27 2win s LEU 12 Ca 0.04 1.09 0.05 0.00 -1.03 0.00 0.00 54.13 54.28 2win s LEU 12 Cb -0.12 -3.93 -0.03 0.00 0.03 0.00 0.00 46.19 42.13 2win s LEU 12 CO -0.05 -1.21 -0.13 -0.13 0.23 0.00 0.00 176.35 175.06 2win s ARG 13 N -5.26 0.87 0.21 1.70 0.52 -1.26 -0.88 118.95 114.85 2win s ARG 13 Ca 0.57 -1.08 -0.13 0.00 -0.52 0.00 0.00 55.73 54.56 2win s ARG 13 Cb -0.11 -0.74 -0.07 0.00 0.52 0.00 0.00 34.95 34.55 2win s ARG 13 CO 0.51 0.14 0.60 -0.51 0.02 0.00 0.00 175.30 176.06 2win s LEU 14 N -2.13 4.23 -1.49 2.53 1.43 -1.21 -4.19 118.68 117.84 2win s LEU 14 Ca 0.03 1.08 -0.12 0.00 -1.03 0.00 0.00 54.13 54.09 2win s LEU 14 Cb -0.07 -3.59 0.07 0.00 0.03 0.00 0.00 46.19 42.64 2win s LEU 14 CO 0.02 -0.02 1.00 -0.62 0.23 0.00 0.00 176.35 176.95 2win n GLU 15 N 0.25 -5.86 -3.70 1.70 1.02 -0.61 -4.71 120.64 108.72 2win n GLU 15 Ca -0.01 0.63 -0.14 0.00 -0.02 0.00 0.00 57.16 57.62 2win n GLU 15 Cb 0.52 -5.53 -0.08 0.00 -0.02 0.00 0.00 31.44 26.33 2win n GLU 15 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2win s SER 16 N -3.39 -0.29 -0.42 1.62 1.04 -1.26 -5.03 113.70 105.96 2win s SER 16 Ca 0.60 0.20 -0.26 0.00 0.48 0.00 0.00 55.95 56.97 2win s SER 16 Cb -0.30 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.21 2win s SER 16 CO 0.81 -0.50 0.96 -1.61 0.98 0.00 0.00 173.24 173.88 2win s GLU 17 N -1.44 3.71 -0.17 4.02 2.02 -1.26 -4.28 118.70 121.31 2win s GLU 17 Ca -0.12 0.43 -0.05 0.00 0.02 0.00 0.00 54.97 55.25 2win s GLU 17 Cb -0.04 -3.86 -0.03 0.00 0.10 0.00 0.00 34.13 30.30 2win s GLU 17 CO 0.05 -1.11 -0.00 -1.21 0.02 0.00 0.00 175.26 173.00 2win s GLU 18 N 3.72 3.76 0.76 1.61 0.41 -0.99 -4.96 118.70 123.01 2win s GLU 18 Ca 0.39 -0.47 -0.11 0.00 -0.41 0.00 0.00 54.97 54.37 2win s GLU 18 Cb -0.11 -3.03 0.05 0.00 -1.78 0.00 0.00 34.13 29.26 2win s GLU 18 CO 0.23 0.21 1.08 0.99 -0.49 0.00 0.00 175.26 177.29 2win s THR 19 N 0.47 3.42 -0.26 3.63 2.01 -1.26 -3.15 115.64 120.49 2win s THR 19 Ca -0.01 0.46 -0.01 0.00 0.31 0.00 0.00 61.69 62.44 2win s THR 19 Cb -0.14 -3.18 0.14 0.00 0.01 0.00 0.00 72.50 69.34 2win s THR 19 CO 0.02 -0.60 0.38 -0.32 -0.69 0.00 0.00 174.62 173.41 2win s MET 20 N -5.09 0.36 -0.51 4.92 1.75 -1.09 -4.50 119.30 115.14 2win s MET 20 Ca 0.60 0.36 -0.26 0.00 -1.25 0.00 0.00 55.69 55.14 2win s MET 20 Cb -0.15 -0.45 0.03 0.00 2.84 0.00 0.00 34.83 37.11 2win s MET 20 CO 0.55 -0.78 1.00 0.08 -0.65 0.00 0.00 175.02 175.21 2win s VAL 21 N 2.53 4.34 0.36 10.11 1.01 -0.79 -2.77 120.40 135.20 2win s VAL 21 Ca 0.12 0.67 -0.10 0.00 0.00 0.00 0.00 61.98 62.67 2win s VAL 21 Cb -0.14 -4.53 -0.07 0.00 0.00 0.00 0.00 36.38 31.64 2win s VAL 21 CO -0.21 -1.02 0.71 -0.76 0.00 0.00 0.00 175.10 173.81 2win s LEU 22 N 4.08 3.93 0.20 3.92 1.43 -1.18 -2.50 118.68 128.56 2win s LEU 22 Ca 0.37 1.06 -0.15 0.00 -1.03 0.00 0.00 54.13 54.39 2win s LEU 22 Cb -0.10 -3.91 0.01 0.00 0.03 0.00 0.00 46.19 42.22 2win s LEU 22 CO 0.25 -0.31 0.47 -1.61 0.23 0.00 0.00 176.35 175.37 2win s GLU 23 N -3.60 1.38 -0.30 1.70 2.02 -1.14 -0.53 118.70 118.24 2win s GLU 23 Ca 0.50 -1.01 0.01 0.00 0.02 0.00 0.00 54.97 54.48 2win s GLU 23 Cb -0.10 0.48 0.19 0.00 0.10 0.00 0.00 34.13 34.80 2win s GLU 23 CO 0.28 -0.57 0.59 0.00 0.02 0.00 0.00 175.26 175.58 2win s ALA 24 N -3.92 -2.25 0.04 5.21 0.00 -0.82 -3.74 121.76 116.27 2win s ALA 24 Ca 0.14 1.63 -0.12 0.00 0.00 0.00 0.00 51.96 53.61 2win s ALA 24 Cb -0.00 -2.24 -0.06 0.00 0.00 0.00 0.00 23.12 20.83 2win s ALA 24 CO 0.01 -1.44 0.40 -1.01 0.00 0.00 0.00 175.76 173.71 2win s HIS 25 N 2.84 3.65 -1.43 0.00 0.09 0.29 -4.24 115.29 116.49 2win s HIS 25 Ca 0.18 0.87 -0.08 0.00 -0.00 0.00 0.00 55.06 56.03 2win s HIS 25 Cb -0.14 -2.21 0.04 0.00 -0.00 0.00 0.00 32.58 30.27 2win s HIS 25 CO -0.22 0.58 0.64 -0.25 -0.00 0.00 0.00 174.74 175.49 2win n ASP 26 N 1.33 -5.01 -4.91 1.40 8.00 -1.26 -1.28 116.55 114.81 2win n ASP 26 Ca -0.11 -0.40 -0.33 0.00 0.71 0.00 0.00 54.79 54.66 2win n ASP 26 Cb 0.52 -4.07 -0.05 0.00 -0.02 0.00 0.00 41.12 37.51 2win n ASP 26 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2win s ALA 27 N -3.10 3.96 -0.07 2.24 0.00 -1.26 -4.09 121.76 119.43 2win s ALA 27 Ca 0.40 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.59 2win s ALA 27 Cb -0.20 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.00 2win s ALA 27 CO 0.50 0.76 -0.02 -0.65 0.00 0.00 0.00 175.76 176.34 2win s GLN 28 N -2.03 2.90 3.58 0.00 -1.52 -1.26 -5.02 119.66 116.30 2win s GLN 28 Ca 0.29 -0.46 0.00 0.00 -1.95 0.00 0.00 55.36 53.23 2win s GLN 28 Cb -0.13 -2.73 0.00 0.00 -0.22 0.00 0.00 33.01 29.94 2win s GLN 28 CO 0.20 0.69 0.00 0.41 -0.25 0.00 0.00 175.29 176.34 2win n GLY 29 N 2.10 0.96 3.95 3.09 0.00 -1.26 -4.81 105.19 109.23 2win n GLY 29 Ca -0.18 -0.70 -0.25 0.00 0.00 0.00 0.00 46.02 44.88 2win n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2win s ASP 30 N -4.00 4.50 -0.29 1.61 1.01 -1.26 -4.36 116.67 113.88 2win s ASP 30 Ca 0.00 0.20 -0.01 0.00 0.71 0.00 0.00 52.55 53.45 2win s ASP 30 Cb 0.00 -0.72 0.18 0.00 1.01 0.00 0.00 42.92 43.38 2win s ASP 30 CO 0.00 -1.78 0.56 0.54 0.21 0.00 0.00 175.17 174.70 2win s VAL 31 N -3.27 -0.93 -0.12 -1.27 0.11 -1.24 -4.99 120.40 108.69 2win s VAL 31 Ca 0.63 -0.01 -0.29 0.00 -2.93 0.00 0.00 61.98 59.38 2win s VAL 31 Cb -0.08 -0.96 -0.06 0.00 -1.53 0.00 0.00 36.38 33.74 2win s VAL 31 CO 0.45 -0.02 1.93 -2.84 -3.33 0.00 0.00 175.10 171.29 2win s PRO 32 N 2.80 3.72 -0.14 1.54 0.02 -1.26 -2.84 135.00 138.84 2win s PRO 32 Ca 0.19 2.13 -0.02 0.00 0.02 0.00 0.00 61.00 63.31 2win s PRO 32 Cb -0.15 -4.18 -0.02 0.00 0.02 0.00 0.00 34.50 30.16 2win s PRO 32 CO -0.20 -1.41 -0.07 0.08 -0.33 0.00 0.00 177.00 175.07 2win s VAL 33 N 5.86 3.65 -0.22 3.83 1.01 0.13 -0.01 120.40 134.66 2win s VAL 33 Ca 0.86 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.40 2win s VAL 33 Cb -0.34 -2.57 0.05 0.00 0.00 0.00 0.00 36.38 33.52 2win s VAL 33 CO 0.35 0.51 -0.08 0.42 0.00 0.00 0.00 175.10 176.30 2win s THR 34 N 0.26 1.63 -0.12 3.92 -4.23 -0.51 -1.60 115.64 114.99 2win s THR 34 Ca -0.05 -1.13 -0.14 0.00 -1.18 0.00 0.00 61.69 59.19 2win s THR 34 Cb -0.14 -1.78 -0.05 0.00 1.34 0.00 0.00 72.50 71.87 2win s THR 34 CO 0.04 0.05 0.32 -0.69 -0.54 0.00 0.00 174.62 173.80 2win s VAL 35 N 1.38 5.26 0.02 2.29 1.01 -1.12 -1.21 120.40 128.02 2win s VAL 35 Ca -0.04 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.57 2win s VAL 35 Cb -0.18 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 2win s VAL 35 CO -0.07 0.44 -0.03 -0.89 0.00 0.00 0.00 175.10 174.55 2win s THR 36 N 0.07 0.16 -0.07 3.92 2.01 0.20 -4.47 115.64 117.45 2win s THR 36 Ca 0.19 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.58 2win s THR 36 Cb -0.14 -0.25 0.01 0.00 0.01 0.00 0.00 72.50 72.14 2win s THR 36 CO 0.06 -0.30 -0.13 -0.69 -0.69 0.00 0.00 174.62 172.88 2win s VAL 37 N -0.94 1.23 0.21 3.82 1.01 0.45 0.19 120.40 126.35 2win s VAL 37 Ca -0.09 -0.52 0.09 0.00 0.00 0.00 0.00 61.98 61.46 2win s VAL 37 Cb -0.07 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2win s VAL 37 CO -0.00 0.38 -0.18 -1.00 0.00 0.00 0.00 175.10 174.29 2win s HIS 38 N 0.69 1.93 0.80 5.22 3.76 -0.88 -2.33 115.29 124.49 2win s HIS 38 Ca -0.14 -0.46 -0.11 0.00 -0.15 0.00 0.00 55.06 54.20 2win s HIS 38 Cb -0.16 -0.91 0.07 0.00 1.11 0.00 0.00 32.58 32.69 2win s HIS 38 CO 0.03 0.44 1.09 0.16 -0.85 0.00 0.00 174.74 175.61 2win s ASP 39 N -3.05 4.33 -0.07 1.40 -4.77 -1.26 -0.55 116.67 112.69 2win s ASP 39 Ca 0.21 1.58 0.02 0.00 -3.30 0.00 0.00 52.55 51.07 2win s ASP 39 Cb -0.04 -2.31 0.01 0.00 -1.09 0.00 0.00 42.92 39.49 2win s ASP 39 CO 0.09 -2.11 -0.13 0.12 0.70 0.00 0.00 175.17 173.84 2win s PHE 40 N -2.99 1.57 0.00 2.11 5.36 -1.06 -4.10 117.98 118.88 2win s PHE 40 Ca 0.61 -0.60 0.00 0.00 -0.96 0.00 0.00 56.93 55.99 2win s PHE 40 Cb -0.16 -1.14 0.00 0.00 -0.34 0.00 0.00 43.02 41.38 2win s PHE 40 CO 0.56 -0.30 0.00 -2.30 -1.46 0.00 0.00 175.22 171.72 2win n PRO 41 N 3.82 0.34 0.00 10.12 -0.02 -1.26 -4.57 135.00 143.43 2win n PRO 41 Ca -0.22 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.26 2win n PRO 41 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2win n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2win n GLY 42 N 5.00 -1.78 2.83 -1.23 0.00 -1.26 -4.89 105.19 103.87 2win n GLY 42 Ca 0.00 -1.37 -0.23 0.00 0.00 0.00 0.00 46.02 44.42 2win n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2win s LYS 43 N 0.00 0.87 0.00 1.61 1.02 -1.26 -4.54 119.74 117.43 2win s LYS 43 Ca 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 55.97 55.96 2win s LYS 43 Cb 0.00 -1.07 0.00 0.00 -0.52 0.00 0.00 37.83 36.24 2win s LYS 43 CO 0.00 -0.23 0.00 1.17 -0.92 0.00 0.00 175.35 175.37 2win n LYS 44 N 4.80 3.20 -2.89 1.68 4.81 -1.26 -4.98 118.16 123.52 2win n LYS 44 Ca -0.13 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.28 2win n LYS 44 Cb 0.50 -0.41 0.00 0.00 0.02 0.00 0.00 35.03 35.15 2win n LYS 44 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2win n LEU 45 N -0.36 -7.06 0.14 3.14 7.94 -1.26 -4.93 117.00 114.61 2win n LEU 45 Ca 0.00 0.19 -0.01 0.00 -1.11 0.00 0.00 56.01 55.08 2win n LEU 45 Cb 0.00 -3.24 0.18 0.00 0.53 0.00 0.00 43.42 40.89 2win n LEU 45 CO 0.00 -1.60 0.51 -0.37 -1.11 0.00 0.00 177.39 174.82 2win h VAL 46 N 1.09 1.39 -1.85 1.96 -1.51 -1.81 -3.44 116.25 112.09 2win h VAL 46 Ca 0.00 -2.09 0.05 0.00 -1.23 0.00 0.00 66.70 63.43 2win h VAL 46 Cb 0.98 2.14 -0.22 0.00 -2.13 0.00 0.00 31.29 32.06 2win h VAL 46 CO 0.24 0.59 -0.21 -0.22 -1.23 0.00 0.00 177.57 176.74 2win s LEU 47 N -7.53 -1.11 -0.01 4.19 0.20 -1.08 -4.66 118.68 108.68 2win s LEU 47 Ca -0.01 1.27 0.11 0.00 0.69 0.00 0.00 54.13 56.20 2win s LEU 47 Cb 0.12 2.08 -0.17 0.00 -0.43 0.00 0.00 46.19 47.80 2win s LEU 47 CO 0.76 -0.23 0.27 -1.54 -0.29 0.00 0.00 176.35 175.31 2win n SER 48 N 5.43 2.26 -3.04 3.68 3.41 -1.26 -0.41 113.62 123.69 2win n SER 48 Ca -0.09 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 2win n SER 48 Cb 0.50 1.47 0.00 0.00 -0.26 0.00 0.00 64.21 65.91 2win n SER 48 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2win n SER 49 N -1.83 -0.57 -2.25 4.04 3.41 -1.26 -4.67 113.62 110.49 2win n SER 49 Ca -0.02 -0.23 -0.04 0.00 -0.26 0.00 0.00 58.87 58.32 2win n SER 49 Cb 0.28 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 2win n SER 49 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2win n GLU 50 N -0.80 -1.42 -4.80 4.33 -0.58 -1.26 -4.57 120.64 111.53 2win n GLU 50 Ca 0.00 1.46 -0.24 0.00 -0.42 0.00 0.00 57.16 57.96 2win n GLU 50 Cb 0.00 -3.80 -0.15 0.00 -0.57 0.00 0.00 31.44 26.91 2win n GLU 50 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 2win s LYS 51 N -1.78 1.41 0.22 3.49 -2.85 -1.26 -2.80 119.74 116.17 2win s LYS 51 Ca 0.12 -0.60 -0.01 0.00 -1.00 0.00 0.00 55.97 54.49 2win s LYS 51 Cb -0.03 -1.34 -0.04 0.00 -2.06 0.00 0.00 37.83 34.36 2win s LYS 51 CO 0.43 0.34 0.17 -0.08 0.10 0.00 0.00 175.35 176.31 2win s THR 52 N -0.33 0.00 -0.09 3.79 -1.32 -0.63 -5.01 115.64 112.06 2win s THR 52 Ca 0.05 -1.96 0.04 0.00 -1.21 0.00 0.00 61.69 58.61 2win s THR 52 Cb -0.07 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.44 2win s THR 52 CO -0.00 0.00 -0.22 -0.69 -2.21 0.00 0.00 174.62 171.50 2win s VAL 53 N -4.07 1.87 -0.58 5.08 1.01 -1.26 -0.70 120.40 121.75 2win s VAL 53 Ca 0.38 -0.92 -0.25 0.00 0.00 0.00 0.00 61.98 61.19 2win s VAL 53 Cb 0.06 -1.62 0.04 0.00 0.00 0.00 0.00 36.38 34.86 2win s VAL 53 CO 0.13 0.52 1.04 -0.76 0.00 0.00 0.00 175.10 176.03 2win s LEU 54 N 0.32 3.86 0.01 3.92 1.43 -1.13 -4.93 118.68 122.15 2win s LEU 54 Ca -0.16 -0.25 -0.20 0.00 -1.03 0.00 0.00 54.13 52.49 2win s LEU 54 Cb -0.17 -2.89 -0.06 0.00 0.03 0.00 0.00 46.19 43.10 2win s LEU 54 CO 0.07 -1.36 0.60 -0.89 0.23 0.00 0.00 176.35 175.00 2win s THR 55 N 4.38 4.87 0.10 5.49 2.01 -1.26 -3.61 115.64 127.62 2win s THR 55 Ca 0.34 1.26 0.23 0.00 0.31 0.00 0.00 61.69 63.83 2win s THR 55 Cb -0.11 -3.93 0.23 0.00 0.01 0.00 0.00 72.50 68.70 2win s THR 55 CO 0.20 0.44 1.69 -0.65 -0.69 0.00 0.00 174.62 175.61 2win h PRO 56 N 5.45 0.00 0.00 4.92 0.11 -1.96 0.15 132.00 140.67 2win h PRO 56 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2win h PRO 56 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2win h PRO 56 CO 0.69 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.48 2win n ALA 57 N -1.77 2.33 -1.38 -0.75 0.00 -1.26 -3.08 120.51 114.60 2win n ALA 57 Ca -0.02 -0.12 0.08 0.00 0.00 0.00 0.00 53.44 53.38 2win n ALA 57 Cb 0.17 -1.45 0.14 0.00 0.00 0.00 0.00 19.45 18.31 2win n ALA 57 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2win n THR 58 N -1.38 1.71 -1.96 0.00 -2.24 0.52 -4.96 114.28 105.96 2win n THR 58 Ca 0.10 -2.28 -0.19 0.00 -2.27 0.00 0.00 64.05 59.42 2win n THR 58 Cb 0.26 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.34 2win n THR 58 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2win n ASN 59 N -1.12 -5.12 -3.17 3.42 4.13 -1.18 -2.52 115.26 109.71 2win n ASN 59 Ca 0.15 0.26 -0.19 0.00 1.68 0.00 0.00 54.58 56.48 2win n ASN 59 Cb 0.69 -4.43 0.07 0.00 -1.54 0.00 0.00 39.78 34.57 2win n ASN 59 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2win n HIS 60 N -3.01 -2.31 -4.48 3.10 8.25 -1.12 -4.77 115.22 110.88 2win n HIS 60 Ca -0.20 0.86 -0.33 0.00 -0.26 0.00 0.00 57.72 57.79 2win n HIS 60 Cb 0.64 -4.58 -0.14 0.00 1.12 0.00 0.00 29.99 27.03 2win n HIS 60 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2win s MET 61 N -5.81 3.38 0.49 -0.41 -1.94 -1.05 -1.95 119.30 112.01 2win s MET 61 Ca 0.34 -0.67 0.09 0.00 -1.71 0.00 0.00 55.69 53.74 2win s MET 61 Cb -0.15 -2.75 0.04 0.00 2.01 0.00 0.00 34.83 33.99 2win s MET 61 CO 0.63 0.08 0.67 0.20 -0.01 0.00 0.00 175.02 176.60 2win s GLY 62 N 0.70 1.86 -0.29 -0.03 0.00 0.31 -4.84 107.32 105.02 2win s GLY 62 Ca -0.05 -1.89 0.03 0.00 0.00 0.00 0.00 44.72 42.81 2win s GLY 62 CO 0.02 -1.59 0.54 0.21 0.00 0.00 0.00 173.10 172.28 2win s ASN 63 N -4.49 -1.05 -0.22 1.64 3.84 -1.26 -3.11 114.94 110.30 2win s ASN 63 Ca 0.58 0.19 0.02 0.00 0.21 0.00 0.00 52.86 53.85 2win s ASN 63 Cb -0.08 1.81 0.04 0.00 -0.55 0.00 0.00 41.25 42.46 2win s ASN 63 CO 0.36 -0.30 -0.16 0.68 -2.79 0.00 0.00 177.10 174.88 2win s VAL 64 N 2.76 2.14 -0.33 -5.21 -7.23 -1.11 -5.01 120.40 106.41 2win s VAL 64 Ca 0.12 -1.24 -0.15 0.00 -1.81 0.00 0.00 61.98 58.90 2win s VAL 64 Cb -0.12 -2.06 -0.02 0.00 0.56 0.00 0.00 36.38 34.74 2win s VAL 64 CO -0.25 0.29 0.36 0.42 -0.31 0.00 0.00 175.10 175.61 2win s THR 65 N 1.21 5.17 0.39 5.32 -4.23 -1.26 -2.66 115.64 119.57 2win s THR 65 Ca -0.01 0.15 0.08 0.00 -1.18 0.00 0.00 61.69 60.73 2win s THR 65 Cb -0.16 -3.80 -0.07 0.00 1.34 0.00 0.00 72.50 69.81 2win s THR 65 CO -0.09 -0.05 0.01 0.72 -0.54 0.00 0.00 174.62 174.67 2win s PHE 66 N 2.04 2.51 -0.05 3.99 -0.12 -1.19 -4.98 117.98 120.17 2win s PHE 66 Ca 0.12 -0.59 -0.02 0.00 -0.05 0.00 0.00 56.93 56.39 2win s PHE 66 Cb -0.16 -1.68 0.04 0.00 -0.63 0.00 0.00 43.02 40.59 2win s PHE 66 CO 0.11 0.45 0.11 0.99 -0.05 0.00 0.00 175.22 176.83 2win s THR 67 N -2.65 -0.11 -0.34 -4.49 2.01 -1.26 -2.34 115.64 106.46 2win s THR 67 Ca 0.35 0.26 -0.20 0.00 0.31 0.00 0.00 61.69 62.42 2win s THR 67 Cb 0.06 -0.20 -0.00 0.00 0.01 0.00 0.00 72.50 72.37 2win s THR 67 CO 0.18 0.11 0.60 -0.63 -0.69 0.00 0.00 174.62 174.20 2win s ILE 68 N 1.53 4.93 0.61 1.82 1.01 -1.26 -4.91 121.20 124.93 2win s ILE 68 Ca -0.05 0.61 -0.10 0.00 0.00 0.00 0.00 60.65 61.11 2win s ILE 68 Cb -0.12 -4.03 0.16 0.00 0.01 0.00 0.00 42.46 38.48 2win s ILE 68 CO -0.05 -0.24 0.40 -2.65 0.00 0.00 0.00 174.94 172.40 2win n PRO 69 N 5.93 -2.91 0.00 2.79 -0.02 -1.26 -1.58 135.00 137.95 2win n PRO 69 Ca -0.02 -0.66 0.00 0.00 -2.02 0.00 0.00 63.50 60.80 2win n PRO 69 Cb 0.49 -0.79 0.00 0.00 -0.02 0.00 0.00 33.50 33.18 2win n PRO 69 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2win n ALA 70 N -4.12 0.00 -4.05 3.55 0.00 -1.26 -4.62 120.51 110.02 2win n ALA 70 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.05 2win n ALA 70 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.69 2win n ALA 70 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2win n ASN 71 N -0.35 -2.21 -3.43 0.00 3.02 -1.26 -5.14 115.26 105.89 2win n ASN 71 Ca 0.00 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 2win n ASN 71 Cb 0.00 -3.10 0.00 0.00 -0.61 0.00 0.00 39.78 36.07 2win n ASN 71 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2win n ARG 72 N -4.44 1.90 -3.29 3.52 1.74 -1.26 -5.25 116.66 109.58 2win n ARG 72 Ca -0.10 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 2win n ARG 72 Cb 0.58 -0.78 0.00 0.00 -1.02 0.00 0.00 32.46 31.25 2win n ARG 72 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2win n LYS 78 N 2.33 -1.09 0.00 5.56 5.02 -1.26 -5.30 118.16 123.42 2win n LYS 78 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2win n LYS 78 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2win n LYS 78 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2win n GLY 79 N 0.00 1.30 3.70 0.72 0.00 -1.26 -5.10 105.19 104.56 2win n GLY 79 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2win n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2win s ARG 80 N 0.00 4.25 0.60 1.61 0.52 -1.26 -5.05 118.95 119.61 2win s ARG 80 Ca 0.00 0.22 -0.18 0.00 -0.52 0.00 0.00 55.73 55.25 2win s ARG 80 Cb 0.00 -3.47 -0.06 0.00 0.52 0.00 0.00 34.95 31.94 2win s ARG 80 CO 0.00 0.11 0.83 0.09 0.02 0.00 0.00 175.30 176.36 2win n ASN 81 N 3.94 0.22 -4.59 0.23 3.02 -1.26 -5.01 115.26 111.81 2win n ASN 81 Ca -0.09 0.78 -0.33 0.00 -0.03 0.00 0.00 54.58 54.90 2win n ASN 81 Cb 0.51 -1.33 -0.11 0.00 -0.61 0.00 0.00 39.78 38.25 2win n ASN 81 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2win s LYS 82 N -2.58 2.68 0.32 3.52 1.02 -1.26 -5.07 119.74 118.37 2win s LYS 82 Ca 0.74 -0.61 0.10 0.00 0.02 0.00 0.00 55.97 56.23 2win s LYS 82 Cb -0.42 -2.56 -0.06 0.00 -0.52 0.00 0.00 37.83 34.27 2win s LYS 82 CO 0.49 0.64 -0.13 -0.06 -0.92 0.00 0.00 175.35 175.37 2win s PHE 83 N -0.88 2.37 0.16 3.18 0.08 -1.26 -2.76 117.98 118.86 2win s PHE 83 Ca 0.14 -0.44 0.06 0.00 0.12 0.00 0.00 56.93 56.82 2win s PHE 83 Cb -0.11 -1.25 -0.04 0.00 -0.57 0.00 0.00 43.02 41.05 2win s PHE 83 CO 0.04 0.63 -0.14 0.14 -0.10 0.00 0.00 175.22 175.79 2win s VAL 84 N -2.57 1.47 -0.35 -0.44 -7.23 -0.93 -2.56 120.40 107.79 2win s VAL 84 Ca 0.32 -1.96 -0.03 0.00 -1.81 0.00 0.00 61.98 58.50 2win s VAL 84 Cb -0.00 -1.79 0.08 0.00 0.56 0.00 0.00 36.38 35.22 2win s VAL 84 CO 0.16 -0.53 0.10 -0.89 -0.31 0.00 0.00 175.10 173.63 2win s THR 85 N -2.64 3.19 0.11 5.32 2.01 0.28 -1.65 115.64 122.26 2win s THR 85 Ca 0.15 -1.67 -0.30 0.00 0.31 0.00 0.00 61.69 60.18 2win s THR 85 Cb -0.02 -3.00 -0.06 0.00 0.01 0.00 0.00 72.50 69.43 2win s THR 85 CO 0.04 -0.38 1.06 -0.69 -0.69 0.00 0.00 174.62 173.96 2win s VAL 86 N 1.21 4.21 -0.26 3.82 1.01 -0.10 -2.07 120.40 128.22 2win s VAL 86 Ca 0.01 1.77 -0.02 0.00 0.00 0.00 0.00 61.98 63.75 2win s VAL 86 Cb -0.21 -4.13 0.08 0.00 0.00 0.00 0.00 36.38 32.12 2win s VAL 86 CO -0.02 0.24 0.08 -1.58 0.00 0.00 0.00 175.10 173.82 2win s GLN 87 N 0.18 0.63 -0.30 2.72 0.74 0.13 -1.01 119.66 122.74 2win s GLN 87 Ca 0.51 -0.74 -0.09 0.00 0.05 0.00 0.00 55.36 55.09 2win s GLN 87 Cb -0.27 -1.92 -0.01 0.00 1.10 0.00 0.00 33.01 31.91 2win s GLN 87 CO 0.31 -0.85 0.14 0.00 -0.55 0.00 0.00 175.29 174.34 2win s ALA 88 N 1.78 3.24 -0.39 1.58 0.00 -0.23 -0.63 121.76 127.11 2win s ALA 88 Ca 0.05 -1.37 -0.13 0.00 0.00 0.00 0.00 51.96 50.52 2win s ALA 88 Cb -0.17 -2.32 0.02 0.00 0.00 0.00 0.00 23.12 20.65 2win s ALA 88 CO -0.20 -0.86 0.25 0.99 0.00 0.00 0.00 175.76 175.94 2win s THR 89 N 1.60 4.88 -1.22 0.00 2.01 -0.35 -0.89 115.64 121.67 2win s THR 89 Ca 0.05 -0.76 -0.13 0.00 0.31 0.00 0.00 61.69 61.15 2win s THR 89 Cb -0.17 -3.72 0.17 0.00 0.01 0.00 0.00 72.50 68.80 2win s THR 89 CO 0.06 -0.26 1.49 0.49 -0.69 0.00 0.00 174.62 175.70 2win n PHE 90 N 5.07 4.71 0.00 4.92 3.72 -0.03 -1.42 117.46 134.42 2win n PHE 90 Ca -0.11 -3.30 0.00 0.00 -0.05 0.00 0.00 57.45 53.99 2win n PHE 90 Cb 0.47 -2.14 0.00 0.00 -0.94 0.00 0.00 39.48 36.86 2win n PHE 90 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2win n GLY 91 N 3.87 2.27 0.38 1.37 0.00 0.99 -3.31 105.19 110.76 2win n GLY 91 Ca 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.37 2win n GLY 91 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2win n THR 92 N 0.00 0.00 -2.11 2.61 -1.04 -1.26 -5.01 114.28 107.47 2win n THR 92 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 2win n THR 92 Cb 0.00 -0.35 -0.03 0.00 -1.82 0.00 0.00 70.33 68.14 2win n THR 92 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2win s GLN 93 N -1.52 4.21 -0.13 -2.82 2.00 -1.21 -5.00 119.66 115.20 2win s GLN 93 Ca 0.00 2.08 -0.05 0.00 -2.00 0.00 0.00 55.36 55.38 2win s GLN 93 Cb 0.00 -3.84 -0.04 0.00 0.80 0.00 0.00 33.01 29.93 2win s GLN 93 CO 0.00 -0.77 0.06 0.54 -0.50 0.00 0.00 175.29 174.63 2win s VAL 94 N 3.54 4.85 -0.10 1.34 0.11 -1.26 -0.85 120.40 128.02 2win s VAL 94 Ca 0.69 -0.03 -0.01 0.00 -2.93 0.00 0.00 61.98 59.70 2win s VAL 94 Cb -0.32 -3.11 0.03 0.00 -1.53 0.00 0.00 36.38 31.45 2win s VAL 94 CO 0.27 0.56 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.85 2win s VAL 95 N -0.53 0.87 0.13 2.04 1.01 -0.07 -4.99 120.40 118.86 2win s VAL 95 Ca 0.10 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.97 2win s VAL 95 Cb -0.12 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 2win s VAL 95 CO 0.02 0.34 -0.18 -1.83 0.00 0.00 0.00 175.10 173.45 2win s GLU 96 N 1.77 1.15 -0.13 2.72 -1.05 -1.26 -1.07 118.70 120.83 2win s GLU 96 Ca 0.05 -1.27 -0.14 0.00 -0.15 0.00 0.00 54.97 53.45 2win s GLU 96 Cb -0.12 -1.23 0.04 0.00 -0.44 0.00 0.00 34.13 32.38 2win s GLU 96 CO -0.08 0.26 0.39 0.21 0.95 0.00 0.00 175.26 177.00 2win s LYS 97 N -2.45 0.50 -0.14 -4.83 2.47 -0.18 -5.00 119.74 110.10 2win s LYS 97 Ca 0.11 0.46 -0.14 0.00 -1.56 0.00 0.00 55.97 54.84 2win s LYS 97 Cb -0.07 0.24 -0.05 0.00 -1.46 0.00 0.00 37.83 36.49 2win s LYS 97 CO 0.05 -0.07 0.32 0.08 0.16 0.00 0.00 175.35 175.88 2win s VAL 98 N 0.01 5.27 0.06 4.02 1.01 -1.26 -0.92 120.40 128.59 2win s VAL 98 Ca -0.02 0.61 0.07 0.00 0.00 0.00 0.00 61.98 62.65 2win s VAL 98 Cb -0.03 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 2win s VAL 98 CO 0.01 0.41 -0.20 -0.69 0.00 0.00 0.00 175.10 174.63 2win s VAL 99 N 0.24 1.66 0.51 2.92 1.01 -0.66 -4.92 120.40 121.16 2win s VAL 99 Ca 0.18 -1.31 -0.20 0.00 0.00 0.00 0.00 61.98 60.65 2win s VAL 99 Cb -0.14 -1.47 -0.07 0.00 0.00 0.00 0.00 36.38 34.70 2win s VAL 99 CO 0.06 0.11 1.10 -0.22 0.00 0.00 0.00 175.10 176.14 2win s LEU 100 N -1.43 3.83 -0.03 3.92 2.96 -1.26 -2.20 118.68 124.48 2win s LEU 100 Ca 0.07 2.09 0.06 0.00 -0.22 0.00 0.00 54.13 56.14 2win s LEU 100 Cb -0.09 -4.52 -0.01 0.00 0.50 0.00 0.00 46.19 42.07 2win s LEU 100 CO 0.03 -0.99 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.15 2win s VAL 101 N -1.81 1.80 -0.09 1.68 1.01 -1.11 -0.74 120.40 121.12 2win s VAL 101 Ca 0.69 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 2win s VAL 101 Cb -0.22 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2win s VAL 101 CO 0.25 0.51 0.09 -0.55 0.00 0.00 0.00 175.10 175.40 2win s SER 102 N -0.37 5.93 0.00 3.32 0.15 -0.06 -4.61 113.70 118.06 2win s SER 102 Ca 0.04 0.33 0.28 0.00 0.70 0.00 0.00 55.95 57.30 2win s SER 102 Cb -0.10 -1.83 1.00 0.00 -1.71 0.00 0.00 66.02 63.38 2win s SER 102 CO 0.01 0.38 1.75 0.18 1.20 0.00 0.00 173.24 176.76 2win n LEU 103 N 1.93 0.28 -4.66 3.45 7.99 -1.26 -3.36 117.00 121.37 2win n LEU 103 Ca -0.19 0.21 -0.42 0.00 -0.01 0.00 0.00 56.01 55.60 2win n LEU 103 Cb 0.54 -0.34 -0.03 0.00 -0.11 0.00 0.00 43.42 43.49 2win n LEU 103 CO 0.31 0.06 1.34 -1.10 -1.51 0.00 0.00 177.39 176.49 2win s GLN 104 N -2.86 4.19 0.03 3.23 -0.21 -1.26 -4.73 119.66 118.05 2win s GLN 104 Ca 0.17 2.15 0.19 0.00 0.02 0.00 0.00 55.36 57.89 2win s GLN 104 Cb 0.19 -3.94 -0.16 0.00 1.00 0.00 0.00 33.01 30.10 2win s GLN 104 CO 0.57 -0.82 0.70 -1.13 -2.12 0.00 0.00 175.29 172.49 2win n SER 105 N 6.95 0.60 0.00 5.90 3.41 -1.26 -4.41 113.62 124.81 2win n SER 105 Ca 0.17 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2win n SER 105 Cb 0.43 0.62 0.00 0.00 -0.26 0.00 0.00 64.21 65.00 2win n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2win n GLY 106 N 1.39 -0.59 3.48 5.00 0.00 -1.26 -4.34 105.19 108.87 2win n GLY 106 Ca -0.10 -0.66 -0.24 0.00 0.00 0.00 0.00 46.02 45.01 2win n GLY 106 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2win s TYR 107 N -3.35 2.31 -0.04 1.61 2.02 -0.98 -4.94 117.35 113.98 2win s TYR 107 Ca 0.00 -0.37 0.01 0.00 -0.37 0.00 0.00 57.07 56.34 2win s TYR 107 Cb 0.00 -1.07 0.02 0.00 -0.40 0.00 0.00 41.96 40.51 2win s TYR 107 CO 0.00 0.69 -0.02 -0.51 -1.57 0.00 0.00 175.55 174.14 2win s LEU 108 N -3.53 1.25 -0.19 -1.29 1.43 -1.26 -3.31 118.68 111.78 2win s LEU 108 Ca 0.30 -0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.34 2win s LEU 108 Cb -0.03 -0.33 0.02 0.00 0.03 0.00 0.00 46.19 45.88 2win s LEU 108 CO 0.15 -0.08 -0.18 -0.36 0.23 0.00 0.00 176.35 176.11 2win s PHE 109 N 0.96 2.85 -0.15 0.29 0.08 -1.05 -4.90 117.98 116.05 2win s PHE 109 Ca -0.11 -1.70 -0.11 0.00 0.12 0.00 0.00 56.93 55.14 2win s PHE 109 Cb -0.14 -1.93 -0.05 0.00 -0.57 0.00 0.00 43.02 40.33 2win s PHE 109 CO -0.01 -0.81 0.20 0.42 -0.10 0.00 0.00 175.22 174.92 2win s ILE 110 N 1.28 5.38 -0.11 0.64 1.01 -1.26 -1.14 121.20 127.00 2win s ILE 110 Ca 0.03 0.34 0.01 0.00 0.00 0.00 0.00 60.65 61.03 2win s ILE 110 Cb -0.14 -3.51 0.02 0.00 0.01 0.00 0.00 42.46 38.84 2win s ILE 110 CO -0.12 0.49 -0.11 -1.58 0.00 0.00 0.00 174.94 173.62 2win s GLN 111 N -0.10 1.83 -0.08 2.79 0.74 -0.44 -4.93 119.66 119.46 2win s GLN 111 Ca 0.13 -0.40 -0.00 0.00 0.05 0.00 0.00 55.36 55.14 2win s GLN 111 Cb -0.12 -1.69 -0.03 0.00 1.10 0.00 0.00 33.01 32.27 2win s GLN 111 CO 0.02 -0.16 -0.06 0.95 -0.55 0.00 0.00 175.29 175.50 2win s THR 112 N 1.30 3.76 0.12 -0.34 -4.23 -1.26 -1.00 115.64 113.99 2win s THR 112 Ca -0.02 -0.45 -0.30 0.00 -1.18 0.00 0.00 61.69 59.75 2win s THR 112 Cb -0.14 -2.56 -0.08 0.00 1.34 0.00 0.00 72.50 71.06 2win s THR 112 CO -0.05 0.58 1.59 -2.24 -0.54 0.00 0.00 174.62 173.97 2win h ASP 113 N 5.50 -1.16 -1.28 3.99 2.03 -1.77 -3.43 116.42 120.29 2win h ASP 113 Ca -0.46 0.14 -0.48 0.00 -0.73 0.00 0.00 57.03 55.51 2win h ASP 113 Cb 1.18 0.45 -0.01 0.00 -0.83 0.00 0.00 39.33 40.12 2win h ASP 113 CO 0.54 -0.45 -0.28 -0.54 -1.03 0.00 0.00 179.24 177.48 2win s LYS 114 N -5.94 2.57 -0.10 4.15 1.02 -1.26 -4.90 119.74 115.28 2win s LYS 114 Ca -0.16 -1.50 0.18 0.00 0.02 0.00 0.00 55.97 54.51 2win s LYS 114 Cb 0.08 -2.53 -0.27 0.00 -0.52 0.00 0.00 37.83 34.60 2win s LYS 114 CO 0.64 -0.37 0.26 0.25 -0.92 0.00 0.00 175.35 175.21 2win n THR 115 N -1.79 0.59 -4.12 2.17 -2.24 -1.26 -4.97 114.28 102.67 2win n THR 115 Ca 0.07 -0.61 -0.15 0.00 -2.27 0.00 0.00 64.05 61.09 2win n THR 115 Cb 0.61 -0.22 -0.14 0.00 -2.10 0.00 0.00 70.33 68.49 2win n THR 115 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2win s ILE 116 N -2.93 0.42 0.11 2.28 2.07 -1.26 -2.15 121.20 119.74 2win s ILE 116 Ca -0.08 -0.45 0.06 0.00 -1.41 0.00 0.00 60.65 58.77 2win s ILE 116 Cb 0.09 -0.40 -0.03 0.00 0.13 0.00 0.00 42.46 42.25 2win s ILE 116 CO 0.79 -0.03 -0.15 -0.31 -1.91 0.00 0.00 174.94 173.33 2win s TYR 117 N -0.47 1.39 -0.06 3.50 2.02 0.47 -4.97 117.35 119.24 2win s TYR 117 Ca -0.02 -0.51 -0.04 0.00 -0.37 0.00 0.00 57.07 56.14 2win s TYR 117 Cb -0.04 -0.75 -0.04 0.00 -0.40 0.00 0.00 41.96 40.73 2win s TYR 117 CO -0.00 0.13 0.12 0.95 -1.57 0.00 0.00 175.55 175.18 2win s THR 118 N -1.78 5.15 -0.27 -0.71 -4.23 -1.26 -1.19 115.64 111.34 2win s THR 118 Ca 0.06 -0.10 -0.32 0.00 -1.18 0.00 0.00 61.69 60.14 2win s THR 118 Cb -0.07 -3.31 -0.09 0.00 1.34 0.00 0.00 72.50 70.38 2win s THR 118 CO 0.03 0.47 2.18 -2.65 -0.54 0.00 0.00 174.62 174.11 2win n PRO 119 N 1.52 1.56 0.00 3.99 -0.02 -1.26 -1.64 135.00 139.15 2win n PRO 119 Ca -0.16 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2win n PRO 119 Cb 0.54 -2.81 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 2win n PRO 119 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2win n GLY 120 N 6.03 1.79 3.97 -1.23 0.00 -0.06 -4.65 105.19 111.04 2win n GLY 120 Ca 0.35 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.09 2win n GLY 120 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2win s SER 121 N -1.32 3.38 -0.06 1.61 1.04 -0.65 -4.71 113.70 112.99 2win s SER 121 Ca 0.00 -0.12 0.03 0.00 0.48 0.00 0.00 55.95 56.34 2win s SER 121 Cb 0.00 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.14 2win s SER 121 CO 0.00 -2.53 -0.15 -0.89 0.98 0.00 0.00 173.24 170.64 2win s THR 122 N -3.64 2.93 -0.27 2.02 2.01 -1.26 -1.40 115.64 116.03 2win s THR 122 Ca 0.73 -0.76 -0.11 0.00 0.31 0.00 0.00 61.69 61.86 2win s THR 122 Cb -0.03 -2.15 -0.05 0.00 0.01 0.00 0.00 72.50 70.28 2win s THR 122 CO 0.50 0.58 0.18 -0.69 -0.69 0.00 0.00 174.62 174.50 2win s VAL 123 N -0.48 5.30 -0.35 3.82 1.01 -0.06 -4.95 120.40 124.70 2win s VAL 123 Ca 0.06 0.17 -0.11 0.00 0.00 0.00 0.00 61.98 62.09 2win s VAL 123 Cb -0.12 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.76 2win s VAL 123 CO 0.02 0.27 0.21 -0.76 0.00 0.00 0.00 175.10 174.83 2win s LEU 124 N 1.60 4.52 -0.02 3.92 1.43 -1.26 -1.74 118.68 127.13 2win s LEU 124 Ca 0.07 -0.72 0.03 0.00 -1.03 0.00 0.00 54.13 52.48 2win s LEU 124 Cb -0.15 -2.05 -0.00 0.00 0.03 0.00 0.00 46.19 44.01 2win s LEU 124 CO 0.09 -0.30 -0.11 -0.72 0.23 0.00 0.00 176.35 175.55 2win s TYR 125 N 1.62 1.02 -0.02 0.29 -0.85 -0.89 -1.81 117.35 116.71 2win s TYR 125 Ca 0.04 -0.22 0.05 0.00 -0.52 0.00 0.00 57.07 56.42 2win s TYR 125 Cb -0.18 -0.68 -0.03 0.00 0.38 0.00 0.00 41.96 41.45 2win s TYR 125 CO 0.08 -0.05 -0.17 1.03 -1.52 0.00 0.00 175.55 174.91 2win s ARG 126 N -0.08 2.32 -0.26 -3.49 0.52 -0.17 -1.08 118.95 116.71 2win s ARG 126 Ca 0.01 -0.81 -0.04 0.00 -0.52 0.00 0.00 55.73 54.37 2win s ARG 126 Cb -0.06 -2.28 0.01 0.00 0.52 0.00 0.00 34.95 33.14 2win s ARG 126 CO 0.00 0.59 0.00 0.42 0.02 0.00 0.00 175.30 176.33 2win s ILE 127 N -0.78 3.45 -0.19 1.52 1.09 -0.67 -1.33 121.20 124.30 2win s ILE 127 Ca 0.12 -0.77 -0.21 0.00 -1.10 0.00 0.00 60.65 58.70 2win s ILE 127 Cb -0.10 -2.73 -0.03 0.00 -1.06 0.00 0.00 42.46 38.54 2win s ILE 127 CO 0.02 0.19 0.61 -0.36 -0.10 0.00 0.00 174.94 175.31 2win s PHE 128 N 1.43 3.39 -0.29 3.97 0.08 -0.29 -1.43 117.98 124.84 2win s PHE 128 Ca 0.02 0.93 -0.06 0.00 0.12 0.00 0.00 56.93 57.95 2win s PHE 128 Cb -0.16 -2.77 0.02 0.00 -0.57 0.00 0.00 43.02 39.53 2win s PHE 128 CO -0.01 -0.13 0.05 0.95 -0.10 0.00 0.00 175.22 175.98 2win s THR 129 N 1.75 3.69 0.16 0.64 -4.23 -1.01 -2.55 115.64 114.10 2win s THR 129 Ca 0.29 -0.83 -0.00 0.00 -1.18 0.00 0.00 61.69 59.96 2win s THR 129 Cb -0.16 -2.93 -0.04 0.00 1.34 0.00 0.00 72.50 70.71 2win s THR 129 CO 0.11 0.07 0.06 0.68 -0.54 0.00 0.00 174.62 175.00 2win s VAL 130 N 1.45 0.21 0.00 2.29 -7.23 -1.21 -2.40 120.40 113.51 2win s VAL 130 Ca 0.01 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 2win s VAL 130 Cb -0.17 -2.19 0.00 0.00 0.56 0.00 0.00 36.38 34.58 2win s VAL 130 CO 0.01 -0.35 0.00 -0.46 -0.31 0.00 0.00 175.10 173.99 2win n ASN 131 N -0.18 0.00 0.22 4.85 6.94 -0.56 -2.32 115.26 124.21 2win n ASN 131 Ca -0.04 -0.46 0.15 0.00 -0.02 0.00 0.00 54.58 54.22 2win n ASN 131 Cb 0.64 0.00 0.62 0.00 -2.36 0.00 0.00 39.78 38.68 2win n ASN 131 CO 0.00 0.00 0.00 0.45 -1.03 0.00 0.00 177.26 176.68 2win h HIS 132 N -0.16 0.00 -0.58 -2.53 3.86 -1.90 -1.69 115.15 112.15 2win h HIS 132 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2win h HIS 132 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2win h HIS 132 CO 0.00 0.00 0.00 1.63 0.86 0.00 0.00 177.93 180.42 2win n LYS 133 N -2.75 2.45 -0.89 2.45 5.02 -1.26 -4.91 118.16 118.28 2win n LYS 133 Ca 0.01 -2.12 0.00 0.00 -2.02 0.00 0.00 58.31 54.18 2win n LYS 133 Cb 0.27 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 2win n LYS 133 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2win n LEU 134 N 1.16 0.78 -4.77 -0.35 4.77 -0.63 -4.96 117.00 113.00 2win n LEU 134 Ca 0.20 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.78 2win n LEU 134 Cb 0.52 -1.81 -0.06 0.00 -2.33 0.00 0.00 43.42 39.75 2win n LEU 134 CO 0.14 -0.67 0.44 -0.76 -1.33 0.00 0.00 177.39 175.21 2win s LEU 135 N 0.00 4.51 0.65 2.23 1.43 -1.26 -4.72 118.68 121.53 2win s LEU 135 Ca 0.00 1.49 -0.17 0.00 -1.03 0.00 0.00 54.13 54.42 2win s LEU 135 Cb 0.00 -3.20 -0.05 0.00 0.03 0.00 0.00 46.19 42.97 2win s LEU 135 CO 0.00 0.13 0.69 -0.81 0.23 0.00 0.00 176.35 176.58 2win n PRO 136 N 2.20 0.52 -3.65 1.29 -0.04 -1.26 -1.49 135.00 132.57 2win n PRO 136 Ca -0.05 0.22 -0.15 0.00 -0.04 0.00 0.00 63.50 63.47 2win n PRO 136 Cb 0.50 -1.92 -0.07 0.00 -0.04 0.00 0.00 33.50 31.96 2win n PRO 136 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2win s VAL 137 N -1.75 0.03 -0.46 0.52 0.11 -1.01 -4.76 120.40 113.09 2win s VAL 137 Ca 0.70 -0.24 -0.17 0.00 -2.93 0.00 0.00 61.98 59.34 2win s VAL 137 Cb -0.39 -0.80 0.05 0.00 -1.53 0.00 0.00 36.38 33.71 2win s VAL 137 CO 0.53 -0.13 0.45 -0.83 -3.33 0.00 0.00 175.10 171.78 2win s GLY 138 N -1.24 1.94 0.32 6.54 0.00 -1.26 -4.50 107.32 109.12 2win s GLY 138 Ca -0.12 -1.81 0.05 0.00 0.00 0.00 0.00 44.72 42.84 2win s GLY 138 CO 0.07 1.16 0.20 0.50 0.00 0.00 0.00 173.10 175.03 2win s ARG 139 N 2.01 1.68 -0.24 2.90 1.81 -1.26 -4.79 118.95 121.06 2win s ARG 139 Ca 0.09 -1.97 -0.13 0.00 -1.72 0.00 0.00 55.73 52.00 2win s ARG 139 Cb -0.20 0.03 -0.04 0.00 -0.45 0.00 0.00 34.95 34.28 2win s ARG 139 CO 0.10 -0.53 0.27 0.99 -0.68 0.00 0.00 175.30 175.45 2win s THR 140 N -3.53 5.27 -0.08 0.02 2.01 -1.26 -1.72 115.64 116.35 2win s THR 140 Ca 0.36 0.41 0.03 0.00 0.31 0.00 0.00 61.69 62.80 2win s THR 140 Cb 0.04 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.92 2win s THR 140 CO 0.21 0.28 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.56 2win s VAL 141 N 1.36 2.86 -0.28 3.82 1.01 -0.65 -0.96 120.40 127.56 2win s VAL 141 Ca 0.12 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 2win s VAL 141 Cb -0.14 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2win s VAL 141 CO 0.07 0.57 0.10 -0.04 0.00 0.00 0.00 175.10 175.80 2win s MET 142 N -0.28 3.47 -0.16 2.72 -1.94 -0.27 -3.00 119.30 119.84 2win s MET 142 Ca 0.02 -0.61 0.00 0.00 -1.71 0.00 0.00 55.69 53.39 2win s MET 142 Cb -0.13 -3.41 -0.00 0.00 2.01 0.00 0.00 34.83 33.30 2win s MET 142 CO 0.03 -0.30 -0.15 0.08 -0.01 0.00 0.00 175.02 174.67 2win s VAL 143 N 1.60 2.72 0.27 -6.03 1.01 -0.96 -1.74 120.40 117.27 2win s VAL 143 Ca 0.05 -0.75 0.11 0.00 0.00 0.00 0.00 61.98 61.39 2win s VAL 143 Cb -0.16 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2win s VAL 143 CO 0.04 0.51 -0.18 0.20 0.00 0.00 0.00 175.10 175.67 2win s ASN 144 N 0.81 3.42 -0.16 3.32 0.02 0.91 -0.48 114.94 122.79 2win s ASN 144 Ca -0.05 -1.04 -0.01 0.00 -1.02 0.00 0.00 52.86 50.74 2win s ASN 144 Cb -0.15 -0.27 0.05 0.00 0.02 0.00 0.00 41.25 40.89 2win s ASN 144 CO 0.00 -0.01 -0.01 -0.63 0.02 0.00 0.00 177.10 176.47 2win s ILE 145 N -2.60 0.78 0.06 0.60 1.01 -0.54 -1.15 121.20 119.36 2win s ILE 145 Ca 0.29 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.46 2win s ILE 145 Cb -0.04 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2win s ILE 145 CO 0.14 0.02 0.14 -1.61 0.00 0.00 0.00 174.94 173.63 2win s GLU 146 N 1.77 3.18 0.75 2.79 2.02 -0.18 -0.90 118.70 128.13 2win s GLU 146 Ca 0.01 -0.53 -0.07 0.00 0.02 0.00 0.00 54.97 54.39 2win s GLU 146 Cb -0.16 -2.90 0.10 0.00 0.10 0.00 0.00 34.13 31.27 2win s GLU 146 CO -0.07 0.60 1.05 0.54 0.02 0.00 0.00 175.26 177.40 2win s ASN 147 N -2.34 4.43 0.44 -0.19 2.20 -0.95 -2.27 114.94 116.25 2win s ASN 147 Ca 0.31 0.23 0.25 0.00 -0.94 0.00 0.00 52.86 52.71 2win s ASN 147 Cb -0.13 -0.72 1.28 0.00 -2.00 0.00 0.00 41.25 39.68 2win s ASN 147 CO 0.24 -1.84 1.74 -0.65 -2.94 0.00 0.00 177.10 173.65 2win h PRO 148 N -0.74 0.23 -0.84 3.55 0.11 -1.87 0.28 132.00 132.71 2win h PRO 148 Ca -0.43 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.58 2win h PRO 148 Cb 1.29 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 2win h PRO 148 CO 0.52 0.15 0.12 -0.85 -0.21 0.00 0.00 178.00 177.73 2win n GLU 149 N -4.54 2.68 -3.42 1.05 0.28 -1.26 -4.91 120.64 110.52 2win n GLU 149 Ca 0.29 -1.71 -0.20 0.00 -0.16 0.00 0.00 57.16 55.38 2win n GLU 149 Cb 1.11 -1.84 0.06 0.00 1.43 0.00 0.00 31.44 32.20 2win n GLU 149 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2win n GLY 150 N 0.10 -0.93 2.74 -1.84 0.00 0.97 -5.01 105.19 101.22 2win n GLY 150 Ca 0.21 0.44 -0.28 0.00 0.00 0.00 0.00 46.02 46.39 2win n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2win s ILE 151 N -3.43 0.59 0.30 -0.61 -1.09 -1.25 -4.87 121.20 110.84 2win s ILE 151 Ca 0.35 -0.68 -0.29 0.00 -2.23 0.00 0.00 60.65 57.80 2win s ILE 151 Cb -0.07 -1.13 -0.13 0.00 -1.58 0.00 0.00 42.46 39.55 2win s ILE 151 CO 0.77 -0.26 1.37 -2.65 -1.23 0.00 0.00 174.94 172.94 2win n PRO 152 N 5.02 2.19 0.00 2.79 -0.02 -1.26 -2.25 135.00 141.46 2win n PRO 152 Ca -0.08 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2win n PRO 152 Cb 0.46 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 2win n PRO 152 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2win n VAL 153 N 1.06 0.00 -3.87 -1.45 0.24 -0.08 -4.95 118.33 109.28 2win n VAL 153 Ca 0.07 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.23 2win n VAL 153 Cb 0.35 -0.89 -0.15 0.00 -1.47 0.00 0.00 33.84 31.68 2win n VAL 153 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2win s LYS 154 N -1.90 0.07 -0.04 7.34 2.20 -1.25 -5.02 119.74 121.15 2win s LYS 154 Ca 0.00 0.06 0.00 0.00 -0.36 0.00 0.00 55.97 55.67 2win s LYS 154 Cb 0.00 -0.20 0.03 0.00 -1.51 0.00 0.00 37.83 36.15 2win s LYS 154 CO 0.00 -0.07 -0.01 1.14 -0.36 0.00 0.00 175.35 176.05 2win s GLN 155 N 0.51 0.46 0.41 4.03 0.00 -1.26 -1.47 119.66 122.34 2win s GLN 155 Ca -0.04 0.04 0.07 0.00 -0.00 0.00 0.00 55.36 55.43 2win s GLN 155 Cb -0.07 -0.63 -0.06 0.00 0.00 0.00 0.00 33.01 32.25 2win s GLN 155 CO -0.01 -0.14 0.11 -0.51 0.00 0.00 0.00 175.29 174.73 2win s ASP 156 N 1.12 4.21 -0.43 12.60 1.01 0.37 -4.98 116.67 130.58 2win s ASP 156 Ca -0.08 -1.18 0.07 0.00 0.71 0.00 0.00 52.55 52.07 2win s ASP 156 Cb -0.14 -0.45 0.24 0.00 1.01 0.00 0.00 42.92 43.58 2win s ASP 156 CO -0.02 -0.49 0.68 -0.24 0.21 0.00 0.00 175.17 175.31 2win n SER 157 N -1.13 -1.15 -4.98 0.27 2.88 -1.26 -2.26 113.62 105.99 2win n SER 157 Ca -0.03 -2.95 -0.20 0.00 -1.33 0.00 0.00 58.87 54.36 2win n SER 157 Cb 0.65 0.42 0.01 0.00 -0.75 0.00 0.00 64.21 64.54 2win n SER 157 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2win s LEU 158 N -0.95 3.67 -0.04 2.46 2.96 -1.16 -4.89 118.68 120.73 2win s LEU 158 Ca 0.34 -0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.25 2win s LEU 158 Cb 0.19 -2.88 -0.01 0.00 0.50 0.00 0.00 46.19 43.99 2win s LEU 158 CO -0.17 -0.72 -0.20 -0.55 -1.32 0.00 0.00 176.35 173.39 2win s SER 159 N -4.27 2.48 -0.03 3.68 0.15 -1.26 -1.64 113.70 112.80 2win s SER 159 Ca 0.50 -0.40 0.02 0.00 0.70 0.00 0.00 55.95 56.77 2win s SER 159 Cb -0.10 -0.54 0.11 0.00 -1.71 0.00 0.00 66.02 63.78 2win s SER 159 CO 0.35 0.21 0.68 -1.54 1.20 0.00 0.00 173.24 174.14 2win n SER 160 N 2.90 1.69 -4.66 5.45 3.41 -0.70 -4.85 113.62 116.86 2win n SER 160 Ca -0.17 -2.13 -0.42 0.00 -0.26 0.00 0.00 58.87 55.89 2win n SER 160 Cb 0.53 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2win n SER 160 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2win s GLN 161 N -1.23 4.10 -1.95 4.33 2.00 -1.26 -2.00 119.66 123.64 2win s GLN 161 Ca 0.08 2.38 0.00 0.00 -2.00 0.00 0.00 55.36 55.82 2win s GLN 161 Cb 0.06 -4.10 0.00 0.00 0.80 0.00 0.00 33.01 29.77 2win s GLN 161 CO 0.02 -0.98 0.00 0.09 -0.50 0.00 0.00 175.29 173.93 2win n ASN 162 N 7.60 -5.48 -0.59 6.67 5.03 -1.26 -4.82 115.26 122.41 2win n ASN 162 Ca 0.19 0.28 0.06 0.00 0.87 0.00 0.00 54.58 55.99 2win n ASN 162 Cb 0.42 -4.73 0.10 0.00 -1.02 0.00 0.00 39.78 34.55 2win n ASN 162 CO 0.00 0.00 0.00 1.67 -1.83 0.00 0.00 177.26 177.10 2win n GLN 163 N -2.62 1.60 -3.13 3.52 -0.06 -0.85 -4.98 117.38 110.86 2win n GLN 163 Ca -0.22 -1.60 -0.20 0.00 -2.00 0.00 0.00 57.00 52.99 2win n GLN 163 Cb 0.67 -1.26 0.05 0.00 -4.06 0.00 0.00 30.24 25.63 2win n GLN 163 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 2win n LEU 164 N 0.67 -2.81 -2.77 1.69 7.94 -1.26 -3.16 117.00 117.30 2win n LEU 164 Ca 0.10 -0.34 -0.20 0.00 -1.11 0.00 0.00 56.01 54.46 2win n LEU 164 Cb 0.37 -2.63 0.04 0.00 0.53 0.00 0.00 43.42 41.72 2win n LEU 164 CO 0.08 0.35 0.02 0.61 -1.11 0.00 0.00 177.39 177.34 2win n GLY 165 N -1.57 -0.40 2.65 -3.96 0.00 -1.26 -4.92 105.19 95.72 2win n GLY 165 Ca -0.05 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2win n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2win s VAL 166 N -3.13 -0.11 -0.57 1.61 1.01 -1.19 -2.40 120.40 115.62 2win s VAL 166 Ca 0.29 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.39 2win s VAL 166 Cb -0.13 -0.35 0.15 0.00 0.00 0.00 0.00 36.38 36.05 2win s VAL 166 CO 0.36 -0.03 0.39 -0.76 0.00 0.00 0.00 175.10 175.06 2win s LEU 167 N 2.16 5.34 0.08 3.92 1.43 -0.52 -4.91 118.68 126.17 2win s LEU 167 Ca 0.04 -2.58 -0.31 0.00 -1.03 0.00 0.00 54.13 50.25 2win s LEU 167 Cb -0.14 -1.87 -0.07 0.00 0.03 0.00 0.00 46.19 44.14 2win s LEU 167 CO -0.06 -0.44 1.39 -2.84 0.23 0.00 0.00 176.35 174.63 2win s PRO 168 N 0.34 4.31 0.21 1.29 0.02 -1.26 -1.66 135.00 138.24 2win s PRO 168 Ca 0.14 2.04 -0.02 0.00 0.02 0.00 0.00 61.00 63.18 2win s PRO 168 Cb -0.21 -3.36 -0.04 0.00 0.02 0.00 0.00 34.50 30.91 2win s PRO 168 CO -0.04 -0.48 0.17 -0.51 -0.33 0.00 0.00 177.00 175.81 2win s LEU 169 N 1.54 1.10 -0.09 -5.54 1.43 -0.24 -5.00 118.68 111.87 2win s LEU 169 Ca 0.64 -1.36 -0.30 0.00 -1.03 0.00 0.00 54.13 52.08 2win s LEU 169 Cb -0.35 0.52 0.08 0.00 0.03 0.00 0.00 46.19 46.46 2win s LEU 169 CO 0.29 -0.88 0.72 -0.94 0.23 0.00 0.00 176.35 175.78 2win s SER 170 N -3.16 -0.64 -0.12 2.29 1.04 -1.26 -2.09 113.70 109.77 2win s SER 170 Ca 0.38 0.78 -0.07 0.00 0.48 0.00 0.00 55.95 57.52 2win s SER 170 Cb 0.06 0.64 0.04 0.00 0.10 0.00 0.00 66.02 66.87 2win s SER 170 CO 0.12 -0.53 0.28 0.86 0.98 0.00 0.00 173.24 174.96 2win s TRP 171 N -0.96 -0.37 -0.14 5.02 -0.00 -0.71 -4.98 118.94 116.81 2win s TRP 171 Ca -0.08 0.86 -0.21 0.00 -0.00 0.00 0.00 56.10 56.67 2win s TRP 171 Cb -0.01 0.10 -0.03 0.00 -0.00 0.00 0.00 33.47 33.53 2win s TRP 171 CO 0.08 -0.23 0.62 -0.51 -0.00 0.00 0.00 176.95 176.91 2win s ASP 172 N 1.01 6.78 -0.29 5.86 1.11 -1.26 -0.88 116.67 129.00 2win s ASP 172 Ca -0.07 0.94 -0.25 0.00 0.18 0.00 0.00 52.55 53.36 2win s ASP 172 Cb -0.08 -2.36 0.00 0.00 1.07 0.00 0.00 42.92 41.56 2win s ASP 172 CO -0.07 -0.17 0.85 -0.63 1.18 0.00 0.00 175.17 176.33 2win s ILE 173 N 1.29 4.75 0.62 0.77 1.01 -0.50 -5.00 121.20 124.15 2win s ILE 173 Ca 0.31 1.38 -0.19 0.00 0.00 0.00 0.00 60.65 62.15 2win s ILE 173 Cb -0.16 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.10 2win s ILE 173 CO 0.13 -0.25 1.27 -2.84 0.00 0.00 0.00 174.94 173.25 2win s PRO 174 N 3.05 2.75 0.18 2.79 0.02 -1.26 -0.88 135.00 141.66 2win s PRO 174 Ca 0.35 2.00 -0.13 0.00 0.02 0.00 0.00 61.00 63.24 2win s PRO 174 Cb -0.14 -1.91 0.08 0.00 0.02 0.00 0.00 34.50 32.55 2win s PRO 174 CO 0.12 -1.43 1.84 0.93 -0.33 0.00 0.00 177.00 178.13 2win h GLU 175 N 0.75 0.76 -5.75 5.54 4.39 -1.93 -3.37 114.58 114.97 2win h GLU 175 Ca -0.51 -0.05 -0.61 0.00 0.34 0.00 0.00 59.36 58.53 2win h GLU 175 Cb 1.32 -0.17 -0.12 0.00 -0.10 0.00 0.00 28.75 29.68 2win h GLU 175 CO 0.54 0.51 0.95 -0.51 -1.16 0.00 0.00 179.01 179.34 2win s LEU 176 N -10.14 4.00 -0.06 1.33 1.43 -1.26 -4.86 118.68 109.12 2win s LEU 176 Ca -0.13 -1.17 -0.29 0.00 -1.03 0.00 0.00 54.13 51.51 2win s LEU 176 Cb 0.13 -2.49 0.10 0.00 0.03 0.00 0.00 46.19 43.96 2win s LEU 176 CO 0.75 -1.49 0.82 0.54 0.23 0.00 0.00 176.35 177.21 2win s VAL 177 N 4.43 0.00 0.15 -1.59 0.11 -1.26 -5.15 120.40 117.09 2win s VAL 177 Ca 0.33 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.08 2win s VAL 177 Cb -0.08 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.69 2win s VAL 177 CO 0.03 0.00 1.23 0.20 -3.33 0.00 0.00 175.10 173.23 2win s ASN 178 N -1.53 7.03 0.54 3.54 0.01 -1.26 -5.03 114.94 118.24 2win s ASN 178 Ca -0.04 2.21 -0.09 0.00 -0.71 0.00 0.00 52.86 54.24 2win s ASN 178 Cb -0.00 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 2win s ASN 178 CO 0.02 -0.44 0.90 -0.04 -1.51 0.00 0.00 177.10 176.03 2win s MET 179 N 0.22 3.62 0.00 -0.60 -1.94 -1.26 -4.83 119.30 114.50 2win s MET 179 Ca 0.56 0.52 0.00 0.00 -1.71 0.00 0.00 55.69 55.05 2win s MET 179 Cb -0.33 -2.23 0.00 0.00 2.01 0.00 0.00 34.83 34.28 2win s MET 179 CO 0.34 -0.35 0.00 0.41 -0.01 0.00 0.00 175.02 175.41 2win n GLY 180 N -2.34 0.42 3.45 -0.03 0.00 -0.52 -4.93 105.19 101.25 2win n GLY 180 Ca 0.03 -1.26 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 2win n GLY 180 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2win s GLN 181 N -2.00 3.35 0.24 1.61 -1.52 -1.26 -1.04 119.66 119.04 2win s GLN 181 Ca 0.00 -0.71 0.02 0.00 -1.95 0.00 0.00 55.36 52.72 2win s GLN 181 Cb 0.00 -3.60 -0.03 0.00 -0.22 0.00 0.00 33.01 29.15 2win s GLN 181 CO 0.00 -0.43 0.40 -1.58 -0.25 0.00 0.00 175.29 173.44 2win s TRP 182 N 1.63 3.48 -0.00 0.91 0.52 -0.73 -3.30 118.94 121.43 2win s TRP 182 Ca 0.05 0.18 0.01 0.00 0.02 0.00 0.00 56.10 56.36 2win s TRP 182 Cb -0.17 -1.73 -0.00 0.00 -1.15 0.00 0.00 33.47 30.41 2win s TRP 182 CO 0.07 0.36 -0.04 0.21 0.02 0.00 0.00 176.95 177.56 2win s LYS 183 N -3.79 0.36 -0.26 4.98 2.20 -0.96 -1.24 119.74 121.03 2win s LYS 183 Ca 0.37 -0.16 -0.01 0.00 -0.36 0.00 0.00 55.97 55.80 2win s LYS 183 Cb -0.10 -0.35 0.03 0.00 -1.51 0.00 0.00 37.83 35.90 2win s LYS 183 CO 0.31 0.10 -0.05 0.42 -0.36 0.00 0.00 175.35 175.76 2win s ILE 184 N -0.10 2.84 -0.19 5.43 1.01 -0.44 -1.01 121.20 128.74 2win s ILE 184 Ca 0.02 -1.16 -0.04 0.00 0.00 0.00 0.00 60.65 59.47 2win s ILE 184 Cb -0.02 -2.51 -0.02 0.00 0.01 0.00 0.00 42.46 39.93 2win s ILE 184 CO -0.00 0.11 -0.04 -0.13 0.00 0.00 0.00 174.94 174.87 2win s ARG 185 N 1.29 3.53 0.13 2.79 0.52 -0.30 -1.93 118.95 124.97 2win s ARG 185 Ca -0.02 -0.58 0.06 0.00 -0.52 0.00 0.00 55.73 54.68 2win s ARG 185 Cb -0.18 -2.95 -0.04 0.00 0.52 0.00 0.00 34.95 32.30 2win s ARG 185 CO -0.04 0.03 -0.15 0.00 0.02 0.00 0.00 175.30 175.17 2win s ALA 186 N 0.90 1.60 -0.14 2.13 0.00 0.19 -0.07 121.76 126.37 2win s ALA 186 Ca -0.00 -1.32 -0.29 0.00 0.00 0.00 0.00 51.96 50.35 2win s ALA 186 Cb -0.15 -0.11 0.09 0.00 0.00 0.00 0.00 23.12 22.96 2win s ALA 186 CO 0.01 0.14 0.82 1.52 0.00 0.00 0.00 175.76 178.25 2win s TYR 187 N -2.04 -0.57 0.44 0.00 -0.85 -0.71 -0.82 117.35 112.79 2win s TYR 187 Ca 0.10 1.09 -0.25 0.00 -0.52 0.00 0.00 57.07 57.49 2win s TYR 187 Cb -0.05 0.40 -0.08 0.00 0.38 0.00 0.00 41.96 42.60 2win s TYR 187 CO 0.04 -0.46 1.32 0.71 -1.52 0.00 0.00 175.55 175.64 2win s TYR 188 N -0.81 2.67 0.44 -3.49 1.51 -1.26 -1.12 117.35 115.29 2win s TYR 188 Ca -0.05 1.39 0.35 0.00 -1.01 0.00 0.00 57.07 57.74 2win s TYR 188 Cb -0.01 -3.71 1.81 0.00 -0.11 0.00 0.00 41.96 39.93 2win s TYR 188 CO 0.05 -2.33 2.17 1.49 -1.11 0.00 0.00 175.55 175.82 2win h GLU 189 N 2.35 0.00 -0.49 -0.62 4.81 -1.41 -2.05 114.58 117.17 2win h GLU 189 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2win h GLU 189 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2win h GLU 189 CO 0.61 0.04 0.00 0.09 -0.73 0.00 0.00 179.01 179.02 2win n ASN 190 N -3.33 2.64 -2.74 1.04 3.02 -1.26 -4.51 115.26 110.13 2win n ASN 190 Ca -0.02 -2.04 -0.06 0.00 -0.03 0.00 0.00 54.58 52.43 2win n ASN 190 Cb 0.18 -0.34 0.04 0.00 -0.61 0.00 0.00 39.78 39.06 2win n ASN 190 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2win n SER 191 N 0.86 -2.84 0.28 6.41 3.41 -0.77 -4.94 113.62 116.03 2win n SER 191 Ca 0.16 -2.89 0.13 0.00 -0.26 0.00 0.00 58.87 56.01 2win n SER 191 Cb 0.43 1.63 0.82 0.00 -0.26 0.00 0.00 64.21 66.84 2win n SER 191 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2win h PRO 192 N 4.25 0.00 -0.12 4.33 0.13 -1.79 -2.69 132.00 136.11 2win h PRO 192 Ca -0.08 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.92 2win h PRO 192 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2win h PRO 192 CO 0.15 0.04 -0.47 -0.56 -0.23 0.00 0.00 178.00 176.93 2win h GLN 193 N 0.00 0.30 -5.29 0.86 -0.00 -1.95 -3.40 115.11 105.63 2win h GLN 193 Ca -0.00 -0.16 -0.66 0.00 -0.00 0.00 0.00 58.65 57.83 2win h GLN 193 Cb 0.10 0.01 -0.16 0.00 -0.00 0.00 0.00 27.48 27.43 2win h GLN 193 CO 0.01 0.71 0.13 -1.14 -0.00 0.00 0.00 178.83 178.53 2win s GLN 194 N -4.04 3.23 -0.05 0.06 0.74 -1.02 -5.04 119.66 113.54 2win s GLN 194 Ca -0.05 -0.53 0.06 0.00 0.05 0.00 0.00 55.36 54.89 2win s GLN 194 Cb 0.13 -4.00 -0.01 0.00 1.10 0.00 0.00 33.01 30.22 2win s GLN 194 CO 0.79 -1.11 -0.24 0.08 -0.55 0.00 0.00 175.29 174.26 2win s VAL 195 N 2.83 1.97 -0.03 1.34 1.01 -1.26 -4.48 120.40 121.79 2win s VAL 195 Ca 0.21 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2win s VAL 195 Cb -0.16 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2win s VAL 195 CO 0.17 0.55 -0.01 -0.36 0.00 0.00 0.00 175.10 175.44 2win s PHE 196 N -0.18 3.06 0.02 5.22 0.40 -0.00 -4.97 117.98 121.53 2win s PHE 196 Ca -0.02 0.09 -0.01 0.00 -0.60 0.00 0.00 56.93 56.38 2win s PHE 196 Cb -0.13 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.69 2win s PHE 196 CO 0.03 0.44 -0.00 -1.12 0.70 0.00 0.00 175.22 175.27 2win s SER 197 N -1.31 0.19 -0.03 1.36 0.01 -1.26 -0.63 113.70 112.02 2win s SER 197 Ca 0.17 -0.41 -0.01 0.00 1.31 0.00 0.00 55.95 57.02 2win s SER 197 Cb -0.11 0.11 0.03 0.00 0.21 0.00 0.00 66.02 66.25 2win s SER 197 CO 0.07 -0.28 0.05 -0.89 0.41 0.00 0.00 173.24 172.60 2win s THR 198 N -1.30 -0.05 0.00 1.44 2.01 -0.81 -4.97 115.64 111.96 2win s THR 198 Ca -0.14 0.19 -0.05 0.00 0.31 0.00 0.00 61.69 62.00 2win s THR 198 Cb -0.09 -0.11 -0.04 0.00 0.01 0.00 0.00 72.50 72.27 2win s THR 198 CO -0.01 0.08 0.23 -1.61 -0.69 0.00 0.00 174.62 172.62 2win s GLU 199 N 0.97 3.52 -0.03 4.92 2.02 -1.26 -1.32 118.70 127.52 2win s GLU 199 Ca -0.08 -0.18 -0.00 0.00 0.02 0.00 0.00 54.97 54.73 2win s GLU 199 Cb -0.11 -3.08 0.03 0.00 0.10 0.00 0.00 34.13 31.07 2win s GLU 199 CO -0.03 0.65 0.02 -0.59 0.02 0.00 0.00 175.26 175.33 2win s PHE 200 N -1.32 0.18 0.24 1.61 -0.12 -0.38 -4.86 117.98 113.34 2win s PHE 200 Ca 0.28 0.07 -0.30 0.00 -0.05 0.00 0.00 56.93 56.93 2win s PHE 200 Cb -0.13 -0.36 -0.09 0.00 -0.63 0.00 0.00 43.02 41.81 2win s PHE 200 CO 0.17 -0.13 0.94 -2.00 -0.05 0.00 0.00 175.22 174.16 2win s GLU 201 N 1.19 4.85 -0.21 1.99 2.12 -0.91 -1.78 118.70 125.95 2win s GLU 201 Ca -0.07 1.48 -0.02 0.00 0.36 0.00 0.00 54.97 56.72 2win s GLU 201 Cb -0.13 -3.27 0.00 0.00 0.26 0.00 0.00 34.13 31.00 2win s GLU 201 CO -0.02 0.51 -0.09 0.08 -0.54 0.00 0.00 175.26 175.20 2win s VAL 202 N -1.19 2.92 -0.07 3.70 1.01 -0.20 -0.39 120.40 126.18 2win s VAL 202 Ca 0.41 -0.69 -0.24 0.00 0.00 0.00 0.00 61.98 61.46 2win s VAL 202 Cb -0.26 -2.33 0.05 0.00 0.00 0.00 0.00 36.38 33.85 2win s VAL 202 CO 0.32 0.43 0.56 -0.75 0.00 0.00 0.00 175.10 175.65 2win s LYS 203 N 1.40 0.88 -0.85 2.72 2.20 -0.34 -1.44 119.74 124.32 2win s LYS 203 Ca 0.05 0.22 -0.25 0.00 -0.36 0.00 0.00 55.97 55.63 2win s LYS 203 Cb -0.14 0.41 0.04 0.00 -1.51 0.00 0.00 37.83 36.63 2win s LYS 203 CO -0.06 -0.24 1.37 -1.21 -0.36 0.00 0.00 175.35 174.85 2win s GLU 204 N -0.97 3.32 0.46 4.03 2.02 -1.26 -4.10 118.70 122.20 2win s GLU 204 Ca -0.10 -0.57 0.03 0.00 0.02 0.00 0.00 54.97 54.35 2win s GLU 204 Cb -0.02 -4.67 -0.02 0.00 0.10 0.00 0.00 34.13 29.52 2win s GLU 204 CO 0.07 -2.21 0.07 1.52 0.02 0.00 0.00 175.26 174.73 2win s TYR 205 N 5.59 1.83 -0.13 1.61 -0.85 -1.26 -5.14 117.35 119.00 2win s TYR 205 Ca 0.41 -1.12 -0.05 0.00 -0.52 0.00 0.00 57.07 55.78 2win s TYR 205 Cb -0.05 -1.38 0.06 0.00 0.38 0.00 0.00 41.96 40.97 2win s TYR 205 CO 0.05 -0.04 0.27 0.14 -1.52 0.00 0.00 175.55 174.45 2win s VAL 206 N -3.04 -0.31 -0.09 -3.49 -7.23 -1.26 -5.05 120.40 99.93 2win s VAL 206 Ca 0.15 0.23 -0.33 0.00 -1.81 0.00 0.00 61.98 60.23 2win s VAL 206 Cb 0.02 -0.44 -0.10 0.00 0.56 0.00 0.00 36.38 36.41 2win s VAL 206 CO 0.09 0.10 1.96 0.18 -0.31 0.00 0.00 175.10 177.12 2win n LEU 207 N 5.02 3.55 0.00 1.32 4.32 -1.26 -4.98 117.00 124.98 2win n LEU 207 Ca -0.12 0.84 0.00 0.00 -0.02 0.00 0.00 56.01 56.71 2win n LEU 207 Cb 0.51 -1.42 0.00 0.00 -1.62 0.00 0.00 43.42 40.88 2win n LEU 207 CO 0.06 -0.09 0.00 -0.81 -1.22 0.00 0.00 177.39 175.33 2win n PRO 208 N 7.21 -1.32 0.00 3.23 -0.04 -1.26 -5.01 135.00 137.81 2win n PRO 208 Ca 0.24 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2win n PRO 208 Cb 0.34 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.80 2win n PRO 208 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2win n SER 209 N -2.60 0.90 -3.51 3.54 3.41 -1.26 -4.91 113.62 109.19 2win n SER 209 Ca 0.00 -1.21 -0.16 0.00 -0.26 0.00 0.00 58.87 57.23 2win n SER 209 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 2win n SER 209 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2win s PHE 210 N -0.21 -0.61 0.18 7.33 -0.12 -1.26 -1.92 117.98 121.36 2win s PHE 210 Ca 0.00 0.91 0.05 0.00 -0.05 0.00 0.00 56.93 57.84 2win s PHE 210 Cb 0.00 0.43 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 2win s PHE 210 CO 0.00 -0.66 0.18 -1.83 -0.05 0.00 0.00 175.22 172.87 2win s GLU 211 N -1.78 3.02 -0.11 1.99 -1.05 -0.22 -4.89 118.70 115.67 2win s GLU 211 Ca -0.08 -0.85 0.01 0.00 -0.15 0.00 0.00 54.97 53.90 2win s GLU 211 Cb -0.00 -2.70 0.02 0.00 -0.44 0.00 0.00 34.13 31.01 2win s GLU 211 CO 0.05 0.48 -0.13 0.08 0.95 0.00 0.00 175.26 176.68 2win s VAL 212 N -1.82 1.36 -0.10 1.83 1.01 -1.26 -2.36 120.40 119.06 2win s VAL 212 Ca 0.32 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.76 2win s VAL 212 Cb -0.10 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 2win s VAL 212 CO 0.25 0.41 -0.12 -0.63 0.00 0.00 0.00 175.10 175.01 2win s ILE 213 N 1.10 3.19 -0.34 2.22 1.01 0.15 -4.78 121.20 123.74 2win s ILE 213 Ca -0.05 -0.64 0.02 0.00 0.00 0.00 0.00 60.65 59.98 2win s ILE 213 Cb -0.14 -2.31 0.10 0.00 0.01 0.00 0.00 42.46 40.11 2win s ILE 213 CO -0.03 0.55 0.06 0.68 0.00 0.00 0.00 174.94 176.21 2win s VAL 214 N -0.11 2.49 -0.28 2.92 -7.23 -1.26 -0.81 120.40 116.11 2win s VAL 214 Ca -0.01 -2.19 0.01 0.00 -1.81 0.00 0.00 61.98 57.99 2win s VAL 214 Cb -0.14 -2.76 0.06 0.00 0.56 0.00 0.00 36.38 34.10 2win s VAL 214 CO 0.03 -0.54 -0.06 -1.61 -0.31 0.00 0.00 175.10 172.61 2win s GLU 215 N 0.98 2.32 0.38 4.82 2.02 -0.78 -4.75 118.70 123.69 2win s GLU 215 Ca 0.08 -1.31 -0.26 0.00 0.02 0.00 0.00 54.97 53.49 2win s GLU 215 Cb -0.20 -3.01 -0.09 0.00 0.10 0.00 0.00 34.13 30.93 2win s GLU 215 CO -0.07 -0.59 1.21 -2.14 0.02 0.00 0.00 175.26 173.69 2win s PRO 216 N 1.16 4.15 0.24 0.39 0.02 -1.26 -1.57 135.00 138.14 2win s PRO 216 Ca -0.07 1.96 -0.05 0.00 0.02 0.00 0.00 61.00 62.85 2win s PRO 216 Cb -0.20 -2.81 0.44 0.00 0.02 0.00 0.00 34.50 31.95 2win s PRO 216 CO -0.03 -0.27 1.70 1.79 -0.33 0.00 0.00 177.00 179.85 2win h THR 217 N 2.55 0.56 -3.48 0.99 1.35 -1.63 -3.39 112.91 109.85 2win h THR 217 Ca -0.49 -0.11 -0.67 0.00 -0.55 0.00 0.00 66.41 64.60 2win h THR 217 Cb 1.23 0.23 -0.15 0.00 -1.73 0.00 0.00 68.15 67.73 2win h THR 217 CO 0.63 0.06 -0.67 -1.61 -0.25 0.00 0.00 175.52 173.68 2win s GLU 218 N -6.05 2.67 0.00 4.72 0.41 -1.26 -4.99 118.70 114.21 2win s GLU 218 Ca -0.13 -0.67 0.00 0.00 -0.41 0.00 0.00 54.97 53.77 2win s GLU 218 Cb 0.21 -2.59 0.00 0.00 -1.78 0.00 0.00 34.13 29.97 2win s GLU 218 CO 0.76 0.61 0.89 1.63 -0.49 0.00 0.00 175.26 178.66 2win n LYS 219 N 1.48 0.89 -1.62 1.61 5.02 -1.26 -4.77 118.16 119.51 2win n LYS 219 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 2win n LYS 219 Cb 0.53 -1.06 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 2win n LYS 219 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 2win n PHE 220 N 0.54 -0.36 -3.72 2.13 1.16 -1.26 -4.36 117.46 111.60 2win n PHE 220 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.44 2win n PHE 220 Cb 0.44 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 38.17 2win n PHE 220 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 2win s TYR 221 N -4.53 -0.25 -0.22 2.97 5.04 -0.15 -4.89 117.35 115.31 2win s TYR 221 Ca 0.00 0.66 -0.23 0.00 -2.44 0.00 0.00 57.07 55.05 2win s TYR 221 Cb 0.00 -0.07 -0.01 0.00 0.35 0.00 0.00 41.96 42.23 2win s TYR 221 CO 0.00 -0.23 0.76 -0.47 -1.34 0.00 0.00 175.55 174.27 2win s TYR 222 N 1.55 3.34 0.44 4.97 5.04 -1.26 -2.99 117.35 128.44 2win s TYR 222 Ca -0.06 1.08 0.13 0.00 -2.44 0.00 0.00 57.07 55.78 2win s TYR 222 Cb -0.11 -2.96 1.03 0.00 0.35 0.00 0.00 41.96 40.26 2win s TYR 222 CO -0.07 -0.31 2.02 0.82 -1.34 0.00 0.00 175.55 176.67 2win h ILE 223 N 5.33 0.96 -0.56 3.14 5.03 -1.94 -0.55 117.51 128.91 2win h ILE 223 Ca -0.27 -0.13 -0.14 0.00 -0.12 0.00 0.00 64.86 64.20 2win h ILE 223 Cb 1.12 0.54 -0.09 0.00 -3.03 0.00 0.00 36.82 35.36 2win h ILE 223 CO 0.83 0.07 0.18 -1.22 -0.68 0.00 0.00 178.15 177.33 2win n TYR 224 N -4.47 1.89 -3.09 1.37 4.01 -1.26 -4.87 117.16 110.75 2win n TYR 224 Ca 0.06 -0.91 -0.43 0.00 -0.16 0.00 0.00 57.90 56.46 2win n TYR 224 Cb 0.26 -0.55 -0.06 0.00 -0.31 0.00 0.00 39.34 38.67 2win n TYR 224 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2win s ASN 225 N -0.66 6.32 0.17 7.72 3.84 -0.22 -4.94 114.94 127.17 2win s ASN 225 Ca 0.43 -0.37 -0.14 0.00 0.21 0.00 0.00 52.86 52.99 2win s ASN 225 Cb 0.34 -2.33 0.06 0.00 -0.55 0.00 0.00 41.25 38.77 2win s ASN 225 CO 0.11 -0.83 1.80 -0.33 -2.79 0.00 0.00 177.10 175.06 2win h GLU 226 N 8.92 0.71 -0.73 0.43 5.08 -1.89 -2.99 114.58 124.10 2win h GLU 226 Ca -0.26 -0.07 0.13 0.00 -1.00 0.00 0.00 59.36 58.17 2win h GLU 226 Cb 1.09 -0.15 -0.09 0.00 0.50 0.00 0.00 28.75 30.11 2win h GLU 226 CO 0.92 0.52 0.29 0.87 -1.00 0.00 0.00 179.01 180.60 2win h LYS 227 N 0.70 0.43 0.00 2.33 1.57 -1.97 -3.40 116.57 116.22 2win h LYS 227 Ca 0.19 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2win h LYS 227 Cb -0.01 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2win h LYS 227 CO -0.03 0.28 0.00 0.41 -0.57 0.00 0.00 179.45 179.54 2win n GLY 228 N -1.32 -3.25 3.57 3.86 0.00 -1.13 -4.64 105.19 102.27 2win n GLY 228 Ca 0.13 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 2win n GLY 228 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2win s LEU 229 N 0.00 3.52 -0.11 0.99 2.96 -0.87 -4.88 118.68 120.29 2win s LEU 229 Ca 0.00 -0.05 -0.22 0.00 -0.22 0.00 0.00 54.13 53.64 2win s LEU 229 Cb 0.00 -3.03 -0.03 0.00 0.50 0.00 0.00 46.19 43.63 2win s LEU 229 CO 0.00 -1.49 0.65 -1.61 -1.32 0.00 0.00 176.35 172.57 2win s GLU 230 N 4.91 4.37 -0.03 1.98 2.02 -1.26 -1.11 118.70 129.58 2win s GLU 230 Ca 0.40 0.75 0.04 0.00 0.02 0.00 0.00 54.97 56.18 2win s GLU 230 Cb -0.08 -3.48 -0.01 0.00 0.10 0.00 0.00 34.13 30.66 2win s GLU 230 CO 0.23 0.00 -0.16 0.08 0.02 0.00 0.00 175.26 175.43 2win s VAL 231 N 1.06 1.30 -0.16 2.63 1.01 0.15 -1.44 120.40 124.95 2win s VAL 231 Ca 0.34 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.61 2win s VAL 231 Cb -0.17 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 2win s VAL 231 CO 0.15 0.37 -0.04 -0.89 0.00 0.00 0.00 175.10 174.70 2win s THR 232 N -0.11 3.88 -0.46 3.92 2.01 -0.61 -1.43 115.64 122.84 2win s THR 232 Ca 0.00 -0.36 -0.12 0.00 0.31 0.00 0.00 61.69 61.52 2win s THR 232 Cb -0.09 -2.70 0.08 0.00 0.01 0.00 0.00 72.50 69.80 2win s THR 232 CO 0.01 0.49 0.35 -0.63 -0.69 0.00 0.00 174.62 174.14 2win s ILE 233 N 0.44 4.74 -0.24 1.82 -1.09 -0.31 -1.86 121.20 124.70 2win s ILE 233 Ca -0.04 -1.30 -0.09 0.00 -2.23 0.00 0.00 60.65 57.00 2win s ILE 233 Cb -0.14 -3.90 -0.04 0.00 -1.58 0.00 0.00 42.46 36.80 2win s ILE 233 CO 0.03 -0.59 0.11 -0.89 -1.23 0.00 0.00 174.94 172.36 2win s THR 234 N 1.53 4.77 -0.09 2.92 2.01 0.01 -0.19 115.64 126.59 2win s THR 234 Ca 0.04 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.02 2win s THR 234 Cb -0.24 -3.22 0.02 0.00 0.01 0.00 0.00 72.50 69.06 2win s THR 234 CO 0.04 0.34 -0.09 0.00 -0.69 0.00 0.00 174.62 174.22 2win s ALA 235 N 1.33 1.27 0.01 7.40 0.00 -0.86 0.33 121.76 131.25 2win s ALA 235 Ca 0.06 -0.48 -0.00 0.00 0.00 0.00 0.00 51.96 51.54 2win s ALA 235 Cb -0.15 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 2win s ALA 235 CO 0.05 -0.22 -0.01 -0.98 0.00 0.00 0.00 175.76 174.59 2win s ARG 236 N 1.33 0.25 0.96 0.00 1.70 -0.99 -2.32 118.95 119.88 2win s ARG 236 Ca -0.02 -0.45 -0.11 0.00 -0.47 0.00 0.00 55.73 54.68 2win s ARG 236 Cb -0.14 0.09 0.17 0.00 -0.57 0.00 0.00 34.95 34.50 2win s ARG 236 CO -0.04 -0.04 1.12 -0.06 -1.08 0.00 0.00 175.30 175.20 2win s PHE 237 N -1.11 1.61 0.49 5.89 0.08 0.13 -1.05 117.98 124.02 2win s PHE 237 Ca -0.12 1.65 0.16 0.00 0.12 0.00 0.00 56.93 58.74 2win s PHE 237 Cb -0.08 -3.28 1.18 0.00 -0.57 0.00 0.00 43.02 40.27 2win s PHE 237 CO -0.01 -2.99 2.09 -0.07 -0.10 0.00 0.00 175.22 174.14 2win h LEU 238 N -2.00 0.00 -0.61 -0.37 3.38 -1.69 -1.13 115.31 112.88 2win h LEU 238 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2win h LEU 238 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2win h LEU 238 CO 0.44 0.08 0.00 0.00 0.09 0.00 0.00 178.44 179.05 2win n TYR 239 N -4.41 0.14 0.00 1.13 0.18 -1.26 -4.91 117.16 108.03 2win n TYR 239 Ca -0.03 -0.07 0.00 0.00 1.88 0.00 0.00 57.90 59.68 2win n TYR 239 Cb 0.16 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.12 2win n TYR 239 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2win n GLY 240 N 0.93 2.67 3.64 -7.48 0.00 -0.43 -5.06 105.19 99.46 2win n GLY 240 Ca 0.13 -0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.41 2win n GLY 240 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2win n LYS 241 N 0.00 1.26 -1.41 1.61 4.76 -1.26 -4.54 118.16 118.58 2win n LYS 241 Ca 0.00 0.47 -0.32 0.00 -2.87 0.00 0.00 58.31 55.59 2win n LYS 241 Cb 0.00 -2.22 0.08 0.00 -1.84 0.00 0.00 35.03 31.05 2win n LYS 241 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2win s LYS 242 N -2.50 2.42 -0.08 1.97 1.02 -1.26 0.20 119.74 121.50 2win s LYS 242 Ca 0.70 1.23 0.02 0.00 0.02 0.00 0.00 55.97 57.94 2win s LYS 242 Cb -0.46 -1.91 -0.02 0.00 -0.52 0.00 0.00 37.83 34.91 2win s LYS 242 CO 0.51 -1.53 -0.13 0.08 -0.92 0.00 0.00 175.35 173.36 2win s VAL 243 N -2.74 3.09 -0.20 3.17 1.01 -0.98 -4.57 120.40 119.19 2win s VAL 243 Ca 0.63 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 2win s VAL 243 Cb -0.18 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 2win s VAL 243 CO 0.52 0.57 -0.05 -1.61 0.00 0.00 0.00 175.10 174.53 2win s GLU 244 N -0.35 3.43 0.00 2.72 0.41 -1.26 -2.38 118.70 121.27 2win s GLU 244 Ca 0.03 -0.61 0.00 0.00 -0.41 0.00 0.00 54.97 53.98 2win s GLU 244 Cb -0.13 -2.97 0.00 0.00 -1.78 0.00 0.00 34.13 29.26 2win s GLU 244 CO 0.02 -0.09 0.00 0.41 -0.49 0.00 0.00 175.26 175.11 2win n GLY 245 N 4.49 1.10 3.06 -1.39 0.00 -1.10 -3.23 105.19 108.12 2win n GLY 245 Ca -0.18 -0.62 -0.22 0.00 0.00 0.00 0.00 46.02 45.00 2win n GLY 245 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2win s THR 246 N -2.17 1.04 0.09 2.61 2.01 -0.36 -0.23 115.64 118.62 2win s THR 246 Ca 0.00 -0.50 0.06 0.00 0.31 0.00 0.00 61.69 61.56 2win s THR 246 Cb 0.00 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 2win s THR 246 CO 0.00 0.31 -0.10 0.00 -0.69 0.00 0.00 174.62 174.14 2win s ALA 247 N 0.10 2.95 -0.32 7.40 0.00 -0.76 -0.54 121.76 130.60 2win s ALA 247 Ca -0.03 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 50.74 2win s ALA 247 Cb -0.09 -0.93 0.08 0.00 0.00 0.00 0.00 23.12 22.18 2win s ALA 247 CO 0.01 0.64 0.02 -0.06 0.00 0.00 0.00 175.76 176.37 2win s PHE 248 N -1.17 3.50 -0.10 0.00 0.08 0.64 -2.60 117.98 118.33 2win s PHE 248 Ca 0.21 -2.49 -0.01 0.00 0.12 0.00 0.00 56.93 54.76 2win s PHE 248 Cb -0.11 -2.53 -0.03 0.00 -0.57 0.00 0.00 43.02 39.78 2win s PHE 248 CO 0.13 -0.90 -0.05 0.54 -0.10 0.00 0.00 175.22 174.83 2win s VAL 249 N 1.07 3.85 0.21 -0.44 0.11 -0.84 -1.21 120.40 123.15 2win s VAL 249 Ca 0.02 -0.41 0.02 0.00 -2.93 0.00 0.00 61.98 58.68 2win s VAL 249 Cb -0.20 -2.62 -0.05 0.00 -1.53 0.00 0.00 36.38 31.98 2win s VAL 249 CO -0.05 0.56 0.02 -0.51 -3.33 0.00 0.00 175.10 171.79 2win s ILE 250 N -0.42 0.79 0.09 7.04 2.07 -0.59 -0.84 121.20 129.35 2win s ILE 250 Ca 0.06 -2.00 0.00 0.00 -1.41 0.00 0.00 60.65 57.31 2win s ILE 250 Cb -0.12 -2.29 -0.00 0.00 0.13 0.00 0.00 42.46 40.18 2win s ILE 250 CO 0.02 -0.34 0.01 0.49 -1.91 0.00 0.00 174.94 173.22 2win n PHE 251 N -0.34 0.12 0.00 3.50 3.72 -1.26 -1.15 117.46 122.04 2win n PHE 251 Ca -0.05 -0.49 0.00 0.00 -0.05 0.00 0.00 57.45 56.86 2win n PHE 251 Cb 0.64 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 2win n PHE 251 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2win n GLY 252 N 2.72 1.92 3.51 1.37 0.00 -1.13 -2.68 105.19 110.91 2win n GLY 252 Ca -0.02 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 2win n GLY 252 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2win s ILE 253 N -2.00 3.23 0.06 -0.61 1.01 -0.74 -1.85 121.20 120.29 2win s ILE 253 Ca 0.00 -0.78 0.06 0.00 0.00 0.00 0.00 60.65 59.93 2win s ILE 253 Cb 0.00 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.12 2win s ILE 253 CO 0.00 0.51 -0.10 -1.58 0.00 0.00 0.00 174.94 173.77 2win s GLN 254 N -1.01 2.29 -0.37 2.79 0.74 0.01 -0.22 119.66 123.89 2win s GLN 254 Ca 0.13 -0.90 0.01 0.00 0.05 0.00 0.00 55.36 54.65 2win s GLN 254 Cb -0.11 -2.37 0.15 0.00 1.10 0.00 0.00 33.01 31.79 2win s GLN 254 CO 0.03 0.55 0.25 0.34 -0.55 0.00 0.00 175.29 175.91 2win s ASP 255 N -1.82 2.45 0.00 6.67 3.68 0.12 -3.32 116.67 124.45 2win s ASP 255 Ca 0.19 -2.43 0.00 0.00 2.13 0.00 0.00 52.55 52.45 2win s ASP 255 Cb -0.11 -0.37 0.00 0.00 -1.45 0.00 0.00 42.92 40.99 2win s ASP 255 CO 0.10 -0.27 0.00 0.61 0.13 0.00 0.00 175.17 175.75 2win n GLY 256 N 3.70 1.65 0.00 2.66 0.00 -1.26 -2.30 105.19 109.64 2win n GLY 256 Ca 0.17 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2win n GLY 256 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2win n GLU 257 N 0.00 3.98 -3.27 1.61 4.71 -1.26 -5.09 120.64 121.31 2win n GLU 257 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.16 56.76 2win n GLU 257 Cb 0.00 -0.33 -0.06 0.00 -1.01 0.00 0.00 31.44 30.04 2win n GLU 257 CO 0.00 0.00 0.00 -1.14 0.09 0.00 0.00 177.13 176.08 2win s GLN 258 N -0.00 4.22 -0.03 3.49 0.74 -0.97 -5.08 119.66 122.02 2win s GLN 258 Ca 0.00 0.70 0.06 0.00 0.05 0.00 0.00 55.36 56.18 2win s GLN 258 Cb 0.00 -3.27 -0.02 0.00 1.10 0.00 0.00 33.01 30.82 2win s GLN 258 CO 0.00 0.55 -0.22 1.03 -0.55 0.00 0.00 175.29 176.10 2win s ARG 259 N -0.79 2.28 -0.32 1.67 0.52 -1.26 0.14 118.95 121.18 2win s ARG 259 Ca 0.29 -0.85 0.04 0.00 -0.52 0.00 0.00 55.73 54.68 2win s ARG 259 Cb -0.19 -2.16 0.09 0.00 0.52 0.00 0.00 34.95 33.21 2win s ARG 259 CO 0.18 0.57 0.02 0.42 0.02 0.00 0.00 175.30 176.50 2win s ILE 260 N -0.61 2.28 0.62 1.52 -1.09 0.69 -4.98 121.20 119.63 2win s ILE 260 Ca 0.09 -2.20 -0.18 0.00 -2.23 0.00 0.00 60.65 56.14 2win s ILE 260 Cb -0.10 -2.62 -0.02 0.00 -1.58 0.00 0.00 42.46 38.14 2win s ILE 260 CO -0.00 -0.48 1.22 -0.55 -1.23 0.00 0.00 174.94 173.89 2win s SER 261 N 0.96 5.00 -0.61 3.58 0.15 -1.26 -1.79 113.70 119.72 2win s SER 261 Ca 0.07 2.41 0.01 0.00 0.70 0.00 0.00 55.95 59.14 2win s SER 261 Cb -0.19 -2.60 0.15 0.00 -1.71 0.00 0.00 66.02 61.67 2win s SER 261 CO -0.07 -1.73 0.39 -0.76 1.20 0.00 0.00 173.24 172.27 2win s LEU 262 N -4.25 4.84 0.54 3.45 1.43 -1.09 -4.91 118.68 118.69 2win s LEU 262 Ca 0.78 -3.07 0.24 0.00 -1.03 0.00 0.00 54.13 51.05 2win s LEU 262 Cb -0.31 -1.75 1.41 0.00 0.03 0.00 0.00 46.19 45.57 2win s LEU 262 CO 0.35 -0.27 2.04 1.55 0.23 0.00 0.00 176.35 180.25 2win h PRO 263 N 6.60 0.00 -0.15 1.29 0.13 -1.94 -0.91 132.00 137.01 2win h PRO 263 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2win h PRO 263 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2win h PRO 263 CO 0.71 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.57 2win n GLU 264 N -4.30 1.40 0.00 0.86 2.13 -1.26 -3.15 120.64 116.32 2win n GLU 264 Ca 0.06 -0.62 0.05 0.00 0.66 0.00 0.00 57.16 57.30 2win n GLU 264 Cb 0.46 -1.20 0.03 0.00 0.27 0.00 0.00 31.44 31.00 2win n GLU 264 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2win n SER 265 N -0.04 1.66 -4.68 4.31 3.41 -0.35 -5.00 113.62 112.93 2win n SER 265 Ca 0.09 -1.33 -0.42 0.00 -0.26 0.00 0.00 58.87 56.94 2win n SER 265 Cb 0.16 0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.22 2win n SER 265 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2win s LEU 266 N -1.05 4.39 0.17 1.04 2.96 -1.19 -4.58 118.68 120.43 2win s LEU 266 Ca 0.11 2.60 0.09 0.00 -0.22 0.00 0.00 54.13 56.71 2win s LEU 266 Cb 0.08 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.17 2win s LEU 266 CO 0.16 -0.97 -0.19 -0.54 -1.32 0.00 0.00 176.35 173.49 2win s LYS 267 N 3.16 1.34 -0.47 1.98 -0.14 -0.02 -5.01 119.74 120.57 2win s LYS 267 Ca 0.79 -1.44 0.03 0.00 -1.36 0.00 0.00 55.97 53.99 2win s LYS 267 Cb -0.42 -1.45 0.15 0.00 -1.68 0.00 0.00 37.83 34.43 2win s LYS 267 CO 0.35 0.30 0.30 0.50 -0.76 0.00 0.00 175.35 176.04 2win s ARG 268 N -2.80 1.37 -0.11 1.68 3.52 -1.26 -1.98 118.95 119.38 2win s ARG 268 Ca 0.17 -2.21 -0.07 0.00 -0.13 0.00 0.00 55.73 53.50 2win s ARG 268 Cb -0.06 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.99 2win s ARG 268 CO 0.08 -1.22 0.15 0.96 -0.81 0.00 0.00 175.30 174.45 2win s ILE 269 N 0.05 5.49 0.72 4.11 -4.36 -1.07 -4.94 121.20 121.20 2win s ILE 269 Ca 0.21 0.19 -0.14 0.00 -0.26 0.00 0.00 60.65 60.66 2win s ILE 269 Cb -0.16 -3.42 0.03 0.00 1.25 0.00 0.00 42.46 40.16 2win s ILE 269 CO -0.06 0.59 1.13 -2.84 0.24 0.00 0.00 174.94 174.01 2win s PRO 270 N -1.12 2.38 -0.51 0.37 0.02 -1.26 -1.82 135.00 133.06 2win s PRO 270 Ca 0.16 1.46 0.04 0.00 0.02 0.00 0.00 61.00 62.68 2win s PRO 270 Cb -0.12 -1.89 0.13 0.00 0.02 0.00 0.00 34.50 32.64 2win s PRO 270 CO 0.06 -1.59 0.25 0.42 -0.33 0.00 0.00 177.00 175.81 2win s ILE 271 N -2.37 2.42 -0.04 2.83 -1.09 0.68 -4.62 121.20 119.01 2win s ILE 271 Ca 0.68 -3.20 -0.03 0.00 -2.23 0.00 0.00 60.65 55.86 2win s ILE 271 Cb -0.22 -2.68 -0.04 0.00 -1.58 0.00 0.00 42.46 37.93 2win s ILE 271 CO 0.46 -0.81 0.16 -1.61 -1.23 0.00 0.00 174.94 171.91 2win s GLU 272 N -0.18 3.38 -2.07 2.79 2.02 -1.00 -2.72 118.70 120.92 2win s GLU 272 Ca 0.17 -0.30 0.00 0.00 0.02 0.00 0.00 54.97 54.86 2win s GLU 272 Cb -0.26 -3.08 0.00 0.00 0.10 0.00 0.00 34.13 30.89 2win s GLU 272 CO -0.00 0.70 0.00 -3.47 0.02 0.00 0.00 175.26 172.51 2win n ASP 273 N 1.26 -5.63 -0.75 -0.19 2.03 -1.26 -1.45 116.55 110.55 2win n ASP 273 Ca -0.14 0.34 -0.08 0.00 0.52 0.00 0.00 54.79 55.43 2win n ASP 273 Cb 0.53 -4.88 -0.02 0.00 -0.72 0.00 0.00 41.12 36.03 2win n ASP 273 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2win n GLY 274 N -0.59 0.66 3.04 0.27 0.00 -1.00 -4.78 105.19 102.78 2win n GLY 274 Ca -0.22 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 2win n GLY 274 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2win s SER 275 N -2.81 0.24 0.05 1.61 0.15 -0.53 -2.02 113.70 110.39 2win s SER 275 Ca 0.00 -0.53 -0.07 0.00 0.70 0.00 0.00 55.95 56.05 2win s SER 275 Cb 0.00 0.15 -0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2win s SER 275 CO 0.00 -0.39 0.13 -0.83 1.20 0.00 0.00 173.24 173.35 2win s GLY 276 N -1.76 0.15 -0.10 9.45 0.00 0.74 -2.37 107.32 113.42 2win s GLY 276 Ca -0.11 -0.57 -0.01 0.00 0.00 0.00 0.00 44.72 44.04 2win s GLY 276 CO -0.02 -0.72 -0.06 1.85 0.00 0.00 0.00 173.10 174.14 2win s GLU 277 N -3.02 1.34 0.02 2.90 2.56 -1.26 -1.16 118.70 120.09 2win s GLU 277 Ca -0.02 -0.18 0.04 0.00 0.00 0.00 0.00 54.97 54.81 2win s GLU 277 Cb 0.01 -1.46 -0.02 0.00 2.00 0.00 0.00 34.13 34.66 2win s GLU 277 CO -0.06 -0.27 -0.13 0.54 -0.56 0.00 0.00 175.26 174.78 2win s VAL 278 N 1.75 1.00 -0.03 3.70 0.11 -0.52 -4.95 120.40 121.47 2win s VAL 278 Ca 0.05 -0.77 0.03 0.00 -2.93 0.00 0.00 61.98 58.36 2win s VAL 278 Cb -0.12 -0.88 -0.00 0.00 -1.53 0.00 0.00 36.38 33.84 2win s VAL 278 CO -0.08 0.11 -0.12 -0.69 -3.33 0.00 0.00 175.10 170.99 2win s VAL 279 N -0.61 1.00 -0.58 2.04 1.01 -1.26 -0.68 120.40 121.32 2win s VAL 279 Ca 0.02 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 2win s VAL 279 Cb -0.06 -0.87 0.15 0.00 0.00 0.00 0.00 36.38 35.60 2win s VAL 279 CO 0.00 0.30 0.49 -0.22 0.00 0.00 0.00 175.10 175.67 2win s LEU 280 N 0.08 6.00 0.39 3.92 2.96 -0.26 -4.99 118.68 126.78 2win s LEU 280 Ca -0.02 -2.17 -0.27 0.00 -0.22 0.00 0.00 54.13 51.45 2win s LEU 280 Cb -0.09 -2.08 -0.11 0.00 0.50 0.00 0.00 46.19 44.41 2win s LEU 280 CO 0.01 -0.67 1.44 -1.54 -1.32 0.00 0.00 176.35 174.27 2win n SER 281 N 4.61 3.49 0.26 3.68 3.41 -1.26 -2.05 113.62 125.77 2win n SER 281 Ca -0.03 1.20 0.12 0.00 -0.26 0.00 0.00 58.87 59.90 2win n SER 281 Cb 0.42 -1.59 0.78 0.00 -0.26 0.00 0.00 64.21 63.55 2win n SER 281 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2win h ARG 282 N 2.71 0.00 0.04 4.33 2.43 -1.82 -2.39 114.38 119.67 2win h ARG 282 Ca -0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2win h ARG 282 Cb 1.26 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 2win h ARG 282 CO 0.63 0.00 -0.04 -0.22 -1.51 0.00 0.00 179.97 178.83 2win h LYS 283 N 0.00 -0.09 -0.44 0.20 1.63 -1.91 -1.86 116.57 114.11 2win h LYS 283 Ca 0.02 0.01 -0.09 0.00 -0.85 0.00 0.00 60.65 59.73 2win h LYS 283 Cb 0.07 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.71 2win h LYS 283 CO -0.00 -0.06 -0.11 0.28 -3.45 0.00 0.00 179.45 176.11 2win h VAL 284 N -0.09 1.26 0.25 2.00 2.07 -1.81 -2.24 116.25 117.69 2win h VAL 284 Ca 0.01 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 2win h VAL 284 Cb 0.09 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2win h VAL 284 CO -0.02 0.40 -0.16 0.25 0.02 0.00 0.00 177.57 178.06 2win h LEU 285 N 0.71 -0.41 -1.21 2.57 5.85 -1.26 -0.90 115.31 120.66 2win h LEU 285 Ca 0.12 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2win h LEU 285 Cb 0.59 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 2win h LEU 285 CO 0.04 -0.26 0.04 -0.07 -0.34 0.00 0.00 178.44 177.85 2win h LEU 286 N -0.41 0.54 -0.82 2.25 3.38 -1.32 -1.42 115.31 117.51 2win h LEU 286 Ca -0.02 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2win h LEU 286 Cb 0.34 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2win h LEU 286 CO 0.02 0.59 0.00 0.44 0.09 0.00 0.00 178.44 179.58 2win h ASP 287 N 0.56 0.00 0.50 -0.43 3.45 -1.06 -2.69 116.42 116.75 2win h ASP 287 Ca 0.12 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.52 2win h ASP 287 Cb 0.30 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.06 2win h ASP 287 CO 0.01 0.00 -0.30 1.23 -1.57 0.00 0.00 179.24 178.61 2win h GLY 288 N 2.49 0.00 0.00 2.75 0.00 -0.02 -3.44 103.07 104.85 2win h GLY 288 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2win h GLY 288 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 2win n VAL 289 N -3.82 0.00 -2.33 4.60 0.24 -1.01 -5.07 118.33 110.94 2win n VAL 289 Ca -0.01 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.06 2win n VAL 289 Cb 0.39 -0.36 0.01 0.00 -1.47 0.00 0.00 33.84 32.41 2win n VAL 289 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2win n GLN 290 N -0.30 3.20 -0.87 7.34 1.13 -1.26 -4.98 117.38 121.64 2win n GLN 290 Ca 0.00 -4.20 0.00 0.00 -1.94 0.00 0.00 57.00 50.86 2win n GLN 290 Cb 0.00 -2.14 0.00 0.00 0.11 0.00 0.00 30.24 28.21 2win n GLN 290 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2win n ARG 293 N -0.55 0.00 -0.40 -1.09 5.12 -1.26 -5.07 116.66 113.41 2win n ARG 293 Ca 0.36 0.00 0.33 0.00 -1.93 0.00 0.00 57.85 56.61 2win n ARG 293 Cb 0.81 -1.08 0.60 0.00 -1.16 0.00 0.00 32.46 31.62 2win n ARG 293 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2win h ALA 294 N 0.00 2.49 0.00 7.54 0.00 -2.01 1.02 119.26 128.30 2win h ALA 294 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2win h ALA 294 Cb 0.44 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2win h ALA 294 CO 0.00 -1.11 0.00 0.39 0.00 0.00 0.00 179.25 178.53 2win n GLU 295 N -4.82 0.13 0.02 0.00 4.71 -1.26 -1.76 120.64 117.67 2win n GLU 295 Ca 0.35 0.61 -0.18 0.00 -0.01 0.00 0.00 57.16 57.93 2win n GLU 295 Cb 1.29 -1.91 -0.12 0.00 -1.01 0.00 0.00 31.44 29.68 2win n GLU 295 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 2win h ASP 296 N 0.00 0.54 0.00 1.62 5.19 0.63 -3.18 116.42 121.21 2win h ASP 296 Ca 0.00 -0.80 0.00 0.00 -0.62 0.00 0.00 57.03 55.61 2win h ASP 296 Cb 0.02 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.37 2win h ASP 296 CO 0.00 1.27 0.01 -0.07 -3.12 0.00 0.00 179.24 177.34 2win h LEU 297 N -0.14 0.00 -9.45 1.55 3.38 -1.46 -3.43 115.31 105.77 2win h LEU 297 Ca -0.09 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.33 2win h LEU 297 Cb 1.41 0.00 0.04 0.00 0.09 0.00 0.00 40.66 42.19 2win h LEU 297 CO 0.13 0.00 1.11 0.52 0.09 0.00 0.00 178.44 180.29 2win n VAL 298 N -2.75 0.44 0.00 1.22 0.31 -1.21 -1.59 118.33 114.75 2win n VAL 298 Ca -0.02 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 2win n VAL 298 Cb 0.07 -2.08 0.00 0.00 -0.91 0.00 0.00 33.84 30.92 2win n VAL 298 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2win n GLY 299 N 4.25 2.30 3.61 2.92 0.00 -0.27 -5.04 105.19 112.96 2win n GLY 299 Ca 0.19 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2win n GLY 299 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2win s LYS 300 N 0.00 -1.38 0.10 1.61 1.02 -0.62 -4.72 119.74 115.75 2win s LYS 300 Ca 0.00 -0.20 0.03 0.00 0.02 0.00 0.00 55.97 55.82 2win s LYS 300 Cb 0.00 -1.59 -0.04 0.00 -0.52 0.00 0.00 37.83 35.68 2win s LYS 300 CO 0.00 -3.79 -0.09 -1.54 -0.92 0.00 0.00 175.35 169.01 2win s SER 301 N -4.06 1.34 0.03 2.83 1.04 -1.21 -2.04 113.70 111.64 2win s SER 301 Ca 0.72 -0.89 0.06 0.00 0.48 0.00 0.00 55.95 56.32 2win s SER 301 Cb -0.07 0.04 -0.03 0.00 0.10 0.00 0.00 66.02 66.05 2win s SER 301 CO 0.56 -0.34 -0.14 -0.76 0.98 0.00 0.00 173.24 173.54 2win s LEU 302 N -2.69 2.82 -0.03 2.42 1.43 0.36 -0.81 118.68 122.19 2win s LEU 302 Ca 0.08 -0.33 0.03 0.00 -1.03 0.00 0.00 54.13 52.87 2win s LEU 302 Cb 0.00 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.58 2win s LEU 302 CO -0.02 0.26 -0.11 -0.72 0.23 0.00 0.00 176.35 175.99 2win s TYR 303 N -0.97 1.14 -0.14 0.29 -0.85 -0.77 -2.02 117.35 114.03 2win s TYR 303 Ca 0.16 -0.31 -0.05 0.00 -0.52 0.00 0.00 57.07 56.35 2win s TYR 303 Cb -0.11 -0.81 -0.04 0.00 0.38 0.00 0.00 41.96 41.39 2win s TYR 303 CO 0.07 -0.13 0.04 0.08 -1.52 0.00 0.00 175.55 174.09 2win s VAL 304 N 0.22 4.62 -0.31 -3.49 1.01 0.12 -2.83 120.40 119.74 2win s VAL 304 Ca -0.04 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2win s VAL 304 Cb -0.10 -3.02 0.09 0.00 0.00 0.00 0.00 36.38 33.35 2win s VAL 304 CO 0.01 0.54 0.04 -0.55 0.00 0.00 0.00 175.10 175.14 2win s SER 305 N -0.24 4.36 0.28 3.32 0.15 -0.30 -0.82 113.70 120.45 2win s SER 305 Ca 0.07 -1.80 0.03 0.00 0.70 0.00 0.00 55.95 54.95 2win s SER 305 Cb -0.12 -1.30 -0.03 0.00 -1.71 0.00 0.00 66.02 62.86 2win s SER 305 CO 0.02 -0.36 0.43 0.00 1.20 0.00 0.00 173.24 174.53 2win s ALA 306 N 1.23 3.84 -0.28 5.45 0.00 -1.00 -1.54 121.76 129.46 2win s ALA 306 Ca 0.07 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 50.96 2win s ALA 306 Cb -0.18 -1.89 0.15 0.00 0.00 0.00 0.00 23.12 21.20 2win s ALA 306 CO -0.13 0.15 0.39 0.99 0.00 0.00 0.00 175.76 177.16 2win s THR 307 N -2.10 -0.60 -0.05 0.00 2.01 -0.35 -1.75 115.64 112.81 2win s THR 307 Ca 0.36 -0.29 -0.15 0.00 0.31 0.00 0.00 61.69 61.92 2win s THR 307 Cb -0.09 -0.96 -0.05 0.00 0.01 0.00 0.00 72.50 71.40 2win s THR 307 CO 0.32 -0.29 0.41 -0.69 -0.69 0.00 0.00 174.62 173.68 2win s VAL 308 N 2.52 5.10 -0.09 3.82 1.01 -0.55 -0.26 120.40 131.94 2win s VAL 308 Ca 0.10 0.84 0.01 0.00 0.00 0.00 0.00 61.98 62.92 2win s VAL 308 Cb -0.13 -3.73 0.02 0.00 0.00 0.00 0.00 36.38 32.54 2win s VAL 308 CO -0.28 0.50 -0.09 -0.63 0.00 0.00 0.00 175.10 174.60 2win s ILE 309 N -0.49 1.00 0.85 2.22 1.01 0.30 -2.14 121.20 123.95 2win s ILE 309 Ca 0.23 -0.33 -0.12 0.00 0.00 0.00 0.00 60.65 60.44 2win s ILE 309 Cb -0.16 -0.99 0.10 0.00 0.01 0.00 0.00 42.46 41.42 2win s ILE 309 CO 0.12 0.35 1.12 0.18 0.00 0.00 0.00 174.94 176.70 2win n LEU 310 N 4.50 3.68 0.00 2.97 4.77 -1.22 -1.23 117.00 130.48 2win n LEU 310 Ca -0.17 0.52 0.07 0.00 -0.03 0.00 0.00 56.01 56.40 2win n LEU 310 Cb 0.51 -1.47 0.35 0.00 -2.33 0.00 0.00 43.42 40.47 2win n LEU 310 CO 0.20 -2.01 0.68 1.41 -1.33 0.00 0.00 177.39 176.34 2win n HIS 311 N -3.61 0.00 0.70 -1.77 8.25 -1.20 -1.50 115.22 116.09 2win n HIS 311 Ca 0.13 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.69 2win n HIS 311 Cb 0.51 -0.28 -0.04 0.00 1.12 0.00 0.00 29.99 31.30 2win n HIS 311 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2win n SER 312 N -1.28 0.67 -1.88 0.41 3.41 -1.26 -4.97 113.62 108.72 2win n SER 312 Ca 0.07 -0.51 -0.19 0.00 -0.26 0.00 0.00 58.87 57.98 2win n SER 312 Cb 0.11 1.00 -0.04 0.00 -0.26 0.00 0.00 64.21 65.03 2win n SER 312 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2win n GLY 313 N 1.42 0.50 0.13 5.00 0.00 -0.57 -4.88 105.19 106.79 2win n GLY 313 Ca 0.02 -0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 2win n GLY 313 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2win n SER 314 N -1.40 2.04 -4.43 1.61 7.64 -1.26 -4.99 113.62 112.83 2win n SER 314 Ca -0.21 0.25 -0.22 0.00 1.01 0.00 0.00 58.87 59.69 2win n SER 314 Cb 0.65 -0.86 -0.10 0.00 -1.01 0.00 0.00 64.21 62.90 2win n SER 314 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2win s ASP 315 N -6.98 3.23 -0.16 6.43 2.15 -1.26 -5.09 116.67 115.00 2win s ASP 315 Ca -0.26 -1.02 -0.10 0.00 0.43 0.00 0.00 52.55 51.60 2win s ASP 315 Cb 0.07 -0.24 0.05 0.00 -0.30 0.00 0.00 42.92 42.50 2win s ASP 315 CO 0.70 -0.03 0.40 -0.32 -0.17 0.00 0.00 175.17 175.74 2win s MET 316 N -3.54 0.40 -0.02 4.34 -2.45 -1.26 -3.45 119.30 113.31 2win s MET 316 Ca 0.27 0.72 0.04 0.00 -1.25 0.00 0.00 55.69 55.47 2win s MET 316 Cb -0.04 0.03 -0.01 0.00 1.25 0.00 0.00 34.83 36.06 2win s MET 316 CO 0.12 -0.13 -0.13 0.08 1.05 0.00 0.00 175.02 176.01 2win s VAL 317 N 1.11 1.05 -0.24 10.11 1.01 -0.91 -5.00 120.40 127.53 2win s VAL 317 Ca -0.07 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 2win s VAL 317 Cb -0.07 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.45 2win s VAL 317 CO -0.09 0.30 -0.07 -1.10 0.00 0.00 0.00 175.10 174.14 2win s GLN 318 N -0.17 2.81 0.49 2.72 -0.21 -1.26 -1.49 119.66 122.55 2win s GLN 318 Ca 0.02 -0.99 0.08 0.00 0.02 0.00 0.00 55.36 54.49 2win s GLN 318 Cb -0.07 -2.95 0.02 0.00 1.00 0.00 0.00 33.01 31.01 2win s GLN 318 CO -0.00 -0.40 0.50 0.00 -2.12 0.00 0.00 175.29 173.28 2win s ALA 319 N 1.31 4.37 -0.29 6.09 0.00 -0.72 -5.00 121.76 127.52 2win s ALA 319 Ca -0.00 -1.76 -0.15 0.00 0.00 0.00 0.00 51.96 50.05 2win s ALA 319 Cb -0.17 -1.12 0.15 0.00 0.00 0.00 0.00 23.12 21.98 2win s ALA 319 CO -0.05 -0.43 0.95 -2.00 0.00 0.00 0.00 175.76 174.22 2win s GLU 320 N -4.32 0.38 -0.22 0.00 2.12 -1.26 -2.36 118.70 113.03 2win s GLU 320 Ca 0.49 0.75 -0.04 0.00 0.36 0.00 0.00 54.97 56.52 2win s GLU 320 Cb -0.04 0.23 -0.01 0.00 0.26 0.00 0.00 34.13 34.56 2win s GLU 320 CO 0.29 -0.10 -0.02 0.50 -0.54 0.00 0.00 175.26 175.40 2win s ARG 321 N 1.77 3.44 0.03 4.30 6.06 0.00 -4.97 118.95 129.58 2win s ARG 321 Ca -0.07 -0.59 0.05 0.00 -2.50 0.00 0.00 55.73 52.62 2win s ARG 321 Cb -0.05 -3.07 -0.02 0.00 0.06 0.00 0.00 34.95 31.88 2win s ARG 321 CO -0.16 -0.18 -0.15 -1.54 -2.50 0.00 0.00 175.30 170.76 2win s SER 322 N 1.47 1.82 0.00 -2.12 1.04 -1.26 0.12 113.70 114.78 2win s SER 322 Ca 0.06 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.04 2win s SER 322 Cb -0.14 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 65.84 2win s SER 322 CO -0.02 0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.89 2win n GLY 323 N 1.98 1.39 3.58 7.32 0.00 -1.21 -5.03 105.19 113.22 2win n GLY 323 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2win n GLY 323 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2win s ILE 324 N -2.00 3.48 0.37 -0.61 1.01 -0.85 -4.84 121.20 117.75 2win s ILE 324 Ca 0.00 0.44 -0.27 0.00 0.00 0.00 0.00 60.65 60.82 2win s ILE 324 Cb 0.00 -3.78 -0.09 0.00 0.01 0.00 0.00 42.46 38.60 2win s ILE 324 CO 0.00 -0.59 1.20 -2.84 0.00 0.00 0.00 174.94 172.71 2win s PRO 325 N 6.04 4.21 -0.58 2.79 0.02 -1.26 -0.49 135.00 145.73 2win s PRO 325 Ca 0.74 1.95 -0.05 0.00 0.02 0.00 0.00 61.00 63.66 2win s PRO 325 Cb -0.18 -2.86 0.15 0.00 0.02 0.00 0.00 34.50 31.63 2win s PRO 325 CO 0.29 -0.22 0.42 0.42 -0.33 0.00 0.00 177.00 177.59 2win s ILE 326 N -1.30 3.95 0.25 2.83 1.01 -0.86 -0.98 121.20 126.10 2win s ILE 326 Ca 0.53 -2.54 0.07 0.00 0.00 0.00 0.00 60.65 58.71 2win s ILE 326 Cb -0.34 -3.58 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 2win s ILE 326 CO 0.43 -0.85 -0.10 0.68 0.00 0.00 0.00 174.94 175.10 2win s VAL 327 N 0.42 1.74 -1.50 2.92 -7.23 -1.16 -1.12 120.40 114.47 2win s VAL 327 Ca 0.14 -2.18 0.28 0.00 -1.81 0.00 0.00 61.98 58.41 2win s VAL 327 Cb -0.20 -2.27 0.36 0.00 0.56 0.00 0.00 36.38 34.83 2win s VAL 327 CO -0.04 -0.43 1.79 0.35 -0.31 0.00 0.00 175.10 176.46 2win n THR 328 N -0.50 0.00 -3.79 5.32 -2.24 -1.26 -4.14 114.28 107.67 2win n THR 328 Ca -0.06 -0.05 -0.14 0.00 -2.27 0.00 0.00 64.05 61.53 2win n THR 328 Cb 0.62 -0.06 -0.15 0.00 -2.10 0.00 0.00 70.33 68.64 2win n THR 328 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2win s SER 329 N -2.60 -0.01 0.00 3.42 0.15 -1.26 -4.66 113.70 108.74 2win s SER 329 Ca 0.25 0.13 0.11 0.00 0.70 0.00 0.00 55.95 57.14 2win s SER 329 Cb 0.20 0.05 0.68 0.00 -1.71 0.00 0.00 66.02 65.23 2win s SER 329 CO 0.51 -0.11 1.10 -2.65 1.20 0.00 0.00 173.24 173.30 2win n PRO 330 N 3.89 0.39 -4.19 5.44 -0.02 -1.26 -4.77 135.00 134.48 2win n PRO 330 Ca -0.23 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.13 2win n PRO 330 Cb 0.53 -1.46 -0.10 0.00 -0.02 0.00 0.00 33.50 32.45 2win n PRO 330 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2win s TYR 331 N -2.00 1.07 -0.01 6.00 2.02 -1.26 -4.26 117.35 118.90 2win s TYR 331 Ca 0.17 -1.28 -0.03 0.00 -0.37 0.00 0.00 57.07 55.56 2win s TYR 331 Cb 0.08 -0.56 -0.00 0.00 -0.40 0.00 0.00 41.96 41.07 2win s TYR 331 CO 0.13 -0.53 0.07 -0.65 -1.57 0.00 0.00 175.55 173.00 2win s GLN 332 N -4.08 0.24 -0.09 -0.62 -0.21 0.27 -4.70 119.66 110.46 2win s GLN 332 Ca 0.31 -0.18 0.04 0.00 0.02 0.00 0.00 55.36 55.55 2win s GLN 332 Cb 0.07 0.10 -0.01 0.00 1.00 0.00 0.00 33.01 34.17 2win s GLN 332 CO 0.07 -0.04 -0.20 0.42 -2.12 0.00 0.00 175.29 173.41 2win s ILE 333 N -0.65 2.44 -0.05 1.08 1.01 -1.26 -1.03 121.20 122.74 2win s ILE 333 Ca -0.07 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.69 2win s ILE 333 Cb -0.04 -1.95 0.01 0.00 0.01 0.00 0.00 42.46 40.49 2win s ILE 333 CO 0.00 0.56 -0.10 -1.00 0.00 0.00 0.00 174.94 174.40 2win s HIS 334 N 0.05 1.22 -0.55 3.97 3.76 -0.83 -4.87 115.29 118.05 2win s HIS 334 Ca -0.08 -0.40 0.01 0.00 -0.15 0.00 0.00 55.06 54.44 2win s HIS 334 Cb -0.15 -0.91 0.54 0.00 1.11 0.00 0.00 32.58 33.16 2win s HIS 334 CO 0.05 -0.21 1.97 1.19 -0.85 0.00 0.00 174.74 176.89 2win n PHE 335 N 3.71 3.06 0.78 1.40 3.72 -1.26 -2.17 117.46 126.69 2win n PHE 335 Ca -0.22 -2.41 0.13 0.00 -0.05 0.00 0.00 57.45 54.89 2win n PHE 335 Cb 0.52 -1.19 0.50 0.00 -0.94 0.00 0.00 39.48 38.37 2win n PHE 335 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2win n THR 336 N -0.96 0.36 -0.49 4.37 -2.24 -1.26 -3.05 114.28 111.00 2win n THR 336 Ca 0.60 -0.11 0.06 0.00 -2.27 0.00 0.00 64.05 62.32 2win n THR 336 Cb 1.13 -0.59 0.16 0.00 -2.10 0.00 0.00 70.33 68.93 2win n THR 336 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2win n LYS 337 N -1.90 2.76 -4.72 -0.78 5.02 -1.26 -4.72 118.16 112.56 2win n LYS 337 Ca 0.06 -2.27 -0.33 0.00 -2.02 0.00 0.00 58.31 53.75 2win n LYS 337 Cb 0.37 -1.43 -0.15 0.00 -0.02 0.00 0.00 35.03 33.79 2win n LYS 337 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2win s THR 338 N -1.75 2.58 0.38 -0.18 2.01 -1.17 -4.49 115.64 113.03 2win s THR 338 Ca 0.27 -0.81 -0.25 0.00 0.31 0.00 0.00 61.69 61.20 2win s THR 338 Cb 0.19 -2.07 -0.12 0.00 0.01 0.00 0.00 72.50 70.51 2win s THR 338 CO 0.10 0.53 1.01 -2.65 -0.69 0.00 0.00 174.62 172.92 2win n PRO 339 N 3.84 1.39 -0.70 4.92 -0.02 -1.26 -4.83 135.00 138.34 2win n PRO 339 Ca -0.19 0.49 0.06 0.00 -2.02 0.00 0.00 63.50 61.84 2win n PRO 339 Cb 0.52 -2.00 0.32 0.00 -0.02 0.00 0.00 33.50 32.33 2win n PRO 339 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2win n LYS 340 N 0.34 4.05 -3.75 -0.52 4.76 -1.26 -4.85 118.16 116.92 2win n LYS 340 Ca 0.09 -2.51 -0.13 0.00 -2.87 0.00 0.00 58.31 52.89 2win n LYS 340 Cb 0.37 -2.09 -0.14 0.00 -1.84 0.00 0.00 35.03 31.33 2win n LYS 340 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2win s TYR 341 N -2.35 -0.17 0.27 2.13 2.02 -1.26 -2.22 117.35 115.77 2win s TYR 341 Ca 0.44 0.49 0.10 0.00 -0.37 0.00 0.00 57.07 57.72 2win s TYR 341 Cb 0.33 -0.07 -0.04 0.00 -0.40 0.00 0.00 41.96 41.77 2win s TYR 341 CO 0.13 -0.16 -0.05 -0.59 -1.57 0.00 0.00 175.55 173.31 2win s PHE 342 N 1.11 2.60 -0.33 2.71 -0.12 -0.95 -4.88 117.98 118.12 2win s PHE 342 Ca -0.09 -0.25 -0.14 0.00 -0.05 0.00 0.00 56.93 56.41 2win s PHE 342 Cb -0.11 -1.15 -0.02 0.00 -0.63 0.00 0.00 43.02 41.12 2win s PHE 342 CO -0.06 0.64 0.31 0.15 -0.05 0.00 0.00 175.22 176.22 2win s LYS 343 N -3.63 3.59 -0.31 1.99 3.01 -1.26 -2.33 119.74 120.79 2win s LYS 343 Ca 0.31 -0.46 -0.36 0.00 -1.01 0.00 0.00 55.97 54.45 2win s LYS 343 Cb -0.06 -3.79 -0.12 0.00 -1.01 0.00 0.00 37.83 32.85 2win s LYS 343 CO 0.19 -0.47 2.07 -2.30 0.51 0.00 0.00 175.35 175.35 2win n PRO 344 N 5.27 1.18 -0.70 -1.68 -0.02 -1.26 -0.46 135.00 137.33 2win n PRO 344 Ca -0.10 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2win n PRO 344 Cb 0.50 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2win n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2win n GLY 345 N 5.91 0.59 3.16 -1.23 0.00 -1.00 -4.62 105.19 108.00 2win n GLY 345 Ca 0.37 -0.52 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 2win n GLY 345 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2win s MET 346 N -1.05 0.88 -0.18 1.61 -1.94 0.39 -4.81 119.30 114.21 2win s MET 346 Ca 0.00 -0.85 -0.32 0.00 -1.71 0.00 0.00 55.69 52.81 2win s MET 346 Cb 0.00 -0.90 -0.10 0.00 2.01 0.00 0.00 34.83 35.85 2win s MET 346 CO 0.00 0.21 2.06 -2.30 -0.01 0.00 0.00 175.02 174.98 2win n PRO 347 N 1.61 1.91 -3.59 2.03 -0.02 -1.26 -3.99 135.00 131.70 2win n PRO 347 Ca -0.19 0.63 -0.36 0.00 -2.02 0.00 0.00 63.50 61.55 2win n PRO 347 Cb 0.54 -2.80 -0.08 0.00 -0.02 0.00 0.00 33.50 31.15 2win n PRO 347 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2win s PHE 348 N 6.07 3.42 -0.10 6.00 5.36 -0.06 -4.91 117.98 133.75 2win s PHE 348 Ca 0.99 0.49 -0.17 0.00 -0.96 0.00 0.00 56.93 57.28 2win s PHE 348 Cb -0.61 -2.30 -0.05 0.00 -0.34 0.00 0.00 43.02 39.72 2win s PHE 348 CO 0.46 0.21 0.42 -0.51 -1.46 0.00 0.00 175.22 174.34 2win s ASP 349 N 0.56 6.65 -0.24 6.13 1.01 -1.26 -1.52 116.67 128.00 2win s ASP 349 Ca 0.13 0.77 -0.04 0.00 0.71 0.00 0.00 52.55 54.13 2win s ASP 349 Cb -0.13 -2.26 0.01 0.00 1.01 0.00 0.00 42.92 41.55 2win s ASP 349 CO 0.03 0.08 -0.03 -0.76 0.21 0.00 0.00 175.17 174.70 2win s LEU 350 N 0.26 3.16 -1.14 1.23 1.02 0.28 -4.66 118.68 118.83 2win s LEU 350 Ca 0.23 -0.60 -0.10 0.00 0.02 0.00 0.00 54.13 53.68 2win s LEU 350 Cb -0.15 -1.74 0.26 0.00 0.02 0.00 0.00 46.19 44.58 2win s LEU 350 CO 0.09 -0.09 1.21 0.23 0.02 0.00 0.00 176.35 177.82 2win n MET 351 N 4.77 3.55 -1.91 1.70 2.81 -1.26 -2.02 117.12 124.76 2win n MET 351 Ca -0.17 -4.33 -0.42 0.00 -1.81 0.00 0.00 57.70 50.97 2win n MET 351 Cb 0.49 -2.65 -0.03 0.00 -0.71 0.00 0.00 33.22 30.32 2win n MET 351 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2win s VAL 352 N -0.77 2.81 -0.68 2.03 1.01 -1.17 -4.29 120.40 119.34 2win s VAL 352 Ca 0.33 0.43 -0.02 0.00 0.00 0.00 0.00 61.98 62.72 2win s VAL 352 Cb -0.08 -3.27 0.17 0.00 0.00 0.00 0.00 36.38 33.20 2win s VAL 352 CO -0.06 0.01 0.51 0.12 0.00 0.00 0.00 175.10 175.69 2win s PHE 353 N 2.01 3.50 -0.02 5.22 5.36 -0.92 -0.36 117.98 132.77 2win s PHE 353 Ca 0.73 -2.86 -0.26 0.00 -0.96 0.00 0.00 56.93 53.58 2win s PHE 353 Cb -0.42 -3.15 -0.04 0.00 -0.34 0.00 0.00 43.02 39.07 2win s PHE 353 CO 0.32 -0.79 0.80 0.08 -1.46 0.00 0.00 175.22 174.17 2win s VAL 354 N -0.46 4.92 0.04 3.12 1.01 -0.70 -1.96 120.40 126.38 2win s VAL 354 Ca 0.20 1.66 0.00 0.00 0.00 0.00 0.00 61.98 63.84 2win s VAL 354 Cb -0.17 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 2win s VAL 354 CO -0.06 0.25 -0.04 0.42 0.00 0.00 0.00 175.10 175.67 2win s THR 355 N 0.67 0.28 0.74 3.92 -4.23 -0.19 -2.08 115.64 114.75 2win s THR 355 Ca 0.42 -1.26 -0.11 0.00 -1.18 0.00 0.00 61.69 59.56 2win s THR 355 Cb -0.19 -0.77 0.04 0.00 1.34 0.00 0.00 72.50 72.92 2win s THR 355 CO 0.22 -0.63 1.08 0.20 -0.54 0.00 0.00 174.62 174.95 2win s ASN 356 N -1.98 4.80 0.57 3.99 0.01 0.71 -0.57 114.94 122.47 2win s ASN 356 Ca -0.07 1.77 0.31 0.00 -0.71 0.00 0.00 52.86 54.17 2win s ASN 356 Cb -0.04 -2.52 1.45 0.00 0.41 0.00 0.00 41.25 40.55 2win s ASN 356 CO -0.03 -1.84 1.83 -0.65 -1.51 0.00 0.00 177.10 174.90 2win h PRO 357 N -0.94 0.00 0.09 -0.60 0.11 -1.85 -0.52 132.00 128.30 2win h PRO 357 Ca -0.44 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.39 2win h PRO 357 Cb 1.23 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.36 2win h PRO 357 CO 0.53 0.00 -1.18 0.38 -0.21 0.00 0.00 178.00 177.52 2win h ASP 358 N 0.00 0.77 0.00 -2.05 2.03 -1.91 -3.46 116.42 111.80 2win h ASP 358 Ca 0.37 -0.70 0.00 0.00 -0.73 0.00 0.00 57.03 55.97 2win h ASP 358 Cb 1.70 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 39.96 2win h ASP 358 CO -0.00 1.51 0.00 0.61 -1.03 0.00 0.00 179.24 180.32 2win n GLY 359 N 1.30 1.22 3.76 7.15 0.00 -0.20 -5.11 105.19 113.29 2win n GLY 359 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 2win n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2win s SER 360 N 0.00 6.93 0.51 1.61 1.04 -1.26 -4.64 113.70 117.89 2win s SER 360 Ca 0.00 2.52 -0.22 0.00 0.48 0.00 0.00 55.95 58.73 2win s SER 360 Cb 0.00 -2.64 -0.07 0.00 0.10 0.00 0.00 66.02 63.41 2win s SER 360 CO 0.00 -0.43 1.09 -0.81 0.98 0.00 0.00 173.24 174.07 2win n PRO 361 N 1.28 1.33 -3.73 4.02 -0.04 -1.26 -0.21 135.00 136.39 2win n PRO 361 Ca 0.01 0.49 -0.36 0.00 -0.04 0.00 0.00 63.50 63.60 2win n PRO 361 Cb 0.43 -2.23 -0.09 0.00 -0.04 0.00 0.00 33.50 31.57 2win n PRO 361 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2win s ALA 362 N -1.36 3.62 -0.05 0.55 0.00 -0.88 -4.61 121.76 119.04 2win s ALA 362 Ca 0.69 -0.78 -0.14 0.00 0.00 0.00 0.00 51.96 51.73 2win s ALA 362 Cb -0.47 -2.20 -0.05 0.00 0.00 0.00 0.00 23.12 20.39 2win s ALA 362 CO 0.52 0.01 0.36 -0.47 0.00 0.00 0.00 175.76 176.19 2win s TYR 363 N 0.66 3.66 -0.57 0.00 6.14 -1.26 -4.54 117.35 121.44 2win s TYR 363 Ca 0.07 0.88 -0.12 0.00 0.64 0.00 0.00 57.07 58.54 2win s TYR 363 Cb -0.12 -2.27 0.02 0.00 0.42 0.00 0.00 41.96 40.00 2win s TYR 363 CO 0.01 0.57 0.64 0.54 0.64 0.00 0.00 175.55 177.95 2win n ARG 364 N 2.21 -1.92 -3.50 4.97 1.74 -0.96 -4.98 116.66 114.22 2win n ARG 364 Ca -0.14 1.74 -0.26 0.00 -0.77 0.00 0.00 57.85 58.43 2win n ARG 364 Cb 0.53 -5.08 -0.13 0.00 -1.02 0.00 0.00 32.46 26.75 2win n ARG 364 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2win s VAL 365 N -2.65 -0.16 0.36 1.55 0.11 -1.26 -4.86 120.40 113.49 2win s VAL 365 Ca 0.16 -0.73 -0.27 0.00 -2.93 0.00 0.00 61.98 58.22 2win s VAL 365 Cb -0.04 -0.98 -0.12 0.00 -1.53 0.00 0.00 36.38 33.71 2win s VAL 365 CO 0.78 -0.67 1.16 -0.81 -3.33 0.00 0.00 175.10 172.24 2win n PRO 366 N 5.20 1.74 -4.17 1.54 -0.04 -1.26 -3.72 135.00 134.30 2win n PRO 366 Ca -0.04 0.62 -0.10 0.00 -0.04 0.00 0.00 63.50 63.93 2win n PRO 366 Cb 0.43 -2.16 -0.10 0.00 -0.04 0.00 0.00 33.50 31.63 2win n PRO 366 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2win s VAL 367 N -1.14 0.41 0.27 0.52 -7.23 -0.13 -0.36 120.40 112.72 2win s VAL 367 Ca 0.59 -1.92 -0.09 0.00 -1.81 0.00 0.00 61.98 58.75 2win s VAL 367 Cb -0.59 -1.90 0.03 0.00 0.56 0.00 0.00 36.38 34.49 2win s VAL 367 CO 0.60 -0.65 0.51 0.00 -0.31 0.00 0.00 175.10 175.25 2win n ALA 368 N -0.09 -1.06 -2.14 1.32 0.00 -0.77 -2.54 120.51 115.23 2win n ALA 368 Ca -0.09 -0.91 -0.18 0.00 0.00 0.00 0.00 53.44 52.26 2win n ALA 368 Cb 0.62 0.73 -0.00 0.00 0.00 0.00 0.00 19.45 20.80 2win n ALA 368 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2win s VAL 369 N -2.44 3.09 0.10 0.00 1.01 -1.26 -0.80 120.40 120.10 2win s VAL 369 Ca 0.12 -1.09 -0.28 0.00 0.00 0.00 0.00 61.98 60.74 2win s VAL 369 Cb -0.03 -3.06 -0.10 0.00 0.00 0.00 0.00 36.38 33.19 2win s VAL 369 CO 0.09 -0.03 1.45 -0.61 0.00 0.00 0.00 175.10 176.00 2win h GLN 370 N 0.78 -0.43 0.00 2.72 5.75 -0.97 -3.43 115.11 119.54 2win h GLN 370 Ca -0.41 0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.12 2win h GLN 370 Cb 1.27 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.92 2win h GLN 370 CO 0.49 -0.28 0.00 0.41 -2.65 0.00 0.00 178.83 176.80 2win n GLY 371 N -1.34 0.33 3.63 2.39 0.00 -1.26 -4.77 105.19 104.17 2win n GLY 371 Ca -0.04 -1.70 -0.23 0.00 0.00 0.00 0.00 46.02 44.05 2win n GLY 371 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2win n GLU 372 N 0.00 -1.30 0.29 1.61 -0.58 -1.26 -4.80 120.64 114.60 2win n GLU 372 Ca 0.00 0.80 0.18 0.00 -0.42 0.00 0.00 57.16 57.72 2win n GLU 372 Cb 0.00 -3.46 0.98 0.00 -0.57 0.00 0.00 31.44 28.39 2win n GLU 372 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2win h ASP 373 N -0.67 0.00 0.78 1.62 3.32 -1.87 -1.67 116.42 117.93 2win h ASP 373 Ca -0.51 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.32 2win h ASP 373 Cb 1.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 2win h ASP 373 CO 0.39 0.00 -1.04 0.00 -1.72 0.00 0.00 179.24 176.87 2win h THR 374 N 0.00 1.60 -3.27 0.35 1.03 -1.98 -3.45 112.91 107.18 2win h THR 374 Ca 0.03 -3.11 -0.53 0.00 -0.01 0.00 0.00 66.41 62.79 2win h THR 374 Cb 0.23 2.78 0.05 0.00 -1.07 0.00 0.00 68.15 70.15 2win h THR 374 CO -0.00 0.90 0.79 0.54 -0.01 0.00 0.00 175.52 177.73 2win s VAL 375 N -2.82 2.64 0.18 0.00 0.11 -0.63 -5.00 120.40 114.88 2win s VAL 375 Ca -0.01 0.52 -0.12 0.00 -2.93 0.00 0.00 61.98 59.43 2win s VAL 375 Cb 0.09 -3.33 0.00 0.00 -1.53 0.00 0.00 36.38 31.61 2win s VAL 375 CO 0.84 0.07 0.38 -1.10 -3.33 0.00 0.00 175.10 171.96 2win s GLN 376 N -0.06 1.27 -0.29 1.54 -0.21 -1.26 -4.66 119.66 115.98 2win s GLN 376 Ca 0.62 -1.10 -0.17 0.00 0.02 0.00 0.00 55.36 54.73 2win s GLN 376 Cb -0.42 0.43 0.16 0.00 1.00 0.00 0.00 33.01 34.18 2win s GLN 376 CO 0.41 -0.50 1.07 -1.54 -2.12 0.00 0.00 175.29 172.61 2win s SER 377 N -2.95 -0.37 0.48 5.90 1.04 -1.05 -4.97 113.70 111.77 2win s SER 377 Ca 0.16 0.61 -0.05 0.00 0.48 0.00 0.00 55.95 57.15 2win s SER 377 Cb 0.02 1.07 -0.03 0.00 0.10 0.00 0.00 66.02 67.18 2win s SER 377 CO 0.00 -0.10 0.77 -0.76 0.98 0.00 0.00 173.24 174.13 2win s LEU 378 N 1.09 3.63 -0.01 2.42 1.02 -1.26 -0.96 118.68 124.61 2win s LEU 378 Ca -0.07 0.85 -0.18 0.00 0.02 0.00 0.00 54.13 54.75 2win s LEU 378 Cb -0.03 -3.78 -0.05 0.00 0.02 0.00 0.00 46.19 42.34 2win s LEU 378 CO -0.13 -0.59 0.50 -0.89 0.02 0.00 0.00 176.35 175.26 2win s THR 379 N -2.72 4.98 0.16 5.49 2.01 -1.24 -4.32 115.64 119.99 2win s THR 379 Ca 0.47 1.03 -0.03 0.00 0.31 0.00 0.00 61.69 63.48 2win s THR 379 Cb -0.10 -3.82 0.04 0.00 0.01 0.00 0.00 72.50 68.62 2win s THR 379 CO 0.44 0.48 0.20 0.00 -0.69 0.00 0.00 174.62 175.05 2win n GLN 380 N 2.45 -0.32 0.26 4.92 6.02 -1.01 -2.26 117.38 127.43 2win n GLN 380 Ca -0.10 -0.32 0.16 0.00 -0.01 0.00 0.00 57.00 56.73 2win n GLN 380 Cb 0.51 -0.22 0.60 0.00 1.02 0.00 0.00 30.24 32.15 2win n GLN 380 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2win h GLY 381 N -0.33 0.00 1.50 1.08 0.00 -1.92 -2.89 103.07 100.51 2win h GLY 381 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2win h GLY 381 CO 0.05 0.00 -0.44 1.29 0.00 0.00 0.00 176.54 177.44 2win h ASP 382 N 0.00 0.00 0.00 0.19 2.03 -1.93 -3.47 116.42 113.24 2win h ASP 382 Ca 0.00 -0.07 0.00 0.00 -0.73 0.00 0.00 57.03 56.23 2win h ASP 382 Cb 0.57 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.07 2win h ASP 382 CO 0.00 0.03 0.00 0.61 -1.03 0.00 0.00 179.24 178.85 2win n GLY 383 N 1.23 0.96 3.22 7.15 0.00 -1.09 -4.80 105.19 111.86 2win n GLY 383 Ca 0.03 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 2win n GLY 383 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2win s VAL 384 N -2.00 1.98 0.13 1.61 1.01 -1.26 -1.71 120.40 120.15 2win s VAL 384 Ca 0.00 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.02 2win s VAL 384 Cb 0.00 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 2win s VAL 384 CO 0.00 0.54 0.18 0.00 0.00 0.00 0.00 175.10 175.83 2win s ALA 385 N 0.21 3.76 -0.40 5.51 0.00 0.52 -2.40 121.76 128.95 2win s ALA 385 Ca -0.14 -1.06 -0.12 0.00 0.00 0.00 0.00 51.96 50.64 2win s ALA 385 Cb -0.16 -1.58 0.04 0.00 0.00 0.00 0.00 23.12 21.42 2win s ALA 385 CO 0.07 0.61 0.26 0.21 0.00 0.00 0.00 175.76 176.90 2win s LYS 386 N -2.93 2.83 0.12 0.00 2.47 -1.26 -3.01 119.74 117.96 2win s LYS 386 Ca 0.32 -1.16 0.10 0.00 -1.56 0.00 0.00 55.97 53.67 2win s LYS 386 Cb -0.11 -3.84 -0.04 0.00 -1.46 0.00 0.00 37.83 32.38 2win s LYS 386 CO 0.25 -0.79 -0.24 -0.51 0.16 0.00 0.00 175.35 174.22 2win s LEU 387 N 1.57 2.31 -0.13 5.43 1.43 -0.86 -4.77 118.68 123.66 2win s LEU 387 Ca 0.03 -0.72 -0.07 0.00 -1.03 0.00 0.00 54.13 52.34 2win s LEU 387 Cb -0.20 -1.07 0.05 0.00 0.03 0.00 0.00 46.19 45.00 2win s LEU 387 CO 0.07 0.13 0.31 -0.94 0.23 0.00 0.00 176.35 176.14 2win s SER 388 N -1.97 -0.35 0.12 2.29 1.04 -1.26 -0.55 113.70 113.02 2win s SER 388 Ca 0.10 0.66 0.07 0.00 0.48 0.00 0.00 55.95 57.27 2win s SER 388 Cb -0.10 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 2win s SER 388 CO 0.05 -0.18 -0.16 0.27 0.98 0.00 0.00 173.24 174.20 2win s ILE 389 N 1.34 1.49 -0.18 -1.02 -4.36 -0.57 -4.97 121.20 112.92 2win s ILE 389 Ca -0.09 -1.68 -0.12 0.00 -0.26 0.00 0.00 60.65 58.50 2win s ILE 389 Cb -0.10 -1.55 -0.05 0.00 1.25 0.00 0.00 42.46 42.01 2win s ILE 389 CO -0.10 -0.31 0.21 0.20 0.24 0.00 0.00 174.94 175.18 2win s ASN 390 N -2.32 6.32 0.24 4.36 0.02 -1.26 -0.88 114.94 121.42 2win s ASN 390 Ca 0.09 0.36 0.08 0.00 -1.02 0.00 0.00 52.86 52.36 2win s ASN 390 Cb -0.07 -2.13 -0.04 0.00 0.02 0.00 0.00 41.25 39.03 2win s ASN 390 CO 0.04 0.14 0.12 -0.89 0.02 0.00 0.00 177.10 176.53 2win s THR 391 N 0.41 4.10 0.38 1.60 2.01 -1.26 -5.00 115.64 117.89 2win s THR 391 Ca 0.12 -1.53 -0.02 0.00 0.31 0.00 0.00 61.69 60.57 2win s THR 391 Cb -0.12 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 2win s THR 391 CO 0.01 -0.32 0.62 -1.00 -0.69 0.00 0.00 174.62 173.24 2win s HIS 392 N -2.13 3.52 0.00 4.92 0.09 -1.26 -3.31 115.29 117.12 2win s HIS 392 Ca 0.32 0.51 0.00 0.00 -0.00 0.00 0.00 55.06 55.89 2win s HIS 392 Cb -0.08 -2.03 0.00 0.00 -0.00 0.00 0.00 32.58 30.47 2win s HIS 392 CO 0.23 0.01 0.63 -2.30 -0.00 0.00 0.00 174.74 173.30 2win n PRO 393 N -1.86 0.45 -3.50 8.40 -0.02 -1.26 -2.36 135.00 134.84 2win n PRO 393 Ca -0.03 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.08 2win n PRO 393 Cb 0.56 -1.28 -0.06 0.00 -0.02 0.00 0.00 33.50 32.70 2win n PRO 393 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2win s SER 394 N 1.39 6.61 -0.01 2.55 1.04 -1.26 -4.91 113.70 119.11 2win s SER 394 Ca 0.00 0.72 0.02 0.00 0.48 0.00 0.00 55.95 57.18 2win s SER 394 Cb 0.00 -2.22 0.08 0.00 0.10 0.00 0.00 66.02 63.98 2win s SER 394 CO 0.00 0.18 0.91 0.00 0.98 0.00 0.00 173.24 175.31 2win n GLN 395 N 2.87 1.29 -3.31 4.02 1.13 -1.26 -4.83 117.38 117.29 2win n GLN 395 Ca -0.12 -0.33 -0.38 0.00 -1.94 0.00 0.00 57.00 54.23 2win n GLN 395 Cb 0.52 -1.25 -0.06 0.00 0.11 0.00 0.00 30.24 29.56 2win n GLN 395 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 2win s LYS 396 N -1.64 4.21 0.33 -1.09 2.20 -1.26 -4.76 119.74 117.73 2win s LYS 396 Ca 0.06 0.61 -0.25 0.00 -0.36 0.00 0.00 55.97 56.03 2win s LYS 396 Cb 0.04 -3.31 -0.14 0.00 -1.51 0.00 0.00 37.83 32.90 2win s LYS 396 CO 0.03 0.45 0.61 -2.30 -0.36 0.00 0.00 175.35 173.79 2win n PRO 397 N 2.50 0.56 -3.66 4.03 -0.02 -1.26 -4.83 135.00 132.32 2win n PRO 397 Ca -0.09 0.20 -0.38 0.00 -2.02 0.00 0.00 63.50 61.21 2win n PRO 397 Cb 0.51 -1.41 -0.12 0.00 -0.02 0.00 0.00 33.50 32.47 2win n PRO 397 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2win s LEU 398 N 2.00 3.94 -0.25 2.45 0.20 -0.16 -4.97 118.68 121.90 2win s LEU 398 Ca 0.62 -0.32 -0.10 0.00 0.69 0.00 0.00 54.13 55.02 2win s LEU 398 Cb -0.72 -2.02 -0.05 0.00 -0.43 0.00 0.00 46.19 42.97 2win s LEU 398 CO 0.58 -0.12 0.16 -0.55 -0.29 0.00 0.00 176.35 176.13 2win s SER 399 N 1.66 6.04 -0.08 3.68 0.15 -1.26 -1.17 113.70 122.72 2win s SER 399 Ca 0.06 0.07 0.04 0.00 0.70 0.00 0.00 55.95 56.81 2win s SER 399 Cb -0.16 -2.10 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 2win s SER 399 CO 0.07 0.03 -0.19 -0.63 1.20 0.00 0.00 173.24 173.72 2win s ILE 400 N 1.24 1.67 -0.25 6.45 1.09 -1.05 -5.03 121.20 125.32 2win s ILE 400 Ca 0.07 -0.81 0.01 0.00 -1.10 0.00 0.00 60.65 58.82 2win s ILE 400 Cb -0.14 -1.46 0.04 0.00 -1.06 0.00 0.00 42.46 39.85 2win s ILE 400 CO 0.06 0.47 -0.11 -0.89 -0.10 0.00 0.00 174.94 174.38 2win s THR 401 N 0.34 2.40 -0.11 2.92 2.01 -1.26 -2.00 115.64 119.94 2win s THR 401 Ca -0.14 -1.32 -0.15 0.00 0.31 0.00 0.00 61.69 60.39 2win s THR 401 Cb -0.16 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 2win s THR 401 CO 0.06 0.13 0.36 -0.69 -0.69 0.00 0.00 174.62 173.79 2win s VAL 402 N 1.21 5.22 -0.10 3.82 1.01 -1.01 -0.20 120.40 130.34 2win s VAL 402 Ca -0.04 0.71 0.02 0.00 0.00 0.00 0.00 61.98 62.67 2win s VAL 402 Cb -0.18 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.53 2win s VAL 402 CO -0.06 0.43 -0.16 -0.60 0.00 0.00 0.00 175.10 174.71 2win s ARG 403 N 0.07 2.23 0.30 2.72 3.52 0.02 -3.26 118.95 124.55 2win s ARG 403 Ca 0.21 -0.57 -0.29 0.00 -0.13 0.00 0.00 55.73 54.94 2win s ARG 403 Cb -0.14 -1.88 -0.10 0.00 -1.56 0.00 0.00 34.95 31.27 2win s ARG 403 CO 0.08 -0.04 1.44 -0.08 -0.81 0.00 0.00 175.30 175.89 2win s THR 404 N 0.92 2.46 -0.30 4.11 -1.32 -1.24 -1.86 115.64 118.42 2win s THR 404 Ca -0.08 0.42 0.10 0.00 -1.21 0.00 0.00 61.69 60.92 2win s THR 404 Cb -0.15 -3.27 0.46 0.00 -1.51 0.00 0.00 72.50 68.03 2win s THR 404 CO -0.00 0.08 1.16 0.29 -2.21 0.00 0.00 174.62 173.94 2win n LYS 405 N 1.57 3.18 -2.57 7.08 4.76 0.51 -4.83 118.16 127.86 2win n LYS 405 Ca 0.04 -4.06 -0.42 0.00 -2.87 0.00 0.00 58.31 50.99 2win n LYS 405 Cb 0.40 -2.12 -0.03 0.00 -1.84 0.00 0.00 35.03 31.44 2win n LYS 405 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2win s LYS 406 N -3.61 4.39 0.10 1.97 2.36 -1.26 -4.71 119.74 118.98 2win s LYS 406 Ca 0.46 1.53 -0.02 0.00 -2.55 0.00 0.00 55.97 55.39 2win s LYS 406 Cb 0.39 -3.55 0.02 0.00 -1.05 0.00 0.00 37.83 33.65 2win s LYS 406 CO -0.00 -0.39 0.07 1.04 1.55 0.00 0.00 175.35 177.62 2win n GLN 407 N 5.12 -1.66 0.00 4.03 6.02 -1.26 -3.88 117.38 125.75 2win n GLN 407 Ca 0.10 -0.12 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 2win n GLN 407 Cb 0.47 -0.13 0.00 0.00 1.02 0.00 0.00 30.24 31.61 2win n GLN 407 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2win n GLU 408 N -2.00 0.00 -0.84 -1.09 1.02 -1.26 -4.88 120.64 111.59 2win n GLU 408 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2win n GLU 408 Cb 0.04 -2.01 0.00 0.00 -0.02 0.00 0.00 31.44 29.45 2win n GLU 408 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2win n LEU 409 N 0.00 0.00 -4.39 -4.62 4.32 -1.25 -5.16 117.00 105.90 2win n LEU 409 Ca 0.00 0.00 -0.19 0.00 -0.02 0.00 0.00 56.01 55.80 2win n LEU 409 Cb 0.00 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 41.70 2win n LEU 409 CO 0.00 -0.18 -0.34 -0.94 -1.22 0.00 0.00 177.39 174.72 2win s SER 410 N -0.67 2.32 0.00 -1.43 1.04 -1.26 -5.01 113.70 108.69 2win s SER 410 Ca 0.00 -1.22 0.05 0.00 0.48 0.00 0.00 55.95 55.26 2win s SER 410 Cb 0.00 -0.08 0.25 0.00 0.10 0.00 0.00 66.02 66.29 2win s SER 410 CO 0.00 -0.45 1.06 -0.62 0.98 0.00 0.00 173.24 174.22 2win n GLU 411 N -0.52 0.05 -0.03 4.02 -0.58 -1.26 -1.39 120.64 120.93 2win n GLU 411 Ca -0.05 0.29 -0.05 0.00 -0.42 0.00 0.00 57.16 56.94 2win n GLU 411 Cb 0.64 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.88 2win n GLU 411 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2win n ALA 412 N -1.36 1.75 1.24 0.62 0.00 -1.26 -4.11 120.51 117.39 2win n ALA 412 Ca 0.02 -0.84 0.12 0.00 0.00 0.00 0.00 53.44 52.74 2win n ALA 412 Cb 0.05 -0.68 0.40 0.00 0.00 0.00 0.00 19.45 19.21 2win n ALA 412 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2win n GLU 413 N -2.84 1.80 -3.12 0.00 1.02 -0.49 -4.91 120.64 112.10 2win n GLU 413 Ca -0.18 -1.19 -0.32 0.00 -0.02 0.00 0.00 57.16 55.44 2win n GLU 413 Cb 0.97 -1.44 -0.06 0.00 -0.02 0.00 0.00 31.44 30.90 2win n GLU 413 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2win s GLN 414 N -1.85 4.01 -0.14 3.49 -1.52 -1.15 -4.16 119.66 118.34 2win s GLN 414 Ca 0.34 0.69 -0.05 0.00 -1.95 0.00 0.00 55.36 54.40 2win s GLN 414 Cb 0.19 -2.42 -0.04 0.00 -0.22 0.00 0.00 33.01 30.52 2win s GLN 414 CO 0.29 0.15 0.03 0.00 -0.25 0.00 0.00 175.29 175.51 2win s ALA 415 N -1.99 3.32 0.19 6.09 0.00 -1.26 -4.91 121.76 123.20 2win s ALA 415 Ca 0.54 -0.77 0.09 0.00 0.00 0.00 0.00 51.96 51.82 2win s ALA 415 Cb -0.10 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.26 2win s ALA 415 CO 0.17 0.35 -0.18 -0.08 0.00 0.00 0.00 175.76 176.02 2win s THR 416 N -0.13 1.89 -0.08 0.00 -1.32 -1.26 -3.61 115.64 111.13 2win s THR 416 Ca 0.05 -2.04 -0.17 0.00 -1.21 0.00 0.00 61.69 58.32 2win s THR 416 Cb -0.12 -1.95 0.04 0.00 -1.51 0.00 0.00 72.50 68.95 2win s THR 416 CO 0.02 -0.39 0.42 -0.60 -2.21 0.00 0.00 174.62 171.86 2win s ARG 417 N -3.07 0.66 -0.03 7.08 6.06 -1.20 -4.88 118.95 123.56 2win s ARG 417 Ca 0.19 0.21 0.05 0.00 -2.50 0.00 0.00 55.73 53.68 2win s ARG 417 Cb -0.04 0.30 -0.01 0.00 0.06 0.00 0.00 34.95 35.26 2win s ARG 417 CO 0.08 -0.15 -0.18 0.99 -2.50 0.00 0.00 175.30 173.54 2win s THR 418 N -0.65 1.44 0.38 4.11 2.01 -1.26 -2.40 115.64 119.27 2win s THR 418 Ca -0.07 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 61.21 2win s THR 418 Cb -0.04 -1.22 -0.05 0.00 0.01 0.00 0.00 72.50 71.21 2win s THR 418 CO 0.04 0.41 0.07 0.00 -0.69 0.00 0.00 174.62 174.44 2win s MET 419 N -0.21 1.82 -0.08 4.92 0.23 -0.85 -5.02 119.30 120.12 2win s MET 419 Ca 0.02 -2.06 -0.02 0.00 -1.03 0.00 0.00 55.69 52.60 2win s MET 419 Cb -0.09 -0.95 0.03 0.00 -1.53 0.00 0.00 34.83 32.29 2win s MET 419 CO 0.01 -0.27 0.02 -1.14 -2.03 0.00 0.00 175.02 171.61 2win s GLN 420 N -3.82 0.43 -0.06 3.16 0.74 -1.26 -2.54 119.66 116.30 2win s GLN 420 Ca 0.29 0.11 -0.03 0.00 0.05 0.00 0.00 55.36 55.78 2win s GLN 420 Cb 0.06 -1.03 -0.04 0.00 1.10 0.00 0.00 33.01 33.11 2win s GLN 420 CO 0.14 -0.36 0.10 0.00 -0.55 0.00 0.00 175.29 174.62 2win s ALA 421 N 2.02 3.67 -0.05 1.58 0.00 -0.32 -4.90 121.76 123.76 2win s ALA 421 Ca 0.04 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.24 2win s ALA 421 Cb -0.13 -1.73 -0.03 0.00 0.00 0.00 0.00 23.12 21.23 2win s ALA 421 CO -0.05 0.65 -0.04 -0.51 0.00 0.00 0.00 175.76 175.82 2win s LEU 422 N -1.36 3.35 0.71 0.00 1.43 -0.94 -0.99 118.68 120.88 2win s LEU 422 Ca 0.19 0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 53.13 2win s LEU 422 Cb -0.12 -1.81 0.02 0.00 0.03 0.00 0.00 46.19 44.31 2win s LEU 422 CO 0.09 0.34 1.26 -2.84 0.23 0.00 0.00 176.35 175.43 2win s PRO 423 N -1.08 2.21 -0.50 1.29 0.02 -1.26 -2.24 135.00 133.43 2win s PRO 423 Ca 0.15 1.96 -0.29 0.00 0.02 0.00 0.00 61.00 62.84 2win s PRO 423 Cb -0.11 -1.82 0.03 0.00 0.02 0.00 0.00 34.50 32.62 2win s PRO 423 CO 0.04 -1.83 1.19 -0.47 -0.33 0.00 0.00 177.00 175.60 2win s TYR 424 N -1.66 2.70 -0.20 6.54 5.04 -0.99 -4.85 117.35 123.93 2win s TYR 424 Ca 0.79 0.63 -0.29 0.00 -2.44 0.00 0.00 57.07 55.76 2win s TYR 424 Cb -0.34 -4.45 -0.04 0.00 0.35 0.00 0.00 41.96 37.48 2win s TYR 424 CO 0.44 -1.45 1.78 0.45 -1.34 0.00 0.00 175.55 175.43 2win s SER 425 N 2.82 6.18 0.26 4.32 0.15 -0.69 -4.94 113.70 121.80 2win s SER 425 Ca 0.48 1.77 -0.08 0.00 0.70 0.00 0.00 55.95 58.82 2win s SER 425 Cb -0.08 -2.53 -0.06 0.00 -1.71 0.00 0.00 66.02 61.64 2win s SER 425 CO 0.30 -1.40 0.56 -0.89 1.20 0.00 0.00 173.24 173.02 2win s THR 426 N 5.80 4.96 -0.01 6.45 2.01 -1.26 -4.59 115.64 129.00 2win s THR 426 Ca 0.79 0.34 -0.30 0.00 0.31 0.00 0.00 61.69 62.84 2win s THR 426 Cb -0.28 -3.66 -0.08 0.00 0.01 0.00 0.00 72.50 68.49 2win s THR 426 CO 0.32 -0.18 2.00 -0.69 -0.69 0.00 0.00 174.62 175.38 2win s VAL 427 N -1.93 3.04 -1.85 3.82 1.01 -1.26 -2.02 120.40 121.20 2win s VAL 427 Ca 0.46 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.50 2win s VAL 427 Cb -0.11 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.23 2win s VAL 427 CO 0.25 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2win n GLY 428 N 4.73 0.57 3.74 4.51 0.00 -1.26 -2.63 105.19 114.85 2win n GLY 428 Ca 0.21 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 2win n GLY 428 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2win n ASN 429 N -1.50 -2.78 -0.17 1.61 3.02 -0.86 -4.88 115.26 109.71 2win n ASN 429 Ca -0.22 -0.77 0.14 0.00 -0.03 0.00 0.00 54.58 53.70 2win n ASN 429 Cb 0.66 -4.16 0.51 0.00 -0.61 0.00 0.00 39.78 36.18 2win n ASN 429 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2win n SER 430 N -2.99 0.70 -3.34 6.41 3.41 -1.08 -4.94 113.62 111.79 2win n SER 430 Ca -0.17 -0.69 -0.24 0.00 -0.26 0.00 0.00 58.87 57.51 2win n SER 430 Cb 0.62 0.01 0.04 0.00 -0.26 0.00 0.00 64.21 64.62 2win n SER 430 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2win n ASN 431 N -0.83 -5.64 -4.41 4.04 3.02 -1.26 -4.90 115.26 105.28 2win n ASN 431 Ca 0.13 -0.43 -0.40 0.00 -0.03 0.00 0.00 54.58 53.85 2win n ASN 431 Cb 0.31 -4.53 -0.11 0.00 -0.61 0.00 0.00 39.78 34.84 2win n ASN 431 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2win s ASN 432 N -2.94 5.70 0.43 6.41 0.01 -1.26 -4.54 114.94 118.76 2win s ASN 432 Ca 0.44 -0.80 0.06 0.00 -0.71 0.00 0.00 52.86 51.85 2win s ASN 432 Cb -0.21 -2.03 -0.06 0.00 0.41 0.00 0.00 41.25 39.37 2win s ASN 432 CO 0.54 -0.32 0.09 -0.31 -1.51 0.00 0.00 177.10 175.59 2win s TYR 433 N 1.59 2.43 -0.16 2.20 2.02 0.09 -4.89 117.35 120.63 2win s TYR 433 Ca 0.03 -0.68 -0.06 0.00 -0.37 0.00 0.00 57.07 55.99 2win s TYR 433 Cb -0.18 -1.83 0.07 0.00 -0.40 0.00 0.00 41.96 39.61 2win s TYR 433 CO 0.07 0.29 0.34 -1.17 -1.57 0.00 0.00 175.55 173.50 2win s LEU 434 N -3.83 -0.28 -0.06 -1.29 2.96 -1.26 -2.27 118.68 112.65 2win s LEU 434 Ca 0.34 0.77 0.05 0.00 -0.22 0.00 0.00 54.13 55.06 2win s LEU 434 Cb 0.06 1.03 -0.02 0.00 0.50 0.00 0.00 46.19 47.76 2win s LEU 434 CO 0.18 -0.22 -0.20 -2.28 -1.32 0.00 0.00 176.35 172.51 2win s HIS 435 N 2.16 2.56 -0.39 5.38 5.65 -0.39 -4.55 115.29 125.70 2win s HIS 435 Ca -0.03 -0.49 0.01 0.00 0.25 0.00 0.00 55.06 54.80 2win s HIS 435 Cb -0.11 -1.63 0.11 0.00 -1.18 0.00 0.00 32.58 29.77 2win s HIS 435 CO -0.11 -0.06 0.14 -0.51 -0.65 0.00 0.00 174.74 173.55 2win s LEU 436 N -0.33 4.92 -0.16 8.88 1.43 -1.26 -1.24 118.68 130.91 2win s LEU 436 Ca 0.02 -2.23 -0.17 0.00 -1.03 0.00 0.00 54.13 50.72 2win s LEU 436 Cb -0.13 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2win s LEU 436 CO 0.02 -0.42 0.42 -0.94 0.23 0.00 0.00 176.35 175.66 2win s SER 437 N 1.09 6.55 -0.11 2.29 1.04 -1.20 -4.94 113.70 118.42 2win s SER 437 Ca 0.11 0.65 0.03 0.00 0.48 0.00 0.00 55.95 57.22 2win s SER 437 Cb -0.21 -2.25 -0.00 0.00 0.10 0.00 0.00 66.02 63.66 2win s SER 437 CO -0.06 -0.02 -0.21 -0.69 0.98 0.00 0.00 173.24 173.24 2win s VAL 438 N 0.89 2.32 -1.00 5.02 1.01 -1.26 -2.73 120.40 124.64 2win s VAL 438 Ca 0.22 -0.93 -0.25 0.00 0.00 0.00 0.00 61.98 61.02 2win s VAL 438 Cb -0.15 -1.91 -0.11 0.00 0.00 0.00 0.00 36.38 34.21 2win s VAL 438 CO 0.08 0.55 2.06 -0.76 0.00 0.00 0.00 175.10 177.03 2win s LEU 439 N 0.35 2.92 -0.57 3.92 1.02 -1.26 -4.89 118.68 120.17 2win s LEU 439 Ca -0.17 -0.91 -0.27 0.00 0.02 0.00 0.00 54.13 52.80 2win s LEU 439 Cb -0.17 -2.57 0.00 0.00 0.02 0.00 0.00 46.19 43.46 2win s LEU 439 CO 0.08 -3.43 1.56 0.00 0.02 0.00 0.00 176.35 174.58 2win s ARG 440 N 7.45 3.11 0.21 1.70 1.70 -1.26 -4.95 118.95 126.91 2win s ARG 440 Ca 0.76 0.52 0.03 0.00 -0.47 0.00 0.00 55.73 56.57 2win s ARG 440 Cb -0.06 -4.21 -0.05 0.00 -0.57 0.00 0.00 34.95 30.06 2win s ARG 440 CO 0.09 -2.17 -0.02 0.95 -1.08 0.00 0.00 175.30 173.07 2win s THR 441 N 6.93 1.00 -0.69 4.99 -4.23 -1.26 -5.06 115.64 117.33 2win s THR 441 Ca 0.57 -2.03 -0.25 0.00 -1.18 0.00 0.00 61.69 58.80 2win s THR 441 Cb -0.12 -2.24 -0.13 0.00 1.34 0.00 0.00 72.50 71.35 2win s THR 441 CO 0.24 -0.40 2.42 -0.62 -0.54 0.00 0.00 174.62 175.71 2win n GLU 442 N -0.36 0.70 -2.08 3.99 1.02 -1.26 -4.88 120.64 117.76 2win n GLU 442 Ca -0.06 -0.42 -0.41 0.00 -0.02 0.00 0.00 57.16 56.25 2win n GLU 442 Cb 0.63 -3.35 -0.02 0.00 -0.02 0.00 0.00 31.44 28.69 2win n GLU 442 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2win s LEU 443 N 12.72 4.41 -0.05 -4.62 1.43 -1.26 -4.85 118.68 126.47 2win s LEU 443 Ca 0.99 2.68 0.02 0.00 -1.03 0.00 0.00 54.13 56.80 2win s LEU 443 Cb -0.24 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.35 2win s LEU 443 CO 0.20 -0.59 -0.09 -0.13 0.23 0.00 0.00 176.35 175.98 2win s ARG 444 N -1.37 1.21 -0.36 1.70 0.52 -1.26 -0.94 118.95 118.44 2win s ARG 444 Ca 0.52 -0.27 -0.37 0.00 -0.52 0.00 0.00 55.73 55.08 2win s ARG 444 Cb -0.40 -1.08 -0.13 0.00 0.52 0.00 0.00 34.95 33.86 2win s ARG 444 CO 0.50 0.00 2.12 -2.30 0.02 0.00 0.00 175.30 175.65 2win n PRO 445 N 3.79 0.90 0.00 3.54 -0.02 -1.26 -1.42 135.00 140.52 2win n PRO 445 Ca -0.23 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2win n PRO 445 Cb 0.52 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 2win n PRO 445 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2win n GLY 446 N 6.43 1.09 3.86 -1.23 0.00 0.61 -4.92 105.19 111.03 2win n GLY 446 Ca 0.42 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.14 2win n GLY 446 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2win s GLU 447 N 0.00 0.04 0.02 1.61 2.02 -0.50 -4.79 118.70 117.10 2win s GLU 447 Ca 0.00 -0.42 0.07 0.00 0.02 0.00 0.00 54.97 54.64 2win s GLU 447 Cb 0.00 -1.78 -0.02 0.00 0.10 0.00 0.00 34.13 32.43 2win s GLU 447 CO 0.00 -2.82 -0.21 -0.08 0.02 0.00 0.00 175.26 172.18 2win s THR 448 N -3.74 1.65 -0.11 3.63 -1.32 -1.26 -1.55 115.64 112.93 2win s THR 448 Ca 0.75 -1.09 -0.01 0.00 -1.21 0.00 0.00 61.69 60.13 2win s THR 448 Cb -0.04 -1.41 -0.03 0.00 -1.51 0.00 0.00 72.50 69.51 2win s THR 448 CO 0.54 0.29 -0.07 -0.22 -2.21 0.00 0.00 174.62 172.95 2win s LEU 449 N -0.95 3.12 -0.79 9.08 2.96 -0.11 -4.97 118.68 127.02 2win s LEU 449 Ca 0.08 -0.11 -0.18 0.00 -0.22 0.00 0.00 54.13 53.69 2win s LEU 449 Cb -0.08 -1.71 0.13 0.00 0.50 0.00 0.00 46.19 45.03 2win s LEU 449 CO 0.01 0.26 0.93 0.20 -1.32 0.00 0.00 176.35 176.43 2win s ASN 450 N -0.20 6.48 -0.33 3.68 0.01 -1.26 -1.85 114.94 121.47 2win s ASN 450 Ca 0.02 -1.88 -0.27 0.00 -0.71 0.00 0.00 52.86 50.02 2win s ASN 450 Cb -0.13 -2.34 0.01 0.00 0.41 0.00 0.00 41.25 39.21 2win s ASN 450 CO 0.03 -1.03 0.98 -0.69 -1.51 0.00 0.00 177.10 174.88 2win s VAL 451 N 2.37 4.57 -0.10 1.60 1.01 -1.05 -4.38 120.40 124.42 2win s VAL 451 Ca 0.23 1.48 -0.19 0.00 0.00 0.00 0.00 61.98 63.50 2win s VAL 451 Cb -0.12 -4.35 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 2win s VAL 451 CO -0.03 -0.47 0.50 0.20 0.00 0.00 0.00 175.10 175.30 2win s ASN 452 N 1.73 6.73 -0.37 3.32 0.01 -1.11 -0.64 114.94 124.61 2win s ASN 452 Ca 0.41 0.87 -0.04 0.00 -0.71 0.00 0.00 52.86 53.39 2win s ASN 452 Cb -0.12 -2.30 0.08 0.00 0.41 0.00 0.00 41.25 39.32 2win s ASN 452 CO 0.16 0.02 0.14 -0.36 -1.51 0.00 0.00 177.10 175.55 2win s PHE 453 N 0.49 3.40 -0.32 2.20 0.08 -0.40 -3.24 117.98 120.20 2win s PHE 453 Ca 0.27 -1.95 -0.09 0.00 0.12 0.00 0.00 56.93 55.27 2win s PHE 453 Cb -0.16 -2.73 0.00 0.00 -0.57 0.00 0.00 43.02 39.57 2win s PHE 453 CO 0.11 -0.87 0.15 -1.17 -0.10 0.00 0.00 175.22 173.35 2win s LEU 454 N 1.27 4.20 0.35 -0.37 2.96 -0.38 -2.53 118.68 124.18 2win s LEU 454 Ca 0.02 -0.64 -0.08 0.00 -0.22 0.00 0.00 54.13 53.20 2win s LEU 454 Cb -0.22 -1.99 -0.06 0.00 0.50 0.00 0.00 46.19 44.42 2win s LEU 454 CO -0.01 -0.23 0.68 -0.22 -1.32 0.00 0.00 176.35 175.24 2win s LEU 455 N 1.59 3.94 -0.33 -0.68 2.96 -0.44 -1.26 118.68 124.46 2win s LEU 455 Ca 0.04 0.96 0.02 0.00 -0.22 0.00 0.00 54.13 54.93 2win s LEU 455 Cb -0.17 -3.81 0.15 0.00 0.50 0.00 0.00 46.19 42.85 2win s LEU 455 CO 0.06 -0.30 0.35 -0.60 -1.32 0.00 0.00 176.35 174.53 2win s ARG 456 N -3.68 0.48 -0.06 1.98 6.06 -0.96 -4.94 118.95 117.82 2win s ARG 456 Ca 0.48 -0.44 -0.30 0.00 -2.50 0.00 0.00 55.73 52.97 2win s ARG 456 Cb -0.10 -0.64 0.11 0.00 0.06 0.00 0.00 34.95 34.37 2win s ARG 456 CO 0.30 -1.11 0.94 0.00 -2.50 0.00 0.00 175.30 172.94 2win s MET 457 N 1.95 0.72 0.68 5.12 0.23 -1.26 -0.73 119.30 126.01 2win s MET 457 Ca 0.13 -0.16 -0.17 0.00 -1.03 0.00 0.00 55.69 54.46 2win s MET 457 Cb -0.14 0.33 0.01 0.00 -1.53 0.00 0.00 34.83 33.50 2win s MET 457 CO -0.19 -0.29 1.28 0.16 -2.03 0.00 0.00 175.02 173.95 2win s ASP 458 N -2.08 4.38 0.30 -1.18 1.47 -1.26 -4.83 116.67 113.47 2win s ASP 458 Ca 0.03 2.58 0.24 0.00 1.18 0.00 0.00 52.55 56.59 2win s ASP 458 Cb -0.01 -2.61 1.10 0.00 -0.34 0.00 0.00 42.92 41.06 2win s ASP 458 CO -0.06 -2.15 1.72 0.08 0.68 0.00 0.00 175.17 175.44 2win h ARG 459 N 0.25 0.00 0.00 2.11 0.11 -2.01 -2.90 114.38 111.94 2win h ARG 459 Ca -0.50 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.58 2win h ARG 459 Cb 1.33 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.41 2win h ARG 459 CO 0.52 0.00 -0.00 0.00 0.10 0.00 0.00 179.97 180.59 2win h ALA 460 N 2.15 1.29 0.00 0.08 0.00 -2.06 -3.04 119.26 117.69 2win h ALA 460 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2win h ALA 460 Cb 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2win h ALA 460 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 2win n HIS 461 N -3.50 0.00 0.21 0.00 8.25 -1.11 -4.81 115.22 114.27 2win n HIS 461 Ca -0.03 -0.05 0.07 0.00 -0.26 0.00 0.00 57.72 57.45 2win n HIS 461 Cb 0.08 -0.01 0.48 0.00 1.12 0.00 0.00 29.99 31.66 2win n HIS 461 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 2win h GLU 462 N 0.00 0.00 0.00 -0.41 -0.00 -1.40 -2.27 114.58 110.50 2win h GLU 462 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2win h GLU 462 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.42 2win h GLU 462 CO 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 179.01 179.29 2win n ALA 463 N -2.35 2.01 0.05 1.06 0.00 -1.26 -2.80 120.51 117.22 2win n ALA 463 Ca -0.01 -0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.28 2win n ALA 463 Cb 0.38 -1.35 -0.12 0.00 0.00 0.00 0.00 19.45 18.36 2win n ALA 463 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2win h LYS 464 N 0.00 0.00 -6.17 0.00 -0.00 -1.77 -3.44 116.57 105.18 2win h LYS 464 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 60.65 60.08 2win h LYS 464 Cb 0.36 0.00 -0.05 0.00 -0.00 0.00 0.00 32.23 32.55 2win h LYS 464 CO 0.00 0.90 0.75 0.42 -0.00 0.00 0.00 179.45 181.51 2win s ILE 465 N -2.71 4.56 0.00 0.07 -1.09 -1.12 -4.87 121.20 116.05 2win s ILE 465 Ca 0.00 1.87 0.00 0.00 -2.23 0.00 0.00 60.65 60.29 2win s ILE 465 Cb 0.10 -4.21 0.00 0.00 -1.58 0.00 0.00 42.46 36.77 2win s ILE 465 CO 0.82 -0.10 0.06 0.54 -1.23 0.00 0.00 174.94 175.03 2win n ARG 466 N 5.89 2.49 -3.53 2.79 5.12 -1.26 -4.67 116.66 123.49 2win n ARG 466 Ca 0.11 -0.06 -0.15 0.00 -1.93 0.00 0.00 57.85 55.82 2win n ARG 466 Cb 0.46 -0.36 -0.05 0.00 -1.16 0.00 0.00 32.46 31.35 2win n ARG 466 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 2win s TYR 467 N -0.37 -0.56 -0.02 -1.55 -0.85 -1.26 -0.91 117.35 111.83 2win s TYR 467 Ca 0.00 0.89 0.04 0.00 -0.52 0.00 0.00 57.07 57.48 2win s TYR 467 Cb 0.00 0.44 -0.03 0.00 0.38 0.00 0.00 41.96 42.75 2win s TYR 467 CO 0.00 -0.56 -0.13 0.71 -1.52 0.00 0.00 175.55 174.06 2win s TYR 468 N -1.48 2.74 -0.43 -3.49 2.02 -0.52 -4.77 117.35 111.43 2win s TYR 468 Ca -0.07 -0.13 -0.10 0.00 -0.37 0.00 0.00 57.07 56.40 2win s TYR 468 Cb -0.00 -1.60 0.09 0.00 -0.40 0.00 0.00 41.96 40.04 2win s TYR 468 CO 0.05 0.25 0.29 0.99 -1.57 0.00 0.00 175.55 175.56 2win s THR 469 N -0.83 4.34 0.03 -0.71 2.01 -0.52 -1.35 115.64 118.60 2win s THR 469 Ca 0.13 -1.43 0.01 0.00 0.31 0.00 0.00 61.69 60.71 2win s THR 469 Cb -0.11 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 2win s THR 469 CO 0.03 -0.56 0.08 -0.72 -0.69 0.00 0.00 174.62 172.76 2win s TYR 470 N 1.44 3.25 0.07 4.92 -0.85 -1.15 -2.47 117.35 122.56 2win s TYR 470 Ca 0.04 0.15 0.05 0.00 -0.52 0.00 0.00 57.07 56.79 2win s TYR 470 Cb -0.24 -1.69 -0.03 0.00 0.38 0.00 0.00 41.96 40.38 2win s TYR 470 CO 0.02 0.54 -0.14 -0.51 -1.52 0.00 0.00 175.55 173.94 2win s LEU 471 N -2.01 2.26 -0.17 -3.49 1.02 0.15 -2.40 118.68 114.03 2win s LEU 471 Ca 0.26 -0.59 -0.03 0.00 0.02 0.00 0.00 54.13 53.78 2win s LEU 471 Cb -0.12 -0.53 -0.02 0.00 0.02 0.00 0.00 46.19 45.53 2win s LEU 471 CO 0.18 -0.06 -0.05 -0.63 0.02 0.00 0.00 176.35 175.81 2win s ILE 472 N -1.20 3.67 -0.12 -0.59 -1.09 0.12 -2.07 121.20 119.92 2win s ILE 472 Ca -0.01 -0.43 -0.05 0.00 -2.23 0.00 0.00 60.65 57.93 2win s ILE 472 Cb -0.10 -2.62 -0.04 0.00 -1.58 0.00 0.00 42.46 38.13 2win s ILE 472 CO 0.02 0.47 0.06 -0.04 -1.23 0.00 0.00 174.94 174.22 2win s MET 473 N 0.67 3.41 -0.26 2.79 -1.94 -0.88 -1.13 119.30 121.95 2win s MET 473 Ca -0.03 -0.31 -0.08 0.00 -1.71 0.00 0.00 55.69 53.56 2win s MET 473 Cb -0.15 -3.02 0.12 0.00 2.01 0.00 0.00 34.83 33.79 2win s MET 473 CO 0.02 0.59 0.56 1.21 -0.01 0.00 0.00 175.02 177.39 2win s ASN 474 N -0.55 -0.82 -1.34 3.03 3.04 -0.37 -1.43 114.94 116.51 2win s ASN 474 Ca 0.10 1.24 0.00 0.00 0.04 0.00 0.00 52.86 54.25 2win s ASN 474 Cb -0.12 1.93 0.00 0.00 -1.54 0.00 0.00 41.25 41.52 2win s ASN 474 CO 0.02 -0.23 0.00 0.29 -3.04 0.00 0.00 177.10 174.14 2win n LYS 475 N 5.42 -1.56 -0.15 0.43 5.02 -1.26 -1.19 118.16 124.88 2win n LYS 475 Ca -0.09 0.86 0.00 0.00 -2.02 0.00 0.00 58.31 57.06 2win n LYS 475 Cb 0.49 -5.14 0.00 0.00 -0.02 0.00 0.00 35.03 30.36 2win n LYS 475 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2win n GLY 476 N 0.00 0.92 3.20 0.72 0.00 -1.26 -4.92 105.19 103.85 2win n GLY 476 Ca -0.13 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 2win n GLY 476 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2win s ARG 477 N -0.65 0.92 -0.54 1.61 1.70 -0.33 -4.94 118.95 116.72 2win s ARG 477 Ca 0.00 -1.33 -0.28 0.00 -0.47 0.00 0.00 55.73 53.65 2win s ARG 477 Cb 0.00 -0.46 0.02 0.00 -0.57 0.00 0.00 34.95 33.94 2win s ARG 477 CO 0.00 0.05 1.26 -0.51 -1.08 0.00 0.00 175.30 175.02 2win s LEU 478 N -2.91 3.48 -0.04 -1.89 1.43 -1.26 -1.24 118.68 116.24 2win s LEU 478 Ca 0.12 0.28 -0.24 0.00 -1.03 0.00 0.00 54.13 53.25 2win s LEU 478 Cb 0.02 -3.24 -0.22 0.00 0.03 0.00 0.00 46.19 42.77 2win s LEU 478 CO -0.01 -1.50 1.07 0.25 0.23 0.00 0.00 176.35 176.39 2win h LEU 479 N 12.13 0.20 -7.04 1.79 5.85 -1.45 -3.44 115.31 123.34 2win h LEU 479 Ca -0.25 -0.73 -0.04 0.00 0.84 0.00 0.00 57.88 57.70 2win h LEU 479 Cb 1.07 -0.06 -0.15 0.00 0.37 0.00 0.00 40.66 41.89 2win h LEU 479 CO 1.17 0.90 0.17 -0.75 -0.34 0.00 0.00 178.44 179.58 2win s LYS 480 N -3.31 1.17 -0.18 1.25 2.20 -1.25 -5.00 119.74 114.62 2win s LYS 480 Ca -0.16 -0.23 -0.10 0.00 -0.36 0.00 0.00 55.97 55.12 2win s LYS 480 Cb 0.01 0.54 0.06 0.00 -1.51 0.00 0.00 37.83 36.93 2win s LYS 480 CO 0.73 -0.46 0.44 0.00 -0.36 0.00 0.00 175.35 175.70 2win s ALA 481 N -2.80 -1.13 0.00 3.13 0.00 -1.26 0.16 121.76 119.86 2win s ALA 481 Ca -0.03 1.61 0.00 0.00 0.00 0.00 0.00 51.96 53.53 2win s ALA 481 Cb -0.01 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2win s ALA 481 CO -0.04 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 175.85 2win n GLY 482 N 4.20 4.75 3.08 0.00 0.00 -1.01 -5.02 105.19 111.20 2win n GLY 482 Ca -0.23 -1.27 -0.21 0.00 0.00 0.00 0.00 46.02 44.32 2win n GLY 482 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2win s ARG 483 N 1.05 0.96 -0.32 1.61 1.81 -1.26 -2.91 118.95 119.90 2win s ARG 483 Ca 0.00 -0.47 -0.02 0.00 -1.72 0.00 0.00 55.73 53.51 2win s ARG 483 Cb 0.00 -0.94 0.05 0.00 -0.45 0.00 0.00 34.95 33.62 2win s ARG 483 CO 0.00 0.25 0.03 -1.14 -0.68 0.00 0.00 175.30 173.77 2win s GLN 484 N -0.40 2.40 0.65 3.54 2.00 -0.46 -4.92 119.66 122.47 2win s GLN 484 Ca 0.04 -1.31 -0.18 0.00 -2.00 0.00 0.00 55.36 51.91 2win s GLN 484 Cb -0.05 -3.25 -0.01 0.00 0.80 0.00 0.00 33.01 30.50 2win s GLN 484 CO -0.00 -0.67 1.26 0.14 -0.50 0.00 0.00 175.29 175.52 2win s VAL 485 N 1.26 2.19 -0.16 1.34 -7.23 -1.26 -1.43 120.40 115.10 2win s VAL 485 Ca -0.03 0.11 -0.08 0.00 -1.81 0.00 0.00 61.98 60.17 2win s VAL 485 Cb -0.20 -2.98 0.06 0.00 0.56 0.00 0.00 36.38 33.82 2win s VAL 485 CO -0.01 -0.03 0.36 -0.60 -0.31 0.00 0.00 175.10 174.51 2win s ARG 486 N -3.46 0.32 0.07 4.82 3.52 -0.09 -4.88 118.95 119.25 2win s ARG 486 Ca 0.80 0.76 -0.06 0.00 -0.13 0.00 0.00 55.73 57.10 2win s ARG 486 Cb -0.35 -0.01 -0.05 0.00 -1.56 0.00 0.00 34.95 32.99 2win s ARG 486 CO 0.39 -0.18 0.33 -1.21 -0.81 0.00 0.00 175.30 173.82 2win s GLU 487 N 1.59 3.62 -0.05 5.12 8.01 -1.26 -4.34 118.70 131.39 2win s GLU 487 Ca -0.08 -0.05 -0.35 0.00 0.01 0.00 0.00 54.97 54.50 2win s GLU 487 Cb -0.10 -2.99 -0.13 0.00 -4.31 0.00 0.00 34.13 26.60 2win s GLU 487 CO -0.11 0.57 1.75 -2.30 0.01 0.00 0.00 175.26 175.17 2win n PRO 488 N 0.70 1.91 0.00 0.39 -0.02 -1.26 -1.97 135.00 134.74 2win n PRO 488 Ca -0.07 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2win n PRO 488 Cb 0.52 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2win n PRO 488 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2win n GLY 489 N 4.00 0.71 3.47 -1.23 0.00 -1.26 -5.08 105.19 105.81 2win n GLY 489 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2win n GLY 489 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2win s GLN 490 N -0.69 3.49 0.06 1.61 -0.21 -0.83 -4.94 119.66 118.15 2win s GLN 490 Ca 0.00 -0.62 0.22 0.00 0.02 0.00 0.00 55.36 54.99 2win s GLN 490 Cb 0.00 -3.58 -0.15 0.00 1.00 0.00 0.00 33.01 30.28 2win s GLN 490 CO 0.00 -0.35 0.78 -0.25 -2.12 0.00 0.00 175.29 173.35 2win n ASP 491 N 5.00 0.43 -3.75 5.90 10.43 -1.26 -4.83 116.55 128.47 2win n ASP 491 Ca -0.14 0.00 -0.25 0.00 2.57 0.00 0.00 54.79 56.97 2win n ASP 491 Cb 0.50 1.24 -0.17 0.00 1.84 0.00 0.00 41.12 44.53 2win n ASP 491 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 2win s LEU 492 N -4.56 0.85 -0.02 0.64 2.96 -1.25 -1.32 118.68 115.99 2win s LEU 492 Ca -0.03 -0.46 0.06 0.00 -0.22 0.00 0.00 54.13 53.48 2win s LEU 492 Cb 0.13 -0.51 -0.01 0.00 0.50 0.00 0.00 46.19 46.30 2win s LEU 492 CO 0.85 -0.25 -0.18 0.68 -1.32 0.00 0.00 176.35 176.12 2win s VAL 493 N 1.93 1.45 -0.13 1.68 -7.23 -1.05 -4.94 120.40 112.10 2win s VAL 493 Ca 0.02 -0.78 -0.07 0.00 -1.81 0.00 0.00 61.98 59.34 2win s VAL 493 Cb -0.15 -1.21 -0.04 0.00 0.56 0.00 0.00 36.38 35.54 2win s VAL 493 CO -0.07 0.41 0.14 -0.69 -0.31 0.00 0.00 175.10 174.58 2win s VAL 494 N -0.40 5.49 -0.35 1.32 1.01 -1.26 -1.27 120.40 124.94 2win s VAL 494 Ca 0.06 0.20 -0.04 0.00 0.00 0.00 0.00 61.98 62.21 2win s VAL 494 Cb -0.07 -3.40 0.07 0.00 0.00 0.00 0.00 36.38 32.97 2win s VAL 494 CO -0.00 0.60 0.10 -0.22 0.00 0.00 0.00 175.10 175.57 2win s LEU 495 N -0.86 4.47 -0.98 3.92 2.96 0.18 -4.93 118.68 123.45 2win s LEU 495 Ca 0.14 -1.49 -0.25 0.00 -0.22 0.00 0.00 54.13 52.31 2win s LEU 495 Cb -0.12 -1.80 -0.11 0.00 0.50 0.00 0.00 46.19 44.67 2win s LEU 495 CO 0.03 -0.38 2.08 -2.84 -1.32 0.00 0.00 176.35 173.92 2win s PRO 496 N 1.26 2.09 -0.49 0.98 0.02 -1.26 -2.52 135.00 135.08 2win s PRO 496 Ca 0.00 -0.36 -0.18 0.00 0.02 0.00 0.00 61.00 60.49 2win s PRO 496 Cb -0.21 -5.03 0.06 0.00 0.02 0.00 0.00 34.50 29.34 2win s PRO 496 CO -0.01 -4.14 0.54 -1.17 -0.33 0.00 0.00 177.00 171.89 2win s LEU 497 N 12.58 5.17 0.13 -5.54 2.96 -0.77 -4.93 118.68 128.27 2win s LEU 497 Ca 0.77 -1.03 -0.30 0.00 -0.22 0.00 0.00 54.13 53.35 2win s LEU 497 Cb -0.06 -2.36 -0.07 0.00 0.50 0.00 0.00 46.19 44.20 2win s LEU 497 CO 0.08 -0.79 1.20 -0.44 -1.32 0.00 0.00 176.35 175.08 2win s SER 498 N 2.60 7.08 -0.24 3.68 0.01 -1.26 -0.93 113.70 124.64 2win s SER 498 Ca 0.11 2.14 -0.14 0.00 1.31 0.00 0.00 55.95 59.38 2win s SER 498 Cb -0.21 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.39 2win s SER 498 CO 0.10 -0.41 0.31 -0.63 0.41 0.00 0.00 173.24 173.02 2win s ILE 499 N 0.44 5.24 0.00 1.44 -1.09 -0.60 -4.95 121.20 121.69 2win s ILE 499 Ca 0.56 0.48 0.00 0.00 -2.23 0.00 0.00 60.65 59.45 2win s ILE 499 Cb -0.31 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 36.92 2win s ILE 499 CO 0.33 0.24 0.00 0.35 -1.23 0.00 0.00 174.94 174.63 2win n THR 500 N 4.69 0.00 1.45 2.92 -2.24 -1.26 -0.29 114.28 119.55 2win n THR 500 Ca -0.11 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.77 2win n THR 500 Cb 0.51 -0.79 0.38 0.00 -2.10 0.00 0.00 70.33 68.33 2win n THR 500 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2win n THR 501 N -0.37 0.17 -0.02 4.28 -2.24 -1.26 -3.71 114.28 111.13 2win n THR 501 Ca 0.00 -0.24 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 2win n THR 501 Cb 0.00 0.15 -0.14 0.00 -2.10 0.00 0.00 70.33 68.24 2win n THR 501 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2win n ASP 502 N -0.01 1.20 0.30 3.42 8.00 -1.26 -4.14 116.55 124.06 2win n ASP 502 Ca 0.14 0.34 0.18 0.00 0.71 0.00 0.00 54.79 56.17 2win n ASP 502 Cb 0.23 -0.26 1.00 0.00 -0.02 0.00 0.00 41.12 42.08 2win n ASP 502 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2win h PHE 503 N 0.02 0.00 -3.31 1.24 0.04 -1.96 -3.42 116.94 109.55 2win h PHE 503 Ca -0.33 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 59.91 2win h PHE 503 Cb 2.03 0.00 0.07 0.00 2.20 0.00 0.00 35.95 40.25 2win h PHE 503 CO 0.02 0.00 0.85 0.42 -0.60 0.00 0.00 178.31 179.01 2win s ILE 504 N -4.43 2.25 -0.10 -0.55 1.01 -1.26 -2.98 121.20 115.13 2win s ILE 504 Ca -0.05 0.21 -0.03 0.00 0.00 0.00 0.00 60.65 60.78 2win s ILE 504 Cb 0.14 -3.13 -0.01 0.00 0.01 0.00 0.00 42.46 39.47 2win s ILE 504 CO 0.48 0.03 -0.05 -0.65 0.00 0.00 0.00 174.94 174.75 2win h PRO 505 N 5.01 0.00 -6.52 2.79 0.11 -1.89 -3.46 132.00 128.03 2win h PRO 505 Ca -0.46 0.00 -0.69 0.00 0.11 0.00 0.00 66.00 64.96 2win h PRO 505 Cb 1.22 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.09 2win h PRO 505 CO 0.80 0.00 -0.81 -1.54 -0.21 0.00 0.00 178.00 176.24 2win s SER 506 N -5.43 3.74 0.01 -2.05 1.04 -1.16 -1.70 113.70 108.15 2win s SER 506 Ca -0.04 -0.38 0.04 0.00 0.48 0.00 0.00 55.95 56.05 2win s SER 506 Cb 0.01 -0.62 -0.01 0.00 0.10 0.00 0.00 66.02 65.49 2win s SER 506 CO 0.06 0.29 -0.12 0.72 0.98 0.00 0.00 173.24 175.17 2win s PHE 507 N -0.83 1.04 0.33 5.02 -0.71 -1.01 -4.40 117.98 117.42 2win s PHE 507 Ca 0.13 -0.24 0.07 0.00 -1.04 0.00 0.00 56.93 55.84 2win s PHE 507 Cb -0.10 -0.65 -0.01 0.00 -1.21 0.00 0.00 43.02 41.04 2win s PHE 507 CO 0.03 -0.01 0.45 1.03 -1.34 0.00 0.00 175.22 175.39 2win s ARG 508 N -0.55 3.08 -0.23 1.99 0.52 -0.51 -2.47 118.95 120.78 2win s ARG 508 Ca 0.03 -1.04 -0.03 0.00 -0.52 0.00 0.00 55.73 54.17 2win s ARG 508 Cb -0.05 -2.79 0.11 0.00 0.52 0.00 0.00 34.95 32.73 2win s ARG 508 CO 0.00 0.07 0.23 -1.17 0.02 0.00 0.00 175.30 174.45 2win s LEU 509 N -4.15 -0.08 -0.13 2.53 1.98 -0.44 -2.08 118.68 116.32 2win s LEU 509 Ca 0.44 -0.47 -0.06 0.00 -2.89 0.00 0.00 54.13 51.15 2win s LEU 509 Cb -0.09 0.34 -0.04 0.00 0.66 0.00 0.00 46.19 47.06 2win s LEU 509 CO 0.31 -0.35 0.10 0.68 -1.89 0.00 0.00 176.35 175.19 2win s VAL 510 N 2.31 5.16 -0.02 1.68 -7.23 -0.88 -2.05 120.40 119.37 2win s VAL 510 Ca 0.08 0.08 0.01 0.00 -1.81 0.00 0.00 61.98 60.34 2win s VAL 510 Cb -0.15 -3.26 0.01 0.00 0.56 0.00 0.00 36.38 33.54 2win s VAL 510 CO -0.20 0.57 -0.03 0.00 -0.31 0.00 0.00 175.10 175.13 2win s ALA 511 N -0.61 0.43 0.07 1.32 0.00 -0.62 -0.67 121.76 121.68 2win s ALA 511 Ca 0.12 -0.07 -0.10 0.00 0.00 0.00 0.00 51.96 51.91 2win s ALA 511 Cb -0.12 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.79 2win s ALA 511 CO 0.02 0.03 0.22 1.52 0.00 0.00 0.00 175.76 177.55 2win s TYR 512 N 0.38 0.07 0.04 0.00 -0.85 -1.03 -1.16 117.35 114.80 2win s TYR 512 Ca -0.04 -0.41 0.02 0.00 -0.52 0.00 0.00 57.07 56.12 2win s TYR 512 Cb -0.07 -0.01 -0.02 0.00 0.38 0.00 0.00 41.96 42.23 2win s TYR 512 CO -0.00 -0.52 -0.08 1.52 -1.52 0.00 0.00 175.55 174.95 2win s TYR 513 N -3.39 0.65 -0.01 -3.49 -0.85 -0.75 -1.44 117.35 108.06 2win s TYR 513 Ca 0.01 -0.47 0.04 0.00 -0.52 0.00 0.00 57.07 56.13 2win s TYR 513 Cb 0.03 -0.39 -0.01 0.00 0.38 0.00 0.00 41.96 41.96 2win s TYR 513 CO -0.08 -0.08 -0.13 -0.08 -1.52 0.00 0.00 175.55 173.66 2win s THR 514 N -1.29 1.00 0.38 -3.49 -1.32 -1.26 -2.53 115.64 107.12 2win s THR 514 Ca -0.09 -0.54 -0.13 0.00 -1.21 0.00 0.00 61.69 59.72 2win s THR 514 Cb -0.09 -0.83 0.04 0.00 -1.51 0.00 0.00 72.50 70.11 2win s THR 514 CO 0.00 0.28 0.71 -1.48 -2.21 0.00 0.00 174.62 171.93 2win s LEU 515 N -0.30 0.25 -0.13 9.08 2.34 -1.18 -4.95 118.68 123.80 2win s LEU 515 Ca 0.05 -1.23 -0.00 0.00 0.06 0.00 0.00 54.13 53.01 2win s LEU 515 Cb -0.05 2.52 -0.01 0.00 -0.56 0.00 0.00 46.19 48.09 2win s LEU 515 CO -0.00 -1.60 -0.13 -0.63 -1.06 0.00 0.00 176.35 172.93 2win s ILE 516 N -2.50 3.01 0.00 1.48 1.09 -1.26 -2.86 121.20 120.16 2win s ILE 516 Ca 0.19 -0.67 0.00 0.00 -1.10 0.00 0.00 60.65 59.07 2win s ILE 516 Cb -0.04 -2.26 0.00 0.00 -1.06 0.00 0.00 42.46 39.10 2win s ILE 516 CO 0.14 0.52 0.00 0.61 -0.10 0.00 0.00 174.94 176.11 2win n GLY 517 N 3.59 1.68 5.17 6.18 0.00 -1.22 -4.97 105.19 115.62 2win n GLY 517 Ca -0.18 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 44.99 2win n GLY 517 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2win n ALA 518 N -3.00 0.00 -2.79 4.61 0.00 -1.26 -2.81 120.51 115.26 2win n ALA 518 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2win n ALA 518 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 2win n ALA 518 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2win n SER 519 N 1.83 -1.76 -1.87 0.00 2.88 -1.26 -4.94 113.62 108.50 2win n SER 519 Ca 0.00 -3.41 -0.20 0.00 -1.33 0.00 0.00 58.87 53.93 2win n SER 519 Cb 0.00 1.40 -0.05 0.00 -0.75 0.00 0.00 64.21 64.81 2win n SER 519 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2win n GLY 520 N 0.20 0.80 3.69 0.46 0.00 -1.15 -4.97 105.19 104.22 2win n GLY 520 Ca 0.07 -0.06 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2win n GLY 520 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2win s GLN 521 N -4.29 3.61 0.18 1.61 0.74 -1.12 -4.93 119.66 115.45 2win s GLN 521 Ca 0.00 -0.32 -0.30 0.00 0.05 0.00 0.00 55.36 54.79 2win s GLN 521 Cb 0.00 -3.09 -0.08 0.00 1.10 0.00 0.00 33.01 30.93 2win s GLN 521 CO 0.00 0.48 1.24 0.50 -0.55 0.00 0.00 175.29 176.97 2win s ARG 522 N -0.23 4.45 -0.00 1.67 6.06 -1.26 -3.42 118.95 126.21 2win s ARG 522 Ca 0.08 1.94 0.03 0.00 -2.50 0.00 0.00 55.73 55.28 2win s ARG 522 Cb -0.12 -3.23 -0.01 0.00 0.06 0.00 0.00 34.95 31.65 2win s ARG 522 CO 0.01 -0.17 -0.09 -2.00 -2.50 0.00 0.00 175.30 170.56 2win s GLU 523 N -0.11 0.73 -0.08 5.12 2.12 -1.13 -5.04 118.70 120.31 2win s GLU 523 Ca 0.55 -0.36 0.02 0.00 0.36 0.00 0.00 54.97 55.53 2win s GLU 523 Cb -0.34 -0.70 0.02 0.00 0.26 0.00 0.00 34.13 33.36 2win s GLU 523 CO 0.37 0.19 -0.11 0.08 -0.54 0.00 0.00 175.26 175.25 2win s VAL 524 N -0.29 1.13 -0.08 3.70 1.01 -1.26 -3.09 120.40 121.52 2win s VAL 524 Ca 0.03 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.60 2win s VAL 524 Cb -0.04 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.29 2win s VAL 524 CO -0.00 0.36 -0.18 -0.69 0.00 0.00 0.00 175.10 174.58 2win s VAL 525 N 0.92 1.62 0.22 2.92 1.01 -1.05 -4.69 120.40 121.34 2win s VAL 525 Ca -0.10 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.13 2win s VAL 525 Cb -0.15 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 2win s VAL 525 CO 0.01 0.46 0.06 0.00 0.00 0.00 0.00 175.10 175.63 2win s ALA 526 N 0.46 1.53 -0.28 5.51 0.00 -1.26 -1.82 121.76 125.91 2win s ALA 526 Ca -0.16 -1.74 -0.17 0.00 0.00 0.00 0.00 51.96 49.89 2win s ALA 526 Cb -0.17 0.85 0.08 0.00 0.00 0.00 0.00 23.12 23.89 2win s ALA 526 CO 0.06 -0.41 0.68 0.34 0.00 0.00 0.00 175.76 176.44 2win s ASP 527 N -3.24 -0.92 0.25 0.00 2.15 -0.31 -4.72 116.67 109.88 2win s ASP 527 Ca 0.32 1.49 0.10 0.00 0.43 0.00 0.00 52.55 54.89 2win s ASP 527 Cb 0.07 1.37 -0.04 0.00 -0.30 0.00 0.00 42.92 44.02 2win s ASP 527 CO 0.09 -0.24 -0.07 -0.94 -0.17 0.00 0.00 175.17 173.84 2win s SER 528 N 1.52 4.25 -0.13 -0.34 1.04 -1.26 -1.59 113.70 117.19 2win s SER 528 Ca -0.09 -0.72 -0.11 0.00 0.48 0.00 0.00 55.95 55.51 2win s SER 528 Cb -0.05 -0.69 0.04 0.00 0.10 0.00 0.00 66.02 65.42 2win s SER 528 CO -0.18 0.03 0.33 0.54 0.98 0.00 0.00 173.24 174.95 2win s VAL 529 N -2.22 -0.00 -0.24 5.02 0.11 -0.87 -2.49 120.40 119.70 2win s VAL 529 Ca 0.29 0.02 -0.04 0.00 -2.93 0.00 0.00 61.98 59.32 2win s VAL 529 Cb -0.07 -0.47 -0.00 0.00 -1.53 0.00 0.00 36.38 34.31 2win s VAL 529 CO 0.18 0.01 -0.01 0.86 -3.33 0.00 0.00 175.10 172.80 2win s TRP 530 N 0.35 3.03 -0.02 1.54 -0.00 -0.95 -1.32 118.94 121.55 2win s TRP 530 Ca -0.01 -1.00 0.05 0.00 -0.00 0.00 0.00 56.10 55.13 2win s TRP 530 Cb -0.03 -2.14 -0.03 0.00 -0.00 0.00 0.00 33.47 31.27 2win s TRP 530 CO -0.01 -0.57 -0.16 0.08 -0.00 0.00 0.00 176.95 176.29 2win s VAL 531 N 1.47 2.89 -0.21 5.86 1.01 -1.03 -5.01 120.40 125.39 2win s VAL 531 Ca 0.04 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.05 2win s VAL 531 Cb -0.15 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 2win s VAL 531 CO -0.02 0.52 0.12 -0.62 0.00 0.00 0.00 175.10 175.11 2win s ASP 532 N -0.90 6.04 0.10 3.32 2.15 -1.26 -2.40 116.67 123.71 2win s ASP 532 Ca 0.12 0.16 0.02 0.00 0.43 0.00 0.00 52.55 53.28 2win s ASP 532 Cb -0.11 -2.06 -0.04 0.00 -0.30 0.00 0.00 42.92 40.41 2win s ASP 532 CO 0.02 0.15 0.16 -0.69 -0.17 0.00 0.00 175.17 174.63 2win s VAL 533 N 0.56 4.92 -0.00 1.11 1.01 -0.69 -4.15 120.40 123.16 2win s VAL 533 Ca 0.07 -0.68 -0.37 0.00 0.00 0.00 0.00 61.98 61.00 2win s VAL 533 Cb -0.12 -3.43 -0.16 0.00 0.00 0.00 0.00 36.38 32.67 2win s VAL 533 CO 0.00 0.06 1.46 1.17 0.00 0.00 0.00 175.10 177.80 2win n LYS 534 N 0.14 1.24 -2.64 2.72 3.00 -0.11 -4.70 118.16 117.81 2win n LYS 534 Ca -0.07 0.45 -0.42 0.00 -0.00 0.00 0.00 58.31 58.26 2win n LYS 534 Cb 0.52 -2.11 -0.03 0.00 0.00 0.00 0.00 35.03 33.41 2win n LYS 534 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2win s ASP 535 N 1.33 6.39 0.34 3.14 1.11 -1.26 -4.93 116.67 122.79 2win s ASP 535 Ca 0.88 -0.07 -0.09 0.00 0.18 0.00 0.00 52.55 53.45 2win s ASP 535 Cb -0.96 -2.53 0.02 0.00 1.07 0.00 0.00 42.92 40.52 2win s ASP 535 CO 0.51 -1.47 0.59 -0.94 1.18 0.00 0.00 175.17 175.04 2win s SER 536 N 3.03 0.43 0.36 0.27 1.04 -1.26 -5.05 113.70 112.52 2win s SER 536 Ca 0.39 -1.26 -0.28 0.00 0.48 0.00 0.00 55.95 55.27 2win s SER 536 Cb -0.09 0.72 -0.11 0.00 0.10 0.00 0.00 66.02 66.64 2win s SER 536 CO 0.23 -1.40 1.44 0.00 0.98 0.00 0.00 173.24 174.48 2win h VAL 538 N 3.03 0.79 0.00 0.00 2.07 -2.00 -3.41 116.25 116.74 2win h VAL 538 Ca -0.50 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2win h VAL 538 Cb 1.23 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2win h VAL 538 CO 0.66 0.11 0.00 0.61 0.02 0.00 0.00 177.57 178.97 2win n GLY 539 N -1.46 0.96 3.65 2.17 0.00 -1.26 -4.89 105.19 104.36 2win n GLY 539 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 2win n GLY 539 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2win s SER 540 N 0.33 -0.16 -0.17 1.61 1.04 -1.26 -5.09 113.70 109.99 2win s SER 540 Ca 0.00 0.31 -0.04 0.00 0.48 0.00 0.00 55.95 56.70 2win s SER 540 Cb 0.00 0.42 0.08 0.00 0.10 0.00 0.00 66.02 66.62 2win s SER 540 CO 0.00 -0.05 0.25 -0.22 0.98 0.00 0.00 173.24 174.19 2win s LEU 541 N 0.23 -0.22 -0.00 2.42 2.96 -1.26 -3.51 118.68 119.30 2win s LEU 541 Ca 0.04 0.14 0.07 0.00 -0.22 0.00 0.00 54.13 54.16 2win s LEU 541 Cb -0.05 0.55 -0.02 0.00 0.50 0.00 0.00 46.19 47.18 2win s LEU 541 CO -0.13 -0.29 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.70 2win s VAL 542 N 2.38 1.74 -0.25 1.68 1.01 0.25 -4.99 120.40 122.21 2win s VAL 542 Ca 0.05 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.02 2win s VAL 542 Cb -0.14 -1.46 0.07 0.00 0.00 0.00 0.00 36.38 34.86 2win s VAL 542 CO -0.11 0.43 0.03 -0.69 0.00 0.00 0.00 175.10 174.76 2win s VAL 543 N -0.58 1.00 0.47 2.92 1.01 -1.26 -0.71 120.40 123.25 2win s VAL 543 Ca 0.08 -1.09 0.02 0.00 0.00 0.00 0.00 61.98 61.00 2win s VAL 543 Cb -0.09 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 2win s VAL 543 CO -0.00 -0.34 0.05 -1.59 0.00 0.00 0.00 175.10 173.23 2win s LYS 544 N 1.61 2.09 0.11 2.72 -2.85 -1.01 -5.02 119.74 117.39 2win s LYS 544 Ca 0.01 -2.31 -0.30 0.00 -1.00 0.00 0.00 55.97 52.37 2win s LYS 544 Cb -0.18 -1.16 -0.06 0.00 -2.06 0.00 0.00 37.83 34.37 2win s LYS 544 CO -0.13 -0.41 1.10 0.45 0.10 0.00 0.00 175.35 176.47 2win s SER 545 N -3.77 7.24 0.17 0.03 0.15 -1.26 -1.88 113.70 114.38 2win s SER 545 Ca 0.13 1.98 -0.11 0.00 0.70 0.00 0.00 55.95 58.66 2win s SER 545 Cb 0.02 -2.59 0.07 0.00 -1.71 0.00 0.00 66.02 61.81 2win s SER 545 CO 0.08 -0.29 1.68 1.23 1.20 0.00 0.00 173.24 177.14 2win h GLY 546 N 5.90 1.03 -7.16 9.45 0.00 -0.60 -3.41 103.07 108.29 2win h GLY 546 Ca -0.43 -0.65 -0.54 0.00 0.00 0.00 0.00 47.33 45.71 2win h GLY 546 CO 0.75 0.60 1.39 1.20 0.00 0.00 0.00 176.54 180.49 2win s GLN 547 N -5.31 2.93 0.00 4.80 1.11 -1.26 -4.82 119.66 117.11 2win s GLN 547 Ca -0.12 1.35 0.00 0.00 0.01 0.00 0.00 55.36 56.59 2win s GLN 547 Cb 0.13 -4.34 0.00 0.00 -1.01 0.00 0.00 33.01 27.79 2win s GLN 547 CO 0.82 -2.34 1.09 -1.13 0.01 0.00 0.00 175.29 173.74 2win n SER 548 N 12.04 3.19 -2.58 5.90 3.41 -1.26 -4.81 113.62 129.52 2win n SER 548 Ca 0.26 -2.00 -0.02 0.00 -0.26 0.00 0.00 58.87 56.85 2win n SER 548 Cb 0.49 -0.56 0.01 0.00 -0.26 0.00 0.00 64.21 63.90 2win n SER 548 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2win n GLU 549 N 0.62 0.42 -0.07 4.33 2.13 -1.26 -5.17 120.64 121.63 2win n GLU 549 Ca 0.00 -0.97 0.01 0.00 0.66 0.00 0.00 57.16 56.86 2win n GLU 549 Cb 0.49 1.33 -0.00 0.00 0.27 0.00 0.00 31.44 33.52 2win n GLU 549 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2win n ASP 550 N -1.05 -1.84 0.00 4.31 10.43 -1.26 -5.04 116.55 122.11 2win n ASP 550 Ca -0.01 0.08 0.00 0.00 2.57 0.00 0.00 54.79 57.43 2win n ASP 550 Cb 0.39 -0.22 0.00 0.00 1.84 0.00 0.00 41.12 43.14 2win n ASP 550 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2win n ARG 551 N -0.80 2.12 -3.04 -1.24 3.00 -1.26 -5.11 116.66 110.33 2win n ARG 551 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.85 57.45 2win n ARG 551 Cb 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.43 2win n ARG 551 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2win s GLN 552 N 4.71 4.48 0.42 5.56 -0.21 -1.26 -5.07 119.66 128.28 2win s GLN 552 Ca 0.00 1.05 -0.07 0.00 0.02 0.00 0.00 55.36 56.36 2win s GLN 552 Cb 0.00 -3.28 0.10 0.00 1.00 0.00 0.00 33.01 30.83 2win s GLN 552 CO 0.00 0.51 0.39 -2.30 -2.12 0.00 0.00 175.29 171.77 2win n PRO 553 N 1.94 -1.61 -4.31 2.91 -0.02 -1.26 -5.09 135.00 127.55 2win n PRO 553 Ca -0.06 -0.62 -0.19 0.00 -2.02 0.00 0.00 63.50 60.61 2win n PRO 553 Cb 0.49 -0.56 -0.15 0.00 -0.02 0.00 0.00 33.50 33.26 2win n PRO 553 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2win s VAL 554 N -1.73 0.66 -0.46 -1.45 1.01 -1.26 -5.07 120.40 112.10 2win s VAL 554 Ca 0.25 -0.31 -0.45 0.00 0.00 0.00 0.00 61.98 61.47 2win s VAL 554 Cb -0.02 -0.59 -0.19 0.00 0.00 0.00 0.00 36.38 35.58 2win s VAL 554 CO 0.19 0.21 1.73 -2.65 0.00 0.00 0.00 175.10 174.57 2win n PRO 555 N 3.20 0.23 0.00 2.72 -0.02 -1.26 -0.04 135.00 139.83 2win n PRO 555 Ca -0.17 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 2win n PRO 555 Cb 0.55 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 2win n PRO 555 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2win n GLY 556 N 4.65 1.70 3.80 -1.23 0.00 -1.26 -5.08 105.19 107.78 2win n GLY 556 Ca 0.34 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.02 2win n GLY 556 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2win s GLN 557 N -0.81 4.23 0.46 1.61 0.74 0.93 -5.06 119.66 121.77 2win s GLN 557 Ca 0.00 1.24 -0.09 0.00 0.05 0.00 0.00 55.36 56.56 2win s GLN 557 Cb 0.00 -2.33 -0.05 0.00 1.10 0.00 0.00 33.01 31.73 2win s GLN 557 CO 0.00 -0.04 0.81 -0.65 -0.55 0.00 0.00 175.29 174.86 2win s GLN 558 N -2.90 3.69 -0.21 1.67 -0.21 -1.26 -4.87 119.66 115.57 2win s GLN 558 Ca 0.60 0.43 -0.15 0.00 0.02 0.00 0.00 55.36 56.26 2win s GLN 558 Cb -0.13 -2.34 0.06 0.00 1.00 0.00 0.00 33.01 31.60 2win s GLN 558 CO 0.18 -0.16 0.53 0.00 -2.12 0.00 0.00 175.29 173.72 2win s MET 559 N -4.30 0.57 0.31 2.91 0.23 -1.26 -5.03 119.30 112.74 2win s MET 559 Ca 0.51 0.86 -0.29 0.00 -1.03 0.00 0.00 55.69 55.74 2win s MET 559 Cb -0.10 0.17 -0.10 0.00 -1.53 0.00 0.00 34.83 33.27 2win s MET 559 CO 0.38 -0.12 1.23 0.99 -2.03 0.00 0.00 175.02 175.48 2win s THR 560 N 0.90 3.01 -0.33 3.16 2.01 -1.26 -4.94 115.64 118.19 2win s THR 560 Ca -0.05 1.01 0.02 0.00 0.31 0.00 0.00 61.69 62.98 2win s THR 560 Cb -0.05 -3.64 0.10 0.00 0.01 0.00 0.00 72.50 68.91 2win s THR 560 CO -0.08 0.24 0.08 -0.22 -0.69 0.00 0.00 174.62 173.95 2win s LEU 561 N -1.62 3.64 0.22 4.42 2.96 -1.26 0.17 118.68 127.20 2win s LEU 561 Ca 0.47 -1.95 -0.30 0.00 -0.22 0.00 0.00 54.13 52.14 2win s LEU 561 Cb -0.37 -1.29 -0.09 0.00 0.50 0.00 0.00 46.19 44.95 2win s LEU 561 CO 0.48 -0.39 1.20 -0.75 -1.32 0.00 0.00 176.35 175.57 2win s LYS 562 N 1.19 4.50 -0.21 1.98 2.20 -0.79 -4.82 119.74 123.79 2win s LYS 562 Ca 0.11 1.90 -0.01 0.00 -0.36 0.00 0.00 55.97 57.61 2win s LYS 562 Cb -0.18 -3.21 0.06 0.00 -1.51 0.00 0.00 37.83 32.98 2win s LYS 562 CO -0.15 -0.05 -0.01 0.42 -0.36 0.00 0.00 175.35 175.20 2win s ILE 563 N -0.33 0.99 -0.48 5.43 1.01 -1.26 -2.40 121.20 124.15 2win s ILE 563 Ca 0.51 -0.83 -0.12 0.00 0.00 0.00 0.00 60.65 60.21 2win s ILE 563 Cb -0.33 -1.37 0.11 0.00 0.01 0.00 0.00 42.46 40.88 2win s ILE 563 CO 0.39 -0.13 0.38 -1.61 0.00 0.00 0.00 174.94 173.97 2win s GLU 564 N 1.65 2.73 0.20 2.79 2.02 0.11 -4.97 118.70 123.22 2win s GLU 564 Ca -0.03 -1.63 0.03 0.00 0.02 0.00 0.00 54.97 53.36 2win s GLU 564 Cb -0.18 -4.04 -0.01 0.00 0.10 0.00 0.00 34.13 30.00 2win s GLU 564 CO -0.07 -1.16 0.09 0.41 0.02 0.00 0.00 175.26 174.55 2win n GLY 565 N 5.06 3.61 3.80 -1.39 0.00 -1.26 -0.59 105.19 114.42 2win n GLY 565 Ca -0.11 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.63 2win n GLY 565 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2win s ASP 566 N -2.24 6.48 0.29 1.61 1.01 -1.23 -5.00 116.67 117.59 2win s ASP 566 Ca 0.13 1.85 -0.29 0.00 0.71 0.00 0.00 52.55 54.95 2win s ASP 566 Cb 0.01 -2.55 -0.10 0.00 1.01 0.00 0.00 42.92 41.29 2win s ASP 566 CO 0.09 -0.68 1.29 -2.28 0.21 0.00 0.00 175.17 173.80 2win s HIS 567 N -2.07 3.16 0.00 4.23 5.65 -1.26 -2.69 115.29 122.31 2win s HIS 567 Ca 0.66 1.39 0.00 0.00 0.25 0.00 0.00 55.06 57.35 2win s HIS 567 Cb -0.14 -3.62 0.00 0.00 -1.18 0.00 0.00 32.58 27.64 2win s HIS 567 CO 0.19 -1.73 0.00 0.41 -0.65 0.00 0.00 174.74 172.96 2win n GLY 568 N 1.28 1.35 3.81 1.59 0.00 -1.26 -5.01 105.19 106.95 2win n GLY 568 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2win n GLY 568 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2win s ALA 569 N -3.82 3.47 -0.14 4.61 0.00 -1.10 -5.07 121.76 119.71 2win s ALA 569 Ca 0.00 0.16 -0.12 0.00 0.00 0.00 0.00 51.96 52.00 2win s ALA 569 Cb 0.00 -2.79 -0.05 0.00 0.00 0.00 0.00 23.12 20.28 2win s ALA 569 CO 0.00 0.34 0.24 0.50 0.00 0.00 0.00 175.76 176.84 2win s ARG 570 N -1.63 4.04 -0.15 0.00 3.52 -1.26 -4.96 118.95 118.51 2win s ARG 570 Ca 0.38 0.02 0.01 0.00 -0.13 0.00 0.00 55.73 56.01 2win s ARG 570 Cb -0.19 -3.35 0.00 0.00 -1.56 0.00 0.00 34.95 29.85 2win s ARG 570 CO 0.22 0.42 -0.18 0.08 -0.81 0.00 0.00 175.30 175.03 2win s VAL 571 N -0.04 2.45 -0.17 7.11 1.01 -1.26 -5.11 120.40 124.40 2win s VAL 571 Ca 0.15 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.21 2win s VAL 571 Cb -0.13 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 2win s VAL 571 CO 0.04 0.53 0.11 0.68 0.00 0.00 0.00 175.10 176.45 2win s VAL 572 N 0.82 5.22 0.35 2.92 -7.23 -1.26 -5.10 120.40 116.11 2win s VAL 572 Ca -0.06 0.11 0.08 0.00 -1.81 0.00 0.00 61.98 60.31 2win s VAL 572 Cb -0.15 -3.33 -0.05 0.00 0.56 0.00 0.00 36.38 33.40 2win s VAL 572 CO -0.01 0.51 0.08 -0.76 -0.31 0.00 0.00 175.10 174.61 2win s LEU 573 N -0.11 3.10 -0.29 1.32 1.43 -1.26 -5.14 118.68 117.73 2win s LEU 573 Ca 0.09 -0.93 -0.16 0.00 -1.03 0.00 0.00 54.13 52.10 2win s LEU 573 Cb -0.12 -1.50 0.16 0.00 0.03 0.00 0.00 46.19 44.77 2win s LEU 573 CO 0.00 -0.30 1.05 0.54 0.23 0.00 0.00 176.35 177.88 2win s VAL 574 N -2.50 0.00 -0.11 -1.59 0.11 -1.26 -5.15 120.40 109.91 2win s VAL 574 Ca 0.37 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.44 2win s VAL 574 Cb -0.00 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.84 2win s VAL 574 CO 0.21 0.00 -0.19 0.00 -3.33 0.00 0.00 175.10 171.79 2win s ALA 575 N 1.22 2.38 -0.01 1.54 0.00 -1.26 -5.12 121.76 120.51 2win s ALA 575 Ca -0.08 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 50.96 2win s ALA 575 Cb -0.03 -0.98 -0.00 0.00 0.00 0.00 0.00 23.12 22.11 2win s ALA 575 CO -0.13 0.29 -0.09 0.08 0.00 0.00 0.00 175.76 175.91 2win s VAL 576 N 0.27 0.70 0.15 0.00 1.01 -1.26 -5.08 120.40 116.19 2win s VAL 576 Ca -0.13 -0.36 -0.31 0.00 0.00 0.00 0.00 61.98 61.17 2win s VAL 576 Cb -0.17 -0.60 -0.10 0.00 0.00 0.00 0.00 36.38 35.51 2win s VAL 576 CO 0.07 0.21 1.61 -0.62 0.00 0.00 0.00 175.10 176.37 2win s ASP 577 N -0.08 6.55 0.57 3.32 -1.08 -1.26 -4.88 116.67 119.81 2win s ASP 577 Ca 0.01 2.64 0.26 0.00 -0.52 0.00 0.00 52.55 54.95 2win s ASP 577 Cb -0.05 -2.59 1.54 0.00 -1.46 0.00 0.00 42.92 40.36 2win s ASP 577 CO -0.00 -0.86 2.07 0.11 0.52 0.00 0.00 175.17 177.01 2win h LYS 578 N 7.11 0.00 -0.30 4.34 1.57 -2.00 -1.25 116.57 126.05 2win h LYS 578 Ca -0.43 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.44 2win h LYS 578 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 2win h LYS 578 CO 0.92 0.00 0.29 0.78 -0.57 0.00 0.00 179.45 180.87 2win h GLY 579 N 0.00 0.00 1.24 3.86 0.00 -1.91 -0.87 103.07 105.39 2win h GLY 579 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.33 2win h GLY 579 CO -0.00 0.00 -0.23 -2.08 0.00 0.00 0.00 176.54 174.23 2win h VAL 580 N 0.00 1.27 0.00 4.60 2.07 -1.60 -2.86 116.25 119.72 2win h VAL 580 Ca 0.14 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.29 2win h VAL 580 Cb 0.71 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2win h VAL 580 CO -0.00 0.47 0.00 0.49 0.02 0.00 0.00 177.57 178.54 2win n PHE 581 N -4.11 0.42 0.18 1.57 3.72 -0.34 -2.03 117.46 116.87 2win n PHE 581 Ca -0.00 0.15 0.04 0.00 -0.05 0.00 0.00 57.45 57.59 2win n PHE 581 Cb 0.45 -0.75 0.31 0.00 -0.94 0.00 0.00 39.48 38.55 2win n PHE 581 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2win h VAL 582 N 0.00 1.02 0.00 -4.37 2.07 -1.47 -3.10 116.25 110.39 2win h VAL 582 Ca 0.00 -1.63 -0.26 0.00 0.82 0.00 0.00 66.70 65.63 2win h VAL 582 Cb 0.38 1.96 -0.05 0.00 -1.52 0.00 0.00 31.29 32.06 2win h VAL 582 CO 0.00 0.42 -1.72 0.18 0.02 0.00 0.00 177.57 176.47 2win n LEU 583 N -3.62 0.73 -3.53 2.57 4.32 -0.86 -4.92 117.00 111.68 2win n LEU 583 Ca -0.01 0.34 0.00 0.00 -0.02 0.00 0.00 56.01 56.33 2win n LEU 583 Cb 0.52 0.18 -0.04 0.00 -1.62 0.00 0.00 43.42 42.47 2win n LEU 583 CO 0.38 0.32 0.41 0.21 -1.22 0.00 0.00 177.39 177.49 2win s ASN 584 N -5.88 -0.90 0.00 -1.43 3.84 -1.03 -5.02 114.94 104.52 2win s ASN 584 Ca -0.05 1.22 0.02 0.00 0.21 0.00 0.00 52.86 54.26 2win s ASN 584 Cb 0.08 2.02 0.03 0.00 -0.55 0.00 0.00 41.25 42.83 2win s ASN 584 CO 0.82 -0.17 0.75 2.29 -2.79 0.00 0.00 177.10 178.00 2win n LYS 585 N 5.25 0.76 -2.40 0.43 2.85 -1.23 -4.05 118.16 119.76 2win n LYS 585 Ca -0.10 -1.00 -0.27 0.00 -1.05 0.00 0.00 58.31 55.89 2win n LYS 585 Cb 0.51 -1.04 0.03 0.00 -0.65 0.00 0.00 35.03 33.88 2win n LYS 585 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2win s LYS 586 N -0.49 2.92 -1.54 -1.58 1.02 -1.26 -4.33 119.74 114.47 2win s LYS 586 Ca 0.03 -0.01 -0.00 0.00 0.02 0.00 0.00 55.97 56.00 2win s LYS 586 Cb 0.02 -2.28 0.00 0.00 -0.52 0.00 0.00 37.83 35.05 2win s LYS 586 CO 0.02 -0.70 0.04 0.09 -0.92 0.00 0.00 175.35 173.88 2win n ASN 587 N -2.58 -5.30 -3.14 2.83 5.03 -1.26 -4.95 115.26 105.88 2win n ASN 587 Ca 0.04 -0.03 -0.16 0.00 0.87 0.00 0.00 54.58 55.30 2win n ASN 587 Cb 0.58 -4.36 0.10 0.00 -1.02 0.00 0.00 39.78 35.09 2win n ASN 587 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2win n LYS 588 N -2.81 -0.53 -4.09 3.52 5.02 -1.26 -4.85 118.16 113.16 2win n LYS 588 Ca -0.21 -1.23 -0.32 0.00 -2.02 0.00 0.00 58.31 54.53 2win n LYS 588 Cb 0.66 -0.68 -0.15 0.00 -0.02 0.00 0.00 35.03 34.83 2win n LYS 588 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2win s LEU 589 N 0.00 2.90 0.05 -0.35 2.96 -1.26 -5.09 118.68 117.89 2win s LEU 589 Ca 0.41 -1.09 0.06 0.00 -0.22 0.00 0.00 54.13 53.29 2win s LEU 589 Cb -0.01 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 2win s LEU 589 CO 0.29 -0.11 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.14 2win s THR 590 N 1.18 1.42 0.48 3.68 2.01 -1.26 -5.02 115.64 118.12 2win s THR 590 Ca -0.03 -1.14 0.14 0.00 0.31 0.00 0.00 61.69 60.96 2win s THR 590 Cb -0.17 -1.26 0.29 0.00 0.01 0.00 0.00 72.50 71.37 2win s THR 590 CO -0.08 0.09 2.08 -0.61 -0.69 0.00 0.00 174.62 175.40 2win h GLN 591 N 4.82 0.22 -0.26 4.92 5.75 -2.00 -1.11 115.11 127.44 2win h GLN 591 Ca -0.41 -0.01 -0.10 0.00 -0.15 0.00 0.00 58.65 57.97 2win h GLN 591 Cb 1.17 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.66 2win h GLN 591 CO 0.43 0.15 -0.27 1.03 -2.65 0.00 0.00 178.83 177.52 2win h SER 592 N 0.23 0.53 0.78 -0.69 0.87 -1.96 -2.51 113.55 110.80 2win h SER 592 Ca 0.12 -0.19 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 2win h SER 592 Cb 0.20 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 2win h SER 592 CO -0.02 0.79 -0.24 0.11 -0.53 0.00 0.00 176.83 176.94 2win h LYS 593 N 0.46 0.00 -0.01 2.24 1.57 -1.62 -2.30 116.57 116.90 2win h LYS 593 Ca 0.06 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2win h LYS 593 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 2win h LYS 593 CO 0.05 0.24 -0.02 0.82 -0.57 0.00 0.00 179.45 179.97 2win h ILE 594 N 0.00 1.47 -0.07 1.86 2.04 -1.13 -2.97 117.51 118.71 2win h ILE 594 Ca -0.00 -1.41 -0.05 0.00 1.00 0.00 0.00 64.86 64.40 2win h ILE 594 Cb 0.69 2.40 -0.01 0.00 -0.74 0.00 0.00 36.82 39.17 2win h ILE 594 CO 0.03 0.37 -0.20 -0.50 0.00 0.00 0.00 178.15 177.85 2win h TRP 595 N -0.56 0.12 -0.26 1.37 4.06 -1.46 -1.85 115.95 117.37 2win h TRP 595 Ca -0.00 -0.01 -0.04 0.00 2.06 0.00 0.00 58.89 60.89 2win h TRP 595 Cb 0.61 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.73 2win h TRP 595 CO 0.13 0.31 -0.03 0.22 -3.56 0.00 0.00 178.44 175.51 2win h ASP 596 N 0.11 0.37 0.04 -3.49 3.58 -1.42 -0.61 116.42 114.99 2win h ASP 596 Ca 0.02 -0.06 -0.19 0.00 0.42 0.00 0.00 57.03 57.21 2win h ASP 596 Cb 0.42 -0.10 0.02 0.00 1.72 0.00 0.00 39.33 41.39 2win h ASP 596 CO 0.03 0.46 -0.77 0.58 -2.88 0.00 0.00 179.24 176.66 2win h VAL 597 N 0.38 1.41 -0.96 2.25 2.07 -1.21 -2.96 116.25 117.23 2win h VAL 597 Ca 0.08 -2.22 0.01 0.00 0.82 0.00 0.00 66.70 65.39 2win h VAL 597 Cb 0.31 2.69 -0.05 0.00 -1.52 0.00 0.00 31.29 32.72 2win h VAL 597 CO 0.01 0.65 0.64 0.58 0.02 0.00 0.00 177.57 179.47 2win h VAL 598 N -0.05 1.24 -0.27 2.57 2.07 -1.10 -2.29 116.25 118.42 2win h VAL 598 Ca -0.11 -0.44 -0.11 0.00 0.82 0.00 0.00 66.70 66.85 2win h VAL 598 Cb 1.49 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2win h VAL 598 CO 0.15 0.24 -0.30 -0.08 0.02 0.00 0.00 177.57 177.59 2win h GLU 599 N 1.30 0.57 0.00 1.57 4.22 -1.19 -2.61 114.58 118.44 2win h GLU 599 Ca 0.36 -0.25 -0.05 0.00 0.08 0.00 0.00 59.36 59.50 2win h GLU 599 Cb -0.14 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2win h GLU 599 CO -0.08 0.81 -0.25 0.87 -2.18 0.00 0.00 179.01 178.18 2win h LYS 600 N 0.49 0.00 -0.71 1.92 1.57 -1.25 -2.47 116.57 116.12 2win h LYS 600 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2win h LYS 600 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 2win h LYS 600 CO 0.06 0.25 0.00 0.00 -0.57 0.00 0.00 179.45 179.19 2win n ALA 601 N -2.34 3.13 -1.78 3.86 0.00 -0.91 -4.93 120.51 117.54 2win n ALA 601 Ca -0.01 -1.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.05 2win n ALA 601 Cb 0.35 -1.05 -0.04 0.00 0.00 0.00 0.00 19.45 18.70 2win n ALA 601 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2win s ASP 602 N -0.53 6.95 0.02 0.00 2.15 -0.93 -4.86 116.67 119.47 2win s ASP 602 Ca 0.30 2.05 0.25 0.00 0.43 0.00 0.00 52.55 55.57 2win s ASP 602 Cb 0.22 -2.59 0.49 0.00 -0.30 0.00 0.00 42.92 40.73 2win s ASP 602 CO 0.11 -0.35 1.40 2.30 -0.17 0.00 0.00 175.17 178.46 2win n ILE 603 N 0.28 0.05 -3.05 4.11 -5.35 -1.26 -4.86 119.36 109.29 2win n ILE 603 Ca 0.03 -0.05 -0.39 0.00 -0.27 0.00 0.00 62.75 62.07 2win n ILE 603 Cb 0.49 0.18 -0.06 0.00 -1.74 0.00 0.00 39.64 38.51 2win n ILE 603 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2win s GLY 604 N -3.11 2.81 -0.11 3.28 0.00 -1.26 -4.28 107.32 104.64 2win s GLY 604 Ca 0.10 0.25 0.16 0.00 0.00 0.00 0.00 44.72 45.24 2win s GLY 604 CO 0.70 0.88 1.18 0.00 0.00 0.00 0.00 173.10 175.86 2win s THR 606 N -1.84 -0.01 0.21 0.00 2.01 -1.14 -4.95 115.64 109.92 2win s THR 606 Ca 0.33 0.05 0.24 0.00 0.31 0.00 0.00 61.69 62.63 2win s THR 606 Cb 0.34 -0.77 0.24 0.00 0.01 0.00 0.00 72.50 72.33 2win s THR 606 CO -0.09 0.02 1.71 -0.65 -0.69 0.00 0.00 174.62 174.92 2win h PRO 607 N 6.88 0.00 0.00 4.92 0.11 -1.85 -3.45 132.00 138.61 2win h PRO 607 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2win h PRO 607 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2win h PRO 607 CO 0.23 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.43 2win n GLY 608 N -1.24 2.96 1.36 -0.55 0.00 -1.26 -2.25 105.19 104.20 2win n GLY 608 Ca -0.02 -1.24 0.18 0.00 0.00 0.00 0.00 46.02 44.94 2win n GLY 608 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2win n SER 609 N 0.00 -8.07 -3.27 1.61 2.88 -1.04 -4.35 113.62 101.39 2win n SER 609 Ca 0.00 0.55 -0.04 0.00 -1.33 0.00 0.00 58.87 58.05 2win n SER 609 Cb 0.00 -4.11 0.02 0.00 -0.75 0.00 0.00 64.21 59.37 2win n SER 609 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2win s GLY 610 N -6.85 0.17 0.14 0.46 0.00 -1.26 -4.59 107.32 95.39 2win s GLY 610 Ca 0.00 -0.43 -0.12 0.00 0.00 0.00 0.00 44.72 44.17 2win s GLY 610 CO 0.00 1.91 1.51 0.07 0.00 0.00 0.00 173.10 176.58 2win h LYS 611 N 2.00 0.90 0.00 2.90 2.10 -1.91 -3.45 116.57 119.11 2win h LYS 611 Ca -0.29 -0.41 0.00 0.00 -2.00 0.00 0.00 60.65 57.95 2win h LYS 611 Cb 1.22 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2win h LYS 611 CO 0.37 1.07 0.00 -0.40 -2.00 0.00 0.00 179.45 178.49 2win n ASP 612 N -4.16 0.00 -0.03 7.07 5.68 -1.26 -1.71 116.55 122.14 2win n ASP 612 Ca -0.01 -0.97 -0.05 0.00 -0.50 0.00 0.00 54.79 53.25 2win n ASP 612 Cb 0.47 0.00 0.16 0.00 -1.14 0.00 0.00 41.12 40.61 2win n ASP 612 CO 0.00 0.00 0.00 0.10 -1.33 0.00 0.00 177.20 175.97 2win h TYR 613 N 0.97 0.67 0.00 2.11 -0.00 -1.84 -1.14 116.97 117.75 2win h TYR 613 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 58.73 58.59 2win h TYR 613 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 36.73 36.56 2win h TYR 613 CO 0.00 0.77 0.00 0.00 -0.00 0.00 0.00 178.16 178.93 2win n ALA 614 N -2.49 2.00 -0.03 0.10 0.00 -1.26 -3.18 120.51 115.65 2win n ALA 614 Ca 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 53.44 53.32 2win n ALA 614 Cb 0.40 -1.42 -0.14 0.00 0.00 0.00 0.00 19.45 18.29 2win n ALA 614 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2win n GLY 615 N 0.73 -0.82 0.15 0.00 0.00 -0.78 -3.64 105.19 100.82 2win n GLY 615 Ca 0.04 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 2win n GLY 615 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2win h VAL 616 N 0.02 1.04 0.05 1.61 2.07 -1.19 0.11 116.25 119.96 2win h VAL 616 Ca -0.38 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 2win h VAL 616 Cb 2.04 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2win h VAL 616 CO 0.06 0.07 -0.03 -0.26 0.02 0.00 0.00 177.57 177.44 2win h PHE 617 N 0.39 -0.07 -0.82 1.57 0.04 -1.74 -2.89 116.94 113.41 2win h PHE 617 Ca 0.13 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.87 2win h PHE 617 Cb -0.00 0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.13 2win h PHE 617 CO -0.07 0.17 0.41 0.77 -0.60 0.00 0.00 178.31 178.99 2win h SER 618 N -0.30 1.06 0.00 2.17 0.02 -1.50 0.33 113.55 115.32 2win h SER 618 Ca -0.01 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2win h SER 618 Cb 0.27 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2win h SER 618 CO 0.01 0.88 0.00 0.47 -1.14 0.00 0.00 176.83 177.05 2win n ASP 619 N -4.32 0.00 0.00 3.07 8.00 0.36 -2.49 116.55 121.17 2win n ASP 619 Ca 0.08 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.50 2win n ASP 619 Cb 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.23 2win n ASP 619 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2win n ALA 620 N -0.86 2.27 -1.64 2.24 0.00 -0.51 -2.87 120.51 119.15 2win n ALA 620 Ca 0.15 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2win n ALA 620 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2win n ALA 620 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2win n GLY 621 N -0.01 0.50 3.30 0.00 0.00 -0.76 -4.52 105.19 103.69 2win n GLY 621 Ca 0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.53 2win n GLY 621 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2win s LEU 622 N -1.53 1.10 -0.07 0.99 1.43 -0.01 -1.99 118.68 118.60 2win s LEU 622 Ca 0.00 -0.86 0.01 0.00 -1.03 0.00 0.00 54.13 52.25 2win s LEU 622 Cb 0.00 1.10 0.02 0.00 0.03 0.00 0.00 46.19 47.34 2win s LEU 622 CO 0.00 -0.85 -0.06 0.42 0.23 0.00 0.00 176.35 176.09 2win s THR 623 N -3.96 0.71 -0.11 5.49 -4.23 -0.28 -3.23 115.64 110.03 2win s THR 623 Ca 0.16 -0.17 -0.02 0.00 -1.18 0.00 0.00 61.69 60.47 2win s THR 623 Cb 0.04 -0.74 -0.03 0.00 1.34 0.00 0.00 72.50 73.11 2win s THR 623 CO -0.02 0.28 -0.02 0.12 -0.54 0.00 0.00 174.62 174.45 2win s PHE 624 N 1.23 3.09 -0.18 3.99 5.36 -1.26 -2.77 117.98 127.44 2win s PHE 624 Ca -0.06 0.02 -0.08 0.00 -0.96 0.00 0.00 56.93 55.86 2win s PHE 624 Cb -0.14 -1.85 0.07 0.00 -0.34 0.00 0.00 43.02 40.77 2win s PHE 624 CO -0.02 0.28 0.40 0.99 -1.46 0.00 0.00 175.22 175.41 2win s THR 625 N -0.42 -0.33 0.38 0.12 2.01 -0.82 -1.67 115.64 114.91 2win s THR 625 Ca 0.07 0.14 0.05 0.00 0.31 0.00 0.00 61.69 62.26 2win s THR 625 Cb -0.12 -0.62 -0.06 0.00 0.01 0.00 0.00 72.50 71.70 2win s THR 625 CO 0.02 0.06 0.04 -0.94 -0.69 0.00 0.00 174.62 173.11 2win s SER 626 N 2.02 3.09 0.00 3.53 1.04 -1.15 -0.24 113.70 121.98 2win s SER 626 Ca -0.05 -1.41 0.29 0.00 0.48 0.00 0.00 55.95 55.25 2win s SER 626 Cb -0.10 -0.12 1.19 0.00 0.10 0.00 0.00 66.02 67.09 2win s SER 626 CO -0.12 -0.59 1.87 -1.54 0.98 0.00 0.00 173.24 173.84 2win n SER 627 N -0.87 0.13 0.04 7.02 3.41 -0.35 -3.40 113.62 119.59 2win n SER 627 Ca -0.05 0.14 -0.02 0.00 -0.26 0.00 0.00 58.87 58.68 2win n SER 627 Cb 0.67 -0.30 -0.08 0.00 -0.26 0.00 0.00 64.21 64.24 2win n SER 627 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2win h SER 628 N 0.07 0.00 0.00 4.04 0.02 -1.93 -3.49 113.55 112.26 2win h SER 628 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2win h SER 628 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2win h SER 628 CO 0.00 0.68 0.00 0.61 -1.14 0.00 0.00 176.83 176.98 2win n GLY 629 N 1.40 1.28 3.58 -3.77 0.00 -1.22 -5.08 105.19 101.38 2win n GLY 629 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 2win n GLY 629 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2win s GLN 630 N 0.00 2.90 0.35 1.61 1.11 -1.26 -4.82 119.66 119.55 2win s GLN 630 Ca 0.00 1.46 0.04 0.00 0.01 0.00 0.00 55.36 56.87 2win s GLN 630 Cb 0.00 -4.36 -0.06 0.00 -1.01 0.00 0.00 33.01 27.58 2win s GLN 630 CO 0.00 -2.37 0.06 1.14 0.01 0.00 0.00 175.29 174.13 2win s GLN 631 N 6.62 1.72 0.64 2.91 -2.07 -1.26 -2.95 119.66 125.27 2win s GLN 631 Ca 0.87 -1.97 0.00 0.00 -1.82 0.00 0.00 55.36 52.44 2win s GLN 631 Cb -0.23 -0.91 0.08 0.00 -1.09 0.00 0.00 33.01 30.86 2win s GLN 631 CO 0.30 -0.22 0.89 0.95 -1.32 0.00 0.00 175.29 175.89 2win s THR 632 N -3.23 2.39 0.13 3.63 -4.23 -0.67 -4.73 115.64 108.92 2win s THR 632 Ca 0.34 -0.62 -0.31 0.00 -1.18 0.00 0.00 61.69 59.92 2win s THR 632 Cb 0.08 -2.77 -0.07 0.00 1.34 0.00 0.00 72.50 71.08 2win s THR 632 CO 0.15 0.00 1.28 0.00 -0.54 0.00 0.00 174.62 175.51 2win s ALA 633 N -2.95 3.49 0.08 3.99 0.00 -1.25 -4.95 121.76 120.16 2win s ALA 633 Ca 0.62 1.00 -0.31 0.00 0.00 0.00 0.00 51.96 53.27 2win s ALA 633 Cb -0.08 -3.47 -0.10 0.00 0.00 0.00 0.00 23.12 19.47 2win s ALA 633 CO 0.41 -0.49 1.91 0.94 0.00 0.00 0.00 175.76 178.53 2win n GLN 634 N 3.41 2.83 -3.98 0.00 7.27 -1.26 -4.98 117.38 120.67 2win n GLN 634 Ca 0.08 1.04 -0.35 0.00 0.07 0.00 0.00 57.00 57.84 2win n GLN 634 Cb 0.44 -2.96 -0.11 0.00 2.41 0.00 0.00 30.24 30.01 2win n GLN 634 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 2win s ARG 635 N 3.65 3.79 -0.04 3.69 3.52 -1.26 -4.96 118.95 127.34 2win s ARG 635 Ca 0.86 -0.43 0.08 0.00 -0.13 0.00 0.00 55.73 56.11 2win s ARG 635 Cb -0.46 -3.21 0.15 0.00 -1.56 0.00 0.00 34.95 29.87 2win s ARG 635 CO 0.40 0.08 1.07 0.00 -0.81 0.00 0.00 175.30 176.04 2win n ALA 636 N 4.10 2.20 -3.58 6.12 0.00 -1.26 -4.45 120.51 123.63 2win n ALA 636 Ca -0.16 -1.66 -0.27 0.00 0.00 0.00 0.00 53.44 51.35 2win n ALA 636 Cb 0.52 -0.51 -0.17 0.00 0.00 0.00 0.00 19.45 19.30 2win n ALA 636 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2win s GLU 637 N -0.75 1.95 0.00 0.00 2.56 -1.26 -4.97 118.70 116.23 2win s GLU 637 Ca 0.14 -0.47 -0.01 0.00 0.00 0.00 0.00 54.97 54.62 2win s GLU 637 Cb 0.14 -1.67 -0.00 0.00 2.00 0.00 0.00 34.13 34.60 2win s GLU 637 CO -0.02 -0.04 1.01 -0.07 -0.56 0.00 0.00 175.26 175.58 2win h LEU 638 N 7.29 -0.03-10.27 2.70 3.38 -1.98 -3.44 115.31 112.95 2win h LEU 638 Ca -0.30 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.15 2win h LEU 638 Cb 1.18 0.01 0.17 0.00 0.09 0.00 0.00 40.66 42.11 2win h LEU 638 CO 0.47 -0.02 0.27 -1.10 0.09 0.00 0.00 178.44 178.15 2win s GLN 639 N -3.06 1.48 1.16 1.13 1.11 -1.26 -5.02 119.66 115.20 2win s GLN 639 Ca -0.00 1.47 -0.15 0.00 0.01 0.00 0.00 55.36 56.68 2win s GLN 639 Cb 0.00 -1.79 0.27 0.00 -1.01 0.00 0.00 33.01 30.48 2win s GLN 639 CO 0.01 -2.27 1.05 0.00 0.01 0.00 0.00 175.29 174.09 2win n PRO 641 N -4.75 1.94 -1.53 0.00 -0.02 -1.26 -4.82 135.00 124.55 2win n PRO 641 Ca 0.07 0.69 -0.47 0.00 -2.02 0.00 0.00 63.50 61.77 2win n PRO 641 Cb 0.57 -2.34 -0.05 0.00 -0.02 0.00 0.00 33.50 31.66 2win n PRO 641 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2win n GLN 642 N 2.17 1.55 -1.49 -0.52 6.02 -1.26 -4.73 117.38 119.13 2win n GLN 642 Ca 0.13 0.44 -0.19 0.00 -0.01 0.00 0.00 57.00 57.37 2win n GLN 642 Cb 0.30 -2.81 -0.18 0.00 1.02 0.00 0.00 30.24 28.57 2win n GLN 642 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2win n PRO 643 N 8.31 0.13 -1.19 -1.09 -0.02 -1.26 -4.75 135.00 135.12 2win n PRO 643 Ca 0.35 -0.23 -0.20 0.00 -2.02 0.00 0.00 63.50 61.40 2win n PRO 643 Cb 0.33 -1.67 -0.06 0.00 -0.02 0.00 0.00 33.50 32.07 2win n PRO 643 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2win n ALA 644 N 8.75 6.03 0.00 3.55 0.00 -1.26 -5.31 120.51 132.27 2win n ALA 644 Ca 0.59 -2.29 0.00 0.00 0.00 0.00 0.00 53.44 51.74 2win n ALA 644 Cb 0.23 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.71 2win n ALA 644 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50