#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uht s SER 2 N 0.00 5.73 0.09 1.61 0.01 -1.26 -5.03 113.70 114.85 1uht s SER 2 Ca 0.00 -1.32 -0.25 0.00 1.31 0.00 0.00 55.95 55.69 1uht s SER 2 Cb 0.00 -2.02 0.08 0.00 0.21 0.00 0.00 66.02 64.29 1uht s SER 2 CO 0.00 -0.50 0.70 -0.44 0.41 0.00 0.00 173.24 173.40 1uht s SER 3 N 2.00 -0.51 1.05 2.44 0.01 -1.26 -5.16 113.70 112.26 1uht s SER 3 Ca 0.03 0.07 -0.19 0.00 1.31 0.00 0.00 55.95 57.17 1uht s SER 3 Cb -0.22 0.53 0.01 0.00 0.21 0.00 0.00 66.02 66.55 1uht s SER 3 CO 0.04 -0.83 -0.25 0.61 0.41 0.00 0.00 173.24 173.23 1uht n GLY 4 N -0.21 -2.69 0.29 3.44 0.00 -1.26 -4.98 105.19 99.78 1uht n GLY 4 Ca -0.15 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 45.09 1uht n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uht n SER 5 N -0.18 1.72 -3.33 1.61 3.41 -1.26 -5.00 113.62 110.58 1uht n SER 5 Ca 0.01 0.29 -0.08 0.00 -0.26 0.00 0.00 58.87 58.83 1uht n SER 5 Cb 0.62 -0.66 -0.07 0.00 -0.26 0.00 0.00 64.21 63.84 1uht n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1uht s SER 6 N -6.22 0.09 0.00 4.04 0.15 -1.26 -5.16 113.70 105.34 1uht s SER 6 Ca -0.25 0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.68 1uht s SER 6 Cb 0.06 1.22 0.00 0.00 -1.71 0.00 0.00 66.02 65.58 1uht s SER 6 CO 0.36 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.11 1uht n GLY 7 N 5.37 0.42 3.45 9.45 0.00 -1.26 -5.12 105.19 117.50 1uht n GLY 7 Ca -0.03 -1.61 -0.09 0.00 0.00 0.00 0.00 46.02 44.29 1uht n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1uht s MET 8 N 0.47 0.56 0.38 1.61 -2.45 -1.26 -5.17 119.30 113.44 1uht s MET 8 Ca 0.00 0.99 0.08 0.00 -1.25 0.00 0.00 55.69 55.51 1uht s MET 8 Cb 0.00 0.08 -0.06 0.00 1.25 0.00 0.00 34.83 36.09 1uht s MET 8 CO 0.00 -0.15 0.03 0.14 1.05 0.00 0.00 175.02 176.09 1uht s VAL 9 N 1.42 2.27 0.26 10.11 -7.23 -1.26 -4.91 120.40 121.07 1uht s VAL 9 Ca -0.09 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 1uht s VAL 9 Cb -0.06 -2.88 0.00 0.00 0.56 0.00 0.00 36.38 33.99 1uht s VAL 9 CO -0.15 -0.09 0.00 0.41 -0.31 0.00 0.00 175.10 174.96 1uht n THR 10 N -0.99-11.15 -2.54 5.32 -1.04 -1.26 -4.85 114.28 97.77 1uht n THR 10 Ca -0.04 3.18 -0.35 0.00 -2.04 0.00 0.00 64.05 64.80 1uht n THR 10 Cb 0.65 -4.89 -0.04 0.00 -1.82 0.00 0.00 70.33 64.23 1uht n THR 10 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1uht s PRO 11 N -1.13 3.97 0.56 -2.82 0.04 -1.26 -4.69 135.00 129.67 1uht s PRO 11 Ca 0.00 1.44 -0.20 0.00 0.04 0.00 0.00 61.00 62.28 1uht s PRO 11 Cb 0.00 -2.30 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 1uht s PRO 11 CO 0.00 -0.30 1.19 0.45 0.04 0.00 0.00 177.00 178.38 1uht s SER 12 N -1.78 5.48 -0.33 6.66 0.15 0.65 -4.63 113.70 119.89 1uht s SER 12 Ca 0.63 2.34 -0.19 0.00 0.70 0.00 0.00 55.95 59.42 1uht s SER 12 Cb -0.19 -2.60 -0.00 0.00 -1.71 0.00 0.00 66.02 61.52 1uht s SER 12 CO 0.24 -1.39 0.59 -0.22 1.20 0.00 0.00 173.24 173.65 1uht s LEU 13 N -3.83 4.23 -0.36 3.45 2.96 -0.66 -1.20 118.68 123.27 1uht s LEU 13 Ca 0.74 0.20 -0.02 0.00 -0.22 0.00 0.00 54.13 54.83 1uht s LEU 13 Cb -0.29 -2.73 0.08 0.00 0.50 0.00 0.00 46.19 43.76 1uht s LEU 13 CO 0.32 -0.51 0.11 -0.60 -1.32 0.00 0.00 176.35 174.35 1uht s ARG 14 N 2.56 2.16 -0.47 1.98 3.52 0.40 -1.49 118.95 127.62 1uht s ARG 14 Ca 0.23 -1.57 -0.22 0.00 -0.13 0.00 0.00 55.73 54.04 1uht s ARG 14 Cb -0.15 -3.39 0.03 0.00 -1.56 0.00 0.00 34.95 29.88 1uht s ARG 14 CO 0.13 -0.86 0.73 -0.51 -0.81 0.00 0.00 175.30 173.97 1uht s LEU 15 N 1.18 4.45 -0.24 -0.88 1.43 -0.94 -1.11 118.68 122.57 1uht s LEU 15 Ca 0.03 -0.38 -0.11 0.00 -1.03 0.00 0.00 54.13 52.63 1uht s LEU 15 Cb -0.21 -2.76 -0.05 0.00 0.03 0.00 0.00 46.19 43.20 1uht s LEU 15 CO -0.03 -0.91 0.20 -0.69 0.23 0.00 0.00 176.35 175.16 1uht s VAL 16 N 3.09 5.33 -1.02 -1.59 1.01 0.38 -1.51 120.40 126.10 1uht s VAL 16 Ca 0.24 0.27 -0.22 0.00 0.00 0.00 0.00 61.98 62.28 1uht s VAL 16 Cb -0.14 -3.54 0.07 0.00 0.00 0.00 0.00 36.38 32.77 1uht s VAL 16 CO 0.19 0.33 1.40 -0.36 0.00 0.00 0.00 175.10 176.65 1uht s PHE 17 N 1.13 2.69 0.22 5.22 0.08 0.43 0.82 117.98 128.57 1uht s PHE 17 Ca 0.09 -1.02 0.10 0.00 0.12 0.00 0.00 56.93 56.22 1uht s PHE 17 Cb -0.14 -4.61 0.20 0.00 -0.57 0.00 0.00 43.02 37.90 1uht s PHE 17 CO 0.05 -1.83 1.52 -0.39 -0.10 0.00 0.00 175.22 174.47 1uht h VAL 18 N 6.49 1.51 -4.60 -0.44 -1.51 -1.64 0.96 116.25 117.01 1uht h VAL 18 Ca 0.21 -2.48 -0.43 0.00 -1.23 0.00 0.00 66.70 62.76 1uht h VAL 18 Cb 1.00 2.34 -0.14 0.00 -2.13 0.00 0.00 31.29 32.37 1uht h VAL 18 CO 1.36 0.71 -0.52 -0.54 -1.23 0.00 0.00 177.57 177.34 1uht s LYS 19 N -3.35 1.65 0.11 5.19 1.02 -0.92 -4.65 119.74 118.79 1uht s LYS 19 Ca -0.01 -1.95 0.00 0.00 0.02 0.00 0.00 55.97 54.04 1uht s LYS 19 Cb 0.12 0.21 0.00 0.00 -0.52 0.00 0.00 37.83 37.64 1uht s LYS 19 CO 0.78 -0.57 0.00 0.41 -0.92 0.00 0.00 175.35 175.05 1uht n GLY 20 N -0.57 -1.77 0.24 -3.33 0.00 0.29 -3.24 105.19 96.81 1uht n GLY 20 Ca 0.05 -1.99 0.14 0.00 0.00 0.00 0.00 46.02 44.22 1uht n GLY 20 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uht h PRO 21 N 0.00 0.00 -0.30 1.61 0.13 -1.83 -2.68 132.00 128.93 1uht h PRO 21 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1uht h PRO 21 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1uht h PRO 21 CO 0.00 0.04 0.00 0.54 -0.23 0.00 0.00 178.00 178.35 1uht n ARG 22 N -3.13 2.36 -1.45 0.86 1.74 -1.26 -4.97 116.66 110.82 1uht n ARG 22 Ca 0.02 -2.05 -0.63 0.00 -0.77 0.00 0.00 57.85 54.42 1uht n ARG 22 Cb 0.43 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.27 1uht n ARG 22 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1uht n GLU 23 N 1.29 0.00 0.00 5.56 0.00 -1.01 0.28 120.64 126.76 1uht n GLU 23 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.34 1uht n GLU 23 Cb 0.56 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.51 1uht n GLU 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1uht n GLY 24 N 6.05 0.84 3.88 8.31 0.00 0.33 -4.96 105.19 119.64 1uht n GLY 24 Ca 0.45 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.24 1uht n GLY 24 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uht s ASP 25 N -1.18 5.88 -0.09 1.61 1.01 0.14 -4.92 116.67 119.12 1uht s ASP 25 Ca 0.00 -0.08 -0.22 0.00 0.71 0.00 0.00 52.55 52.96 1uht s ASP 25 Cb 0.00 -1.62 0.05 0.00 1.01 0.00 0.00 42.92 42.36 1uht s ASP 25 CO 0.00 -0.02 0.51 0.00 0.21 0.00 0.00 175.17 175.87 1uht s ALA 26 N -1.98 -1.30 0.33 5.23 0.00 -1.26 0.16 121.76 122.94 1uht s ALA 26 Ca 0.33 1.07 0.03 0.00 0.00 0.00 0.00 51.96 53.39 1uht s ALA 26 Cb -0.09 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1uht s ALA 26 CO 0.26 -0.29 0.10 -0.51 0.00 0.00 0.00 175.76 175.32 1uht s LEU 27 N -0.72 1.95 -0.05 0.00 1.43 -0.57 -4.98 118.68 115.73 1uht s LEU 27 Ca -0.08 -1.48 -0.11 0.00 -1.03 0.00 0.00 54.13 51.43 1uht s LEU 27 Cb -0.03 -0.15 0.02 0.00 0.03 0.00 0.00 46.19 46.06 1uht s LEU 27 CO 0.05 -0.76 0.27 1.51 0.23 0.00 0.00 176.35 177.66 1uht s ASP 28 N -3.47 -0.21 0.06 2.29 -4.77 -1.26 -2.21 116.67 107.11 1uht s ASP 28 Ca 0.33 0.27 -0.08 0.00 -3.30 0.00 0.00 52.55 49.76 1uht s ASP 28 Cb 0.06 0.42 -0.00 0.00 -1.09 0.00 0.00 42.92 42.32 1uht s ASP 28 CO 0.15 -0.28 0.18 -0.31 0.70 0.00 0.00 175.17 175.61 1uht s TYR 29 N -0.66 0.13 0.69 2.11 1.51 -0.55 -4.97 117.35 115.60 1uht s TYR 29 Ca -0.08 -0.48 -0.11 0.00 -1.01 0.00 0.00 57.07 55.40 1uht s TYR 29 Cb -0.04 -0.07 0.00 0.00 -0.11 0.00 0.00 41.96 41.75 1uht s TYR 29 CO 0.02 -0.48 1.07 0.15 -1.11 0.00 0.00 175.55 175.20 1uht s LYS 30 N -3.26 2.99 0.08 -0.62 1.02 -1.26 -1.66 119.74 117.03 1uht s LYS 30 Ca 0.00 0.65 -0.30 0.00 0.02 0.00 0.00 55.97 56.34 1uht s LYS 30 Cb 0.02 -2.02 -0.06 0.00 -0.52 0.00 0.00 37.83 35.25 1uht s LYS 30 CO -0.08 -0.98 1.16 -1.25 -0.92 0.00 0.00 175.35 173.27 1uht s PRO 31 N -5.22 4.48 0.00 -1.68 0.04 -1.26 -3.12 135.00 128.23 1uht s PRO 31 Ca 0.58 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.34 1uht s PRO 31 Cb -0.12 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.08 1uht s PRO 31 CO 0.53 -0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.82 1uht n GLY 32 N 2.91 0.91 3.13 0.56 0.00 -1.26 -5.06 105.19 106.37 1uht n GLY 32 Ca 0.07 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1uht n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uht s SER 33 N -2.09 4.96 0.19 1.61 0.01 -1.18 -4.90 113.70 112.28 1uht s SER 33 Ca 0.00 -1.64 -0.32 0.00 1.31 0.00 0.00 55.95 55.30 1uht s SER 33 Cb 0.00 -1.72 -0.11 0.00 0.21 0.00 0.00 66.02 64.39 1uht s SER 33 CO 0.00 -0.36 1.72 -0.89 0.41 0.00 0.00 173.24 174.12 1uht s THR 34 N 1.16 2.22 -0.36 1.44 2.01 -1.26 -4.76 115.64 116.08 1uht s THR 34 Ca 0.01 0.10 -0.01 0.00 0.31 0.00 0.00 61.69 62.09 1uht s THR 34 Cb -0.21 -3.06 0.09 0.00 0.01 0.00 0.00 72.50 69.33 1uht s THR 34 CO -0.03 0.01 0.11 -0.63 -0.69 0.00 0.00 174.62 173.38 1uht s ILE 35 N 1.45 3.03 -0.48 1.82 1.01 0.37 -4.90 121.20 123.50 1uht s ILE 35 Ca 0.75 -1.85 -0.27 0.00 0.00 0.00 0.00 60.65 59.28 1uht s ILE 35 Cb -0.48 -2.97 0.03 0.00 0.01 0.00 0.00 42.46 39.05 1uht s ILE 35 CO 0.33 -0.46 1.05 -0.13 0.00 0.00 0.00 174.94 175.72 1uht s ARG 36 N 1.15 3.62 -0.30 2.79 0.52 -1.26 0.38 118.95 125.85 1uht s ARG 36 Ca 0.04 0.36 -0.15 0.00 -0.52 0.00 0.00 55.73 55.45 1uht s ARG 36 Cb -0.21 -3.93 -0.03 0.00 0.52 0.00 0.00 34.95 31.30 1uht s ARG 36 CO -0.04 -1.34 0.36 0.08 0.02 0.00 0.00 175.30 174.39 1uht s VAL 37 N 4.18 5.18 0.00 3.52 1.01 -0.77 -0.88 120.40 132.63 1uht s VAL 37 Ca 0.43 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.77 1uht s VAL 37 Cb -0.08 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1uht s VAL 37 CO 0.29 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.07 1uht n GLY 38 N 4.81 5.35 0.02 4.51 0.00 0.44 -2.39 105.19 117.93 1uht n GLY 38 Ca -0.09 -1.11 0.04 0.00 0.00 0.00 0.00 46.02 44.86 1uht n GLY 38 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1uht n ARG 39 N 0.00 0.73 -4.97 1.61 0.63 -0.74 -0.35 116.66 113.57 1uht n ARG 39 Ca 0.00 -0.11 -0.32 0.00 -0.92 0.00 0.00 57.85 56.50 1uht n ARG 39 Cb 0.00 -1.36 -0.14 0.00 0.45 0.00 0.00 32.46 31.41 1uht n ARG 39 CO 0.00 0.00 0.00 0.96 -2.51 0.00 0.00 177.63 176.08 1uht s ILE 40 N -2.90 2.79 -0.02 5.15 -4.36 -1.26 -3.93 121.20 116.66 1uht s ILE 40 Ca -0.06 -0.81 0.15 0.00 -0.26 0.00 0.00 60.65 59.68 1uht s ILE 40 Cb 0.09 -2.09 0.05 0.00 1.25 0.00 0.00 42.46 41.76 1uht s ILE 40 CO 0.62 0.57 1.52 -0.37 0.24 0.00 0.00 174.94 177.52 1uht h VAL 41 N 4.74 0.98 0.00 8.37 -1.51 -1.87 -3.37 116.25 123.58 1uht h VAL 41 Ca -0.38 -2.15 0.00 0.00 -1.23 0.00 0.00 66.70 62.94 1uht h VAL 41 Cb 1.17 2.32 0.00 0.00 -2.13 0.00 0.00 31.29 32.65 1uht h VAL 41 CO 0.51 0.51 0.00 0.54 -1.23 0.00 0.00 177.57 177.90 1uht n ARG 42 N -3.34 0.00 -2.49 5.19 3.00 -1.26 -2.06 116.66 115.71 1uht n ARG 42 Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.44 1uht n ARG 42 Cb 0.69 -0.28 0.01 0.00 0.00 0.00 0.00 32.46 32.88 1uht n ARG 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1uht n GLY 43 N 0.00 5.49 3.53 -0.13 0.00 -1.26 -4.90 105.19 107.92 1uht n GLY 43 Ca 0.00 -2.38 -0.08 0.00 0.00 0.00 0.00 46.02 43.56 1uht n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1uht s ASN 44 N -0.64 -0.31 -0.05 1.61 0.01 -0.87 -5.00 114.94 109.67 1uht s ASN 44 Ca 0.42 0.03 -0.22 0.00 -0.71 0.00 0.00 52.86 52.38 1uht s ASN 44 Cb 0.15 0.32 -0.31 0.00 0.41 0.00 0.00 41.25 41.82 1uht s ASN 44 CO -0.05 -0.51 0.89 -0.33 -1.51 0.00 0.00 177.10 175.58 1uht h GLU 45 N 2.05 0.28 -4.89 -0.60 4.39 -1.26 -3.44 114.58 111.11 1uht h GLU 45 Ca -0.19 -0.47 -0.43 0.00 0.34 0.00 0.00 59.36 58.61 1uht h GLU 45 Cb 1.22 0.18 -0.29 0.00 -0.10 0.00 0.00 28.75 29.75 1uht h GLU 45 CO 0.29 1.23 -0.79 0.42 -1.16 0.00 0.00 179.01 178.99 1uht s ILE 46 N -2.41 0.87 -0.01 3.13 1.01 -0.84 -4.97 121.20 117.98 1uht s ILE 46 Ca -0.14 -0.46 0.03 0.00 0.00 0.00 0.00 60.65 60.09 1uht s ILE 46 Cb 0.01 -0.74 -0.01 0.00 0.01 0.00 0.00 42.46 41.73 1uht s ILE 46 CO 0.82 0.25 -0.12 0.00 0.00 0.00 0.00 174.94 175.90 1uht s ALA 47 N -0.15 0.99 -0.02 9.38 0.00 -1.26 -0.42 121.76 130.29 1uht s ALA 47 Ca 0.02 -0.48 0.05 0.00 0.00 0.00 0.00 51.96 51.55 1uht s ALA 47 Cb -0.05 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 1uht s ALA 47 CO -0.00 0.22 -0.17 0.42 0.00 0.00 0.00 175.76 176.23 1uht s ILE 48 N -0.16 2.81 -0.96 0.00 1.01 0.53 -4.89 121.20 119.53 1uht s ILE 48 Ca 0.02 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 59.73 1uht s ILE 48 Cb -0.06 -2.11 0.31 0.00 0.01 0.00 0.00 42.46 40.61 1uht s ILE 48 CO -0.00 0.51 1.47 0.29 0.00 0.00 0.00 174.94 177.21 1uht n LYS 49 N 2.08 4.49 -0.00 2.79 4.76 -1.26 -4.31 118.16 126.70 1uht n LYS 49 Ca -0.17 -4.65 0.03 0.00 -2.87 0.00 0.00 58.31 50.65 1uht n LYS 49 Cb 0.52 -2.44 -0.03 0.00 -1.84 0.00 0.00 35.03 31.24 1uht n LYS 49 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1uht n ASP 50 N 0.60 0.37 0.00 4.39 2.03 -1.26 -4.69 116.55 117.99 1uht n ASP 50 Ca 0.35 -0.61 0.00 0.00 0.52 0.00 0.00 54.79 55.05 1uht n ASP 50 Cb 0.32 1.01 0.00 0.00 -0.72 0.00 0.00 41.12 41.73 1uht n ASP 50 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1uht n ALA 51 N -1.15 0.00 0.33 -1.67 0.00 -1.26 -4.60 120.51 112.15 1uht n ALA 51 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.59 1uht n ALA 51 Cb 0.09 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.25 1uht n ALA 51 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1uht h GLY 52 N 0.00 0.00 -4.93 0.00 0.00 -1.94 -3.39 103.07 92.81 1uht h GLY 52 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1uht h GLY 52 CO 0.00 0.00 -0.29 -0.42 0.00 0.00 0.00 176.54 175.83 1uht s ILE 53 N -4.10 5.17 0.17 2.60 1.01 -1.26 -4.39 121.20 120.40 1uht s ILE 53 Ca -0.03 0.48 0.06 0.00 0.00 0.00 0.00 60.65 61.16 1uht s ILE 53 Cb 0.08 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 1uht s ILE 53 CO 0.25 0.44 0.09 -0.44 0.00 0.00 0.00 174.94 175.28 1uht s SER 54 N -1.45 5.28 0.29 3.58 0.01 -1.26 -4.51 113.70 115.64 1uht s SER 54 Ca 0.27 -0.22 -0.02 0.00 1.31 0.00 0.00 55.95 57.29 1uht s SER 54 Cb -0.14 -1.30 0.63 0.00 0.21 0.00 0.00 66.02 65.41 1uht s SER 54 CO 0.14 0.07 1.51 0.35 0.41 0.00 0.00 173.24 175.73 1uht n THR 55 N -0.29 -0.41 -3.36 1.44 -2.24 -1.26 -1.23 114.28 106.94 1uht n THR 55 Ca -0.09 2.16 -0.28 0.00 -2.27 0.00 0.00 64.05 63.57 1uht n THR 55 Cb 0.55 -3.10 -0.07 0.00 -2.10 0.00 0.00 70.33 65.61 1uht n THR 55 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1uht n LYS 56 N -5.50 2.75 0.09 -0.78 4.01 -1.26 -3.62 118.16 113.85 1uht n LYS 56 Ca 0.20 -4.68 -0.04 0.00 -0.51 0.00 0.00 58.31 53.28 1uht n LYS 56 Cb 0.65 -2.28 -0.02 0.00 -0.51 0.00 0.00 35.03 32.87 1uht n LYS 56 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1uht h HIS 57 N 4.22 -0.25 -3.76 2.13 2.76 -1.26 -3.45 115.15 115.54 1uht h HIS 57 Ca 0.20 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.26 1uht h HIS 57 Cb 0.65 0.08 -0.09 0.00 1.55 0.00 0.00 27.41 29.60 1uht h HIS 57 CO 0.75 -0.16 -0.15 -0.48 -1.30 0.00 0.00 177.93 176.60 1uht s LEU 58 N -6.42 0.48 -0.00 0.26 0.05 -1.01 -2.69 118.68 109.34 1uht s LEU 58 Ca -0.04 -1.06 0.03 0.00 0.05 0.00 0.00 54.13 53.10 1uht s LEU 58 Cb 0.00 1.67 -0.01 0.00 -2.05 0.00 0.00 46.19 45.81 1uht s LEU 58 CO 0.12 -1.17 -0.09 0.00 -0.55 0.00 0.00 176.35 174.66 1uht s ARG 59 N -3.79 0.68 -0.02 1.48 1.70 -1.18 -1.85 118.95 115.98 1uht s ARG 59 Ca 0.25 -0.34 0.01 0.00 -0.47 0.00 0.00 55.73 55.18 1uht s ARG 59 Cb -0.00 -0.65 -0.03 0.00 -0.57 0.00 0.00 34.95 33.69 1uht s ARG 59 CO 0.11 0.18 -0.01 0.42 -1.08 0.00 0.00 175.30 174.92 1uht s ILE 60 N -0.27 4.12 0.26 4.99 1.01 0.16 -3.18 121.20 128.28 1uht s ILE 60 Ca 0.03 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 60.00 1uht s ILE 60 Cb -0.04 -2.80 0.00 0.00 0.01 0.00 0.00 42.46 39.63 1uht s ILE 60 CO -0.00 0.44 0.53 -1.83 0.00 0.00 0.00 174.94 174.08 1uht s GLU 61 N -1.36 1.61 0.15 2.79 4.04 -0.68 0.14 118.70 125.39 1uht s GLU 61 Ca 0.18 -1.21 0.07 0.00 0.04 0.00 0.00 54.97 54.05 1uht s GLU 61 Cb -0.11 0.50 -0.04 0.00 0.02 0.00 0.00 34.13 34.50 1uht s GLU 61 CO 0.08 -0.69 -0.15 0.45 -1.84 0.00 0.00 175.26 173.11 1uht s SER 62 N -3.00 2.23 0.07 0.83 0.15 -1.26 0.32 113.70 113.04 1uht s SER 62 Ca 0.20 -0.88 -0.26 0.00 0.70 0.00 0.00 55.95 55.71 1uht s SER 62 Cb -0.02 -0.09 0.08 0.00 -1.71 0.00 0.00 66.02 64.28 1uht s SER 62 CO 0.09 -0.15 0.70 -1.81 1.20 0.00 0.00 173.24 173.27 1uht s ASP 63 N -2.75 -0.53 -1.47 5.45 1.01 0.28 -4.75 116.67 113.91 1uht s ASP 63 Ca 0.14 0.14 -0.04 0.00 0.71 0.00 0.00 52.55 53.50 1uht s ASP 63 Cb -0.03 0.53 0.00 0.00 1.01 0.00 0.00 42.92 44.43 1uht s ASP 63 CO 0.04 -0.80 0.19 -0.24 0.21 0.00 0.00 175.17 174.56 1uht n SER 64 N -0.08 -0.01 -4.02 0.27 2.88 -1.26 0.11 113.62 111.50 1uht n SER 64 Ca -0.15 -1.21 -0.31 0.00 -1.33 0.00 0.00 58.87 55.87 1uht n SER 64 Cb 0.63 -1.98 -0.00 0.00 -0.75 0.00 0.00 64.21 62.11 1uht n SER 64 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uht n GLY 65 N -2.38 -0.40 3.47 0.46 0.00 -1.26 -4.94 105.19 100.15 1uht n GLY 65 Ca -0.30 0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 1uht n GLY 65 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1uht s ASN 66 N -3.63 -0.07 -0.01 1.61 0.01 0.29 -4.72 114.94 108.43 1uht s ASN 66 Ca 0.49 -0.85 0.03 0.00 -0.71 0.00 0.00 52.86 51.82 1uht s ASN 66 Cb -0.26 0.52 -0.03 0.00 0.41 0.00 0.00 41.25 41.89 1uht s ASN 66 CO 0.88 -1.03 -0.08 0.26 -1.51 0.00 0.00 177.10 175.62 1uht s TRP 67 N -3.98 2.87 -0.02 2.20 0.52 -1.26 0.10 118.94 119.37 1uht s TRP 67 Ca 0.19 -0.05 -0.04 0.00 0.02 0.00 0.00 56.10 56.22 1uht s TRP 67 Cb 0.01 -1.62 0.00 0.00 -1.15 0.00 0.00 33.47 30.71 1uht s TRP 67 CO 0.04 0.35 0.09 0.14 0.02 0.00 0.00 176.95 177.59 1uht s VAL 68 N -0.95 0.05 0.09 4.03 -7.23 0.15 -0.20 120.40 116.34 1uht s VAL 68 Ca 0.16 -0.39 0.09 0.00 -1.81 0.00 0.00 61.98 60.03 1uht s VAL 68 Cb -0.11 -0.27 -0.03 0.00 0.56 0.00 0.00 36.38 36.53 1uht s VAL 68 CO 0.06 -0.22 -0.24 -0.51 -0.31 0.00 0.00 175.10 173.88 1uht s ILE 69 N -0.69 1.97 -0.05 -0.62 -1.16 -0.33 -1.68 121.20 118.63 1uht s ILE 69 Ca -0.08 -1.53 -0.03 0.00 -0.51 0.00 0.00 60.65 58.50 1uht s ILE 69 Cb -0.05 -1.74 0.03 0.00 0.61 0.00 0.00 42.46 41.31 1uht s ILE 69 CO 0.00 0.11 0.11 -1.58 -2.81 0.00 0.00 174.94 170.77 1uht s GLN 70 N -1.72 0.08 -0.39 3.50 0.74 -1.19 -2.75 119.66 117.92 1uht s GLN 70 Ca 0.10 0.26 -0.24 0.00 0.05 0.00 0.00 55.36 55.53 1uht s GLN 70 Cb -0.10 -0.11 0.02 0.00 1.10 0.00 0.00 33.01 33.92 1uht s GLN 70 CO 0.04 -0.11 0.85 0.34 -0.55 0.00 0.00 175.29 175.85 1uht s ASP 71 N 0.76 6.55 -0.90 6.67 2.15 -1.25 -3.08 116.67 127.59 1uht s ASP 71 Ca -0.06 0.30 -0.06 0.00 0.43 0.00 0.00 52.55 53.16 1uht s ASP 71 Cb -0.08 -2.42 -0.08 0.00 -0.30 0.00 0.00 42.92 40.04 1uht s ASP 71 CO -0.03 -0.85 2.37 0.18 -0.17 0.00 0.00 175.17 176.67 1uht n LEU 72 N 6.69 5.47 -3.75 -1.34 4.32 -1.10 -3.81 117.00 123.49 1uht n LEU 72 Ca 0.04 -3.09 -0.24 0.00 -0.02 0.00 0.00 56.01 52.71 1uht n LEU 72 Cb 0.48 -1.16 -0.07 0.00 -1.62 0.00 0.00 43.42 41.05 1uht n LEU 72 CO 0.57 0.98 -0.28 0.61 -1.22 0.00 0.00 177.39 178.06 1uht n GLY 73 N 3.53 -0.13 0.00 -0.72 0.00 -1.26 -4.82 105.19 101.79 1uht n GLY 73 Ca 0.49 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1uht n GLY 73 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uht n SER 74 N -1.83 0.00 0.08 1.61 3.41 -1.25 -4.94 113.62 110.71 1uht n SER 74 Ca -0.15 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.46 1uht n SER 74 Cb 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1uht n SER 74 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1uht n SER 75 N 0.00 -1.52 -0.02 4.04 7.64 -1.26 -4.97 113.62 117.53 1uht n SER 75 Ca 0.00 0.50 -0.15 0.00 1.01 0.00 0.00 58.87 60.23 1uht n SER 75 Cb 0.00 1.65 -0.12 0.00 -1.01 0.00 0.00 64.21 64.73 1uht n SER 75 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1uht h ASN 76 N 0.00 0.22 -3.50 6.43 2.35 -1.92 -3.50 115.58 115.66 1uht h ASN 76 Ca 0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 56.30 54.94 1uht h ASN 76 Cb 0.00 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1uht h ASN 76 CO 0.00 1.00 0.00 0.61 -1.65 0.00 0.00 177.43 177.39 1uht n GLY 77 N 1.14 3.41 3.89 2.83 0.00 -1.26 -5.10 105.19 110.10 1uht n GLY 77 Ca -0.10 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 1uht n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uht s THR 78 N -1.70 5.09 -0.01 2.61 2.01 -1.26 -4.66 115.64 117.72 1uht s THR 78 Ca 0.00 0.15 0.06 0.00 0.31 0.00 0.00 61.69 62.21 1uht s THR 78 Cb 0.00 -3.63 -0.02 0.00 0.01 0.00 0.00 72.50 68.86 1uht s THR 78 CO 0.00 -0.03 -0.20 -0.76 -0.69 0.00 0.00 174.62 172.94 1uht s LEU 79 N -2.81 2.06 -0.29 4.42 1.43 -0.37 0.15 118.68 123.27 1uht s LEU 79 Ca 0.43 -0.38 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 1uht s LEU 79 Cb -0.12 -1.00 0.08 0.00 0.03 0.00 0.00 46.19 45.19 1uht s LEU 79 CO 0.24 0.23 0.02 -0.22 0.23 0.00 0.00 176.35 176.85 1uht s LEU 80 N -0.57 3.28 0.00 1.79 2.96 0.12 -0.58 118.68 125.68 1uht s LEU 80 Ca 0.07 -1.65 0.00 0.00 -0.22 0.00 0.00 54.13 52.34 1uht s LEU 80 Cb -0.08 -1.27 0.00 0.00 0.50 0.00 0.00 46.19 45.34 1uht s LEU 80 CO -0.00 -0.33 0.00 0.59 -1.32 0.00 0.00 176.35 175.29 1uht n ASN 81 N 4.56 0.00 -2.72 3.68 3.02 0.14 -2.56 115.26 121.39 1uht n ASN 81 Ca -0.04 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.43 1uht n ASN 81 Cb 0.43 0.00 0.09 0.00 -0.61 0.00 0.00 39.78 39.69 1uht n ASN 81 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1uht n SER 82 N 1.39 -2.11 -3.65 6.41 7.64 -1.26 -4.96 113.62 117.07 1uht n SER 82 Ca 0.00 -3.26 -0.02 0.00 1.01 0.00 0.00 58.87 56.60 1uht n SER 82 Cb 0.00 1.70 -0.07 0.00 -1.01 0.00 0.00 64.21 64.84 1uht n SER 82 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1uht s ASN 83 N -1.09 -0.27 -0.16 6.43 2.47 -1.06 -5.13 114.94 116.13 1uht s ASN 83 Ca 0.21 0.45 -0.29 0.00 0.42 0.00 0.00 52.86 53.65 1uht s ASN 83 Cb 0.30 0.89 -0.01 0.00 -1.45 0.00 0.00 41.25 40.98 1uht s ASN 83 CO -0.07 -0.07 1.21 0.00 -3.72 0.00 0.00 177.10 174.45 1uht s ALA 84 N 0.83 3.65 1.21 1.71 0.00 -1.26 0.13 121.76 128.04 1uht s ALA 84 Ca -0.04 0.42 -0.17 0.00 0.00 0.00 0.00 51.96 52.18 1uht s ALA 84 Cb -0.04 -3.59 0.29 0.00 0.00 0.00 0.00 23.12 19.78 1uht s ALA 84 CO -0.12 -1.10 1.03 -0.51 0.00 0.00 0.00 175.76 175.06 1uht s LEU 85 N 3.29 0.40 0.11 0.00 1.43 0.12 -4.95 118.68 119.08 1uht s LEU 85 Ca 0.53 1.04 0.08 0.00 -1.03 0.00 0.00 54.13 54.75 1uht s LEU 85 Cb -0.21 -2.83 -0.04 0.00 0.03 0.00 0.00 46.19 43.15 1uht s LEU 85 CO 0.14 -4.30 -0.20 -0.62 0.23 0.00 0.00 176.35 171.60 1uht s ASP 86 N -3.21 2.44 -0.04 2.29 2.15 -1.26 -4.66 116.67 114.37 1uht s ASP 86 Ca 0.68 -0.70 -0.07 0.00 0.43 0.00 0.00 52.55 52.89 1uht s ASP 86 Cb -0.17 -0.13 -0.04 0.00 -0.30 0.00 0.00 42.92 42.28 1uht s ASP 86 CO 0.59 0.03 0.36 1.55 -0.17 0.00 0.00 175.17 177.53 1uht h PRO 87 N 3.99 -0.24 -0.10 4.34 0.13 -1.97 -3.30 132.00 134.84 1uht h PRO 87 Ca -0.45 0.02 0.03 0.00 -0.87 0.00 0.00 66.00 64.73 1uht h PRO 87 Cb 1.18 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1uht h PRO 87 CO 0.41 -0.16 0.08 0.93 -0.23 0.00 0.00 178.00 179.03 1uht h GLU 88 N -0.80 0.00 -6.08 0.86 5.08 -1.98 -3.42 114.58 108.24 1uht h GLU 88 Ca -0.03 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.74 1uht h GLU 88 Cb 0.19 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 1uht h GLU 88 CO 0.04 0.00 -0.35 0.99 -1.00 0.00 0.00 179.01 178.69 1uht s THR 89 N -4.91 5.22 0.01 1.13 2.01 -1.24 -5.10 115.64 112.75 1uht s THR 89 Ca -0.05 0.01 0.06 0.00 0.31 0.00 0.00 61.69 62.03 1uht s THR 89 Cb 0.17 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.04 1uht s THR 89 CO 0.64 0.12 -0.19 -0.94 -0.69 0.00 0.00 174.62 173.56 1uht s SER 90 N -2.29 2.29 0.23 3.53 1.04 -1.26 -4.33 113.70 112.91 1uht s SER 90 Ca 0.37 -0.41 0.12 0.00 0.48 0.00 0.00 55.95 56.51 1uht s SER 90 Cb -0.13 -0.23 -0.05 0.00 0.10 0.00 0.00 66.02 65.72 1uht s SER 90 CO 0.23 0.20 -0.21 -0.69 0.98 0.00 0.00 173.24 173.75 1uht s VAL 91 N -0.59 2.46 -0.21 5.02 1.01 -1.11 -5.01 120.40 121.96 1uht s VAL 91 Ca 0.07 -2.18 -0.16 0.00 0.00 0.00 0.00 61.98 59.72 1uht s VAL 91 Cb -0.08 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 1uht s VAL 91 CO 0.00 -0.24 0.40 0.54 0.00 0.00 0.00 175.10 175.80 1uht s ASN 92 N -3.05 6.41 0.79 3.32 2.20 -1.26 -1.19 114.94 122.16 1uht s ASN 92 Ca 0.25 0.48 -0.13 0.00 -0.94 0.00 0.00 52.86 52.53 1uht s ASN 92 Cb -0.07 -2.23 0.07 0.00 -2.00 0.00 0.00 41.25 37.03 1uht s ASN 92 CO 0.12 -0.10 1.18 -0.76 -2.94 0.00 0.00 177.10 174.60 1uht s LEU 93 N 1.44 3.14 0.02 3.54 1.43 0.72 -4.92 118.68 124.05 1uht s LEU 93 Ca 0.18 2.25 -0.03 0.00 -1.03 0.00 0.00 54.13 55.51 1uht s LEU 93 Cb -0.15 -4.58 -0.02 0.00 0.03 0.00 0.00 46.19 41.48 1uht s LEU 93 CO 0.08 -2.51 0.03 -0.83 0.23 0.00 0.00 176.35 173.35 1uht s GLY 94 N -2.37 0.20 -0.27 -3.19 0.00 -1.26 -4.68 107.32 95.75 1uht s GLY 94 Ca 0.71 -0.52 -0.28 0.00 0.00 0.00 0.00 44.72 44.62 1uht s GLY 94 CO 0.50 -0.62 1.91 -0.35 0.00 0.00 0.00 173.10 174.54 1uht s ASP 95 N -1.63 5.84 0.00 1.64 -1.08 -1.26 -1.09 116.67 119.08 1uht s ASP 95 Ca -0.13 1.55 0.00 0.00 -0.52 0.00 0.00 52.55 53.46 1uht s ASP 95 Cb -0.07 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.87 1uht s ASP 95 CO -0.01 -1.71 0.00 0.61 0.52 0.00 0.00 175.17 174.57 1uht n GLY 96 N 5.42 1.16 3.66 2.66 0.00 0.49 -4.98 105.19 113.60 1uht n GLY 96 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1uht n GLY 96 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uht s ASP 97 N -2.00 6.89 -0.20 1.61 1.11 -0.25 -4.82 116.67 119.01 1uht s ASP 97 Ca 0.00 1.10 -0.18 0.00 0.18 0.00 0.00 52.55 53.65 1uht s ASP 97 Cb 0.00 -2.44 -0.03 0.00 1.07 0.00 0.00 42.92 41.52 1uht s ASP 97 CO 0.00 -0.44 0.52 -0.69 1.18 0.00 0.00 175.17 175.74 1uht s VAL 98 N 2.42 5.11 -0.36 -1.27 1.01 -1.26 -1.03 120.40 125.02 1uht s VAL 98 Ca 0.36 0.96 -0.09 0.00 0.00 0.00 0.00 61.98 63.21 1uht s VAL 98 Cb -0.16 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.41 1uht s VAL 98 CO 0.10 0.18 0.16 -0.63 0.00 0.00 0.00 175.10 174.90 1uht s ILE 99 N 1.63 4.19 -0.47 2.22 1.01 0.29 0.27 121.20 130.34 1uht s ILE 99 Ca 0.24 -0.98 -0.16 0.00 0.00 0.00 0.00 60.65 59.75 1uht s ILE 99 Cb -0.15 -3.35 0.07 0.00 0.01 0.00 0.00 42.46 39.03 1uht s ILE 99 CO 0.10 -0.20 0.39 -0.54 0.00 0.00 0.00 174.94 174.69 1uht s LYS 100 N 1.48 2.98 0.31 2.79 1.02 0.25 -0.03 119.74 128.54 1uht s LYS 100 Ca 0.00 -1.30 0.06 0.00 0.02 0.00 0.00 55.97 54.76 1uht s LYS 100 Cb -0.19 -4.11 -0.06 0.00 -0.52 0.00 0.00 37.83 32.94 1uht s LYS 100 CO 0.05 -1.00 -0.02 -0.48 -0.92 0.00 0.00 175.35 172.97 1uht s LEU 101 N 1.68 2.47 0.00 3.17 2.34 -0.35 -1.24 118.68 126.75 1uht s LEU 101 Ca 0.05 -1.26 0.00 0.00 0.06 0.00 0.00 54.13 52.97 1uht s LEU 101 Cb -0.23 -0.62 0.00 0.00 -0.56 0.00 0.00 46.19 44.77 1uht s LEU 101 CO 0.07 -0.42 0.00 0.61 -1.06 0.00 0.00 176.35 175.56 1uht n GLY 102 N -0.67 2.54 0.00 -3.48 0.00 -1.26 -2.80 105.19 99.52 1uht n GLY 102 Ca -0.05 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1uht n GLY 102 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uht n GLU 103 N 13.54 0.00 -2.74 1.61 1.02 -1.26 -4.80 120.64 128.01 1uht n GLU 103 Ca 0.00 0.08 -0.25 0.00 -0.02 0.00 0.00 57.16 56.97 1uht n GLU 103 Cb 0.00 -0.40 -0.02 0.00 -0.02 0.00 0.00 31.44 31.01 1uht n GLU 103 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1uht n TYR 104 N -1.56 3.36 -4.72 -0.32 4.02 -1.26 -5.03 117.16 111.64 1uht n TYR 104 Ca 0.00 -3.54 -0.33 0.00 -0.01 0.00 0.00 57.90 54.02 1uht n TYR 104 Cb 0.00 -0.31 -0.16 0.00 -0.02 0.00 0.00 39.34 38.85 1uht n TYR 104 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1uht s THR 105 N -4.71 2.30 -0.05 -0.72 2.01 -1.12 -0.55 115.64 112.80 1uht s THR 105 Ca 0.47 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.59 1uht s THR 105 Cb 0.35 -1.93 0.00 0.00 0.01 0.00 0.00 72.50 70.93 1uht s THR 105 CO -0.15 0.54 -0.15 -0.44 -0.69 0.00 0.00 174.62 173.74 1uht s SER 106 N 0.71 1.93 -0.02 3.53 0.01 -1.20 -1.22 113.70 117.46 1uht s SER 106 Ca -0.09 -0.32 0.08 0.00 1.31 0.00 0.00 55.95 56.93 1uht s SER 106 Cb -0.16 -0.69 -0.02 0.00 0.21 0.00 0.00 66.02 65.36 1uht s SER 106 CO 0.01 0.10 -0.25 -0.63 0.41 0.00 0.00 173.24 172.88 1uht s ILE 107 N 0.31 2.16 -0.19 1.44 1.01 0.95 -1.86 121.20 125.02 1uht s ILE 107 Ca -0.09 -1.10 -0.04 0.00 0.00 0.00 0.00 60.65 59.42 1uht s ILE 107 Cb -0.13 -1.76 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 1uht s ILE 107 CO 0.03 0.56 -0.02 -0.22 0.00 0.00 0.00 174.94 175.29 1uht s LEU 108 N -0.69 3.17 -0.25 2.97 2.96 0.24 0.10 118.68 127.19 1uht s LEU 108 Ca 0.10 -0.22 -0.20 0.00 -0.22 0.00 0.00 54.13 53.59 1uht s LEU 108 Cb -0.10 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 1uht s LEU 108 CO -0.01 0.08 0.62 -0.69 -1.32 0.00 0.00 176.35 175.03 1uht s VAL 109 N 0.90 5.00 -0.03 1.68 1.01 -0.20 -0.47 120.40 128.29 1uht s VAL 109 Ca 0.00 1.11 0.04 0.00 0.00 0.00 0.00 61.98 63.13 1uht s VAL 109 Cb -0.14 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.31 1uht s VAL 109 CO 0.02 0.04 -0.16 0.20 0.00 0.00 0.00 175.10 175.20 1uht s ASN 110 N 1.46 1.95 -0.45 3.32 0.02 -0.27 0.19 114.94 121.16 1uht s ASN 110 Ca 0.26 -0.31 -0.16 0.00 -1.02 0.00 0.00 52.86 51.63 1uht s ASN 110 Cb -0.16 -0.45 0.05 0.00 0.02 0.00 0.00 41.25 40.72 1uht s ASN 110 CO 0.09 0.15 0.38 -0.36 0.02 0.00 0.00 177.10 177.38 1uht s PHE 111 N -0.06 3.23 -0.46 2.20 0.08 -1.26 -0.45 117.98 121.26 1uht s PHE 111 Ca -0.01 -0.78 -0.22 0.00 0.12 0.00 0.00 56.93 56.04 1uht s PHE 111 Cb -0.10 -2.99 0.03 0.00 -0.57 0.00 0.00 43.02 39.39 1uht s PHE 111 CO 0.01 -0.74 0.74 0.08 -0.10 0.00 0.00 175.22 175.22 1uht s VAL 112 N 1.71 4.70 0.42 -0.44 1.01 -0.35 -4.82 120.40 122.64 1uht s VAL 112 Ca 0.05 0.22 -0.22 0.00 0.00 0.00 0.00 61.98 62.03 1uht s VAL 112 Cb -0.22 -4.31 -0.10 0.00 0.00 0.00 0.00 36.38 31.76 1uht s VAL 112 CO 0.08 -0.73 1.00 -0.55 0.00 0.00 0.00 175.10 174.90 1uht s SER 113 N 2.23 6.77 0.63 3.32 0.15 -1.26 -0.26 113.70 125.28 1uht s SER 113 Ca 0.26 1.87 -0.08 0.00 0.70 0.00 0.00 55.95 58.70 1uht s SER 113 Cb -0.13 -2.56 0.01 0.00 -1.71 0.00 0.00 66.02 61.62 1uht s SER 113 CO 0.20 -0.48 0.97 -0.83 1.20 0.00 0.00 173.24 174.30 1uht s GLY 114 N -1.88 1.61 -0.42 9.45 0.00 -1.26 -4.95 107.32 109.87 1uht s GLY 114 Ca 0.61 -0.53 -0.29 0.00 0.00 0.00 0.00 44.72 44.51 1uht s GLY 114 CO 0.20 -0.22 1.41 2.56 0.00 0.00 0.00 173.10 177.05 1uht s PRO 115 N -5.12 3.56 0.13 2.90 0.04 -1.26 -4.29 135.00 130.96 1uht s PRO 115 Ca 0.55 0.91 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1uht s PRO 115 Cb -0.11 -4.03 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1uht s PRO 115 CO 0.48 -1.59 0.00 0.45 0.04 0.00 0.00 177.00 176.38 1uht n SER 116 N 8.87 -1.21 -4.18 6.66 2.88 -1.26 -4.97 113.62 120.41 1uht n SER 116 Ca 0.16 0.59 -0.36 0.00 -1.33 0.00 0.00 58.87 57.94 1uht n SER 116 Cb 0.48 1.46 -0.13 0.00 -0.75 0.00 0.00 64.21 65.27 1uht n SER 116 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1uht s SER 117 N -2.00 5.05 0.00 -3.46 0.15 -1.26 -5.20 113.70 106.98 1uht s SER 117 Ca 0.00 -1.43 0.30 0.00 0.70 0.00 0.00 55.95 55.52 1uht s SER 117 Cb 0.00 -1.77 1.37 0.00 -1.71 0.00 0.00 66.02 63.92 1uht s SER 117 CO 0.00 -0.34 1.93 0.61 1.20 0.00 0.00 173.24 176.64