#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1klg s HIS 5 N 0.00 -0.11 -0.04 -0.32 3.76 -1.26 -5.15 115.29 112.17 1klg s HIS 5 Ca 0.00 0.22 0.02 0.00 -0.15 0.00 0.00 55.06 55.15 1klg s HIS 5 Cb 0.00 0.07 0.01 0.00 1.11 0.00 0.00 32.58 33.77 1klg s HIS 5 CO 0.00 -0.06 -0.08 0.08 -0.85 0.00 0.00 174.74 173.84 1klg s VAL 6 N 1.14 0.74 -0.16 -0.90 1.01 -1.26 -5.01 120.40 115.96 1klg s VAL 6 Ca -0.08 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 1klg s VAL 6 Cb -0.02 -0.70 -0.00 0.00 0.00 0.00 0.00 36.38 35.66 1klg s VAL 6 CO -0.11 0.25 -0.14 -0.63 0.00 0.00 0.00 175.10 174.48 1klg s ILE 7 N 0.57 2.74 -0.06 2.22 1.09 -1.26 -0.72 121.20 125.78 1klg s ILE 7 Ca -0.09 -0.74 0.05 0.00 -1.10 0.00 0.00 60.65 58.77 1klg s ILE 7 Cb -0.12 -2.17 -0.01 0.00 -1.06 0.00 0.00 42.46 39.10 1klg s ILE 7 CO 0.01 0.51 -0.22 -0.63 -0.10 0.00 0.00 174.94 174.50 1klg s ILE 8 N 0.90 1.85 -0.43 2.92 1.01 0.21 -4.94 121.20 122.72 1klg s ILE 8 Ca -0.03 -0.95 -0.11 0.00 0.00 0.00 0.00 60.65 59.56 1klg s ILE 8 Cb -0.15 -1.58 0.07 0.00 0.01 0.00 0.00 42.46 40.82 1klg s ILE 8 CO -0.01 0.52 0.29 -1.58 0.00 0.00 0.00 174.94 174.16 1klg s GLN 9 N -0.04 2.72 -0.09 2.79 0.74 -1.26 0.59 119.66 125.11 1klg s GLN 9 Ca -0.05 -1.41 0.01 0.00 0.05 0.00 0.00 55.36 53.96 1klg s GLN 9 Cb -0.13 -3.87 -0.02 0.00 1.10 0.00 0.00 33.01 30.08 1klg s GLN 9 CO 0.04 -0.96 -0.12 0.00 -0.55 0.00 0.00 175.29 173.70 1klg s ALA 10 N 1.49 2.74 0.05 1.58 0.00 -0.08 -5.00 121.76 122.54 1klg s ALA 10 Ca 0.03 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 1klg s ALA 10 Cb -0.23 -1.14 -0.02 0.00 0.00 0.00 0.00 23.12 21.73 1klg s ALA 10 CO 0.04 0.44 0.03 -1.83 0.00 0.00 0.00 175.76 174.44 1klg s GLU 11 N -0.34 0.59 0.19 0.00 -1.05 -1.26 -1.23 118.70 115.60 1klg s GLU 11 Ca 0.04 -0.96 -0.20 0.00 -0.15 0.00 0.00 54.97 53.70 1klg s GLU 11 Cb -0.13 0.22 0.04 0.00 -0.44 0.00 0.00 34.13 33.83 1klg s GLU 11 CO 0.02 -0.13 0.57 -0.59 0.95 0.00 0.00 175.26 176.08 1klg s PHE 12 N -3.16 -0.30 -0.08 4.83 -0.12 -0.84 -4.99 117.98 113.32 1klg s PHE 12 Ca -0.00 -0.01 -0.04 0.00 -0.05 0.00 0.00 56.93 56.83 1klg s PHE 12 Cb 0.02 0.49 0.04 0.00 -0.63 0.00 0.00 43.02 42.95 1klg s PHE 12 CO -0.07 -0.92 0.19 -0.47 -0.05 0.00 0.00 175.22 173.90 1klg s TYR 13 N -3.83 -0.23 -0.16 3.49 5.04 -1.26 -1.73 117.35 118.68 1klg s TYR 13 Ca 0.06 0.61 0.00 0.00 -2.44 0.00 0.00 57.07 55.30 1klg s TYR 13 Cb -0.01 -0.03 -0.00 0.00 0.35 0.00 0.00 41.96 42.26 1klg s TYR 13 CO -0.06 -0.19 -0.15 -1.17 -1.34 0.00 0.00 175.55 172.63 1klg s LEU 14 N 1.21 2.48 0.08 6.97 2.96 0.19 -4.96 118.68 127.60 1klg s LEU 14 Ca -0.09 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.38 1klg s LEU 14 Cb -0.11 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 1klg s LEU 14 CO -0.07 0.08 0.06 0.20 -1.32 0.00 0.00 176.35 175.29 1klg s ASN 15 N 0.87 5.38 -0.04 3.68 0.01 -1.26 0.10 114.94 123.68 1klg s ASN 15 Ca -0.04 -0.05 0.15 0.00 -0.71 0.00 0.00 52.86 52.21 1klg s ASN 15 Cb -0.15 -1.40 0.52 0.00 0.41 0.00 0.00 41.25 40.62 1klg s ASN 15 CO -0.01 0.18 1.41 -0.81 -1.51 0.00 0.00 177.10 176.36 1klg n PRO 16 N 0.52 2.66 0.19 -0.60 -0.04 -1.26 -4.84 135.00 131.64 1klg n PRO 16 Ca -0.09 -2.07 0.14 0.00 -0.04 0.00 0.00 63.50 61.44 1klg n PRO 16 Cb 0.52 -1.58 0.60 0.00 -0.04 0.00 0.00 33.50 32.99 1klg n PRO 16 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1klg h ASP 17 N 3.17 0.00 -6.27 3.54 5.19 -1.99 -3.46 116.42 116.60 1klg h ASP 17 Ca 0.00 0.00 -0.46 0.00 -0.62 0.00 0.00 57.03 55.95 1klg h ASP 17 Cb 0.94 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.44 1klg h ASP 17 CO 0.09 0.00 -0.80 0.00 -3.12 0.00 0.00 179.24 175.41 1klg n GLN 18 N -2.57 -5.00 -3.32 3.56 10.64 0.28 -4.97 117.38 116.00 1klg n GLN 18 Ca 0.01 0.58 -0.38 0.00 -1.83 0.00 0.00 57.00 55.38 1klg n GLN 18 Cb 0.24 -5.27 -0.06 0.00 -0.86 0.00 0.00 30.24 24.29 1klg n GLN 18 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 1klg s SER 19 N -3.77 6.84 0.04 2.61 0.01 -0.85 -4.88 113.70 113.69 1klg s SER 19 Ca 0.38 1.00 0.02 0.00 1.31 0.00 0.00 55.95 58.66 1klg s SER 19 Cb -0.19 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.71 1klg s SER 19 CO 0.83 0.13 -0.08 -0.83 0.41 0.00 0.00 173.24 173.71 1klg s GLY 20 N -0.19 0.49 0.00 3.44 0.00 -1.26 0.53 107.32 110.33 1klg s GLY 20 Ca 0.27 -0.73 -0.12 0.00 0.00 0.00 0.00 44.72 44.14 1klg s GLY 20 CO 0.14 -0.77 0.26 1.85 0.00 0.00 0.00 173.10 174.57 1klg s GLU 21 N -1.48 0.64 -0.21 2.90 2.12 -0.70 -4.95 118.70 117.01 1klg s GLU 21 Ca -0.09 -0.32 -0.04 0.00 0.36 0.00 0.00 54.97 54.88 1klg s GLU 21 Cb -0.09 0.28 0.11 0.00 0.26 0.00 0.00 34.13 34.68 1klg s GLU 21 CO 0.00 -0.18 0.29 0.12 -0.54 0.00 0.00 175.26 174.96 1klg s PHE 22 N -1.61 -0.53 0.11 5.30 2.19 -1.26 -1.99 117.98 120.19 1klg s PHE 22 Ca -0.12 0.57 -0.02 0.00 0.33 0.00 0.00 56.93 57.69 1klg s PHE 22 Cb -0.05 -0.16 -0.04 0.00 -1.31 0.00 0.00 43.02 41.46 1klg s PHE 22 CO 0.02 -0.63 0.05 0.00 1.83 0.00 0.00 175.22 176.49 1klg s MET 23 N 2.43 0.85 -0.05 10.12 0.23 -0.36 -0.95 119.30 131.58 1klg s MET 23 Ca 0.09 -1.35 0.04 0.00 -1.03 0.00 0.00 55.69 53.44 1klg s MET 23 Cb -0.15 0.24 -0.02 0.00 -1.53 0.00 0.00 34.83 33.37 1klg s MET 23 CO -0.13 -0.23 -0.17 -0.06 -2.03 0.00 0.00 175.02 172.39 1klg s PHE 24 N -4.01 2.62 0.00 3.16 0.40 -0.44 -0.90 117.98 118.81 1klg s PHE 24 Ca 0.19 -0.29 0.06 0.00 -0.60 0.00 0.00 56.93 56.29 1klg s PHE 24 Cb 0.07 -1.62 -0.02 0.00 0.51 0.00 0.00 43.02 41.97 1klg s PHE 24 CO -0.02 0.08 -0.19 0.34 0.70 0.00 0.00 175.22 176.14 1klg s ASP 25 N -0.58 2.19 -0.16 1.36 -1.08 0.20 -0.83 116.67 117.76 1klg s ASP 25 Ca 0.08 -0.38 -0.01 0.00 -0.52 0.00 0.00 52.55 51.73 1klg s ASP 25 Cb -0.11 -0.22 0.04 0.00 -1.46 0.00 0.00 42.92 41.17 1klg s ASP 25 CO 0.01 0.20 -0.04 0.12 0.52 0.00 0.00 175.17 175.98 1klg s PHE 26 N -0.53 1.59 -1.48 -5.34 5.36 0.34 0.64 117.98 118.55 1klg s PHE 26 Ca 0.07 -1.02 -0.15 0.00 -0.96 0.00 0.00 56.93 54.86 1klg s PHE 26 Cb -0.07 -1.26 0.13 0.00 -0.34 0.00 0.00 43.02 41.48 1klg s PHE 26 CO -0.00 -0.60 0.62 -0.25 -1.46 0.00 0.00 175.22 173.52 1klg n ASP 27 N 4.90 -3.08 0.00 6.13 8.00 0.10 -0.37 116.55 132.23 1klg n ASP 27 Ca -0.11 -0.74 0.00 0.00 0.71 0.00 0.00 54.79 54.64 1klg n ASP 27 Cb 0.48 -2.56 0.00 0.00 -0.02 0.00 0.00 41.12 39.02 1klg n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1klg n GLY 28 N -1.21 1.61 3.67 0.44 0.00 -1.26 -5.03 105.19 103.41 1klg n GLY 28 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1klg n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1klg s ASP 29 N -3.08 5.40 0.05 1.61 1.01 0.50 -5.04 116.67 117.11 1klg s ASP 29 Ca 0.00 0.13 -0.31 0.00 0.71 0.00 0.00 52.55 53.09 1klg s ASP 29 Cb 0.00 -1.69 -0.06 0.00 1.01 0.00 0.00 42.92 42.18 1klg s ASP 29 CO 0.00 0.31 1.40 -0.70 0.21 0.00 0.00 175.17 176.40 1klg s GLU 30 N -0.47 4.30 -0.05 8.23 2.12 -1.26 -0.51 118.70 131.06 1klg s GLU 30 Ca 0.09 2.02 -0.13 0.00 0.36 0.00 0.00 54.97 57.30 1klg s GLU 30 Cb -0.12 -3.46 -0.31 0.00 0.26 0.00 0.00 34.13 30.51 1klg s GLU 30 CO 0.02 -0.52 0.70 0.82 -0.54 0.00 0.00 175.26 175.74 1klg h ILE 31 N 4.67 1.03 -1.85 -3.70 2.04 -1.33 -3.40 117.51 114.97 1klg h ILE 31 Ca -0.40 -2.51 0.37 0.00 1.00 0.00 0.00 64.86 63.32 1klg h ILE 31 Cb 1.19 2.82 -0.09 0.00 -0.74 0.00 0.00 36.82 40.00 1klg h ILE 31 CO 0.89 0.81 0.94 0.72 0.00 0.00 0.00 178.15 181.51 1klg s PHE 32 N -2.55 0.01 0.16 1.37 -0.12 -1.21 -2.06 117.98 113.58 1klg s PHE 32 Ca -0.16 -0.08 -0.15 0.00 -0.05 0.00 0.00 56.93 56.49 1klg s PHE 32 Cb 0.05 0.54 0.02 0.00 -0.63 0.00 0.00 43.02 42.99 1klg s PHE 32 CO 0.85 -0.17 0.43 -3.38 -0.05 0.00 0.00 175.22 172.90 1klg s HIS 33 N -2.07 -0.03 -0.19 3.49 -3.43 -0.88 -1.33 115.29 110.84 1klg s HIS 33 Ca 0.26 -0.31 -0.08 0.00 -0.80 0.00 0.00 55.06 54.13 1klg s HIS 33 Cb 0.02 0.25 -0.04 0.00 -1.43 0.00 0.00 32.58 31.37 1klg s HIS 33 CO -0.03 -0.80 0.08 0.08 -2.00 0.00 0.00 174.74 172.07 1klg s VAL 34 N -3.87 4.92 -0.40 -5.38 1.01 -0.12 -0.82 120.40 115.74 1klg s VAL 34 Ca 0.09 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.79 1klg s VAL 34 Cb 0.01 -3.23 0.02 0.00 0.00 0.00 0.00 36.38 33.18 1klg s VAL 34 CO -0.05 0.45 1.24 -0.62 0.00 0.00 0.00 175.10 176.12 1klg s ASP 35 N 0.42 6.59 0.21 3.32 -1.08 -0.11 -4.64 116.67 121.40 1klg s ASP 35 Ca 0.04 0.79 0.23 0.00 -0.52 0.00 0.00 52.55 53.10 1klg s ASP 35 Cb -0.12 -2.54 0.92 0.00 -1.46 0.00 0.00 42.92 39.72 1klg s ASP 35 CO -0.00 -1.22 1.70 0.23 0.52 0.00 0.00 175.17 176.40 1klg n MET 36 N 7.68 0.18 -0.09 4.34 2.81 -1.26 -0.28 117.12 130.50 1klg n MET 36 Ca 0.14 0.36 -0.23 0.00 -1.81 0.00 0.00 57.70 56.15 1klg n MET 36 Cb 0.48 -1.81 -0.12 0.00 -0.71 0.00 0.00 33.22 31.06 1klg n MET 36 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1klg n ALA 37 N -1.74 1.00 0.97 3.04 0.00 -1.26 -4.20 120.51 118.32 1klg n ALA 37 Ca 0.03 -0.75 0.14 0.00 0.00 0.00 0.00 53.44 52.86 1klg n ALA 37 Cb 0.26 -0.36 0.54 0.00 0.00 0.00 0.00 19.45 19.89 1klg n ALA 37 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1klg n LYS 38 N -4.01 0.02 -3.73 0.00 5.02 -1.22 -4.93 118.16 109.31 1klg n LYS 38 Ca -0.40 0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 55.67 1klg n LYS 38 Cb 0.86 -1.52 0.02 0.00 -0.02 0.00 0.00 35.03 34.37 1klg n LYS 38 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1klg n LYS 39 N -1.56 -3.75 -3.94 1.97 5.02 0.61 -4.99 118.16 111.51 1klg n LYS 39 Ca 0.07 0.55 -0.08 0.00 -2.02 0.00 0.00 58.31 56.82 1klg n LYS 39 Cb 0.35 -4.87 -0.08 0.00 -0.02 0.00 0.00 35.03 30.40 1klg n LYS 39 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1klg s GLU 40 N -6.03 0.83 -0.02 1.97 -1.05 -1.16 -4.67 118.70 108.58 1klg s GLU 40 Ca 0.11 -1.08 -0.27 0.00 -0.15 0.00 0.00 54.97 53.58 1klg s GLU 40 Cb -0.03 0.31 -0.04 0.00 -0.44 0.00 0.00 34.13 33.93 1klg s GLU 40 CO 0.83 -0.25 0.84 0.99 0.95 0.00 0.00 175.26 178.63 1klg s THR 41 N -3.90 4.91 -0.28 1.83 2.01 -1.26 -0.93 115.64 118.01 1klg s THR 41 Ca 0.08 1.77 0.02 0.00 0.31 0.00 0.00 61.69 63.87 1klg s THR 41 Cb 0.06 -4.19 0.07 0.00 0.01 0.00 0.00 72.50 68.45 1klg s THR 41 CO -0.09 0.23 -0.06 0.68 -0.69 0.00 0.00 174.62 174.69 1klg s VAL 42 N 0.75 2.35 0.18 3.82 -7.23 -0.00 -4.93 120.40 115.34 1klg s VAL 42 Ca 0.44 -1.72 -0.30 0.00 -1.81 0.00 0.00 61.98 58.60 1klg s VAL 42 Cb -0.20 -2.44 -0.08 0.00 0.56 0.00 0.00 36.38 34.23 1klg s VAL 42 CO 0.24 -0.15 1.06 0.26 -0.31 0.00 0.00 175.10 176.20 1klg s TRP 43 N 1.10 3.68 0.20 2.82 0.52 -1.26 -2.07 118.94 123.93 1klg s TRP 43 Ca -0.05 1.68 -0.10 0.00 0.02 0.00 0.00 56.10 57.65 1klg s TRP 43 Cb -0.20 -3.20 0.23 0.00 -1.15 0.00 0.00 33.47 29.15 1klg s TRP 43 CO -0.05 -0.33 1.79 -0.09 0.02 0.00 0.00 176.95 178.30 1klg h ARG 44 N 4.97 0.59 -5.23 4.98 9.65 -1.63 -3.38 114.38 124.33 1klg h ARG 44 Ca -0.44 -0.04 -0.67 0.00 -1.10 0.00 0.00 59.98 57.73 1klg h ARG 44 Cb 1.21 -0.13 -0.33 0.00 -1.39 0.00 0.00 29.97 29.33 1klg h ARG 44 CO 0.71 0.39 -0.86 -0.51 2.80 0.00 0.00 179.97 182.50 1klg s LEU 45 N -10.28 2.17 0.27 3.80 1.43 -1.26 -5.02 118.68 109.78 1klg s LEU 45 Ca -0.13 -0.57 -0.04 0.00 -1.03 0.00 0.00 54.13 52.36 1klg s LEU 45 Cb 0.16 -1.46 0.53 0.00 0.03 0.00 0.00 46.19 45.45 1klg s LEU 45 CO 0.75 0.10 1.45 1.21 0.23 0.00 0.00 176.35 180.09 1klg n GLU 46 N 3.95 -0.08 -0.26 1.70 2.13 -1.26 -0.54 120.64 126.29 1klg n GLU 46 Ca -0.20 1.43 0.19 0.00 0.66 0.00 0.00 57.16 59.24 1klg n GLU 46 Cb 0.52 -2.18 0.50 0.00 0.27 0.00 0.00 31.44 30.54 1klg n GLU 46 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 1klg h GLU 47 N 0.00 0.42 -0.79 5.31 4.11 -1.95 -2.33 114.58 119.36 1klg h GLU 47 Ca 0.49 -0.03 0.05 0.00 0.07 0.00 0.00 59.36 59.95 1klg h GLU 47 Cb 0.85 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.95 1klg h GLU 47 CO -0.93 0.28 0.48 0.74 0.07 0.00 0.00 179.01 179.65 1klg h PHE 48 N 0.44 0.89 0.00 2.06 0.04 -1.21 -1.51 116.94 117.64 1klg h PHE 48 Ca 0.48 0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.28 1klg h PHE 48 Cb 1.17 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 39.03 1klg h PHE 48 CO -0.00 0.46 0.01 0.41 -0.60 0.00 0.00 178.31 178.58 1klg n GLY 49 N -1.31 -0.66 0.08 -1.45 0.00 -0.88 -1.07 105.19 99.90 1klg n GLY 49 Ca 0.10 0.09 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 1klg n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1klg n ARG 50 N -1.84 0.65 0.00 1.61 1.74 -0.58 -4.25 116.66 113.99 1klg n ARG 50 Ca -0.01 0.10 0.12 0.00 -0.77 0.00 0.00 57.85 57.29 1klg n ARG 50 Cb 0.02 -1.68 0.13 0.00 -1.02 0.00 0.00 32.46 29.91 1klg n ARG 50 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1klg n PHE 51 N -2.77 0.00 -3.89 -1.55 3.72 -0.23 -5.00 117.46 107.74 1klg n PHE 51 Ca -0.17 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.15 1klg n PHE 51 Cb 0.92 -0.06 -0.01 0.00 -0.94 0.00 0.00 39.48 39.39 1klg n PHE 51 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1klg s ALA 52 N -2.57 -0.73 0.21 4.37 0.00 -0.70 -5.11 121.76 117.23 1klg s ALA 52 Ca 0.19 -0.65 -0.07 0.00 0.00 0.00 0.00 51.96 51.43 1klg s ALA 52 Cb 0.18 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 24.14 1klg s ALA 52 CO 0.59 -0.97 0.29 -1.54 0.00 0.00 0.00 175.76 174.13 1klg s SER 53 N -3.01 0.05 -0.27 0.00 1.04 -1.26 -4.57 113.70 105.67 1klg s SER 53 Ca 0.16 -1.11 -0.23 0.00 0.48 0.00 0.00 55.95 55.25 1klg s SER 53 Cb -0.04 0.46 0.07 0.00 0.10 0.00 0.00 66.02 66.61 1klg s SER 53 CO 0.10 -0.96 0.72 0.12 0.98 0.00 0.00 173.24 174.20 1klg s PHE 54 N -4.07 -0.84 -0.86 5.02 5.36 -1.26 -5.10 117.98 116.24 1klg s PHE 54 Ca 0.28 1.95 -0.22 0.00 -0.96 0.00 0.00 56.93 57.98 1klg s PHE 54 Cb 0.03 0.35 0.08 0.00 -0.34 0.00 0.00 43.02 43.14 1klg s PHE 54 CO 0.08 -0.41 1.20 -1.21 -1.46 0.00 0.00 175.22 173.42 1klg s GLU 55 N 0.64 3.42 0.24 10.12 0.41 -1.26 -4.83 118.70 127.45 1klg s GLU 55 Ca -0.02 -1.14 -0.05 0.00 -0.41 0.00 0.00 54.97 53.35 1klg s GLU 55 Cb -0.05 -4.77 0.45 0.00 -1.78 0.00 0.00 34.13 27.98 1klg s GLU 55 CO -0.04 -1.96 1.71 0.00 -0.49 0.00 0.00 175.26 174.48 1klg h ALA 56 N 9.45 0.99 -0.92 5.21 0.00 -1.94 -0.54 119.26 131.52 1klg h ALA 56 Ca -0.00 0.14 0.24 0.00 0.00 0.00 0.00 54.91 55.28 1klg h ALA 56 Cb 1.04 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1klg h ALA 56 CO 1.24 -0.27 0.63 1.96 0.00 0.00 0.00 179.25 182.81 1klg h GLN 57 N 0.36 0.22 0.00 0.00 1.08 -1.89 0.15 115.11 115.02 1klg h GLN 57 Ca 0.41 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.57 1klg h GLN 57 Cb 0.65 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1klg h GLN 57 CO -0.44 0.14 -0.14 0.78 -0.95 0.00 0.00 178.83 178.22 1klg h GLY 58 N 0.23 0.00 1.84 3.46 0.00 -1.50 -1.21 103.07 105.89 1klg h GLY 58 Ca 0.47 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.63 1klg h GLY 58 CO -0.12 0.00 -0.74 0.00 0.00 0.00 0.00 176.54 175.69 1klg h ALA 59 N 1.86 0.72 0.00 3.60 0.00 -0.83 -2.93 119.26 121.68 1klg h ALA 59 Ca -0.00 -0.64 -0.05 0.00 0.00 0.00 0.00 54.91 54.22 1klg h ALA 59 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1klg h ALA 59 CO 0.02 0.84 -0.23 -0.07 0.00 0.00 0.00 179.25 179.82 1klg h LEU 60 N 0.10 0.00 -0.02 0.00 -0.00 -1.19 -0.24 115.31 113.96 1klg h LEU 60 Ca -0.02 0.00 -0.10 0.00 -0.00 0.00 0.00 57.88 57.76 1klg h LEU 60 Cb 1.30 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.96 1klg h LEU 60 CO 0.11 0.23 -0.37 0.00 -0.00 0.00 0.00 178.44 178.41 1klg h ALA 61 N 1.77 0.07 -0.48 1.53 0.00 -1.32 -3.02 119.26 117.82 1klg h ALA 61 Ca -0.00 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1klg h ALA 61 Cb 0.57 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1klg h ALA 61 CO 0.03 0.19 0.27 -0.91 0.00 0.00 0.00 179.25 178.82 1klg h ASN 62 N -0.29 0.60 -0.92 0.00 4.21 -1.30 -2.65 115.58 115.23 1klg h ASN 62 Ca -0.04 -0.09 0.08 0.00 1.21 0.00 0.00 56.30 57.46 1klg h ASN 62 Cb 1.08 -0.15 -0.06 0.00 -1.12 0.00 0.00 38.32 38.06 1klg h ASN 62 CO 0.07 0.52 0.59 0.40 -1.29 0.00 0.00 177.43 177.73 1klg h ILE 63 N 0.64 1.03 -0.38 2.81 1.08 -1.12 0.25 117.51 121.83 1klg h ILE 63 Ca 0.17 -0.34 -0.02 0.00 -0.39 0.00 0.00 64.86 64.28 1klg h ILE 63 Cb 0.05 -0.06 -0.02 0.00 -3.07 0.00 0.00 36.82 33.72 1klg h ILE 63 CO -0.03 0.18 0.17 0.00 -0.69 0.00 0.00 178.15 177.79 1klg h ALA 64 N 1.52 0.49 -0.32 1.87 0.00 -1.34 -1.14 119.26 120.33 1klg h ALA 64 Ca 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1klg h ALA 64 Cb 0.27 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1klg h ALA 64 CO -0.16 0.06 0.17 0.28 0.00 0.00 0.00 179.25 179.60 1klg h VAL 65 N 0.47 1.14 -0.50 0.00 2.07 -0.90 -2.13 116.25 116.40 1klg h VAL 65 Ca 0.13 -0.38 0.10 0.00 0.82 0.00 0.00 66.70 67.37 1klg h VAL 65 Cb 0.14 0.80 -0.08 0.00 -1.52 0.00 0.00 31.29 30.63 1klg h VAL 65 CO -0.01 0.14 0.02 0.44 0.02 0.00 0.00 177.57 178.18 1klg h ASP 66 N 0.40 -0.18 0.24 0.57 3.32 -0.18 0.15 116.42 120.74 1klg h ASP 66 Ca 0.11 0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 1klg h ASP 66 Cb 0.08 0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1klg h ASP 66 CO -0.02 -0.06 -0.11 0.50 -1.72 0.00 0.00 179.24 177.83 1klg h LYS 67 N 0.14 -0.31 -0.92 3.56 3.64 -0.98 0.14 116.57 121.84 1klg h LYS 67 Ca 0.25 0.02 0.17 0.00 -1.27 0.00 0.00 60.65 59.83 1klg h LYS 67 Cb 0.38 0.07 -0.10 0.00 -0.41 0.00 0.00 32.23 32.17 1klg h LYS 67 CO -0.41 -0.16 0.50 0.00 -2.27 0.00 0.00 179.45 177.12 1klg h ALA 68 N 0.37 1.46 -0.58 5.00 0.00 -0.78 0.36 119.26 125.09 1klg h ALA 68 Ca -0.03 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1klg h ALA 68 Cb 0.29 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1klg h ALA 68 CO 0.05 -0.10 -0.01 -0.91 0.00 0.00 0.00 179.25 178.28 1klg h ASN 69 N 0.65 1.01 -0.53 0.00 2.35 -0.25 -2.35 115.58 116.46 1klg h ASN 69 Ca 0.52 -0.31 0.03 0.00 -0.55 0.00 0.00 56.30 56.00 1klg h ASN 69 Cb 0.81 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.87 1klg h ASN 69 CO -0.39 1.07 0.30 0.25 -1.65 0.00 0.00 177.43 177.01 1klg h LEU 70 N 0.91 0.47 -0.73 1.61 5.85 0.25 -0.47 115.31 123.21 1klg h LEU 70 Ca 0.16 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 1klg h LEU 70 Cb 0.56 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1klg h LEU 70 CO 0.03 0.33 0.39 -0.33 -0.34 0.00 0.00 178.44 178.52 1klg h GLU 71 N 0.59 1.02 -0.28 1.25 4.39 -0.88 0.20 114.58 120.87 1klg h GLU 71 Ca 0.22 -0.12 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 1klg h GLU 71 Cb 0.07 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1klg h GLU 71 CO -0.12 0.76 0.01 0.82 -1.16 0.00 0.00 179.01 179.33 1klg h ILE 72 N 1.00 1.25 -0.41 3.13 1.08 -0.86 -2.70 117.51 120.01 1klg h ILE 72 Ca 0.26 -0.89 -0.06 0.00 -0.39 0.00 0.00 64.86 63.78 1klg h ILE 72 Cb 0.04 1.27 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 1klg h ILE 72 CO -0.04 0.28 0.03 0.24 -0.69 0.00 0.00 178.15 177.97 1klg h MET 73 N 0.29 0.70 -0.18 2.37 2.86 -0.84 -1.53 114.93 118.60 1klg h MET 73 Ca 0.08 -0.21 0.05 0.00 -2.06 0.00 0.00 59.70 57.56 1klg h MET 73 Cb 0.40 -0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.92 1klg h MET 73 CO 0.01 0.77 -0.30 1.15 1.06 0.00 0.00 176.91 179.61 1klg h THR 74 N 0.54 0.32 -0.71 2.22 2.02 -0.59 -1.63 112.91 115.08 1klg h THR 74 Ca 0.12 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.33 1klg h THR 74 Cb 0.44 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 67.12 1klg h THR 74 CO 0.02 0.00 0.44 0.50 0.37 0.00 0.00 175.52 176.85 1klg h LYS 75 N -0.34 0.83 -0.00 6.66 3.64 -1.30 -0.53 116.57 125.53 1klg h LYS 75 Ca 0.11 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1klg h LYS 75 Cb 0.52 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1klg h LYS 75 CO -0.37 0.55 -0.00 2.89 -2.27 0.00 0.00 179.45 180.25 1klg n ARG 76 N -4.67 0.65 -0.23 1.90 1.85 -0.59 -1.86 116.66 113.70 1klg n ARG 76 Ca 0.08 -0.01 0.12 0.00 -1.00 0.00 0.00 57.85 57.04 1klg n ARG 76 Cb 0.10 -1.50 0.24 0.00 -1.05 0.00 0.00 32.46 30.25 1klg n ARG 76 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1klg n SER 77 N -1.17 3.61 -2.88 2.89 3.41 -0.67 -4.92 113.62 113.90 1klg n SER 77 Ca 0.18 -2.00 -0.17 0.00 -0.26 0.00 0.00 58.87 56.62 1klg n SER 77 Cb 0.20 -0.31 0.06 0.00 -0.26 0.00 0.00 64.21 63.90 1klg n SER 77 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1klg n ASN 78 N 1.56 -4.55 -3.73 4.04 4.13 -0.78 -3.19 115.26 112.73 1klg n ASN 78 Ca 0.21 -0.43 -0.24 0.00 1.68 0.00 0.00 54.58 55.80 1klg n ASN 78 Cb 0.62 -4.01 0.04 0.00 -1.54 0.00 0.00 39.78 34.89 1klg n ASN 78 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1klg n TYR 79 N -4.18 -2.11 -2.54 3.10 4.02 -0.24 -4.90 117.16 110.30 1klg n TYR 79 Ca -0.05 0.88 -0.43 0.00 -0.01 0.00 0.00 57.90 58.29 1klg n TYR 79 Cb 0.57 -4.38 -0.02 0.00 -0.02 0.00 0.00 39.34 35.49 1klg n TYR 79 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1klg s THR 80 N -3.52 4.17 0.71 -0.72 2.01 -1.19 -5.00 115.64 112.10 1klg s THR 80 Ca 0.22 1.23 -0.11 0.00 0.31 0.00 0.00 61.69 63.34 1klg s THR 80 Cb -0.11 -4.48 0.02 0.00 0.01 0.00 0.00 72.50 67.94 1klg s THR 80 CO 0.81 -0.87 1.07 -2.16 -0.69 0.00 0.00 174.62 172.77 1klg s PRO 81 N 4.45 2.79 0.44 4.92 0.04 -1.26 -5.03 135.00 141.34 1klg s PRO 81 Ca 0.51 0.90 -0.22 0.00 0.04 0.00 0.00 61.00 62.23 1klg s PRO 81 Cb -0.09 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 1klg s PRO 81 CO 0.30 -1.19 1.01 -1.50 0.04 0.00 0.00 177.00 175.66 1klg s ILE 82 N -3.06 3.96 -0.23 0.56 1.10 -1.26 -5.01 121.20 117.27 1klg s ILE 82 Ca 0.58 1.32 -0.19 0.00 -0.51 0.00 0.00 60.65 61.85 1klg s ILE 82 Cb -0.14 -3.59 -0.03 0.00 0.15 0.00 0.00 42.46 38.85 1klg s ILE 82 CO 0.55 -0.17 0.58 -0.89 -2.11 0.00 0.00 174.94 172.90 1klg s THR 83 N -1.92 5.04 0.08 4.00 2.01 -1.26 -5.02 115.64 118.57 1klg s THR 83 Ca 0.62 1.05 -0.31 0.00 0.31 0.00 0.00 61.69 63.37 1klg s THR 83 Cb -0.16 -3.89 -0.09 0.00 0.01 0.00 0.00 72.50 68.37 1klg s THR 83 CO 0.20 0.10 1.67 0.20 -0.69 0.00 0.00 174.62 176.10 1klg s ASN 84 N 1.33 6.58 -0.31 3.53 0.01 -1.26 -4.67 114.94 120.15 1klg s ASN 84 Ca 0.25 2.52 0.00 0.00 -0.71 0.00 0.00 52.86 54.93 1klg s ASN 84 Cb -0.16 -2.57 0.07 0.00 0.41 0.00 0.00 41.25 39.01 1klg s ASN 84 CO 0.09 -0.90 0.01 -0.69 -1.51 0.00 0.00 177.10 174.10 1klg s VAL 85 N 2.57 2.72 0.51 1.60 1.01 0.15 -4.77 120.40 124.18 1klg s VAL 85 Ca 0.74 -1.68 -0.22 0.00 0.00 0.00 0.00 61.98 60.82 1klg s VAL 85 Cb -0.41 -2.68 -0.07 0.00 0.00 0.00 0.00 36.38 33.22 1klg s VAL 85 CO 0.33 -0.24 1.10 -0.81 0.00 0.00 0.00 175.10 175.48 1klg n PRO 86 N 4.52 1.36 -2.53 2.72 -0.04 -1.26 -2.00 135.00 137.76 1klg n PRO 86 Ca -0.09 0.50 -0.33 0.00 -0.04 0.00 0.00 63.50 63.54 1klg n PRO 86 Cb 0.43 -2.24 -0.04 0.00 -0.04 0.00 0.00 33.50 31.60 1klg n PRO 86 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1klg s PRO 87 N -2.45 3.94 -0.30 0.54 0.04 -1.26 -4.54 135.00 130.96 1klg s PRO 87 Ca 0.68 1.13 -0.13 0.00 0.04 0.00 0.00 61.00 62.73 1klg s PRO 87 Cb -0.47 -2.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 1klg s PRO 87 CO 0.52 -0.29 0.28 -2.00 0.04 0.00 0.00 177.00 175.55 1klg s GLU 88 N -3.58 3.81 -0.12 4.56 2.12 0.24 -4.91 118.70 120.81 1klg s GLU 88 Ca 0.62 -0.31 -0.02 0.00 0.36 0.00 0.00 54.97 55.62 1klg s GLU 88 Cb -0.12 -3.71 -0.03 0.00 0.26 0.00 0.00 34.13 30.53 1klg s GLU 88 CO 0.23 -0.32 -0.06 0.08 -0.54 0.00 0.00 175.26 174.66 1klg s VAL 89 N 1.88 3.76 0.03 3.70 1.01 -1.26 -1.26 120.40 128.25 1klg s VAL 89 Ca 0.10 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.67 1klg s VAL 89 Cb -0.16 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 1klg s VAL 89 CO 0.11 0.54 -0.07 -0.89 0.00 0.00 0.00 175.10 174.78 1klg s THR 90 N -0.06 0.51 -0.06 3.92 2.01 -0.63 -4.99 115.64 116.34 1klg s THR 90 Ca 0.01 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.17 1klg s THR 90 Cb -0.13 -0.54 0.01 0.00 0.01 0.00 0.00 72.50 71.84 1klg s THR 90 CO 0.03 -0.26 -0.13 -0.69 -0.69 0.00 0.00 174.62 172.87 1klg s VAL 91 N -1.07 1.22 0.24 3.82 1.01 -1.26 -0.24 120.40 124.11 1klg s VAL 91 Ca -0.07 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 1klg s VAL 91 Cb -0.08 -1.10 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 1klg s VAL 91 CO 0.00 0.37 0.32 -0.76 0.00 0.00 0.00 175.10 175.04 1klg s LEU 92 N 0.55 0.77 0.19 3.92 1.43 -0.49 -4.98 118.68 120.07 1klg s LEU 92 Ca -0.13 -1.19 0.05 0.00 -1.03 0.00 0.00 54.13 51.82 1klg s LEU 92 Cb -0.15 1.12 -0.04 0.00 0.03 0.00 0.00 46.19 47.15 1klg s LEU 92 CO 0.04 -1.02 0.24 0.42 0.23 0.00 0.00 176.35 176.25 1klg s THR 93 N -3.99 4.89 0.25 5.49 -4.23 -1.26 0.64 115.64 117.44 1klg s THR 93 Ca 0.31 -0.99 0.26 0.00 -1.18 0.00 0.00 61.69 60.08 1klg s THR 93 Cb 0.03 -3.56 0.26 0.00 1.34 0.00 0.00 72.50 70.57 1klg s THR 93 CO 0.12 -0.18 1.93 -0.55 -0.54 0.00 0.00 174.62 175.39 1klg h ASN 94 N 1.94 0.00 -5.12 3.99 7.08 -1.65 -3.46 115.58 118.36 1klg h ASN 94 Ca -0.49 0.00 -0.04 0.00 -3.08 0.00 0.00 56.30 52.69 1klg h ASN 94 Cb 1.21 0.00 -0.11 0.00 -2.08 0.00 0.00 38.32 37.34 1klg h ASN 94 CO 0.64 0.18 -0.05 -0.94 -2.08 0.00 0.00 177.43 175.18 1klg s SER 95 N -6.15 -0.20 -0.23 6.14 1.04 -1.26 -5.06 113.70 107.98 1klg s SER 95 Ca -0.01 -0.52 -0.39 0.00 0.48 0.00 0.00 55.95 55.50 1klg s SER 95 Cb 0.11 0.54 -0.16 0.00 0.10 0.00 0.00 66.02 66.61 1klg s SER 95 CO 0.61 -0.99 1.71 -0.81 0.98 0.00 0.00 173.24 174.74 1klg n PRO 96 N -0.30 1.21 -2.34 4.02 -0.04 -1.26 -4.87 135.00 131.42 1klg n PRO 96 Ca -0.11 0.44 -0.41 0.00 -0.04 0.00 0.00 63.50 63.39 1klg n PRO 96 Cb 0.63 -2.13 -0.03 0.00 -0.04 0.00 0.00 33.50 31.92 1klg n PRO 96 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1klg s VAL 97 N 3.25 3.40 -0.02 0.52 0.11 -1.26 -5.05 120.40 121.35 1klg s VAL 97 Ca 0.97 1.24 0.01 0.00 -2.93 0.00 0.00 61.98 61.26 1klg s VAL 97 Cb -1.04 -3.79 0.01 0.00 -1.53 0.00 0.00 36.38 30.03 1klg s VAL 97 CO 0.63 0.23 -0.02 -1.61 -3.33 0.00 0.00 175.10 171.00 1klg s GLU 98 N -0.63 0.32 0.07 1.54 0.41 -1.26 -5.10 118.70 114.04 1klg s GLU 98 Ca 0.51 -0.03 -0.36 0.00 -0.41 0.00 0.00 54.97 54.68 1klg s GLU 98 Cb -0.34 -0.40 -0.16 0.00 -1.78 0.00 0.00 34.13 31.46 1klg s GLU 98 CO 0.40 -0.03 1.47 1.28 -0.49 0.00 0.00 175.26 177.89 1klg n LEU 99 N 3.57 2.20 0.00 1.80 4.77 -1.26 -1.30 117.00 126.79 1klg n LEU 99 Ca -0.20 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.88 1klg n LEU 99 Cb 0.54 -1.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.37 1klg n LEU 99 CO 0.24 -0.73 0.00 0.54 -1.33 0.00 0.00 177.39 176.11 1klg n ARG 100 N 3.23 -0.04 -3.12 3.23 1.74 -1.06 -4.95 116.66 115.69 1klg n ARG 100 Ca 0.19 0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.85 1klg n ARG 100 Cb 0.22 -3.71 -0.06 0.00 -1.02 0.00 0.00 32.46 27.88 1klg n ARG 100 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1klg s GLU 101 N -0.62 3.18 -0.06 5.56 0.41 -0.42 -4.83 118.70 121.93 1klg s GLU 101 Ca 0.00 -0.68 -0.35 0.00 -0.41 0.00 0.00 54.97 53.53 1klg s GLU 101 Cb 0.00 -4.05 -0.17 0.00 -1.78 0.00 0.00 34.13 28.13 1klg s GLU 101 CO 0.00 -1.17 0.99 -2.30 -0.49 0.00 0.00 175.26 172.28 1klg n PRO 102 N 6.30 0.00 -3.32 0.39 -0.02 -1.26 -4.49 135.00 132.60 1klg n PRO 102 Ca -0.04 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.32 1klg n PRO 102 Cb 0.46 -1.29 -0.04 0.00 -0.02 0.00 0.00 33.50 32.61 1klg n PRO 102 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1klg n ASN 103 N 1.60 -0.54 -3.87 2.55 2.85 -0.69 -5.03 115.26 112.14 1klg n ASN 103 Ca 0.19 -2.33 -0.13 0.00 -0.11 0.00 0.00 54.58 52.20 1klg n ASN 103 Cb 0.05 1.18 -0.14 0.00 1.24 0.00 0.00 39.78 42.11 1klg n ASN 103 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1klg s VAL 104 N -2.80 0.06 -0.21 3.44 1.01 -1.26 -1.38 120.40 119.25 1klg s VAL 104 Ca 0.23 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 1klg s VAL 104 Cb 0.01 -0.08 -0.04 0.00 0.00 0.00 0.00 36.38 36.27 1klg s VAL 104 CO 0.17 0.03 0.39 -0.76 0.00 0.00 0.00 175.10 174.93 1klg s LEU 105 N 0.13 4.14 -0.15 3.92 1.43 -0.15 -1.51 118.68 126.50 1klg s LEU 105 Ca -0.01 0.47 -0.05 0.00 -1.03 0.00 0.00 54.13 53.51 1klg s LEU 105 Cb -0.02 -2.49 -0.03 0.00 0.03 0.00 0.00 46.19 43.67 1klg s LEU 105 CO -0.00 -0.09 0.02 -0.63 0.23 0.00 0.00 176.35 175.87 1klg s ILE 106 N 1.42 4.42 -0.29 -0.59 1.01 0.21 -1.14 121.20 126.23 1klg s ILE 106 Ca 0.18 -0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.63 1klg s ILE 106 Cb -0.15 -2.94 0.05 0.00 0.01 0.00 0.00 42.46 39.43 1klg s ILE 106 CO 0.08 0.52 -0.01 0.00 0.00 0.00 0.00 174.94 175.53 1klg s PHE 108 N 1.27 3.03 -0.42 0.00 0.08 0.67 -2.03 117.98 120.57 1klg s PHE 108 Ca -0.05 0.10 -0.10 0.00 0.12 0.00 0.00 56.93 57.01 1klg s PHE 108 Cb -0.19 -3.51 0.08 0.00 -0.57 0.00 0.00 43.02 38.82 1klg s PHE 108 CO -0.01 -0.92 0.27 0.42 -0.10 0.00 0.00 175.22 174.88 1klg s ILE 109 N 3.08 4.30 0.32 0.64 -1.09 -0.61 -1.60 121.20 126.24 1klg s ILE 109 Ca 0.27 -1.39 0.08 0.00 -2.23 0.00 0.00 60.65 57.38 1klg s ILE 109 Cb -0.13 -3.64 -0.06 0.00 -1.58 0.00 0.00 42.46 37.05 1klg s ILE 109 CO 0.21 -0.52 -0.06 -0.62 -1.23 0.00 0.00 174.94 172.71 1klg s ASP 110 N 2.17 3.26 -1.25 3.58 2.15 -0.39 -0.58 116.67 125.62 1klg s ASP 110 Ca 0.03 -1.22 -0.11 0.00 0.43 0.00 0.00 52.55 51.68 1klg s ASP 110 Cb -0.23 -0.26 -0.01 0.00 -0.30 0.00 0.00 42.92 42.12 1klg s ASP 110 CO 0.02 -0.30 0.66 0.29 -0.17 0.00 0.00 175.17 175.67 1klg n LYS 111 N -0.71 -2.39 -4.23 4.34 5.02 -0.63 -0.59 118.16 118.96 1klg n LYS 111 Ca -0.05 0.46 -0.13 0.00 -2.02 0.00 0.00 58.31 56.57 1klg n LYS 111 Cb 0.64 -4.40 -0.10 0.00 -0.02 0.00 0.00 35.03 31.14 1klg n LYS 111 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1klg s PHE 112 N -3.65 1.20 -0.24 2.13 -0.12 -1.02 -4.45 117.98 111.83 1klg s PHE 112 Ca 0.26 -1.13 -0.28 0.00 -0.05 0.00 0.00 56.93 55.73 1klg s PHE 112 Cb -0.09 -0.68 0.16 0.00 -0.63 0.00 0.00 43.02 41.78 1klg s PHE 112 CO 0.86 -0.34 1.20 -0.08 -0.05 0.00 0.00 175.22 176.81 1klg s THR 113 N -3.80 0.00 0.83 -4.49 -1.32 -0.85 0.07 115.64 106.08 1klg s THR 113 Ca 0.28 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.65 1klg s THR 113 Cb 0.07 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.15 1klg s THR 113 CO 0.06 0.00 1.09 -2.16 -2.21 0.00 0.00 174.62 171.41 1klg s PRO 114 N -0.76 1.79 -0.73 7.08 0.04 -1.26 0.33 135.00 141.49 1klg s PRO 114 Ca 0.04 1.08 -0.17 0.00 0.04 0.00 0.00 61.00 61.99 1klg s PRO 114 Cb -0.02 -1.85 -0.13 0.00 0.04 0.00 0.00 34.50 32.54 1klg s PRO 114 CO -0.05 -1.95 1.91 -0.35 0.04 0.00 0.00 177.00 176.60 1klg n PRO 115 N -3.72 1.51 -3.69 0.56 -0.04 -1.26 -4.75 135.00 123.61 1klg n PRO 115 Ca 0.08 -1.62 -0.12 0.00 -0.04 0.00 0.00 63.50 61.81 1klg n PRO 115 Cb 0.54 -2.72 -0.12 0.00 -0.04 0.00 0.00 33.50 31.16 1klg n PRO 115 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1klg s VAL 116 N 4.67 -0.29 0.03 0.52 1.01 -1.26 -5.05 120.40 120.03 1klg s VAL 116 Ca 0.50 0.19 -0.23 0.00 0.00 0.00 0.00 61.98 62.44 1klg s VAL 116 Cb 0.13 -0.49 0.05 0.00 0.00 0.00 0.00 36.38 36.06 1klg s VAL 116 CO 0.08 0.08 0.53 0.54 0.00 0.00 0.00 175.10 176.33 1klg s VAL 117 N 1.96 0.03 -0.22 2.92 0.11 -1.26 -4.74 120.40 119.19 1klg s VAL 117 Ca -0.04 -0.22 0.02 0.00 -2.93 0.00 0.00 61.98 58.81 1klg s VAL 117 Cb -0.11 -0.95 0.04 0.00 -1.53 0.00 0.00 36.38 33.83 1klg s VAL 117 CO -0.10 -0.12 -0.14 0.21 -3.33 0.00 0.00 175.10 171.62 1klg s ASN 118 N -1.80 3.86 -0.07 3.54 2.47 -0.77 -4.99 114.94 117.17 1klg s ASN 118 Ca -0.07 -1.01 0.03 0.00 0.42 0.00 0.00 52.86 52.24 1klg s ASN 118 Cb -0.01 -1.53 -0.02 0.00 -1.45 0.00 0.00 41.25 38.24 1klg s ASN 118 CO 0.01 -0.10 -0.17 -0.69 -3.72 0.00 0.00 177.10 172.42 1klg s VAL 119 N 1.21 2.75 -0.04 -5.21 1.01 -1.26 -0.44 120.40 118.43 1klg s VAL 119 Ca -0.02 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 1klg s VAL 119 Cb -0.17 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1klg s VAL 119 CO -0.08 0.57 0.08 -0.89 0.00 0.00 0.00 175.10 174.77 1klg s THR 120 N -0.30 -0.03 0.09 3.92 2.01 0.53 -4.98 115.64 116.89 1klg s THR 120 Ca 0.02 0.11 -0.13 0.00 0.31 0.00 0.00 61.69 62.00 1klg s THR 120 Cb -0.13 -0.14 -0.06 0.00 0.01 0.00 0.00 72.50 72.18 1klg s THR 120 CO 0.03 0.04 0.46 0.26 -0.69 0.00 0.00 174.62 174.72 1klg s TRP 121 N 0.63 3.63 -0.03 4.92 0.52 -1.26 0.97 118.94 128.32 1klg s TRP 121 Ca -0.05 0.94 0.03 0.00 0.02 0.00 0.00 56.10 57.05 1klg s TRP 121 Cb -0.07 -2.27 -0.00 0.00 -1.15 0.00 0.00 33.47 29.98 1klg s TRP 121 CO -0.02 0.51 -0.12 -0.51 0.02 0.00 0.00 176.95 176.82 1klg s LEU 122 N -1.76 1.86 -0.33 2.99 1.43 0.65 -1.59 118.68 121.94 1klg s LEU 122 Ca 0.33 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 1klg s LEU 122 Cb -0.15 -0.71 0.09 0.00 0.03 0.00 0.00 46.19 45.45 1klg s LEU 122 CO 0.18 0.11 0.03 -0.60 0.23 0.00 0.00 176.35 176.29 1klg s ARG 123 N 0.06 1.58 -1.10 1.70 3.52 0.32 -1.32 118.95 123.72 1klg s ARG 123 Ca -0.02 -1.77 -0.06 0.00 -0.13 0.00 0.00 55.73 53.75 1klg s ARG 123 Cb -0.09 -3.13 -0.05 0.00 -1.56 0.00 0.00 34.95 30.13 1klg s ARG 123 CO 0.01 -0.88 0.92 0.09 -0.81 0.00 0.00 175.30 174.63 1klg n ASN 124 N 4.30 -5.38 0.00 -2.12 3.02 0.79 -2.44 115.26 113.43 1klg n ASN 124 Ca 0.01 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 1klg n ASN 124 Cb 0.42 -5.02 0.00 0.00 -0.61 0.00 0.00 39.78 34.57 1klg n ASN 124 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1klg n GLY 125 N -1.25 0.98 3.52 7.41 0.00 -1.26 -4.97 105.19 109.61 1klg n GLY 125 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 1klg n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1klg s LYS 126 N -0.27 2.33 0.23 1.61 1.02 -1.02 -5.05 119.74 118.59 1klg s LYS 126 Ca 0.00 -0.84 -0.30 0.00 0.02 0.00 0.00 55.97 54.85 1klg s LYS 126 Cb 0.00 -2.34 -0.09 0.00 -0.52 0.00 0.00 37.83 34.88 1klg s LYS 126 CO 0.00 0.58 1.27 -1.25 -0.92 0.00 0.00 175.35 175.03 1klg s PRO 127 N -1.35 4.42 0.00 -1.68 0.04 -1.26 0.12 135.00 135.29 1klg s PRO 127 Ca 0.15 2.04 0.01 0.00 0.04 0.00 0.00 61.00 63.24 1klg s PRO 127 Cb -0.11 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.22 1klg s PRO 127 CO 0.06 -0.17 0.03 0.08 0.04 0.00 0.00 177.00 177.05 1klg s VAL 128 N -0.30 4.39 0.00 -0.36 1.01 -0.62 -4.85 120.40 119.67 1klg s VAL 128 Ca 0.53 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1klg s VAL 128 Cb -0.36 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.03 1klg s VAL 128 CO 0.41 0.35 0.00 0.41 0.00 0.00 0.00 175.10 176.27 1klg n THR 129 N 1.25 0.00 -1.62 3.92 -1.04 -1.26 -4.58 114.28 110.94 1klg n THR 129 Ca -0.14 0.00 -0.48 0.00 -2.04 0.00 0.00 64.05 61.39 1klg n THR 129 Cb 0.53 -0.90 -0.04 0.00 -1.82 0.00 0.00 70.33 68.09 1klg n THR 129 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1klg n THR 130 N -2.63 0.40 0.00 12.58 -2.24 -1.26 -2.26 114.28 118.86 1klg n THR 130 Ca 0.00 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1klg n THR 130 Cb 0.28 -1.13 0.00 0.00 -2.10 0.00 0.00 70.33 67.38 1klg n THR 130 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1klg n GLY 131 N 2.55 1.80 3.75 3.38 0.00 -1.26 -4.79 105.19 110.62 1klg n GLY 131 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1klg n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1klg s VAL 132 N -1.63 2.69 0.16 1.61 -7.23 -0.96 -4.40 120.40 110.64 1klg s VAL 132 Ca 0.00 0.39 -0.12 0.00 -1.81 0.00 0.00 61.98 60.44 1klg s VAL 132 Cb 0.00 -3.06 0.00 0.00 0.56 0.00 0.00 36.38 33.89 1klg s VAL 132 CO 0.00 -0.13 0.34 -0.94 -0.31 0.00 0.00 175.10 174.06 1klg s SER 133 N -1.87 -0.04 0.16 4.85 1.04 -0.91 -4.99 113.70 111.94 1klg s SER 133 Ca 0.75 -0.71 -0.14 0.00 0.48 0.00 0.00 55.95 56.33 1klg s SER 133 Cb -0.28 0.46 0.02 0.00 0.10 0.00 0.00 66.02 66.32 1klg s SER 133 CO 0.37 -0.91 0.40 -1.83 0.98 0.00 0.00 173.24 172.25 1klg s GLU 134 N -3.92 1.21 0.53 4.02 -1.05 -1.26 0.21 118.70 118.43 1klg s GLU 134 Ca 0.13 -0.93 0.08 0.00 -0.15 0.00 0.00 54.97 54.09 1klg s GLU 134 Cb 0.02 0.45 0.08 0.00 -0.44 0.00 0.00 34.13 34.24 1klg s GLU 134 CO -0.03 -0.48 0.65 0.25 0.95 0.00 0.00 175.26 176.60 1klg n THR 135 N -0.26 0.00 -2.69 1.83 -2.24 0.03 -5.00 114.28 105.96 1klg n THR 135 Ca -0.11 -1.85 -0.17 0.00 -2.27 0.00 0.00 64.05 59.65 1klg n THR 135 Cb 0.63 -0.42 0.08 0.00 -2.10 0.00 0.00 70.33 68.51 1klg n THR 135 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1klg n VAL 136 N -2.05 0.00 -2.33 2.28 0.24 -1.26 -4.71 118.33 110.50 1klg n VAL 136 Ca 0.11 -1.29 -0.42 0.00 -2.04 0.00 0.00 64.34 60.69 1klg n VAL 136 Cb 0.56 -0.88 -0.03 0.00 -1.47 0.00 0.00 33.84 32.02 1klg n VAL 136 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1klg s PHE 137 N -2.12 3.30 -0.06 6.34 0.08 -1.26 -4.64 117.98 119.63 1klg s PHE 137 Ca 0.49 1.14 -0.01 0.00 0.12 0.00 0.00 56.93 58.68 1klg s PHE 137 Cb -0.03 -3.52 -0.03 0.00 -0.57 0.00 0.00 43.02 38.86 1klg s PHE 137 CO 0.32 -1.73 -0.00 -0.51 -0.10 0.00 0.00 175.22 173.20 1klg s LEU 138 N 1.28 3.53 0.69 -0.37 1.43 0.23 -4.93 118.68 120.55 1klg s LEU 138 Ca 0.61 0.09 -0.13 0.00 -1.03 0.00 0.00 54.13 53.66 1klg s LEU 138 Cb -0.32 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.05 1klg s LEU 138 CO 0.29 0.35 1.10 -2.16 0.23 0.00 0.00 176.35 176.15 1klg s PRO 139 N -1.09 2.66 0.04 1.29 0.04 -1.26 -0.70 135.00 135.99 1klg s PRO 139 Ca 0.15 1.30 0.02 0.00 0.04 0.00 0.00 61.00 62.51 1klg s PRO 139 Cb -0.11 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.46 1klg s PRO 139 CO 0.05 -1.35 -0.07 1.03 0.04 0.00 0.00 177.00 176.70 1klg s ARG 140 N -4.38 0.53 0.40 4.56 0.52 -1.06 -4.75 118.95 114.77 1klg s ARG 140 Ca 0.65 -0.78 0.14 0.00 -0.52 0.00 0.00 55.73 55.22 1klg s ARG 140 Cb -0.19 -0.26 0.99 0.00 0.52 0.00 0.00 34.95 36.01 1klg s ARG 140 CO 0.46 0.04 1.88 1.49 0.02 0.00 0.00 175.30 179.20 1klg h GLU 141 N 4.43 0.48 -0.05 3.54 4.57 -1.99 0.28 114.58 125.85 1klg h GLU 141 Ca -0.36 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.80 1klg h GLU 141 Cb 1.20 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 1klg h GLU 141 CO 0.42 0.32 0.00 -0.40 -1.18 0.00 0.00 179.01 178.17 1klg n ASP 142 N -4.52 0.42 -0.27 1.04 5.68 -1.26 -4.89 116.55 112.75 1klg n ASP 142 Ca 0.17 -1.59 -0.04 0.00 -0.50 0.00 0.00 54.79 52.84 1klg n ASP 142 Cb 0.57 -0.03 -0.02 0.00 -1.14 0.00 0.00 41.12 40.50 1klg n ASP 142 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1klg n HIS 143 N -0.47 0.00 -2.83 2.11 8.25 0.10 -5.02 115.22 117.36 1klg n HIS 143 Ca 0.12 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.41 1klg n HIS 143 Cb 0.12 -1.12 0.07 0.00 1.12 0.00 0.00 29.99 30.19 1klg n HIS 143 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1klg n LEU 144 N -0.40 0.00 -4.50 2.41 4.77 -1.26 -4.87 117.00 113.15 1klg n LEU 144 Ca -0.04 -1.95 -0.24 0.00 -0.03 0.00 0.00 56.01 53.75 1klg n LEU 144 Cb 0.21 -0.43 -0.10 0.00 -2.33 0.00 0.00 43.42 40.76 1klg n LEU 144 CO 0.05 -0.77 -0.39 -0.36 -1.33 0.00 0.00 177.39 174.59 1klg s PHE 145 N -2.22 2.23 0.26 -1.77 0.40 0.11 -2.56 117.98 114.43 1klg s PHE 145 Ca 0.53 -0.55 0.05 0.00 -0.60 0.00 0.00 56.93 56.35 1klg s PHE 145 Cb -0.04 -1.25 -0.06 0.00 0.51 0.00 0.00 43.02 42.18 1klg s PHE 145 CO 0.34 0.49 -0.03 -0.98 0.70 0.00 0.00 175.22 175.74 1klg s ARG 146 N -3.64 1.46 -0.12 0.44 1.70 0.13 -1.61 118.95 117.30 1klg s ARG 146 Ca 0.31 -1.74 -0.30 0.00 -0.47 0.00 0.00 55.73 53.53 1klg s ARG 146 Cb 0.02 -0.89 0.11 0.00 -0.57 0.00 0.00 34.95 33.62 1klg s ARG 146 CO 0.15 -0.03 0.89 0.21 -1.08 0.00 0.00 175.30 175.43 1klg s LYS 147 N -3.80 0.75 -0.04 3.89 2.20 0.26 -0.60 119.74 122.41 1klg s LYS 147 Ca 0.29 0.20 0.04 0.00 -0.36 0.00 0.00 55.97 56.14 1klg s LYS 147 Cb 0.05 0.36 -0.00 0.00 -1.51 0.00 0.00 37.83 36.72 1klg s LYS 147 CO 0.10 -0.23 -0.16 -0.06 -0.36 0.00 0.00 175.35 174.64 1klg s PHE 148 N -1.11 1.57 -0.02 4.03 0.40 -1.26 -1.57 117.98 120.02 1klg s PHE 148 Ca -0.05 -0.42 0.07 0.00 -0.60 0.00 0.00 56.93 55.93 1klg s PHE 148 Cb -0.00 -1.06 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 1klg s PHE 148 CO 0.04 -0.14 -0.23 -1.01 0.70 0.00 0.00 175.22 174.59 1klg s HIS 149 N -0.00 2.07 0.11 0.36 3.76 -0.86 -0.79 115.29 119.94 1klg s HIS 149 Ca -0.02 -0.41 0.08 0.00 -0.15 0.00 0.00 55.06 54.56 1klg s HIS 149 Cb -0.10 -1.33 -0.04 0.00 1.11 0.00 0.00 32.58 32.22 1klg s HIS 149 CO 0.02 -0.05 -0.21 0.71 -0.85 0.00 0.00 174.74 174.35 1klg s TYR 150 N -0.50 1.83 -0.24 1.40 1.51 0.13 -0.55 117.35 120.93 1klg s TYR 150 Ca 0.08 -0.42 -0.04 0.00 -1.01 0.00 0.00 57.07 55.68 1klg s TYR 150 Cb -0.09 -1.00 0.08 0.00 -0.11 0.00 0.00 41.96 40.84 1klg s TYR 150 CO -0.01 0.22 0.11 -1.17 -1.11 0.00 0.00 175.55 173.59 1klg s LEU 151 N -1.95 0.59 0.28 -1.29 2.96 -0.30 -2.14 118.68 116.83 1klg s LEU 151 Ca 0.07 -1.01 -0.29 0.00 -0.22 0.00 0.00 54.13 52.68 1klg s LEU 151 Cb -0.10 -0.35 -0.10 0.00 0.50 0.00 0.00 46.19 46.14 1klg s LEU 151 CO 0.04 -0.39 1.31 -2.84 -1.32 0.00 0.00 176.35 173.15 1klg s PRO 152 N 2.07 4.38 0.16 0.98 0.02 -1.26 -0.97 135.00 140.38 1klg s PRO 152 Ca 0.06 2.15 -0.13 0.00 0.02 0.00 0.00 61.00 63.09 1klg s PRO 152 Cb -0.16 -3.12 0.01 0.00 0.02 0.00 0.00 34.50 31.25 1klg s PRO 152 CO -0.24 -0.21 0.38 -0.59 -0.33 0.00 0.00 177.00 176.02 1klg s PHE 153 N -0.60 0.10 -0.36 6.54 -0.71 -0.48 -4.92 117.98 117.55 1klg s PHE 153 Ca 0.52 -0.45 -0.07 0.00 -1.04 0.00 0.00 56.93 55.89 1klg s PHE 153 Cb -0.38 0.15 0.05 0.00 -1.21 0.00 0.00 43.02 41.63 1klg s PHE 153 CO 0.46 -0.77 0.14 -1.17 -1.34 0.00 0.00 175.22 172.54 1klg s LEU 154 N -2.90 4.53 0.59 -1.99 2.96 -1.26 -1.70 118.68 118.91 1klg s LEU 154 Ca 0.11 -1.27 -0.18 0.00 -0.22 0.00 0.00 54.13 52.57 1klg s LEU 154 Cb 0.02 -1.89 -0.08 0.00 0.50 0.00 0.00 46.19 44.74 1klg s LEU 154 CO -0.04 -0.38 0.55 -2.65 -1.32 0.00 0.00 176.35 172.51 1klg n PRO 155 N 4.81 0.51 -3.66 0.98 -0.02 -1.26 -4.80 135.00 131.57 1klg n PRO 155 Ca -0.11 0.20 -0.07 0.00 -2.02 0.00 0.00 63.50 61.50 1klg n PRO 155 Cb 0.44 -1.74 -0.02 0.00 -0.02 0.00 0.00 33.50 32.16 1klg n PRO 155 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1klg s SER 156 N -1.21 -0.31 0.15 2.55 1.04 -1.26 -2.55 113.70 112.11 1klg s SER 156 Ca 0.69 -0.27 0.18 0.00 0.48 0.00 0.00 55.95 57.03 1klg s SER 156 Cb -0.43 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.17 1klg s SER 156 CO 0.54 -0.93 1.01 0.71 0.98 0.00 0.00 173.24 175.56 1klg h THR 157 N 2.00 0.42 0.06 2.02 1.35 -2.00 -3.40 112.91 113.36 1klg h THR 157 Ca -0.24 -1.75 -0.10 0.00 -0.55 0.00 0.00 66.41 63.77 1klg h THR 157 Cb 1.25 1.97 0.01 0.00 -1.73 0.00 0.00 68.15 69.65 1klg h THR 157 CO 0.28 0.24 -0.43 -0.33 -0.25 0.00 0.00 175.52 175.03 1klg h GLU 158 N 0.00 0.18 -6.93 4.72 5.08 -2.01 -3.45 114.58 112.17 1klg h GLU 158 Ca -0.09 -0.28 -0.56 0.00 -1.00 0.00 0.00 59.36 57.43 1klg h GLU 158 Cb 1.39 0.10 0.15 0.00 0.50 0.00 0.00 28.75 30.88 1klg h GLU 158 CO 0.04 1.10 0.40 -0.25 -1.00 0.00 0.00 179.01 179.29 1klg n ASP 159 N -4.36 1.88 -3.74 1.42 8.00 -1.26 -5.04 116.55 113.46 1klg n ASP 159 Ca -0.12 0.92 -0.21 0.00 0.71 0.00 0.00 54.79 56.09 1klg n ASP 159 Cb 0.65 -1.49 -0.18 0.00 -0.02 0.00 0.00 41.12 40.08 1klg n ASP 159 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1klg s VAL 160 N -1.36 0.15 0.27 2.53 -7.23 -1.26 -4.43 120.40 109.07 1klg s VAL 160 Ca 0.73 0.24 0.07 0.00 -1.81 0.00 0.00 61.98 61.22 1klg s VAL 160 Cb -0.43 -0.34 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 1klg s VAL 160 CO 0.49 0.21 0.20 -0.31 -0.31 0.00 0.00 175.10 175.37 1klg s TYR 161 N 1.93 3.04 -0.08 2.82 1.51 0.10 -0.15 117.35 126.53 1klg s TYR 161 Ca 0.03 -0.15 -0.05 0.00 -1.01 0.00 0.00 57.07 55.89 1klg s TYR 161 Cb -0.12 -1.45 0.03 0.00 -0.11 0.00 0.00 41.96 40.31 1klg s TYR 161 CO -0.04 0.47 0.19 -0.51 -1.11 0.00 0.00 175.55 174.55 1klg s ASP 162 N -3.85 -0.19 -0.37 2.29 1.01 -0.44 -1.11 116.67 114.01 1klg s ASP 162 Ca 0.34 0.39 -0.13 0.00 0.71 0.00 0.00 52.55 53.86 1klg s ASP 162 Cb -0.07 0.33 0.00 0.00 1.01 0.00 0.00 42.92 44.19 1klg s ASP 162 CO 0.25 -0.11 0.25 0.00 0.21 0.00 0.00 175.17 175.77 1klg s ARG 164 N 1.69 3.60 -0.10 0.00 3.52 0.27 -1.45 118.95 126.47 1klg s ARG 164 Ca 0.05 -0.49 0.03 0.00 -0.13 0.00 0.00 55.73 55.20 1klg s ARG 164 Cb -0.18 -3.78 -0.00 0.00 -1.56 0.00 0.00 34.95 29.43 1klg s ARG 164 CO 0.10 -0.43 -0.23 0.08 -0.81 0.00 0.00 175.30 174.01 1klg s VAL 165 N 1.85 2.19 -0.09 7.11 1.01 -0.11 -0.34 120.40 132.02 1klg s VAL 165 Ca 0.09 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.12 1klg s VAL 165 Cb -0.17 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 1klg s VAL 165 CO 0.11 0.56 -0.15 -1.61 0.00 0.00 0.00 175.10 174.00 1klg s GLU 166 N 0.35 2.94 -0.22 2.72 2.02 0.41 -1.43 118.70 125.49 1klg s GLU 166 Ca -0.18 -0.72 -0.21 0.00 0.02 0.00 0.00 54.97 53.88 1klg s GLU 166 Cb -0.18 -2.47 0.06 0.00 0.10 0.00 0.00 34.13 31.64 1klg s GLU 166 CO 0.08 0.39 0.59 -1.58 0.02 0.00 0.00 175.26 174.76 1klg s HIS 167 N -0.12 -0.65 0.58 1.61 2.46 -1.26 -1.86 115.29 116.06 1klg s HIS 167 Ca -0.02 1.57 0.31 0.00 0.47 0.00 0.00 55.06 57.39 1klg s HIS 167 Cb -0.14 0.22 1.38 0.00 -0.13 0.00 0.00 32.58 33.92 1klg s HIS 167 CO 0.04 -0.32 1.74 -1.49 -2.47 0.00 0.00 174.74 172.24 1klg h TRP 168 N 5.16 0.00 0.00 3.88 6.55 -1.96 1.04 115.95 130.63 1klg h TRP 168 Ca -0.28 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.56 1klg h TRP 168 Cb 1.17 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.47 1klg h TRP 168 CO 0.39 0.00 0.00 0.78 -1.05 0.00 0.00 178.44 178.56 1klg h GLY 169 N 0.00 0.00 -7.40 1.49 0.00 -1.88 -3.42 103.07 91.85 1klg h GLY 169 Ca 0.37 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 47.07 1klg h GLY 169 CO -0.00 0.00 -0.53 1.08 0.00 0.00 0.00 176.54 177.09 1klg s LEU 170 N -5.00 3.97 0.63 3.11 1.43 0.36 -4.47 118.68 118.71 1klg s LEU 170 Ca 0.05 0.02 0.37 0.00 -1.03 0.00 0.00 54.13 53.53 1klg s LEU 170 Cb 0.10 -2.08 2.11 0.00 0.03 0.00 0.00 46.19 46.35 1klg s LEU 170 CO 0.49 0.01 2.31 0.44 0.23 0.00 0.00 176.35 179.83 1klg h ASP 171 N 7.92 0.00 -5.01 2.29 3.45 -1.82 -3.43 116.42 119.82 1klg h ASP 171 Ca -0.37 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.05 1klg h ASP 171 Cb 1.18 0.00 -0.15 0.00 -0.56 0.00 0.00 39.33 39.80 1klg h ASP 171 CO 0.60 0.00 0.16 -1.61 -1.57 0.00 0.00 179.24 176.82 1klg s GLU 172 N -4.41 1.16 0.12 3.56 2.02 -1.26 -5.14 118.70 114.75 1klg s GLU 172 Ca -0.05 -0.24 -0.35 0.00 0.02 0.00 0.00 54.97 54.36 1klg s GLU 172 Cb 0.14 0.54 -0.17 0.00 0.10 0.00 0.00 34.13 34.74 1klg s GLU 172 CO 0.48 -0.45 1.11 -2.30 0.02 0.00 0.00 175.26 174.12 1klg n PRO 173 N 0.13 0.77 -3.74 0.39 -0.02 -1.26 -4.92 135.00 126.35 1klg n PRO 173 Ca -0.18 0.28 -0.36 0.00 -2.02 0.00 0.00 63.50 61.21 1klg n PRO 173 Cb 0.62 -1.75 -0.11 0.00 -0.02 0.00 0.00 33.50 32.24 1klg n PRO 173 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1klg s LEU 174 N 0.72 3.87 -0.24 2.45 2.96 -0.52 -4.95 118.68 122.98 1klg s LEU 174 Ca 0.79 0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 54.66 1klg s LEU 174 Cb -0.98 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 43.68 1klg s LEU 174 CO 0.53 0.04 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.80 1klg s LEU 175 N 1.20 3.13 -0.24 -0.68 1.02 -1.26 -0.94 118.68 120.91 1klg s LEU 175 Ca 0.06 -0.62 -0.13 0.00 0.02 0.00 0.00 54.13 53.45 1klg s LEU 175 Cb -0.14 -1.73 -0.04 0.00 0.02 0.00 0.00 46.19 44.30 1klg s LEU 175 CO 0.05 -0.09 0.30 -0.54 0.02 0.00 0.00 176.35 176.09 1klg s LYS 176 N 1.42 4.07 0.23 1.70 -0.14 -0.53 -4.90 119.74 121.59 1klg s LYS 176 Ca 0.03 -0.04 -0.19 0.00 -1.36 0.00 0.00 55.97 54.41 1klg s LYS 176 Cb -0.16 -3.59 -0.08 0.00 -1.68 0.00 0.00 37.83 32.32 1klg s LYS 176 CO -0.03 -0.10 0.72 -1.58 -0.76 0.00 0.00 175.35 173.60 1klg s HIS 177 N 1.53 3.62 -0.22 3.18 2.46 -1.26 -1.10 115.29 123.50 1klg s HIS 177 Ca 0.13 1.37 -0.12 0.00 0.47 0.00 0.00 55.06 56.91 1klg s HIS 177 Cb -0.15 -2.61 0.07 0.00 -0.13 0.00 0.00 32.58 29.77 1klg s HIS 177 CO 0.08 0.31 0.53 -0.46 -2.47 0.00 0.00 174.74 172.73 1klg s TRP 178 N -1.57 -0.83 0.19 3.88 -0.00 -0.27 -4.91 118.94 115.43 1klg s TRP 178 Ca 0.44 1.68 -0.10 0.00 -0.00 0.00 0.00 56.10 58.12 1klg s TRP 178 Cb -0.16 0.44 -0.01 0.00 -0.00 0.00 0.00 33.47 33.74 1klg s TRP 178 CO 0.21 -0.44 0.34 -1.83 -0.00 0.00 0.00 176.95 175.22 1klg s GLU 179 N 1.65 1.29 0.00 5.86 -1.05 -1.26 0.01 118.70 125.20 1klg s GLU 179 Ca -0.09 -1.23 0.16 0.00 -0.15 0.00 0.00 54.97 53.66 1klg s GLU 179 Cb -0.08 0.40 0.96 0.00 -0.44 0.00 0.00 34.13 34.98 1klg s GLU 179 CO -0.16 -0.49 1.37 0.34 0.95 0.00 0.00 175.26 177.27