#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 1.15 -0.16 -1.58 2.02 -1.26 -5.10 118.70 113.78 1gya s GLU 2 Ca 0.00 -0.86 0.01 0.00 0.02 0.00 0.00 54.97 54.14 1gya s GLU 2 Cb 0.00 -2.37 0.02 0.00 0.10 0.00 0.00 34.13 31.88 1gya s GLU 2 CO 0.00 -0.69 -0.18 0.42 0.02 0.00 0.00 175.26 174.83 1gya s ILE 3 N 1.56 1.83 0.28 -1.63 1.01 -1.26 -5.12 121.20 117.87 1gya s ILE 3 Ca -0.01 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.85 1gya s ILE 3 Cb -0.18 -1.67 -0.05 0.00 0.01 0.00 0.00 42.46 40.57 1gya s ILE 3 CO -0.10 0.50 0.10 0.42 0.00 0.00 0.00 174.94 175.87 1gya s THR 4 N 1.25 0.59 -0.38 2.92 -4.23 -1.26 -5.08 115.64 109.46 1gya s THR 4 Ca 0.02 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.64 1gya s THR 4 Cb -0.14 -2.63 0.41 0.00 1.34 0.00 0.00 72.50 71.49 1gya s THR 4 CO -0.09 0.00 1.29 0.59 -0.54 0.00 0.00 174.62 175.87 1gya n ASN 5 N -0.59 -1.14 -3.56 3.99 3.02 -1.26 -5.14 115.26 110.59 1gya n ASN 5 Ca -0.00 -2.48 -0.05 0.00 -0.03 0.00 0.00 54.58 52.01 1gya n ASN 5 Cb 0.66 0.66 -0.00 0.00 -0.61 0.00 0.00 39.78 40.48 1gya n ASN 5 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gya s ALA 6 N -0.55 -1.38 -0.19 5.41 0.00 -1.26 -4.21 121.76 119.58 1gya s ALA 6 Ca 0.22 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.97 1gya s ALA 6 Cb 0.41 0.72 0.03 0.00 0.00 0.00 0.00 23.12 24.28 1gya s ALA 6 CO -0.07 -1.04 -0.18 -0.51 0.00 0.00 0.00 175.76 173.96 1gya s LEU 7 N -3.05 2.36 -0.79 0.00 1.43 -0.53 -4.96 118.68 113.15 1gya s LEU 7 Ca 0.14 -0.79 -0.25 0.00 -1.03 0.00 0.00 54.13 52.20 1gya s LEU 7 Cb -0.03 -1.49 -0.07 0.00 0.03 0.00 0.00 46.19 44.63 1gya s LEU 7 CO 0.06 -0.04 2.11 -1.61 0.23 0.00 0.00 176.35 177.10 1gya s GLU 8 N 1.26 2.24 -0.15 1.70 0.41 -1.26 -3.20 118.70 119.70 1gya s GLU 8 Ca 0.02 0.23 -0.02 0.00 -0.41 0.00 0.00 54.97 54.79 1gya s GLU 8 Cb -0.14 -4.84 -0.02 0.00 -1.78 0.00 0.00 34.13 27.35 1gya s GLU 8 CO -0.11 -3.59 -0.08 0.95 -0.49 0.00 0.00 175.26 171.94 1gya s THR 9 N 11.51 3.43 0.23 3.63 -4.23 -1.16 -5.05 115.64 123.99 1gya s THR 9 Ca 0.79 -0.52 0.04 0.00 -1.18 0.00 0.00 61.69 60.82 1gya s THR 9 Cb -0.10 -2.48 -0.05 0.00 1.34 0.00 0.00 72.50 71.20 1gya s THR 9 CO 0.07 0.50 -0.03 0.26 -0.54 0.00 0.00 174.62 174.89 1gya s TRP 10 N 0.48 1.61 0.23 3.99 0.52 -1.26 -0.92 118.94 123.58 1gya s TRP 10 Ca -0.06 -0.85 -0.22 0.00 0.02 0.00 0.00 56.10 54.99 1gya s TRP 10 Cb -0.15 -0.92 0.04 0.00 -1.15 0.00 0.00 33.47 31.29 1gya s TRP 10 CO 0.04 0.05 0.70 0.20 0.02 0.00 0.00 176.95 177.95 1gya s GLY 11 N -3.32 -0.28 0.28 0.98 0.00 -0.13 -4.76 107.32 100.09 1gya s GLY 11 Ca 0.27 0.00 0.07 0.00 0.00 0.00 0.00 44.72 45.06 1gya s GLY 11 CO 0.08 0.01 0.27 0.00 0.00 0.00 0.00 173.10 173.46 1gya s ALA 12 N -3.81 3.75 -0.02 3.20 0.00 -1.26 -2.98 121.76 120.64 1gya s ALA 12 Ca 0.08 -1.45 -0.30 0.00 0.00 0.00 0.00 51.96 50.28 1gya s ALA 12 Cb -0.04 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.67 1gya s ALA 12 CO -0.00 0.17 1.24 -0.51 0.00 0.00 0.00 175.76 176.65 1gya s LEU 13 N -3.93 4.31 -0.09 0.00 1.02 -1.26 -2.15 118.68 116.58 1gya s LEU 13 Ca 0.36 1.91 -0.00 0.00 0.02 0.00 0.00 54.13 56.42 1gya s LEU 13 Cb -0.08 -3.56 0.00 0.00 0.02 0.00 0.00 46.19 42.57 1gya s LEU 13 CO 0.26 -0.58 0.04 0.61 0.02 0.00 0.00 176.35 176.71 1gya n GLY 14 N 3.38 0.67 2.82 -3.19 0.00 -0.80 -4.85 105.19 103.23 1gya n GLY 14 Ca 0.11 -0.70 -0.16 0.00 0.00 0.00 0.00 46.02 45.26 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 -4.70 0.26 -0.06 1.61 0.74 -0.92 -4.55 119.66 112.04 1gya s GLN 15 Ca 0.02 0.07 -0.26 0.00 0.05 0.00 0.00 55.36 55.24 1gya s GLN 15 Cb -0.01 -0.43 -0.03 0.00 1.10 0.00 0.00 33.01 33.64 1gya s GLN 15 CO 0.03 -0.12 0.81 0.16 -0.55 0.00 0.00 175.29 175.63 1gya s ASP 16 N 0.90 7.11 0.11 6.67 -4.77 -1.26 -2.22 116.67 123.21 1gya s ASP 16 Ca -0.09 1.35 0.03 0.00 -3.30 0.00 0.00 52.55 50.54 1gya s ASP 16 Cb -0.12 -2.47 -0.04 0.00 -1.09 0.00 0.00 42.92 39.20 1gya s ASP 16 CO -0.02 -0.21 -0.09 -0.51 0.70 0.00 0.00 175.17 175.05 1gya s ILE 17 N 1.07 0.94 -0.06 2.11 1.10 -0.97 -4.94 121.20 120.45 1gya s ILE 17 Ca 0.43 -1.85 0.03 0.00 -0.51 0.00 0.00 60.65 58.75 1gya s ILE 17 Cb -0.19 -1.59 -0.02 0.00 0.15 0.00 0.00 42.46 40.81 1gya s ILE 17 CO 0.21 -0.70 -0.16 0.20 -2.11 0.00 0.00 174.94 172.37 1gya s ASN 18 N -2.83 3.84 -0.44 4.50 0.01 -1.26 -1.16 114.94 117.60 1gya s ASN 18 Ca 0.11 -0.28 -0.28 0.00 -0.71 0.00 0.00 52.86 51.70 1gya s ASN 18 Cb 0.01 -0.97 0.03 0.00 0.41 0.00 0.00 41.25 40.73 1gya s ASN 18 CO -0.01 0.29 1.06 -0.76 -1.51 0.00 0.00 177.10 176.17 1gya s LEU 19 N -0.43 3.80 -0.40 0.60 2.01 0.93 -4.90 118.68 120.30 1gya s LEU 19 Ca 0.05 0.48 -0.14 0.00 0.01 0.00 0.00 54.13 54.53 1gya s LEU 19 Cb -0.12 -3.44 0.01 0.00 0.01 0.00 0.00 46.19 42.66 1gya s LEU 19 CO 0.02 -1.11 0.28 -1.81 1.01 0.00 0.00 176.35 174.74 1gya s ASP 20 N 2.24 6.08 0.67 2.29 1.01 -1.26 -0.66 116.67 127.03 1gya s ASP 20 Ca 0.44 -0.81 -0.15 0.00 0.71 0.00 0.00 52.55 52.74 1gya s ASP 20 Cb -0.09 -2.15 0.00 0.00 1.01 0.00 0.00 42.92 41.69 1gya s ASP 20 CO 0.27 -0.41 1.10 -0.51 0.21 0.00 0.00 175.17 175.83 1gya s ILE 21 N 1.68 3.31 0.59 0.77 2.07 -1.26 -5.05 121.20 123.32 1gya s ILE 21 Ca 0.05 0.59 -0.05 0.00 -1.41 0.00 0.00 60.65 59.83 1gya s ILE 21 Cb -0.19 -3.11 0.08 0.00 0.13 0.00 0.00 42.46 39.37 1gya s ILE 21 CO 0.10 -0.40 0.18 -2.65 -1.91 0.00 0.00 174.94 170.26 1gya n PRO 22 N -2.51 0.28 -0.57 3.50 -0.02 -1.26 -4.85 135.00 129.57 1gya n PRO 22 Ca 0.10 -0.31 -0.11 0.00 -2.02 0.00 0.00 63.50 61.16 1gya n PRO 22 Cb 0.52 -0.95 0.08 0.00 -0.02 0.00 0.00 33.50 33.13 1gya n PRO 22 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1gya n SER 23 N 0.22 3.54 -4.51 2.55 3.41 -1.26 -4.79 113.62 112.78 1gya n SER 23 Ca 0.03 -2.74 -0.35 0.00 -0.26 0.00 0.00 58.87 55.55 1gya n SER 23 Cb 0.13 -0.68 -0.12 0.00 -0.26 0.00 0.00 64.21 63.28 1gya n SER 23 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1gya s PHE 24 N -1.49 3.12 0.10 7.33 5.36 -1.26 -5.10 117.98 126.04 1gya s PHE 24 Ca 0.26 -0.25 0.10 0.00 -0.96 0.00 0.00 56.93 56.08 1gya s PHE 24 Cb 0.22 -2.14 -0.04 0.00 -0.34 0.00 0.00 43.02 40.72 1gya s PHE 24 CO 0.05 -0.15 -0.27 1.14 -1.46 0.00 0.00 175.22 174.53 1gya s GLN 25 N 1.02 1.51 0.76 10.12 -2.07 -1.26 -4.98 119.66 124.76 1gya s GLN 25 Ca 0.03 -1.26 -0.08 0.00 -1.82 0.00 0.00 55.36 52.23 1gya s GLN 25 Cb -0.14 -1.90 0.09 0.00 -1.09 0.00 0.00 33.01 29.97 1gya s GLN 25 CO 0.03 0.46 1.08 0.00 -1.32 0.00 0.00 175.29 175.54 1gya s MET 26 N -1.79 1.90 0.00 9.60 0.23 -1.26 -5.07 119.30 122.91 1gya s MET 26 Ca 0.13 -0.29 0.00 0.00 -1.03 0.00 0.00 55.69 54.50 1gya s MET 26 Cb -0.10 -2.11 0.00 0.00 -1.53 0.00 0.00 34.83 31.09 1gya s MET 26 CO 0.05 -1.47 0.00 -1.13 -2.03 0.00 0.00 175.02 170.43 1gya n SER 27 N -3.09 0.00 0.08 -1.18 3.41 -1.26 -5.01 113.62 106.57 1gya n SER 27 Ca 0.10 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.83 1gya n SER 27 Cb 0.60 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.87 1gya n SER 27 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1gya n ASP 28 N 0.00 0.74 -0.05 4.04 5.75 -1.26 -4.03 116.55 121.74 1gya n ASP 28 Ca 0.00 0.38 0.01 0.00 -0.01 0.00 0.00 54.79 55.17 1gya n ASP 28 Cb 0.00 -0.39 -0.16 0.00 -1.03 0.00 0.00 41.12 39.55 1gya n ASP 28 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1gya n ASP 29 N -2.16 0.26 -4.83 -1.12 8.00 -1.26 -4.96 116.55 110.48 1gya n ASP 29 Ca 0.05 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.19 1gya n ASP 29 Cb 0.43 1.50 -0.06 0.00 -0.02 0.00 0.00 41.12 42.97 1gya n ASP 29 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1gya s ILE 30 N -2.99 4.65 0.00 0.53 1.01 -1.26 -3.21 121.20 119.94 1gya s ILE 30 Ca -0.08 1.12 0.00 0.00 0.00 0.00 0.00 60.65 61.69 1gya s ILE 30 Cb 0.10 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.77 1gya s ILE 30 CO 0.83 0.15 0.00 -0.67 0.00 0.00 0.00 174.94 175.25 1gya n ASP 31 N 0.57 1.78 -4.74 3.58 -0.08 -1.14 -4.78 116.55 111.75 1gya n ASP 31 Ca -0.02 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.94 1gya n ASP 31 Cb 0.52 0.03 -0.08 0.00 2.34 0.00 0.00 41.12 43.93 1gya n ASP 31 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1gya s ASP 32 N -3.22 5.43 -0.27 1.67 -1.08 -0.05 -4.68 116.67 114.47 1gya s ASP 32 Ca 0.00 0.05 -0.03 0.00 -0.52 0.00 0.00 52.55 52.06 1gya s ASP 32 Cb 0.00 -1.48 0.11 0.00 -1.46 0.00 0.00 42.92 40.09 1gya s ASP 32 CO 0.00 0.26 0.20 -0.63 0.52 0.00 0.00 175.17 175.52 1gya s ILE 33 N -1.19 -0.24 0.10 4.11 1.01 -0.85 -1.49 121.20 122.66 1gya s ILE 33 Ca 0.23 -0.53 0.08 0.00 0.00 0.00 0.00 60.65 60.43 1gya s ILE 33 Cb -0.12 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.40 1gya s ILE 33 CO 0.14 -0.53 -0.13 -0.54 0.00 0.00 0.00 174.94 173.88 1gya s LYS 34 N 2.24 2.02 -0.04 2.79 -0.14 -0.93 -1.08 119.74 124.60 1gya s LYS 34 Ca 0.08 -1.06 -0.01 0.00 -1.36 0.00 0.00 55.97 53.62 1gya s LYS 34 Cb -0.15 -2.23 0.03 0.00 -1.68 0.00 0.00 37.83 33.80 1gya s LYS 34 CO -0.30 0.50 0.09 -1.58 -0.76 0.00 0.00 175.35 173.30 1gya s TRP 35 N -1.16 -0.06 0.37 3.18 0.52 0.21 -2.13 118.94 119.87 1gya s TRP 35 Ca 0.19 0.30 0.07 0.00 0.02 0.00 0.00 56.10 56.69 1gya s TRP 35 Cb -0.11 -0.17 -0.07 0.00 -1.15 0.00 0.00 33.47 31.97 1gya s TRP 35 CO 0.11 -0.13 -0.01 -1.21 0.02 0.00 0.00 176.95 175.74 1gya s GLU 36 N 1.14 1.85 -0.44 4.98 2.02 -0.72 -2.18 118.70 125.35 1gya s GLU 36 Ca -0.09 -2.02 -0.17 0.00 0.02 0.00 0.00 54.97 52.71 1gya s GLU 36 Cb -0.12 -1.48 0.04 0.00 0.10 0.00 0.00 34.13 32.66 1gya s GLU 36 CO -0.04 -0.03 0.45 0.21 0.02 0.00 0.00 175.26 175.87 1gya s LYS 37 N -3.72 3.07 0.21 1.61 2.20 -0.68 -2.59 119.74 119.84 1gya s LYS 37 Ca 0.34 -0.90 -0.13 0.00 -0.36 0.00 0.00 55.97 54.93 1gya s LYS 37 Cb 0.08 -4.02 0.25 0.00 -1.51 0.00 0.00 37.83 32.63 1gya s LYS 37 CO 0.17 -0.93 1.62 1.79 -0.36 0.00 0.00 175.35 177.64 1gya h THR 38 N 5.75 0.35 0.00 3.43 1.35 -1.70 -0.67 112.91 121.41 1gya h THR 38 Ca -0.27 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1gya h THR 38 Cb 1.11 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 1gya h THR 38 CO 0.83 0.00 0.00 -0.24 -0.25 0.00 0.00 175.52 175.86 1gya n SER 39 N -5.44 0.00 0.00 5.36 2.88 -1.26 -3.21 113.62 111.95 1gya n SER 39 Ca 0.08 0.33 0.10 0.00 -1.33 0.00 0.00 58.87 58.05 1gya n SER 39 Cb 0.34 0.00 0.57 0.00 -0.75 0.00 0.00 64.21 64.36 1gya n SER 39 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1gya n ASP 40 N -0.46 0.00 -3.26 -3.46 9.92 -1.23 -4.90 116.55 113.17 1gya n ASP 40 Ca 0.00 -1.20 -0.09 0.00 -0.53 0.00 0.00 54.79 52.97 1gya n ASP 40 Cb 0.00 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.50 1gya n ASP 40 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1gya n LYS 41 N -0.83 -1.51 -3.72 -1.24 5.02 -0.28 -5.00 118.16 110.60 1gya n LYS 41 Ca 0.14 1.18 -0.29 0.00 -2.02 0.00 0.00 58.31 57.32 1gya n LYS 41 Cb 0.07 -5.14 -0.16 0.00 -0.02 0.00 0.00 35.03 29.78 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 -3.83 0.67 0.53 1.97 2.36 -1.08 -4.91 119.74 115.46 1gya s LYS 42 Ca 0.13 -0.74 -0.18 0.00 -2.55 0.00 0.00 55.97 52.63 1gya s LYS 42 Cb -0.03 -1.97 -0.14 0.00 -1.05 0.00 0.00 37.83 34.64 1gya s LYS 42 CO 0.78 -0.83 -0.08 0.36 1.55 0.00 0.00 175.35 177.13 1gya n LYS 43 N 4.97 0.06 0.00 4.03 2.85 -1.26 -1.69 118.16 127.11 1gya n LYS 43 Ca -0.06 0.02 0.00 0.00 -1.05 0.00 0.00 58.31 57.23 1gya n LYS 43 Cb 0.44 -1.09 0.00 0.00 -0.65 0.00 0.00 35.03 33.74 1gya n LYS 43 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 177.40 177.79 1gya n ILE 44 N -1.58 0.00 -4.23 0.58 -5.35 -0.93 -4.79 119.36 103.07 1gya n ILE 44 Ca 0.08 0.00 -0.25 0.00 -0.27 0.00 0.00 62.75 62.31 1gya n ILE 44 Cb 0.48 -0.27 -0.17 0.00 -1.74 0.00 0.00 39.64 37.94 1gya n ILE 44 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1gya s ALA 45 N -1.89 1.25 -0.15 -1.28 0.00 -1.07 -4.83 121.76 113.78 1gya s ALA 45 Ca 0.00 -0.45 -0.20 0.00 0.00 0.00 0.00 51.96 51.31 1gya s ALA 45 Cb 0.00 -0.72 0.05 0.00 0.00 0.00 0.00 23.12 22.45 1gya s ALA 45 CO 0.00 -0.15 0.52 -0.65 0.00 0.00 0.00 175.76 175.48 1gya s GLN 46 N 1.18 0.69 -0.12 0.00 -0.21 -1.08 0.65 119.66 120.77 1gya s GLN 46 Ca -0.05 0.54 0.01 0.00 0.02 0.00 0.00 55.36 55.88 1gya s GLN 46 Cb -0.14 0.33 0.02 0.00 1.00 0.00 0.00 33.01 34.21 1gya s GLN 46 CO -0.02 -0.12 -0.14 -0.06 -2.12 0.00 0.00 175.29 172.83 1gya s PHE 47 N -0.15 1.92 -0.11 0.91 0.40 -0.24 -2.31 117.98 118.41 1gya s PHE 47 Ca -0.03 -0.95 -0.03 0.00 -0.60 0.00 0.00 56.93 55.31 1gya s PHE 47 Cb -0.03 -1.42 0.05 0.00 0.51 0.00 0.00 43.02 42.13 1gya s PHE 47 CO 0.02 -0.52 0.12 1.03 0.70 0.00 0.00 175.22 176.57 1gya s ARG 48 N 1.20 0.03 0.35 0.44 0.52 -1.20 -2.01 118.95 118.28 1gya s ARG 48 Ca -0.02 0.30 0.00 0.00 -0.52 0.00 0.00 55.73 55.49 1gya s ARG 48 Cb -0.14 -0.84 0.00 0.00 0.52 0.00 0.00 34.95 34.48 1gya s ARG 48 CO -0.05 -0.45 0.00 1.17 0.02 0.00 0.00 175.30 176.00 1gya n LYS 49 N 5.31 -1.86 0.00 3.54 3.00 -1.26 -4.00 118.16 122.88 1gya n LYS 49 Ca -0.05 1.53 0.02 0.00 -0.00 0.00 0.00 58.31 59.81 1gya n LYS 49 Cb 0.50 -2.17 0.13 0.00 0.00 0.00 0.00 35.03 33.49 1gya n LYS 49 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1gya n GLU 50 N -3.29 0.58 -3.65 1.64 0.28 -1.26 -4.28 120.64 110.67 1gya n GLU 50 Ca -0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.92 1gya n GLU 50 Cb 0.38 -1.12 -0.05 0.00 1.43 0.00 0.00 31.44 32.08 1gya n GLU 50 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1gya s LYS 51 N -2.00 0.61 0.00 3.44 -0.14 -1.26 -5.07 119.74 115.32 1gya s LYS 51 Ca 0.07 1.41 0.00 0.00 -1.36 0.00 0.00 55.97 56.09 1gya s LYS 51 Cb 0.03 0.72 0.00 0.00 -1.68 0.00 0.00 37.83 36.90 1gya s LYS 51 CO 0.05 -0.19 0.00 -1.91 -0.76 0.00 0.00 175.35 172.54 1gya n GLU 52 N 5.21 0.00 -4.14 1.68 4.07 -1.26 -4.96 120.64 121.25 1gya n GLU 52 Ca -0.14 0.00 -0.36 0.00 -0.06 0.00 0.00 57.16 56.61 1gya n GLU 52 Cb 0.51 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.81 1gya n GLU 52 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 1gya s THR 53 N 0.00 4.85 -0.50 6.31 -4.23 -1.26 -3.21 115.64 117.59 1gya s THR 53 Ca 0.00 -0.04 0.03 0.00 -1.18 0.00 0.00 61.69 60.50 1gya s THR 53 Cb 0.00 -3.09 0.15 0.00 1.34 0.00 0.00 72.50 70.90 1gya s THR 53 CO 0.00 0.60 0.32 0.12 -0.54 0.00 0.00 174.62 175.12 1gya s PHE 54 N -0.84 2.26 0.00 3.99 5.36 -0.98 -4.92 117.98 122.85 1gya s PHE 54 Ca 0.13 -2.67 0.00 0.00 -0.96 0.00 0.00 56.93 53.44 1gya s PHE 54 Cb -0.12 -1.95 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 1gya s PHE 54 CO 0.03 -0.73 0.43 0.36 -1.46 0.00 0.00 175.22 173.85 1gya n LYS 55 N 3.01 0.00 -2.52 10.12 2.85 -1.26 -2.65 118.16 127.71 1gya n LYS 55 Ca 0.15 -0.23 -0.43 0.00 -1.05 0.00 0.00 58.31 56.75 1gya n LYS 55 Cb 0.37 -0.15 0.00 0.00 -0.65 0.00 0.00 35.03 34.61 1gya n LYS 55 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1gya n GLU 56 N 0.00 3.61 0.00 -1.58 0.00 -1.26 -4.78 120.64 116.63 1gya n GLU 56 Ca 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 57.16 53.49 1gya n GLU 56 Cb 0.53 -2.92 0.00 0.00 0.00 0.00 0.00 31.44 29.05 1gya n GLU 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1gya n LYS 57 N 4.10 0.00 0.12 5.31 4.81 -1.26 -5.04 118.16 126.20 1gya n LYS 57 Ca 0.38 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.82 1gya n LYS 57 Cb 0.38 0.00 0.26 0.00 0.02 0.00 0.00 35.03 35.69 1gya n LYS 57 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1gya h ASP 58 N 0.00 0.17 0.04 3.14 3.32 -1.94 -2.67 116.42 118.48 1gya h ASP 58 Ca 0.00 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1gya h ASP 58 Cb 0.00 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1gya h ASP 58 CO 0.00 0.55 0.00 0.00 -1.72 0.00 0.00 179.24 178.07 1gya h THR 59 N 0.14 0.00 -1.75 0.35 1.03 -1.87 -3.28 112.91 107.52 1gya h THR 59 Ca 0.01 -0.01 -0.30 0.00 -0.01 0.00 0.00 66.41 66.10 1gya h THR 59 Cb 0.77 0.55 -0.29 0.00 -1.07 0.00 0.00 68.15 68.12 1gya h THR 59 CO 0.06 0.00 -0.63 -0.31 -0.01 0.00 0.00 175.52 174.63 1gya s TYR 60 N -3.59 -0.61 0.26 0.00 1.51 -1.01 -3.65 117.35 110.26 1gya s TYR 60 Ca -0.02 -0.55 0.06 0.00 -1.01 0.00 0.00 57.07 55.54 1gya s TYR 60 Cb 0.07 -0.26 -0.03 0.00 -0.11 0.00 0.00 41.96 41.64 1gya s TYR 60 CO 0.23 -1.01 0.35 0.21 -1.11 0.00 0.00 175.55 174.22 1gya s LYS 61 N 1.57 3.28 0.11 -0.62 2.36 0.14 -4.69 119.74 121.90 1gya s LYS 61 Ca 0.16 -0.87 0.05 0.00 -2.55 0.00 0.00 55.97 52.76 1gya s LYS 61 Cb -0.13 -2.81 -0.04 0.00 -1.05 0.00 0.00 37.83 33.80 1gya s LYS 61 CO -0.06 0.34 0.05 -0.51 1.55 0.00 0.00 175.35 176.73 1gya s LEU 62 N -4.00 3.60 0.31 5.43 1.43 -1.26 -2.08 118.68 122.11 1gya s LEU 62 Ca 0.36 -0.15 0.03 0.00 -1.03 0.00 0.00 54.13 53.34 1gya s LEU 62 Cb -0.09 -2.28 -0.05 0.00 0.03 0.00 0.00 46.19 43.79 1gya s LEU 62 CO 0.29 0.14 0.08 -0.36 0.23 0.00 0.00 176.35 176.73 1gya s PHE 63 N -1.48 1.78 0.01 0.29 0.08 -0.34 -4.96 117.98 113.37 1gya s PHE 63 Ca 0.28 -1.08 -0.25 0.00 0.12 0.00 0.00 56.93 55.99 1gya s PHE 63 Cb -0.11 -1.12 -0.17 0.00 -0.57 0.00 0.00 43.02 41.05 1gya s PHE 63 CO 0.20 -0.16 1.28 -0.22 -0.10 0.00 0.00 175.22 176.22 1gya h LYS 64 N 2.19 -0.41 -0.11 0.44 3.11 -2.01 -2.32 116.57 117.46 1gya h LYS 64 Ca -0.39 0.03 0.03 0.00 -2.81 0.00 0.00 60.65 57.51 1gya h LYS 64 Cb 1.25 0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 32.57 1gya h LYS 64 CO 0.65 -0.10 0.36 -2.95 -2.81 0.00 0.00 179.45 174.59 1gya h ASN 65 N -0.74 0.00 0.00 4.20 7.08 -1.97 -3.45 115.58 120.70 1gya h ASN 65 Ca -0.04 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.18 1gya h ASN 65 Cb 0.50 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.74 1gya h ASN 65 CO 0.07 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 176.03 1gya n GLY 66 N -1.29 1.43 3.86 9.14 0.00 -0.87 -4.73 105.19 112.73 1gya n GLY 66 Ca 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 4.89 0.16 2.61 2.01 -1.26 -4.08 115.64 117.98 1gya s THR 67 Ca 0.00 0.61 0.05 0.00 0.31 0.00 0.00 61.69 62.66 1gya s THR 67 Cb 0.00 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1gya s THR 67 CO 0.00 0.01 0.13 -0.22 -0.69 0.00 0.00 174.62 173.85 1gya s LEU 68 N -2.58 3.79 -0.07 4.42 2.96 0.16 -1.20 118.68 126.17 1gya s LEU 68 Ca 0.45 -0.14 -0.00 0.00 -0.22 0.00 0.00 54.13 54.22 1gya s LEU 68 Cb -0.12 -2.40 0.02 0.00 0.50 0.00 0.00 46.19 44.19 1gya s LEU 68 CO 0.20 0.07 -0.03 -0.75 -1.32 0.00 0.00 176.35 174.52 1gya s LYS 69 N -3.09 0.89 -0.27 1.98 2.20 -0.88 -0.05 119.74 120.51 1gya s LYS 69 Ca 0.31 -0.06 0.01 0.00 -0.36 0.00 0.00 55.97 55.87 1gya s LYS 69 Cb -0.10 -1.03 0.05 0.00 -1.51 0.00 0.00 37.83 35.25 1gya s LYS 69 CO 0.23 -0.19 -0.07 0.42 -0.36 0.00 0.00 175.35 175.38 1gya s ILE 70 N 1.43 2.48 0.24 5.43 1.01 -0.31 -0.69 121.20 130.80 1gya s ILE 70 Ca -0.03 -1.50 -0.28 0.00 0.00 0.00 0.00 60.65 58.85 1gya s ILE 70 Cb -0.13 -2.42 -0.09 0.00 0.01 0.00 0.00 42.46 39.82 1gya s ILE 70 CO -0.03 -0.03 0.90 -0.75 0.00 0.00 0.00 174.94 175.03 1gya s LYS 71 N 1.17 4.72 -0.47 2.79 2.20 -1.24 -2.29 119.74 126.61 1gya s LYS 71 Ca -0.07 1.36 -0.26 0.00 -0.36 0.00 0.00 55.97 56.64 1gya s LYS 71 Cb -0.20 -3.15 0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1gya s LYS 71 CO -0.04 0.47 0.64 1.58 -0.36 0.00 0.00 175.35 177.64 1gya n HIS 72 N 1.27 -3.03 -4.07 4.03 -0.00 -1.26 -4.81 115.22 107.35 1gya n HIS 72 Ca -0.02 1.24 -0.32 0.00 -0.00 0.00 0.00 57.72 58.63 1gya n HIS 72 Cb 0.48 -2.91 -0.16 0.00 -0.00 0.00 0.00 29.99 27.40 1gya n HIS 72 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.34 175.17 1gya s LEU 73 N -2.69 2.02 0.00 0.27 0.20 -0.94 -4.64 118.68 112.90 1gya s LEU 73 Ca 0.30 -0.64 0.00 0.00 0.69 0.00 0.00 54.13 54.48 1gya s LEU 73 Cb -0.05 -1.34 0.00 0.00 -0.43 0.00 0.00 46.19 44.37 1gya s LEU 73 CO 0.83 -0.04 0.00 2.29 -0.29 0.00 0.00 176.35 179.13 1gya n LYS 74 N 4.68 2.80 -0.08 1.98 2.85 -1.26 -1.90 118.16 127.23 1gya n LYS 74 Ca -0.18 0.00 0.26 0.00 -1.05 0.00 0.00 58.31 57.33 1gya n LYS 74 Cb 0.49 0.00 0.70 0.00 -0.65 0.00 0.00 35.03 35.57 1gya n LYS 74 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1gya h THR 75 N 0.10 0.35 0.08 0.58 2.02 -1.95 0.29 112.91 114.38 1gya h THR 75 Ca 0.00 0.00 -0.28 0.00 0.77 0.00 0.00 66.41 66.90 1gya h THR 75 Cb 0.00 0.49 0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1gya h THR 75 CO 0.00 0.00 -1.15 0.44 0.37 0.00 0.00 175.52 175.18 1gya h ASP 76 N 0.00 0.75 1.10 4.18 3.32 -1.99 -3.07 116.42 120.71 1gya h ASP 76 Ca 0.35 -0.67 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1gya h ASP 76 Cb 1.70 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 41.01 1gya h ASP 76 CO -0.00 1.49 0.00 0.47 -1.72 0.00 0.00 179.24 179.47 1gya n ASP 77 N -3.76 0.41 -4.56 6.45 9.92 -0.04 -4.75 116.55 120.21 1gya n ASP 77 Ca -0.11 0.55 -0.41 0.00 -0.53 0.00 0.00 54.79 54.29 1gya n ASP 77 Cb 0.94 -0.66 -0.03 0.00 -0.64 0.00 0.00 41.12 40.74 1gya n ASP 77 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1gya s GLN 78 N -3.08 3.08 0.38 -1.24 0.74 -0.42 -4.91 119.66 114.21 1gya s GLN 78 Ca 0.11 0.44 0.04 0.00 0.05 0.00 0.00 55.36 55.99 1gya s GLN 78 Cb 0.14 -4.22 -0.03 0.00 1.10 0.00 0.00 33.01 30.00 1gya s GLN 78 CO 0.51 -2.21 0.12 0.34 -0.55 0.00 0.00 175.29 173.50 1gya s ASP 79 N 5.49 2.58 -0.07 6.67 2.15 -1.26 -4.95 116.67 127.28 1gya s ASP 79 Ca 0.55 -1.60 -0.04 0.00 0.43 0.00 0.00 52.55 51.89 1gya s ASP 79 Cb -0.12 0.38 -0.04 0.00 -0.30 0.00 0.00 42.92 42.85 1gya s ASP 79 CO 0.22 -0.87 0.13 -0.63 -0.17 0.00 0.00 175.17 173.86 1gya s ILE 80 N -3.27 5.27 0.24 4.11 1.01 -1.26 -0.36 121.20 126.93 1gya s ILE 80 Ca 0.27 -0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.90 1gya s ILE 80 Cb 0.04 -3.35 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 1gya s ILE 80 CO 0.15 0.49 0.13 -0.31 0.00 0.00 0.00 174.94 175.40 1gya s TYR 81 N -1.13 1.39 0.06 3.97 2.02 -0.87 -2.18 117.35 120.61 1gya s TYR 81 Ca 0.20 -1.31 -0.22 0.00 -0.37 0.00 0.00 57.07 55.36 1gya s TYR 81 Cb -0.12 -0.74 0.05 0.00 -0.40 0.00 0.00 41.96 40.75 1gya s TYR 81 CO 0.10 -0.51 0.52 0.21 -1.57 0.00 0.00 175.55 174.29 1gya s LYS 82 N -4.04 1.05 -0.07 -0.62 2.20 -1.07 -0.23 119.74 116.97 1gya s LYS 82 Ca 0.38 -0.28 0.02 0.00 -0.36 0.00 0.00 55.97 55.73 1gya s LYS 82 Cb 0.07 0.48 0.02 0.00 -1.51 0.00 0.00 37.83 36.88 1gya s LYS 82 CO 0.14 -0.39 -0.11 0.54 -0.36 0.00 0.00 175.35 175.17 1gya s VAL 83 N -2.60 1.07 -0.27 4.02 0.11 -0.00 -1.75 120.40 120.98 1gya s VAL 83 Ca -0.04 -0.43 -0.02 0.00 -2.93 0.00 0.00 61.98 58.56 1gya s VAL 83 Cb -0.01 -1.00 0.09 0.00 -1.53 0.00 0.00 36.38 33.93 1gya s VAL 83 CO -0.03 0.34 0.08 -0.94 -3.33 0.00 0.00 175.10 171.22 1gya s SER 84 N 0.80 3.60 -0.28 3.54 1.04 -0.90 -1.61 113.70 119.89 1gya s SER 84 Ca -0.12 -1.31 -0.03 0.00 0.48 0.00 0.00 55.95 54.96 1gya s SER 84 Cb -0.15 -0.73 0.03 0.00 0.10 0.00 0.00 66.02 65.27 1gya s SER 84 CO 0.02 -0.38 0.00 -0.63 0.98 0.00 0.00 173.24 173.24 1gya s ILE 85 N 1.75 3.28 0.38 -1.02 -1.09 -1.09 -2.18 121.20 121.22 1gya s ILE 85 Ca 0.06 -0.98 0.08 0.00 -2.23 0.00 0.00 60.65 57.57 1gya s ILE 85 Cb -0.17 -2.72 -0.03 0.00 -1.58 0.00 0.00 42.46 37.96 1gya s ILE 85 CO -0.20 0.09 0.25 -0.31 -1.23 0.00 0.00 174.94 173.54 1gya s TYR 86 N 1.37 2.73 0.00 3.97 2.02 -0.55 -3.43 117.35 123.45 1gya s TYR 86 Ca -0.00 -0.44 0.00 0.00 -0.37 0.00 0.00 57.07 56.26 1gya s TYR 86 Cb -0.17 -1.89 0.00 0.00 -0.40 0.00 0.00 41.96 39.50 1gya s TYR 86 CO -0.01 0.14 0.00 -0.40 -1.57 0.00 0.00 175.55 173.71 1gya n ASP 87 N -1.33 0.00 0.06 2.29 5.75 -1.07 -0.87 116.55 121.38 1gya n ASP 87 Ca -0.00 -0.52 0.03 0.00 -0.01 0.00 0.00 54.79 54.28 1gya n ASP 87 Cb 0.62 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 41.10 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 -0.37 1.15 -0.38 2.12 1.35 -1.86 -2.92 112.91 112.00 1gya h THR 88 Ca 0.00 -0.54 -0.08 0.00 -0.55 0.00 0.00 66.41 65.23 1gya h THR 88 Cb 0.00 0.91 -0.05 0.00 -1.73 0.00 0.00 68.15 67.28 1gya h THR 88 CO 0.00 0.19 0.11 0.29 -0.25 0.00 0.00 175.52 175.86 1gya n LYS 89 N -4.36 2.70 -1.12 4.72 4.76 -1.26 -4.85 118.16 118.75 1gya n LYS 89 Ca 0.01 -1.69 -0.04 0.00 -2.87 0.00 0.00 58.31 53.71 1gya n LYS 89 Cb 0.19 -1.84 -0.02 0.00 -1.84 0.00 0.00 35.03 31.52 1gya n LYS 89 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1gya n GLY 90 N 0.12 0.52 3.59 0.72 0.00 -1.10 -4.92 105.19 104.11 1gya n GLY 90 Ca 0.20 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.01 3.73 -0.75 1.61 1.02 -1.26 -4.85 119.74 117.23 1gya s LYS 91 Ca 0.00 0.36 -0.26 0.00 0.02 0.00 0.00 55.97 56.09 1gya s LYS 91 Cb 0.00 -3.83 -0.12 0.00 -0.52 0.00 0.00 37.83 33.36 1gya s LYS 91 CO 0.00 -0.94 2.37 0.54 -0.92 0.00 0.00 175.35 176.39 1gya s ASN 92 N 1.92 4.08 0.26 2.83 6.03 -1.26 -2.61 114.94 126.19 1gya s ASN 92 Ca 0.34 0.14 0.03 0.00 -1.03 0.00 0.00 52.86 52.35 1gya s ASN 92 Cb -0.12 -2.54 0.34 0.00 -3.03 0.00 0.00 41.25 35.89 1gya s ASN 92 CO 0.19 -3.63 1.64 -0.37 -2.03 0.00 0.00 177.10 172.89 1gya h VAL 93 N 7.65 1.32 -2.99 3.54 -1.51 -1.91 -3.44 116.25 118.91 1gya h VAL 93 Ca -0.03 -1.61 -0.13 0.00 -1.23 0.00 0.00 66.70 63.71 1gya h VAL 93 Cb 1.04 1.68 -0.22 0.00 -2.13 0.00 0.00 31.29 31.67 1gya h VAL 93 CO 1.05 0.49 -0.30 -0.22 -1.23 0.00 0.00 177.57 177.36 1gya s LEU 94 N -8.30 0.80 0.05 4.19 2.96 -1.25 -5.09 118.68 112.04 1gya s LEU 94 Ca -0.05 0.34 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 1gya s LEU 94 Cb 0.13 1.21 -0.03 0.00 0.50 0.00 0.00 46.19 48.00 1gya s LEU 94 CO 0.79 -0.30 -0.05 -1.83 -1.32 0.00 0.00 176.35 173.64 1gya s GLU 95 N -0.67 0.59 -0.09 1.98 -1.05 -1.26 -2.67 118.70 115.53 1gya s GLU 95 Ca -0.08 -1.02 -0.30 0.00 -0.15 0.00 0.00 54.97 53.42 1gya s GLU 95 Cb -0.04 -0.03 0.11 0.00 -0.44 0.00 0.00 34.13 33.73 1gya s GLU 95 CO 0.03 -0.04 0.93 0.21 0.95 0.00 0.00 175.26 177.33 1gya s LYS 96 N -2.87 0.72 -0.03 -4.83 2.47 -0.63 -5.01 119.74 109.56 1gya s LYS 96 Ca -0.00 -0.03 0.03 0.00 -1.56 0.00 0.00 55.97 54.41 1gya s LYS 96 Cb -0.00 0.34 -0.03 0.00 -1.46 0.00 0.00 37.83 36.67 1gya s LYS 96 CO -0.04 -0.27 -0.12 0.42 0.16 0.00 0.00 175.35 175.50 1gya s ILE 97 N -1.96 3.29 0.22 5.43 1.01 -1.26 -0.82 121.20 127.10 1gya s ILE 97 Ca 0.00 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 59.99 1gya s ILE 97 Cb -0.01 -2.34 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 1gya s ILE 97 CO -0.02 0.53 -0.07 -0.36 0.00 0.00 0.00 174.94 175.02 1gya s PHE 98 N -0.82 1.65 -0.26 3.97 0.40 0.68 -1.46 117.98 122.15 1gya s PHE 98 Ca 0.13 -0.75 -0.02 0.00 -0.60 0.00 0.00 56.93 55.69 1gya s PHE 98 Cb -0.11 -0.89 0.14 0.00 0.51 0.00 0.00 43.02 42.68 1gya s PHE 98 CO 0.02 0.16 0.40 0.16 0.70 0.00 0.00 175.22 176.67 1gya s ASP 99 N -3.32 0.14 0.49 1.36 -4.77 -1.19 -2.05 116.67 107.33 1gya s ASP 99 Ca 0.25 0.16 -0.21 0.00 -3.30 0.00 0.00 52.55 49.45 1gya s ASP 99 Cb 0.03 1.20 -0.07 0.00 -1.09 0.00 0.00 42.92 42.98 1gya s ASP 99 CO 0.08 -0.31 1.09 -0.76 0.70 0.00 0.00 175.17 175.97 1gya s LEU 100 N 2.57 3.87 0.10 2.11 2.01 0.51 -3.01 118.68 126.85 1gya s LEU 100 Ca 0.13 2.07 -0.01 0.00 0.01 0.00 0.00 54.13 56.33 1gya s LEU 100 Cb -0.15 -4.48 -0.04 0.00 0.01 0.00 0.00 46.19 41.53 1gya s LEU 100 CO -0.19 -0.92 0.03 -0.54 1.01 0.00 0.00 176.35 175.74 1gya s LYS 101 N -3.10 0.83 0.05 1.70 1.02 -0.10 -4.29 119.74 115.86 1gya s LYS 101 Ca 0.68 -1.37 0.08 0.00 0.02 0.00 0.00 55.97 55.37 1gya s LYS 101 Cb -0.21 0.22 -0.03 0.00 -0.52 0.00 0.00 37.83 37.29 1gya s LYS 101 CO 0.25 -0.21 -0.21 0.42 -0.92 0.00 0.00 175.35 174.68 1gya s ILE 102 N -3.99 1.73 0.20 2.17 -1.09 -1.26 -0.95 121.20 118.00 1gya s ILE 102 Ca 0.18 -1.28 0.08 0.00 -2.23 0.00 0.00 60.65 57.41 1gya s ILE 102 Cb 0.08 -1.51 -0.05 0.00 -1.58 0.00 0.00 42.46 39.40 1gya s ILE 102 CO -0.02 0.18 -0.16 -1.58 -1.23 0.00 0.00 174.94 172.12 1gya s GLN 103 N -1.31 1.34 -0.49 2.79 -0.44 -1.16 -4.93 119.66 115.45 1gya s GLN 103 Ca 0.08 -1.54 0.07 0.00 -2.50 0.00 0.00 55.36 51.46 1gya s GLN 103 Cb -0.09 -1.24 0.19 0.00 -1.64 0.00 0.00 33.01 30.23 1gya s GLN 103 CO 0.02 0.22 0.67 -1.21 0.50 0.00 0.00 175.29 175.50 1gya s GLU 104 N -3.34 1.03 0.00 1.67 2.02 -1.26 -4.87 118.70 113.94 1gya s GLU 104 Ca 0.21 -1.10 0.00 0.00 0.02 0.00 0.00 54.97 54.09 1gya s GLU 104 Cb -0.03 -0.20 0.00 0.00 0.10 0.00 0.00 34.13 34.00 1gya s GLU 104 CO 0.07 -1.32 0.00 0.54 0.02 0.00 0.00 175.26 174.57