#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gya n GLN 3 N 0.00 0.86 -2.40 0.38 10.64 -1.26 -0.72 117.38 124.88 2gya n GLN 3 Ca 0.00 -2.04 -0.39 0.00 -1.83 0.00 0.00 57.00 52.74 2gya n GLN 3 Cb 0.00 0.98 -0.03 0.00 -0.86 0.00 0.00 30.24 30.32 2gya n GLN 3 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.06 173.40 2gya s GLU 4 N -2.94 4.32 -0.11 2.61 -1.05 -1.26 -3.20 118.70 117.07 2gya s GLU 4 Ca 0.09 1.79 0.00 0.00 -0.15 0.00 0.00 54.97 56.70 2gya s GLU 4 Cb 0.00 -2.87 0.00 0.00 -0.44 0.00 0.00 34.13 30.82 2gya s GLU 4 CO 0.07 -0.07 0.00 0.94 0.95 0.00 0.00 175.26 177.14 2gya n GLN 5 N 0.52 -0.11 -3.31 -4.83 7.27 -0.32 -4.98 117.38 111.63 2gya n GLN 5 Ca 0.02 0.40 -0.31 0.00 0.07 0.00 0.00 57.00 57.17 2gya n GLN 5 Cb 0.46 -3.82 -0.05 0.00 2.41 0.00 0.00 30.24 29.24 2gya n GLN 5 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2gya s THR 6 N -2.02 4.89 -0.28 1.69 -4.23 -1.20 -4.81 115.64 109.68 2gya s THR 6 Ca 0.00 0.51 -0.08 0.00 -1.18 0.00 0.00 61.69 60.94 2gya s THR 6 Cb 0.00 -3.64 -0.01 0.00 1.34 0.00 0.00 72.50 70.19 2gya s THR 6 CO 0.00 -0.16 0.09 -0.32 -0.54 0.00 0.00 174.62 173.69 2gya s MET 7 N -3.03 3.34 0.21 3.99 1.75 -1.26 -1.29 119.30 123.02 2gya s MET 7 Ca 0.48 -0.69 0.08 0.00 -1.25 0.00 0.00 55.69 54.32 2gya s MET 7 Cb -0.11 -3.39 -0.05 0.00 2.84 0.00 0.00 34.83 34.12 2gya s MET 7 CO 0.23 -0.35 -0.15 -0.48 -0.65 0.00 0.00 175.02 173.61 2gya s LEU 8 N 1.57 2.55 0.50 4.11 2.34 0.11 -4.86 118.68 125.00 2gya s LEU 8 Ca 0.04 -1.01 -0.06 0.00 0.06 0.00 0.00 54.13 53.16 2gya s LEU 8 Cb -0.16 -0.74 -0.04 0.00 -0.56 0.00 0.00 46.19 44.68 2gya s LEU 8 CO 0.04 -0.13 0.83 0.21 -1.06 0.00 0.00 176.35 176.23 2gya s ASN 9 N -3.29 6.26 0.27 1.48 2.47 -0.16 0.18 114.94 122.15 2gya s ASN 9 Ca 0.23 1.02 -0.04 0.00 0.42 0.00 0.00 52.86 54.49 2gya s ASN 9 Cb -0.02 -2.29 -0.05 0.00 -1.45 0.00 0.00 41.25 37.45 2gya s ASN 9 CO 0.08 -0.62 0.51 -0.69 -3.72 0.00 0.00 177.10 172.66 2gya s VAL 10 N -2.81 5.07 -0.35 -5.21 1.01 -0.56 -1.40 120.40 116.16 2gya s VAL 10 Ca 0.49 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.44 2gya s VAL 10 Cb -0.10 -3.74 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 2gya s VAL 10 CO 0.46 -0.29 0.40 0.00 0.00 0.00 0.00 175.10 175.68 2gya n ALA 11 N -0.88 2.48 -2.49 5.51 0.00 -0.27 -4.79 120.51 120.06 2gya n ALA 11 Ca -0.03 -0.33 -0.27 0.00 0.00 0.00 0.00 53.44 52.81 2gya n ALA 11 Cb 0.54 -0.13 -0.11 0.00 0.00 0.00 0.00 19.45 19.75 2gya n ALA 11 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2gya s ASP 12 N -0.80 3.82 -1.38 0.00 1.47 -1.26 -0.54 116.67 117.98 2gya s ASP 12 Ca 0.03 -0.70 -0.09 0.00 1.18 0.00 0.00 52.55 52.97 2gya s ASP 12 Cb 0.03 -0.48 0.09 0.00 -0.34 0.00 0.00 42.92 42.22 2gya s ASP 12 CO 0.10 0.12 2.26 -0.46 0.68 0.00 0.00 175.17 177.87 2gya n ASN 13 N 0.28 6.41 -0.06 2.11 6.94 -1.23 -4.46 115.26 125.24 2gya n ASN 13 Ca -0.12 -3.00 0.10 0.00 -0.02 0.00 0.00 54.58 51.54 2gya n ASN 13 Cb 0.55 -1.48 -0.10 0.00 -2.36 0.00 0.00 39.78 36.39 2gya n ASN 13 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2gya n SER 14 N 3.48 1.12 0.00 0.53 3.41 -1.26 -4.51 113.62 116.38 2gya n SER 14 Ca 0.55 -1.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.11 2gya n SER 14 Cb 0.31 0.92 0.00 0.00 -0.26 0.00 0.00 64.21 65.18 2gya n SER 14 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gya n GLY 15 N 1.49 0.98 3.88 5.00 0.00 -1.26 -5.02 105.19 110.26 2gya n GLY 15 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2gya n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gya s ALA 16 N -2.00 3.65 -0.03 4.61 0.00 -1.26 -2.79 121.76 123.94 2gya s ALA 16 Ca 0.00 -0.37 -0.07 0.00 0.00 0.00 0.00 51.96 51.52 2gya s ALA 16 Cb 0.00 -2.33 -0.02 0.00 0.00 0.00 0.00 23.12 20.77 2gya s ALA 16 CO 0.00 0.56 -0.14 0.54 0.00 0.00 0.00 175.76 176.72 2gya n ARG 17 N -0.01 0.21 -4.31 0.00 5.12 0.24 -4.78 116.66 113.14 2gya n ARG 17 Ca -0.01 0.08 -0.23 0.00 -1.93 0.00 0.00 57.85 55.76 2gya n ARG 17 Cb 0.52 -0.82 -0.08 0.00 -1.16 0.00 0.00 32.46 30.92 2gya n ARG 17 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 2gya s ARG 18 N -2.18 2.18 0.02 5.56 1.70 -1.17 -1.49 118.95 123.58 2gya s ARG 18 Ca -0.12 -1.53 0.01 0.00 -0.47 0.00 0.00 55.73 53.62 2gya s ARG 18 Cb 0.02 -2.07 -0.02 0.00 -0.57 0.00 0.00 34.95 32.31 2gya s ARG 18 CO 0.17 0.30 -0.04 0.08 -1.08 0.00 0.00 175.30 174.73 2gya s VAL 19 N -2.39 0.25 -0.25 4.99 1.01 0.13 -2.54 120.40 121.60 2gya s VAL 19 Ca 0.32 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2gya s VAL 19 Cb -0.05 -0.34 0.04 0.00 0.00 0.00 0.00 36.38 36.03 2gya s VAL 19 CO 0.19 -0.34 -0.10 -0.32 0.00 0.00 0.00 175.10 174.54 2gya s MET 20 N -1.18 2.58 0.61 2.72 1.75 -1.23 -0.72 119.30 123.84 2gya s MET 20 Ca -0.10 -1.13 -0.19 0.00 -1.25 0.00 0.00 55.69 53.02 2gya s MET 20 Cb -0.08 -2.90 -0.03 0.00 2.84 0.00 0.00 34.83 34.65 2gya s MET 20 CO -0.00 -0.46 1.12 0.00 -0.65 0.00 0.00 175.02 175.03 2gya n ILE 22 N -1.72 0.54 -3.89 0.00 2.08 -0.92 -1.17 119.36 114.28 2gya n ILE 22 Ca 0.14 0.18 -0.09 0.00 0.56 0.00 0.00 62.75 63.54 2gya n ILE 22 Cb 0.47 -1.09 -0.06 0.00 -0.75 0.00 0.00 39.64 38.21 2gya n ILE 22 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2gya s LYS 23 N -2.00 1.27 0.04 0.38 1.02 -1.10 -4.74 119.74 114.61 2gya s LYS 23 Ca 0.00 -1.08 0.08 0.00 0.02 0.00 0.00 55.97 54.99 2gya s LYS 23 Cb 0.00 0.43 -0.03 0.00 -0.52 0.00 0.00 37.83 37.71 2gya s LYS 23 CO 0.00 -0.50 -0.22 0.54 -0.92 0.00 0.00 175.35 174.25 2gya s VAL 24 N -3.94 2.45 -0.35 3.17 0.11 -1.26 -0.97 120.40 119.61 2gya s VAL 24 Ca 0.15 -1.28 -0.26 0.00 -2.93 0.00 0.00 61.98 57.66 2gya s VAL 24 Cb 0.02 -1.99 0.01 0.00 -1.53 0.00 0.00 36.38 32.89 2gya s VAL 24 CO -0.00 0.36 0.95 -0.22 -3.33 0.00 0.00 175.10 172.86 2gya s LEU 25 N -1.30 3.98 -0.72 2.54 2.96 -0.99 -4.03 118.68 121.12 2gya s LEU 25 Ca 0.13 0.70 -0.02 0.00 -0.22 0.00 0.00 54.13 54.73 2gya s LEU 25 Cb -0.10 -3.32 -0.02 0.00 0.50 0.00 0.00 46.19 43.26 2gya s LEU 25 CO 0.03 -0.84 0.61 0.61 -1.32 0.00 0.00 176.35 175.44 2gya n GLY 26 N 4.25 -0.19 2.73 7.98 0.00 -1.26 -4.87 105.19 113.83 2gya n GLY 26 Ca 0.08 0.04 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 2gya n GLY 26 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gya s GLY 27 N -3.61 -0.27 -1.29 -0.02 0.00 -1.26 -5.06 107.32 95.81 2gya s GLY 27 Ca 0.12 -1.01 -0.14 0.00 0.00 0.00 0.00 44.72 43.69 2gya s GLY 27 CO 0.46 2.99 1.73 1.44 0.00 0.00 0.00 173.10 179.73 2gya n SER 28 N 3.54 4.91 -4.14 1.64 7.64 -1.26 -4.85 113.62 121.10 2gya n SER 28 Ca 0.18 -2.97 -0.11 0.00 1.01 0.00 0.00 58.87 56.98 2gya n SER 28 Cb 0.51 -1.62 -0.10 0.00 -1.01 0.00 0.00 64.21 61.98 2gya n SER 28 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2gya s HIS 29 N 2.37 0.84 -0.88 1.43 3.76 -1.26 -5.08 115.29 116.47 2gya s HIS 29 Ca 0.46 -0.78 -0.25 0.00 -0.15 0.00 0.00 55.06 54.34 2gya s HIS 29 Cb 0.04 -0.49 -0.02 0.00 1.11 0.00 0.00 32.58 33.23 2gya s HIS 29 CO 0.01 -0.12 1.79 1.03 -0.85 0.00 0.00 174.74 176.60 2gya s ARG 30 N -3.15 2.83 -0.03 1.40 0.52 -1.26 -4.49 118.95 114.77 2gya s ARG 30 Ca 0.05 -0.35 -0.03 0.00 -0.52 0.00 0.00 55.73 54.89 2gya s ARG 30 Cb 0.01 -4.99 0.01 0.00 0.52 0.00 0.00 34.95 30.49 2gya s ARG 30 CO -0.03 -2.96 0.05 0.54 0.02 0.00 0.00 175.30 172.92 2gya n ARG 31 N 8.94 -3.77 -3.65 3.54 1.74 -1.26 -5.10 116.66 117.10 2gya n ARG 31 Ca 0.34 2.89 -0.02 0.00 -0.77 0.00 0.00 57.85 60.29 2gya n ARG 31 Cb 0.49 -3.76 -0.04 0.00 -1.02 0.00 0.00 32.46 28.12 2gya n ARG 31 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2gya s TYR 32 N -0.46 -0.03 -0.30 -1.55 5.04 -1.19 -4.80 117.35 114.07 2gya s TYR 32 Ca -0.06 0.05 -0.14 0.00 -2.44 0.00 0.00 57.07 54.48 2gya s TYR 32 Cb 0.00 0.50 0.18 0.00 0.35 0.00 0.00 41.96 42.99 2gya s TYR 32 CO 0.16 -0.02 1.08 0.00 -1.34 0.00 0.00 175.55 175.43 2gya s ALA 33 N -0.95 -3.55 0.55 3.97 0.00 0.11 -4.74 121.76 117.15 2gya s ALA 33 Ca 0.09 1.40 0.05 0.00 0.00 0.00 0.00 51.96 53.50 2gya s ALA 33 Cb -0.01 -2.53 0.05 0.00 0.00 0.00 0.00 23.12 20.63 2gya s ALA 33 CO -0.09 -1.49 0.42 0.41 0.00 0.00 0.00 175.76 175.02 2gya n GLY 34 N 5.47 2.71 3.64 0.00 0.00 -1.26 -3.93 105.19 111.82 2gya n GLY 34 Ca -0.07 -2.30 -0.42 0.00 0.00 0.00 0.00 46.02 43.23 2gya n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gya s VAL 35 N -2.71 3.23 0.00 1.61 1.01 -1.26 -1.83 120.40 120.44 2gya s VAL 35 Ca 0.32 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.57 2gya s VAL 35 Cb -0.03 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.13 2gya s VAL 35 CO 0.20 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.84 2gya n GLY 36 N 4.86 2.43 3.74 4.51 0.00 -0.28 -4.99 105.19 115.47 2gya n GLY 36 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 2gya n GLY 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gya s ASP 37 N -1.63 7.20 -0.15 1.61 1.01 -0.76 -4.82 116.67 119.13 2gya s ASP 37 Ca 0.00 1.44 -0.22 0.00 0.71 0.00 0.00 52.55 54.47 2gya s ASP 37 Cb 0.00 -2.46 -0.03 0.00 1.01 0.00 0.00 42.92 41.44 2gya s ASP 37 CO 0.00 0.01 0.68 0.27 0.21 0.00 0.00 175.17 176.34 2gya s ILE 38 N -0.04 5.01 0.07 0.77 -0.00 -1.26 -3.08 121.20 122.68 2gya s ILE 38 Ca 0.38 1.33 0.07 0.00 -0.00 0.00 0.00 60.65 62.43 2gya s ILE 38 Cb -0.20 -4.00 -0.03 0.00 -0.00 0.00 0.00 42.46 38.22 2gya s ILE 38 CO 0.23 0.15 -0.18 0.27 -0.00 0.00 0.00 174.94 175.41 2gya s ILE 39 N 1.52 1.43 0.09 8.37 -0.00 -0.56 -2.35 121.20 129.69 2gya s ILE 39 Ca 0.33 -1.33 -0.30 0.00 -0.00 0.00 0.00 60.65 59.35 2gya s ILE 39 Cb -0.16 -1.31 -0.05 0.00 -0.00 0.00 0.00 42.46 40.94 2gya s ILE 39 CO 0.13 -0.06 0.97 -0.75 -0.00 0.00 0.00 174.94 175.23 2gya s LYS 40 N -1.63 4.66 0.32 0.37 2.20 -0.14 -1.65 119.74 123.88 2gya s LYS 40 Ca 0.03 1.45 0.04 0.00 -0.36 0.00 0.00 55.97 57.13 2gya s LYS 40 Cb -0.09 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.80 2gya s LYS 40 CO 0.03 0.15 0.18 0.96 -0.36 0.00 0.00 175.35 176.31 2gya s ILE 41 N 0.24 0.28 -0.36 5.43 -4.36 0.13 -2.16 121.20 120.40 2gya s ILE 41 Ca 0.48 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.89 2gya s ILE 41 Cb -0.23 -2.48 0.15 0.00 1.25 0.00 0.00 42.46 41.15 2gya s ILE 41 CO 0.29 0.00 0.32 0.28 0.24 0.00 0.00 174.94 176.08 2gya s THR 42 N -3.54 -0.20 0.47 8.37 -1.32 -1.10 -1.34 115.64 116.99 2gya s THR 42 Ca 0.35 -1.16 -0.21 0.00 -1.21 0.00 0.00 61.69 59.46 2gya s THR 42 Cb 0.04 -0.82 -0.11 0.00 -1.51 0.00 0.00 72.50 70.10 2gya s THR 42 CO 0.19 -0.69 0.55 2.30 -2.21 0.00 0.00 174.62 174.76 2gya n ILE 43 N 4.26 1.89 -0.00 5.08 -5.35 -1.25 -3.48 119.36 120.52 2gya n ILE 43 Ca 0.10 -0.50 -0.00 0.00 -0.27 0.00 0.00 62.75 62.08 2gya n ILE 43 Cb 0.43 -0.61 -0.00 0.00 -1.74 0.00 0.00 39.64 37.72 2gya n ILE 43 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2gya n LYS 44 N 0.41 0.02 -3.31 6.28 3.00 -1.05 -3.66 118.16 119.85 2gya n LYS 44 Ca 0.11 0.01 -0.38 0.00 -0.00 0.00 0.00 58.31 58.05 2gya n LYS 44 Cb 0.42 -0.41 -0.06 0.00 0.00 0.00 0.00 35.03 34.98 2gya n LYS 44 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2gya s GLU 45 N -1.10 4.32 0.00 1.64 2.12 -1.26 -4.74 118.70 119.68 2gya s GLU 45 Ca -0.01 0.47 0.00 0.00 0.36 0.00 0.00 54.97 55.79 2gya s GLU 45 Cb 0.00 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.97 2gya s GLU 45 CO 0.02 0.19 0.00 0.00 -0.54 0.00 0.00 175.26 174.93 2gya n ALA 46 N 3.53 0.00 -2.75 6.30 0.00 -1.26 -0.59 120.51 125.74 2gya n ALA 46 Ca -0.07 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.93 2gya n ALA 46 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 2gya n ALA 46 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2gya s ILE 47 N -3.00 4.80 -2.00 0.00 2.07 -1.12 -4.87 121.20 117.08 2gya s ILE 47 Ca 0.00 -0.37 0.02 0.00 -1.41 0.00 0.00 60.65 58.89 2gya s ILE 47 Cb 0.00 -4.34 0.05 0.00 0.13 0.00 0.00 42.46 38.31 2gya s ILE 47 CO 0.00 -0.86 0.39 -2.65 -1.91 0.00 0.00 174.94 169.91 2gya n PRO 48 N 6.38 0.17 -3.77 3.50 -0.02 -1.26 -4.00 135.00 136.01 2gya n PRO 48 Ca -0.05 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.24 2gya n PRO 48 Cb 0.46 -1.18 -0.05 0.00 -0.02 0.00 0.00 33.50 32.71 2gya n PRO 48 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2gya n ARG 49 N -0.68 0.77 0.00 -0.52 1.74 -1.26 -4.62 116.66 112.09 2gya n ARG 49 Ca 0.01 -2.52 0.00 0.00 -0.77 0.00 0.00 57.85 54.57 2gya n ARG 49 Cb 0.01 1.22 0.00 0.00 -1.02 0.00 0.00 32.46 32.67 2gya n ARG 49 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gya n GLY 50 N 0.19 2.16 3.02 -0.13 0.00 -1.26 -4.41 105.19 104.77 2gya n GLY 50 Ca -0.06 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 2gya n GLY 50 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gya s LYS 51 N 0.00 2.02 -0.54 1.61 0.00 -1.26 -5.02 119.74 116.55 2gya s LYS 51 Ca 0.00 -1.21 -0.08 0.00 0.00 0.00 0.00 55.97 54.69 2gya s LYS 51 Cb 0.00 -2.77 -0.17 0.00 0.00 0.00 0.00 37.83 34.89 2gya s LYS 51 CO 0.00 -0.58 1.23 1.55 0.00 0.00 0.00 175.35 177.56 2gya n VAL 52 N 4.52 0.00 -0.00 1.79 3.14 -1.26 -4.75 118.33 121.77 2gya n VAL 52 Ca -0.13 -0.21 -0.00 0.00 -2.96 0.00 0.00 64.34 61.03 2gya n VAL 52 Cb 0.43 -0.06 -0.00 0.00 -1.06 0.00 0.00 33.84 33.15 2gya n VAL 52 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 2gya h LYS 53 N 6.08 0.00 -6.02 1.45 1.63 -1.81 -3.40 116.57 114.50 2gya h LYS 53 Ca 0.01 0.00 -0.62 0.00 -0.85 0.00 0.00 60.65 59.19 2gya h LYS 53 Cb 0.63 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.26 2gya h LYS 53 CO 0.85 0.00 1.42 1.17 -3.45 0.00 0.00 179.45 179.45 2gya n LYS 54 N -2.31 1.64 0.00 1.90 4.81 -1.26 -1.80 118.16 121.14 2gya n LYS 54 Ca -0.00 0.47 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 2gya n LYS 54 Cb 0.01 -2.86 0.00 0.00 0.02 0.00 0.00 35.03 32.20 2gya n LYS 54 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2gya n GLY 55 N 5.94 0.71 3.79 3.14 0.00 -1.24 -4.96 105.19 112.57 2gya n GLY 55 Ca 0.34 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 2gya n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gya s ASP 56 N -0.87 5.90 -0.19 1.61 1.11 -0.74 -4.92 116.67 118.55 2gya s ASP 56 Ca 0.00 1.97 -0.05 0.00 0.18 0.00 0.00 52.55 54.65 2gya s ASP 56 Cb 0.00 -2.56 -0.03 0.00 1.07 0.00 0.00 42.92 41.41 2gya s ASP 56 CO 0.00 -1.09 -0.00 0.68 1.18 0.00 0.00 175.17 175.94 2gya s VAL 57 N -2.10 3.98 0.00 -1.27 -7.23 -1.26 -3.82 120.40 108.70 2gya s VAL 57 Ca 0.68 -0.31 0.00 0.00 -1.81 0.00 0.00 61.98 60.54 2gya s VAL 57 Cb -0.19 -2.80 0.00 0.00 0.56 0.00 0.00 36.38 33.96 2gya s VAL 57 CO 0.29 0.44 0.00 0.18 -0.31 0.00 0.00 175.10 175.69 2gya n LEU 58 N 4.14 0.00 -4.65 1.32 4.32 -0.45 -4.94 117.00 116.75 2gya n LEU 58 Ca -0.17 0.00 -0.24 0.00 -0.02 0.00 0.00 56.01 55.58 2gya n LEU 58 Cb 0.52 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.24 2gya n LEU 58 CO 0.32 0.00 -0.33 -0.54 -1.22 0.00 0.00 177.39 175.62 2gya s LYS 59 N -1.91 2.31 0.26 3.23 -0.14 -1.26 0.21 119.74 122.45 2gya s LYS 59 Ca 0.00 -1.32 -0.17 0.00 -1.36 0.00 0.00 55.97 53.12 2gya s LYS 59 Cb 0.00 -2.22 0.01 0.00 -1.68 0.00 0.00 37.83 33.94 2gya s LYS 59 CO 0.00 0.39 0.60 0.00 -0.76 0.00 0.00 175.35 175.59 2gya s ALA 60 N -2.12 -0.78 -0.13 5.17 0.00 -0.66 -1.45 121.76 121.81 2gya s ALA 60 Ca 0.30 -0.55 0.01 0.00 0.00 0.00 0.00 51.96 51.72 2gya s ALA 60 Cb -0.07 0.95 0.02 0.00 0.00 0.00 0.00 23.12 24.01 2gya s ALA 60 CO 0.19 -0.94 -0.14 0.08 0.00 0.00 0.00 175.76 174.95 2gya s VAL 61 N -3.96 1.49 0.12 0.00 1.01 0.45 -1.50 120.40 118.02 2gya s VAL 61 Ca 0.16 -0.61 -0.31 0.00 0.00 0.00 0.00 61.98 61.22 2gya s VAL 61 Cb -0.03 -1.39 -0.08 0.00 0.00 0.00 0.00 36.38 34.88 2gya s VAL 61 CO 0.07 0.44 1.34 -0.69 0.00 0.00 0.00 175.10 176.27 2gya s VAL 62 N 1.24 3.40 -0.08 2.92 1.01 -1.18 -1.18 120.40 126.55 2gya s VAL 62 Ca -0.01 1.04 -0.01 0.00 0.00 0.00 0.00 61.98 63.00 2gya s VAL 62 Cb -0.14 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 2gya s VAL 62 CO -0.06 0.10 -0.08 1.33 0.00 0.00 0.00 175.10 176.39 2gya n VAL 63 N 3.65 0.44 -4.43 2.92 0.24 -1.01 -1.13 118.33 119.02 2gya n VAL 63 Ca 0.10 -0.15 -0.21 0.00 -2.04 0.00 0.00 64.34 62.04 2gya n VAL 63 Cb 0.43 -0.97 -0.14 0.00 -1.47 0.00 0.00 33.84 31.69 2gya n VAL 63 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2gya s ARG 64 N -2.15 0.98 0.17 7.34 0.52 -1.21 -4.80 118.95 119.79 2gya s ARG 64 Ca -0.11 -0.67 -0.04 0.00 -0.52 0.00 0.00 55.73 54.39 2gya s ARG 64 Cb 0.03 -0.97 -0.03 0.00 0.52 0.00 0.00 34.95 34.50 2gya s ARG 64 CO 0.17 0.25 0.17 0.95 0.02 0.00 0.00 175.30 176.86 2gya s THR 65 N -0.68 0.06 -0.03 0.02 -4.23 -1.26 -1.52 115.64 108.00 2gya s THR 65 Ca 0.03 -1.74 -0.22 0.00 -1.18 0.00 0.00 61.69 58.57 2gya s THR 65 Cb -0.07 -2.11 -0.23 0.00 1.34 0.00 0.00 72.50 71.42 2gya s THR 65 CO 0.01 -0.27 1.06 0.11 -0.54 0.00 0.00 174.62 174.99 2gya h LYS 66 N 2.66 0.27 -6.39 3.99 1.57 -1.76 -3.17 116.57 113.74 2gya h LYS 66 Ca -0.34 -0.29 -0.61 0.00 -1.87 0.00 0.00 60.65 57.54 2gya h LYS 66 Cb 1.22 0.08 0.11 0.00 0.08 0.00 0.00 32.23 33.73 2gya h LYS 66 CO 0.52 1.00 -0.01 1.63 -0.57 0.00 0.00 179.45 182.02 2gya n LYS 67 N -4.39 1.08 -3.26 3.15 4.76 -1.26 -3.97 118.16 114.28 2gya n LYS 67 Ca -0.10 0.38 -0.38 0.00 -2.87 0.00 0.00 58.31 55.34 2gya n LYS 67 Cb 0.57 -1.69 -0.06 0.00 -1.84 0.00 0.00 35.03 32.01 2gya n LYS 67 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2gya s GLY 68 N -0.66 2.46 -0.12 0.72 0.00 -1.26 -4.71 107.32 103.75 2gya s GLY 68 Ca 0.60 -0.11 -0.03 0.00 0.00 0.00 0.00 44.72 45.18 2gya s GLY 68 CO 0.59 0.83 -0.02 0.54 0.00 0.00 0.00 173.10 175.04 2gya s VAL 69 N 0.54 4.11 0.13 1.40 0.11 -1.05 -4.87 120.40 120.76 2gya s VAL 69 Ca 0.29 -0.30 -0.16 0.00 -2.93 0.00 0.00 61.98 58.87 2gya s VAL 69 Cb -0.16 -2.77 -0.07 0.00 -1.53 0.00 0.00 36.38 31.85 2gya s VAL 69 CO 0.12 0.54 0.57 -0.60 -3.33 0.00 0.00 175.10 172.40 2gya s ARG 70 N -0.19 4.07 0.30 1.54 3.52 -1.26 -2.24 118.95 124.70 2gya s ARG 70 Ca 0.04 0.60 0.07 0.00 -0.13 0.00 0.00 55.73 56.32 2gya s ARG 70 Cb -0.13 -3.03 -0.03 0.00 -1.56 0.00 0.00 34.95 30.21 2gya s ARG 70 CO 0.02 0.53 0.26 1.03 -0.81 0.00 0.00 175.30 176.33 2gya s ARG 71 N -1.68 2.81 0.54 5.12 0.52 -0.81 -4.99 118.95 120.47 2gya s ARG 71 Ca 0.35 -1.20 0.38 0.00 -0.52 0.00 0.00 55.73 54.75 2gya s ARG 71 Cb -0.17 -2.52 1.56 0.00 0.52 0.00 0.00 34.95 34.35 2gya s ARG 71 CO 0.19 0.21 1.76 -1.35 0.02 0.00 0.00 175.30 176.13 2gya h PRO 72 N 1.33 0.02 0.00 3.54 0.11 -1.99 0.37 132.00 135.38 2gya h PRO 72 Ca -0.46 -0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 2gya h PRO 72 Cb 1.25 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2gya h PRO 72 CO 0.59 0.01 -0.49 0.38 -0.21 0.00 0.00 178.00 178.29 2gya h ASP 73 N 0.02 0.00 0.00 -2.05 2.03 -2.04 -3.47 116.42 110.91 2gya h ASP 73 Ca 0.64 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.94 2gya h ASP 73 Cb 2.51 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 41.01 2gya h ASP 73 CO -0.03 0.49 0.00 0.61 -1.03 0.00 0.00 179.24 179.27 2gya n GLY 74 N 0.64 0.82 3.79 7.15 0.00 0.13 -5.10 105.19 112.61 2gya n GLY 74 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2gya n GLY 74 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gya s SER 75 N -1.12 6.71 -0.01 1.61 1.04 -1.26 -4.80 113.70 115.86 2gya s SER 75 Ca 0.00 0.84 -0.02 0.00 0.48 0.00 0.00 55.95 57.25 2gya s SER 75 Cb 0.00 -2.24 -0.04 0.00 0.10 0.00 0.00 66.02 63.84 2gya s SER 75 CO 0.00 0.21 0.14 0.54 0.98 0.00 0.00 173.24 175.11 2gya s VAL 76 N -0.40 5.17 -0.02 5.02 0.11 -1.26 -1.92 120.40 127.10 2gya s VAL 76 Ca 0.23 -0.24 0.07 0.00 -2.93 0.00 0.00 61.98 59.10 2gya s VAL 76 Cb -0.16 -3.39 -0.02 0.00 -1.53 0.00 0.00 36.38 31.28 2gya s VAL 76 CO 0.11 0.34 -0.22 -0.51 -3.33 0.00 0.00 175.10 171.49 2gya s ILE 77 N -1.27 1.75 0.02 7.04 2.07 -0.95 -4.94 121.20 124.91 2gya s ILE 77 Ca 0.25 -0.94 0.02 0.00 -1.41 0.00 0.00 60.65 58.57 2gya s ILE 77 Cb -0.12 -1.45 -0.01 0.00 0.13 0.00 0.00 42.46 41.00 2gya s ILE 77 CO 0.16 0.49 -0.07 -0.13 -1.91 0.00 0.00 174.94 173.49 2gya s ARG 78 N -0.49 0.52 0.40 3.50 0.52 -1.26 -2.54 118.95 119.61 2gya s ARG 78 Ca 0.08 -0.45 0.08 0.00 -0.52 0.00 0.00 55.73 54.91 2gya s ARG 78 Cb -0.09 -0.43 -0.04 0.00 0.52 0.00 0.00 34.95 34.92 2gya s ARG 78 CO -0.01 0.10 0.25 -0.06 0.02 0.00 0.00 175.30 175.61 2gya s PHE 79 N -0.65 2.67 0.00 -0.53 0.40 -1.20 -5.08 117.98 113.60 2gya s PHE 79 Ca -0.02 -0.51 0.00 0.00 -0.60 0.00 0.00 56.93 55.80 2gya s PHE 79 Cb -0.05 -1.99 0.00 0.00 0.51 0.00 0.00 43.02 41.48 2gya s PHE 79 CO 0.00 0.09 0.40 -0.25 0.70 0.00 0.00 175.22 176.16 2gya n ASP 80 N -1.35 0.00 0.00 1.36 8.00 -1.26 -4.43 116.55 118.87 2gya n ASP 80 Ca 0.00 0.44 0.00 0.00 0.71 0.00 0.00 54.79 55.94 2gya n ASP 80 Cb 0.63 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 2gya n ASP 80 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gya n GLY 81 N 0.41 2.90 3.22 0.44 0.00 -1.26 -4.62 105.19 106.29 2gya n GLY 81 Ca 0.00 -1.83 -0.21 0.00 0.00 0.00 0.00 46.02 43.99 2gya n GLY 81 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2gya s ASN 82 N -0.38 2.05 0.09 1.61 0.01 -1.26 -3.35 114.94 113.72 2gya s ASN 82 Ca 0.00 -0.66 -0.07 0.00 -0.71 0.00 0.00 52.86 51.42 2gya s ASN 82 Cb 0.00 -0.09 -0.01 0.00 0.41 0.00 0.00 41.25 41.56 2gya s ASN 82 CO 0.00 -0.03 0.14 0.00 -1.51 0.00 0.00 177.10 175.70 2gya s ALA 83 N -1.31 0.00 0.21 0.60 0.00 -0.57 -0.99 121.76 119.70 2gya s ALA 83 Ca 0.02 -0.81 -0.15 0.00 0.00 0.00 0.00 51.96 51.03 2gya s ALA 83 Cb -0.10 0.48 0.01 0.00 0.00 0.00 0.00 23.12 23.51 2gya s ALA 83 CO 0.03 -0.49 0.49 0.00 0.00 0.00 0.00 175.76 175.79 2gya s VAL 85 N -3.94 1.55 0.26 0.00 1.01 -0.32 -1.12 120.40 117.85 2gya s VAL 85 Ca 0.15 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 2gya s VAL 85 Cb -0.01 -1.36 -0.09 0.00 0.00 0.00 0.00 36.38 34.92 2gya s VAL 85 CO 0.02 0.45 1.08 -0.76 0.00 0.00 0.00 175.10 175.89 2gya s LEU 86 N 0.37 4.56 0.05 3.92 1.43 -1.26 -0.41 118.68 127.34 2gya s LEU 86 Ca -0.13 2.22 0.05 0.00 -1.03 0.00 0.00 54.13 55.24 2gya s LEU 86 Cb -0.15 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.42 2gya s LEU 86 CO 0.05 -0.12 -0.14 -1.48 0.23 0.00 0.00 176.35 174.89 2gya s LEU 87 N -1.29 2.21 0.00 1.79 0.05 -0.53 -2.16 118.68 118.75 2gya s LEU 87 Ca 0.45 -0.52 0.01 0.00 0.05 0.00 0.00 54.13 54.12 2gya s LEU 87 Cb -0.31 -0.58 0.02 0.00 -2.05 0.00 0.00 46.19 43.27 2gya s LEU 87 CO 0.39 -0.00 0.14 -0.46 -0.55 0.00 0.00 176.35 175.87 2gya n ASN 88 N 1.67 0.33 -0.16 1.48 0.23 -0.36 -4.02 115.26 114.42 2gya n ASN 88 Ca -0.19 -1.24 0.00 0.00 -0.53 0.00 0.00 54.58 52.62 2gya n ASN 88 Cb 0.54 -0.08 0.26 0.00 -2.08 0.00 0.00 39.78 38.43 2gya n ASN 88 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 2gya h ASN 89 N -0.01 0.78 -0.33 0.53 2.35 -2.00 -3.40 115.58 113.50 2gya h ASN 89 Ca -0.05 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 2gya h ASN 89 Cb 0.21 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 2gya h ASN 89 CO 0.06 0.61 0.03 0.59 -1.65 0.00 0.00 177.43 177.07 2gya n ASN 90 N -4.40 1.76 0.00 5.81 4.13 -1.26 -4.64 115.26 116.66 2gya n ASN 90 Ca 0.06 -1.52 0.00 0.00 1.68 0.00 0.00 54.58 54.80 2gya n ASN 90 Cb 0.08 -1.66 0.00 0.00 -1.54 0.00 0.00 39.78 36.66 2gya n ASN 90 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2gya n SER 91 N 18.69 0.00 -3.79 6.41 7.64 -1.26 -1.97 113.62 139.35 2gya n SER 91 Ca 0.47 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 60.01 2gya n SER 91 Cb 0.43 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.66 2gya n SER 91 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2gya n GLU 92 N 0.00 -0.95 -3.79 1.43 1.02 -1.26 -4.99 120.64 112.09 2gya n GLU 92 Ca 0.00 0.43 -0.24 0.00 -0.02 0.00 0.00 57.16 57.33 2gya n GLU 92 Cb 0.00 -3.48 -0.17 0.00 -0.02 0.00 0.00 31.44 27.77 2gya n GLU 92 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2gya s GLN 93 N -6.15 0.77 0.47 3.49 0.74 -0.83 -4.98 119.66 113.17 2gya s GLN 93 Ca 0.40 0.03 -0.24 0.00 0.05 0.00 0.00 55.36 55.60 2gya s GLN 93 Cb -0.17 -1.11 -0.08 0.00 1.10 0.00 0.00 33.01 32.74 2gya s GLN 93 CO 0.90 -0.31 1.26 -2.30 -0.55 0.00 0.00 175.29 174.29 2gya n PRO 94 N 5.11 1.78 0.11 1.67 -0.02 -1.26 -1.22 135.00 141.16 2gya n PRO 94 Ca -0.08 0.64 0.12 0.00 -2.02 0.00 0.00 63.50 62.16 2gya n PRO 94 Cb 0.50 -2.41 0.09 0.00 -0.02 0.00 0.00 33.50 31.66 2gya n PRO 94 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2gya h ILE 95 N 1.77 0.00 -2.82 4.25 2.10 -1.76 -3.44 117.51 117.61 2gya h ILE 95 Ca -0.49 -0.82 -0.46 0.00 1.08 0.00 0.00 64.86 64.18 2gya h ILE 95 Cb 1.30 1.42 0.09 0.00 -1.09 0.00 0.00 36.82 38.54 2gya h ILE 95 CO 0.58 0.00 0.16 -0.83 -1.08 0.00 0.00 178.15 176.99 2gya s GLY 96 N -4.09 1.76 -0.19 8.18 0.00 -1.26 -4.91 107.32 106.81 2gya s GLY 96 Ca 0.03 -1.43 -0.15 0.00 0.00 0.00 0.00 44.72 43.16 2gya s GLY 96 CO 0.75 -0.90 -0.10 2.41 0.00 0.00 0.00 173.10 175.26 2gya n THR 97 N -2.94 1.48 -4.25 0.90 -1.04 -1.26 -4.96 114.28 102.20 2gya n THR 97 Ca 0.13 0.04 -0.24 0.00 -2.04 0.00 0.00 64.05 61.94 2gya n THR 97 Cb 0.60 -2.20 -0.07 0.00 -1.82 0.00 0.00 70.33 66.84 2gya n THR 97 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2gya s ARG 98 N -2.41 2.37 0.15 -2.82 3.52 -1.26 -5.04 118.95 113.46 2gya s ARG 98 Ca -0.25 -1.27 0.10 0.00 -0.13 0.00 0.00 55.73 54.18 2gya s ARG 98 Cb 0.05 -2.26 -0.04 0.00 -1.56 0.00 0.00 34.95 31.14 2gya s ARG 98 CO 0.41 0.40 -0.19 -1.50 -0.81 0.00 0.00 175.30 173.61 2gya s ILE 99 N -2.06 2.70 -0.08 4.11 -1.16 -1.26 -3.50 121.20 119.95 2gya s ILE 99 Ca 0.30 -1.70 0.04 0.00 -0.51 0.00 0.00 60.65 58.78 2gya s ILE 99 Cb -0.08 -2.27 0.00 0.00 0.61 0.00 0.00 42.46 40.73 2gya s ILE 99 CO 0.20 0.01 -0.20 0.12 -2.81 0.00 0.00 174.94 172.25 2gya s PHE 100 N -1.36 2.15 0.00 3.50 5.36 0.30 -4.79 117.98 123.14 2gya s PHE 100 Ca 0.19 -0.79 0.00 0.00 -0.96 0.00 0.00 56.93 55.38 2gya s PHE 100 Cb -0.10 -1.46 0.00 0.00 -0.34 0.00 0.00 43.02 41.13 2gya s PHE 100 CO 0.10 -0.31 0.00 0.41 -1.46 0.00 0.00 175.22 173.96 2gya n GLY 101 N 3.42 2.51 3.82 13.12 0.00 -1.26 -4.81 105.19 122.00 2gya n GLY 101 Ca -0.19 -1.88 -0.29 0.00 0.00 0.00 0.00 46.02 43.66 2gya n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gya s PRO 102 N -3.25 1.55 0.18 1.61 0.04 -1.26 -4.43 135.00 129.43 2gya s PRO 102 Ca 0.00 0.30 0.01 0.00 0.04 0.00 0.00 61.00 61.35 2gya s PRO 102 Cb 0.00 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 2gya s PRO 102 CO 0.00 -1.92 0.04 0.14 0.04 0.00 0.00 177.00 175.30 2gya s VAL 103 N -3.34 0.46 0.78 -0.36 -7.23 -1.00 -4.89 120.40 104.82 2gya s VAL 103 Ca 0.63 -1.97 -0.10 0.00 -1.81 0.00 0.00 61.98 58.73 2gya s VAL 103 Cb -0.14 -2.21 0.08 0.00 0.56 0.00 0.00 36.38 34.68 2gya s VAL 103 CO 0.52 -0.37 1.12 0.42 -0.31 0.00 0.00 175.10 176.49 2gya s THR 104 N -3.81 2.11 -0.14 5.32 -4.23 -1.26 -2.38 115.64 111.24 2gya s THR 104 Ca 0.27 -0.11 -0.20 0.00 -1.18 0.00 0.00 61.69 60.47 2gya s THR 104 Cb 0.07 -2.99 -0.17 0.00 1.34 0.00 0.00 72.50 70.74 2gya s THR 104 CO 0.05 0.00 0.44 -0.09 -0.54 0.00 0.00 174.62 174.48 2gya h ARG 105 N -0.91 0.00 0.00 3.99 2.43 -1.99 -3.33 114.38 114.57 2gya h ARG 105 Ca -0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2gya h ARG 105 Cb 1.32 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 2gya h ARG 105 CO 0.62 0.70 0.14 0.39 -1.51 0.00 0.00 179.97 180.32 2gya n GLU 106 N -4.62 0.03 -0.14 0.20 4.71 -1.26 -0.06 120.64 119.49 2gya n GLU 106 Ca -0.11 0.43 0.09 0.00 -0.01 0.00 0.00 57.16 57.56 2gya n GLU 106 Cb 0.39 -1.73 0.29 0.00 -1.01 0.00 0.00 31.44 29.38 2gya n GLU 106 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 2gya n LEU 107 N -1.56 2.13 0.00 -4.62 7.94 -1.25 -4.36 117.00 115.28 2gya n LEU 107 Ca -0.00 -0.96 0.00 0.00 -1.11 0.00 0.00 56.01 53.94 2gya n LEU 107 Cb 0.15 -0.19 0.00 0.00 0.53 0.00 0.00 43.42 43.91 2gya n LEU 107 CO 0.02 0.48 0.00 0.54 -1.11 0.00 0.00 177.39 177.32 2gya n ARG 108 N 0.64 0.00 0.00 1.96 1.74 0.91 -3.56 116.66 118.34 2gya n ARG 108 Ca 0.16 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 2gya n ARG 108 Cb 0.38 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.82 2gya n ARG 108 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2gya n SER 109 N -0.10 0.00 -0.14 0.55 2.88 -1.26 -2.91 113.62 112.64 2gya n SER 109 Ca 0.00 0.95 -0.04 0.00 -1.33 0.00 0.00 58.87 58.45 2gya n SER 109 Cb 0.00 -0.45 0.15 0.00 -0.75 0.00 0.00 64.21 63.16 2gya n SER 109 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2gya h GLU 110 N 0.00 0.87 0.00 -1.46 4.81 -1.90 -3.43 114.58 113.47 2gya h GLU 110 Ca 0.00 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 2gya h GLU 110 Cb 0.00 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.27 2gya h GLU 110 CO 0.00 0.82 0.00 1.17 -0.73 0.00 0.00 179.01 180.27 2gya n LYS 111 N -4.24 0.00 -3.66 1.92 3.00 -1.20 -5.02 118.16 108.97 2gya n LYS 111 Ca 0.03 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.98 2gya n LYS 111 Cb 0.27 0.00 -0.09 0.00 0.00 0.00 0.00 35.03 35.21 2gya n LYS 111 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 2gya s PHE 112 N 0.00 3.36 -0.12 5.64 0.08 -1.14 -4.95 117.98 120.85 2gya s PHE 112 Ca 0.00 0.31 0.15 0.00 0.12 0.00 0.00 56.93 57.52 2gya s PHE 112 Cb 0.00 -2.25 -0.23 0.00 -0.57 0.00 0.00 43.02 39.97 2gya s PHE 112 CO 0.00 0.16 0.38 0.00 -0.10 0.00 0.00 175.22 175.66 2gya n MET 113 N 3.96 0.70 0.01 0.44 0.00 -1.26 -4.14 117.12 116.84 2gya n MET 113 Ca -0.15 -0.12 -0.05 0.00 0.00 0.00 0.00 57.70 57.38 2gya n MET 113 Cb 0.52 -1.34 -0.11 0.00 0.00 0.00 0.00 33.22 32.28 2gya n MET 113 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 2gya h LYS 114 N 0.00 0.00 -0.12 3.17 1.57 -1.92 -3.28 116.57 115.98 2gya h LYS 114 Ca 0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 2gya h LYS 114 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 2gya h LYS 114 CO 0.00 0.47 -0.55 0.82 -0.57 0.00 0.00 179.45 179.62 2gya h ILE 115 N 0.00 1.35 -0.18 1.86 1.08 -1.93 -3.04 117.51 116.64 2gya h ILE 115 Ca -0.21 -1.84 -0.15 0.00 -0.39 0.00 0.00 64.86 62.27 2gya h ILE 115 Cb 1.82 1.86 -0.01 0.00 -3.07 0.00 0.00 36.82 37.42 2gya h ILE 115 CO 0.07 0.55 -0.52 -0.29 -0.69 0.00 0.00 178.15 177.28 2gya h ILE 116 N 0.28 1.32 0.00 -0.67 -0.00 -1.75 -2.40 117.51 114.29 2gya h ILE 116 Ca 0.00 -1.76 -0.02 0.00 -0.00 0.00 0.00 64.86 63.08 2gya h ILE 116 Cb 1.06 1.75 -0.00 0.00 -0.00 0.00 0.00 36.82 39.62 2gya h ILE 116 CO 0.09 0.55 -0.10 0.28 -0.00 0.00 0.00 178.15 178.97 2gya h SER 117 N 0.41 0.00 -0.06 2.19 0.02 -1.59 -1.81 113.55 112.70 2gya h SER 117 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2gya h SER 117 Cb 1.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.59 2gya h SER 117 CO 0.10 0.10 0.00 0.18 -1.14 0.00 0.00 176.83 176.07 2gya n LEU 118 N -3.83 2.85 -4.67 5.07 7.99 -1.11 -4.93 117.00 118.37 2gya n LEU 118 Ca -0.02 -1.06 -0.40 0.00 -0.01 0.00 0.00 56.01 54.52 2gya n LEU 118 Cb 0.20 -0.03 -0.05 0.00 -0.11 0.00 0.00 43.42 43.43 2gya n LEU 118 CO 0.31 0.50 0.45 0.00 -1.51 0.00 0.00 177.39 177.14 2gya s ALA 119 N -1.75 3.52 0.10 -1.18 0.00 -0.68 -4.41 121.76 117.37 2gya s ALA 119 Ca 0.26 -0.15 -0.05 0.00 0.00 0.00 0.00 51.96 52.03 2gya s ALA 119 Cb 0.18 -3.05 -0.18 0.00 0.00 0.00 0.00 23.12 20.07 2gya s ALA 119 CO 0.27 -0.56 1.22 -1.00 0.00 0.00 0.00 175.76 175.70 2gya h PRO 120 N 7.39 0.35 -6.52 0.00 0.13 -1.86 -3.47 132.00 128.02 2gya h PRO 120 Ca -0.31 -0.47 -0.62 0.00 -0.87 0.00 0.00 66.00 63.73 2gya h PRO 120 Cb 1.14 0.15 -0.22 0.00 0.13 0.00 0.00 31.00 32.21 2gya h PRO 120 CO 0.79 1.16 -0.84 -1.21 -0.23 0.00 0.00 178.00 177.67 2gya s GLU 121 N -2.97 1.28 -0.11 0.86 0.41 -1.26 -5.08 118.70 111.83 2gya s GLU 121 Ca -0.05 -1.28 -0.04 0.00 -0.41 0.00 0.00 54.97 53.19 2gya s GLU 121 Cb 0.08 -1.64 0.05 0.00 -1.78 0.00 0.00 34.13 30.84 2gya s GLU 121 CO 0.88 0.38 0.22 0.08 -0.49 0.00 0.00 175.26 176.33 2gya s VAL 122 N -1.19 -0.26 -2.72 2.63 1.01 -1.26 -2.36 120.40 116.25 2gya s VAL 122 Ca 0.11 0.27 0.26 0.00 0.00 0.00 0.00 61.98 62.62 2gya s VAL 122 Cb -0.10 -0.37 0.39 0.00 0.00 0.00 0.00 36.38 36.31 2gya s VAL 122 CO 0.05 0.11 1.53 0.18 0.00 0.00 0.00 175.10 176.98