#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gf8 s ARG 36 N -5.31 1.07 -0.23 0.00 3.00 -1.26 -4.97 118.95 111.24 3gf8 s ARG 36 Ca 0.57 -0.69 -0.07 0.00 0.00 0.00 0.00 55.73 55.54 3gf8 s ARG 36 Cb -0.11 -1.07 -0.03 0.00 0.00 0.00 0.00 34.95 33.73 3gf8 s ARG 36 CO 0.52 0.28 0.07 -1.17 0.00 0.00 0.00 175.30 175.00 3gf8 s LEU 37 N -0.86 3.57 0.20 2.53 2.96 -1.26 -1.96 118.68 123.87 3gf8 s LEU 37 Ca 0.04 -0.11 0.11 0.00 -0.22 0.00 0.00 54.13 53.94 3gf8 s LEU 37 Cb -0.07 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 3gf8 s LEU 37 CO 0.01 0.03 -0.19 -0.44 -1.32 0.00 0.00 176.35 174.43 3gf8 s SER 38 N 1.25 3.68 -0.11 3.68 0.01 0.67 -1.55 113.70 121.33 3gf8 s SER 38 Ca 0.05 -0.81 0.03 0.00 1.31 0.00 0.00 55.95 56.53 3gf8 s SER 38 Cb -0.15 -0.39 0.01 0.00 0.21 0.00 0.00 66.02 65.70 3gf8 s SER 38 CO 0.04 0.10 -0.21 -0.69 0.41 0.00 0.00 173.24 172.89 3gf8 s VAL 39 N -1.81 1.87 -0.16 3.43 1.01 -1.26 0.12 120.40 123.61 3gf8 s VAL 39 Ca 0.23 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 3gf8 s VAL 39 Cb -0.08 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 3gf8 s VAL 39 CO 0.12 0.52 0.07 -0.75 0.00 0.00 0.00 175.10 175.06 3gf8 s LYS 40 N 0.58 3.79 -0.14 2.72 2.20 0.18 -4.47 119.74 124.59 3gf8 s LYS 40 Ca -0.14 -0.31 -0.05 0.00 -0.36 0.00 0.00 55.97 55.11 3gf8 s LYS 40 Cb -0.17 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 32.94 3gf8 s LYS 40 CO 0.04 0.41 0.05 -0.06 -0.36 0.00 0.00 175.35 175.43 3gf8 s PHE 41 N -0.00 3.28 0.10 4.03 0.40 -1.26 0.29 117.98 124.81 3gf8 s PHE 41 Ca 0.06 0.18 0.07 0.00 -0.60 0.00 0.00 56.93 56.64 3gf8 s PHE 41 Cb -0.12 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.42 3gf8 s PHE 41 CO 0.01 0.35 -0.18 -1.59 0.70 0.00 0.00 175.22 174.51 3gf8 s LYS 42 N -0.29 1.04 -0.52 0.44 -2.85 0.06 -4.89 119.74 112.73 3gf8 s LYS 42 Ca 0.08 -1.13 0.05 0.00 -1.00 0.00 0.00 55.97 53.97 3gf8 s LYS 42 Cb -0.12 -1.17 0.18 0.00 -2.06 0.00 0.00 37.83 34.66 3gf8 s LYS 42 CO 0.02 0.26 0.43 0.98 0.10 0.00 0.00 175.35 177.14 3gf8 n TYR 43 N 1.02 0.78 0.33 1.78 9.36 -1.26 -1.26 117.16 127.91 3gf8 n TYR 43 Ca -0.19 -3.71 0.04 0.00 3.32 0.00 0.00 57.90 57.35 3gf8 n TYR 43 Cb 0.54 -0.14 0.01 0.00 -0.63 0.00 0.00 39.34 39.12 3gf8 n TYR 43 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 3gf8 n ASP 44 N 2.29 1.18 -3.73 2.98 5.68 -1.26 0.36 116.55 124.06 3gf8 n ASP 44 Ca 0.26 -1.09 -0.42 0.00 -0.50 0.00 0.00 54.79 53.04 3gf8 n ASP 44 Cb 0.44 0.36 -0.02 0.00 -1.14 0.00 0.00 41.12 40.76 3gf8 n ASP 44 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3gf8 n TYR 45 N -0.14 3.12 0.00 2.11 9.36 -1.26 -3.55 117.16 126.80 3gf8 n TYR 45 Ca 0.03 -2.66 0.00 0.00 3.32 0.00 0.00 57.90 58.60 3gf8 n TYR 45 Cb 0.17 -2.34 0.00 0.00 -0.63 0.00 0.00 39.34 36.54 3gf8 n TYR 45 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3gf8 n ASN 46 N 6.59 0.00 0.00 2.98 0.23 -1.26 -4.36 115.26 119.44 3gf8 n ASN 46 Ca 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.56 3gf8 n ASN 46 Cb 0.40 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.10 3gf8 n ASN 46 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3gf8 n GLU 48 N 0.00 0.00 -3.93 -3.83 4.71 -1.26 -4.67 120.64 111.65 3gf8 n GLU 48 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.84 3gf8 n GLU 48 Cb 0.00 -0.04 -0.03 0.00 -1.01 0.00 0.00 31.44 30.35 3gf8 n GLU 48 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 3gf8 n PHE 49 N 0.04 -1.61 -3.84 -0.32 3.01 -1.26 -4.90 117.46 108.58 3gf8 n PHE 49 Ca 0.00 0.60 -0.11 0.00 1.01 0.00 0.00 57.45 58.95 3gf8 n PHE 49 Cb 0.00 -2.40 -0.09 0.00 -0.01 0.00 0.00 39.48 36.98 3gf8 n PHE 49 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3gf8 s ALA 50 N -3.05 -0.41 -0.17 4.37 0.00 -1.23 -5.02 121.76 116.26 3gf8 s ALA 50 Ca 0.61 -0.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.15 3gf8 s ALA 50 Cb -0.34 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 3gf8 s ALA 50 CO 0.75 -0.28 1.26 0.34 0.00 0.00 0.00 175.76 177.84 3gf8 s ASP 51 N -1.67 6.94 -0.11 0.00 2.15 -1.26 -4.09 116.67 118.63 3gf8 s ASP 51 Ca -0.11 1.69 0.14 0.00 0.43 0.00 0.00 52.55 54.71 3gf8 s ASP 51 Cb -0.04 -2.54 0.36 0.00 -0.30 0.00 0.00 42.92 40.40 3gf8 s ASP 51 CO -0.00 -0.76 1.27 0.00 -0.17 0.00 0.00 175.17 175.50 3gf8 n ALA 52 N 6.61 2.52 -0.02 3.66 0.00 0.16 -4.83 120.51 128.61 3gf8 n ALA 52 Ca 0.14 -2.01 -0.07 0.00 0.00 0.00 0.00 53.44 51.50 3gf8 n ALA 52 Cb 0.45 -0.48 -0.05 0.00 0.00 0.00 0.00 19.45 19.37 3gf8 n ALA 52 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3gf8 h PHE 53 N 1.14 -0.78 -0.34 0.00 3.57 -1.91 -1.72 116.94 116.91 3gf8 h PHE 53 Ca 0.00 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.61 3gf8 h PHE 53 Cb 1.07 0.35 -0.02 0.00 2.79 0.00 0.00 35.95 40.15 3gf8 h PHE 53 CO 0.25 -0.25 0.24 1.12 -2.23 0.00 0.00 178.31 177.44 3gf8 h HIS 54 N -0.26 0.10 -0.00 0.41 2.07 -1.87 0.02 115.15 115.62 3gf8 h HIS 54 Ca 0.02 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.37 3gf8 h HIS 54 Cb 0.31 -0.03 -0.02 0.00 2.57 0.00 0.00 27.41 30.24 3gf8 h HIS 54 CO -0.55 0.05 -0.80 0.00 -3.07 0.00 0.00 177.93 173.57 3gf8 h ALA 55 N 1.83 0.66 0.00 6.11 0.00 -1.70 -3.39 119.26 122.76 3gf8 h ALA 55 Ca 0.16 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3gf8 h ALA 55 Cb 0.51 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3gf8 h ALA 55 CO -0.02 0.92 -0.93 1.04 0.00 0.00 0.00 179.25 180.27 3gf8 n GLN 56 N -3.66 2.57 -3.60 0.00 6.02 -0.66 -5.01 117.38 113.03 3gf8 n GLN 56 Ca -0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.58 3gf8 n GLN 56 Cb 0.76 -0.96 -0.11 0.00 1.02 0.00 0.00 30.24 30.94 3gf8 n GLN 56 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3gf8 s VAL 57 N -1.90 4.93 -1.01 5.09 1.01 -0.10 -4.94 120.40 123.48 3gf8 s VAL 57 Ca 0.00 -0.27 0.12 0.00 0.00 0.00 0.00 61.98 61.83 3gf8 s VAL 57 Cb 0.00 -3.50 0.36 0.00 0.00 0.00 0.00 36.38 33.24 3gf8 s VAL 57 CO 0.00 0.06 1.30 -0.90 0.00 0.00 0.00 175.10 175.56 3gf8 n ASP 58 N 5.04 3.11 -3.65 3.32 5.68 -1.26 -4.78 116.55 124.00 3gf8 n ASP 58 Ca -0.13 -2.05 -0.10 0.00 -0.50 0.00 0.00 54.79 52.01 3gf8 n ASP 58 Cb 0.50 -0.28 -0.08 0.00 -1.14 0.00 0.00 41.12 40.12 3gf8 n ASP 58 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 3gf8 s LYS 59 N -1.09 0.68 0.03 0.11 2.20 -1.26 -2.07 119.74 118.34 3gf8 s LYS 59 Ca 0.27 1.04 0.07 0.00 -0.36 0.00 0.00 55.97 56.99 3gf8 s LYS 59 Cb 0.15 0.20 -0.02 0.00 -1.51 0.00 0.00 37.83 36.64 3gf8 s LYS 59 CO 0.18 -0.13 -0.19 0.14 -0.36 0.00 0.00 175.35 174.99 3gf8 s VAL 60 N 1.13 1.52 -0.18 4.02 -7.23 -0.13 -0.04 120.40 119.48 3gf8 s VAL 60 Ca -0.06 -1.08 -0.02 0.00 -1.81 0.00 0.00 61.98 59.00 3gf8 s VAL 60 Cb -0.05 -1.32 0.06 0.00 0.56 0.00 0.00 36.38 35.62 3gf8 s VAL 60 CO -0.11 0.21 0.02 -0.70 -0.31 0.00 0.00 175.10 174.21 3gf8 s GLU 61 N -1.02 0.74 -0.08 4.82 2.12 0.23 -1.56 118.70 123.96 3gf8 s GLU 61 Ca 0.06 -0.41 -0.20 0.00 0.36 0.00 0.00 54.97 54.78 3gf8 s GLU 61 Cb -0.08 -2.03 -0.04 0.00 0.26 0.00 0.00 34.13 32.24 3gf8 s GLU 61 CO 0.01 -0.60 0.57 -1.17 -0.54 0.00 0.00 175.26 173.53 3gf8 s LEU 62 N 1.83 4.32 -0.16 2.70 2.96 0.99 -1.73 118.68 129.59 3gf8 s LEU 62 Ca -0.01 1.00 -0.05 0.00 -0.22 0.00 0.00 54.13 54.85 3gf8 s LEU 62 Cb -0.17 -2.85 -0.03 0.00 0.50 0.00 0.00 46.19 43.64 3gf8 s LEU 62 CO -0.08 -0.01 0.01 -0.31 -1.32 0.00 0.00 176.35 174.65 3gf8 s TYR 63 N 0.47 3.14 -0.13 5.38 1.51 -1.26 -0.60 117.35 125.86 3gf8 s TYR 63 Ca 0.30 -0.08 0.03 0.00 -1.01 0.00 0.00 57.07 56.31 3gf8 s TYR 63 Cb -0.17 -1.98 0.00 0.00 -0.11 0.00 0.00 41.96 39.71 3gf8 s TYR 63 CO 0.14 0.12 -0.22 0.08 -1.11 0.00 0.00 175.55 174.56 3gf8 s VAL 64 N 0.17 2.16 0.17 0.71 1.01 0.02 -4.28 120.40 120.35 3gf8 s VAL 64 Ca 0.01 -0.96 0.09 0.00 0.00 0.00 0.00 61.98 61.12 3gf8 s VAL 64 Cb -0.13 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 3gf8 s VAL 64 CO 0.02 0.55 -0.20 -0.36 0.00 0.00 0.00 175.10 175.11 3gf8 s PHE 65 N 0.64 1.93 0.06 5.22 0.40 -0.28 -0.29 117.98 125.67 3gf8 s PHE 65 Ca -0.11 -0.44 -0.00 0.00 -0.60 0.00 0.00 56.93 55.78 3gf8 s PHE 65 Cb -0.16 -0.96 0.01 0.00 0.51 0.00 0.00 43.02 42.42 3gf8 s PHE 65 CO 0.02 0.38 0.08 -0.40 0.70 0.00 0.00 175.22 176.00 3gf8 n ASP 66 N 0.27 0.12 -0.15 1.36 5.68 -0.01 -1.02 116.55 122.79 3gf8 n ASP 66 Ca -0.13 -1.10 -0.04 0.00 -0.50 0.00 0.00 54.79 53.02 3gf8 n ASP 66 Cb 0.57 -0.05 0.02 0.00 -1.14 0.00 0.00 41.12 40.52 3gf8 n ASP 66 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 3gf8 h LYS 67 N 0.00 -0.08 0.00 0.11 5.09 -1.75 -0.55 116.57 119.40 3gf8 h LYS 67 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.72 3gf8 h LYS 67 Cb 0.10 0.02 0.00 0.00 0.10 0.00 0.00 32.23 32.45 3gf8 h LYS 67 CO 0.03 -0.05 0.00 0.09 -2.09 0.00 0.00 179.45 177.43 3gf8 n ASN 68 N -5.38 0.00 0.00 7.07 3.02 -1.26 -4.87 115.26 113.84 3gf8 n ASN 68 Ca 0.04 -0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 3gf8 n ASN 68 Cb 0.29 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 3gf8 n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gf8 n GLY 69 N 0.12 0.67 3.75 7.41 0.00 -0.21 -5.04 105.19 111.89 3gf8 n GLY 69 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 3gf8 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gf8 s LYS 70 N -0.09 4.64 0.32 1.61 -0.14 -1.26 -3.40 119.74 121.41 3gf8 s LYS 70 Ca 0.00 1.27 -0.29 0.00 -1.36 0.00 0.00 55.97 55.59 3gf8 s LYS 70 Cb 0.00 -3.32 -0.11 0.00 -1.68 0.00 0.00 37.83 32.72 3gf8 s LYS 70 CO 0.00 0.40 1.53 -0.47 -0.76 0.00 0.00 175.35 176.05 3gf8 s TYR 71 N -0.58 2.74 -0.14 3.18 5.04 0.16 -0.83 117.35 126.91 3gf8 s TYR 71 Ca 0.40 0.95 -0.08 0.00 -2.44 0.00 0.00 57.07 55.90 3gf8 s TYR 71 Cb -0.23 -4.01 -0.06 0.00 0.35 0.00 0.00 41.96 38.01 3gf8 s TYR 71 CO 0.27 -3.24 -0.20 1.28 -1.34 0.00 0.00 175.55 172.33 3gf8 n LEU 72 N 1.60 1.19 -3.65 6.97 4.77 0.61 -1.08 117.00 127.41 3gf8 n LEU 72 Ca 0.05 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3gf8 n LEU 72 Cb 0.38 -0.48 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 3gf8 n LEU 72 CO 0.63 0.17 0.99 0.72 -1.33 0.00 0.00 177.39 178.57 3gf8 s PHE 73 N -2.33 -0.06 0.29 -1.77 -0.12 -1.14 -4.71 117.98 108.13 3gf8 s PHE 73 Ca -0.21 -0.08 0.10 0.00 -0.05 0.00 0.00 56.93 56.69 3gf8 s PHE 73 Cb 0.07 0.57 -0.05 0.00 -0.63 0.00 0.00 43.02 42.97 3gf8 s PHE 73 CO 0.27 -0.39 -0.15 -1.59 -0.05 0.00 0.00 175.22 173.31 3gf8 s LYS 74 N -2.61 1.67 -0.10 1.99 -2.85 -1.26 -0.80 119.74 115.77 3gf8 s LYS 74 Ca 0.14 -1.80 -0.04 0.00 -1.00 0.00 0.00 55.97 53.26 3gf8 s LYS 74 Cb 0.03 -1.61 0.05 0.00 -2.06 0.00 0.00 37.83 34.25 3gf8 s LYS 74 CO -0.03 0.22 0.22 -1.14 0.10 0.00 0.00 175.35 174.73 3gf8 s GLN 75 N -3.58 0.15 -0.07 1.78 0.74 0.23 -4.96 119.66 113.95 3gf8 s GLN 75 Ca 0.30 0.58 0.04 0.00 0.05 0.00 0.00 55.36 56.32 3gf8 s GLN 75 Cb -0.01 -0.13 -0.02 0.00 1.10 0.00 0.00 33.01 33.95 3gf8 s GLN 75 CO 0.14 -0.22 -0.18 0.00 -0.55 0.00 0.00 175.29 174.48 3gf8 s ALA 76 N 1.73 2.46 0.01 1.58 0.00 -1.26 -0.01 121.76 126.27 3gf8 s ALA 76 Ca -0.05 -0.99 -0.05 0.00 0.00 0.00 0.00 51.96 50.87 3gf8 s ALA 76 Cb -0.11 -0.91 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 3gf8 s ALA 76 CO -0.08 0.43 0.09 -2.00 0.00 0.00 0.00 175.76 174.21 3gf8 s GLU 77 N -0.27 0.47 0.18 0.00 2.12 -0.60 -5.02 118.70 115.58 3gf8 s GLU 77 Ca 0.01 -0.51 -0.22 0.00 0.36 0.00 0.00 54.97 54.60 3gf8 s GLU 77 Cb -0.13 0.19 0.06 0.00 0.26 0.00 0.00 34.13 34.50 3gf8 s GLU 77 CO 0.03 -0.11 0.61 -1.83 -0.54 0.00 0.00 175.26 173.42 3gf8 s GLU 78 N -1.64 1.37 0.10 4.30 -1.05 -1.26 -0.96 118.70 119.55 3gf8 s GLU 78 Ca -0.13 -0.59 0.00 0.00 -0.15 0.00 0.00 54.97 54.09 3gf8 s GLU 78 Cb -0.07 0.58 0.00 0.00 -0.44 0.00 0.00 34.13 34.21 3gf8 s GLU 78 CO -0.00 -0.60 0.00 0.41 0.95 0.00 0.00 175.26 176.02 3gf8 n GLY 79 N -0.38 -1.18 0.23 -3.83 0.00 -0.88 -4.65 105.19 94.50 3gf8 n GLY 79 Ca -0.14 -1.91 0.04 0.00 0.00 0.00 0.00 46.02 44.01 3gf8 n GLY 79 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3gf8 h SER 80 N 0.13 0.12 -0.97 1.61 4.64 -2.00 -2.33 113.55 114.75 3gf8 h SER 80 Ca 0.00 -0.02 0.17 0.00 -0.47 0.00 0.00 61.79 61.47 3gf8 h SER 80 Cb 0.00 -0.03 -0.09 0.00 -0.31 0.00 0.00 62.40 61.97 3gf8 h SER 80 CO 0.00 0.30 0.61 0.00 -0.87 0.00 0.00 176.83 176.87 3gf8 h ALA 81 N 1.72 1.76 0.00 5.18 0.00 -1.99 -0.70 119.26 125.23 3gf8 h ALA 81 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3gf8 h ALA 81 Cb 0.37 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3gf8 h ALA 81 CO 0.02 -0.08 0.00 -0.07 0.00 0.00 0.00 179.25 179.13 3gf8 h LEU 82 N 0.74 0.00 -0.34 0.00 4.07 -1.74 -3.15 115.31 114.89 3gf8 h LEU 82 Ca 0.53 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.49 3gf8 h LEU 82 Cb 0.84 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.58 3gf8 h LEU 82 CO -0.30 0.00 -0.44 -1.54 -1.08 0.00 0.00 178.44 175.09 3gf8 n SER 83 N -2.66 0.96 0.24 -0.43 3.41 -0.27 -4.24 113.62 110.63 3gf8 n SER 83 Ca 0.02 -0.76 0.08 0.00 -0.26 0.00 0.00 58.87 57.95 3gf8 n SER 83 Cb 0.30 0.30 0.60 0.00 -0.26 0.00 0.00 64.21 65.16 3gf8 n SER 83 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3gf8 h THR 84 N 0.82 0.94 0.00 6.66 1.35 -1.62 -3.45 112.91 117.60 3gf8 h THR 84 Ca 0.00 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 3gf8 h THR 84 Cb 0.53 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 3gf8 h THR 84 CO 0.00 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 3gf8 n GLY 85 N -1.00 0.95 0.20 5.82 0.00 -1.26 -4.87 105.19 105.03 3gf8 n GLY 85 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 3gf8 n GLY 85 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3gf8 n ASN 86 N 0.00 1.50 -4.71 1.61 3.02 -1.26 -5.03 115.26 110.38 3gf8 n ASN 86 Ca 0.00 -2.62 -0.42 0.00 -0.03 0.00 0.00 54.58 51.51 3gf8 n ASN 86 Cb 0.00 -0.32 -0.03 0.00 -0.61 0.00 0.00 39.78 38.82 3gf8 n ASN 86 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gf8 n TYR 87 N -0.88 2.72 -0.96 3.10 9.36 -1.26 -5.13 117.16 124.11 3gf8 n TYR 87 Ca 0.09 0.02 0.00 0.00 3.32 0.00 0.00 57.90 61.33 3gf8 n TYR 87 Cb 0.63 -2.68 0.00 0.00 -0.63 0.00 0.00 39.34 36.66 3gf8 n TYR 87 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 3gf8 n LEU 88 N 4.21 0.00 -3.57 2.98 4.77 -1.26 -4.63 117.00 119.50 3gf8 n LEU 88 Ca 0.16 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.04 3gf8 n LEU 88 Cb 0.35 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.34 3gf8 n LEU 88 CO 0.64 0.00 -0.06 -1.61 -1.33 0.00 0.00 177.39 175.04 3gf8 s GLU 90 N 3.56 0.27 -0.29 3.23 8.01 -1.26 -4.88 118.70 127.34 3gf8 s GLU 90 Ca 0.00 0.77 -0.03 0.00 0.01 0.00 0.00 54.97 55.72 3gf8 s GLU 90 Cb 0.00 -0.08 0.04 0.00 -4.31 0.00 0.00 34.13 29.78 3gf8 s GLU 90 CO 0.00 -0.38 0.01 0.08 0.01 0.00 0.00 175.26 174.97 3gf8 s VAL 91 N 2.52 3.19 -0.27 2.63 1.01 -0.60 -5.02 120.40 123.87 3gf8 s VAL 91 Ca 0.03 -1.16 -0.29 0.00 0.00 0.00 0.00 61.98 60.56 3gf8 s VAL 91 Cb -0.13 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.50 3gf8 s VAL 91 CO -0.12 -0.01 1.24 -1.61 0.00 0.00 0.00 175.10 174.60 3gf8 s GLU 92 N 1.33 4.02 -0.09 2.72 8.01 -1.26 -4.23 118.70 129.19 3gf8 s GLU 92 Ca -0.02 1.31 -0.08 0.00 0.01 0.00 0.00 54.97 56.18 3gf8 s GLU 92 Cb -0.18 -3.82 0.02 0.00 -4.31 0.00 0.00 34.13 25.84 3gf8 s GLU 92 CO -0.01 -0.98 0.24 -1.17 0.01 0.00 0.00 175.26 173.35 3gf8 s LEU 93 N 4.01 1.09 0.82 1.80 2.96 -1.26 -5.14 118.68 122.96 3gf8 s LEU 93 Ca 0.53 0.48 -0.11 0.00 -0.22 0.00 0.00 54.13 54.81 3gf8 s LEU 93 Cb -0.17 0.82 0.08 0.00 0.50 0.00 0.00 46.19 47.42 3gf8 s LEU 93 CO 0.19 -0.08 1.09 -2.84 -1.32 0.00 0.00 176.35 173.39 3gf8 s PRO 94 N 0.12 1.92 0.29 0.98 0.02 -1.26 -4.95 135.00 132.11 3gf8 s PRO 94 Ca -0.00 0.84 -0.28 0.00 0.02 0.00 0.00 61.00 61.58 3gf8 s PRO 94 Cb -0.02 -1.88 -0.14 0.00 0.02 0.00 0.00 34.50 32.48 3gf8 s PRO 94 CO 0.00 -1.79 1.04 0.28 -0.33 0.00 0.00 177.00 176.21 3gf8 n VAL 95 N -3.58 1.91 -2.33 3.83 0.31 -1.26 -4.88 118.33 112.34 3gf8 n VAL 95 Ca 0.07 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 3gf8 n VAL 95 Cb 0.55 -1.04 0.00 0.00 -0.91 0.00 0.00 33.84 32.44 3gf8 n VAL 95 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gf8 n GLY 96 N 1.25 -1.49 3.60 2.92 0.00 0.11 -5.00 105.19 106.57 3gf8 n GLY 96 Ca 0.10 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 3gf8 n GLY 96 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gf8 s GLN 97 N -1.95 2.88 0.10 1.61 -0.21 -1.26 -0.93 119.66 119.89 3gf8 s GLN 97 Ca 0.00 -0.52 -0.05 0.00 0.02 0.00 0.00 55.36 54.81 3gf8 s GLN 97 Cb 0.00 -2.66 -0.02 0.00 1.00 0.00 0.00 33.01 31.33 3gf8 s GLN 97 CO 0.00 0.64 0.13 0.71 -2.12 0.00 0.00 175.29 174.65 3gf8 s TYR 98 N -0.72 0.42 -0.07 0.91 2.02 0.54 -2.03 117.35 118.41 3gf8 s TYR 98 Ca 0.11 -0.86 0.03 0.00 -0.37 0.00 0.00 57.07 55.98 3gf8 s TYR 98 Cb -0.11 -0.22 -0.02 0.00 -0.40 0.00 0.00 41.96 41.21 3gf8 s TYR 98 CO 0.02 -0.53 -0.14 -0.65 -1.57 0.00 0.00 175.55 172.67 3gf8 s GLN 99 N -3.93 2.73 0.44 -0.62 -0.21 -0.19 -0.03 119.66 117.84 3gf8 s GLN 99 Ca 0.11 -0.70 0.06 0.00 0.02 0.00 0.00 55.36 54.85 3gf8 s GLN 99 Cb 0.06 -2.43 -0.05 0.00 1.00 0.00 0.00 33.01 31.59 3gf8 s GLN 99 CO -0.06 0.51 0.11 -0.06 -2.12 0.00 0.00 175.29 173.67 3gf8 s PHE 100 N -0.44 2.37 0.08 0.91 0.08 -0.41 -1.12 117.98 119.45 3gf8 s PHE 100 Ca 0.05 -0.70 -0.26 0.00 0.12 0.00 0.00 56.93 56.15 3gf8 s PHE 100 Cb -0.12 -1.84 0.08 0.00 -0.57 0.00 0.00 43.02 40.58 3gf8 s PHE 100 CO 0.02 0.23 0.72 0.00 -0.10 0.00 0.00 175.22 176.09 3gf8 s ALA 102 N -2.70 -1.70 -0.06 5.36 0.00 -0.92 -0.28 121.76 121.46 3gf8 s ALA 102 Ca 0.32 0.75 0.06 0.00 0.00 0.00 0.00 51.96 53.10 3gf8 s ALA 102 Cb 0.05 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 23.79 3gf8 s ALA 102 CO 0.18 -0.71 -0.25 -1.58 0.00 0.00 0.00 175.76 173.40 3gf8 s TRP 103 N -3.32 2.40 0.03 0.00 0.52 -0.71 -0.03 118.94 117.84 3gf8 s TRP 103 Ca 0.02 -0.72 0.07 0.00 0.02 0.00 0.00 56.10 55.48 3gf8 s TRP 103 Cb -0.01 -1.58 -0.02 0.00 -1.15 0.00 0.00 33.47 30.71 3gf8 s TRP 103 CO -0.10 -0.22 -0.20 0.00 0.02 0.00 0.00 176.95 176.45 3gf8 s ALA 104 N -0.14 1.71 0.00 0.98 0.00 0.14 -0.60 121.76 123.86 3gf8 s ALA 104 Ca -0.04 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.91 3gf8 s ALA 104 Cb -0.14 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.63 3gf8 s ALA 104 CO 0.04 0.39 0.00 0.41 0.00 0.00 0.00 175.76 176.60 3gf8 n GLY 105 N 2.00 1.76 3.65 0.00 0.00 0.94 -0.60 105.19 112.94 3gf8 n GLY 105 Ca -0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 3gf8 n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gf8 s ALA 106 N -3.37 3.60 0.00 4.61 0.00 -1.26 -4.64 121.76 120.70 3gf8 s ALA 106 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.36 3gf8 s ALA 106 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.46 3gf8 s ALA 106 CO 0.00 -1.31 0.00 0.54 0.00 0.00 0.00 175.76 174.99 3gf8 n ARG 107 N 6.78 0.00 0.17 0.00 1.74 -1.26 -5.02 116.66 119.07 3gf8 n ARG 107 Ca 0.14 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.36 3gf8 n ARG 107 Cb 0.45 0.00 0.56 0.00 -1.02 0.00 0.00 32.46 32.45 3gf8 n ARG 107 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3gf8 h ASP 108 N 0.00 0.00 1.41 0.55 3.32 -1.99 -3.00 116.42 116.70 3gf8 h ASP 108 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gf8 h ASP 108 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3gf8 h ASP 108 CO 0.00 0.00 0.00 0.28 -1.72 0.00 0.00 179.24 177.80 3gf8 h SER 109 N 0.00 0.00 -4.32 6.45 0.02 -1.95 -3.46 113.55 110.29 3gf8 h SER 109 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 3gf8 h SER 109 Cb 0.40 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 62.66 3gf8 h SER 109 CO 0.00 0.00 -0.83 -0.31 -1.14 0.00 0.00 176.83 174.55 3gf8 s TYR 110 N -3.29 1.62 -0.23 3.45 2.02 -1.14 -0.72 117.35 119.07 3gf8 s TYR 110 Ca 0.06 -0.33 -0.10 0.00 -0.37 0.00 0.00 57.07 56.34 3gf8 s TYR 110 Cb 0.09 -1.01 -0.05 0.00 -0.40 0.00 0.00 41.96 40.59 3gf8 s TYR 110 CO 0.57 0.01 0.14 -0.51 -1.57 0.00 0.00 175.55 174.19 3gf8 s ASP 111 N -0.71 5.94 -0.17 2.29 1.01 -0.42 -4.80 116.67 119.81 3gf8 s ASP 111 Ca 0.06 0.07 -0.04 0.00 0.71 0.00 0.00 52.55 53.35 3gf8 s ASP 111 Cb -0.08 -2.07 -0.03 0.00 1.01 0.00 0.00 42.92 41.76 3gf8 s ASP 111 CO 0.00 0.07 -0.02 -0.63 0.21 0.00 0.00 175.17 174.80 3gf8 s ILE 112 N 1.02 4.01 0.46 0.77 1.01 -1.26 -0.48 121.20 126.73 3gf8 s ILE 112 Ca 0.07 -0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.17 3gf8 s ILE 112 Cb -0.14 -2.78 -0.09 0.00 0.01 0.00 0.00 42.46 39.47 3gf8 s ILE 112 CO 0.04 0.47 1.07 0.35 0.00 0.00 0.00 174.94 176.87 3gf8 n THR 113 N 3.71 2.76 -3.49 2.92 -2.24 -0.47 -4.97 114.28 112.50 3gf8 n THR 113 Ca -0.17 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 60.74 3gf8 n THR 113 Cb 0.52 -1.27 -0.07 0.00 -2.10 0.00 0.00 70.33 67.42 3gf8 n THR 113 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3gf8 s SER 114 N -0.80 6.44 0.20 3.42 0.01 -1.26 -4.78 113.70 116.93 3gf8 s SER 114 Ca 0.65 0.52 0.04 0.00 1.31 0.00 0.00 55.95 58.48 3gf8 s SER 114 Cb -0.51 -2.20 -0.03 0.00 0.21 0.00 0.00 66.02 63.49 3gf8 s SER 114 CO 0.55 0.05 0.28 -0.76 0.41 0.00 0.00 173.24 173.77 3gf8 s LEU 115 N 0.68 4.18 -0.22 2.44 1.43 -1.26 -5.10 118.68 120.84 3gf8 s LEU 115 Ca 0.17 0.03 -0.05 0.00 -1.03 0.00 0.00 54.13 53.25 3gf8 s LEU 115 Cb -0.13 -2.74 -0.02 0.00 0.03 0.00 0.00 46.19 43.33 3gf8 s LEU 115 CO 0.05 -0.01 -0.00 -0.89 0.23 0.00 0.00 176.35 175.73 3gf8 s THR 116 N -1.89 3.80 0.08 5.49 2.01 -1.26 -4.98 115.64 118.89 3gf8 s THR 116 Ca 0.34 -0.35 -0.35 0.00 0.31 0.00 0.00 61.69 61.63 3gf8 s THR 116 Cb -0.10 -2.74 -0.15 0.00 0.01 0.00 0.00 72.50 69.53 3gf8 s THR 116 CO 0.27 0.41 1.51 -2.65 -0.69 0.00 0.00 174.62 173.48 3gf8 n PRO 117 N 4.58 1.67 -0.65 4.92 -0.02 -1.26 -1.05 135.00 143.19 3gf8 n PRO 117 Ca -0.17 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3gf8 n PRO 117 Cb 0.51 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 3gf8 n PRO 117 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gf8 n GLY 118 N 3.17 1.41 1.18 -1.23 0.00 -0.24 -4.74 105.19 104.74 3gf8 n GLY 118 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3gf8 n GLY 118 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gf8 n VAL 119 N -2.00 0.50 -1.61 1.61 0.31 -0.70 -4.95 118.33 111.50 3gf8 n VAL 119 Ca 0.00 0.16 -0.31 0.00 -0.01 0.00 0.00 64.34 64.18 3gf8 n VAL 119 Cb 0.00 -1.38 0.05 0.00 -0.91 0.00 0.00 33.84 31.60 3gf8 n VAL 119 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3gf8 s SER 120 N -5.40 5.24 0.36 4.52 0.01 -0.22 -4.86 113.70 113.35 3gf8 s SER 120 Ca 0.00 1.73 0.03 0.00 1.31 0.00 0.00 55.95 59.02 3gf8 s SER 120 Cb 0.00 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 3gf8 s SER 120 CO 0.00 -1.54 0.10 0.42 0.41 0.00 0.00 173.24 172.64 3gf8 s THR 121 N -2.85 0.77 0.27 1.44 -4.23 -1.26 -0.67 115.64 109.11 3gf8 s THR 121 Ca 0.60 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.12 3gf8 s THR 121 Cb -0.16 -2.52 0.26 0.00 1.34 0.00 0.00 72.50 71.42 3gf8 s THR 121 CO 0.51 0.00 1.70 -0.07 -0.54 0.00 0.00 174.62 176.22 3gf8 h LEU 122 N 1.97 0.25 -1.40 4.79 3.38 -1.95 -0.33 115.31 122.02 3gf8 h LEU 122 Ca -0.37 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3gf8 h LEU 122 Cb 1.26 0.14 0.00 0.00 0.09 0.00 0.00 40.66 42.15 3gf8 h LEU 122 CO 0.61 0.02 0.00 0.71 0.09 0.00 0.00 178.44 179.87 3gf8 h THR 123 N 0.39 0.00 0.00 0.22 1.35 -1.97 -0.55 112.91 112.35 3gf8 h THR 123 Ca 0.50 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 3gf8 h THR 123 Cb 0.88 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 3gf8 h THR 123 CO -0.50 0.00 0.00 0.44 -0.25 0.00 0.00 175.52 175.21 3gf8 h ASP 124 N 0.00 0.00 -3.35 5.36 3.32 -1.46 -3.45 116.42 116.85 3gf8 h ASP 124 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 3gf8 h ASP 124 Cb 0.27 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.74 3gf8 h ASP 124 CO 0.00 0.00 0.54 -0.22 -1.72 0.00 0.00 179.24 177.84 3gf8 s LEU 125 N -5.74 4.05 0.01 1.55 2.96 -0.22 -4.80 118.68 116.49 3gf8 s LEU 125 Ca 0.04 0.88 -0.03 0.00 -0.22 0.00 0.00 54.13 54.80 3gf8 s LEU 125 Cb 0.08 -3.24 -0.01 0.00 0.50 0.00 0.00 46.19 43.53 3gf8 s LEU 125 CO 0.55 -0.66 0.05 -0.54 -1.32 0.00 0.00 176.35 174.43 3gf8 s LYS 126 N 3.10 0.33 -0.10 1.98 1.02 -1.26 -2.55 119.74 122.27 3gf8 s LYS 126 Ca 0.37 -0.42 0.04 0.00 0.02 0.00 0.00 55.97 55.98 3gf8 s LYS 126 Cb -0.14 0.13 0.00 0.00 -0.52 0.00 0.00 37.83 37.30 3gf8 s LYS 126 CO 0.12 -0.07 -0.23 -1.17 -0.92 0.00 0.00 175.35 173.08 3gf8 s LEU 127 N -1.18 2.04 -0.09 3.17 0.20 -0.41 -1.36 118.68 121.05 3gf8 s LEU 127 Ca -0.13 -0.53 0.02 0.00 0.69 0.00 0.00 54.13 54.18 3gf8 s LEU 127 Cb -0.08 -1.34 0.01 0.00 -0.43 0.00 0.00 46.19 44.35 3gf8 s LEU 127 CO 0.00 0.14 -0.14 -0.75 -0.29 0.00 0.00 176.35 175.31 3gf8 s LYS 128 N 0.39 2.00 0.15 1.98 2.20 0.37 -0.46 119.74 126.37 3gf8 s LYS 128 Ca -0.18 -0.50 -0.31 0.00 -0.36 0.00 0.00 55.97 54.62 3gf8 s LYS 128 Cb -0.18 -1.68 -0.10 0.00 -1.51 0.00 0.00 37.83 34.36 3gf8 s LYS 128 CO 0.08 -0.02 1.58 -1.17 -0.36 0.00 0.00 175.35 175.46 3gf8 s LEU 129 N 0.85 4.37 0.29 5.43 2.96 0.23 -1.30 118.68 131.50 3gf8 s LEU 129 Ca -0.10 2.59 -0.29 0.00 -0.22 0.00 0.00 54.13 56.11 3gf8 s LEU 129 Cb -0.15 -3.59 -0.10 0.00 0.50 0.00 0.00 46.19 42.85 3gf8 s LEU 129 CO 0.01 -0.83 1.28 -0.54 -1.32 0.00 0.00 176.35 174.94 3gf8 s LYS 130 N 1.41 4.41 0.05 1.98 1.02 0.11 -4.92 119.74 123.80 3gf8 s LYS 130 Ca 0.71 2.11 -0.06 0.00 0.02 0.00 0.00 55.97 58.75 3gf8 s LYS 130 Cb -0.43 -3.12 -0.01 0.00 -0.52 0.00 0.00 37.83 33.75 3gf8 s LYS 130 CO 0.31 -0.14 0.12 -0.98 -0.92 0.00 0.00 175.35 173.74 3gf8 s ARG 131 N -1.31 0.68 0.77 1.68 3.03 -1.26 -5.01 118.95 117.53 3gf8 s ARG 131 Ca 0.50 -0.86 -0.06 0.00 2.03 0.00 0.00 55.73 57.35 3gf8 s ARG 131 Cb -0.38 0.27 0.13 0.00 -1.03 0.00 0.00 34.95 33.94 3gf8 s ARG 131 CO 0.47 -0.18 1.07 -1.21 -1.13 0.00 0.00 175.30 174.32 3gf8 s GLU 132 N -3.15 1.56 0.43 3.89 2.02 -1.26 -4.95 118.70 117.24 3gf8 s GLU 132 Ca -0.00 -0.76 0.16 0.00 0.02 0.00 0.00 54.97 54.39 3gf8 s GLU 132 Cb 0.02 -2.19 1.08 0.00 0.10 0.00 0.00 34.13 33.14 3gf8 s GLU 132 CO -0.07 -1.61 1.93 0.00 0.02 0.00 0.00 175.26 175.53 3gf8 h ALA 133 N -0.79 2.14 0.00 5.21 0.00 -2.02 -0.48 119.26 123.32 3gf8 h ALA 133 Ca -0.40 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3gf8 h ALA 133 Cb 1.27 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3gf8 h ALA 133 CO 0.44 -0.33 0.00 -1.13 0.00 0.00 0.00 179.25 178.23 3gf8 n SER 134 N -4.47 0.59 -1.54 0.00 3.41 -1.26 -4.89 113.62 105.46 3gf8 n SER 134 Ca 0.14 0.68 -0.20 0.00 -0.26 0.00 0.00 58.87 59.22 3gf8 n SER 134 Cb 0.53 -0.79 -0.09 0.00 -0.26 0.00 0.00 64.21 63.60 3gf8 n SER 134 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3gf8 n LEU 135 N -2.18 -1.44 -4.73 1.04 4.77 -0.19 -4.90 117.00 109.36 3gf8 n LEU 135 Ca 0.01 0.50 -0.36 0.00 -0.03 0.00 0.00 56.01 56.13 3gf8 n LEU 135 Cb 0.17 -2.81 -0.07 0.00 -2.33 0.00 0.00 43.42 38.38 3gf8 n LEU 135 CO 0.16 -1.07 -0.04 -0.63 -1.33 0.00 0.00 177.39 174.48 3gf8 s ILE 136 N -2.72 5.32 -0.19 -0.08 1.01 -1.26 -1.36 121.20 121.91 3gf8 s ILE 136 Ca 0.00 0.49 -0.01 0.00 0.00 0.00 0.00 60.65 61.12 3gf8 s ILE 136 Cb 0.00 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.87 3gf8 s ILE 136 CO 0.00 0.41 -0.12 -0.63 0.00 0.00 0.00 174.94 174.60 3gf8 s ILE 137 N 0.37 2.81 -0.05 2.92 -1.09 -0.17 -4.69 121.20 121.31 3gf8 s ILE 137 Ca 0.15 -0.69 0.15 0.00 -2.23 0.00 0.00 60.65 58.03 3gf8 s ILE 137 Cb -0.13 -2.23 0.29 0.00 -1.58 0.00 0.00 42.46 38.81 3gf8 s ILE 137 CO 0.03 0.48 1.13 -0.46 -1.23 0.00 0.00 174.94 174.89 3gf8 n ASN 138 N 4.58 0.96 -4.74 3.58 0.23 -1.26 -0.82 115.26 117.79 3gf8 n ASN 138 Ca -0.19 -2.41 -0.24 0.00 -0.53 0.00 0.00 54.58 51.21 3gf8 n ASN 138 Cb 0.51 -0.32 -0.06 0.00 -2.08 0.00 0.00 39.78 37.83 3gf8 n ASN 138 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 3gf8 s LYS 139 N -0.81 2.64 0.00 -3.83 -2.85 -1.26 -4.12 119.74 109.51 3gf8 s LYS 139 Ca 0.24 -1.13 0.00 0.00 -1.00 0.00 0.00 55.97 54.08 3gf8 s LYS 139 Cb 0.26 -2.43 0.00 0.00 -2.06 0.00 0.00 37.83 33.61 3gf8 s LYS 139 CO -0.08 0.42 0.00 -2.13 0.10 0.00 0.00 175.35 173.65 3gf8 n ARG 140 N -0.74 1.11 -4.01 1.78 0.63 -1.26 -4.79 116.66 109.39 3gf8 n ARG 140 Ca -0.08 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.49 3gf8 n ARG 140 Cb 0.57 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.41 3gf8 n ARG 140 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 3gf8 s GLU 142 N -0.16 3.44 0.24 -0.14 1.03 -1.26 -5.12 118.70 116.73 3gf8 s GLU 142 Ca 0.00 -0.23 -0.30 0.00 0.03 0.00 0.00 54.97 54.47 3gf8 s GLU 142 Cb 0.00 -3.11 -0.10 0.00 -0.80 0.00 0.00 34.13 30.12 3gf8 s GLU 142 CO 0.00 0.67 1.40 0.99 -1.33 0.00 0.00 175.26 176.99 3gf8 s THR 143 N -0.73 2.79 -0.14 1.83 2.01 -1.26 -4.93 115.64 115.21 3gf8 s THR 143 Ca 0.13 0.67 -0.00 0.00 0.31 0.00 0.00 61.69 62.79 3gf8 s THR 143 Cb -0.12 -3.43 -0.01 0.00 0.01 0.00 0.00 72.50 68.95 3gf8 s THR 143 CO 0.03 0.11 -0.13 -0.22 -0.69 0.00 0.00 174.62 173.72 3gf8 s LEU 144 N -0.37 2.72 0.03 4.42 2.96 -1.26 -4.30 118.68 122.88 3gf8 s LEU 144 Ca 0.58 -0.34 0.09 0.00 -0.22 0.00 0.00 54.13 54.24 3gf8 s LEU 144 Cb -0.40 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 3gf8 s LEU 144 CO 0.42 0.15 -0.26 0.26 -1.32 0.00 0.00 176.35 175.61 3gf8 s TRP 145 N 0.45 2.34 -0.17 5.38 0.51 0.23 -1.01 118.94 126.68 3gf8 s TRP 145 Ca -0.09 -0.41 -0.08 0.00 -2.12 0.00 0.00 56.10 53.40 3gf8 s TRP 145 Cb -0.16 -1.42 -0.04 0.00 -0.81 0.00 0.00 33.47 31.04 3gf8 s TRP 145 CO 0.05 0.09 0.10 -0.47 -0.51 0.00 0.00 176.95 176.21 3gf8 s TYR 146 N -0.77 3.38 -0.30 -1.98 5.04 0.34 -0.68 117.35 122.38 3gf8 s TYR 146 Ca 0.11 0.28 -0.09 0.00 -2.44 0.00 0.00 57.07 54.93 3gf8 s TYR 146 Cb -0.10 -2.05 -0.01 0.00 0.35 0.00 0.00 41.96 40.15 3gf8 s TYR 146 CO 0.01 0.36 0.13 0.20 -1.34 0.00 0.00 175.55 174.91 3gf8 s GLY 147 N -0.07 1.84 0.65 8.97 0.00 0.96 -0.63 107.32 119.04 3gf8 s GLY 147 Ca 0.08 -1.34 -0.17 0.00 0.00 0.00 0.00 44.72 43.30 3gf8 s GLY 147 CO 0.00 0.66 1.17 -0.54 0.00 0.00 0.00 173.10 174.39 3gf8 s GLU 148 N 1.60 2.72 0.13 2.90 2.02 -0.66 -2.17 118.70 125.24 3gf8 s GLU 148 Ca 0.05 1.68 -0.31 0.00 0.02 0.00 0.00 54.97 56.41 3gf8 s GLU 148 Cb -0.17 -1.91 -0.08 0.00 0.10 0.00 0.00 34.13 32.07 3gf8 s GLU 148 CO 0.05 -1.37 1.28 0.08 0.02 0.00 0.00 175.26 175.32 3gf8 s VAL 149 N -1.92 3.53 0.10 2.63 1.01 -1.26 -4.61 120.40 119.89 3gf8 s VAL 149 Ca 0.73 1.17 0.07 0.00 0.00 0.00 0.00 61.98 63.96 3gf8 s VAL 149 Cb -0.27 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 3gf8 s VAL 149 CO 0.38 0.13 -0.19 0.27 0.00 0.00 0.00 175.10 175.69 3gf8 s ILE 150 N 0.62 1.57 -0.08 2.22 -4.36 0.61 -4.96 121.20 116.83 3gf8 s ILE 150 Ca 0.59 -1.52 -0.18 0.00 -0.26 0.00 0.00 60.65 59.27 3gf8 s ILE 150 Cb -0.34 -1.47 -0.05 0.00 1.25 0.00 0.00 42.46 41.86 3gf8 s ILE 150 CO 0.33 -0.13 0.50 0.20 0.24 0.00 0.00 174.94 176.08 3gf8 s ASN 151 N -1.95 6.77 -0.11 4.36 0.01 -1.26 -1.28 114.94 121.47 3gf8 s ASN 151 Ca 0.05 0.91 0.02 0.00 -0.71 0.00 0.00 52.86 53.14 3gf8 s ASN 151 Cb -0.09 -2.30 0.01 0.00 0.41 0.00 0.00 41.25 39.28 3gf8 s ASN 151 CO 0.04 0.06 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.84 3gf8 s VAL 152 N 0.23 1.61 -0.24 1.60 1.01 0.96 -4.97 120.40 120.59 3gf8 s VAL 152 Ca 0.27 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.56 3gf8 s VAL 152 Cb -0.16 -1.46 0.05 0.00 0.00 0.00 0.00 36.38 34.81 3gf8 s VAL 152 CO 0.12 0.46 -0.12 0.21 0.00 0.00 0.00 175.10 175.77 3gf8 s ASN 153 N 0.94 4.15 -0.21 3.32 3.84 -1.26 -0.34 114.94 125.37 3gf8 s ASN 153 Ca -0.07 -1.17 0.02 0.00 0.21 0.00 0.00 52.86 51.84 3gf8 s ASN 153 Cb -0.15 -1.55 0.04 0.00 -0.55 0.00 0.00 41.25 39.04 3gf8 s ASN 153 CO -0.01 -0.14 -0.14 0.12 -2.79 0.00 0.00 177.10 174.13 3gf8 s PHE 154 N 1.17 2.84 -2.56 0.43 5.36 -0.11 -5.00 117.98 120.12 3gf8 s PHE 154 Ca -0.05 -1.86 0.21 0.00 -0.96 0.00 0.00 56.93 54.27 3gf8 s PHE 154 Cb -0.18 -1.84 0.24 0.00 -0.34 0.00 0.00 43.02 40.90 3gf8 s PHE 154 CO -0.07 -0.81 1.23 -0.40 -1.46 0.00 0.00 175.22 173.71 3gf8 n ASP 155 N 4.57 2.96 0.00 6.13 5.68 -1.26 0.07 116.55 134.70 3gf8 n ASP 155 Ca -0.17 -1.92 0.00 0.00 -0.50 0.00 0.00 54.79 52.21 3gf8 n ASP 155 Cb 0.46 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 3gf8 n ASP 155 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3gf8 n GLY 156 N 1.25 1.53 0.15 6.12 0.00 -1.26 -4.87 105.19 108.11 3gf8 n GLY 156 Ca 0.14 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.27 3gf8 n GLY 156 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3gf8 h THR 157 N 0.00 0.07 -3.89 2.61 1.35 -1.96 -3.37 112.91 107.71 3gf8 h THR 157 Ca 0.00 -1.12 -0.26 0.00 -0.55 0.00 0.00 66.41 64.48 3gf8 h THR 157 Cb 0.00 1.74 -0.18 0.00 -1.73 0.00 0.00 68.15 67.98 3gf8 h THR 157 CO 0.00 0.04 -0.72 0.68 -0.25 0.00 0.00 175.52 175.27 3gf8 s VAL 158 N -3.27 0.63 0.20 6.82 -7.23 -1.26 -4.97 120.40 111.32 3gf8 s VAL 158 Ca 0.02 -1.48 -0.30 0.00 -1.81 0.00 0.00 61.98 58.41 3gf8 s VAL 158 Cb 0.08 -1.12 -0.09 0.00 0.56 0.00 0.00 36.38 35.82 3gf8 s VAL 158 CO 0.75 -0.60 1.30 -1.00 -0.31 0.00 0.00 175.10 175.24 3gf8 s HIS 159 N -2.40 3.27 -0.00 2.82 3.76 -1.26 -4.45 115.29 117.02 3gf8 s HIS 159 Ca 0.00 1.24 0.00 0.00 -0.15 0.00 0.00 55.06 56.15 3gf8 s HIS 159 Cb -0.03 -3.59 0.00 0.00 1.11 0.00 0.00 32.58 30.07 3gf8 s HIS 159 CO -0.02 -1.83 -0.00 -1.14 -0.85 0.00 0.00 174.74 170.90 3gf8 s GLN 160 N -0.14 0.04 -0.14 1.40 0.74 -0.83 -4.99 119.66 115.75 3gf8 s GLN 160 Ca 0.56 -0.01 0.00 0.00 0.05 0.00 0.00 55.36 55.97 3gf8 s GLN 160 Cb -0.36 -0.05 0.02 0.00 1.10 0.00 0.00 33.01 33.71 3gf8 s GLN 160 CO 0.38 0.00 -0.14 0.99 -0.55 0.00 0.00 175.29 175.98 3gf8 s THR 161 N 0.05 1.50 0.34 -0.34 2.01 -1.26 -0.24 115.64 117.70 3gf8 s THR 161 Ca -0.00 -0.60 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 3gf8 s THR 161 Cb -0.01 -1.41 -0.04 0.00 0.01 0.00 0.00 72.50 71.05 3gf8 s THR 161 CO -0.00 0.45 0.57 -1.61 -0.69 0.00 0.00 174.62 173.34 3gf8 s GLU 162 N 1.43 3.53 -0.14 4.92 0.41 0.12 -4.90 118.70 124.07 3gf8 s GLU 162 Ca 0.03 -0.17 0.02 0.00 -0.41 0.00 0.00 54.97 54.43 3gf8 s GLU 162 Cb -0.13 -2.63 0.00 0.00 -1.78 0.00 0.00 34.13 29.59 3gf8 s GLU 162 CO -0.09 0.13 -0.19 0.99 -0.49 0.00 0.00 175.26 175.61 3gf8 s THR 163 N -2.29 2.33 -0.17 3.63 2.01 -1.26 0.47 115.64 120.36 3gf8 s THR 163 Ca 0.42 -0.89 -0.16 0.00 0.31 0.00 0.00 61.69 61.37 3gf8 s THR 163 Cb -0.10 -1.95 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 3gf8 s THR 163 CO 0.35 0.54 0.39 -0.63 -0.69 0.00 0.00 174.62 174.58 3gf8 s ILE 164 N 0.78 5.23 -0.22 1.82 -1.09 0.15 -4.96 121.20 122.90 3gf8 s ILE 164 Ca -0.07 0.73 -0.13 0.00 -2.23 0.00 0.00 60.65 58.94 3gf8 s ILE 164 Cb -0.16 -3.72 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 3gf8 s ILE 164 CO -0.00 0.31 0.29 0.21 -1.23 0.00 0.00 174.94 174.51 3gf8 s ASN 165 N 0.79 6.28 -0.14 3.58 2.47 -1.26 -0.76 114.94 125.90 3gf8 s ASN 165 Ca 0.20 0.32 -0.06 0.00 0.42 0.00 0.00 52.86 53.74 3gf8 s ASN 165 Cb -0.14 -2.17 -0.04 0.00 -1.45 0.00 0.00 41.25 37.44 3gf8 s ASN 165 CO 0.07 -0.02 0.06 -0.76 -3.72 0.00 0.00 177.10 172.73 3gf8 s LEU 166 N 1.26 3.89 -0.11 3.21 1.43 -0.39 -1.65 118.68 126.33 3gf8 s LEU 166 Ca 0.14 0.20 0.03 0.00 -1.03 0.00 0.00 54.13 53.47 3gf8 s LEU 166 Cb -0.14 -1.95 0.01 0.00 0.03 0.00 0.00 46.19 44.13 3gf8 s LEU 166 CO 0.07 0.29 -0.21 -0.63 0.23 0.00 0.00 176.35 176.10 3gf8 s ILE 167 N -0.35 1.89 0.02 -0.59 1.01 0.20 -4.37 121.20 119.01 3gf8 s ILE 167 Ca 0.09 -0.90 -0.30 0.00 0.00 0.00 0.00 60.65 59.54 3gf8 s ILE 167 Cb -0.12 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 3gf8 s ILE 167 CO 0.02 0.52 1.03 -0.60 0.00 0.00 0.00 174.94 175.90 3gf8 s ARG 168 N 0.59 4.54 -0.07 2.79 3.52 -1.26 -0.50 118.95 128.54 3gf8 s ARG 168 Ca -0.14 1.50 0.13 0.00 -0.13 0.00 0.00 55.73 57.10 3gf8 s ARG 168 Cb -0.17 -3.43 -0.20 0.00 -1.56 0.00 0.00 34.95 29.59 3gf8 s ARG 168 CO 0.04 -0.09 0.19 -0.25 -0.81 0.00 0.00 175.30 174.38 3gf8 n ASP 169 N 3.87 1.64 -4.85 -2.12 8.00 -0.18 -4.88 116.55 118.04 3gf8 n ASP 169 Ca 0.07 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.19 3gf8 n ASP 169 Cb 0.50 1.28 -0.06 0.00 -0.02 0.00 0.00 41.12 42.81 3gf8 n ASP 169 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3gf8 s THR 170 N -2.69 5.13 -0.09 -3.53 -4.23 -1.24 -1.96 115.64 107.04 3gf8 s THR 170 Ca -0.06 0.69 0.02 0.00 -1.18 0.00 0.00 61.69 61.16 3gf8 s THR 170 Cb 0.07 -3.64 0.02 0.00 1.34 0.00 0.00 72.50 70.28 3gf8 s THR 170 CO 0.59 0.58 -0.12 -0.54 -0.54 0.00 0.00 174.62 174.58 3gf8 s LYS 171 N -1.09 1.81 -0.14 3.99 -0.14 -0.10 -4.88 119.74 119.19 3gf8 s LYS 171 Ca 0.22 -0.42 -0.05 0.00 -1.36 0.00 0.00 55.97 54.36 3gf8 s LYS 171 Cb -0.16 -1.58 -0.04 0.00 -1.68 0.00 0.00 37.83 34.38 3gf8 s LYS 171 CO 0.11 -0.06 0.04 0.42 -0.76 0.00 0.00 175.35 175.11 3gf8 s ILE 172 N 0.97 4.66 -0.04 2.17 1.01 -0.01 -0.88 121.20 129.09 3gf8 s ILE 172 Ca -0.08 -0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.48 3gf8 s ILE 172 Cb -0.15 -3.04 0.02 0.00 0.01 0.00 0.00 42.46 39.30 3gf8 s ILE 172 CO -0.00 0.54 -0.04 0.68 0.00 0.00 0.00 174.94 176.12 3gf8 s VAL 173 N -0.30 0.49 -0.30 2.92 -7.23 -1.26 -1.47 120.40 113.25 3gf8 s VAL 173 Ca 0.08 -0.11 -0.08 0.00 -1.81 0.00 0.00 61.98 60.06 3gf8 s VAL 173 Cb -0.12 -0.51 -0.00 0.00 0.56 0.00 0.00 36.38 36.30 3gf8 s VAL 173 CO 0.02 0.21 0.11 -0.60 -0.31 0.00 0.00 175.10 174.52 3gf8 s ARG 174 N 0.82 3.27 -0.15 4.82 3.52 0.37 -4.46 118.95 127.15 3gf8 s ARG 174 Ca -0.11 -0.75 -0.05 0.00 -0.13 0.00 0.00 55.73 54.69 3gf8 s ARG 174 Cb -0.14 -3.45 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 3gf8 s ARG 174 CO 0.00 -0.40 0.04 -0.06 -0.81 0.00 0.00 175.30 174.07 3gf8 s PHE 175 N 1.56 3.24 0.07 5.12 0.08 -0.54 -0.93 117.98 126.58 3gf8 s PHE 175 Ca 0.04 0.11 0.09 0.00 0.12 0.00 0.00 56.93 57.29 3gf8 s PHE 175 Cb -0.17 -1.97 -0.03 0.00 -0.57 0.00 0.00 43.02 40.28 3gf8 s PHE 175 CO 0.04 0.28 -0.24 0.20 -0.10 0.00 0.00 175.22 175.40 3gf8 s GLY 176 N -0.12 1.50 -0.10 4.36 0.00 -0.23 -1.48 107.32 111.26 3gf8 s GLY 176 Ca 0.06 -1.30 -0.01 0.00 0.00 0.00 0.00 44.72 43.48 3gf8 s GLY 176 CO 0.01 -1.21 -0.05 -1.36 0.00 0.00 0.00 173.10 170.50 3gf8 s PHE 177 N -0.91 1.18 0.09 1.90 0.40 -1.26 -0.51 117.98 118.87 3gf8 s PHE 177 Ca 0.13 -0.53 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 3gf8 s PHE 177 Cb -0.10 -1.07 -0.04 0.00 0.51 0.00 0.00 43.02 42.32 3gf8 s PHE 177 CO 0.04 -0.44 -0.07 -0.65 0.70 0.00 0.00 175.22 174.80 3gf8 s GLN 178 N 1.80 0.79 0.18 0.44 -0.21 0.44 -4.84 119.66 118.25 3gf8 s GLN 178 Ca 0.05 -1.25 -0.32 0.00 0.02 0.00 0.00 55.36 53.87 3gf8 s GLN 178 Cb -0.12 -0.21 -0.10 0.00 1.00 0.00 0.00 33.01 33.57 3gf8 s GLN 178 CO -0.07 -0.01 1.58 0.45 -2.12 0.00 0.00 175.29 175.12 3gf8 s SER 179 N -2.82 6.56 0.13 5.90 0.15 -1.26 0.46 113.70 122.82 3gf8 s SER 179 Ca 0.08 2.66 -0.16 0.00 0.70 0.00 0.00 55.95 59.23 3gf8 s SER 179 Cb 0.03 -2.60 -0.01 0.00 -1.71 0.00 0.00 66.02 61.73 3gf8 s SER 179 CO -0.04 -0.84 1.64 0.22 1.20 0.00 0.00 173.24 175.42 3gf8 h TYR 180 N 6.67 0.63 -0.00 3.44 3.20 -0.85 -3.07 116.97 126.99 3gf8 h TYR 180 Ca -0.43 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.38 3gf8 h TYR 180 Cb 1.20 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.29 3gf8 h TYR 180 CO 0.64 0.60 -0.47 0.25 -1.64 0.00 0.00 178.16 177.54 3gf8 n THR 181 N -4.60 0.00 -1.72 1.81 -2.24 -1.26 -4.95 114.28 101.32 3gf8 n THR 181 Ca -0.01 -0.08 -0.17 0.00 -2.27 0.00 0.00 64.05 61.52 3gf8 n THR 181 Cb 0.18 0.54 -0.06 0.00 -2.10 0.00 0.00 70.33 68.89 3gf8 n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gf8 n GLY 182 N 1.43 1.14 0.61 3.38 0.00 -1.16 -4.85 105.19 105.74 3gf8 n GLY 182 Ca 0.08 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 46.03 3gf8 n GLY 182 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gf8 n SER 183 N -0.90 1.88 -3.60 1.61 3.41 -1.26 -4.81 113.62 109.96 3gf8 n SER 183 Ca -0.18 -1.66 -0.16 0.00 -0.26 0.00 0.00 58.87 56.61 3gf8 n SER 183 Cb 0.59 -0.04 -0.07 0.00 -0.26 0.00 0.00 64.21 64.43 3gf8 n SER 183 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 3gf8 s TRP 184 N -1.91 -0.48 -0.33 7.33 1.48 -1.26 -5.13 118.94 118.64 3gf8 s TRP 184 Ca 0.35 0.78 -0.13 0.00 -1.06 0.00 0.00 56.10 56.04 3gf8 s TRP 184 Cb 0.20 0.31 -0.02 0.00 -1.16 0.00 0.00 33.47 32.79 3gf8 s TRP 184 CO 0.31 -0.55 0.25 0.99 -4.06 0.00 0.00 176.95 173.89 3gf8 s THR 185 N -1.43 5.27 -0.12 0.66 2.01 -1.26 -4.50 115.64 116.27 3gf8 s THR 185 Ca -0.11 -0.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.52 3gf8 s THR 185 Cb -0.02 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 3gf8 s THR 185 CO 0.06 0.04 1.37 -0.22 -0.69 0.00 0.00 174.62 175.18 3gf8 s LEU 186 N 1.78 4.23 0.00 4.42 0.20 -1.26 -5.04 118.68 123.01 3gf8 s LEU 186 Ca 0.07 1.87 0.03 0.00 0.69 0.00 0.00 54.13 56.79 3gf8 s LEU 186 Cb -0.17 -3.54 0.03 0.00 -0.43 0.00 0.00 46.19 42.08 3gf8 s LEU 186 CO 0.11 -0.79 0.22 -0.67 -0.29 0.00 0.00 176.35 174.93 3gf8 n ASP 187 N 6.57 0.78 0.00 3.68 -0.08 -1.26 -4.93 116.55 121.31 3gf8 n ASP 187 Ca 0.15 -1.47 0.00 0.00 -1.51 0.00 0.00 54.79 51.95 3gf8 n ASP 187 Cb 0.44 -0.11 0.00 0.00 2.34 0.00 0.00 41.12 43.80 3gf8 n ASP 187 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 3gf8 n ASN 189 N -2.66 0.00 0.14 1.67 6.94 -1.26 -4.54 115.26 115.55 3gf8 n ASN 189 Ca 0.04 0.00 0.13 0.00 -0.02 0.00 0.00 54.58 54.73 3gf8 n ASN 189 Cb 0.18 0.00 0.48 0.00 -2.36 0.00 0.00 39.78 38.07 3gf8 n ASN 189 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 3gf8 h ASP 190 N 0.00 0.00 -3.44 0.53 3.32 -1.99 -3.47 116.42 111.36 3gf8 h ASP 190 Ca 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 3gf8 h ASP 190 Cb 0.00 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.38 3gf8 h ASP 190 CO 0.00 0.00 -0.78 -0.31 -1.72 0.00 0.00 179.24 176.43 3gf8 s TYR 191 N -3.29 1.86 0.22 4.55 2.02 -1.26 -0.13 117.35 121.33 3gf8 s TYR 191 Ca 0.06 -0.46 -0.01 0.00 -0.37 0.00 0.00 57.07 56.28 3gf8 s TYR 191 Cb 0.10 -0.92 -0.04 0.00 -0.40 0.00 0.00 41.96 40.70 3gf8 s TYR 191 CO 0.47 0.36 0.42 -0.51 -1.57 0.00 0.00 175.55 174.72 3gf8 s ASP 192 N -2.75 6.39 -0.05 2.29 1.01 0.55 -4.85 116.67 119.24 3gf8 s ASP 192 Ca 0.17 0.43 0.02 0.00 0.71 0.00 0.00 52.55 53.88 3gf8 s ASP 192 Cb -0.05 -2.02 0.02 0.00 1.01 0.00 0.00 42.92 41.87 3gf8 s ASP 192 CO 0.07 -0.07 -0.09 -0.31 0.21 0.00 0.00 175.17 174.98 3gf8 s TYR 193 N -1.92 1.13 0.01 4.23 1.51 -1.26 -1.04 117.35 120.01 3gf8 s TYR 193 Ca 0.39 -0.38 0.01 0.00 -1.01 0.00 0.00 57.07 56.08 3gf8 s TYR 193 Cb -0.11 -0.88 -0.01 0.00 -0.11 0.00 0.00 41.96 40.86 3gf8 s TYR 193 CO 0.29 -0.23 -0.04 -1.21 -1.11 0.00 0.00 175.55 173.26 3gf8 s GLU 194 N 0.75 0.29 -0.18 -0.62 2.02 -0.32 -4.13 118.70 116.50 3gf8 s GLU 194 Ca -0.13 -0.28 -0.04 0.00 0.02 0.00 0.00 54.97 54.53 3gf8 s GLU 194 Cb -0.15 -0.19 -0.02 0.00 0.10 0.00 0.00 34.13 33.87 3gf8 s GLU 194 CO 0.02 0.04 -0.02 0.42 0.02 0.00 0.00 175.26 175.74 3gf8 s ILE 195 N -0.48 3.85 -0.19 -1.63 1.01 0.49 -0.88 121.20 123.37 3gf8 s ILE 195 Ca -0.03 -0.36 -0.00 0.00 0.00 0.00 0.00 60.65 60.26 3gf8 s ILE 195 Cb -0.04 -2.72 0.02 0.00 0.01 0.00 0.00 42.46 39.73 3gf8 s ILE 195 CO -0.00 0.46 -0.16 -0.63 0.00 0.00 0.00 174.94 174.61 3gf8 s ILE 196 N 0.74 2.38 -0.04 2.92 1.01 -0.44 0.34 121.20 128.12 3gf8 s ILE 196 Ca -0.01 -0.87 -0.29 0.00 0.00 0.00 0.00 60.65 59.48 3gf8 s ILE 196 Cb -0.14 -2.05 0.10 0.00 0.01 0.00 0.00 42.46 40.38 3gf8 s ILE 196 CO 0.02 0.48 0.85 -0.70 0.00 0.00 0.00 174.94 175.59 3gf8 s GLU 197 N 1.33 0.85 -0.78 2.79 2.56 -0.74 -2.69 118.70 122.02 3gf8 s GLU 197 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.97 54.93 3gf8 s GLU 197 Cb -0.14 0.40 0.36 0.00 2.00 0.00 0.00 34.13 36.75 3gf8 s GLU 197 CO -0.10 -0.33 1.68 -1.13 -0.56 0.00 0.00 175.26 174.82 3gf8 n SER 198 N 0.23 6.59 -1.76 -1.70 3.41 -1.26 -0.66 113.62 118.47 3gf8 n SER 198 Ca -0.12 -3.77 0.00 0.00 -0.26 0.00 0.00 58.87 54.73 3gf8 n SER 198 Cb 0.60 -0.91 0.33 0.00 -0.26 0.00 0.00 64.21 63.97 3gf8 n SER 198 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3gf8 n ASN 199 N -0.39 4.87 -1.05 4.04 6.94 -1.26 -4.62 115.26 123.79 3gf8 n ASN 199 Ca 0.47 -3.13 0.09 0.00 -0.02 0.00 0.00 54.58 51.98 3gf8 n ASN 199 Cb 0.34 -0.69 0.25 0.00 -2.36 0.00 0.00 39.78 37.32 3gf8 n ASN 199 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3gf8 n GLY 200 N -0.02 1.66 2.70 4.83 0.00 -1.26 -4.38 105.19 108.71 3gf8 n GLY 200 Ca 0.34 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.46 3gf8 n GLY 200 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3gf8 s HIS 201 N -1.29 1.05 -0.15 1.61 2.46 -1.26 -0.60 115.29 117.11 3gf8 s HIS 201 Ca 0.38 -1.05 -0.04 0.00 0.47 0.00 0.00 55.06 54.81 3gf8 s HIS 201 Cb 0.20 -1.16 -0.03 0.00 -0.13 0.00 0.00 32.58 31.46 3gf8 s HIS 201 CO 0.25 -0.71 -0.01 -0.51 -2.47 0.00 0.00 174.74 171.29 3gf8 s LEU 202 N 1.85 3.41 0.91 8.88 1.43 0.40 0.54 118.68 136.09 3gf8 s LEU 202 Ca 0.03 -0.04 -0.14 0.00 -1.03 0.00 0.00 54.13 52.95 3gf8 s LEU 202 Cb -0.17 -1.82 0.15 0.00 0.03 0.00 0.00 46.19 44.39 3gf8 s LEU 202 CO -0.17 0.21 1.27 -0.83 0.23 0.00 0.00 176.35 177.06 3gf8 s GLY 203 N 0.11 1.71 0.65 -3.19 0.00 0.01 -1.28 107.32 105.32 3gf8 s GLY 203 Ca 0.01 -0.98 0.43 0.00 0.00 0.00 0.00 44.72 44.17 3gf8 s GLY 203 CO 0.02 -0.32 2.32 1.12 0.00 0.00 0.00 173.10 176.24 3gf8 h HIS 204 N -1.43 0.00 -0.56 1.90 2.07 -1.73 0.30 115.15 115.70 3gf8 h HIS 204 Ca -0.45 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.07 3gf8 h HIS 204 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 3gf8 h HIS 204 CO -0.59 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 173.87 3gf8 n ASP 205 N -3.09 3.15 -0.07 3.10 5.75 -1.26 -4.85 116.55 119.28 3gf8 n ASP 205 Ca -0.02 -1.98 -0.01 0.00 -0.01 0.00 0.00 54.79 52.76 3gf8 n ASP 205 Cb 0.10 -0.37 -0.00 0.00 -1.03 0.00 0.00 41.12 39.82 3gf8 n ASP 205 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3gf8 n ASN 206 N 1.23 -3.84 -4.87 -1.12 5.15 0.09 -5.02 115.26 106.88 3gf8 n ASN 206 Ca 0.20 0.02 -0.31 0.00 -0.60 0.00 0.00 54.58 53.89 3gf8 n ASN 206 Cb 0.51 -1.42 -0.04 0.00 -0.53 0.00 0.00 39.78 38.30 3gf8 n ASN 206 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3gf8 s SER 207 N -2.14 6.57 -0.28 1.20 1.04 -1.26 -4.73 113.70 114.10 3gf8 s SER 207 Ca 0.00 1.14 -0.29 0.00 0.48 0.00 0.00 55.95 57.28 3gf8 s SER 207 Cb 0.00 -2.32 -0.00 0.00 0.10 0.00 0.00 66.02 63.79 3gf8 s SER 207 CO 0.00 -0.35 1.35 -0.76 0.98 0.00 0.00 173.24 174.46 3gf8 s LEU 208 N -3.66 3.90 0.75 2.42 1.02 -1.26 -0.81 118.68 121.04 3gf8 s LEU 208 Ca 0.51 1.30 -0.12 0.00 0.02 0.00 0.00 54.13 55.85 3gf8 s LEU 208 Cb -0.10 -3.54 0.04 0.00 0.02 0.00 0.00 46.19 42.61 3gf8 s LEU 208 CO 0.29 -1.09 1.11 -0.76 0.02 0.00 0.00 176.35 175.92 3gf8 s LEU 209 N 4.44 2.73 0.37 1.79 1.43 0.19 -4.94 118.68 124.69 3gf8 s LEU 209 Ca 0.58 1.11 -0.27 0.00 -1.03 0.00 0.00 54.13 54.52 3gf8 s LEU 209 Cb -0.18 -3.80 -0.10 0.00 0.03 0.00 0.00 46.19 42.14 3gf8 s LEU 209 CO 0.23 -1.63 1.36 -1.81 0.23 0.00 0.00 176.35 174.73 3gf8 s ASP 210 N -4.27 6.46 0.15 2.29 1.11 -1.26 -4.64 116.67 116.51 3gf8 s ASP 210 Ca 0.60 2.79 -0.25 0.00 0.18 0.00 0.00 52.55 55.87 3gf8 s ASP 210 Cb -0.12 -2.65 0.06 0.00 1.07 0.00 0.00 42.92 41.28 3gf8 s ASP 210 CO 0.52 -0.76 0.86 -0.62 1.18 0.00 0.00 175.17 176.35 3gf8 s ASP 211 N -0.47 -0.27 0.74 0.27 2.15 -1.26 -4.90 116.67 112.92 3gf8 s ASP 211 Ca 0.53 -0.32 -0.14 0.00 0.43 0.00 0.00 52.55 53.05 3gf8 s ASP 211 Cb -0.41 0.53 0.05 0.00 -0.30 0.00 0.00 42.92 42.78 3gf8 s ASP 211 CO 0.55 -0.95 1.16 -1.81 -0.17 0.00 0.00 175.17 173.95 3gf8 s ASP 212 N -2.83 4.31 -0.01 -0.34 1.01 -1.26 -4.92 116.67 112.64 3gf8 s ASP 212 Ca 0.09 2.16 -0.30 0.00 0.71 0.00 0.00 52.55 55.22 3gf8 s ASP 212 Cb -0.02 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 3gf8 s ASP 212 CO -0.01 -2.17 1.12 -0.69 0.21 0.00 0.00 175.17 173.63 3gf8 s VAL 213 N -2.30 4.40 0.07 -1.27 1.01 -1.26 -4.37 120.40 116.68 3gf8 s VAL 213 Ca 0.69 1.72 0.02 0.00 0.00 0.00 0.00 61.98 64.42 3gf8 s VAL 213 Cb -0.24 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 3gf8 s VAL 213 CO 0.47 0.08 0.09 -0.76 0.00 0.00 0.00 175.10 174.98 3gf8 s LEU 214 N 1.50 3.86 -0.45 3.92 1.43 0.17 -4.92 118.68 124.18 3gf8 s LEU 214 Ca 0.55 0.04 -0.10 0.00 -1.03 0.00 0.00 54.13 53.59 3gf8 s LEU 214 Cb -0.25 -2.49 0.10 0.00 0.03 0.00 0.00 46.19 43.58 3gf8 s LEU 214 CO 0.25 0.19 0.31 -0.55 0.23 0.00 0.00 176.35 176.78 3gf8 s SER 215 N -2.30 5.72 -0.08 2.29 0.15 -0.47 -1.80 113.70 117.22 3gf8 s SER 215 Ca 0.29 -1.65 -0.23 0.00 0.70 0.00 0.00 55.95 55.05 3gf8 s SER 215 Cb -0.12 -2.02 -0.04 0.00 -1.71 0.00 0.00 66.02 62.13 3gf8 s SER 215 CO 0.21 -0.62 0.68 -0.36 1.20 0.00 0.00 173.24 174.36 3gf8 s PHE 216 N 1.42 3.55 0.23 3.44 0.40 0.15 -1.00 117.98 126.19 3gf8 s PHE 216 Ca 0.04 1.20 0.05 0.00 -0.60 0.00 0.00 56.93 57.63 3gf8 s PHE 216 Cb -0.25 -2.79 -0.05 0.00 0.51 0.00 0.00 43.02 40.44 3gf8 s PHE 216 CO 0.01 0.07 -0.06 1.03 0.70 0.00 0.00 175.22 176.97 3gf8 s ARG 217 N 0.91 1.36 0.30 0.44 0.52 -0.00 -0.38 118.95 122.09 3gf8 s ARG 217 Ca 0.36 -1.66 -0.29 0.00 -0.52 0.00 0.00 55.73 53.62 3gf8 s ARG 217 Cb -0.17 -0.87 -0.13 0.00 0.52 0.00 0.00 34.95 34.30 3gf8 s ARG 217 CO 0.17 0.02 1.36 -2.30 0.02 0.00 0.00 175.30 174.57 3gf8 n PRO 218 N -0.43 2.16 0.01 3.54 -0.02 -1.26 -4.41 135.00 134.60 3gf8 n PRO 218 Ca -0.06 0.76 0.11 0.00 -2.02 0.00 0.00 63.50 62.29 3gf8 n PRO 218 Cb 0.63 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 3gf8 n PRO 218 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 3gf8 n TYR 219 N 1.03 0.14 -3.98 6.00 0.18 -0.34 -4.82 117.16 115.37 3gf8 n TYR 219 Ca 0.07 0.04 -0.12 0.00 1.88 0.00 0.00 57.90 59.78 3gf8 n TYR 219 Cb 0.35 -0.31 -0.02 0.00 -0.38 0.00 0.00 39.34 38.98 3gf8 n TYR 219 CO 0.00 0.00 0.00 -0.47 -2.08 0.00 0.00 176.86 174.31 3gf8 s TYR 220 N -3.15 0.59 0.00 -3.48 5.04 -1.12 -4.95 117.35 110.29 3gf8 s TYR 220 Ca 0.05 -0.99 0.00 0.00 -2.44 0.00 0.00 57.07 53.69 3gf8 s TYR 220 Cb 0.15 0.27 0.00 0.00 0.35 0.00 0.00 41.96 42.73 3gf8 s TYR 220 CO 0.81 -1.24 0.00 -1.91 -1.34 0.00 0.00 175.55 171.88 3gf8 n GLU 222 N -0.51 0.00 -1.15 4.97 2.13 -0.27 -0.22 120.64 125.58 3gf8 n GLU 222 Ca -0.02 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.78 3gf8 n GLU 222 Cb 0.61 0.00 0.13 0.00 0.27 0.00 0.00 31.44 32.45 3gf8 n GLU 222 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 3gf8 n GLN 223 N 0.00 1.85 0.00 5.31 7.27 -1.26 -0.53 117.38 130.02 3gf8 n GLN 223 Ca 0.00 -3.34 0.00 0.00 0.07 0.00 0.00 57.00 53.73 3gf8 n GLN 223 Cb 0.00 -1.56 0.00 0.00 2.41 0.00 0.00 30.24 31.09 3gf8 n GLN 223 CO 0.00 0.00 0.00 0.36 0.07 0.00 0.00 177.06 177.49 3gf8 n LYS 224 N -0.79 0.00 -3.39 3.69 2.85 -1.26 -3.73 118.16 115.53 3gf8 n LYS 224 Ca 0.22 0.82 -0.39 0.00 -1.05 0.00 0.00 58.31 57.91 3gf8 n LYS 224 Cb 0.82 -1.37 -0.09 0.00 -0.65 0.00 0.00 35.03 33.75 3gf8 n LYS 224 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 3gf8 s ASP 225 N -2.90 6.30 0.62 -5.58 3.84 -1.26 -4.96 116.67 112.74 3gf8 s ASP 225 Ca 0.00 0.35 0.23 0.00 -0.00 0.00 0.00 52.55 53.13 3gf8 s ASP 225 Cb 0.00 -2.22 1.04 0.00 -1.38 0.00 0.00 42.92 40.36 3gf8 s ASP 225 CO 0.00 -0.16 1.53 -0.65 -0.00 0.00 0.00 175.17 175.89 3gf8 h PRO 226 N 7.95 0.00 0.20 2.11 0.11 -1.96 1.15 132.00 141.56 3gf8 h PRO 226 Ca -0.33 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.49 3gf8 h PRO 226 Cb 1.16 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.30 3gf8 h PRO 226 CO 0.67 0.00 -1.36 0.00 -0.21 0.00 0.00 178.00 177.09 3gf8 h ALA 227 N 0.84 -0.05 -0.76 -0.75 0.00 -1.92 -3.33 119.26 113.28 3gf8 h ALA 227 Ca 0.23 -0.90 0.02 0.00 0.00 0.00 0.00 54.91 54.27 3gf8 h ALA 227 Cb 1.84 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 19.83 3gf8 h ALA 227 CO -0.00 0.69 0.50 0.00 0.00 0.00 0.00 179.25 180.44 3gf8 h THR 228 N -0.04 1.15 -1.25 0.00 1.03 -0.28 -3.48 112.91 110.04 3gf8 h THR 228 Ca -0.25 -0.33 -0.68 0.00 -0.01 0.00 0.00 66.41 65.13 3gf8 h THR 228 Cb 1.99 0.09 0.10 0.00 -1.07 0.00 0.00 68.15 69.25 3gf8 h THR 228 CO 0.21 0.18 -0.28 0.00 -0.01 0.00 0.00 175.52 175.61 3gf8 n ALA 229 N -2.42 -2.52 -3.67 0.00 0.00 0.34 -4.93 120.51 107.31 3gf8 n ALA 229 Ca 0.09 0.46 -0.09 0.00 0.00 0.00 0.00 53.44 53.91 3gf8 n ALA 229 Cb 0.09 -1.72 -0.02 0.00 0.00 0.00 0.00 19.45 17.80 3gf8 n ALA 229 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3gf8 s TYR 230 N -0.76 -0.32 -0.03 0.00 -0.85 0.31 -4.59 117.35 111.11 3gf8 s TYR 230 Ca 0.69 -0.02 0.07 0.00 -0.52 0.00 0.00 57.07 57.29 3gf8 s TYR 230 Cb -0.95 0.64 -0.02 0.00 0.38 0.00 0.00 41.96 42.01 3gf8 s TYR 230 CO 0.56 -1.03 -0.24 0.14 -1.52 0.00 0.00 175.55 173.46 3gf8 s VAL 231 N -3.77 2.21 0.23 -3.49 -7.23 -0.55 -1.12 120.40 106.69 3gf8 s VAL 231 Ca 0.07 -1.05 0.06 0.00 -1.81 0.00 0.00 61.98 59.26 3gf8 s VAL 231 Cb -0.04 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 35.09 3gf8 s VAL 231 CO -0.02 0.58 0.19 -1.81 -0.31 0.00 0.00 175.10 173.74 3gf8 s ASP 232 N -0.60 5.57 0.09 4.85 1.01 0.69 -1.47 116.67 126.81 3gf8 s ASP 232 Ca 0.09 -0.20 -0.26 0.00 0.71 0.00 0.00 52.55 52.89 3gf8 s ASP 232 Cb -0.10 -1.44 0.07 0.00 1.01 0.00 0.00 42.92 42.46 3gf8 s ASP 232 CO -0.01 -0.02 0.63 0.54 0.21 0.00 0.00 175.17 176.53 3gf8 s ASN 234 N -3.68 -0.60 0.00 0.27 6.03 -1.26 -1.20 114.94 114.50 3gf8 s ASN 234 Ca 0.32 0.24 0.00 0.00 -1.03 0.00 0.00 52.86 52.40 3gf8 s ASN 234 Cb -0.08 0.58 0.00 0.00 -3.03 0.00 0.00 41.25 38.71 3gf8 s ASN 234 CO 0.25 -0.85 0.00 1.07 -2.03 0.00 0.00 177.10 175.54 3gf8 n THR 235 N 0.05 0.00 -2.09 0.54 5.66 -0.06 -4.81 114.28 113.57 3gf8 n THR 235 Ca -0.18 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.41 3gf8 n THR 235 Cb 0.62 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.38 3gf8 n THR 235 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 3gf8 s ARG 237 N 4.41 4.32 0.53 1.09 0.52 -0.83 -0.93 118.95 128.07 3gf8 s ARG 237 Ca 0.00 2.21 -0.01 0.00 -0.52 0.00 0.00 55.73 57.41 3gf8 s ARG 237 Cb 0.00 -3.12 0.02 0.00 0.52 0.00 0.00 34.95 32.36 3gf8 s ARG 237 CO 0.00 -0.32 0.78 -0.51 0.02 0.00 0.00 175.30 175.27 3gf8 s LEU 238 N -0.65 3.37 -0.01 2.53 1.43 -1.26 -4.93 118.68 119.17 3gf8 s LEU 238 Ca 0.56 0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.94 3gf8 s LEU 238 Cb -0.40 -3.11 -0.02 0.00 0.03 0.00 0.00 46.19 42.69 3gf8 s LEU 238 CO 0.44 -1.00 0.02 -1.84 0.23 0.00 0.00 176.35 174.20 3gf8 n GLU 240 N -2.33 2.24 -0.39 1.70 0.28 -1.26 -4.70 120.64 116.18 3gf8 n GLU 240 Ca 0.05 -0.01 0.08 0.00 -0.16 0.00 0.00 57.16 57.12 3gf8 n GLU 240 Cb 0.59 -1.04 0.26 0.00 1.43 0.00 0.00 31.44 32.68 3gf8 n GLU 240 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 3gf8 n ASP 241 N -1.85 3.38 -4.88 -1.84 5.75 -1.26 -4.92 116.55 110.94 3gf8 n ASP 241 Ca -0.01 -2.19 -0.21 0.00 -0.01 0.00 0.00 54.79 52.37 3gf8 n ASP 241 Cb 0.34 -0.44 -0.03 0.00 -1.03 0.00 0.00 41.12 39.96 3gf8 n ASP 241 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3gf8 s ARG 242 N -1.55 2.67 -0.33 0.11 1.81 -1.26 -5.06 118.95 115.35 3gf8 s ARG 242 Ca 0.38 -1.37 0.07 0.00 -1.72 0.00 0.00 55.73 53.09 3gf8 s ARG 242 Cb 0.22 -2.47 0.45 0.00 -0.45 0.00 0.00 34.95 32.70 3gf8 s ARG 242 CO 0.21 -0.04 1.16 1.63 -0.68 0.00 0.00 175.30 177.59 3gf8 n LYS 243 N -1.48 3.47 -1.61 3.54 5.02 -1.26 -4.75 118.16 121.09 3gf8 n LYS 243 Ca 0.01 -4.22 -0.54 0.00 -2.02 0.00 0.00 58.31 51.54 3gf8 n LYS 243 Cb 0.60 -2.23 -0.06 0.00 -0.02 0.00 0.00 35.03 33.31 3gf8 n LYS 243 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3gf8 n THR 244 N -0.64 0.07 -4.07 -0.18 -1.04 -1.26 -4.71 114.28 102.45 3gf8 n THR 244 Ca 0.41 -0.01 -0.35 0.00 -2.04 0.00 0.00 64.05 62.06 3gf8 n THR 244 Cb 0.88 -0.84 -0.07 0.00 -1.82 0.00 0.00 70.33 68.49 3gf8 n THR 244 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3gf8 s ARG 245 N 1.19 3.22 -0.23 -2.82 0.52 -1.10 -0.32 118.95 119.42 3gf8 s ARG 245 Ca 0.89 -0.31 -0.07 0.00 -0.52 0.00 0.00 55.73 55.72 3gf8 s ARG 245 Cb -1.02 -2.99 -0.03 0.00 0.52 0.00 0.00 34.95 31.43 3gf8 s ARG 245 CO 0.53 0.71 0.05 -1.17 0.02 0.00 0.00 175.30 175.44 3gf8 s LEU 246 N -1.27 3.41 -0.09 2.53 2.96 -0.40 -1.33 118.68 124.47 3gf8 s LEU 246 Ca 0.18 -0.19 0.01 0.00 -0.22 0.00 0.00 54.13 53.91 3gf8 s LEU 246 Cb -0.12 -1.90 0.02 0.00 0.50 0.00 0.00 46.19 44.69 3gf8 s LEU 246 CO 0.08 0.01 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.31 3gf8 s VAL 247 N 1.35 1.18 -0.11 1.68 1.01 -0.05 -1.38 120.40 124.08 3gf8 s VAL 247 Ca 0.05 -0.45 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 3gf8 s VAL 247 Cb -0.15 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 3gf8 s VAL 247 CO 0.03 0.38 -0.01 -0.76 0.00 0.00 0.00 175.10 174.73 3gf8 s LEU 248 N 1.10 3.46 -0.05 3.92 1.02 -0.08 -1.18 118.68 126.87 3gf8 s LEU 248 Ca -0.06 0.04 0.03 0.00 0.02 0.00 0.00 54.13 54.16 3gf8 s LEU 248 Cb -0.14 -1.80 0.01 0.00 0.02 0.00 0.00 46.19 44.27 3gf8 s LEU 248 CO -0.02 0.30 -0.12 -0.89 0.02 0.00 0.00 176.35 175.65 3gf8 s THR 249 N -0.44 1.07 -0.01 5.49 2.01 -0.21 -0.99 115.64 122.57 3gf8 s THR 249 Ca 0.08 -0.47 -0.30 0.00 0.31 0.00 0.00 61.69 61.30 3gf8 s THR 249 Cb -0.12 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.37 3gf8 s THR 249 CO 0.02 0.33 1.27 -0.70 -0.69 0.00 0.00 174.62 174.86 3gf8 s GLU 250 N 0.47 4.34 0.10 4.92 2.12 0.92 -0.33 118.70 131.23 3gf8 s GLU 250 Ca -0.10 1.80 -0.26 0.00 0.36 0.00 0.00 54.97 56.78 3gf8 s GLU 250 Cb -0.13 -3.51 -0.12 0.00 0.26 0.00 0.00 34.13 30.62 3gf8 s GLU 250 CO 0.03 -0.45 1.68 0.87 -0.54 0.00 0.00 175.26 176.85 3gf8 h LYS 251 N 7.44 -0.31 0.02 4.30 1.57 -0.86 0.41 116.57 129.15 3gf8 h LYS 251 Ca -0.37 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.44 3gf8 h LYS 251 Cb 1.18 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 3gf8 h LYS 251 CO 0.87 -0.21 -0.23 0.00 -0.57 0.00 0.00 179.45 179.31 3gf8 h ALA 252 N 0.50 -0.72 0.00 3.86 0.00 -1.92 -3.14 119.26 117.84 3gf8 h ALA 252 Ca 0.00 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 3gf8 h ALA 252 Cb 0.30 0.68 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3gf8 h ALA 252 CO -0.03 -0.79 -0.72 0.66 0.00 0.00 0.00 179.25 178.38 3gf8 h SER 253 N -0.31 0.00 -0.08 0.00 4.64 -1.95 -3.47 113.55 112.38 3gf8 h SER 253 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3gf8 h SER 253 Cb 0.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 3gf8 h SER 253 CO -0.14 0.57 -0.03 0.61 -0.87 0.00 0.00 176.83 176.96 3gf8 n GLY 254 N 1.27 0.46 3.76 -0.77 0.00 0.14 -5.02 105.19 105.03 3gf8 n GLY 254 Ca -0.00 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 3gf8 n GLY 254 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gf8 s LYS 255 N -1.11 4.67 -0.12 1.61 2.36 -1.25 -4.72 119.74 121.19 3gf8 s LYS 255 Ca 0.00 1.29 -0.30 0.00 -2.55 0.00 0.00 55.97 54.42 3gf8 s LYS 255 Cb 0.00 -3.29 -0.02 0.00 -1.05 0.00 0.00 37.83 33.46 3gf8 s LYS 255 CO 0.00 0.48 1.25 1.03 1.55 0.00 0.00 175.35 179.66 3gf8 s ARG 256 N -0.90 4.28 -0.00 4.03 0.52 -1.26 -0.06 118.95 125.56 3gf8 s ARG 256 Ca 0.39 1.69 0.14 0.00 -0.52 0.00 0.00 55.73 57.42 3gf8 s ARG 256 Cb -0.24 -3.68 -0.16 0.00 0.52 0.00 0.00 34.95 31.39 3gf8 s ARG 256 CO 0.28 -0.61 0.55 1.33 0.02 0.00 0.00 175.30 176.88 3gf8 n VAL 257 N 5.06 0.00 -3.66 3.52 0.24 -0.16 -4.95 118.33 118.37 3gf8 n VAL 257 Ca 0.13 -0.19 -0.08 0.00 -2.04 0.00 0.00 64.34 62.15 3gf8 n VAL 257 Cb 0.45 0.92 -0.08 0.00 -1.47 0.00 0.00 33.84 33.66 3gf8 n VAL 257 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3gf8 s PHE 258 N -2.36 -0.89 -0.36 6.34 5.36 -1.19 -4.79 117.98 120.10 3gf8 s PHE 258 Ca 0.04 1.80 0.05 0.00 -0.96 0.00 0.00 56.93 57.87 3gf8 s PHE 258 Cb 0.10 0.49 0.17 0.00 -0.34 0.00 0.00 43.02 43.45 3gf8 s PHE 258 CO 0.56 -0.46 0.50 0.34 -1.46 0.00 0.00 175.22 174.71 3gf8 s ASP 259 N 1.57 -0.36 0.30 6.13 -1.08 -1.25 -0.90 116.67 121.08 3gf8 s ASP 259 Ca -0.10 -0.81 0.09 0.00 -0.52 0.00 0.00 52.55 51.21 3gf8 s ASP 259 Cb -0.06 1.39 -0.06 0.00 -1.46 0.00 0.00 42.92 42.72 3gf8 s ASP 259 CO -0.17 -0.25 -0.10 0.27 0.52 0.00 0.00 175.17 175.44 3gf8 s ILE 260 N 2.00 2.00 -0.55 4.11 -5.25 -0.48 -4.96 121.20 118.06 3gf8 s ILE 260 Ca 0.14 -2.20 -0.18 0.00 -0.99 0.00 0.00 60.65 57.43 3gf8 s ILE 260 Cb -0.10 -2.49 0.10 0.00 2.95 0.00 0.00 42.46 42.92 3gf8 s ILE 260 CO -0.13 -0.29 0.61 0.21 -1.79 0.00 0.00 174.94 173.54 3gf8 s ASN 261 N -3.51 6.19 0.24 4.36 3.84 -1.26 -1.28 114.94 123.52 3gf8 s ASN 261 Ca 0.30 -1.43 -0.05 0.00 0.21 0.00 0.00 52.86 51.90 3gf8 s ASN 261 Cb 0.02 -2.26 0.26 0.00 -0.55 0.00 0.00 41.25 38.71 3gf8 s ASN 261 CO 0.14 -0.96 1.82 0.25 -2.79 0.00 0.00 177.10 175.55 3gf8 h LEU 262 N 9.52 1.01 -0.70 3.21 5.85 -0.95 -0.76 115.31 132.49 3gf8 h LEU 262 Ca -0.29 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.28 3gf8 h LEU 262 Cb 1.09 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 3gf8 h LEU 262 CO 1.04 0.89 0.43 0.40 -0.34 0.00 0.00 178.44 180.85 3gf8 h ILE 263 N 1.08 1.20 -0.65 4.05 1.08 -1.85 -0.43 117.51 121.99 3gf8 h ILE 263 Ca 0.25 -0.44 -0.07 0.00 -0.39 0.00 0.00 64.86 64.21 3gf8 h ILE 263 Cb 0.19 0.22 -0.03 0.00 -3.07 0.00 0.00 36.82 34.13 3gf8 h ILE 263 CO -0.02 0.21 0.12 -0.78 -0.69 0.00 0.00 178.15 176.99 3gf8 h ASP 264 N 0.96 1.01 -0.69 1.72 3.58 -1.72 0.28 116.42 121.57 3gf8 h ASP 264 Ca 0.25 -0.25 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 3gf8 h ASP 264 Cb -0.04 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 40.71 3gf8 h ASP 264 CO -0.05 1.01 0.30 1.88 -2.88 0.00 0.00 179.24 179.50 3gf8 h TYR 265 N 0.98 1.04 -0.07 0.28 -1.99 -0.85 -2.81 116.97 113.55 3gf8 h TYR 265 Ca 0.20 -0.06 -0.20 0.00 2.00 0.00 0.00 58.73 60.67 3gf8 h TYR 265 Cb 0.41 -0.32 -0.00 0.00 2.00 0.00 0.00 36.73 38.82 3gf8 h TYR 265 CO 0.03 0.78 -0.79 -0.07 -0.00 0.00 0.00 178.16 178.10 3gf8 h LEU 266 N 1.02 0.57 -3.83 3.88 3.38 -0.70 -3.26 115.31 116.37 3gf8 h LEU 266 Ca 0.24 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3gf8 h LEU 266 Cb 0.16 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 3gf8 h LEU 266 CO -0.02 1.16 0.00 0.00 0.09 0.00 0.00 178.44 179.67 3gf8 n ALA 267 N -2.53 1.96 0.00 1.53 0.00 0.96 -4.68 120.51 117.74 3gf8 n ALA 267 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3gf8 n ALA 267 Cb 0.75 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.38 3gf8 n ALA 267 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3gf8 n THR 269 N 1.92 0.00 -0.97 0.00 -2.24 -1.23 -4.92 114.28 106.83 3gf8 n THR 269 Ca 0.00 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 3gf8 n THR 269 Cb 0.09 0.00 0.36 0.00 -2.10 0.00 0.00 70.33 68.68 3gf8 n THR 269 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3gf8 n ASN 270 N -3.62 5.23 -3.99 3.42 6.94 -1.26 -4.91 115.26 117.07 3gf8 n ASN 270 Ca 0.00 -3.06 -0.30 0.00 -0.02 0.00 0.00 54.58 51.21 3gf8 n ASN 270 Cb 0.00 -0.69 -0.00 0.00 -2.36 0.00 0.00 39.78 36.72 3gf8 n ASN 270 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3gf8 n ALA 271 N 0.22 -1.56 -3.24 -2.53 0.00 -1.26 -1.51 120.51 110.63 3gf8 n ALA 271 Ca 0.32 -0.03 -0.23 0.00 0.00 0.00 0.00 53.44 53.49 3gf8 n ALA 271 Cb 1.24 -3.07 0.03 0.00 0.00 0.00 0.00 19.45 17.65 3gf8 n ALA 271 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3gf8 n GLU 272 N -4.47 -5.04 -0.58 0.00 1.02 -1.26 -1.33 120.64 108.99 3gf8 n GLU 272 Ca -0.08 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 3gf8 n GLU 272 Cb 0.58 -5.65 0.00 0.00 -0.02 0.00 0.00 31.44 26.35 3gf8 n GLU 272 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gf8 n GLY 273 N -1.53 0.76 4.00 0.62 0.00 -0.57 -5.04 105.19 103.43 3gf8 n GLY 273 Ca -0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 3gf8 n GLY 273 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gf8 s LYS 274 N -0.42 2.85 -1.18 1.61 1.02 -0.44 -5.02 119.74 118.16 3gf8 s LYS 274 Ca 0.00 -1.14 -0.10 0.00 0.02 0.00 0.00 55.97 54.75 3gf8 s LYS 274 Cb 0.00 -2.74 0.22 0.00 -0.52 0.00 0.00 37.83 34.79 3gf8 s LYS 274 CO 0.00 -0.26 1.44 0.27 -0.92 0.00 0.00 175.35 175.89 3gf8 n ASN 275 N -1.87 5.49 -4.12 2.83 0.23 -1.26 -4.58 115.26 111.98 3gf8 n ASN 275 Ca 0.07 -3.10 -0.23 0.00 -0.53 0.00 0.00 54.58 50.79 3gf8 n ASN 275 Cb 0.59 -1.45 -0.15 0.00 -2.08 0.00 0.00 39.78 36.69 3gf8 n ASN 275 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3gf8 s LEU 276 N -0.32 2.00 0.79 -4.53 1.43 -1.26 -5.09 118.68 111.69 3gf8 s LEU 276 Ca 0.37 -0.27 -0.13 0.00 -1.03 0.00 0.00 54.13 53.06 3gf8 s LEU 276 Cb -0.01 -0.78 0.07 0.00 0.03 0.00 0.00 46.19 45.51 3gf8 s LEU 276 CO -0.00 0.17 1.19 -0.94 0.23 0.00 0.00 176.35 177.00 3gf8 s SER 277 N -0.27 3.78 0.20 2.29 1.04 -1.26 -4.81 113.70 114.66 3gf8 s SER 277 Ca 0.04 2.32 -0.13 0.00 0.48 0.00 0.00 55.95 58.66 3gf8 s SER 277 Cb -0.07 -2.58 0.22 0.00 0.10 0.00 0.00 66.02 63.69 3gf8 s SER 277 CO -0.00 -2.54 1.66 0.74 0.98 0.00 0.00 173.24 174.08 3gf8 h THR 278 N -0.80 0.53 -0.33 2.02 2.02 -1.98 -0.78 112.91 113.59 3gf8 h THR 278 Ca -0.46 -0.03 -0.09 0.00 0.77 0.00 0.00 66.41 66.60 3gf8 h THR 278 Cb 1.29 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 3gf8 h THR 278 CO 0.47 0.01 -0.19 -0.61 0.37 0.00 0.00 175.52 175.58 3gf8 h GLN 279 N 0.08 0.61 -0.50 6.66 5.75 -1.94 -0.14 115.11 125.63 3gf8 h GLN 279 Ca 0.27 -0.22 -0.13 0.00 -0.15 0.00 0.00 58.65 58.43 3gf8 h GLN 279 Cb 0.43 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.92 3gf8 h GLN 279 CO -0.49 0.76 -0.18 1.49 -2.65 0.00 0.00 178.83 177.76 3gf8 h GLU 280 N 0.54 1.00 -0.19 1.69 4.81 -1.78 -0.34 114.58 120.31 3gf8 h GLU 280 Ca 0.09 -0.41 -0.02 0.00 -0.13 0.00 0.00 59.36 58.89 3gf8 h GLU 280 Cb 0.63 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 3gf8 h GLU 280 CO 0.04 1.09 0.06 -0.92 -0.73 0.00 0.00 179.01 178.55 3gf8 h TYR 281 N 0.86 0.32 -0.65 0.92 3.20 -0.81 -0.16 116.97 120.64 3gf8 h TYR 281 Ca 0.12 -0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.00 3gf8 h TYR 281 Cb 0.76 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.90 3gf8 h TYR 281 CO 0.05 0.41 0.43 -0.07 -1.64 0.00 0.00 178.16 177.34 3gf8 h LEU 282 N 0.14 0.62 0.11 2.82 3.38 -0.86 -0.05 115.31 121.48 3gf8 h LEU 282 Ca 0.06 -0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.80 3gf8 h LEU 282 Cb 0.24 -0.14 0.02 0.00 0.09 0.00 0.00 40.66 40.88 3gf8 h LEU 282 CO -0.00 0.42 -0.96 0.44 0.09 0.00 0.00 178.44 178.43 3gf8 h ASP 283 N 0.72 0.64 -0.07 -0.43 3.32 -0.93 -3.36 116.42 116.31 3gf8 h ASP 283 Ca 0.27 -0.87 -0.19 0.00 0.02 0.00 0.00 57.03 56.27 3gf8 h ASP 283 Cb 0.17 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.51 3gf8 h ASP 283 CO -0.08 1.45 -0.64 0.03 -1.72 0.00 0.00 179.24 178.28 3gf8 h ARG 284 N -0.07 0.68 -5.59 3.56 3.08 -0.74 -3.40 114.38 111.91 3gf8 h ARG 284 Ca -0.15 -0.48 -0.59 0.00 0.07 0.00 0.00 59.98 58.83 3gf8 h ARG 284 Cb 1.70 0.08 -0.10 0.00 0.08 0.00 0.00 29.97 31.73 3gf8 h ARG 284 CO 0.18 1.10 -0.15 -1.14 -1.07 0.00 0.00 179.97 178.89 3gf8 s GLN 285 N -3.91 4.26 0.00 0.04 2.00 -0.06 -4.26 119.66 117.73 3gf8 s GLN 285 Ca -0.09 0.34 0.00 0.00 -2.00 0.00 0.00 55.36 53.62 3gf8 s GLN 285 Cb 0.10 -3.49 0.00 0.00 0.80 0.00 0.00 33.01 30.42 3gf8 s GLN 285 CO 0.87 0.05 0.46 0.43 -0.50 0.00 0.00 175.29 176.60 3gf8 n SER 286 N 4.11 0.89 -4.10 6.67 7.64 -1.26 -4.75 113.62 122.82 3gf8 n SER 286 Ca -0.07 -1.12 -0.32 0.00 1.01 0.00 0.00 58.87 58.37 3gf8 n SER 286 Cb 0.51 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.55 3gf8 n SER 286 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3gf8 s ASN 287 N -0.12 2.93 -0.20 6.43 -0.87 -1.26 -0.83 114.94 121.02 3gf8 s ASN 287 Ca 0.00 -0.57 0.01 0.00 -1.57 0.00 0.00 52.86 50.72 3gf8 s ASN 287 Cb 0.00 -1.35 0.05 0.00 -0.02 0.00 0.00 41.25 39.93 3gf8 s ASN 287 CO 0.00 0.00 -0.08 -0.31 -2.57 0.00 0.00 177.10 174.14 3gf8 s TYR 288 N 1.22 2.34 -0.37 2.20 1.51 -0.54 -4.97 117.35 118.75 3gf8 s TYR 288 Ca 0.01 -1.58 -0.09 0.00 -1.01 0.00 0.00 57.07 54.40 3gf8 s TYR 288 Cb -0.14 -1.59 0.04 0.00 -0.11 0.00 0.00 41.96 40.16 3gf8 s TYR 288 CO -0.09 -0.74 0.17 -1.58 -1.11 0.00 0.00 175.55 172.21 3gf8 s HIS 289 N 1.42 3.26 -0.19 2.71 2.46 -1.26 -0.48 115.29 123.21 3gf8 s HIS 289 Ca -0.02 -1.21 -0.00 0.00 0.47 0.00 0.00 55.06 54.29 3gf8 s HIS 289 Cb -0.17 -2.43 0.01 0.00 -0.13 0.00 0.00 32.58 29.86 3gf8 s HIS 289 CO -0.08 -0.70 -0.15 0.42 -2.47 0.00 0.00 174.74 171.76 3gf8 s ILE 290 N 1.48 2.42 -0.19 0.89 1.01 -0.11 -0.74 121.20 125.96 3gf8 s ILE 290 Ca 0.01 -0.85 -0.15 0.00 0.00 0.00 0.00 60.65 59.66 3gf8 s ILE 290 Cb -0.20 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 3gf8 s ILE 290 CO 0.05 0.48 0.35 -0.63 0.00 0.00 0.00 174.94 175.19 3gf8 s ILE 291 N 1.33 5.24 -0.15 2.92 -1.09 -0.29 -1.06 121.20 128.10 3gf8 s ILE 291 Ca 0.05 0.62 -0.17 0.00 -2.23 0.00 0.00 60.65 58.91 3gf8 s ILE 291 Cb -0.14 -3.68 -0.04 0.00 -1.58 0.00 0.00 42.46 37.02 3gf8 s ILE 291 CO -0.10 0.30 0.43 -0.36 -1.23 0.00 0.00 174.94 173.97 3gf8 s PHE 292 N 1.07 3.46 -0.38 3.97 0.40 0.34 -1.23 117.98 125.61 3gf8 s PHE 292 Ca 0.17 0.76 -0.11 0.00 -0.60 0.00 0.00 56.93 57.16 3gf8 s PHE 292 Cb -0.14 -2.52 0.03 0.00 0.51 0.00 0.00 43.02 40.90 3gf8 s PHE 292 CO 0.07 0.11 0.22 -0.06 0.70 0.00 0.00 175.22 176.26 3gf8 s PHE 293 N 0.85 3.25 0.13 0.36 0.40 -0.51 -0.42 117.98 122.06 3gf8 s PHE 293 Ca 0.22 -1.02 0.06 0.00 -0.60 0.00 0.00 56.93 55.59 3gf8 s PHE 293 Cb -0.15 -2.49 -0.04 0.00 0.51 0.00 0.00 43.02 40.85 3gf8 s PHE 293 CO 0.08 -0.67 0.03 -0.51 0.70 0.00 0.00 175.22 174.85 3gf8 s LEU 294 N 1.54 3.48 0.86 -0.37 1.43 0.17 -0.55 118.68 125.25 3gf8 s LEU 294 Ca 0.02 -0.24 -0.12 0.00 -1.03 0.00 0.00 54.13 52.76 3gf8 s LEU 294 Cb -0.20 -2.16 0.11 0.00 0.03 0.00 0.00 46.19 43.97 3gf8 s LEU 294 CO 0.06 0.13 1.12 -0.94 0.23 0.00 0.00 176.35 176.95 3gf8 s SER 295 N -2.68 3.99 0.62 2.29 1.04 0.47 -0.22 113.70 119.21 3gf8 s SER 295 Ca 0.27 1.08 0.30 0.00 0.48 0.00 0.00 55.95 58.08 3gf8 s SER 295 Cb -0.11 -1.71 1.63 0.00 0.10 0.00 0.00 66.02 65.94 3gf8 s SER 295 CO 0.19 -2.26 1.99 -0.33 0.98 0.00 0.00 173.24 173.82 3gf8 h GLU 296 N -1.29 0.00 -0.74 4.02 5.08 -1.99 -2.09 114.58 117.57 3gf8 h GLU 296 Ca -0.49 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.50 3gf8 h GLU 296 Cb 1.31 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.34 3gf8 h GLU 296 CO 0.61 0.00 0.36 -1.13 -1.00 0.00 0.00 179.01 177.85 3gf8 n SER 297 N -3.44 3.40 -2.72 1.42 3.41 -1.26 -4.93 113.62 109.50 3gf8 n SER 297 Ca 0.02 -3.63 -0.20 0.00 -0.26 0.00 0.00 58.87 54.81 3gf8 n SER 297 Cb 0.44 -0.76 0.01 0.00 -0.26 0.00 0.00 64.21 63.64 3gf8 n SER 297 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3gf8 n TRP 298 N -1.04 -1.49 -3.85 7.33 7.02 -0.78 -4.99 117.44 119.63 3gf8 n TRP 298 Ca 0.48 0.22 -0.35 0.00 -1.02 0.00 0.00 57.50 56.84 3gf8 n TRP 298 Cb 1.42 -3.81 -0.08 0.00 -2.42 0.00 0.00 31.31 26.42 3gf8 n TRP 298 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 3gf8 s LEU 299 N -6.23 4.10 -0.21 -0.99 1.43 -1.26 -4.85 118.68 110.67 3gf8 s LEU 299 Ca 0.14 0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 53.17 3gf8 s LEU 299 Cb -0.07 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 3gf8 s LEU 299 CO 0.18 0.22 1.52 0.00 0.23 0.00 0.00 176.35 178.49 3gf8 s ALA 300 N 0.14 3.37 -0.07 4.21 0.00 -1.26 -0.39 121.76 127.76 3gf8 s ALA 300 Ca 0.08 0.45 -0.21 0.00 0.00 0.00 0.00 51.96 52.28 3gf8 s ALA 300 Cb -0.12 -3.80 -0.30 0.00 0.00 0.00 0.00 23.12 18.91 3gf8 s ALA 300 CO -0.00 -1.76 0.78 0.28 0.00 0.00 0.00 175.76 175.05 3gf8 h VAL 301 N 5.97 1.39 -3.13 0.00 2.07 -1.15 -3.41 116.25 117.99 3gf8 h VAL 301 Ca -0.32 -2.48 -0.06 0.00 0.82 0.00 0.00 66.70 64.66 3gf8 h VAL 301 Cb 1.14 3.06 -0.15 0.00 -1.52 0.00 0.00 31.29 33.82 3gf8 h VAL 301 CO 1.00 0.69 -0.07 0.00 0.02 0.00 0.00 177.57 179.21 3gf8 s GLN 302 N -2.42 0.99 0.24 1.57 -2.07 -1.19 -1.13 119.66 115.65 3gf8 s GLN 302 Ca -0.16 -0.47 0.11 0.00 -1.82 0.00 0.00 55.36 53.02 3gf8 s GLN 302 Cb 0.02 0.44 -0.05 0.00 -1.09 0.00 0.00 33.01 32.33 3gf8 s GLN 302 CO 0.80 -0.36 -0.20 0.96 -1.32 0.00 0.00 175.29 175.16 3gf8 s ILE 303 N -2.97 2.32 -0.15 3.63 -4.36 -0.18 -1.42 121.20 118.07 3gf8 s ILE 303 Ca -0.02 -2.27 0.00 0.00 -0.26 0.00 0.00 60.65 58.10 3gf8 s ILE 303 Cb 0.00 -2.20 0.02 0.00 1.25 0.00 0.00 42.46 41.54 3gf8 s ILE 303 CO -0.06 -0.36 -0.13 -0.69 0.24 0.00 0.00 174.94 173.93 3gf8 s VAL 304 N -2.37 1.55 -0.28 8.37 1.01 -0.36 -0.78 120.40 127.54 3gf8 s VAL 304 Ca 0.26 -0.65 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 3gf8 s VAL 304 Cb -0.05 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.87 3gf8 s VAL 304 CO 0.12 0.43 0.02 -0.69 0.00 0.00 0.00 175.10 174.98 3gf8 s VAL 305 N 1.49 3.43 -1.49 2.92 1.01 -0.13 -1.14 120.40 126.49 3gf8 s VAL 305 Ca 0.04 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 61.09 3gf8 s VAL 305 Cb -0.13 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.46 3gf8 s VAL 305 CO -0.10 0.09 0.17 0.59 0.00 0.00 0.00 175.10 175.84 3gf8 n ASN 306 N 4.76 0.41 0.00 3.32 3.02 0.08 -0.96 115.26 125.89 3gf8 n ASN 306 Ca -0.15 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 3gf8 n ASN 306 Cb 0.47 -2.17 0.00 0.00 -0.61 0.00 0.00 39.78 37.46 3gf8 n ASN 306 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gf8 n GLY 307 N -2.34 2.90 3.64 7.41 0.00 -1.26 -5.02 105.19 110.52 3gf8 n GLY 307 Ca -0.32 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 3gf8 n GLY 307 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3gf8 s TRP 308 N -2.20 3.33 -0.02 1.61 0.52 -0.14 -5.05 118.94 117.00 3gf8 s TRP 308 Ca 0.00 0.78 -0.26 0.00 0.02 0.00 0.00 56.10 56.64 3gf8 s TRP 308 Cb 0.00 -2.75 -0.04 0.00 -1.15 0.00 0.00 33.47 29.53 3gf8 s TRP 308 CO 0.00 -0.21 0.81 0.08 0.02 0.00 0.00 176.95 177.65 3gf8 s VAL 309 N 2.06 4.91 -0.08 4.03 1.01 -1.26 -0.95 120.40 130.11 3gf8 s VAL 309 Ca 0.25 1.70 -0.01 0.00 0.00 0.00 0.00 61.98 63.92 3gf8 s VAL 309 Cb -0.16 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.10 3gf8 s VAL 309 CO 0.09 0.25 -0.01 -1.00 0.00 0.00 0.00 175.10 174.43 3gf8 s HIS 310 N 0.68 0.78 0.29 5.22 3.76 0.04 -5.00 115.29 121.05 3gf8 s HIS 310 Ca 0.43 -0.25 -0.29 0.00 -0.15 0.00 0.00 55.06 54.80 3gf8 s HIS 310 Cb -0.20 -0.86 -0.10 0.00 1.11 0.00 0.00 32.58 32.53 3gf8 s HIS 310 CO 0.23 -0.36 1.43 0.50 -0.85 0.00 0.00 174.74 175.69 3gf8 s ARG 311 N 1.94 4.25 -0.24 1.40 6.06 -1.26 -1.01 118.95 130.09 3gf8 s ARG 311 Ca 0.05 2.35 -0.11 0.00 -2.50 0.00 0.00 55.73 55.52 3gf8 s ARG 311 Cb -0.12 -3.07 -0.05 0.00 0.06 0.00 0.00 34.95 31.77 3gf8 s ARG 311 CO -0.06 -0.40 0.17 0.42 -2.50 0.00 0.00 175.30 172.92 3gf8 s ILE 312 N -0.42 5.35 -0.07 4.11 -1.09 -0.29 -4.91 121.20 123.89 3gf8 s ILE 312 Ca 0.56 0.19 -0.30 0.00 -2.23 0.00 0.00 60.65 58.88 3gf8 s ILE 312 Cb -0.43 -3.51 -0.03 0.00 -1.58 0.00 0.00 42.46 36.92 3gf8 s ILE 312 CO 0.49 0.34 1.14 -1.10 -1.23 0.00 0.00 174.94 174.57 3gf8 s GLN 313 N 1.11 4.37 0.32 2.79 -1.52 -1.26 -4.85 119.66 120.62 3gf8 s GLN 313 Ca 0.08 1.59 0.10 0.00 -1.95 0.00 0.00 55.36 55.17 3gf8 s GLN 313 Cb -0.14 -3.55 0.93 0.00 -0.22 0.00 0.00 33.01 30.03 3gf8 s GLN 313 CO 0.05 -0.41 1.68 1.49 -0.25 0.00 0.00 175.29 177.85 3gf8 h GLU 314 N 7.34 0.36 0.00 2.91 4.81 -1.96 0.73 114.58 128.77 3gf8 h GLU 314 Ca -0.33 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.87 3gf8 h GLU 314 Cb 1.16 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.45 3gf8 h GLU 314 CO 0.87 0.24 -0.05 0.93 -0.73 0.00 0.00 179.01 180.27 3gf8 h GLU 315 N 0.37 0.00 -0.48 1.92 3.07 -2.02 -1.91 114.58 115.53 3gf8 h GLU 315 Ca 0.66 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.52 3gf8 h GLU 315 Cb 1.40 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.31 3gf8 h GLU 315 CO -0.58 0.05 0.00 0.09 -1.40 0.00 0.00 179.01 177.18 3gf8 n ASN 316 N -3.39 3.29 0.00 1.42 5.03 0.25 -5.29 115.26 116.58 3gf8 n ASN 316 Ca -0.02 -2.00 0.01 0.00 0.87 0.00 0.00 54.58 53.44 3gf8 n ASN 316 Cb 0.19 -0.32 0.04 0.00 -1.02 0.00 0.00 39.78 38.67 3gf8 n ASN 316 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43