#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gya s GLU 2 N 0.00 1.59 0.32 -1.58 2.12 -1.26 -5.10 118.70 114.79 1gya s GLU 2 Ca 0.00 -2.51 0.08 0.00 0.36 0.00 0.00 54.97 52.90 1gya s GLU 2 Cb 0.00 -2.45 -0.03 0.00 0.26 0.00 0.00 34.13 31.90 1gya s GLU 2 CO 0.00 -1.27 0.20 0.42 -0.54 0.00 0.00 175.26 174.07 1gya s ILE 3 N -0.37 3.49 0.52 -3.70 1.01 -1.26 -5.14 121.20 115.76 1gya s ILE 3 Ca 0.25 -1.54 0.09 0.00 0.00 0.00 0.00 60.65 59.45 1gya s ILE 3 Cb -0.09 -3.12 0.06 0.00 0.01 0.00 0.00 42.46 39.32 1gya s ILE 3 CO -0.12 -0.22 0.70 0.42 0.00 0.00 0.00 174.94 175.72 1gya s THR 4 N -2.32 2.43 -0.30 2.92 -4.23 -1.26 -5.05 115.64 107.82 1gya s THR 4 Ca 0.38 -1.02 0.17 0.00 -1.18 0.00 0.00 61.69 60.03 1gya s THR 4 Cb -0.05 -2.45 0.48 0.00 1.34 0.00 0.00 72.50 71.82 1gya s THR 4 CO 0.24 0.00 1.08 0.59 -0.54 0.00 0.00 174.62 175.99 1gya n ASN 5 N -2.09 2.50 -4.85 3.99 4.13 -1.26 -5.09 115.26 112.59 1gya n ASN 5 Ca 0.12 -2.72 -0.24 0.00 1.68 0.00 0.00 54.58 53.43 1gya n ASN 5 Cb 0.61 -0.47 -0.03 0.00 -1.54 0.00 0.00 39.78 38.35 1gya n ASN 5 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1gya s ALA 6 N -3.55 4.09 -0.39 5.41 0.00 -1.26 -3.96 121.76 122.10 1gya s ALA 6 Ca 0.34 -1.69 0.02 0.00 0.00 0.00 0.00 51.96 50.62 1gya s ALA 6 Cb 0.38 -0.73 0.12 0.00 0.00 0.00 0.00 23.12 22.89 1gya s ALA 6 CO -0.02 -0.30 0.17 -0.51 0.00 0.00 0.00 175.76 175.10 1gya s LEU 7 N -4.13 3.05 -0.46 0.00 1.43 -0.96 -5.00 118.68 112.61 1gya s LEU 7 Ca 0.41 -2.28 -0.35 0.00 -1.03 0.00 0.00 54.13 50.88 1gya s LEU 7 Cb -0.01 -1.14 -0.13 0.00 0.03 0.00 0.00 46.19 44.94 1gya s LEU 7 CO 0.24 -0.33 2.28 -0.62 0.23 0.00 0.00 176.35 178.15 1gya n GLU 8 N 4.02 0.82 -4.67 1.70 4.71 -1.26 -3.68 120.64 122.27 1gya n GLU 8 Ca 0.04 0.19 -0.33 0.00 -0.01 0.00 0.00 57.16 57.05 1gya n GLU 8 Cb 0.38 -2.35 -0.12 0.00 -1.01 0.00 0.00 31.44 28.34 1gya n GLU 8 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1gya s THR 9 N 7.97 3.35 0.15 2.62 -4.23 -0.82 -5.00 115.64 119.67 1gya s THR 9 Ca 1.13 -0.75 0.05 0.00 -1.18 0.00 0.00 61.69 60.94 1gya s THR 9 Cb -0.90 -2.38 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 1gya s THR 9 CO 0.48 0.50 -0.10 0.26 -0.54 0.00 0.00 174.62 175.22 1gya s TRP 10 N -0.86 1.28 0.00 3.99 0.52 -1.26 -1.66 118.94 120.95 1gya s TRP 10 Ca 0.14 -0.74 0.00 0.00 0.02 0.00 0.00 56.10 55.51 1gya s TRP 10 Cb -0.11 -0.65 0.00 0.00 -1.15 0.00 0.00 33.47 31.56 1gya s TRP 10 CO 0.03 0.09 0.00 0.41 0.02 0.00 0.00 176.95 177.51 1gya n GLY 11 N -0.17 3.91 3.57 0.98 0.00 0.14 -4.73 105.19 108.89 1gya n GLY 11 Ca -0.10 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.00 1gya n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gya s ALA 12 N -1.31 -1.81 -0.23 4.61 0.00 -1.26 -2.99 121.76 118.77 1gya s ALA 12 Ca 0.00 1.60 -0.38 0.00 0.00 0.00 0.00 51.96 53.19 1gya s ALA 12 Cb 0.00 -0.54 -0.14 0.00 0.00 0.00 0.00 23.12 22.44 1gya s ALA 12 CO 0.00 -0.34 1.85 -0.11 0.00 0.00 0.00 175.76 177.16 1gya n LEU 13 N 1.51 2.70 -0.34 0.00 7.94 -1.26 -2.40 117.00 125.15 1gya n LEU 13 Ca -0.16 0.95 0.00 0.00 -1.11 0.00 0.00 56.01 55.69 1gya n LEU 13 Cb 0.56 -1.23 0.00 0.00 0.53 0.00 0.00 43.42 43.28 1gya n LEU 13 CO 0.15 -0.34 0.00 0.61 -1.11 0.00 0.00 177.39 176.70 1gya n GLY 14 N 4.61 0.78 3.41 -3.96 0.00 0.27 -4.89 105.19 105.39 1gya n GLY 14 Ca 0.27 -0.29 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 1gya n GLY 14 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1gya s GLN 15 N -2.06 1.57 -0.02 1.61 2.00 -1.01 -4.75 119.66 117.01 1gya s GLN 15 Ca 0.00 -1.86 0.05 0.00 -2.00 0.00 0.00 55.36 51.55 1gya s GLN 15 Cb 0.00 -0.67 -0.01 0.00 0.80 0.00 0.00 33.01 33.13 1gya s GLN 15 CO 0.00 -0.22 -0.17 0.34 -0.50 0.00 0.00 175.29 174.74 1gya s ASP 16 N -3.43 2.07 0.26 6.67 2.15 -1.26 0.12 116.67 123.25 1gya s ASP 16 Ca 0.37 -0.32 -0.06 0.00 0.43 0.00 0.00 52.55 52.96 1gya s ASP 16 Cb 0.08 -0.31 -0.01 0.00 -0.30 0.00 0.00 42.92 42.38 1gya s ASP 16 CO 0.15 0.20 0.39 -0.51 -0.17 0.00 0.00 175.17 175.22 1gya s ILE 17 N -0.31 0.00 -0.01 4.11 1.10 -0.82 -4.98 121.20 120.29 1gya s ILE 17 Ca 0.04 -1.63 0.03 0.00 -0.51 0.00 0.00 60.65 58.59 1gya s ILE 17 Cb -0.08 -2.41 -0.01 0.00 0.15 0.00 0.00 42.46 40.12 1gya s ILE 17 CO -0.00 0.00 -0.11 0.20 -2.11 0.00 0.00 174.94 172.92 1gya s ASN 18 N -3.12 1.33 -0.80 4.50 -0.87 -1.26 -0.33 114.94 114.38 1gya s ASN 18 Ca 0.29 -0.21 -0.22 0.00 -1.57 0.00 0.00 52.86 51.16 1gya s ASN 18 Cb 0.01 -0.21 0.09 0.00 -0.02 0.00 0.00 41.25 41.12 1gya s ASN 18 CO 0.13 0.12 1.10 -0.76 -2.57 0.00 0.00 177.10 175.13 1gya s LEU 19 N -0.13 4.44 -0.45 0.60 2.01 0.27 -4.91 118.68 120.52 1gya s LEU 19 Ca 0.02 -1.39 -0.19 0.00 0.01 0.00 0.00 54.13 52.58 1gya s LEU 19 Cb -0.06 -2.44 0.03 0.00 0.01 0.00 0.00 46.19 43.74 1gya s LEU 19 CO -0.00 -1.34 0.56 -1.81 1.01 0.00 0.00 176.35 174.77 1gya s ASP 20 N 3.83 6.25 0.65 2.29 1.01 -1.26 -0.77 116.67 128.66 1gya s ASP 20 Ca 0.30 -0.62 -0.15 0.00 0.71 0.00 0.00 52.55 52.79 1gya s ASP 20 Cb -0.10 -2.28 -0.01 0.00 1.01 0.00 0.00 42.92 41.55 1gya s ASP 20 CO 0.01 -0.73 1.11 -0.51 0.21 0.00 0.00 175.17 175.25 1gya s ILE 21 N 2.51 3.30 0.32 0.77 1.10 -1.25 -5.05 121.20 122.91 1gya s ILE 21 Ca 0.17 0.61 -0.01 0.00 -0.51 0.00 0.00 60.65 60.91 1gya s ILE 21 Cb -0.17 -3.14 0.02 0.00 0.15 0.00 0.00 42.46 39.32 1gya s ILE 21 CO 0.15 -0.37 0.04 -2.65 -2.11 0.00 0.00 174.94 170.00 1gya n PRO 22 N -2.33 1.53 -0.39 3.50 -0.02 -1.26 -4.81 135.00 131.22 1gya n PRO 22 Ca 0.10 -0.07 -0.07 0.00 -2.02 0.00 0.00 63.50 61.44 1gya n PRO 22 Cb 0.52 -0.60 0.06 0.00 -0.02 0.00 0.00 33.50 33.46 1gya n PRO 22 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1gya n SER 23 N 1.16 3.22 -4.51 2.55 7.64 -1.26 -4.75 113.62 117.66 1gya n SER 23 Ca 0.01 -2.50 -0.36 0.00 1.01 0.00 0.00 58.87 57.02 1gya n SER 23 Cb 0.03 -0.61 -0.12 0.00 -1.01 0.00 0.00 64.21 62.50 1gya n SER 23 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1gya s PHE 24 N -1.06 3.14 0.02 1.43 2.19 -1.26 -5.10 117.98 117.35 1gya s PHE 24 Ca 0.18 -0.23 0.05 0.00 0.33 0.00 0.00 56.93 57.26 1gya s PHE 24 Cb 0.15 -2.21 -0.02 0.00 -1.31 0.00 0.00 43.02 39.63 1gya s PHE 24 CO 0.04 -0.20 -0.15 1.14 1.83 0.00 0.00 175.22 177.88 1gya s GLN 25 N 1.30 1.05 0.62 10.12 -2.07 -1.26 -4.84 119.66 124.58 1gya s GLN 25 Ca 0.05 -0.68 -0.16 0.00 -1.82 0.00 0.00 55.36 52.75 1gya s GLN 25 Cb -0.15 -1.06 -0.02 0.00 -1.09 0.00 0.00 33.01 30.70 1gya s GLN 25 CO 0.04 0.27 1.09 0.00 -1.32 0.00 0.00 175.29 175.37 1gya s MET 26 N -0.84 3.07 0.00 9.60 0.23 -1.26 -5.04 119.30 125.06 1gya s MET 26 Ca 0.04 1.32 0.00 0.00 -1.03 0.00 0.00 55.69 56.01 1gya s MET 26 Cb -0.07 -1.99 0.00 0.00 -1.53 0.00 0.00 34.83 31.24 1gya s MET 26 CO 0.01 -1.02 0.00 0.45 -2.03 0.00 0.00 175.02 172.42 1gya n SER 27 N -2.17 0.00 0.03 -1.18 2.88 -1.26 -5.00 113.62 106.92 1gya n SER 27 Ca 0.10 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.61 1gya n SER 27 Cb 0.52 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.89 1gya n SER 27 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1gya h ASP 28 N 0.00 0.00 0.68 -3.46 2.03 -2.06 -3.37 116.42 110.23 1gya h ASP 28 Ca 0.00 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 56.10 1gya h ASP 28 Cb 0.00 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.47 1gya h ASP 28 CO 0.00 0.74 -1.45 0.44 -1.03 0.00 0.00 179.24 177.94 1gya h ASP 29 N 0.00 0.00 -3.52 4.15 3.32 -2.01 -3.47 116.42 114.88 1gya h ASP 29 Ca -0.17 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.40 1gya h ASP 29 Cb 1.72 0.00 0.04 0.00 0.22 0.00 0.00 39.33 41.31 1gya h ASP 29 CO 0.07 0.68 0.11 -0.63 -1.72 0.00 0.00 179.24 177.75 1gya s ILE 30 N -2.84 4.49 0.00 0.35 1.01 -1.26 -3.79 121.20 119.15 1gya s ILE 30 Ca -0.03 0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.70 1gya s ILE 30 Cb 0.08 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.83 1gya s ILE 30 CO 0.81 -0.70 0.00 -0.67 0.00 0.00 0.00 174.94 174.38 1gya n ASP 31 N -2.33 0.00 -4.89 3.58 -0.08 -1.15 -4.72 116.55 106.96 1gya n ASP 31 Ca 0.02 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 53.07 1gya n ASP 31 Cb 0.56 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.99 1gya n ASP 31 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1gya s ASP 32 N -1.66 5.91 0.04 1.67 1.11 0.11 -4.60 116.67 119.25 1gya s ASP 32 Ca 0.00 -0.07 -0.01 0.00 0.18 0.00 0.00 52.55 52.65 1gya s ASP 32 Cb 0.00 -1.64 -0.03 0.00 1.07 0.00 0.00 42.92 42.32 1gya s ASP 32 CO 0.00 -0.03 -0.03 -0.63 1.18 0.00 0.00 175.17 175.67 1gya s ILE 33 N -1.98 0.19 -0.23 0.77 1.01 -1.07 -1.40 121.20 118.49 1gya s ILE 33 Ca 0.33 -1.58 -0.24 0.00 0.00 0.00 0.00 60.65 59.16 1gya s ILE 33 Cb -0.09 -1.21 0.07 0.00 0.01 0.00 0.00 42.46 41.24 1gya s ILE 33 CO 0.27 -0.87 0.67 -0.75 0.00 0.00 0.00 174.94 174.25 1gya s LYS 34 N -3.31 0.81 -0.08 2.79 2.20 0.15 -0.79 119.74 121.51 1gya s LYS 34 Ca 0.01 0.85 -0.01 0.00 -0.36 0.00 0.00 55.97 56.47 1gya s LYS 34 Cb 0.04 0.39 0.03 0.00 -1.51 0.00 0.00 37.83 36.78 1gya s LYS 34 CO -0.08 -0.12 -0.03 -1.58 -0.36 0.00 0.00 175.35 173.18 1gya s TRP 35 N 0.18 0.96 0.08 4.03 0.52 -0.07 -0.60 118.94 124.03 1gya s TRP 35 Ca -0.01 -0.37 0.01 0.00 0.02 0.00 0.00 56.10 55.75 1gya s TRP 35 Cb -0.04 -0.94 -0.04 0.00 -1.15 0.00 0.00 33.47 31.30 1gya s TRP 35 CO 0.02 -0.38 0.21 -1.21 0.02 0.00 0.00 176.95 175.61 1gya s GLU 36 N 1.79 3.38 -0.01 4.98 2.02 -0.28 -0.90 118.70 129.67 1gya s GLU 36 Ca 0.04 -0.50 -0.02 0.00 0.02 0.00 0.00 54.97 54.51 1gya s GLU 36 Cb -0.13 -2.99 -0.04 0.00 0.10 0.00 0.00 34.13 31.07 1gya s GLU 36 CO -0.06 0.59 0.12 -1.59 0.02 0.00 0.00 175.26 174.34 1gya s LYS 37 N -2.64 3.21 0.10 1.61 -2.85 -1.00 -2.44 119.74 115.73 1gya s LYS 37 Ca 0.34 -0.41 -0.08 0.00 -1.00 0.00 0.00 55.97 54.83 1gya s LYS 37 Cb -0.13 -2.95 -0.16 0.00 -2.06 0.00 0.00 37.83 32.53 1gya s LYS 37 CO 0.27 0.66 1.25 1.79 0.10 0.00 0.00 175.35 179.42 1gya h THR 38 N 3.14 1.37 0.25 3.79 1.35 -1.61 -0.07 112.91 121.13 1gya h THR 38 Ca -0.49 -2.45 -0.01 0.00 -0.55 0.00 0.00 66.41 62.91 1gya h THR 38 Cb 1.19 2.47 -0.01 0.00 -1.73 0.00 0.00 68.15 70.07 1gya h THR 38 CO 0.64 0.74 -0.28 0.28 -0.25 0.00 0.00 175.52 176.65 1gya h SER 39 N 0.26 -0.78 0.51 5.36 0.02 -1.96 -3.08 113.55 113.88 1gya h SER 39 Ca -0.11 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1gya h SER 39 Cb 1.67 0.26 0.00 0.00 0.14 0.00 0.00 62.40 64.47 1gya h SER 39 CO 0.18 -0.36 -0.60 -0.67 -1.14 0.00 0.00 176.83 174.25 1gya n ASP 40 N -4.05 0.57 -3.24 3.07 2.03 -1.26 -4.98 116.55 108.69 1gya n ASP 40 Ca -0.06 -0.25 -0.13 0.00 0.52 0.00 0.00 54.79 54.87 1gya n ASP 40 Cb 0.25 0.34 0.05 0.00 -0.72 0.00 0.00 41.12 41.04 1gya n ASP 40 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1gya n LYS 41 N -1.62 -1.96 -3.69 -0.67 5.02 -0.06 -5.03 118.16 110.16 1gya n LYS 41 Ca 0.05 0.99 -0.10 0.00 -2.02 0.00 0.00 58.31 57.23 1gya n LYS 41 Cb 0.36 -5.67 -0.10 0.00 -0.02 0.00 0.00 35.03 29.59 1gya n LYS 41 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1gya s LYS 42 N -4.18 0.39 -0.85 1.97 2.47 -1.10 -4.90 119.74 113.55 1gya s LYS 42 Ca 0.35 0.86 -0.26 0.00 -1.56 0.00 0.00 55.97 55.35 1gya s LYS 42 Cb -0.05 0.05 -0.19 0.00 -1.46 0.00 0.00 37.83 36.18 1gya s LYS 42 CO 0.75 -0.18 2.53 0.36 0.16 0.00 0.00 175.35 178.97 1gya n LYS 43 N 4.48 0.32 0.20 4.03 2.85 -1.26 -2.39 118.16 126.40 1gya n LYS 43 Ca -0.20 -0.07 0.05 0.00 -1.05 0.00 0.00 58.31 57.04 1gya n LYS 43 Cb 0.54 -2.13 0.41 0.00 -0.65 0.00 0.00 35.03 33.20 1gya n LYS 43 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 177.40 176.51 1gya h ILE 44 N 7.76 1.09 -3.48 0.58 3.07 -1.34 -3.45 117.51 121.73 1gya h ILE 44 Ca -0.09 -1.24 -0.16 0.00 1.55 0.00 0.00 64.86 64.93 1gya h ILE 44 Cb 1.25 1.70 -0.22 0.00 -0.27 0.00 0.00 36.82 39.27 1gya h ILE 44 CO 1.33 0.33 -0.51 0.00 -1.05 0.00 0.00 178.15 178.25 1gya s ALA 45 N -4.06 -0.33 -0.04 0.16 0.00 -1.08 -4.84 121.76 111.58 1gya s ALA 45 Ca -0.02 0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.66 1gya s ALA 45 Cb 0.13 -0.00 0.11 0.00 0.00 0.00 0.00 23.12 23.36 1gya s ALA 45 CO 0.70 -0.16 0.94 -1.14 0.00 0.00 0.00 175.76 176.10 1gya s GLN 46 N -0.93 0.73 -0.05 0.00 0.74 -1.09 -0.89 119.66 118.16 1gya s GLN 46 Ca -0.10 -0.26 0.05 0.00 0.05 0.00 0.00 55.36 55.10 1gya s GLN 46 Cb -0.06 0.34 -0.00 0.00 1.10 0.00 0.00 33.01 34.38 1gya s GLN 46 CO 0.01 -0.32 -0.20 0.12 -0.55 0.00 0.00 175.29 174.35 1gya s PHE 47 N -2.94 2.03 -0.29 1.67 5.36 0.03 -2.07 117.98 121.76 1gya s PHE 47 Ca 0.05 -0.63 -0.15 0.00 -0.96 0.00 0.00 56.93 55.25 1gya s PHE 47 Cb -0.01 -1.35 0.14 0.00 -0.34 0.00 0.00 43.02 41.46 1gya s PHE 47 CO -0.08 -0.21 0.93 0.50 -1.46 0.00 0.00 175.22 174.90 1gya s ARG 48 N 0.03 0.40 0.32 10.12 3.52 -1.26 -2.58 118.95 129.49 1gya s ARG 48 Ca -0.06 0.79 0.00 0.00 -0.13 0.00 0.00 55.73 56.34 1gya s ARG 48 Cb -0.13 0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.52 1gya s ARG 48 CO 0.03 -0.10 0.00 1.17 -0.81 0.00 0.00 175.30 175.59 1gya n LYS 49 N 4.30 -2.64 -0.85 5.12 4.81 -1.26 -4.57 118.16 123.07 1gya n LYS 49 Ca -0.15 1.99 -0.17 0.00 -0.87 0.00 0.00 58.31 59.11 1gya n LYS 49 Cb 0.55 -2.29 0.06 0.00 0.02 0.00 0.00 35.03 33.37 1gya n LYS 49 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1gya n GLU 50 N -1.23 1.82 0.00 1.64 0.00 -1.26 -3.78 120.64 117.83 1gya n GLU 50 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 57.16 55.46 1gya n GLU 50 Cb 0.07 -1.67 0.00 0.00 0.00 0.00 0.00 31.44 29.84 1gya n GLU 50 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1gya n LYS 51 N 0.04 6.39 0.00 5.31 4.81 -1.26 -5.09 118.16 128.36 1gya n LYS 51 Ca 0.33 -0.03 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1gya n LYS 51 Cb 0.75 -0.53 0.00 0.00 0.02 0.00 0.00 35.03 35.27 1gya n LYS 51 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1gya n GLU 52 N -0.92 0.00 -2.51 1.64 4.07 -1.25 -5.19 120.64 116.48 1gya n GLU 52 Ca 0.00 0.00 -0.05 0.00 -0.06 0.00 0.00 57.16 57.05 1gya n GLU 52 Cb 0.00 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.36 1gya n GLU 52 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1gya n THR 53 N -0.39 0.00 -3.81 6.31 -2.24 -1.26 -4.46 114.28 108.43 1gya n THR 53 Ca 0.00 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 60.98 1gya n THR 53 Cb 0.00 0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.27 1gya n THR 53 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1gya s PHE 54 N -1.86 2.43 -0.46 4.78 5.36 -0.88 -4.92 117.98 122.42 1gya s PHE 54 Ca 0.04 -2.46 0.06 0.00 -0.96 0.00 0.00 56.93 53.61 1gya s PHE 54 Cb 0.00 -2.18 0.30 0.00 -0.34 0.00 0.00 43.02 40.80 1gya s PHE 54 CO 0.03 -0.83 1.06 0.36 -1.46 0.00 0.00 175.22 174.37 1gya n LYS 55 N 3.97 0.96 0.15 10.12 2.85 -1.26 -2.68 118.16 132.27 1gya n LYS 55 Ca 0.04 -1.93 0.18 0.00 -1.05 0.00 0.00 58.31 55.55 1gya n LYS 55 Cb 0.38 -1.14 0.78 0.00 -0.65 0.00 0.00 35.03 34.39 1gya n LYS 55 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 177.40 178.40 1gya h GLU 56 N 3.22 0.00 -3.81 -1.58 4.11 -1.90 -3.44 114.58 111.18 1gya h GLU 56 Ca -0.10 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.23 1gya h GLU 56 Cb 1.08 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.22 1gya h GLU 56 CO 0.19 0.00 -0.23 0.15 0.07 0.00 0.00 179.01 179.18 1gya s LYS 57 N -4.71 1.37 0.02 1.06 -0.14 -1.26 -5.04 119.74 111.03 1gya s LYS 57 Ca -0.05 -1.24 0.27 0.00 -1.36 0.00 0.00 55.97 53.59 1gya s LYS 57 Cb 0.16 0.42 0.81 0.00 -1.68 0.00 0.00 37.83 37.54 1gya s LYS 57 CO 0.58 -0.54 1.64 -0.25 -0.76 0.00 0.00 175.35 176.02 1gya n ASP 58 N -0.31 0.32 0.30 2.83 8.00 -1.26 -3.32 116.55 123.10 1gya n ASP 58 Ca -0.04 0.13 0.18 0.00 0.71 0.00 0.00 54.79 55.77 1gya n ASP 58 Cb 0.63 -0.12 0.89 0.00 -0.02 0.00 0.00 41.12 42.50 1gya n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gya h THR 59 N 0.00 0.16 -1.81 -3.53 1.03 -1.80 -2.61 112.91 104.34 1gya h THR 59 Ca 0.00 -0.34 -0.30 0.00 -0.01 0.00 0.00 66.41 65.76 1gya h THR 59 Cb 0.53 1.29 -0.29 0.00 -1.07 0.00 0.00 68.15 68.60 1gya h THR 59 CO 0.00 0.03 -0.63 -0.31 -0.01 0.00 0.00 175.52 174.60 1gya s TYR 60 N -3.98 -0.59 0.17 0.00 2.02 -1.21 -3.23 117.35 110.52 1gya s TYR 60 Ca -0.02 -0.48 0.07 0.00 -0.37 0.00 0.00 57.07 56.27 1gya s TYR 60 Cb 0.12 -0.28 -0.04 0.00 -0.40 0.00 0.00 41.96 41.35 1gya s TYR 60 CO 0.51 -1.00 0.00 0.21 -1.57 0.00 0.00 175.55 173.70 1gya s LYS 61 N 1.71 2.41 0.09 -0.62 2.20 -0.25 -4.57 119.74 120.71 1gya s LYS 61 Ca 0.15 -1.10 0.05 0.00 -0.36 0.00 0.00 55.97 54.71 1gya s LYS 61 Cb -0.13 -2.36 -0.04 0.00 -1.51 0.00 0.00 37.83 33.78 1gya s LYS 61 CO -0.10 0.46 0.01 -1.17 -0.36 0.00 0.00 175.35 174.19 1gya s LEU 62 N -2.93 3.52 0.41 5.43 2.96 -1.26 -1.77 118.68 125.04 1gya s LEU 62 Ca 0.27 -0.15 0.04 0.00 -0.22 0.00 0.00 54.13 54.07 1gya s LEU 62 Cb -0.09 -2.24 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 1gya s LEU 62 CO 0.19 0.17 0.11 -0.36 -1.32 0.00 0.00 176.35 175.14 1gya s PHE 63 N -1.33 1.81 0.10 5.38 0.40 -0.33 -4.97 117.98 119.03 1gya s PHE 63 Ca 0.26 -1.23 -0.14 0.00 -0.60 0.00 0.00 56.93 55.23 1gya s PHE 63 Cb -0.12 -1.21 -0.14 0.00 0.51 0.00 0.00 43.02 42.06 1gya s PHE 63 CO 0.19 -0.22 1.32 0.87 0.70 0.00 0.00 175.22 178.08 1gya h LYS 64 N 1.77 0.76 -0.58 0.44 6.56 -2.01 -3.22 116.57 120.29 1gya h LYS 64 Ca -0.37 -0.56 0.00 0.00 -1.06 0.00 0.00 60.65 58.66 1gya h LYS 64 Cb 1.28 0.10 0.00 0.00 -0.57 0.00 0.00 32.23 33.03 1gya h LYS 64 CO 0.59 1.18 0.00 0.27 -2.06 0.00 0.00 179.45 179.43 1gya n ASN 65 N -4.04 2.14 -0.19 0.86 0.23 -1.26 -4.50 115.26 108.49 1gya n ASN 65 Ca -0.07 -2.18 -0.02 0.00 -0.53 0.00 0.00 54.58 51.78 1gya n ASN 65 Cb 0.67 -0.39 -0.01 0.00 -2.08 0.00 0.00 39.78 37.97 1gya n ASN 65 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1gya n GLY 66 N 0.55 0.47 3.83 4.83 0.00 -1.21 -4.76 105.19 108.89 1gya n GLY 66 Ca 0.10 -0.93 -0.38 0.00 0.00 0.00 0.00 46.02 44.81 1gya n GLY 66 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gya s THR 67 N -2.09 4.84 0.14 2.61 2.01 -1.26 -3.91 115.64 117.98 1gya s THR 67 Ca 0.00 1.03 0.05 0.00 0.31 0.00 0.00 61.69 63.08 1gya s THR 67 Cb 0.00 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 1gya s THR 67 CO 0.00 0.49 0.06 -0.22 -0.69 0.00 0.00 174.62 174.26 1gya s LEU 68 N -1.30 3.59 -0.15 4.42 0.20 0.05 -1.19 118.68 124.31 1gya s LEU 68 Ca 0.30 -0.20 -0.02 0.00 0.69 0.00 0.00 54.13 54.90 1gya s LEU 68 Cb -0.18 -2.25 0.05 0.00 -0.43 0.00 0.00 46.19 43.38 1gya s LEU 68 CO 0.18 0.11 0.01 -0.75 -0.29 0.00 0.00 176.35 175.61 1gya s LYS 69 N -2.78 0.73 -0.42 1.98 2.36 -0.73 0.97 119.74 121.85 1gya s LYS 69 Ca 0.29 -0.25 -0.07 0.00 -2.55 0.00 0.00 55.97 53.39 1gya s LYS 69 Cb -0.10 -1.70 0.09 0.00 -1.05 0.00 0.00 37.83 35.06 1gya s LYS 69 CO 0.21 -0.50 0.25 0.42 1.55 0.00 0.00 175.35 177.28 1gya s ILE 70 N 1.87 3.93 0.09 5.43 1.01 0.55 -1.09 121.20 132.99 1gya s ILE 70 Ca 0.01 -1.63 -0.19 0.00 0.00 0.00 0.00 60.65 58.85 1gya s ILE 70 Cb -0.15 -3.50 -0.07 0.00 0.01 0.00 0.00 42.46 38.75 1gya s ILE 70 CO -0.07 -0.58 0.57 -0.75 0.00 0.00 0.00 174.94 174.11 1gya s LYS 71 N 1.34 4.18 0.26 2.79 2.20 -0.98 -1.94 119.74 127.57 1gya s LYS 71 Ca 0.04 0.71 0.00 0.00 -0.36 0.00 0.00 55.97 56.37 1gya s LYS 71 Cb -0.23 -3.19 0.00 0.00 -1.51 0.00 0.00 37.83 32.89 1gya s LYS 71 CO -0.00 0.62 0.00 1.58 -0.36 0.00 0.00 175.35 177.18 1gya n HIS 72 N 1.59 -4.74 -4.13 4.03 -0.00 -1.15 -4.43 115.22 106.39 1gya n HIS 72 Ca -0.10 2.73 -0.09 0.00 0.46 0.00 0.00 57.72 60.73 1gya n HIS 72 Cb 0.51 -3.63 -0.10 0.00 -0.12 0.00 0.00 29.99 26.65 1gya n HIS 72 CO 0.00 0.00 0.00 -1.17 0.46 0.00 0.00 176.34 175.63 1gya s LEU 73 N -0.97 2.05 0.00 0.27 2.96 0.31 -4.86 118.68 118.44 1gya s LEU 73 Ca 0.00 -1.13 0.00 0.00 -0.22 0.00 0.00 54.13 52.78 1gya s LEU 73 Cb 0.00 0.25 0.00 0.00 0.50 0.00 0.00 46.19 46.94 1gya s LEU 73 CO 0.00 -0.68 0.00 0.29 -1.32 0.00 0.00 176.35 174.64 1gya n LYS 74 N -0.02 0.00 0.04 1.98 4.01 -1.26 -0.57 118.16 122.34 1gya n LYS 74 Ca -0.09 0.00 -0.07 0.00 -0.51 0.00 0.00 58.31 57.64 1gya n LYS 74 Cb 0.63 0.00 -0.12 0.00 -0.51 0.00 0.00 35.03 35.02 1gya n LYS 74 CO 0.00 0.00 0.00 1.15 -1.11 0.00 0.00 177.40 177.44 1gya h THR 75 N 0.00 1.54 0.18 -0.18 2.02 -1.93 -3.17 112.91 111.37 1gya h THR 75 Ca 0.00 -3.28 -0.01 0.00 0.77 0.00 0.00 66.41 63.89 1gya h THR 75 Cb 0.00 2.76 0.00 0.00 -1.74 0.00 0.00 68.15 69.17 1gya h THR 75 CO 0.00 0.88 -0.09 0.44 0.37 0.00 0.00 175.52 177.12 1gya h ASP 76 N 0.00 -0.21 0.05 4.18 5.19 -2.01 -3.25 116.42 120.37 1gya h ASP 76 Ca -0.06 -0.32 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1gya h ASP 76 Cb 1.82 0.05 0.00 0.00 0.18 0.00 0.00 39.33 41.38 1gya h ASP 76 CO 0.12 0.29 0.00 0.47 -3.12 0.00 0.00 179.24 177.00 1gya n ASP 77 N -4.97 0.00 -4.78 6.45 8.00 -1.26 -4.61 116.55 115.38 1gya n ASP 77 Ca -0.08 -0.46 -0.39 0.00 0.71 0.00 0.00 54.79 54.56 1gya n ASP 77 Cb 0.26 -0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.26 1gya n ASP 77 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1gya s GLN 78 N -2.09 4.34 0.24 -1.24 -0.44 -1.20 -4.66 119.66 114.62 1gya s GLN 78 Ca 0.25 0.86 -0.20 0.00 -2.50 0.00 0.00 55.36 53.77 1gya s GLN 78 Cb 0.12 -3.29 0.03 0.00 -1.64 0.00 0.00 33.01 28.23 1gya s GLN 78 CO 0.21 0.50 0.64 -0.51 0.50 0.00 0.00 175.29 176.64 1gya s ASP 79 N -0.72 -0.29 0.09 6.67 1.11 -1.19 -4.97 116.67 117.36 1gya s ASP 79 Ca 0.32 -0.52 -0.13 0.00 0.18 0.00 0.00 52.55 52.40 1gya s ASP 79 Cb -0.20 0.67 -0.06 0.00 1.07 0.00 0.00 42.92 44.40 1gya s ASP 79 CO 0.20 -1.22 0.47 -0.63 1.18 0.00 0.00 175.17 175.17 1gya s ILE 80 N -3.89 4.97 0.25 0.77 1.09 -1.26 0.11 121.20 123.23 1gya s ILE 80 Ca 0.10 0.73 0.01 0.00 -1.10 0.00 0.00 60.65 60.40 1gya s ILE 80 Cb -0.04 -3.71 -0.05 0.00 -1.06 0.00 0.00 42.46 37.60 1gya s ILE 80 CO 0.02 0.36 0.08 -0.31 -0.10 0.00 0.00 174.94 174.99 1gya s TYR 81 N -1.33 1.53 -0.14 3.97 1.51 -1.00 -1.47 117.35 120.42 1gya s TYR 81 Ca 0.32 -1.15 -0.07 0.00 -1.01 0.00 0.00 57.07 55.17 1gya s TYR 81 Cb -0.15 -0.90 0.06 0.00 -0.11 0.00 0.00 41.96 40.85 1gya s TYR 81 CO 0.17 -0.30 0.32 0.21 -1.11 0.00 0.00 175.55 174.84 1gya s LYS 82 N -4.01 0.27 -0.31 -0.62 2.20 -1.02 -0.03 119.74 116.22 1gya s LYS 82 Ca 0.36 0.69 -0.09 0.00 -0.36 0.00 0.00 55.97 56.57 1gya s LYS 82 Cb 0.08 -0.04 -0.01 0.00 -1.51 0.00 0.00 37.83 36.35 1gya s LYS 82 CO 0.13 -0.18 0.14 0.54 -0.36 0.00 0.00 175.35 175.61 1gya s VAL 83 N 1.56 4.49 -0.14 4.02 0.11 0.17 -1.13 120.40 129.48 1gya s VAL 83 Ca -0.08 -0.45 0.00 0.00 -2.93 0.00 0.00 61.98 58.53 1gya s VAL 83 Cb -0.10 -3.29 0.02 0.00 -1.53 0.00 0.00 36.38 31.49 1gya s VAL 83 CO -0.10 0.08 -0.12 -0.94 -3.33 0.00 0.00 175.10 170.68 1gya s SER 84 N 1.60 2.62 -0.08 3.54 1.04 0.23 -0.88 113.70 121.76 1gya s SER 84 Ca 0.04 -0.47 0.03 0.00 0.48 0.00 0.00 55.95 56.03 1gya s SER 84 Cb -0.17 -1.11 0.01 0.00 0.10 0.00 0.00 66.02 64.85 1gya s SER 84 CO 0.06 -0.08 -0.16 -0.63 0.98 0.00 0.00 173.24 173.41 1gya s ILE 85 N 1.53 1.47 0.30 -1.02 -1.09 -1.03 0.31 121.20 121.67 1gya s ILE 85 Ca 0.05 -0.67 0.07 0.00 -2.23 0.00 0.00 60.65 57.87 1gya s ILE 85 Cb -0.13 -1.31 -0.06 0.00 -1.58 0.00 0.00 42.46 39.38 1gya s ILE 85 CO -0.10 0.43 -0.06 -0.31 -1.23 0.00 0.00 174.94 173.67 1gya s TYR 86 N 0.59 2.06 0.46 3.97 1.51 -0.49 -3.40 117.35 122.05 1gya s TYR 86 Ca -0.15 -0.67 -0.08 0.00 -1.01 0.00 0.00 57.07 55.16 1gya s TYR 86 Cb -0.16 -1.19 0.11 0.00 -0.11 0.00 0.00 41.96 40.60 1gya s TYR 86 CO 0.05 0.34 0.61 -0.40 -1.11 0.00 0.00 175.55 175.04 1gya n ASP 87 N -0.64 -0.04 0.13 2.29 5.75 -1.03 0.07 116.55 123.08 1gya n ASP 87 Ca -0.05 -1.20 0.05 0.00 -0.01 0.00 0.00 54.79 53.58 1gya n ASP 87 Cb 0.64 -0.47 0.50 0.00 -1.03 0.00 0.00 41.12 40.76 1gya n ASP 87 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1gya h THR 88 N -1.40 1.08 -0.62 2.12 1.35 -1.85 -2.79 112.91 110.80 1gya h THR 88 Ca -0.20 -0.24 -0.21 0.00 -0.55 0.00 0.00 66.41 65.21 1gya h THR 88 Cb 0.55 0.85 -0.13 0.00 -1.73 0.00 0.00 68.15 67.70 1gya h THR 88 CO 0.14 0.09 0.27 0.29 -0.25 0.00 0.00 175.52 176.06 1gya n LYS 89 N -4.46 2.96 -1.89 4.72 5.02 -1.26 -4.88 118.16 118.38 1gya n LYS 89 Ca -0.00 -2.40 -0.16 0.00 -2.02 0.00 0.00 58.31 53.73 1gya n LYS 89 Cb 0.12 -2.01 -0.04 0.00 -0.02 0.00 0.00 35.03 33.08 1gya n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gya n GLY 90 N -0.18 0.65 3.70 0.72 0.00 -1.05 -4.97 105.19 104.06 1gya n GLY 90 Ca 0.35 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1gya n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gya s LYS 91 N -4.08 4.30 -0.85 1.61 1.02 -1.26 -4.93 119.74 115.56 1gya s LYS 91 Ca 0.00 0.54 -0.25 0.00 0.02 0.00 0.00 55.97 56.28 1gya s LYS 91 Cb 0.00 -3.49 -0.01 0.00 -0.52 0.00 0.00 37.83 33.81 1gya s LYS 91 CO 0.00 0.01 1.76 0.54 -0.92 0.00 0.00 175.35 176.74 1gya s ASN 92 N 0.86 5.55 0.10 2.83 2.20 -1.26 -2.46 114.94 122.76 1gya s ASN 92 Ca 0.28 -0.59 -0.09 0.00 -0.94 0.00 0.00 52.86 51.52 1gya s ASN 92 Cb -0.16 -2.56 -0.18 0.00 -2.00 0.00 0.00 41.25 36.35 1gya s ASN 92 CO 0.11 -2.32 1.22 -0.37 -2.94 0.00 0.00 177.10 172.81 1gya h VAL 93 N 6.96 1.36 -2.39 3.54 -1.51 -1.92 -3.46 116.25 118.83 1gya h VAL 93 Ca 0.00 -2.45 -0.08 0.00 -1.23 0.00 0.00 66.70 62.94 1gya h VAL 93 Cb 1.05 2.51 -0.22 0.00 -2.13 0.00 0.00 31.29 32.49 1gya h VAL 93 CO 1.26 0.74 -0.04 -0.22 -1.23 0.00 0.00 177.57 178.08 1gya s LEU 94 N -7.80 -0.13 0.23 4.19 1.98 -1.23 -5.10 118.68 110.82 1gya s LEU 94 Ca -0.07 0.99 -0.06 0.00 -2.89 0.00 0.00 54.13 52.10 1gya s LEU 94 Cb 0.08 1.95 -0.02 0.00 0.66 0.00 0.00 46.19 48.86 1gya s LEU 94 CO 0.90 -0.27 0.30 -1.83 -1.89 0.00 0.00 176.35 173.56 1gya s GLU 95 N -0.03 1.41 -0.09 1.98 -1.05 -1.26 -2.47 118.70 117.18 1gya s GLU 95 Ca -0.03 -1.50 -0.31 0.00 -0.15 0.00 0.00 54.97 52.98 1gya s GLU 95 Cb -0.04 0.37 0.12 0.00 -0.44 0.00 0.00 34.13 34.14 1gya s GLU 95 CO 0.02 -0.53 1.03 0.21 0.95 0.00 0.00 175.26 176.94 1gya s LYS 96 N -4.00 0.59 -0.10 -4.83 2.47 -0.06 -5.00 119.74 108.80 1gya s LYS 96 Ca 0.32 -0.20 0.04 0.00 -1.56 0.00 0.00 55.97 54.57 1gya s LYS 96 Cb 0.03 0.27 0.00 0.00 -1.46 0.00 0.00 37.83 36.68 1gya s LYS 96 CO 0.12 -0.26 -0.23 0.42 0.16 0.00 0.00 175.35 175.56 1gya s ILE 97 N -2.69 2.11 0.43 5.43 1.01 -1.25 -0.65 121.20 125.58 1gya s ILE 97 Ca 0.06 -1.00 0.06 0.00 0.00 0.00 0.00 60.65 59.78 1gya s ILE 97 Cb -0.01 -1.81 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 1gya s ILE 97 CO -0.07 0.56 0.13 -0.36 0.00 0.00 0.00 174.94 175.20 1gya s PHE 98 N 0.38 2.42 -0.35 3.97 0.40 0.95 -2.25 117.98 123.50 1gya s PHE 98 Ca -0.18 -0.67 0.05 0.00 -0.60 0.00 0.00 56.93 55.54 1gya s PHE 98 Cb -0.18 -1.87 0.18 0.00 0.51 0.00 0.00 43.02 41.66 1gya s PHE 98 CO 0.08 0.21 0.53 -0.51 0.70 0.00 0.00 175.22 176.23 1gya s ASP 99 N -3.88 -0.62 0.05 1.36 1.11 -1.24 -2.37 116.67 111.08 1gya s ASP 99 Ca 0.35 -0.67 -0.30 0.00 0.18 0.00 0.00 52.55 52.11 1gya s ASP 99 Cb 0.05 1.52 -0.05 0.00 1.07 0.00 0.00 42.92 45.51 1gya s ASP 99 CO 0.19 -0.25 1.08 -0.22 1.18 0.00 0.00 175.17 177.15 1gya s LEU 100 N 2.10 4.39 0.28 1.23 1.98 0.12 -1.95 118.68 126.84 1gya s LEU 100 Ca 0.14 1.86 0.02 0.00 -2.89 0.00 0.00 54.13 53.26 1gya s LEU 100 Cb -0.09 -3.58 -0.05 0.00 0.66 0.00 0.00 46.19 43.13 1gya s LEU 100 CO -0.15 -0.33 0.11 -0.54 -1.89 0.00 0.00 176.35 173.55 1gya s LYS 101 N 0.83 1.51 0.05 1.98 1.02 -0.66 -3.19 119.74 121.27 1gya s LYS 101 Ca 0.54 -1.83 0.09 0.00 0.02 0.00 0.00 55.97 54.79 1gya s LYS 101 Cb -0.26 -0.32 -0.03 0.00 -0.52 0.00 0.00 37.83 36.70 1gya s LYS 101 CO 0.29 -0.32 -0.26 0.42 -0.92 0.00 0.00 175.35 174.56 1gya s ILE 102 N -3.64 2.08 0.00 2.17 -1.09 -1.26 0.25 121.20 119.71 1gya s ILE 102 Ca 0.36 -1.40 0.04 0.00 -2.23 0.00 0.00 60.65 57.43 1gya s ILE 102 Cb 0.07 -1.79 -0.01 0.00 -1.58 0.00 0.00 42.46 39.15 1gya s ILE 102 CO 0.15 0.31 -0.13 -1.58 -1.23 0.00 0.00 174.94 172.46 1gya s GLN 103 N -1.32 1.01 -0.43 2.79 -0.44 -1.16 -4.88 119.66 115.24 1gya s GLN 103 Ca 0.11 -0.53 0.05 0.00 -2.50 0.00 0.00 55.36 52.50 1gya s GLN 103 Cb -0.10 -0.99 0.19 0.00 -1.64 0.00 0.00 33.01 30.47 1gya s GLN 103 CO 0.02 0.27 0.73 -1.21 0.50 0.00 0.00 175.29 175.60 1gya s GLU 104 N -0.50 0.80 0.00 1.67 2.02 -1.26 -4.78 118.70 116.65 1gya s GLU 104 Ca 0.04 -0.50 0.09 0.00 0.02 0.00 0.00 54.97 54.62 1gya s GLU 104 Cb -0.06 0.04 0.07 0.00 0.10 0.00 0.00 34.13 34.28 1gya s GLU 104 CO -0.00 -1.08 0.79 2.89 0.02 0.00 0.00 175.26 177.87