#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 6.19 -0.05 1.61 0.01 -1.26 -4.89 113.70 115.31 1uht s SER 2 Ca 0.00 2.22 -0.09 0.00 1.31 0.00 0.00 55.95 59.40 1uht s SER 2 Cb 0.00 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.66 1uht s SER 2 CO 0.00 -1.32 0.39 -1.28 0.41 0.00 0.00 173.24 171.44 1uht h SER 3 N 11.72 -0.27 -4.04 2.44 0.87 -2.07 -3.46 113.55 118.73 1uht h SER 3 Ca -0.43 0.01 -0.45 0.00 -1.23 0.00 0.00 61.79 59.68 1uht h SER 3 Cb 1.22 0.07 -0.30 0.00 -0.44 0.00 0.00 62.40 62.95 1uht h SER 3 CO 0.96 0.13 -0.80 -0.83 -0.53 0.00 0.00 176.83 175.76 1uht s GLY 4 N -2.97 0.61 -0.12 5.77 0.00 -1.26 -5.08 107.32 104.27 1uht s GLY 4 Ca -0.05 -0.49 -0.04 0.00 0.00 0.00 0.00 44.72 44.14 1uht s GLY 4 CO 0.14 -0.34 0.22 -0.56 0.00 0.00 0.00 173.10 172.56 1uht s SER 5 N -0.14 0.58 -0.18 1.64 0.01 -1.26 -5.01 113.70 109.35 1uht s SER 5 Ca 0.02 0.44 -0.04 0.00 1.31 0.00 0.00 55.95 57.68 1uht s SER 5 Cb -0.06 0.51 0.01 0.00 0.21 0.00 0.00 66.02 66.69 1uht s SER 5 CO -0.00 -0.25 0.08 -1.20 0.41 0.00 0.00 173.24 172.28 1uht n SER 6 N 5.34 -5.40 -0.03 2.44 7.64 -1.26 -5.04 113.62 117.31 1uht n SER 6 Ca -0.05 1.17 0.00 0.00 1.01 0.00 0.00 58.87 60.99 1uht n SER 6 Cb 0.50 -4.14 0.00 0.00 -1.01 0.00 0.00 64.21 59.55 1uht n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uht n GLY 7 N 1.37 2.49 3.80 0.23 0.00 -1.26 -5.16 105.19 106.66 1uht n GLY 7 Ca -0.13 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 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 0.92 3.74 0.00 1.61 0.00 -1.26 -4.95 119.30 119.37 1uht s MET 8 Ca 0.00 1.27 0.25 0.00 0.00 0.00 0.00 55.69 57.21 1uht s MET 8 Cb 0.00 -2.09 0.46 0.00 0.00 0.00 0.00 34.83 33.20 1uht s MET 8 CO 0.00 -0.47 1.38 1.33 0.00 0.00 0.00 175.02 177.26 1uht n VAL 9 N -1.22 0.00 -3.54 10.11 0.24 -1.26 -4.79 118.33 117.86 1uht n VAL 9 Ca 0.09 -0.15 -0.41 0.00 -2.04 0.00 0.00 64.34 61.83 1uht n VAL 9 Cb 0.53 0.66 -0.11 0.00 -1.47 0.00 0.00 33.84 33.46 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 -2.56 5.02 0.42 3.34 2.01 -1.26 -5.00 115.64 117.60 1uht s THR 10 Ca 0.21 -0.51 -0.23 0.00 0.31 0.00 0.00 61.69 61.47 1uht s THR 10 Cb 0.19 -3.68 -0.09 0.00 0.01 0.00 0.00 72.50 68.92 1uht s THR 10 CO 0.57 -0.13 1.05 -2.16 -0.69 0.00 0.00 174.62 173.26 1uht s PRO 11 N 1.66 4.09 0.51 4.92 0.04 -1.26 -4.73 135.00 140.22 1uht s PRO 11 Ca 0.05 1.49 -0.22 0.00 0.04 0.00 0.00 61.00 62.36 1uht s PRO 11 Cb -0.18 -2.46 -0.06 0.00 0.04 0.00 0.00 34.50 31.84 1uht s PRO 11 CO 0.09 -0.20 1.28 -1.12 0.04 0.00 0.00 177.00 177.08 1uht s SER 12 N -1.63 5.66 -0.42 6.66 0.01 -0.14 -4.69 113.70 119.14 1uht s SER 12 Ca 0.60 2.58 -0.20 0.00 1.31 0.00 0.00 55.95 60.23 1uht s SER 12 Cb -0.21 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.42 1uht s SER 12 CO 0.26 -1.29 0.62 -0.22 0.41 0.00 0.00 173.24 173.03 1uht s LEU 13 N -3.30 4.48 -0.30 2.44 1.98 -1.19 -2.11 118.68 120.68 1uht s LEU 13 Ca 0.68 -0.28 -0.06 0.00 -2.89 0.00 0.00 54.13 51.59 1uht s LEU 13 Cb -0.35 -2.71 0.02 0.00 0.66 0.00 0.00 46.19 43.81 1uht s LEU 13 CO 0.42 -0.73 0.06 -0.60 -1.89 0.00 0.00 176.35 173.62 1uht s ARG 14 N 2.74 2.91 -0.44 1.98 3.52 -0.62 -1.76 118.95 127.28 1uht s ARG 14 Ca 0.22 -0.97 -0.19 0.00 -0.13 0.00 0.00 55.73 54.66 1uht s ARG 14 Cb -0.14 -3.32 0.03 0.00 -1.56 0.00 0.00 34.95 29.95 1uht s ARG 14 CO 0.18 -0.50 0.57 -0.51 -0.81 0.00 0.00 175.30 174.23 1uht s LEU 15 N 1.44 4.69 -0.19 -0.88 1.43 -0.73 -1.96 118.68 122.48 1uht s LEU 15 Ca 0.01 -0.53 -0.12 0.00 -1.03 0.00 0.00 54.13 52.47 1uht s LEU 15 Cb -0.18 -2.57 -0.05 0.00 0.03 0.00 0.00 46.19 43.42 1uht s LEU 15 CO 0.01 -0.72 0.20 -0.69 0.23 0.00 0.00 176.35 175.38 1uht s VAL 16 N 2.55 5.37 -1.11 -1.59 1.01 -0.40 -0.59 120.40 125.63 1uht s VAL 16 Ca 0.18 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.33 1uht s VAL 16 Cb -0.16 -3.54 0.15 0.00 0.00 0.00 0.00 36.38 32.83 1uht s VAL 16 CO 0.16 0.42 1.35 -0.36 0.00 0.00 0.00 175.10 176.67 1uht s PHE 17 N 0.43 3.29 0.27 5.22 0.08 0.42 0.21 117.98 127.89 1uht s PHE 17 Ca 0.11 -1.81 0.06 0.00 0.12 0.00 0.00 56.93 55.42 1uht s PHE 17 Cb -0.12 -4.35 0.35 0.00 -0.57 0.00 0.00 43.02 38.34 1uht s PHE 17 CO 0.00 -1.48 1.63 -0.39 -0.10 0.00 0.00 175.22 174.88 1uht h VAL 18 N 5.19 1.36 -4.54 -0.44 -1.51 -1.68 1.03 116.25 115.66 1uht h VAL 18 Ca 0.27 -1.81 -0.44 0.00 -1.23 0.00 0.00 66.70 63.49 1uht h VAL 18 Cb 0.93 1.90 -0.11 0.00 -2.13 0.00 0.00 31.29 31.88 1uht h VAL 18 CO 1.22 0.53 -0.40 0.29 -1.23 0.00 0.00 177.57 177.98 1uht n LYS 19 N -3.93 0.47 0.00 5.19 5.02 -1.02 -4.62 118.16 119.28 1uht n LYS 19 Ca -0.02 -2.93 0.00 0.00 -2.02 0.00 0.00 58.31 53.35 1uht n LYS 19 Cb 0.56 2.02 0.00 0.00 -0.02 0.00 0.00 35.03 37.59 1uht n LYS 19 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1uht n GLY 20 N -0.48 -2.13 0.22 0.72 0.00 0.97 -3.53 105.19 100.96 1uht n GLY 20 Ca 0.01 -1.96 0.10 0.00 0.00 0.00 0.00 46.02 44.17 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 -0.72 1.61 0.13 -1.90 -2.76 132.00 128.35 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 0.18 0.00 0.54 -0.23 0.00 0.00 178.00 178.49 1uht n ARG 22 N -3.23 2.98 -1.52 0.86 1.74 -1.26 -4.98 116.66 111.26 1uht n ARG 22 Ca 0.02 -2.74 -0.60 0.00 -0.77 0.00 0.00 57.85 53.76 1uht n ARG 22 Cb 0.49 -1.65 -0.10 0.00 -1.02 0.00 0.00 32.46 30.18 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 1.55 0.41 0.00 5.56 2.13 -1.04 -0.65 120.64 128.60 1uht n GLU 23 Ca 0.25 0.13 0.00 0.00 0.66 0.00 0.00 57.16 58.21 1uht n GLU 23 Cb 0.69 -1.78 0.00 0.00 0.27 0.00 0.00 31.44 30.62 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 5.66 1.00 3.90 8.31 0.00 0.35 -4.96 105.19 119.46 1uht n GLY 24 Ca 0.40 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.82 5.69 -0.21 1.61 1.11 0.18 -4.92 116.67 119.31 1uht s ASP 25 Ca 0.00 -0.27 -0.21 0.00 0.18 0.00 0.00 52.55 52.25 1uht s ASP 25 Cb 0.00 -1.28 0.06 0.00 1.07 0.00 0.00 42.92 42.77 1uht s ASP 25 CO 0.00 -0.26 0.60 0.00 1.18 0.00 0.00 175.17 176.69 1uht s ALA 26 N -2.18 -1.48 0.37 5.23 0.00 -1.26 0.16 121.76 122.60 1uht s ALA 26 Ca 0.39 1.62 0.05 0.00 0.00 0.00 0.00 51.96 54.02 1uht s ALA 26 Cb -0.08 -0.88 -0.06 0.00 0.00 0.00 0.00 23.12 22.10 1uht s ALA 26 CO 0.28 -0.29 0.04 -0.51 0.00 0.00 0.00 175.76 175.28 1uht s LEU 27 N 0.15 2.43 -0.02 0.00 1.43 0.24 -4.96 118.68 117.95 1uht s LEU 27 Ca -0.01 -1.41 -0.13 0.00 -1.03 0.00 0.00 54.13 51.55 1uht s LEU 27 Cb -0.04 -0.57 0.02 0.00 0.03 0.00 0.00 46.19 45.63 1uht s LEU 27 CO 0.02 -0.58 0.29 1.51 0.23 0.00 0.00 176.35 177.81 1uht s ASP 28 N -3.60 -0.18 0.35 2.29 1.47 -1.26 -1.77 116.67 113.98 1uht s ASP 28 Ca 0.34 0.10 -0.00 0.00 1.18 0.00 0.00 52.55 54.17 1uht s ASP 28 Cb 0.08 0.33 -0.00 0.00 -0.34 0.00 0.00 42.92 43.00 1uht s ASP 28 CO 0.16 -0.40 0.45 -0.31 0.68 0.00 0.00 175.17 175.75 1uht s TYR 29 N -1.17 1.23 0.34 2.11 1.51 -0.72 -4.99 117.35 115.65 1uht s TYR 29 Ca -0.12 -1.39 0.07 0.00 -1.01 0.00 0.00 57.07 54.61 1uht s TYR 29 Cb -0.05 -0.20 -0.01 0.00 -0.11 0.00 0.00 41.96 41.59 1uht s TYR 29 CO 0.03 -1.11 0.46 0.15 -1.11 0.00 0.00 175.55 173.97 1uht s LYS 30 N -3.03 3.08 0.07 -0.62 1.02 -1.26 -3.15 119.74 115.84 1uht s LYS 30 Ca 0.33 -1.04 -0.30 0.00 0.02 0.00 0.00 55.97 54.97 1uht s LYS 30 Cb -0.00 -2.79 -0.06 0.00 -0.52 0.00 0.00 37.83 34.46 1uht s LYS 30 CO 0.23 0.06 1.16 -1.25 -0.92 0.00 0.00 175.35 174.62 1uht s PRO 31 N -4.16 4.47 0.00 -1.68 0.04 -1.26 -2.97 135.00 129.43 1uht s PRO 31 Ca 0.45 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1uht s PRO 31 Cb -0.09 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.10 1uht s PRO 31 CO 0.31 -0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.57 1uht n GLY 32 N 3.00 0.86 3.37 0.56 0.00 -1.26 -5.06 105.19 106.66 1uht n GLY 32 Ca 0.08 -0.08 -0.37 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 -2.07 5.16 -0.02 1.61 0.01 -1.16 -4.91 113.70 112.32 1uht s SER 33 Ca 0.00 -0.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.37 1uht s SER 33 Cb 0.00 -1.90 -0.05 0.00 0.21 0.00 0.00 66.02 64.28 1uht s SER 33 CO 0.00 -0.16 1.34 -0.89 0.41 0.00 0.00 173.24 173.94 1uht s THR 34 N 1.53 3.88 -0.56 1.44 2.01 -1.26 -4.70 115.64 117.98 1uht s THR 34 Ca 0.04 1.24 -0.06 0.00 0.31 0.00 0.00 61.69 63.21 1uht s THR 34 Cb -0.17 -3.80 0.15 0.00 0.01 0.00 0.00 72.50 68.69 1uht s THR 34 CO 0.03 -0.01 0.41 -0.63 -0.69 0.00 0.00 174.62 173.73 1uht s ILE 35 N 2.38 4.03 -0.62 1.82 1.09 0.41 -4.82 121.20 125.48 1uht s ILE 35 Ca 0.61 -2.37 -0.28 0.00 -1.10 0.00 0.00 60.65 57.51 1uht s ILE 35 Cb -0.29 -3.64 0.03 0.00 -1.06 0.00 0.00 42.46 37.50 1uht s ILE 35 CO 0.25 -0.83 1.27 -0.13 -0.10 0.00 0.00 174.94 175.40 1uht s ARG 36 N 0.62 3.37 -0.22 2.79 0.52 -1.26 0.01 118.95 124.78 1uht s ARG 36 Ca 0.12 0.15 -0.16 0.00 -0.52 0.00 0.00 55.73 55.32 1uht s ARG 36 Cb -0.21 -4.09 -0.04 0.00 0.52 0.00 0.00 34.95 31.13 1uht s ARG 36 CO -0.03 -1.88 0.43 0.08 0.02 0.00 0.00 175.30 173.91 1uht s VAL 37 N 5.45 5.16 0.00 3.52 1.01 -0.59 -0.57 120.40 134.38 1uht s VAL 37 Ca 0.43 0.74 0.00 0.00 0.00 0.00 0.00 61.98 63.15 1uht s VAL 37 Cb -0.08 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.54 1uht s VAL 37 CO 0.22 0.20 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1uht n GLY 38 N 4.15 4.88 0.11 4.51 0.00 -0.08 -2.14 105.19 116.62 1uht n GLY 38 Ca -0.07 -1.16 -0.14 0.00 0.00 0.00 0.00 46.02 44.66 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 0.74 -3.90 1.61 0.63 0.52 -1.85 116.66 114.42 1uht n ARG 39 Ca 0.00 0.08 -0.34 0.00 -0.92 0.00 0.00 57.85 56.67 1uht n ARG 39 Cb 0.00 -1.46 -0.05 0.00 0.45 0.00 0.00 32.46 31.40 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 -2.45 5.45 0.22 5.15 -4.36 -1.26 -3.69 121.20 120.25 1uht s ILE 40 Ca -0.24 -0.07 -0.01 0.00 -0.26 0.00 0.00 60.65 60.07 1uht s ILE 40 Cb 0.07 -3.51 -0.02 0.00 1.25 0.00 0.00 42.46 40.25 1uht s ILE 40 CO 0.61 0.39 1.57 -0.37 0.24 0.00 0.00 174.94 177.37 1uht h VAL 41 N 3.06 1.31 -1.48 8.37 -1.51 -1.90 -3.42 116.25 120.69 1uht h VAL 41 Ca -0.50 -1.68 -0.75 0.00 -1.23 0.00 0.00 66.70 62.54 1uht h VAL 41 Cb 1.20 1.68 0.02 0.00 -2.13 0.00 0.00 31.29 32.05 1uht h VAL 41 CO 0.67 0.52 0.82 0.54 -1.23 0.00 0.00 177.57 178.89 1uht n ARG 42 N -3.99 0.99 -3.61 5.19 1.74 -1.26 -1.66 116.66 114.05 1uht n ARG 42 Ca -0.02 0.36 -0.24 0.00 -0.77 0.00 0.00 57.85 57.18 1uht n ARG 42 Cb 0.55 -2.02 0.02 0.00 -1.02 0.00 0.00 32.46 30.00 1uht n ARG 42 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uht n GLY 43 N 3.97 -1.14 3.64 -0.13 0.00 -1.26 -4.98 105.19 105.29 1uht n GLY 43 Ca 0.26 0.50 -0.09 0.00 0.00 0.00 0.00 46.02 46.69 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 -3.22 -0.49 0.18 1.61 0.01 -0.67 -4.92 114.94 107.45 1uht s ASN 44 Ca 0.23 0.93 -0.01 0.00 -0.71 0.00 0.00 52.86 53.30 1uht s ASN 44 Cb -0.09 0.97 0.08 0.00 0.41 0.00 0.00 41.25 42.61 1uht s ASN 44 CO 0.86 -0.16 1.44 -0.08 -1.51 0.00 0.00 177.10 177.65 1uht h GLU 45 N 4.47 0.37 -3.63 -0.60 4.57 -1.12 -3.45 114.58 115.20 1uht h GLU 45 Ca -0.28 -0.31 -0.22 0.00 -1.18 0.00 0.00 59.36 57.37 1uht h GLU 45 Cb 1.18 0.06 -0.28 0.00 -0.16 0.00 0.00 28.75 29.55 1uht h GLU 45 CO 0.11 0.95 -0.67 0.42 -1.18 0.00 0.00 179.01 178.63 1uht s ILE 46 N -3.61 -0.00 0.01 2.32 1.01 -0.81 -4.92 121.20 115.21 1uht s ILE 46 Ca -0.05 0.00 0.03 0.00 0.00 0.00 0.00 60.65 60.63 1uht s ILE 46 Cb 0.11 -0.07 -0.01 0.00 0.01 0.00 0.00 42.46 42.49 1uht s ILE 46 CO 0.83 0.00 -0.09 0.00 0.00 0.00 0.00 174.94 175.68 1uht s ALA 47 N 0.04 0.77 -0.04 9.38 0.00 -1.26 -0.90 121.76 129.75 1uht s ALA 47 Ca -0.00 -0.53 0.02 0.00 0.00 0.00 0.00 51.96 51.44 1uht s ALA 47 Cb -0.01 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.99 1uht s ALA 47 CO -0.00 0.14 -0.08 0.42 0.00 0.00 0.00 175.76 176.24 1uht s ILE 48 N -0.56 0.77 -1.06 0.00 1.01 -0.77 -4.98 121.20 115.62 1uht s ILE 48 Ca 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 60.65 60.32 1uht s ILE 48 Cb -0.05 -0.73 0.31 0.00 0.01 0.00 0.00 42.46 42.00 1uht s ILE 48 CO 0.00 0.26 1.64 0.29 0.00 0.00 0.00 174.94 177.14 1uht n LYS 49 N 3.68 4.91 0.00 2.79 4.76 -1.26 -4.42 118.16 128.62 1uht n LYS 49 Ca -0.22 -4.60 0.06 0.00 -2.87 0.00 0.00 58.31 50.68 1uht n LYS 49 Cb 0.52 -2.50 -0.07 0.00 -1.84 0.00 0.00 35.03 31.15 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 0.72 0.60 0.00 4.39 2.03 -1.26 -4.89 116.55 118.15 1uht n ASP 50 Ca 0.35 -0.80 0.00 0.00 0.52 0.00 0.00 54.79 54.86 1uht n ASP 50 Cb 0.30 0.99 0.00 0.00 -0.72 0.00 0.00 41.12 41.69 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 -1.26 0.00 -0.36 -1.67 0.00 -1.26 -4.63 120.51 111.32 1uht n ALA 51 Ca 0.02 0.00 0.37 0.00 0.00 0.00 0.00 53.44 53.83 1uht n ALA 51 Cb 0.19 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.40 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 0.06 -1.26 0.00 0.00 -1.94 -3.40 103.07 96.54 1uht h GLY 52 Ca 0.00 -0.01 -0.46 0.00 0.00 0.00 0.00 47.33 46.86 1uht h GLY 52 CO 0.00 -0.01 0.20 -0.42 0.00 0.00 0.00 176.54 176.31 1uht s ILE 53 N -4.96 2.60 0.34 2.60 1.01 -1.26 -4.26 121.20 117.27 1uht s ILE 53 Ca -0.05 -0.23 0.05 0.00 0.00 0.00 0.00 60.65 60.42 1uht s ILE 53 Cb 0.24 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 39.58 1uht s ILE 53 CO 0.82 -0.10 0.20 -0.24 0.00 0.00 0.00 174.94 175.61 1uht n SER 54 N -2.81 0.28 -4.62 3.58 2.88 -1.26 -4.79 113.62 106.87 1uht n SER 54 Ca 0.07 -3.02 -0.43 0.00 -1.33 0.00 0.00 58.87 54.16 1uht n SER 54 Cb 0.60 1.25 -0.02 0.00 -0.75 0.00 0.00 64.21 65.29 1uht n SER 54 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1uht s THR 55 N -3.11 4.22 -0.84 2.46 -4.23 -1.26 0.20 115.64 113.08 1uht s THR 55 Ca 0.28 1.35 0.00 0.00 -1.18 0.00 0.00 61.69 62.14 1uht s THR 55 Cb 0.01 -4.31 0.00 0.00 1.34 0.00 0.00 72.50 69.54 1uht s THR 55 CO 0.20 -0.61 0.00 0.29 -0.54 0.00 0.00 174.62 173.96 1uht n LYS 56 N 7.38 -0.77 -0.35 3.99 4.01 -1.26 -4.87 118.16 126.29 1uht n LYS 56 Ca 0.14 0.49 0.05 0.00 -0.51 0.00 0.00 58.31 58.47 1uht n LYS 56 Cb 0.47 -4.52 0.12 0.00 -0.51 0.00 0.00 35.03 30.59 1uht n LYS 56 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 1uht n HIS 57 N -3.94 0.29 -3.79 2.13 -0.00 -1.12 -4.65 115.22 104.13 1uht n HIS 57 Ca -0.11 1.18 -0.09 0.00 0.46 0.00 0.00 57.72 59.15 1uht n HIS 57 Cb 0.57 -1.02 -0.03 0.00 -0.12 0.00 0.00 29.99 29.39 1uht n HIS 57 CO 0.00 0.00 0.00 -0.48 0.46 0.00 0.00 176.34 176.32 1uht s LEU 58 N -11.08 -0.12 0.01 0.27 0.05 -0.91 -2.11 118.68 104.78 1uht s LEU 58 Ca -0.14 -0.55 0.04 0.00 0.05 0.00 0.00 54.13 53.53 1uht s LEU 58 Cb 0.25 2.41 -0.01 0.00 -2.05 0.00 0.00 46.19 46.79 1uht s LEU 58 CO 0.74 -1.19 -0.13 0.00 -0.55 0.00 0.00 176.35 175.22 1uht s ARG 59 N -3.90 0.95 -0.15 1.48 1.70 -1.11 -1.55 118.95 116.38 1uht s ARG 59 Ca 0.11 -0.55 -0.04 0.00 -0.47 0.00 0.00 55.73 54.78 1uht s ARG 59 Cb -0.03 -0.93 -0.03 0.00 -0.57 0.00 0.00 34.95 33.39 1uht s ARG 59 CO 0.02 0.25 -0.01 0.42 -1.08 0.00 0.00 175.30 174.89 1uht s ILE 60 N -0.50 4.13 0.16 4.99 1.01 0.10 -3.05 121.20 128.04 1uht s ILE 60 Ca 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 1uht s ILE 60 Cb -0.06 -2.81 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 1uht s ILE 60 CO 0.00 0.51 0.09 -1.83 0.00 0.00 0.00 174.94 173.70 1uht s GLU 61 N 0.15 1.05 -0.02 2.79 4.04 -1.00 0.16 118.70 125.87 1uht s GLU 61 Ca 0.00 -1.53 0.05 0.00 0.04 0.00 0.00 54.97 53.53 1uht s GLU 61 Cb -0.13 0.25 -0.01 0.00 0.02 0.00 0.00 34.13 34.25 1uht s GLU 61 CO 0.02 -0.32 -0.16 0.45 -1.84 0.00 0.00 175.26 173.42 1uht s SER 62 N -3.10 1.89 0.10 0.83 0.15 -1.26 -0.37 113.70 111.94 1uht s SER 62 Ca 0.31 -0.30 -0.07 0.00 0.70 0.00 0.00 55.95 56.59 1uht s SER 62 Cb 0.07 -0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.06 1uht s SER 62 CO 0.06 0.18 0.16 -0.62 1.20 0.00 0.00 173.24 174.22 1uht s ASP 63 N -0.23 0.18 -1.39 5.45 2.15 0.25 -4.71 116.67 118.37 1uht s ASP 63 Ca 0.03 -0.78 -0.15 0.00 0.43 0.00 0.00 52.55 52.08 1uht s ASP 63 Cb -0.08 0.33 0.02 0.00 -0.30 0.00 0.00 42.92 42.89 1uht s ASP 63 CO 0.00 -0.73 0.33 -0.24 -0.17 0.00 0.00 175.17 174.36 1uht n SER 64 N -0.06 -1.36 -3.88 -0.34 2.88 -1.26 0.17 113.62 109.77 1uht n SER 64 Ca -0.13 -1.26 -0.31 0.00 -1.33 0.00 0.00 58.87 55.84 1uht n SER 64 Cb 0.62 -1.77 -0.02 0.00 -0.75 0.00 0.00 64.21 62.29 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 -2.33 -0.46 3.34 0.46 0.00 -1.26 -4.90 105.19 100.04 1uht n GLY 65 Ca -0.23 0.10 -0.11 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 -3.01 0.07 -0.06 1.61 -0.87 0.45 -4.76 114.94 108.37 1uht s ASN 66 Ca 0.60 -1.16 0.03 0.00 -1.57 0.00 0.00 52.86 50.76 1uht s ASN 66 Cb -0.33 0.45 -0.03 0.00 -0.02 0.00 0.00 41.25 41.32 1uht s ASN 66 CO 0.74 -0.93 -0.13 0.26 -2.57 0.00 0.00 177.10 174.47 1uht s TRP 67 N -4.08 2.76 0.07 2.20 0.52 -1.26 0.86 118.94 120.00 1uht s TRP 67 Ca 0.30 -0.12 0.00 0.00 0.02 0.00 0.00 56.10 56.30 1uht s TRP 67 Cb 0.04 -1.65 -0.04 0.00 -1.15 0.00 0.00 33.47 30.67 1uht s TRP 67 CO 0.09 0.21 -0.05 0.14 0.02 0.00 0.00 176.95 177.36 1uht s VAL 68 N -0.73 0.44 0.07 4.03 -7.23 0.50 0.62 120.40 118.10 1uht s VAL 68 Ca 0.11 -1.76 0.07 0.00 -1.81 0.00 0.00 61.98 58.60 1uht s VAL 68 Cb -0.11 -1.45 -0.03 0.00 0.56 0.00 0.00 36.38 35.35 1uht s VAL 68 CO 0.01 -0.87 -0.20 -0.51 -0.31 0.00 0.00 175.10 173.22 1uht s ILE 69 N -3.46 1.63 -0.05 -0.62 2.07 0.37 -2.36 121.20 118.79 1uht s ILE 69 Ca 0.07 -1.36 -0.02 0.00 -1.41 0.00 0.00 60.65 57.93 1uht s ILE 69 Cb 0.04 -1.46 0.04 0.00 0.13 0.00 0.00 42.46 41.21 1uht s ILE 69 CO -0.06 0.05 0.09 -1.58 -1.91 0.00 0.00 174.94 171.52 1uht s GLN 70 N -1.55 0.01 -0.47 3.50 0.74 -1.17 -2.88 119.66 117.83 1uht s GLN 70 Ca 0.06 0.33 -0.26 0.00 0.05 0.00 0.00 55.36 55.54 1uht s GLN 70 Cb -0.09 -0.26 0.03 0.00 1.10 0.00 0.00 33.01 33.78 1uht s GLN 70 CO 0.03 -0.21 0.97 0.34 -0.55 0.00 0.00 175.29 175.87 1uht s ASP 71 N 1.41 6.51 -0.77 6.67 -1.08 -1.25 -2.75 116.67 125.40 1uht s ASP 71 Ca -0.06 0.14 -0.05 0.00 -0.52 0.00 0.00 52.55 52.07 1uht s ASP 71 Cb -0.12 -2.47 -0.05 0.00 -1.46 0.00 0.00 42.92 38.82 1uht s ASP 71 CO -0.04 -1.11 1.99 0.18 0.52 0.00 0.00 175.17 176.71 1uht n LEU 72 N 7.32 4.30 -3.63 -1.34 4.32 -0.90 -3.95 117.00 123.12 1uht n LEU 72 Ca 0.07 -2.64 -0.20 0.00 -0.02 0.00 0.00 56.01 53.22 1uht n LEU 72 Cb 0.49 -1.01 -0.05 0.00 -1.62 0.00 0.00 43.42 41.22 1uht n LEU 72 CO 0.65 0.42 -0.26 0.61 -1.22 0.00 0.00 177.39 177.59 1uht n GLY 73 N 3.74 -0.12 0.00 -0.72 0.00 -1.26 -4.79 105.19 102.04 1uht n GLY 73 Ca 0.39 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -1.52 0.00 0.15 1.61 3.41 -1.25 -5.00 113.62 111.02 1uht n SER 74 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 1uht n SER 74 Cb 0.41 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 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 -2.64 -0.02 4.04 7.64 -1.26 -4.96 113.62 116.41 1uht n SER 75 Ca 0.00 0.71 -0.16 0.00 1.01 0.00 0.00 58.87 60.43 1uht n SER 75 Cb 0.00 2.62 -0.10 0.00 -1.01 0.00 0.00 64.21 65.73 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 0.51 -5.00 6.43 2.35 -1.94 -3.50 115.58 114.43 1uht h ASN 76 Ca 0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 56.30 55.07 1uht h ASN 76 Cb 0.00 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.22 1uht h ASN 76 CO 0.00 1.11 0.00 0.61 -1.65 0.00 0.00 177.43 177.50 1uht n GLY 77 N 0.82 2.82 3.81 2.83 0.00 -1.26 -5.07 105.19 109.14 1uht n GLY 77 Ca -0.09 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.69 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 -2.84 4.84 0.01 2.61 2.01 -1.26 -4.58 115.64 116.43 1uht s THR 78 Ca 0.00 -0.41 0.06 0.00 0.31 0.00 0.00 61.69 61.65 1uht s THR 78 Cb 0.00 -3.24 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 1uht s THR 78 CO 0.00 0.31 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.30 1uht s LEU 79 N -1.88 2.59 -0.29 4.42 1.43 0.06 0.12 118.68 125.14 1uht s LEU 79 Ca 0.25 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 52.98 1uht s LEU 79 Cb -0.12 -1.51 0.08 0.00 0.03 0.00 0.00 46.19 44.67 1uht s LEU 79 CO 0.16 0.28 0.03 -0.22 0.23 0.00 0.00 176.35 176.84 1uht s LEU 80 N -1.18 2.88 0.00 1.79 2.96 0.20 -0.38 118.68 124.95 1uht s LEU 80 Ca 0.13 -1.56 0.00 0.00 -0.22 0.00 0.00 54.13 52.48 1uht s LEU 80 Cb -0.10 -1.13 0.00 0.00 0.50 0.00 0.00 46.19 45.46 1uht s LEU 80 CO 0.03 -0.34 0.00 0.59 -1.32 0.00 0.00 176.35 175.31 1uht n ASN 81 N 4.66 0.00 -2.60 3.68 3.02 0.19 -2.03 115.26 122.18 1uht n ASN 81 Ca -0.04 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.46 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 -0.24 -2.62 0.00 0.00 177.26 174.40 1uht n SER 82 N 1.59 -1.53 -3.66 6.41 2.88 -1.26 -4.95 113.62 113.09 1uht n SER 82 Ca 0.00 -2.16 -0.11 0.00 -1.33 0.00 0.00 58.87 55.27 1uht n SER 82 Cb 0.00 0.87 -0.08 0.00 -0.75 0.00 0.00 64.21 64.25 1uht n SER 82 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1uht s ASN 83 N -0.92 -0.73 -0.16 -3.46 0.01 -0.86 -5.14 114.94 103.69 1uht s ASN 83 Ca 0.14 1.30 -0.28 0.00 -0.71 0.00 0.00 52.86 53.31 1uht s ASN 83 Cb 0.33 1.25 -0.01 0.00 0.41 0.00 0.00 41.25 43.23 1uht s ASN 83 CO -0.08 -0.22 0.94 0.00 -1.51 0.00 0.00 177.10 176.23 1uht s ALA 84 N 0.86 3.51 1.11 0.60 0.00 -1.26 0.60 121.76 127.18 1uht s ALA 84 Ca -0.04 0.19 -0.16 0.00 0.00 0.00 0.00 51.96 51.96 1uht s ALA 84 Cb -0.05 -3.37 0.24 0.00 0.00 0.00 0.00 23.12 19.94 1uht s ALA 84 CO -0.07 -0.71 1.09 -0.51 0.00 0.00 0.00 175.76 175.56 1uht s LEU 85 N 2.31 1.05 0.07 0.00 1.43 0.32 -4.96 118.68 118.89 1uht s LEU 85 Ca 0.43 0.94 0.03 0.00 -1.03 0.00 0.00 54.13 54.51 1uht s LEU 85 Cb -0.17 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.14 1uht s LEU 85 CO 0.13 -3.72 -0.10 -0.62 0.23 0.00 0.00 176.35 172.28 1uht s ASP 86 N -3.58 1.19 0.14 2.29 2.15 -1.26 -4.62 116.67 112.97 1uht s ASP 86 Ca 0.68 -0.67 -0.05 0.00 0.43 0.00 0.00 52.55 52.95 1uht s ASP 86 Cb -0.15 0.02 -0.07 0.00 -0.30 0.00 0.00 42.92 42.42 1uht s ASP 86 CO 0.57 -0.21 1.33 1.55 -0.17 0.00 0.00 175.17 178.24 1uht h PRO 87 N 4.10 0.46 -0.81 4.34 0.13 -1.98 -3.03 132.00 135.21 1uht h PRO 87 Ca -0.37 -0.45 -0.02 0.00 -0.87 0.00 0.00 66.00 64.28 1uht h PRO 87 Cb 1.19 0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 1uht h PRO 87 CO 0.45 1.10 0.03 0.39 -0.23 0.00 0.00 178.00 179.74 1uht n GLU 88 N -3.79 2.84 -3.85 0.86 1.02 -1.26 -4.73 120.64 111.72 1uht n GLU 88 Ca -0.06 -1.57 -0.12 0.00 -0.02 0.00 0.00 57.16 55.39 1uht n GLU 88 Cb 0.80 -1.86 -0.11 0.00 -0.02 0.00 0.00 31.44 30.25 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 -1.86 0.05 -0.09 2.62 2.01 -1.14 -5.15 115.64 112.07 1uht s THR 89 Ca 0.27 -0.38 0.02 0.00 0.31 0.00 0.00 61.69 61.92 1uht s THR 89 Cb 0.21 -0.33 0.01 0.00 0.01 0.00 0.00 72.50 72.41 1uht s THR 89 CO 0.08 -0.21 -0.14 -0.94 -0.69 0.00 0.00 174.62 172.72 1uht s SER 90 N -0.70 2.23 0.10 3.53 1.04 -1.26 -4.42 113.70 114.21 1uht s SER 90 Ca -0.08 -0.38 0.06 0.00 0.48 0.00 0.00 55.95 56.03 1uht s SER 90 Cb -0.05 -1.00 -0.04 0.00 0.10 0.00 0.00 66.02 65.03 1uht s SER 90 CO 0.01 0.02 -0.05 -0.69 0.98 0.00 0.00 173.24 173.51 1uht s VAL 91 N 0.88 3.70 -0.32 5.02 1.01 -1.14 -4.95 120.40 124.60 1uht s VAL 91 Ca -0.09 -1.12 -0.20 0.00 0.00 0.00 0.00 61.98 60.56 1uht s VAL 91 Cb -0.15 -2.75 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 1uht s VAL 91 CO 0.01 0.12 0.61 0.54 0.00 0.00 0.00 175.10 176.38 1uht s ASN 92 N -2.25 6.45 1.03 3.32 2.20 -1.26 -0.48 114.94 123.96 1uht s ASN 92 Ca 0.24 0.30 -0.14 0.00 -0.94 0.00 0.00 52.86 52.32 1uht s ASN 92 Cb -0.11 -2.32 0.18 0.00 -2.00 0.00 0.00 41.25 37.00 1uht s ASN 92 CO 0.16 -0.50 0.34 0.18 -2.94 0.00 0.00 177.10 174.34 1uht n LEU 93 N 5.90 -1.32 -3.56 3.54 4.77 0.20 -4.91 117.00 121.62 1uht n LEU 93 Ca -0.02 -0.40 -0.13 0.00 -0.03 0.00 0.00 56.01 55.43 1uht n LEU 93 Cb 0.49 -0.79 -0.05 0.00 -2.33 0.00 0.00 43.42 40.74 1uht n LEU 93 CO 0.46 -3.32 0.65 -0.83 -1.33 0.00 0.00 177.39 173.02 1uht s GLY 94 N -2.03 -0.38 -0.32 -0.72 0.00 -1.26 -4.80 107.32 97.80 1uht s GLY 94 Ca 0.38 1.78 -0.28 0.00 0.00 0.00 0.00 44.72 46.60 1uht s GLY 94 CO 0.36 1.02 2.05 -0.35 0.00 0.00 0.00 173.10 176.18 1uht s ASP 95 N -1.11 5.49 0.00 1.64 2.15 -1.25 -0.82 116.67 122.77 1uht s ASP 95 Ca -0.05 1.46 0.00 0.00 0.43 0.00 0.00 52.55 54.39 1uht s ASP 95 Cb -0.00 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.10 1uht s ASP 95 CO 0.05 -2.00 0.00 0.61 -0.17 0.00 0.00 175.17 173.65 1uht n GLY 96 N 5.66 1.28 3.65 2.66 0.00 0.30 -4.99 105.19 113.74 1uht n GLY 96 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.88 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 6.73 -0.21 1.61 1.11 0.00 -4.83 116.67 119.08 1uht s ASP 97 Ca 0.00 0.90 -0.16 0.00 0.18 0.00 0.00 52.55 53.46 1uht s ASP 97 Cb 0.00 -2.38 -0.04 0.00 1.07 0.00 0.00 42.92 41.57 1uht s ASP 97 CO 0.00 -0.39 0.43 -0.69 1.18 0.00 0.00 175.17 175.70 1uht s VAL 98 N 2.40 5.17 -0.42 -1.27 1.01 -1.26 -0.60 120.40 125.43 1uht s VAL 98 Ca 0.31 0.76 -0.11 0.00 0.00 0.00 0.00 61.98 62.93 1uht s VAL 98 Cb -0.16 -3.75 0.06 0.00 0.00 0.00 0.00 36.38 32.53 1uht s VAL 98 CO 0.09 0.22 0.28 -0.63 0.00 0.00 0.00 175.10 175.06 1uht s ILE 99 N 1.49 4.53 -0.48 2.22 1.01 0.51 0.54 121.20 131.01 1uht s ILE 99 Ca 0.20 -1.19 -0.17 0.00 0.00 0.00 0.00 60.65 59.48 1uht s ILE 99 Cb -0.15 -3.70 0.06 0.00 0.01 0.00 0.00 42.46 38.69 1uht s ILE 99 CO 0.09 -0.46 0.49 -0.54 0.00 0.00 0.00 174.94 174.52 1uht s LYS 100 N 1.50 3.05 0.36 2.79 1.02 0.49 0.32 119.74 129.27 1uht s LYS 100 Ca 0.03 -1.11 0.05 0.00 0.02 0.00 0.00 55.97 54.95 1uht s LYS 100 Cb -0.22 -4.10 -0.07 0.00 -0.52 0.00 0.00 37.83 32.92 1uht s LYS 100 CO 0.04 -1.09 0.04 -0.48 -0.92 0.00 0.00 175.35 172.94 1uht s LEU 101 N 2.09 2.39 0.00 3.17 2.34 0.75 -0.76 118.68 128.67 1uht s LEU 101 Ca 0.09 -1.40 0.00 0.00 0.06 0.00 0.00 54.13 52.89 1uht s LEU 101 Cb -0.22 -0.54 0.00 0.00 -0.56 0.00 0.00 46.19 44.88 1uht s LEU 101 CO 0.09 -0.58 0.00 0.61 -1.06 0.00 0.00 176.35 175.41 1uht n GLY 102 N -0.80 2.98 0.52 -3.48 0.00 -1.26 -2.30 105.19 100.86 1uht n GLY 102 Ca -0.04 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.71 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 13.24 0.30 -2.71 1.61 1.02 -1.26 -4.78 120.64 128.06 1uht n GLU 103 Ca 0.00 0.12 -0.04 0.00 -0.02 0.00 0.00 57.16 57.22 1uht n GLU 103 Cb 0.00 -1.02 0.04 0.00 -0.02 0.00 0.00 31.44 30.45 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 -3.96 1.49 -3.77 -0.32 4.01 -1.26 -5.06 117.16 108.30 1uht n TYR 104 Ca -0.12 -2.21 -0.36 0.00 -0.16 0.00 0.00 57.90 55.04 1uht n TYR 104 Cb 0.37 -0.25 -0.13 0.00 -0.31 0.00 0.00 39.34 39.02 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 -3.89 4.19 -0.07 -0.72 2.01 -0.97 -0.02 115.64 116.16 1uht s THR 105 Ca 0.31 -0.21 0.05 0.00 0.31 0.00 0.00 61.69 62.15 1uht s THR 105 Cb 0.34 -2.95 -0.01 0.00 0.01 0.00 0.00 72.50 69.89 1uht s THR 105 CO -0.02 0.35 -0.24 -0.44 -0.69 0.00 0.00 174.62 173.58 1uht s SER 106 N 1.60 2.96 -0.11 3.53 0.01 -1.23 -0.18 113.70 120.28 1uht s SER 106 Ca 0.06 -0.50 0.03 0.00 1.31 0.00 0.00 55.95 56.85 1uht s SER 106 Cb -0.15 -0.97 0.01 0.00 0.21 0.00 0.00 66.02 65.12 1uht s SER 106 CO 0.03 0.21 -0.20 -0.63 0.41 0.00 0.00 173.24 173.06 1uht s ILE 107 N 0.01 1.78 -0.08 1.44 1.01 0.15 -2.05 121.20 123.46 1uht s ILE 107 Ca -0.08 -0.83 -0.12 0.00 0.00 0.00 0.00 60.65 59.62 1uht s ILE 107 Cb -0.15 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 1uht s ILE 107 CO 0.05 0.50 0.28 -0.22 0.00 0.00 0.00 174.94 175.55 1uht s LEU 108 N 0.67 4.39 -0.33 2.97 0.20 0.13 0.19 118.68 126.90 1uht s LEU 108 Ca -0.12 0.68 -0.14 0.00 0.69 0.00 0.00 54.13 55.24 1uht s LEU 108 Cb -0.16 -2.35 -0.02 0.00 -0.43 0.00 0.00 46.19 43.23 1uht s LEU 108 CO 0.03 0.30 0.29 -0.69 -0.29 0.00 0.00 176.35 175.99 1uht s VAL 109 N -0.69 5.23 -0.05 1.68 1.01 0.23 -1.27 120.40 126.55 1uht s VAL 109 Ca 0.19 -0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.19 1uht s VAL 109 Cb -0.14 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 1uht s VAL 109 CO 0.08 -0.01 -0.20 0.20 0.00 0.00 0.00 175.10 175.17 1uht s ASN 110 N 1.73 2.46 -0.37 3.32 0.02 -0.83 0.11 114.94 121.38 1uht s ASN 110 Ca 0.09 -0.41 -0.15 0.00 -1.02 0.00 0.00 52.86 51.37 1uht s ASN 110 Cb -0.17 -0.69 -0.00 0.00 0.02 0.00 0.00 41.25 40.41 1uht s ASN 110 CO 0.11 0.18 0.34 -0.36 0.02 0.00 0.00 177.10 177.39 1uht s PHE 111 N -0.02 3.21 -0.37 2.20 0.08 -1.26 -1.58 117.98 120.23 1uht s PHE 111 Ca -0.04 -0.24 -0.15 0.00 0.12 0.00 0.00 56.93 56.62 1uht s PHE 111 Cb -0.12 -2.65 0.00 0.00 -0.57 0.00 0.00 43.02 39.68 1uht s PHE 111 CO 0.03 -0.50 0.35 0.08 -0.10 0.00 0.00 175.22 175.08 1uht s VAL 112 N 1.91 5.18 -0.79 -0.44 1.01 -0.90 -4.86 120.40 121.50 1uht s VAL 112 Ca 0.09 -0.21 -0.26 0.00 0.00 0.00 0.00 61.98 61.60 1uht s VAL 112 Cb -0.17 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.36 1uht s VAL 112 CO 0.11 -0.20 1.33 -0.55 0.00 0.00 0.00 175.10 175.80 1uht s SER 113 N 1.74 6.20 0.36 3.32 0.15 -1.26 -0.97 113.70 123.24 1uht s SER 113 Ca 0.10 -0.64 0.00 0.00 0.70 0.00 0.00 55.95 56.11 1uht s SER 113 Cb -0.17 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 1uht s SER 113 CO 0.12 -1.79 0.00 0.61 1.20 0.00 0.00 173.24 173.37 1uht n GLY 114 N 5.71 -1.69 3.23 9.45 0.00 -1.26 -4.27 105.19 116.36 1uht n GLY 114 Ca 0.10 -1.27 -0.39 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.86 2.28 -3.22 1.61 -0.04 -1.26 -4.89 135.00 128.62 1uht n PRO 115 Ca 0.00 -2.53 -0.44 0.00 -0.04 0.00 0.00 63.50 60.49 1uht n PRO 115 Cb 0.02 -3.34 -0.06 0.00 -0.04 0.00 0.00 33.50 30.07 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 4.70 6.19 0.38 3.54 0.01 -1.26 -5.05 113.70 122.21 1uht s SER 116 Ca 0.56 -1.16 -0.25 0.00 1.31 0.00 0.00 55.95 56.42 1uht s SER 116 Cb 0.08 -2.26 -0.09 0.00 0.21 0.00 0.00 66.02 63.96 1uht s SER 116 CO 0.06 -0.86 1.02 -0.55 0.41 0.00 0.00 173.24 173.32 1uht s SER 117 N 2.87 6.94 0.00 2.44 0.15 -1.26 -5.02 113.70 119.82 1uht s SER 117 Ca 0.11 1.97 0.00 0.00 0.70 0.00 0.00 55.95 58.73 1uht s SER 117 Cb -0.22 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.51 1uht s SER 117 CO 0.09 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.78