#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 5.19 0.58 1.61 0.01 -1.26 -5.01 113.70 114.82 1uht s SER 2 Ca 0.00 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.03 1uht s SER 2 Cb 0.00 -1.26 0.00 0.00 0.21 0.00 0.00 66.02 64.97 1uht s SER 2 CO 0.00 0.09 0.00 -1.20 0.41 0.00 0.00 173.24 172.54 1uht n SER 3 N -0.14 -7.40 0.00 2.44 7.64 -1.26 -5.08 113.62 109.81 1uht n SER 3 Ca -0.09 1.34 0.00 0.00 1.01 0.00 0.00 58.87 61.13 1uht n SER 3 Cb 0.54 -4.64 0.00 0.00 -1.01 0.00 0.00 64.21 59.11 1uht n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uht n GLY 4 N -4.20 -0.79 3.79 0.23 0.00 -1.26 -5.14 105.19 97.82 1uht n GLY 4 Ca -0.09 0.64 -0.34 0.00 0.00 0.00 0.00 46.02 46.23 1uht n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uht s SER 5 N 2.00 5.96 0.23 1.61 0.15 -1.26 -4.91 113.70 117.47 1uht s SER 5 Ca 0.00 2.01 0.00 0.00 0.70 0.00 0.00 55.95 58.66 1uht s SER 5 Cb 0.00 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 1uht s SER 5 CO 0.00 -1.05 0.00 -0.24 1.20 0.00 0.00 173.24 173.15 1uht n SER 6 N -1.33 -1.54 0.00 5.45 2.88 -1.26 -5.15 113.62 112.67 1uht n SER 6 Ca 0.10 0.43 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1uht n SER 6 Cb 0.52 1.61 0.00 0.00 -0.75 0.00 0.00 64.21 65.59 1uht n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uht n GLY 7 N -0.34 6.72 3.77 0.46 0.00 -1.26 -5.18 105.19 109.36 1uht n GLY 7 Ca 0.00 -1.89 -0.04 0.00 0.00 0.00 0.00 46.02 44.09 1uht n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1uht s MET 8 N 1.35 1.27 0.04 1.61 0.00 -1.26 -5.05 119.30 117.27 1uht s MET 8 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 55.69 54.97 1uht s MET 8 Cb 0.00 0.42 0.00 0.00 0.00 0.00 0.00 34.83 35.25 1uht s MET 8 CO 0.00 -0.58 0.00 1.33 0.00 0.00 0.00 175.02 175.77 1uht n VAL 9 N -0.49 0.00 -3.95 5.16 0.24 -1.26 -5.08 118.33 112.95 1uht n VAL 9 Ca -0.06 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.95 1uht n VAL 9 Cb 0.60 -0.34 -0.16 0.00 -1.47 0.00 0.00 33.84 32.47 1uht n VAL 9 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1uht s THR 10 N -2.00 1.42 0.58 3.34 2.01 -1.26 -4.88 115.64 114.84 1uht s THR 10 Ca 0.00 -0.85 -0.16 0.00 0.31 0.00 0.00 61.69 60.99 1uht s THR 10 Cb 0.00 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.93 1uht s THR 10 CO 0.00 0.15 1.05 -2.16 -0.69 0.00 0.00 174.62 172.97 1uht s PRO 11 N 1.50 3.41 0.43 4.92 0.04 -1.26 -4.70 135.00 139.33 1uht s PRO 11 Ca -0.00 1.18 -0.23 0.00 0.04 0.00 0.00 61.00 61.98 1uht s PRO 11 Cb -0.16 -2.05 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 1uht s PRO 11 CO -0.08 -0.74 1.06 -1.12 0.04 0.00 0.00 177.00 176.17 1uht s SER 12 N -2.81 6.57 -0.43 6.66 0.01 -0.16 -4.57 113.70 118.98 1uht s SER 12 Ca 0.63 2.05 -0.21 0.00 1.31 0.00 0.00 55.95 59.73 1uht s SER 12 Cb -0.15 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.52 1uht s SER 12 CO 0.36 -0.62 0.64 -0.22 0.41 0.00 0.00 173.24 173.81 1uht s LEU 13 N -2.90 4.47 -0.33 2.44 1.98 -0.83 -2.01 118.68 121.50 1uht s LEU 13 Ca 0.61 -0.28 -0.04 0.00 -2.89 0.00 0.00 54.13 51.53 1uht s LEU 13 Cb -0.21 -2.74 0.05 0.00 0.66 0.00 0.00 46.19 43.95 1uht s LEU 13 CO 0.27 -0.76 0.07 -0.60 -1.89 0.00 0.00 176.35 173.43 1uht s ARG 14 N 2.81 2.47 -0.34 1.98 3.52 -0.48 -1.13 118.95 127.78 1uht s ARG 14 Ca 0.23 -1.29 -0.21 0.00 -0.13 0.00 0.00 55.73 54.33 1uht s ARG 14 Cb -0.14 -3.34 0.00 0.00 -1.56 0.00 0.00 34.95 29.91 1uht s ARG 14 CO 0.19 -0.69 0.67 -0.51 -0.81 0.00 0.00 175.30 174.15 1uht s LEU 15 N 1.30 4.20 -0.20 -0.88 1.43 -0.52 -1.74 118.68 122.27 1uht s LEU 15 Ca -0.02 0.28 -0.06 0.00 -1.03 0.00 0.00 54.13 53.30 1uht s LEU 15 Cb -0.20 -2.85 -0.03 0.00 0.03 0.00 0.00 46.19 43.14 1uht s LEU 15 CO 0.00 -0.59 0.02 -0.69 0.23 0.00 0.00 176.35 175.32 1uht s VAL 16 N 2.77 4.10 -0.95 -1.59 1.01 -0.13 -0.27 120.40 125.34 1uht s VAL 16 Ca 0.26 -0.26 -0.20 0.00 0.00 0.00 0.00 61.98 61.78 1uht s VAL 16 Cb -0.14 -2.86 0.10 0.00 0.00 0.00 0.00 36.38 33.48 1uht s VAL 16 CO 0.14 0.42 1.22 -0.36 0.00 0.00 0.00 175.10 176.52 1uht s PHE 17 N 0.99 2.93 0.16 5.22 0.08 0.40 0.11 117.98 127.87 1uht s PHE 17 Ca 0.02 -1.20 0.08 0.00 0.12 0.00 0.00 56.93 55.95 1uht s PHE 17 Cb -0.14 -4.41 -0.06 0.00 -0.57 0.00 0.00 43.02 37.84 1uht s PHE 17 CO 0.02 -1.63 1.37 -0.39 -0.10 0.00 0.00 175.22 174.49 1uht h VAL 18 N 6.12 1.64 -2.66 -0.44 -1.51 -1.62 0.86 116.25 118.64 1uht h VAL 18 Ca 0.16 -3.05 0.00 0.00 -1.23 0.00 0.00 66.70 62.57 1uht h VAL 18 Cb 1.02 2.65 0.00 0.00 -2.13 0.00 0.00 31.29 32.83 1uht h VAL 18 CO 1.21 0.87 0.00 0.29 -1.23 0.00 0.00 177.57 178.71 1uht n LYS 19 N -3.48 0.73 0.00 5.19 4.76 -1.00 -4.63 118.16 119.74 1uht n LYS 19 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1uht n LYS 19 Cb 0.85 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 34.04 1uht n LYS 19 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1uht n GLY 20 N 1.76 -2.04 0.18 0.72 0.00 0.21 -2.49 105.19 103.52 1uht n GLY 20 Ca 0.00 -1.41 0.06 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.02 1.61 0.13 -1.85 -2.71 132.00 129.16 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 0.38 0.00 0.54 -0.23 0.00 0.00 178.00 178.69 1uht n ARG 22 N -3.38 1.47 -1.46 0.86 1.74 -1.26 -4.92 116.66 109.71 1uht n ARG 22 Ca 0.01 -0.69 -0.63 0.00 -0.77 0.00 0.00 57.85 55.77 1uht n ARG 22 Cb 0.57 -1.48 -0.11 0.00 -1.02 0.00 0.00 32.46 30.43 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 -0.16 0.00 0.00 5.56 2.13 -1.02 0.74 120.64 127.89 1uht n GLU 23 Ca 0.20 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.02 1uht n GLU 23 Cb 0.28 -1.47 0.00 0.00 0.27 0.00 0.00 31.44 30.52 1uht n GLU 23 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1uht n GLY 24 N 5.72 0.77 3.89 8.31 0.00 0.30 -4.97 105.19 119.21 1uht n GLY 24 Ca 0.43 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.64 6.02 -0.02 1.61 1.01 0.23 -4.93 116.67 118.95 1uht s ASP 25 Ca 0.00 0.02 -0.22 0.00 0.71 0.00 0.00 52.55 53.06 1uht s ASP 25 Cb 0.00 -1.71 0.04 0.00 1.01 0.00 0.00 42.92 42.26 1uht s ASP 25 CO 0.00 0.03 0.48 0.00 0.21 0.00 0.00 175.17 175.89 1uht s ALA 26 N -1.83 -1.23 0.20 5.23 0.00 -1.26 0.15 121.76 123.03 1uht s ALA 26 Ca 0.33 0.73 -0.00 0.00 0.00 0.00 0.00 51.96 53.01 1uht s ALA 26 Cb -0.10 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 1uht s ALA 26 CO 0.27 -0.34 0.10 -0.51 0.00 0.00 0.00 175.76 175.27 1uht s LEU 27 N -1.40 1.44 -0.08 0.00 1.43 0.63 -4.98 118.68 115.72 1uht s LEU 27 Ca -0.11 -1.34 -0.11 0.00 -1.03 0.00 0.00 54.13 51.54 1uht s LEU 27 Cb -0.02 0.26 0.03 0.00 0.03 0.00 0.00 46.19 46.48 1uht s LEU 27 CO 0.05 -0.78 0.29 1.51 0.23 0.00 0.00 176.35 177.65 1uht s ASP 28 N -3.17 -0.25 0.10 2.29 -4.77 -1.26 -1.44 116.67 108.16 1uht s ASP 28 Ca 0.35 0.41 -0.03 0.00 -3.30 0.00 0.00 52.55 49.99 1uht s ASP 28 Cb 0.07 0.51 -0.03 0.00 -1.09 0.00 0.00 42.92 42.38 1uht s ASP 28 CO 0.10 -0.20 0.06 -0.31 0.70 0.00 0.00 175.17 175.51 1uht s TYR 29 N -0.31 0.61 0.67 2.11 1.51 -0.28 -4.98 117.35 116.68 1uht s TYR 29 Ca -0.04 -1.06 -0.08 0.00 -1.01 0.00 0.00 57.07 54.87 1uht s TYR 29 Cb -0.03 -0.36 0.03 0.00 -0.11 0.00 0.00 41.96 41.48 1uht s TYR 29 CO 0.01 -0.49 1.01 0.15 -1.11 0.00 0.00 175.55 175.13 1uht s LYS 30 N -3.97 2.67 0.07 -0.62 3.01 -1.26 -1.96 119.74 117.67 1uht s LYS 30 Ca 0.15 0.11 -0.30 0.00 -1.01 0.00 0.00 55.97 54.91 1uht s LYS 30 Cb 0.07 -2.14 -0.06 0.00 -1.01 0.00 0.00 37.83 34.69 1uht s LYS 30 CO -0.04 -0.99 1.16 -1.25 0.51 0.00 0.00 175.35 174.74 1uht s PRO 31 N -5.21 4.46 0.00 -1.68 0.04 -1.26 -3.13 135.00 128.21 1uht s PRO 31 Ca 0.57 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.34 1uht s PRO 31 Cb -0.11 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.08 1uht s PRO 31 CO 0.48 -0.20 0.00 0.41 0.04 0.00 0.00 177.00 177.73 1uht n GLY 32 N 3.06 0.85 3.13 0.56 0.00 -1.26 -5.06 105.19 106.46 1uht n GLY 32 Ca 0.08 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.23 4.44 0.18 1.61 0.01 -1.18 -4.95 113.70 111.58 1uht s SER 33 Ca 0.00 -1.20 -0.31 0.00 1.31 0.00 0.00 55.95 55.76 1uht s SER 33 Cb 0.00 -1.61 -0.09 0.00 0.21 0.00 0.00 66.02 64.53 1uht s SER 33 CO 0.00 -0.18 1.41 -0.89 0.41 0.00 0.00 173.24 173.99 1uht s THR 34 N 1.20 3.00 -0.48 1.44 2.01 -1.26 -4.74 115.64 116.82 1uht s THR 34 Ca -0.05 0.77 0.01 0.00 0.31 0.00 0.00 61.69 62.73 1uht s THR 34 Cb -0.19 -3.49 0.13 0.00 0.01 0.00 0.00 72.50 68.95 1uht s THR 34 CO -0.04 0.09 0.24 -0.63 -0.69 0.00 0.00 174.62 173.58 1uht s ILE 35 N 0.57 2.90 -0.52 1.82 1.01 0.18 -4.88 121.20 122.27 1uht s ILE 35 Ca 0.62 -2.75 -0.28 0.00 0.00 0.00 0.00 60.65 58.24 1uht s ILE 35 Cb -0.39 -3.00 0.01 0.00 0.01 0.00 0.00 42.46 39.09 1uht s ILE 35 CO 0.36 -0.75 1.43 -0.13 0.00 0.00 0.00 174.94 175.86 1uht s ARG 36 N 0.34 3.35 -0.26 2.79 0.52 -1.26 -1.78 118.95 122.63 1uht s ARG 36 Ca 0.14 0.59 -0.17 0.00 -0.52 0.00 0.00 55.73 55.77 1uht s ARG 36 Cb -0.22 -4.11 -0.03 0.00 0.52 0.00 0.00 34.95 31.11 1uht s ARG 36 CO -0.04 -1.87 0.45 0.08 0.02 0.00 0.00 175.30 173.95 1uht s VAL 37 N 6.02 5.12 0.00 3.52 1.01 -1.10 -0.73 120.40 134.23 1uht s VAL 37 Ca 0.55 0.75 0.00 0.00 0.00 0.00 0.00 61.98 63.28 1uht s VAL 37 Cb -0.12 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1uht s VAL 37 CO 0.27 0.12 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1uht n GLY 38 N 4.52 5.29 0.02 4.51 0.00 -0.03 -2.66 105.19 116.85 1uht n GLY 38 Ca -0.06 -1.11 0.05 0.00 0.00 0.00 0.00 46.02 44.90 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 0.71 -4.11 1.61 0.63 0.76 -1.58 116.66 114.68 1uht n ARG 39 Ca 0.00 -0.12 -0.26 0.00 -0.92 0.00 0.00 57.85 56.55 1uht n ARG 39 Cb 0.00 -1.40 -0.06 0.00 0.45 0.00 0.00 32.46 31.46 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 -2.99 4.31 -0.11 5.15 -4.36 -1.26 -3.94 121.20 118.00 1uht s ILE 40 Ca -0.06 -1.16 0.06 0.00 -0.26 0.00 0.00 60.65 59.23 1uht s ILE 40 Cb 0.09 -3.19 -0.24 0.00 1.25 0.00 0.00 42.46 40.38 1uht s ILE 40 CO 0.68 -0.11 0.39 1.33 0.24 0.00 0.00 174.94 177.47 1uht n VAL 41 N -0.29 1.62 0.00 8.37 0.24 -1.26 -4.17 118.33 122.84 1uht n VAL 41 Ca -0.09 -0.74 0.00 0.00 -2.04 0.00 0.00 64.34 61.47 1uht n VAL 41 Cb 0.55 -1.21 0.00 0.00 -1.47 0.00 0.00 33.84 31.71 1uht n VAL 41 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1uht n ARG 42 N -3.16 0.00 -2.14 7.34 3.00 -1.26 -2.88 116.66 117.56 1uht n ARG 42 Ca -0.27 0.07 -0.42 0.00 -0.01 0.00 0.00 57.85 57.22 1uht n ARG 42 Cb 1.06 -0.58 0.00 0.00 0.00 0.00 0.00 32.46 32.95 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 -0.14 4.68 0.00 -0.13 0.00 -1.26 -4.81 105.19 103.53 1uht n GLY 43 Ca 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1uht n GLY 43 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1uht n ASN 44 N 4.43 0.00 0.05 1.61 3.02 -1.14 -4.95 115.26 118.28 1uht n ASN 44 Ca 0.44 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.94 1uht n ASN 44 Cb 0.37 0.00 0.14 0.00 -0.61 0.00 0.00 39.78 39.68 1uht n ASN 44 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1uht h GLU 45 N 0.00 0.38 -3.91 3.52 4.57 -1.18 -3.43 114.58 114.53 1uht h GLU 45 Ca 0.00 -0.21 -0.21 0.00 -1.18 0.00 0.00 59.36 57.76 1uht h GLU 45 Cb 0.00 0.01 -0.25 0.00 -0.16 0.00 0.00 28.75 28.35 1uht h GLU 45 CO 0.00 0.78 -0.72 0.42 -1.18 0.00 0.00 179.01 178.31 1uht s ILE 46 N -4.06 0.10 0.05 2.32 1.01 -0.79 -4.94 121.20 114.90 1uht s ILE 46 Ca -0.06 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.20 1uht s ILE 46 Cb 0.12 -0.16 -0.02 0.00 0.01 0.00 0.00 42.46 42.41 1uht s ILE 46 CO 0.80 -0.21 -0.11 0.00 0.00 0.00 0.00 174.94 175.43 1uht s ALA 47 N -0.65 0.85 -0.08 9.38 0.00 -1.26 -0.85 121.76 129.15 1uht s ALA 47 Ca -0.07 -0.84 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 1uht s ALA 47 Cb -0.05 -0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.07 1uht s ALA 47 CO -0.00 0.08 -0.00 0.42 0.00 0.00 0.00 175.76 176.25 1uht s ILE 48 N -1.24 0.44 -1.38 0.00 1.01 -0.61 -4.95 121.20 114.46 1uht s ILE 48 Ca -0.05 0.08 -0.11 0.00 0.00 0.00 0.00 60.65 60.56 1uht s ILE 48 Cb -0.09 -0.59 0.10 0.00 0.01 0.00 0.00 42.46 41.89 1uht s ILE 48 CO 0.01 0.26 2.11 0.29 0.00 0.00 0.00 174.94 177.61 1uht n LYS 49 N 5.13 3.34 0.00 2.79 4.76 -1.26 -4.25 118.16 128.67 1uht n LYS 49 Ca -0.08 -3.06 0.03 0.00 -2.87 0.00 0.00 58.31 52.33 1uht n LYS 49 Cb 0.50 -3.06 -0.03 0.00 -1.84 0.00 0.00 35.03 30.60 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 4.70 0.32 0.00 4.39 -0.08 -1.26 -4.75 116.55 119.87 1uht n ASP 50 Ca 0.48 -0.66 0.00 0.00 -1.51 0.00 0.00 54.79 53.10 1uht n ASP 50 Cb 0.36 0.94 0.00 0.00 2.34 0.00 0.00 41.12 44.76 1uht n ASP 50 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1uht n ALA 51 N -1.04 0.00 0.22 -1.67 0.00 -1.26 -4.57 120.51 112.19 1uht n ALA 51 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.60 1uht n ALA 51 Cb 0.09 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.15 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 -4.54 0.00 0.00 -1.91 -3.39 103.07 93.23 1uht h GLY 52 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1uht h GLY 52 CO 0.00 0.00 -0.15 -0.42 0.00 0.00 0.00 176.54 175.97 1uht s ILE 53 N -4.23 4.95 0.40 2.60 1.01 -1.26 -4.40 121.20 120.26 1uht s ILE 53 Ca -0.03 0.78 0.08 0.00 0.00 0.00 0.00 60.65 61.48 1uht s ILE 53 Cb 0.09 -3.73 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 1uht s ILE 53 CO 0.31 0.38 0.32 -0.55 0.00 0.00 0.00 174.94 175.40 1uht s SER 54 N -1.48 4.96 0.17 3.58 0.15 -1.26 -4.53 113.70 115.28 1uht s SER 54 Ca 0.32 -0.76 -0.20 0.00 0.70 0.00 0.00 55.95 56.01 1uht s SER 54 Cb -0.16 -0.63 0.09 0.00 -1.71 0.00 0.00 66.02 63.62 1uht s SER 54 CO 0.17 -0.57 1.63 0.71 1.20 0.00 0.00 173.24 176.39 1uht h THR 55 N 1.16 0.39 -2.30 6.45 1.35 -1.92 0.22 112.91 118.26 1uht h THR 55 Ca -0.42 0.00 -0.64 0.00 -0.55 0.00 0.00 66.41 64.80 1uht h THR 55 Cb 1.26 0.39 -0.39 0.00 -1.73 0.00 0.00 68.15 67.68 1uht h THR 55 CO 0.60 0.00 -0.27 0.29 -0.25 0.00 0.00 175.52 175.89 1uht n LYS 56 N -5.38 3.55 0.25 4.72 4.76 -1.26 -3.71 118.16 121.08 1uht n LYS 56 Ca 0.02 -4.78 -0.10 0.00 -2.87 0.00 0.00 58.31 50.58 1uht n LYS 56 Cb 0.30 -2.30 -0.05 0.00 -1.84 0.00 0.00 35.03 31.14 1uht n LYS 56 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1uht h HIS 57 N 3.54 -0.58 -3.89 2.13 -0.00 -1.59 -3.45 115.15 111.31 1uht h HIS 57 Ca 0.22 -0.01 -0.14 0.00 -0.00 0.00 0.00 60.37 60.43 1uht h HIS 57 Cb 0.51 0.19 -0.09 0.00 -0.00 0.00 0.00 27.41 28.02 1uht h HIS 57 CO 0.91 -0.36 -0.20 -0.48 -0.00 0.00 0.00 177.93 177.80 1uht s LEU 58 N -6.83 0.62 -0.04 0.26 0.05 -1.09 -2.61 118.68 109.05 1uht s LEU 58 Ca -0.09 -1.16 0.02 0.00 0.05 0.00 0.00 54.13 52.94 1uht s LEU 58 Cb 0.01 1.53 0.02 0.00 -2.05 0.00 0.00 46.19 45.69 1uht s LEU 58 CO 0.27 -1.16 -0.06 -0.60 -0.55 0.00 0.00 176.35 174.25 1uht s ARG 59 N -3.70 0.92 -0.16 1.48 3.52 -1.11 -2.70 118.95 117.19 1uht s ARG 59 Ca 0.27 -0.18 -0.06 0.00 -0.13 0.00 0.00 55.73 55.63 1uht s ARG 59 Cb 0.00 -0.87 -0.04 0.00 -1.56 0.00 0.00 34.95 32.48 1uht s ARG 59 CO 0.13 -0.02 0.04 0.42 -0.81 0.00 0.00 175.30 175.06 1uht s ILE 60 N 0.67 4.59 0.19 4.11 1.01 -0.74 -3.26 121.20 127.77 1uht s ILE 60 Ca -0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.41 1uht s ILE 60 Cb -0.13 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 1uht s ILE 60 CO 0.01 0.50 0.18 -1.83 0.00 0.00 0.00 174.94 173.79 1uht s GLU 61 N 0.10 1.18 -0.04 2.79 4.04 -1.12 0.47 118.70 126.12 1uht s GLU 61 Ca 0.04 -1.48 0.04 0.00 0.04 0.00 0.00 54.97 53.60 1uht s GLU 61 Cb -0.12 0.30 -0.00 0.00 0.02 0.00 0.00 34.13 34.33 1uht s GLU 61 CO 0.01 -0.40 -0.14 0.45 -1.84 0.00 0.00 175.26 173.34 1uht s SER 62 N -3.09 1.82 0.12 0.83 0.15 -1.26 -0.76 113.70 111.51 1uht s SER 62 Ca 0.31 -0.29 -0.08 0.00 0.70 0.00 0.00 55.95 56.58 1uht s SER 62 Cb 0.06 -0.51 -0.01 0.00 -1.71 0.00 0.00 66.02 63.85 1uht s SER 62 CO 0.08 0.12 0.22 -1.81 1.20 0.00 0.00 173.24 173.05 1uht s ASP 63 N 0.11 0.10 -1.38 5.45 1.01 0.22 -4.70 116.67 117.48 1uht s ASP 63 Ca -0.04 -0.77 -0.08 0.00 0.71 0.00 0.00 52.55 52.37 1uht s ASP 63 Cb -0.11 0.38 0.01 0.00 1.01 0.00 0.00 42.92 44.21 1uht s ASP 63 CO 0.02 -0.80 0.39 -0.24 0.21 0.00 0.00 175.17 174.75 1uht n SER 64 N -0.12 -1.19 -4.27 0.27 2.88 -1.26 0.44 113.62 110.37 1uht n SER 64 Ca -0.11 -1.13 -0.36 0.00 -1.33 0.00 0.00 58.87 55.93 1uht n SER 64 Cb 0.63 -2.46 -0.04 0.00 -0.75 0.00 0.00 64.21 61.59 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 -2.14 -0.39 3.63 0.46 0.00 -1.26 -4.90 105.19 100.59 1uht n GLY 65 Ca -0.26 0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.47 -0.13 -0.04 1.61 0.01 0.17 -4.73 114.94 108.36 1uht s ASN 66 Ca 0.63 -0.84 0.03 0.00 -0.71 0.00 0.00 52.86 51.97 1uht s ASN 66 Cb -0.35 0.61 -0.03 0.00 0.41 0.00 0.00 41.25 41.89 1uht s ASN 66 CO 0.95 -1.17 -0.09 0.26 -1.51 0.00 0.00 177.10 175.54 1uht s TRP 67 N -3.99 2.84 0.09 2.20 0.52 -1.26 0.72 118.94 120.06 1uht s TRP 67 Ca 0.19 -0.05 0.02 0.00 0.02 0.00 0.00 56.10 56.28 1uht s TRP 67 Cb -0.02 -1.65 -0.04 0.00 -1.15 0.00 0.00 33.47 30.62 1uht s TRP 67 CO 0.08 0.30 -0.07 0.14 0.02 0.00 0.00 176.95 177.42 1uht s VAL 68 N -0.85 0.71 0.06 4.03 -7.23 0.06 0.17 120.40 117.36 1uht s VAL 68 Ca 0.14 -1.78 0.08 0.00 -1.81 0.00 0.00 61.98 58.60 1uht s VAL 68 Cb -0.11 -1.49 -0.03 0.00 0.56 0.00 0.00 36.38 35.31 1uht s VAL 68 CO 0.03 -0.76 -0.22 -0.51 -0.31 0.00 0.00 175.10 173.33 1uht s ILE 69 N -3.16 1.78 -0.06 -0.62 2.07 -0.13 -2.79 121.20 118.29 1uht s ILE 69 Ca 0.08 -1.33 -0.02 0.00 -1.41 0.00 0.00 60.65 57.97 1uht s ILE 69 Cb 0.02 -1.56 0.04 0.00 0.13 0.00 0.00 42.46 41.09 1uht s ILE 69 CO -0.03 0.17 0.11 -1.58 -1.91 0.00 0.00 174.94 171.69 1uht s GLN 70 N -1.38 0.01 -0.57 3.50 0.74 -1.20 -2.89 119.66 117.86 1uht s GLN 70 Ca 0.08 0.40 -0.26 0.00 0.05 0.00 0.00 55.36 55.64 1uht s GLN 70 Cb -0.09 -0.30 0.04 0.00 1.10 0.00 0.00 33.01 33.75 1uht s GLN 70 CO 0.03 -0.25 1.06 0.34 -0.55 0.00 0.00 175.29 175.91 1uht s ASP 71 N 1.76 6.37 -0.78 6.67 2.15 -1.25 -2.75 116.67 128.84 1uht s ASP 71 Ca -0.02 -0.18 -0.06 0.00 0.43 0.00 0.00 52.55 52.72 1uht s ASP 71 Cb -0.12 -2.49 -0.05 0.00 -0.30 0.00 0.00 42.92 39.96 1uht s ASP 71 CO -0.05 -1.36 1.95 0.18 -0.17 0.00 0.00 175.17 175.72 1uht n LEU 72 N 7.94 4.22 -3.85 -1.34 4.32 -1.07 -3.87 117.00 123.34 1uht n LEU 72 Ca 0.04 -2.64 -0.27 0.00 -0.02 0.00 0.00 56.01 53.12 1uht n LEU 72 Cb 0.48 -1.02 -0.07 0.00 -1.62 0.00 0.00 43.42 41.20 1uht n LEU 72 CO 0.67 0.31 -0.27 0.61 -1.22 0.00 0.00 177.39 177.49 1uht n GLY 73 N 3.85 -0.17 3.01 -0.72 0.00 -1.26 -4.76 105.19 105.13 1uht n GLY 73 Ca 0.39 0.10 -0.18 0.00 0.00 0.00 0.00 46.02 46.34 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 -1.94 -2.96 0.13 1.61 3.41 -1.24 -4.94 113.62 107.69 1uht n SER 74 Ca -0.12 -0.36 -0.06 0.00 -0.26 0.00 0.00 58.87 58.07 1uht n SER 74 Cb 0.46 -0.76 -0.03 0.00 -0.26 0.00 0.00 64.21 63.62 1uht n SER 74 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1uht h SER 75 N -2.63 -0.34 0.03 4.04 0.87 -1.87 -3.41 113.55 110.24 1uht h SER 75 Ca -0.24 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.33 1uht h SER 75 Cb 0.76 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 1uht h SER 75 CO 0.15 0.00 -0.01 0.78 -0.53 0.00 0.00 176.83 177.22 1uht h ASN 76 N -0.89 -0.03 -3.85 6.23 4.21 -1.92 -3.51 115.58 115.81 1uht h ASN 76 Ca -0.04 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.47 1uht h ASN 76 Cb 0.31 0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.52 1uht h ASN 76 CO 0.07 0.18 0.00 0.61 -1.29 0.00 0.00 177.43 177.00 1uht n GLY 77 N 1.70 2.09 3.44 2.83 0.00 -1.26 -5.09 105.19 108.90 1uht n GLY 77 Ca -0.00 -1.81 -0.31 0.00 0.00 0.00 0.00 46.02 43.89 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 -1.53 2.69 -0.09 2.61 2.01 -1.26 -3.95 115.64 116.12 1uht s THR 78 Ca 0.00 -1.19 0.04 0.00 0.31 0.00 0.00 61.69 60.85 1uht s THR 78 Cb 0.00 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.40 1uht s THR 78 CO 0.00 0.36 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.31 1uht s LEU 79 N -1.35 2.01 -0.29 4.42 1.43 0.20 -1.08 118.68 124.02 1uht s LEU 79 Ca 0.14 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.76 1uht s LEU 79 Cb -0.10 -1.29 0.08 0.00 0.03 0.00 0.00 46.19 44.91 1uht s LEU 79 CO 0.04 0.15 -0.00 -0.22 0.23 0.00 0.00 176.35 176.55 1uht s LEU 80 N 0.32 3.57 -0.42 1.79 2.96 0.70 0.12 118.68 127.72 1uht s LEU 80 Ca -0.16 -1.68 -0.24 0.00 -0.22 0.00 0.00 54.13 51.83 1uht s LEU 80 Cb -0.17 -1.38 0.03 0.00 0.50 0.00 0.00 46.19 45.17 1uht s LEU 80 CO 0.07 -0.31 0.58 0.59 -1.32 0.00 0.00 176.35 175.96 1uht n ASN 81 N 4.48 -6.92 -4.10 3.68 3.02 -0.83 -2.42 115.26 112.18 1uht n ASN 81 Ca -0.04 0.29 -0.28 0.00 -0.03 0.00 0.00 54.58 54.52 1uht n ASN 81 Cb 0.43 -3.74 -0.09 0.00 -0.61 0.00 0.00 39.78 35.77 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 -0.14 0.59 -3.68 6.41 7.64 -1.26 -4.89 113.62 118.29 1uht n SER 82 Ca 0.03 -1.12 -0.10 0.00 1.01 0.00 0.00 58.87 58.69 1uht n SER 82 Cb 0.53 -1.39 -0.09 0.00 -1.01 0.00 0.00 64.21 62.25 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 -4.09 -0.65 -0.14 6.43 2.47 -1.01 -5.14 114.94 112.80 1uht s ASN 83 Ca 0.07 1.11 -0.22 0.00 0.42 0.00 0.00 52.86 54.25 1uht s ASN 83 Cb -0.04 1.02 -0.03 0.00 -1.45 0.00 0.00 41.25 40.75 1uht s ASN 83 CO 0.88 -0.21 0.68 0.00 -3.72 0.00 0.00 177.10 174.73 1uht s ALA 84 N 1.24 3.46 1.06 1.71 0.00 -1.26 0.25 121.76 128.23 1uht s ALA 84 Ca -0.08 -0.07 -0.10 0.00 0.00 0.00 0.00 51.96 51.71 1uht s ALA 84 Cb -0.06 -2.99 0.14 0.00 0.00 0.00 0.00 23.12 20.21 1uht s ALA 84 CO -0.12 -0.38 0.66 1.28 0.00 0.00 0.00 175.76 177.20 1uht n LEU 85 N 4.56 0.00 -3.92 0.00 4.77 -0.24 -4.91 117.00 117.26 1uht n LEU 85 Ca -0.01 -0.72 -0.10 0.00 -0.03 0.00 0.00 56.01 55.15 1uht n LEU 85 Cb 0.50 -0.55 -0.10 0.00 -2.33 0.00 0.00 43.42 40.94 1uht n LEU 85 CO 0.46 -1.30 -0.25 -0.62 -1.33 0.00 0.00 177.39 174.34 1uht s ASP 86 N -3.40 0.12 0.17 -1.43 2.15 -1.26 -4.84 116.67 108.18 1uht s ASP 86 Ca 0.40 -0.35 0.01 0.00 0.43 0.00 0.00 52.55 53.03 1uht s ASP 86 Cb -0.02 0.16 0.02 0.00 -0.30 0.00 0.00 42.92 42.78 1uht s ASP 86 CO 0.29 -0.35 1.40 1.55 -0.17 0.00 0.00 175.17 177.88 1uht h PRO 87 N 4.38 0.29 -1.04 4.34 0.13 -1.98 -3.10 132.00 135.02 1uht h PRO 87 Ca -0.31 -0.28 -0.35 0.00 -0.87 0.00 0.00 66.00 64.19 1uht h PRO 87 Cb 1.20 0.07 -0.20 0.00 0.13 0.00 0.00 31.00 32.20 1uht h PRO 87 CO 0.41 0.96 0.44 0.39 -0.23 0.00 0.00 178.00 179.98 1uht n GLU 88 N -3.74 1.84 -3.70 0.86 1.02 -1.26 -4.75 120.64 110.90 1uht n GLU 88 Ca -0.04 -1.96 -0.14 0.00 -0.02 0.00 0.00 57.16 55.00 1uht n GLU 88 Cb 0.77 -1.77 -0.08 0.00 -0.02 0.00 0.00 31.44 30.34 1uht n GLU 88 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1uht s THR 89 N -2.23 0.03 -0.12 2.62 2.01 -1.17 -5.15 115.64 111.63 1uht s THR 89 Ca 0.37 -0.26 -0.00 0.00 0.31 0.00 0.00 61.69 62.11 1uht s THR 89 Cb 0.31 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 72.15 1uht s THR 89 CO 0.06 -0.14 -0.09 -0.94 -0.69 0.00 0.00 174.62 172.82 1uht s SER 90 N -0.91 2.29 0.23 3.53 1.04 -1.26 -4.58 113.70 114.04 1uht s SER 90 Ca -0.10 -0.34 0.06 0.00 0.48 0.00 0.00 55.95 56.05 1uht s SER 90 Cb -0.04 -0.92 -0.03 0.00 0.10 0.00 0.00 66.02 65.13 1uht s SER 90 CO 0.05 -0.10 0.24 -0.69 0.98 0.00 0.00 173.24 173.71 1uht s VAL 91 N 1.63 4.71 -0.31 5.02 1.01 -1.14 -4.95 120.40 126.36 1uht s VAL 91 Ca 0.04 -1.22 -0.15 0.00 0.00 0.00 0.00 61.98 60.65 1uht s VAL 91 Cb -0.13 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1uht s VAL 91 CO -0.08 -0.31 0.34 0.54 0.00 0.00 0.00 175.10 175.59 1uht s ASN 92 N -3.77 6.18 1.13 3.32 2.20 -1.26 -0.96 114.94 121.79 1uht s ASN 92 Ca 0.33 -0.05 -0.17 0.00 -0.94 0.00 0.00 52.86 52.03 1uht s ASN 92 Cb -0.09 -2.19 0.16 0.00 -2.00 0.00 0.00 41.25 37.13 1uht s ASN 92 CO 0.26 -0.26 0.31 0.18 -2.94 0.00 0.00 177.10 174.65 1uht n LEU 93 N 5.33 -1.95 -3.54 3.54 4.77 0.13 -4.93 117.00 120.34 1uht n LEU 93 Ca -0.10 -0.11 -0.16 0.00 -0.03 0.00 0.00 56.01 55.62 1uht n LEU 93 Cb 0.50 -1.06 -0.05 0.00 -2.33 0.00 0.00 43.42 40.48 1uht n LEU 93 CO 0.38 -3.17 0.35 -0.83 -1.33 0.00 0.00 177.39 172.80 1uht s GLY 94 N -2.01 -0.51 -0.23 -0.72 0.00 -1.26 -4.77 107.32 97.83 1uht s GLY 94 Ca 0.60 0.90 -0.29 0.00 0.00 0.00 0.00 44.72 45.93 1uht s GLY 94 CO 0.66 0.58 1.70 -0.35 0.00 0.00 0.00 173.10 175.68 1uht s ASP 95 N -1.67 6.25 0.00 1.64 2.15 -1.26 -1.71 116.67 122.07 1uht s ASP 95 Ca -0.08 1.63 0.00 0.00 0.43 0.00 0.00 52.55 54.54 1uht s ASP 95 Cb -0.01 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1uht s ASP 95 CO 0.03 -1.36 0.00 0.61 -0.17 0.00 0.00 175.17 174.27 1uht n GLY 96 N 4.85 1.20 3.67 2.66 0.00 0.25 -4.99 105.19 112.83 1uht n GLY 96 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 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 6.76 -0.36 1.61 1.11 -0.70 -4.84 116.67 118.26 1uht s ASP 97 Ca 0.00 0.93 -0.17 0.00 0.18 0.00 0.00 52.55 53.49 1uht s ASP 97 Cb 0.00 -2.37 -0.00 0.00 1.07 0.00 0.00 42.92 41.61 1uht s ASP 97 CO 0.00 -0.27 0.43 -0.69 1.18 0.00 0.00 175.17 175.82 1uht s VAL 98 N 1.80 5.10 -0.43 -1.27 1.01 -1.26 -0.88 120.40 124.47 1uht s VAL 98 Ca 0.31 0.12 -0.18 0.00 0.00 0.00 0.00 61.98 62.23 1uht s VAL 98 Cb -0.16 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.33 1uht s VAL 98 CO 0.11 -0.18 0.49 -0.63 0.00 0.00 0.00 175.10 174.89 1uht s ILE 99 N 2.19 5.02 -0.47 2.22 1.01 0.37 -1.97 121.20 129.56 1uht s ILE 99 Ca 0.15 -0.23 -0.15 0.00 0.00 0.00 0.00 60.65 60.41 1uht s ILE 99 Cb -0.16 -4.08 0.07 0.00 0.01 0.00 0.00 42.46 38.30 1uht s ILE 99 CO 0.13 -0.47 0.39 -0.54 0.00 0.00 0.00 174.94 174.45 1uht s LYS 100 N 2.31 2.96 0.26 2.79 1.02 0.31 0.31 119.74 129.71 1uht s LYS 100 Ca 0.15 -1.37 0.07 0.00 0.02 0.00 0.00 55.97 54.84 1uht s LYS 100 Cb -0.16 -4.12 -0.05 0.00 -0.52 0.00 0.00 37.83 32.97 1uht s LYS 100 CO 0.15 -1.03 -0.08 -0.48 -0.92 0.00 0.00 175.35 172.99 1uht s LEU 101 N 1.63 2.49 0.00 3.17 2.34 0.23 0.62 118.68 129.15 1uht s LEU 101 Ca 0.04 -1.15 0.00 0.00 0.06 0.00 0.00 54.13 53.08 1uht s LEU 101 Cb -0.24 -0.64 0.00 0.00 -0.56 0.00 0.00 46.19 44.75 1uht s LEU 101 CO 0.06 -0.31 0.00 0.61 -1.06 0.00 0.00 176.35 175.66 1uht n GLY 102 N -0.54 1.74 0.00 -3.48 0.00 -1.25 -2.35 105.19 99.31 1uht n GLY 102 Ca -0.06 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 12.85 0.00 -2.82 1.61 1.02 -1.26 -4.76 120.64 127.28 1uht n GLU 103 Ca 0.00 0.44 -0.14 0.00 -0.02 0.00 0.00 57.16 57.44 1uht n GLU 103 Cb 0.00 -0.94 0.01 0.00 -0.02 0.00 0.00 31.44 30.49 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 -2.00 1.21 -3.91 -0.32 4.01 -1.26 -5.07 117.16 109.82 1uht n TYR 104 Ca 0.00 -3.19 -0.35 0.00 -0.16 0.00 0.00 57.90 54.20 1uht n TYR 104 Cb 0.00 -0.37 -0.14 0.00 -0.31 0.00 0.00 39.34 38.52 1uht n TYR 104 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1uht s THR 105 N -3.20 3.55 -0.10 -0.72 2.01 -0.99 0.65 115.64 116.84 1uht s THR 105 Ca 0.34 -0.43 0.03 0.00 0.31 0.00 0.00 61.69 61.93 1uht s THR 105 Cb 0.41 -2.62 -0.01 0.00 0.01 0.00 0.00 72.50 70.29 1uht s THR 105 CO -0.03 0.41 -0.19 -0.44 -0.69 0.00 0.00 174.62 173.68 1uht s SER 106 N 1.44 3.51 -0.11 3.53 0.01 -1.24 -0.60 113.70 120.24 1uht s SER 106 Ca 0.05 -0.44 0.04 0.00 1.31 0.00 0.00 55.95 56.91 1uht s SER 106 Cb -0.14 -1.39 0.00 0.00 0.21 0.00 0.00 66.02 64.70 1uht s SER 106 CO -0.02 0.18 -0.23 -0.63 0.41 0.00 0.00 173.24 172.96 1uht s ILE 107 N 0.22 2.04 -0.13 1.44 1.01 0.15 -1.81 121.20 124.11 1uht s ILE 107 Ca -0.12 -0.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.40 1uht s ILE 107 Cb -0.16 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.49 1uht s ILE 107 CO 0.07 0.55 0.29 -0.22 0.00 0.00 0.00 174.94 175.63 1uht s LEU 108 N 0.48 4.30 -0.34 2.97 0.20 0.29 0.14 118.68 126.72 1uht s LEU 108 Ca -0.15 0.58 -0.17 0.00 0.69 0.00 0.00 54.13 55.08 1uht s LEU 108 Cb -0.17 -2.37 -0.01 0.00 -0.43 0.00 0.00 46.19 43.21 1uht s LEU 108 CO 0.06 0.17 0.44 -0.69 -0.29 0.00 0.00 176.35 176.04 1uht s VAL 109 N 0.03 5.09 -0.06 1.68 1.01 -0.06 -0.95 120.40 127.14 1uht s VAL 109 Ca 0.18 0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.43 1uht s VAL 109 Cb -0.13 -3.89 -0.00 0.00 0.00 0.00 0.00 36.38 32.35 1uht s VAL 109 CO 0.05 -0.14 -0.21 0.20 0.00 0.00 0.00 175.10 175.00 1uht s ASN 110 N 1.74 2.66 -0.39 3.32 0.02 -0.71 0.87 114.94 122.44 1uht s ASN 110 Ca 0.15 -0.45 -0.17 0.00 -1.02 0.00 0.00 52.86 51.38 1uht s ASN 110 Cb -0.16 -0.85 0.01 0.00 0.02 0.00 0.00 41.25 40.27 1uht s ASN 110 CO 0.12 0.18 0.42 -0.36 0.02 0.00 0.00 177.10 177.49 1uht s PHE 111 N 0.05 3.18 -0.41 2.20 0.08 -1.26 -1.38 117.98 120.44 1uht s PHE 111 Ca -0.07 -0.23 -0.17 0.00 0.12 0.00 0.00 56.93 56.58 1uht s PHE 111 Cb -0.14 -2.84 0.02 0.00 -0.57 0.00 0.00 43.02 39.49 1uht s PHE 111 CO 0.04 -0.62 0.41 0.08 -0.10 0.00 0.00 175.22 175.03 1uht s VAL 112 N 2.13 5.13 -1.12 -0.44 1.01 -0.85 -4.83 120.40 121.43 1uht s VAL 112 Ca 0.13 -0.38 -0.08 0.00 0.00 0.00 0.00 61.98 61.65 1uht s VAL 112 Cb -0.17 -4.00 0.27 0.00 0.00 0.00 0.00 36.38 32.48 1uht s VAL 112 CO 0.13 -0.38 1.27 -0.24 0.00 0.00 0.00 175.10 175.88 1uht n SER 113 N 5.50 5.72 0.00 3.32 2.88 -1.26 -0.99 113.62 128.79 1uht n SER 113 Ca -0.08 -3.13 0.00 0.00 -1.33 0.00 0.00 58.87 54.32 1uht n SER 113 Cb 0.47 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 1uht n SER 113 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uht n GLY 114 N 2.45 -1.68 3.31 0.46 0.00 -1.26 -4.95 105.19 103.52 1uht n GLY 114 Ca 0.26 -1.55 -0.27 0.00 0.00 0.00 0.00 46.02 44.47 1uht n GLY 114 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uht n PRO 115 N 0.00 -2.04 -3.15 1.61 -0.04 -1.26 -4.99 135.00 125.13 1uht n PRO 115 Ca 0.00 -1.71 -0.45 0.00 -0.04 0.00 0.00 63.50 61.30 1uht n PRO 115 Cb 0.00 -1.35 -0.04 0.00 -0.04 0.00 0.00 33.50 32.07 1uht n PRO 115 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1uht s SER 116 N -4.78 6.28 -0.02 3.54 0.01 -1.26 -5.03 113.70 112.43 1uht s SER 116 Ca 0.66 -1.66 -0.25 0.00 1.31 0.00 0.00 55.95 56.01 1uht s SER 116 Cb -0.04 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.86 1uht s SER 116 CO 0.48 -1.02 0.77 -0.55 0.41 0.00 0.00 173.24 173.33 1uht s SER 117 N 3.48 7.12 0.00 2.44 0.15 -1.26 -5.28 113.70 120.35 1uht s SER 117 Ca 0.12 1.35 0.00 0.00 0.70 0.00 0.00 55.95 58.12 1uht s SER 117 Cb -0.22 -2.46 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1uht s SER 117 CO 0.03 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.98