#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ao7 s GLU 2 N 0.00 0.97 -0.09 1.64 2.56 -1.26 -5.00 118.70 117.52 1ao7 s GLU 2 Ca 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 54.97 54.87 1ao7 s GLU 2 Cb 0.00 0.44 0.00 0.00 2.00 0.00 0.00 34.13 36.58 1ao7 s GLU 2 CO 0.00 -0.33 -0.20 0.08 -0.56 0.00 0.00 175.26 174.25 1ao7 s VAL 3 N -2.00 1.74 -0.18 3.70 1.01 -1.26 -1.67 120.40 121.74 1ao7 s VAL 3 Ca -0.08 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.02 1ao7 s VAL 3 Cb -0.01 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1ao7 s VAL 3 CO 0.02 0.49 -0.01 -1.61 0.00 0.00 0.00 175.10 173.99 1ao7 s GLU 4 N 0.44 3.69 0.08 2.72 2.02 0.11 -4.54 118.70 123.22 1ao7 s GLU 4 Ca -0.17 -0.50 0.05 0.00 0.02 0.00 0.00 54.97 54.37 1ao7 s GLU 4 Cb -0.17 -3.02 -0.04 0.00 0.10 0.00 0.00 34.13 31.00 1ao7 s GLU 4 CO 0.07 0.15 -0.04 -0.65 0.02 0.00 0.00 175.26 174.82 1ao7 s GLN 5 N 0.63 2.46 0.00 1.61 -0.21 -1.26 -1.64 119.66 121.24 1ao7 s GLN 5 Ca -0.01 -0.85 0.00 0.00 0.02 0.00 0.00 55.36 54.52 1ao7 s GLN 5 Cb -0.14 -2.48 0.00 0.00 1.00 0.00 0.00 33.01 31.39 1ao7 s GLN 5 CO 0.02 0.55 0.00 -1.71 -2.12 0.00 0.00 175.29 172.03 1ao7 n ASN 6 N 0.80 0.00 0.00 5.90 5.15 -1.05 -4.93 115.26 121.13 1ao7 n ASN 6 Ca -0.12 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.86 1ao7 n ASN 6 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.77 1ao7 n ASN 6 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1ao7 n SER 7 N -0.04 1.13 0.00 1.20 3.41 -1.26 -5.05 113.62 113.01 1ao7 n SER 7 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ao7 n SER 7 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1ao7 n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ao7 n GLY 8 N 0.00 1.01 3.72 5.00 0.00 -1.26 -4.56 105.19 109.10 1ao7 n GLY 8 Ca 0.00 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 1ao7 n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ao7 s PRO 9 N 0.82 4.48 -0.31 1.61 0.04 -1.26 -3.59 135.00 136.80 1ao7 s PRO 9 Ca 0.00 1.68 -0.07 0.00 0.04 0.00 0.00 61.00 62.66 1ao7 s PRO 9 Cb 0.00 -3.36 0.02 0.00 0.04 0.00 0.00 34.50 31.20 1ao7 s PRO 9 CO 0.00 -0.16 0.08 -1.17 0.04 0.00 0.00 177.00 175.79 1ao7 s LEU 10 N 0.84 3.98 -0.18 -3.56 2.96 0.16 -5.01 118.68 117.87 1ao7 s LEU 10 Ca 0.56 -0.85 -0.08 0.00 -0.22 0.00 0.00 54.13 53.54 1ao7 s LEU 10 Cb -0.28 -1.87 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1ao7 s LEU 10 CO 0.30 -0.23 0.08 -0.44 -1.32 0.00 0.00 176.35 174.73 1ao7 s SER 11 N 1.46 5.76 0.02 3.68 0.01 -1.26 -1.31 113.70 122.06 1ao7 s SER 11 Ca 0.01 0.12 0.01 0.00 1.31 0.00 0.00 55.95 57.40 1ao7 s SER 11 Cb -0.18 -1.99 -0.01 0.00 0.21 0.00 0.00 66.02 64.05 1ao7 s SER 11 CO 0.02 0.18 -0.03 0.68 0.41 0.00 0.00 173.24 174.50 1ao7 s VAL 12 N 0.33 0.19 0.61 3.43 -7.23 -0.53 -4.98 120.40 112.23 1ao7 s VAL 12 Ca 0.04 -0.59 -0.15 0.00 -1.81 0.00 0.00 61.98 59.47 1ao7 s VAL 12 Cb -0.12 -0.26 -0.03 0.00 0.56 0.00 0.00 36.38 36.53 1ao7 s VAL 12 CO -0.00 -0.26 1.06 -2.16 -0.31 0.00 0.00 175.10 173.43 1ao7 s PRO 13 N -0.89 3.22 0.04 4.82 0.04 -1.26 -0.68 135.00 140.29 1ao7 s PRO 13 Ca -0.08 1.18 -0.30 0.00 0.04 0.00 0.00 61.00 61.84 1ao7 s PRO 13 Cb -0.06 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 1ao7 s PRO 13 CO -0.00 -0.89 1.95 -2.00 0.04 0.00 0.00 177.00 176.10 1ao7 s GLU 14 N -4.21 4.14 0.00 4.56 2.12 0.29 -1.86 118.70 123.74 1ao7 s GLU 14 Ca 0.63 2.61 0.00 0.00 0.36 0.00 0.00 54.97 58.57 1ao7 s GLU 14 Cb -0.16 -4.12 0.00 0.00 0.26 0.00 0.00 34.13 30.11 1ao7 s GLU 14 CO 0.40 -0.95 0.00 0.41 -0.54 0.00 0.00 175.26 174.58 1ao7 n GLY 15 N 4.51 2.56 3.31 -1.50 0.00 0.84 -4.82 105.19 110.09 1ao7 n GLY 15 Ca 0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1ao7 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ao7 n ALA 16 N -0.83 -1.22 -2.79 4.61 0.00 -0.78 -4.06 120.51 115.45 1ao7 n ALA 16 Ca 0.00 -1.50 -0.36 0.00 0.00 0.00 0.00 53.44 51.58 1ao7 n ALA 16 Cb 0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 19.45 19.33 1ao7 n ALA 16 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ao7 s ILE 17 N -3.44 5.42 -0.21 0.00 -1.09 -1.26 -2.30 121.20 118.32 1ao7 s ILE 17 Ca 0.64 0.19 -0.03 0.00 -2.23 0.00 0.00 60.65 59.22 1ao7 s ILE 17 Cb -0.02 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.44 1ao7 s ILE 17 CO 0.45 0.52 -0.08 0.00 -1.23 0.00 0.00 174.94 174.60 1ao7 s ALA 18 N -0.22 2.70 -0.10 9.38 0.00 -0.76 -4.97 121.76 127.79 1ao7 s ALA 18 Ca 0.11 -1.21 0.03 0.00 0.00 0.00 0.00 51.96 50.90 1ao7 s ALA 18 Cb -0.11 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 21.41 1ao7 s ALA 18 CO 0.01 -0.45 -0.22 -1.54 0.00 0.00 0.00 175.76 173.56 1ao7 s SER 19 N 1.43 2.89 0.06 0.00 1.04 -1.26 0.55 113.70 118.41 1ao7 s SER 19 Ca 0.05 -0.53 0.07 0.00 0.48 0.00 0.00 55.95 56.02 1ao7 s SER 19 Cb -0.14 -1.32 -0.04 0.00 0.10 0.00 0.00 66.02 64.62 1ao7 s SER 19 CO -0.05 0.12 -0.15 -0.76 0.98 0.00 0.00 173.24 173.38 1ao7 s LEU 20 N 0.51 2.80 0.20 2.42 1.43 0.79 -4.99 118.68 121.83 1ao7 s LEU 20 Ca -0.16 -0.40 0.11 0.00 -1.03 0.00 0.00 54.13 52.65 1ao7 s LEU 20 Cb -0.17 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1ao7 s LEU 20 CO 0.06 0.23 -0.21 0.20 0.23 0.00 0.00 176.35 176.86 1ao7 s ASN 21 N -1.73 3.63 -0.06 2.29 -0.87 -1.26 -2.08 114.94 114.85 1ao7 s ASN 21 Ca 0.17 -0.82 -0.15 0.00 -1.57 0.00 0.00 52.86 50.49 1ao7 s ASN 21 Cb -0.11 -0.36 0.03 0.00 -0.02 0.00 0.00 41.25 40.79 1ao7 s ASN 21 CO 0.08 0.11 0.35 0.00 -2.57 0.00 0.00 177.10 175.07 1ao7 s THR 23 N -0.77 -0.03 0.35 0.00 2.01 -0.65 0.21 115.64 116.77 1ao7 s THR 23 Ca -0.09 0.10 0.07 0.00 0.31 0.00 0.00 61.69 62.08 1ao7 s THR 23 Cb -0.04 -0.12 -0.07 0.00 0.01 0.00 0.00 72.50 72.28 1ao7 s THR 23 CO 0.03 0.04 -0.02 -0.72 -0.69 0.00 0.00 174.62 173.26 1ao7 s TYR 24 N 0.55 2.26 -0.19 4.92 1.13 -0.99 0.07 117.35 125.11 1ao7 s TYR 24 Ca -0.04 -0.70 0.04 0.00 -1.41 0.00 0.00 57.07 54.96 1ao7 s TYR 24 Cb -0.06 -1.45 -0.14 0.00 -1.10 0.00 0.00 41.96 39.21 1ao7 s TYR 24 CO -0.02 0.35 -0.13 -1.13 -2.51 0.00 0.00 175.55 172.11 1ao7 n SER 25 N -0.79 2.22 -4.59 -0.18 3.41 -0.67 -4.89 113.62 108.13 1ao7 n SER 25 Ca -0.05 -0.09 -0.42 0.00 -0.26 0.00 0.00 58.87 58.06 1ao7 n SER 25 Cb 0.65 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 1ao7 n SER 25 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ao7 s ASP 26 N -5.72 5.96 0.57 4.04 -1.08 -1.26 -4.86 116.67 114.32 1ao7 s ASP 26 Ca -0.23 0.93 0.27 0.00 -0.52 0.00 0.00 52.55 53.00 1ao7 s ASP 26 Cb 0.06 -2.53 1.60 0.00 -1.46 0.00 0.00 42.92 40.59 1ao7 s ASP 26 CO 0.49 -1.72 2.12 -0.09 0.52 0.00 0.00 175.17 176.49 1ao7 h ARG 27 N 12.34 0.00 -0.10 4.34 2.43 -1.98 -2.00 114.38 129.41 1ao7 h ARG 27 Ca -0.30 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1ao7 h ARG 27 Cb 1.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1ao7 h ARG 27 CO 1.09 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 179.96 1ao7 n GLY 28 N -1.44 -0.44 3.74 2.80 0.00 -1.26 -4.91 105.19 103.68 1ao7 n GLY 28 Ca 0.01 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1ao7 n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ao7 s SER 29 N -1.26 6.39 -0.10 1.61 0.01 -0.75 -4.71 113.70 114.89 1ao7 s SER 29 Ca 0.18 2.90 0.07 0.00 1.31 0.00 0.00 55.95 60.42 1ao7 s SER 29 Cb 0.09 -2.62 -0.11 0.00 0.21 0.00 0.00 66.02 63.59 1ao7 s SER 29 CO 0.14 -0.92 0.01 0.00 0.41 0.00 0.00 173.24 172.89 1ao7 n GLN 30 N 2.74 2.19 -4.92 12.44 6.02 0.85 -4.94 117.38 131.77 1ao7 n GLN 30 Ca 0.10 0.01 -0.32 0.00 -0.01 0.00 0.00 57.00 56.78 1ao7 n GLN 30 Cb 0.37 -1.24 -0.14 0.00 1.02 0.00 0.00 30.24 30.26 1ao7 n GLN 30 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1ao7 s SER 31 N -4.27 3.71 -0.02 1.08 0.01 -0.52 -4.71 113.70 108.98 1ao7 s SER 31 Ca -0.06 -0.34 0.02 0.00 1.31 0.00 0.00 55.95 56.88 1ao7 s SER 31 Cb 0.03 -0.64 0.00 0.00 0.21 0.00 0.00 66.02 65.62 1ao7 s SER 31 CO 0.37 0.31 -0.07 -0.36 0.41 0.00 0.00 173.24 173.89 1ao7 s PHE 32 N -0.77 0.74 0.21 2.43 0.08 -1.05 -0.69 117.98 118.94 1ao7 s PHE 32 Ca 0.12 -0.16 0.00 0.00 0.12 0.00 0.00 56.93 57.02 1ao7 s PHE 32 Cb -0.10 -0.51 -0.05 0.00 -0.57 0.00 0.00 43.02 41.79 1ao7 s PHE 32 CO 0.02 -0.05 0.09 -0.06 -0.10 0.00 0.00 175.22 175.11 1ao7 s PHE 33 N 0.06 1.29 -0.02 0.36 0.08 0.15 -0.78 117.98 119.11 1ao7 s PHE 33 Ca -0.00 -1.22 -0.00 0.00 0.12 0.00 0.00 56.93 55.82 1ao7 s PHE 33 Cb -0.06 -0.71 0.03 0.00 -0.57 0.00 0.00 43.02 41.71 1ao7 s PHE 33 CO -0.00 -0.43 0.03 -1.58 -0.10 0.00 0.00 175.22 173.14 1ao7 s TRP 34 N -3.90 0.07 0.16 0.36 0.52 -0.27 -2.14 118.94 113.75 1ao7 s TRP 34 Ca 0.34 0.13 0.10 0.00 0.02 0.00 0.00 56.10 56.69 1ao7 s TRP 34 Cb 0.07 -0.30 -0.04 0.00 -1.15 0.00 0.00 33.47 32.05 1ao7 s TRP 34 CO 0.10 -0.11 -0.18 0.71 0.02 0.00 0.00 176.95 177.50 1ao7 s TYR 35 N 1.24 2.49 -0.12 -1.98 1.51 0.54 -1.27 117.35 119.75 1ao7 s TYR 35 Ca -0.07 -0.28 0.02 0.00 -1.01 0.00 0.00 57.07 55.73 1ao7 s TYR 35 Cb -0.13 -1.27 0.01 0.00 -0.11 0.00 0.00 41.96 40.46 1ao7 s TYR 35 CO -0.03 0.45 -0.20 0.50 -1.11 0.00 0.00 175.55 175.17 1ao7 s ARG 36 N -2.49 2.69 -0.22 -0.62 3.52 0.76 -0.78 118.95 121.82 1ao7 s ARG 36 Ca 0.21 -0.74 0.01 0.00 -0.13 0.00 0.00 55.73 55.08 1ao7 s ARG 36 Cb -0.09 -2.19 0.05 0.00 -1.56 0.00 0.00 34.95 31.15 1ao7 s ARG 36 CO 0.11 -0.01 -0.11 -1.14 -0.81 0.00 0.00 175.30 173.35 1ao7 s GLN 37 N 0.81 2.15 0.01 5.12 0.74 0.05 -0.75 119.66 127.80 1ao7 s GLN 37 Ca -0.09 -0.99 -0.25 0.00 0.05 0.00 0.00 55.36 54.09 1ao7 s GLN 37 Cb -0.16 -2.57 -0.05 0.00 1.10 0.00 0.00 33.01 31.33 1ao7 s GLN 37 CO -0.00 -0.46 0.75 0.71 -0.55 0.00 0.00 175.29 175.74 1ao7 s TYR 38 N 1.31 3.69 -0.16 1.67 2.02 -1.26 -1.69 117.35 122.93 1ao7 s TYR 38 Ca -0.03 1.42 -0.38 0.00 -0.37 0.00 0.00 57.07 57.71 1ao7 s TYR 38 Cb -0.17 -2.82 -0.18 0.00 -0.40 0.00 0.00 41.96 38.39 1ao7 s TYR 38 CO -0.08 0.22 1.12 0.45 -1.57 0.00 0.00 175.55 175.69 1ao7 n SER 39 N 3.08 0.39 -0.33 2.29 2.88 -1.26 0.13 113.62 120.80 1ao7 n SER 39 Ca -0.02 1.04 -0.04 0.00 -1.33 0.00 0.00 58.87 58.52 1ao7 n SER 39 Cb 0.51 -0.80 -0.02 0.00 -0.75 0.00 0.00 64.21 63.14 1ao7 n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ao7 n GLY 40 N 2.15 0.70 3.54 0.46 0.00 -1.26 -5.01 105.19 105.76 1ao7 n GLY 40 Ca 0.21 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 1ao7 n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ao7 s LYS 41 N -1.90 1.93 0.19 1.61 1.02 0.12 -5.16 119.74 117.55 1ao7 s LYS 41 Ca 0.00 -2.18 -0.06 0.00 0.02 0.00 0.00 55.97 53.75 1ao7 s LYS 41 Cb 0.00 -0.74 -0.06 0.00 -0.52 0.00 0.00 37.83 36.51 1ao7 s LYS 41 CO 0.00 -0.44 0.46 -1.54 -0.92 0.00 0.00 175.35 172.91 1ao7 s SER 42 N -3.63 6.53 0.20 2.83 1.04 -1.26 -4.70 113.70 114.71 1ao7 s SER 42 Ca 0.23 0.72 -0.32 0.00 0.48 0.00 0.00 55.95 57.06 1ao7 s SER 42 Cb 0.03 -2.14 -0.12 0.00 0.10 0.00 0.00 66.02 63.88 1ao7 s SER 42 CO 0.13 -0.03 1.71 -2.65 0.98 0.00 0.00 173.24 173.39 1ao7 n PRO 43 N -0.14 2.71 -4.90 4.02 -0.02 -1.26 -4.62 135.00 130.79 1ao7 n PRO 43 Ca -0.01 0.98 -0.33 0.00 -2.02 0.00 0.00 63.50 62.12 1ao7 n PRO 43 Cb 0.52 -2.82 -0.15 0.00 -0.02 0.00 0.00 33.50 31.04 1ao7 n PRO 43 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1ao7 s GLU 44 N 1.14 3.29 0.23 -0.52 2.12 0.07 -4.91 118.70 120.13 1ao7 s GLU 44 Ca 0.76 -0.74 -0.30 0.00 0.36 0.00 0.00 54.97 55.05 1ao7 s GLU 44 Cb -0.52 -2.54 -0.09 0.00 0.26 0.00 0.00 34.13 31.23 1ao7 s GLU 44 CO 0.33 0.20 1.28 -1.17 -0.54 0.00 0.00 175.26 175.37 1ao7 s LEU 45 N 0.35 4.43 0.00 2.70 2.96 -1.26 -0.17 118.68 127.69 1ao7 s LEU 45 Ca -0.13 2.44 0.00 0.00 -0.22 0.00 0.00 54.13 56.21 1ao7 s LEU 45 Cb -0.16 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.91 1ao7 s LEU 45 CO 0.07 -0.48 0.00 2.30 -1.32 0.00 0.00 176.35 176.91 1ao7 n ILE 46 N 2.14 0.00 -3.68 6.68 -5.35 -0.40 -4.89 119.36 113.87 1ao7 n ILE 46 Ca 0.04 -0.07 -0.14 0.00 -0.27 0.00 0.00 62.75 62.31 1ao7 n ILE 46 Cb 0.43 0.46 -0.09 0.00 -1.74 0.00 0.00 39.64 38.70 1ao7 n ILE 46 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 1ao7 s MET 47 N -0.93 0.67 -0.02 6.28 -1.94 -1.05 -4.99 119.30 117.31 1ao7 s MET 47 Ca 0.00 0.63 0.01 0.00 -1.71 0.00 0.00 55.69 54.62 1ao7 s MET 47 Cb 0.00 0.32 0.02 0.00 2.01 0.00 0.00 34.83 37.18 1ao7 s MET 47 CO 0.00 -0.10 -0.01 -1.12 -0.01 0.00 0.00 175.02 173.78 1ao7 s SER 48 N 0.03 0.40 -0.09 3.03 0.01 -1.26 -1.11 113.70 114.71 1ao7 s SER 48 Ca -0.02 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.21 1ao7 s SER 48 Cb -0.04 -0.19 0.02 0.00 0.21 0.00 0.00 66.02 66.03 1ao7 s SER 48 CO 0.02 -0.07 -0.07 -0.63 0.41 0.00 0.00 173.24 172.90 1ao7 s ILE 49 N 0.78 0.92 -0.97 1.44 1.01 0.04 -5.01 121.20 119.41 1ao7 s ILE 49 Ca -0.08 -0.25 0.09 0.00 0.00 0.00 0.00 60.65 60.41 1ao7 s ILE 49 Cb -0.11 -0.94 0.03 0.00 0.01 0.00 0.00 42.46 41.45 1ao7 s ILE 49 CO -0.01 0.34 0.68 -1.22 0.00 0.00 0.00 174.94 174.72 1ao7 n TYR 50 N 4.70 0.00 -4.15 3.97 4.01 -1.26 -2.53 117.16 121.90 1ao7 n TYR 50 Ca -0.15 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.43 1ao7 n TYR 50 Cb 0.50 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.41 1ao7 n TYR 50 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1ao7 s SER 51 N -1.07 1.34 -0.25 7.72 0.01 -1.26 -4.95 113.70 115.23 1ao7 s SER 51 Ca 0.09 -0.56 -0.25 0.00 1.31 0.00 0.00 55.95 56.54 1ao7 s SER 51 Cb 0.07 -0.03 -0.00 0.00 0.21 0.00 0.00 66.02 66.28 1ao7 s SER 51 CO 0.18 -0.11 0.86 0.54 0.41 0.00 0.00 173.24 175.12 1ao7 s ASN 52 N -1.56 6.85 0.00 2.44 2.20 -1.26 -4.78 114.94 118.83 1ao7 s ASN 52 Ca -0.04 1.03 0.00 0.00 -0.94 0.00 0.00 52.86 52.91 1ao7 s ASN 52 Cb -0.09 -2.45 0.00 0.00 -2.00 0.00 0.00 41.25 36.71 1ao7 s ASN 52 CO 0.01 -0.56 0.00 0.61 -2.94 0.00 0.00 177.10 174.23 1ao7 n GLY 53 N 3.76 -0.77 3.38 0.45 0.00 -1.09 -4.93 105.19 105.99 1ao7 n GLY 53 Ca 0.06 -0.82 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 1ao7 n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ao7 s ASP 54 N -4.00 5.61 -0.41 1.61 1.11 -1.26 -1.51 116.67 117.83 1ao7 s ASP 54 Ca 0.00 -0.85 -0.13 0.00 0.18 0.00 0.00 52.55 51.75 1ao7 s ASP 54 Cb 0.00 -2.00 0.05 0.00 1.07 0.00 0.00 42.92 42.04 1ao7 s ASP 54 CO 0.00 -0.32 0.28 -0.75 1.18 0.00 0.00 175.17 175.57 1ao7 s LYS 55 N 1.56 2.85 -0.81 8.23 2.20 0.17 -4.95 119.74 128.99 1ao7 s LYS 55 Ca 0.03 -1.20 0.02 0.00 -0.36 0.00 0.00 55.97 54.46 1ao7 s LYS 55 Cb -0.18 -3.89 0.27 0.00 -1.51 0.00 0.00 37.83 32.51 1ao7 s LYS 55 CO 0.06 -0.83 1.01 -1.91 -0.36 0.00 0.00 175.35 173.31 1ao7 n GLU 56 N 5.07 3.22 -3.80 4.03 2.13 -1.26 -0.55 120.64 129.48 1ao7 n GLU 56 Ca -0.11 -4.62 -0.37 0.00 0.66 0.00 0.00 57.16 52.71 1ao7 n GLU 56 Cb 0.45 -2.36 -0.13 0.00 0.27 0.00 0.00 31.44 29.68 1ao7 n GLU 56 CO 0.00 0.00 0.00 0.16 -0.41 0.00 0.00 177.13 176.88 1ao7 s ASP 57 N -2.12 5.02 0.00 4.31 -4.77 -1.19 -4.95 116.67 112.98 1ao7 s ASP 57 Ca 0.36 -0.89 0.00 0.00 -3.30 0.00 0.00 52.55 48.72 1ao7 s ASP 57 Cb 0.10 -1.83 0.00 0.00 -1.09 0.00 0.00 42.92 40.10 1ao7 s ASP 57 CO 0.02 -0.22 0.00 0.61 0.70 0.00 0.00 175.17 176.28 1ao7 n GLY 58 N 4.80 0.39 1.04 2.12 0.00 -1.26 -4.32 105.19 107.97 1ao7 n GLY 58 Ca -0.14 -1.81 0.12 0.00 0.00 0.00 0.00 46.02 44.18 1ao7 n GLY 58 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ao7 n ARG 61 N 0.00 2.40 -4.07 1.61 0.63 -1.26 -4.90 116.66 111.07 1ao7 n ARG 61 Ca 0.00 -2.07 -0.33 0.00 -0.92 0.00 0.00 57.85 54.53 1ao7 n ARG 61 Cb 0.00 -1.49 -0.07 0.00 0.45 0.00 0.00 32.46 31.36 1ao7 n ARG 61 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1ao7 s PHE 62 N -1.75 3.32 -0.07 -0.14 0.08 -1.26 -1.99 117.98 116.17 1ao7 s PHE 62 Ca 0.34 0.22 0.01 0.00 0.12 0.00 0.00 56.93 57.62 1ao7 s PHE 62 Cb 0.21 -1.75 0.02 0.00 -0.57 0.00 0.00 43.02 40.94 1ao7 s PHE 62 CO 0.31 0.56 -0.07 0.99 -0.10 0.00 0.00 175.22 176.92 1ao7 s THR 63 N -1.23 0.78 -0.09 0.64 2.01 -0.80 -3.18 115.64 113.77 1ao7 s THR 63 Ca 0.24 -0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.06 1ao7 s THR 63 Cb -0.12 -0.79 -0.01 0.00 0.01 0.00 0.00 72.50 71.59 1ao7 s THR 63 CO 0.15 0.30 -0.22 0.00 -0.69 0.00 0.00 174.62 174.16 1ao7 s ALA 64 N 1.17 2.28 0.09 7.40 0.00 0.29 -0.77 121.76 132.22 1ao7 s ALA 64 Ca -0.06 -0.98 0.09 0.00 0.00 0.00 0.00 51.96 51.01 1ao7 s ALA 64 Cb -0.14 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.09 1ao7 s ALA 64 CO -0.01 0.33 -0.23 -0.65 0.00 0.00 0.00 175.76 175.20 1ao7 s GLN 65 N 0.14 1.72 -0.06 0.00 -0.21 -1.14 0.44 119.66 120.55 1ao7 s GLN 65 Ca -0.11 -1.18 -0.00 0.00 0.02 0.00 0.00 55.36 54.08 1ao7 s GLN 65 Cb -0.16 -2.03 0.02 0.00 1.00 0.00 0.00 33.01 31.85 1ao7 s GLN 65 CO 0.06 0.49 -0.02 -1.17 -2.12 0.00 0.00 175.29 172.53 1ao7 s LEU 66 N -1.79 1.01 -0.48 2.90 2.96 -0.57 -1.25 118.68 121.46 1ao7 s LEU 66 Ca 0.15 -0.11 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 1ao7 s LEU 66 Cb -0.10 -0.45 0.13 0.00 0.50 0.00 0.00 46.19 46.27 1ao7 s LEU 66 CO 0.06 -0.12 0.23 0.21 -1.32 0.00 0.00 176.35 175.42 1ao7 s ASN 67 N 1.39 4.16 0.15 3.68 3.84 -0.05 -2.69 114.94 125.42 1ao7 s ASN 67 Ca -0.04 -2.82 -0.16 0.00 0.21 0.00 0.00 52.86 50.06 1ao7 s ASN 67 Cb -0.13 -1.45 0.05 0.00 -0.55 0.00 0.00 41.25 39.16 1ao7 s ASN 67 CO -0.03 -0.26 1.77 0.11 -2.79 0.00 0.00 177.10 175.91 1ao7 h LYS 68 N 6.68 0.35 -0.96 0.43 1.57 -1.95 0.46 116.57 123.15 1ao7 h LYS 68 Ca -0.06 -0.02 0.16 0.00 -1.87 0.00 0.00 60.65 58.86 1ao7 h LYS 68 Cb 0.91 -0.08 -0.10 0.00 0.08 0.00 0.00 32.23 33.05 1ao7 h LYS 68 CO 0.62 0.23 0.57 0.00 -0.57 0.00 0.00 179.45 180.30 1ao7 h ALA 69 N 1.20 1.51 -0.02 3.86 0.00 -1.97 0.20 119.26 124.04 1ao7 h ALA 69 Ca 0.16 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ao7 h ALA 69 Cb 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ao7 h ALA 69 CO -0.12 0.02 -0.02 0.43 0.00 0.00 0.00 179.25 179.56 1ao7 n SER 70 N -4.75 2.50 -3.77 0.00 7.64 -1.02 -4.98 113.62 109.24 1ao7 n SER 70 Ca 0.20 -1.82 -0.27 0.00 1.01 0.00 0.00 58.87 57.99 1ao7 n SER 70 Cb 0.47 0.02 0.02 0.00 -1.01 0.00 0.00 64.21 63.70 1ao7 n SER 70 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ao7 n GLN 71 N 0.94 -2.63 -4.43 1.43 6.02 0.15 -4.93 117.38 113.93 1ao7 n GLN 71 Ca 0.15 0.47 -0.20 0.00 -0.01 0.00 0.00 57.00 57.41 1ao7 n GLN 71 Cb 0.52 -4.48 -0.15 0.00 1.02 0.00 0.00 30.24 27.15 1ao7 n GLN 71 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1ao7 s TYR 72 N -3.68 0.96 0.10 1.08 6.14 -0.50 -2.34 117.35 119.11 1ao7 s TYR 72 Ca 0.22 -0.21 0.08 0.00 0.64 0.00 0.00 57.07 57.80 1ao7 s TYR 72 Cb -0.08 -0.65 -0.03 0.00 0.42 0.00 0.00 41.96 41.62 1ao7 s TYR 72 CO 0.86 -0.06 -0.22 0.08 0.64 0.00 0.00 175.55 176.85 1ao7 s VAL 73 N -0.03 1.78 0.12 3.14 1.01 0.13 -0.87 120.40 125.68 1ao7 s VAL 73 Ca 0.00 -1.52 0.01 0.00 0.00 0.00 0.00 61.98 60.48 1ao7 s VAL 73 Cb -0.06 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1ao7 s VAL 73 CO 0.00 0.01 -0.02 -0.44 0.00 0.00 0.00 175.10 174.65 1ao7 s SER 74 N -1.81 0.92 -0.18 3.32 0.01 -0.38 -0.23 113.70 115.35 1ao7 s SER 74 Ca 0.08 -1.09 -0.06 0.00 1.31 0.00 0.00 55.95 56.18 1ao7 s SER 74 Cb -0.10 0.15 0.08 0.00 0.21 0.00 0.00 66.02 66.37 1ao7 s SER 74 CO 0.04 -0.56 0.39 -0.22 0.41 0.00 0.00 173.24 173.30 1ao7 s LEU 75 N -3.06 -0.56 -0.22 2.44 2.96 -0.88 -2.87 118.68 116.49 1ao7 s LEU 75 Ca 0.17 0.91 -0.01 0.00 -0.22 0.00 0.00 54.13 54.97 1ao7 s LEU 75 Cb 0.06 1.21 0.02 0.00 0.50 0.00 0.00 46.19 47.98 1ao7 s LEU 75 CO -0.02 -0.23 -0.11 -0.76 -1.32 0.00 0.00 176.35 173.91 1ao7 s LEU 76 N 2.55 2.74 -0.43 -0.68 2.01 0.05 -0.15 118.68 124.77 1ao7 s LEU 76 Ca -0.01 -0.69 -0.18 0.00 0.01 0.00 0.00 54.13 53.27 1ao7 s LEU 76 Cb -0.12 -1.61 0.02 0.00 0.01 0.00 0.00 46.19 44.49 1ao7 s LEU 76 CO -0.12 -0.06 0.45 -0.63 1.01 0.00 0.00 176.35 177.01 1ao7 s ILE 77 N 1.34 5.07 0.60 -0.59 1.01 0.19 -1.90 121.20 126.92 1ao7 s ILE 77 Ca 0.03 -0.33 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 1ao7 s ILE 77 Cb -0.15 -4.06 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 1ao7 s ILE 77 CO -0.07 -0.45 0.97 -0.60 0.00 0.00 0.00 174.94 174.79 1ao7 s ARG 78 N 2.19 3.44 -1.08 2.79 3.52 -0.84 -1.83 118.95 127.13 1ao7 s ARG 78 Ca 0.13 0.53 -0.23 0.00 -0.13 0.00 0.00 55.73 56.03 1ao7 s ARG 78 Cb -0.17 -2.15 0.03 0.00 -1.56 0.00 0.00 34.95 31.10 1ao7 s ARG 78 CO 0.14 -0.56 0.65 -3.47 -0.81 0.00 0.00 175.30 171.25 1ao7 n ASP 79 N -2.66 -4.36 -4.70 -2.12 2.03 -1.25 -4.79 116.55 98.69 1ao7 n ASP 79 Ca 0.05 -1.19 -0.42 0.00 0.52 0.00 0.00 54.79 53.74 1ao7 n ASP 79 Cb 0.55 -1.62 -0.03 0.00 -0.72 0.00 0.00 41.12 39.30 1ao7 n ASP 79 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1ao7 n SER 80 N -2.31 4.05 -4.70 1.67 7.64 -0.97 -4.74 113.62 114.25 1ao7 n SER 80 Ca -0.19 1.01 -0.31 0.00 1.01 0.00 0.00 58.87 60.39 1ao7 n SER 80 Cb 0.61 -1.56 -0.08 0.00 -1.01 0.00 0.00 64.21 62.17 1ao7 n SER 80 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1ao7 s GLN 81 N 2.25 2.67 0.52 1.43 -1.52 -1.26 -0.11 119.66 123.64 1ao7 s GLN 81 Ca 0.80 -0.74 0.35 0.00 -1.95 0.00 0.00 55.36 53.81 1ao7 s GLN 81 Cb -0.49 -2.61 1.82 0.00 -0.22 0.00 0.00 33.01 31.51 1ao7 s GLN 81 CO 0.36 0.57 2.06 -1.35 -0.25 0.00 0.00 175.29 176.68 1ao7 h PRO 82 N 3.72 0.00 0.00 2.91 0.11 -1.92 -0.43 132.00 136.39 1ao7 h PRO 82 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1ao7 h PRO 82 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ao7 h PRO 82 CO 0.60 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.05 1ao7 h SER 83 N 0.00 0.00 0.67 -2.05 4.64 -1.95 -2.47 113.55 112.40 1ao7 h SER 83 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ao7 h SER 83 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1ao7 h SER 83 CO 0.00 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 176.40 1ao7 h ASP 84 N 0.00 0.00 -1.75 4.97 3.32 -1.45 -3.43 116.42 118.08 1ao7 h ASP 84 Ca 0.00 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 1ao7 h ASP 84 Cb 0.41 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 1ao7 h ASP 84 CO 0.00 0.00 1.46 -1.20 -1.72 0.00 0.00 179.24 177.78 1ao7 n SER 85 N -2.64 2.98 -3.46 6.45 7.64 -0.93 -4.83 113.62 118.83 1ao7 n SER 85 Ca 0.01 0.29 -0.04 0.00 1.01 0.00 0.00 58.87 60.14 1ao7 n SER 85 Cb 0.22 -1.47 0.01 0.00 -1.01 0.00 0.00 64.21 61.95 1ao7 n SER 85 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ao7 s ALA 86 N 7.88 -1.55 -0.17 -0.43 0.00 -1.03 -4.88 121.76 121.57 1ao7 s ALA 86 Ca 1.03 -0.20 -0.04 0.00 0.00 0.00 0.00 51.96 52.75 1ao7 s ALA 86 Cb -0.49 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.32 1ao7 s ALA 86 CO 0.39 -1.05 -0.04 -0.08 0.00 0.00 0.00 175.76 174.99 1ao7 s THR 87 N -2.57 3.77 -0.18 0.00 -1.32 -0.68 -1.70 115.64 112.97 1ao7 s THR 87 Ca 0.18 -0.39 -0.14 0.00 -1.21 0.00 0.00 61.69 60.13 1ao7 s THR 87 Cb -0.02 -2.67 -0.05 0.00 -1.51 0.00 0.00 72.50 68.26 1ao7 s THR 87 CO 0.05 0.47 0.30 -0.31 -2.21 0.00 0.00 174.62 172.92 1ao7 s TYR 88 N 0.66 3.43 -0.15 9.09 1.51 -0.33 -0.77 117.35 130.80 1ao7 s TYR 88 Ca -0.02 0.57 -0.03 0.00 -1.01 0.00 0.00 57.07 56.58 1ao7 s TYR 88 Cb -0.14 -2.37 -0.03 0.00 -0.11 0.00 0.00 41.96 39.31 1ao7 s TYR 88 CO 0.02 0.17 -0.04 -0.51 -1.11 0.00 0.00 175.55 174.08 1ao7 s LEU 89 N 0.68 3.22 -0.13 -1.29 1.02 0.04 -1.39 118.68 120.82 1ao7 s LEU 89 Ca 0.16 -0.13 -0.12 0.00 0.02 0.00 0.00 54.13 54.07 1ao7 s LEU 89 Cb -0.13 -1.77 -0.05 0.00 0.02 0.00 0.00 46.19 44.26 1ao7 s LEU 89 CO 0.05 0.19 0.24 0.00 0.02 0.00 0.00 176.35 176.85 1ao7 s ALA 91 N -0.14 1.03 -0.05 0.00 0.00 -0.91 0.08 121.76 121.77 1ao7 s ALA 91 Ca 0.16 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 51.10 1ao7 s ALA 91 Cb -0.13 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 22.94 1ao7 s ALA 91 CO 0.04 0.13 0.24 0.08 0.00 0.00 0.00 175.76 176.25 1ao7 s VAL 92 N -1.24 0.03 0.15 0.00 1.01 -0.35 -0.68 120.40 119.33 1ao7 s VAL 92 Ca -0.03 -0.27 -0.05 0.00 0.00 0.00 0.00 61.98 61.63 1ao7 s VAL 92 Cb -0.10 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1ao7 s VAL 92 CO 0.02 -0.15 0.17 0.42 0.00 0.00 0.00 175.10 175.56 1ao7 s THR 93 N -0.55 0.08 -0.25 3.92 -4.23 0.14 -2.18 115.64 112.56 1ao7 s THR 93 Ca -0.07 -1.68 -0.13 0.00 -1.18 0.00 0.00 61.69 58.64 1ao7 s THR 93 Cb -0.04 -1.99 -0.11 0.00 1.34 0.00 0.00 72.50 71.70 1ao7 s THR 93 CO 0.02 -0.35 -0.33 0.35 -0.54 0.00 0.00 174.62 173.77 1ao7 n THR 98 N -0.17 1.39 -4.16 3.99 -2.24 -1.26 -0.10 114.28 111.73 1ao7 n THR 98 Ca -0.06 -0.34 -0.13 0.00 -2.27 0.00 0.00 64.05 61.25 1ao7 n THR 98 Cb 0.63 -1.85 -0.05 0.00 -2.10 0.00 0.00 70.33 66.96 1ao7 n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ao7 n ASP 99 N -4.14 -0.55 0.18 3.42 5.75 -1.26 -4.02 116.55 115.93 1ao7 n ASP 99 Ca -0.49 -2.50 0.14 0.00 -0.01 0.00 0.00 54.79 51.92 1ao7 n ASP 99 Cb 0.85 1.24 0.56 0.00 -1.03 0.00 0.00 41.12 42.74 1ao7 n ASP 99 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1ao7 h SER 100 N 1.42 0.00 -0.01 -1.12 4.64 -2.03 -1.93 113.55 114.52 1ao7 h SER 100 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1ao7 h SER 100 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1ao7 h SER 100 CO 0.24 0.00 -0.01 0.79 -0.87 0.00 0.00 176.83 176.98 1ao7 n TRP 101 N -2.56 0.00 -1.37 4.77 7.02 -1.26 -5.01 117.44 119.02 1ao7 n TRP 101 Ca 0.02 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.19 1ao7 n TRP 101 Cb 0.26 0.00 0.10 0.00 -2.42 0.00 0.00 31.31 29.26 1ao7 n TRP 101 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1ao7 s GLY 102 N -0.95 1.64 0.03 6.99 0.00 -0.73 -5.02 107.32 109.28 1ao7 s GLY 102 Ca 0.13 -0.01 -0.22 0.00 0.00 0.00 0.00 44.72 44.63 1ao7 s GLY 102 CO 0.14 0.40 0.64 0.54 0.00 0.00 0.00 173.10 174.83 1ao7 s LYS 103 N -5.01 4.36 0.24 2.90 1.02 -1.26 -4.88 119.74 117.11 1ao7 s LYS 103 Ca 0.61 0.83 -0.30 0.00 0.02 0.00 0.00 55.97 57.14 1ao7 s LYS 103 Cb -0.16 -3.33 -0.09 0.00 -0.52 0.00 0.00 37.83 33.73 1ao7 s LYS 103 CO 0.56 0.40 1.04 -0.51 -0.92 0.00 0.00 175.35 175.91 1ao7 s LEU 104 N -0.34 4.57 -0.08 3.17 2.01 -1.26 -4.67 118.68 122.07 1ao7 s LEU 104 Ca 0.33 2.10 0.01 0.00 0.01 0.00 0.00 54.13 56.57 1ao7 s LEU 104 Cb -0.19 -3.61 0.02 0.00 0.01 0.00 0.00 46.19 42.41 1ao7 s LEU 104 CO 0.19 -0.05 -0.08 -1.10 1.01 0.00 0.00 176.35 176.33 1ao7 s GLN 105 N -1.07 1.41 0.33 1.70 -0.21 -0.93 -4.96 119.66 115.93 1ao7 s GLN 105 Ca 0.44 -0.26 0.07 0.00 0.02 0.00 0.00 55.36 55.64 1ao7 s GLN 105 Cb -0.29 -1.36 -0.02 0.00 1.00 0.00 0.00 33.01 32.33 1ao7 s GLN 105 CO 0.36 -0.14 0.31 -0.06 -2.12 0.00 0.00 175.29 173.64 1ao7 s PHE 106 N 1.25 2.97 0.56 0.91 0.40 -1.25 -1.21 117.98 121.61 1ao7 s PHE 106 Ca -0.04 -0.26 0.01 0.00 -0.60 0.00 0.00 56.93 56.03 1ao7 s PHE 106 Cb -0.14 -1.79 0.03 0.00 0.51 0.00 0.00 43.02 41.64 1ao7 s PHE 106 CO -0.03 0.19 0.79 0.20 0.70 0.00 0.00 175.22 177.07 1ao7 s GLY 107 N -4.01 1.82 0.63 4.36 0.00 0.11 -4.51 107.32 105.72 1ao7 s GLY 107 Ca 0.41 -1.31 0.39 0.00 0.00 0.00 0.00 44.72 44.21 1ao7 s GLY 107 CO 0.27 -1.02 2.30 0.00 0.00 0.00 0.00 173.10 174.66 1ao7 h ALA 108 N 0.04 1.17 0.00 3.20 0.00 -1.91 -3.43 119.26 118.32 1ao7 h ALA 108 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ao7 h ALA 108 Cb 1.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1ao7 h ALA 108 CO 0.52 0.01 0.00 0.41 0.00 0.00 0.00 179.25 180.20 1ao7 n GLY 109 N -1.05 1.87 3.16 0.00 0.00 -1.26 -5.04 105.19 102.87 1ao7 n GLY 109 Ca -0.03 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 44.12 1ao7 n GLY 109 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ao7 s THR 110 N -1.05 2.01 -0.08 2.61 -1.32 -0.49 -4.86 115.64 112.47 1ao7 s THR 110 Ca 0.00 -0.95 -0.26 0.00 -1.21 0.00 0.00 61.69 59.27 1ao7 s THR 110 Cb 0.00 -1.78 -0.03 0.00 -1.51 0.00 0.00 72.50 69.18 1ao7 s THR 110 CO 0.00 0.54 0.84 -1.58 -2.21 0.00 0.00 174.62 172.21 1ao7 s GLN 111 N 0.86 4.44 -0.13 7.08 0.74 -1.24 -1.18 119.66 130.23 1ao7 s GLN 111 Ca -0.06 1.11 0.01 0.00 0.05 0.00 0.00 55.36 56.47 1ao7 s GLN 111 Cb -0.15 -3.49 -0.01 0.00 1.10 0.00 0.00 33.01 30.46 1ao7 s GLN 111 CO -0.03 -0.10 -0.17 0.08 -0.55 0.00 0.00 175.29 174.53 1ao7 s VAL 112 N 1.29 2.60 -0.21 1.34 1.01 -0.69 0.36 120.40 126.10 1ao7 s VAL 112 Ca 0.43 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1ao7 s VAL 112 Cb -0.18 -2.07 0.05 0.00 0.00 0.00 0.00 36.38 34.18 1ao7 s VAL 112 CO 0.20 0.53 -0.07 0.68 0.00 0.00 0.00 175.10 176.44 1ao7 s VAL 113 N 0.52 1.52 -0.61 2.92 -7.23 -0.43 -2.46 120.40 114.63 1ao7 s VAL 113 Ca -0.11 -1.08 -0.18 0.00 -1.81 0.00 0.00 61.98 58.79 1ao7 s VAL 113 Cb -0.16 -1.71 0.11 0.00 0.56 0.00 0.00 36.38 35.18 1ao7 s VAL 113 CO 0.04 0.02 0.70 -0.69 -0.31 0.00 0.00 175.10 174.87 1ao7 s VAL 114 N 1.42 4.89 0.25 1.32 1.01 -1.26 -1.45 120.40 126.58 1ao7 s VAL 114 Ca -0.04 -1.13 -0.30 0.00 0.00 0.00 0.00 61.98 60.52 1ao7 s VAL 114 Cb -0.18 -4.49 -0.09 0.00 0.00 0.00 0.00 36.38 31.63 1ao7 s VAL 114 CO -0.07 -1.11 1.13 0.28 0.00 0.00 0.00 175.10 175.32 1ao7 s THR 115 N 2.47 3.54 0.31 3.92 -1.32 0.15 -4.35 115.64 120.35 1ao7 s THR 115 Ca 0.12 1.45 -0.19 0.00 -1.21 0.00 0.00 61.69 61.85 1ao7 s THR 115 Cb -0.23 -3.92 -0.09 0.00 -1.51 0.00 0.00 72.50 66.74 1ao7 s THR 115 CO 0.05 0.31 0.81 -2.16 -2.21 0.00 0.00 174.62 171.41 1ao7 s PRO 116 N -1.04 4.22 -0.55 7.08 0.04 -1.26 0.10 135.00 143.60 1ao7 s PRO 116 Ca 0.47 0.93 -0.27 0.00 0.04 0.00 0.00 61.00 62.16 1ao7 s PRO 116 Cb -0.32 -2.59 -0.01 0.00 0.04 0.00 0.00 34.50 31.62 1ao7 s PRO 116 CO 0.40 0.22 1.71 -0.51 0.04 0.00 0.00 177.00 178.86 1ao7 s ASP 117 N -1.94 5.64 -0.13 6.66 1.11 -1.26 -4.87 116.67 121.88 1ao7 s ASP 117 Ca 0.51 0.48 -0.11 0.00 0.18 0.00 0.00 52.55 53.61 1ao7 s ASP 117 Cb -0.13 -2.53 -0.05 0.00 1.07 0.00 0.00 42.92 41.27 1ao7 s ASP 117 CO 0.19 -2.06 0.23 0.27 1.18 0.00 0.00 175.17 174.98 1ao7 s ILE 118 N 7.76 5.35 -2.50 0.77 -4.36 -1.26 -4.99 121.20 121.96 1ao7 s ILE 118 Ca 0.64 0.42 0.27 0.00 -0.26 0.00 0.00 60.65 61.72 1ao7 s ILE 118 Cb -0.14 -3.54 0.53 0.00 1.25 0.00 0.00 42.46 40.56 1ao7 s ILE 118 CO 0.24 0.51 1.71 0.00 0.24 0.00 0.00 174.94 177.64 1ao7 n GLN 119 N 2.73 1.70 -2.70 0.37 1.13 -1.26 -4.90 117.38 114.45 1ao7 n GLN 119 Ca -0.16 -1.02 -0.01 0.00 -1.94 0.00 0.00 57.00 53.88 1ao7 n GLN 119 Cb 0.53 -1.47 0.02 0.00 0.11 0.00 0.00 30.24 29.43 1ao7 n GLN 119 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1ao7 s ASN 120 N -1.97 -0.22 0.00 1.08 0.01 -1.26 -5.37 114.94 107.21 1ao7 s ASN 120 Ca 0.37 -0.18 0.00 0.00 -0.71 0.00 0.00 52.86 52.34 1ao7 s ASN 120 Cb 0.21 0.28 0.00 0.00 0.41 0.00 0.00 41.25 42.15 1ao7 s ASN 120 CO 0.33 -0.02 0.47 -0.81 -1.51 0.00 0.00 177.10 175.56