#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 6.80 -0.26 1.61 0.01 -1.26 -4.29 113.70 116.31 1uht s SER 2 Ca 0.00 2.14 -0.12 0.00 1.31 0.00 0.00 55.95 59.28 1uht s SER 2 Cb 0.00 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.65 1uht s SER 2 CO 0.00 -0.47 0.25 -1.20 0.41 0.00 0.00 173.24 172.24 1uht n SER 3 N 0.19 -6.98 0.00 2.44 7.64 -1.26 -4.98 113.62 110.67 1uht n SER 3 Ca 0.04 0.58 0.00 0.00 1.01 0.00 0.00 58.87 60.50 1uht n SER 3 Cb 0.48 -3.28 0.00 0.00 -1.01 0.00 0.00 64.21 60.40 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 0.53 0.66 2.15 0.23 0.00 -1.26 -5.11 105.19 102.39 1uht n GLY 4 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1uht n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uht n SER 5 N 0.00 -2.74 -2.55 1.61 2.88 -1.26 -4.99 113.62 106.58 1uht n SER 5 Ca 0.00 0.63 -0.03 0.00 -1.33 0.00 0.00 58.87 58.15 1uht n SER 5 Cb 0.00 2.68 -0.02 0.00 -0.75 0.00 0.00 64.21 66.12 1uht n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1uht n SER 6 N -3.21 -4.19 0.00 -3.46 7.64 -1.26 -5.03 113.62 104.11 1uht n SER 6 Ca 0.00 1.41 0.00 0.00 1.01 0.00 0.00 58.87 61.29 1uht n SER 6 Cb 0.00 -4.24 0.00 0.00 -1.01 0.00 0.00 64.21 58.96 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 1.93 0.00 3.79 0.23 0.00 -1.26 -5.00 105.19 104.89 1uht n GLY 7 Ca -0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1uht n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1uht s MET 8 N 0.00 3.84 0.40 1.61 1.00 -1.26 -4.96 119.30 119.93 1uht s MET 8 Ca 0.00 -0.19 0.29 0.00 0.00 0.00 0.00 55.69 55.79 1uht s MET 8 Cb 0.00 -3.30 1.23 0.00 0.00 0.00 0.00 34.83 32.76 1uht s MET 8 CO 0.00 0.51 1.85 -0.39 0.00 0.00 0.00 175.02 177.00 1uht h VAL 9 N 4.37 0.00 -3.15 -6.03 -1.51 -1.98 -3.42 116.25 104.54 1uht h VAL 9 Ca -0.47 -0.32 -0.58 0.00 -1.23 0.00 0.00 66.70 64.10 1uht h VAL 9 Cb 1.19 1.15 -0.07 0.00 -2.13 0.00 0.00 31.29 31.43 1uht h VAL 9 CO 0.68 0.00 0.69 -0.89 -1.23 0.00 0.00 177.57 176.82 1uht s THR 10 N -3.52 4.73 0.35 7.19 2.01 -1.26 -5.02 115.64 120.13 1uht s THR 10 Ca 0.02 1.90 -0.26 0.00 0.31 0.00 0.00 61.69 63.66 1uht s THR 10 Cb 0.09 -4.25 -0.09 0.00 0.01 0.00 0.00 72.50 68.26 1uht s THR 10 CO 0.44 -0.14 1.07 -2.16 -0.69 0.00 0.00 174.62 173.14 1uht s PRO 11 N 3.03 4.34 0.53 4.92 0.04 -1.26 -4.64 135.00 141.96 1uht s PRO 11 Ca 0.42 1.62 -0.21 0.00 0.04 0.00 0.00 61.00 62.86 1uht s PRO 11 Cb -0.15 -2.79 -0.05 0.00 0.04 0.00 0.00 34.50 31.54 1uht s PRO 11 CO 0.07 -0.01 1.23 -1.12 0.04 0.00 0.00 177.00 177.21 1uht s SER 12 N -1.31 5.61 -0.35 6.66 0.01 0.28 -4.64 113.70 119.96 1uht s SER 12 Ca 0.53 2.44 -0.20 0.00 1.31 0.00 0.00 55.95 60.03 1uht s SER 12 Cb -0.26 -2.61 -0.00 0.00 0.21 0.00 0.00 66.02 63.36 1uht s SER 12 CO 0.33 -1.31 0.59 -0.22 0.41 0.00 0.00 173.24 173.03 1uht s LEU 13 N -3.53 4.28 -0.41 2.44 2.96 -0.84 -1.41 118.68 122.17 1uht s LEU 13 Ca 0.71 0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 54.70 1uht s LEU 13 Cb -0.32 -2.72 0.11 0.00 0.50 0.00 0.00 46.19 43.76 1uht s LEU 13 CO 0.37 -0.54 0.19 -0.60 -1.32 0.00 0.00 176.35 174.45 1uht s ARG 14 N 2.59 1.96 -0.44 1.98 3.52 0.01 -1.39 118.95 127.18 1uht s ARG 14 Ca 0.22 -1.84 -0.27 0.00 -0.13 0.00 0.00 55.73 53.71 1uht s ARG 14 Cb -0.15 -3.55 0.03 0.00 -1.56 0.00 0.00 34.95 29.72 1uht s ARG 14 CO 0.14 -1.06 1.01 -0.51 -0.81 0.00 0.00 175.30 174.06 1uht s LEU 15 N 1.09 3.88 -0.24 -0.88 1.43 -1.00 -1.68 118.68 121.28 1uht s LEU 15 Ca 0.09 0.38 -0.11 0.00 -1.03 0.00 0.00 54.13 53.46 1uht s LEU 15 Cb -0.22 -3.35 -0.05 0.00 0.03 0.00 0.00 46.19 42.60 1uht s LEU 15 CO -0.05 -1.07 0.17 -0.69 0.23 0.00 0.00 176.35 174.95 1uht s VAL 16 N 3.93 5.35 -1.03 -1.59 1.01 0.35 -1.20 120.40 127.23 1uht s VAL 16 Ca 0.41 0.21 -0.21 0.00 0.00 0.00 0.00 61.98 62.39 1uht s VAL 16 Cb -0.10 -3.51 0.09 0.00 0.00 0.00 0.00 36.38 32.86 1uht s VAL 16 CO 0.26 0.34 1.37 -0.36 0.00 0.00 0.00 175.10 176.71 1uht s PHE 17 N 1.08 2.80 0.20 5.22 0.08 0.40 0.12 117.98 127.88 1uht s PHE 17 Ca 0.08 -1.17 0.02 0.00 0.12 0.00 0.00 56.93 55.98 1uht s PHE 17 Cb -0.14 -4.55 0.11 0.00 -0.57 0.00 0.00 43.02 37.88 1uht s PHE 17 CO 0.05 -1.75 1.46 -0.39 -0.10 0.00 0.00 175.22 174.49 1uht h VAL 18 N 6.24 1.43 -2.70 -0.44 -1.51 -1.67 0.97 116.25 118.58 1uht h VAL 18 Ca 0.22 -2.26 -0.01 0.00 -1.23 0.00 0.00 66.70 63.41 1uht h VAL 18 Cb 0.99 2.21 -0.00 0.00 -2.13 0.00 0.00 31.29 32.36 1uht h VAL 18 CO 1.32 0.67 -0.01 0.29 -1.23 0.00 0.00 177.57 178.60 1uht n LYS 19 N -3.78 0.64 0.00 5.19 5.02 -0.93 -4.60 118.16 119.69 1uht n LYS 19 Ca -0.03 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 1uht n LYS 19 Cb 0.71 0.05 0.00 0.00 -0.02 0.00 0.00 35.03 35.77 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 1.54 -2.05 0.22 0.72 0.00 0.14 -2.77 105.19 102.99 1uht n GLY 20 Ca -0.00 -1.57 0.11 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.18 1.61 0.13 -1.90 -2.67 132.00 128.98 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 0.17 0.00 0.54 -0.23 0.00 0.00 178.00 178.48 1uht n ARG 22 N -3.22 1.97 -1.48 0.86 1.74 -1.26 -4.95 116.66 110.32 1uht n ARG 22 Ca 0.02 -1.45 -0.64 0.00 -0.77 0.00 0.00 57.85 55.01 1uht n ARG 22 Cb 0.48 -1.44 -0.11 0.00 -1.02 0.00 0.00 32.46 30.37 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 0.69 0.00 0.00 5.56 0.00 -1.01 0.33 120.64 126.21 1uht n GLU 23 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.33 1uht n GLU 23 Cb 0.43 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.37 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 5.92 0.84 3.89 8.31 0.00 0.34 -4.97 105.19 119.52 1uht n GLY 24 Ca 0.44 0.00 -0.22 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 -1.49 5.92 -0.24 1.61 1.11 0.15 -4.93 116.67 118.81 1uht s ASP 25 Ca 0.00 -0.08 -0.16 0.00 0.18 0.00 0.00 52.55 52.49 1uht s ASP 25 Cb 0.00 -1.63 0.07 0.00 1.07 0.00 0.00 42.92 42.43 1uht s ASP 25 CO 0.00 -0.05 0.60 0.00 1.18 0.00 0.00 175.17 176.90 1uht s ALA 26 N -2.04 -1.56 0.41 5.23 0.00 -1.26 0.15 121.76 122.70 1uht s ALA 26 Ca 0.33 2.00 0.07 0.00 0.00 0.00 0.00 51.96 54.37 1uht s ALA 26 Cb -0.09 -1.18 -0.06 0.00 0.00 0.00 0.00 23.12 21.79 1uht s ALA 26 CO 0.27 -0.33 0.10 -0.51 0.00 0.00 0.00 175.76 175.29 1uht s LEU 27 N 1.21 2.99 -0.12 0.00 1.43 -0.34 -4.97 118.68 118.88 1uht s LEU 27 Ca -0.07 -1.23 -0.08 0.00 -1.03 0.00 0.00 54.13 51.72 1uht s LEU 27 Cb -0.06 -1.17 0.04 0.00 0.03 0.00 0.00 46.19 45.04 1uht s LEU 27 CO -0.12 -0.51 0.31 -0.62 0.23 0.00 0.00 176.35 175.63 1uht s ASP 28 N -3.82 -0.34 0.10 2.29 2.15 -1.26 -2.37 116.67 113.42 1uht s ASP 28 Ca 0.37 0.65 0.02 0.00 0.43 0.00 0.00 52.55 54.02 1uht s ASP 28 Cb 0.07 0.58 -0.04 0.00 -0.30 0.00 0.00 42.92 43.22 1uht s ASP 28 CO 0.20 -0.15 -0.07 -0.31 -0.17 0.00 0.00 175.17 174.67 1uht s TYR 29 N 0.88 0.95 0.72 -5.34 2.02 -0.48 -4.99 117.35 111.11 1uht s TYR 29 Ca -0.06 -0.86 -0.11 0.00 -0.37 0.00 0.00 57.07 55.66 1uht s TYR 29 Cb -0.07 -0.54 0.02 0.00 -0.40 0.00 0.00 41.96 40.98 1uht s TYR 29 CO -0.06 -0.10 1.09 -1.59 -1.57 0.00 0.00 175.55 173.32 1uht s LYS 30 N -3.70 2.75 0.06 -0.62 -2.85 -1.26 -1.99 119.74 112.13 1uht s LYS 30 Ca 0.12 0.52 -0.30 0.00 -1.00 0.00 0.00 55.97 55.30 1uht s LYS 30 Cb 0.04 -2.00 -0.05 0.00 -2.06 0.00 0.00 37.83 33.75 1uht s LYS 30 CO -0.03 -1.13 1.16 -1.25 0.10 0.00 0.00 175.35 174.20 1uht s PRO 31 N -5.31 4.46 0.00 1.78 0.04 -1.26 -3.02 135.00 131.68 1uht s PRO 31 Ca 0.59 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.35 1uht s PRO 31 Cb -0.12 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.06 1uht s PRO 31 CO 0.52 -0.21 0.00 0.41 0.04 0.00 0.00 177.00 177.76 1uht n GLY 32 N 3.12 0.82 3.21 0.56 0.00 -1.26 -5.06 105.19 106.57 1uht n GLY 32 Ca 0.08 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.22 4.94 0.09 1.61 0.01 -1.17 -4.87 113.70 112.10 1uht s SER 33 Ca 0.00 -1.17 -0.31 0.00 1.31 0.00 0.00 55.95 55.78 1uht s SER 33 Cb 0.00 -1.75 -0.09 0.00 0.21 0.00 0.00 66.02 64.39 1uht s SER 33 CO 0.00 -0.26 1.67 -0.89 0.41 0.00 0.00 173.24 174.17 1uht s THR 34 N 1.31 2.88 -0.53 1.44 2.01 -1.26 -4.70 115.64 116.78 1uht s THR 34 Ca -0.03 0.41 -0.03 0.00 0.31 0.00 0.00 61.69 62.34 1uht s THR 34 Cb -0.19 -3.26 0.14 0.00 0.01 0.00 0.00 72.50 69.20 1uht s THR 34 CO -0.00 0.00 0.34 -0.63 -0.69 0.00 0.00 174.62 173.64 1uht s ILE 35 N 2.41 3.58 -0.39 1.82 1.01 0.50 -4.93 121.20 125.20 1uht s ILE 35 Ca 0.74 -2.54 -0.29 0.00 0.00 0.00 0.00 60.65 58.57 1uht s ILE 35 Cb -0.41 -3.38 0.01 0.00 0.01 0.00 0.00 42.46 38.68 1uht s ILE 35 CO 0.33 -0.80 1.30 -0.13 0.00 0.00 0.00 174.94 175.64 1uht s ARG 36 N 0.49 3.74 -0.40 2.79 0.52 -1.26 -0.01 118.95 124.82 1uht s ARG 36 Ca 0.13 0.96 -0.14 0.00 -0.52 0.00 0.00 55.73 56.16 1uht s ARG 36 Cb -0.21 -3.94 0.02 0.00 0.52 0.00 0.00 34.95 31.33 1uht s ARG 36 CO -0.04 -1.35 0.28 0.08 0.02 0.00 0.00 175.30 174.29 1uht s VAL 37 N 4.80 5.19 0.00 3.52 1.01 -0.74 0.16 120.40 134.34 1uht s VAL 37 Ca 0.56 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.93 1uht s VAL 37 Cb -0.13 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.39 1uht s VAL 37 CO 0.29 -0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.74 1uht n GLY 38 N 5.13 5.48 0.08 4.51 0.00 0.15 -2.47 105.19 118.07 1uht n GLY 38 Ca -0.11 -1.47 -0.08 0.00 0.00 0.00 0.00 46.02 44.35 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 1.38 -3.98 1.61 0.63 -0.05 -1.05 116.66 115.20 1uht n ARG 39 Ca 0.00 0.02 -0.36 0.00 -0.92 0.00 0.00 57.85 56.59 1uht n ARG 39 Cb 0.00 -1.37 -0.06 0.00 0.45 0.00 0.00 32.46 31.48 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 -2.35 5.24 0.21 5.15 -4.36 -1.26 -3.70 121.20 120.14 1uht s ILE 40 Ca -0.11 0.03 -0.02 0.00 -0.26 0.00 0.00 60.65 60.29 1uht s ILE 40 Cb 0.05 -3.31 -0.02 0.00 1.25 0.00 0.00 42.46 40.43 1uht s ILE 40 CO 0.55 0.55 1.56 -0.37 0.24 0.00 0.00 174.94 177.47 1uht h VAL 41 N 3.78 1.31 -3.09 8.37 -1.51 -1.89 -3.32 116.25 119.91 1uht h VAL 41 Ca -0.53 -1.68 -0.57 0.00 -1.23 0.00 0.00 66.70 62.69 1uht h VAL 41 Cb 1.21 1.67 -0.04 0.00 -2.13 0.00 0.00 31.29 32.00 1uht h VAL 41 CO 0.59 0.52 1.06 -0.13 -1.23 0.00 0.00 177.57 178.39 1uht s ARG 42 N -4.11 3.72 0.00 5.19 3.00 -1.26 -3.12 118.95 122.37 1uht s ARG 42 Ca -0.07 1.22 0.00 0.00 0.00 0.00 0.00 55.73 56.88 1uht s ARG 42 Cb 0.12 -3.99 0.00 0.00 0.00 0.00 0.00 34.95 31.08 1uht s ARG 42 CO 0.83 -1.38 0.00 0.41 0.00 0.00 0.00 175.30 175.16 1uht n GLY 43 N 4.75 3.17 3.71 -3.53 0.00 -1.26 -5.03 105.19 107.00 1uht n GLY 43 Ca 0.17 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 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 0.00 5.16 0.01 1.61 0.01 -1.18 -4.96 114.94 115.59 1uht s ASN 44 Ca 0.00 -0.12 -0.19 0.00 -0.71 0.00 0.00 52.86 51.84 1uht s ASN 44 Cb 0.00 -1.28 -0.10 0.00 0.41 0.00 0.00 41.25 40.27 1uht s ASN 44 CO 0.00 0.18 1.00 -0.33 -1.51 0.00 0.00 177.10 176.44 1uht h GLU 45 N 3.48 -0.65 -5.88 -0.60 4.39 -0.50 -3.41 114.58 111.41 1uht h GLU 45 Ca -0.47 0.04 -0.61 0.00 0.34 0.00 0.00 59.36 58.66 1uht h GLU 45 Cb 1.16 0.15 -0.06 0.00 -0.10 0.00 0.00 28.75 29.90 1uht h GLU 45 CO 0.61 -0.43 -0.23 0.42 -1.16 0.00 0.00 179.01 178.22 1uht s ILE 46 N -4.01 5.12 -0.06 3.13 1.01 -0.32 -4.89 121.20 121.18 1uht s ILE 46 Ca -0.10 0.77 0.01 0.00 0.00 0.00 0.00 60.65 61.33 1uht s ILE 46 Cb 0.01 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.81 1uht s ILE 46 CO 0.30 0.52 -0.06 0.00 0.00 0.00 0.00 174.94 175.70 1uht s ALA 47 N -0.64 0.89 -0.16 9.38 0.00 -1.26 0.35 121.76 130.32 1uht s ALA 47 Ca 0.22 -0.20 0.01 0.00 0.00 0.00 0.00 51.96 51.99 1uht s ALA 47 Cb -0.16 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.42 1uht s ALA 47 CO 0.11 -0.09 -0.19 0.42 0.00 0.00 0.00 175.76 176.01 1uht s ILE 48 N 1.09 2.29 -1.26 0.00 1.01 -0.22 -4.92 121.20 119.19 1uht s ILE 48 Ca -0.08 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.63 1uht s ILE 48 Cb -0.14 -1.95 0.17 0.00 0.01 0.00 0.00 42.46 40.55 1uht s ILE 48 CO -0.01 0.53 2.15 0.29 0.00 0.00 0.00 174.94 177.90 1uht n LYS 49 N 4.25 4.51 0.00 2.79 4.76 -1.26 -4.36 118.16 128.85 1uht n LYS 49 Ca -0.20 -3.71 0.07 0.00 -2.87 0.00 0.00 58.31 51.61 1uht n LYS 49 Cb 0.51 -2.66 -0.06 0.00 -1.84 0.00 0.00 35.03 30.98 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 1.90 1.03 0.00 4.39 2.03 -1.26 -4.89 116.55 119.75 1uht n ASP 50 Ca 0.53 -1.02 0.00 0.00 0.52 0.00 0.00 54.79 54.83 1uht n ASP 50 Cb 0.28 0.81 0.00 0.00 -0.72 0.00 0.00 41.12 41.49 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 -0.93 0.00 0.27 -1.67 0.00 -1.26 -4.61 120.51 112.31 1uht n ALA 51 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.62 1uht n ALA 51 Cb 0.27 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.45 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 -5.72 0.00 0.00 -1.92 -3.39 103.07 92.05 1uht h GLY 52 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.67 1uht h GLY 52 CO 0.00 0.00 -0.50 -0.42 0.00 0.00 0.00 176.54 175.62 1uht s ILE 53 N -3.82 5.37 0.24 2.60 1.01 -1.26 -4.12 121.20 121.22 1uht s ILE 53 Ca -0.03 0.16 0.05 0.00 0.00 0.00 0.00 60.65 60.83 1uht s ILE 53 Cb 0.08 -3.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.16 1uht s ILE 53 CO 0.24 0.59 0.36 -0.55 0.00 0.00 0.00 174.94 175.58 1uht s SER 54 N -0.77 6.32 0.44 3.58 0.15 -1.26 -4.56 113.70 117.61 1uht s SER 54 Ca 0.13 0.07 0.29 0.00 0.70 0.00 0.00 55.95 57.14 1uht s SER 54 Cb -0.12 -1.86 1.37 0.00 -1.71 0.00 0.00 66.02 63.70 1uht s SER 54 CO 0.03 -0.07 1.67 0.71 1.20 0.00 0.00 173.24 176.78 1uht h THR 55 N 1.18 0.24 -2.08 6.45 1.35 -1.91 0.16 112.91 118.30 1uht h THR 55 Ca -0.52 -0.05 -0.56 0.00 -0.55 0.00 0.00 66.41 64.72 1uht h THR 55 Cb 1.23 0.07 -0.40 0.00 -1.73 0.00 0.00 68.15 67.32 1uht h THR 55 CO 0.61 0.03 -0.93 2.29 -0.25 0.00 0.00 175.52 177.27 1uht n LYS 56 N -4.60 1.48 0.12 4.72 2.85 -1.26 -3.41 118.16 118.06 1uht n LYS 56 Ca 0.34 -3.80 -0.05 0.00 -1.05 0.00 0.00 58.31 53.75 1uht n LYS 56 Cb 1.30 -1.66 -0.02 0.00 -0.65 0.00 0.00 35.03 34.00 1uht n LYS 56 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1uht h HIS 57 N 3.86 -0.29 -3.80 5.58 2.76 -1.43 -3.45 115.15 118.37 1uht h HIS 57 Ca 0.12 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.18 1uht h HIS 57 Cb 0.80 0.10 -0.10 0.00 1.55 0.00 0.00 27.41 29.76 1uht h HIS 57 CO 0.52 -0.18 -0.18 -0.48 -1.30 0.00 0.00 177.93 176.30 1uht s LEU 58 N -5.99 0.48 -0.01 0.26 0.05 -1.03 -2.43 118.68 110.01 1uht s LEU 58 Ca -0.05 -1.04 0.02 0.00 0.05 0.00 0.00 54.13 53.12 1uht s LEU 58 Cb 0.00 1.58 -0.00 0.00 -2.05 0.00 0.00 46.19 45.72 1uht s LEU 58 CO 0.14 -1.12 -0.08 0.00 -0.55 0.00 0.00 176.35 174.74 1uht s ARG 59 N -3.93 0.70 -0.12 1.48 1.70 -1.14 -1.79 118.95 115.84 1uht s ARG 59 Ca 0.25 -0.27 -0.06 0.00 -0.47 0.00 0.00 55.73 55.19 1uht s ARG 59 Cb 0.00 -0.67 -0.04 0.00 -0.57 0.00 0.00 34.95 33.67 1uht s ARG 59 CO 0.10 0.14 0.09 0.42 -1.08 0.00 0.00 175.30 174.97 1uht s ILE 60 N -0.02 5.07 0.17 4.99 1.01 0.99 -3.39 121.20 130.01 1uht s ILE 60 Ca 0.01 0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.61 1uht s ILE 60 Cb -0.05 -3.20 -0.01 0.00 0.01 0.00 0.00 42.46 39.21 1uht s ILE 60 CO -0.00 0.59 0.31 -1.83 0.00 0.00 0.00 174.94 174.01 1uht s GLU 61 N -0.77 1.19 0.07 2.79 4.04 -1.09 0.19 118.70 125.12 1uht s GLU 61 Ca 0.13 -1.16 0.07 0.00 0.04 0.00 0.00 54.97 54.05 1uht s GLU 61 Cb -0.12 0.39 -0.03 0.00 0.02 0.00 0.00 34.13 34.39 1uht s GLU 61 CO 0.03 -0.44 -0.20 0.45 -1.84 0.00 0.00 175.26 173.26 1uht s SER 62 N -2.96 2.35 0.15 0.83 0.15 -1.26 -0.88 113.70 112.07 1uht s SER 62 Ca 0.17 -0.59 -0.19 0.00 0.70 0.00 0.00 55.95 56.03 1uht s SER 62 Cb 0.03 -0.15 0.05 0.00 -1.71 0.00 0.00 66.02 64.24 1uht s SER 62 CO 0.00 0.08 0.51 -1.81 1.20 0.00 0.00 173.24 173.23 1uht s ASP 63 N -1.53 -0.39 -1.40 5.45 1.01 0.38 -4.74 116.67 115.46 1uht s ASP 63 Ca 0.06 -0.19 -0.13 0.00 0.71 0.00 0.00 52.55 52.99 1uht s ASP 63 Cb -0.09 0.55 0.02 0.00 1.01 0.00 0.00 42.92 44.40 1uht s ASP 63 CO 0.03 -0.94 0.33 -1.20 0.21 0.00 0.00 175.17 173.60 1uht n SER 64 N -0.31 -1.27 -3.87 0.27 7.64 -1.26 0.16 113.62 114.97 1uht n SER 64 Ca -0.16 -1.25 -0.30 0.00 1.01 0.00 0.00 58.87 58.17 1uht n SER 64 Cb 0.64 -1.87 -0.03 0.00 -1.01 0.00 0.00 64.21 61.94 1uht n SER 64 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uht n GLY 65 N -2.31 -0.45 3.35 0.23 0.00 -1.26 -4.89 105.19 99.85 1uht n GLY 65 Ca -0.24 0.09 -0.10 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 -2.98 0.02 0.06 1.61 -0.87 0.41 -4.76 114.94 108.43 1uht s ASN 66 Ca 0.59 -0.84 0.03 0.00 -1.57 0.00 0.00 52.86 51.07 1uht s ASN 66 Cb -0.33 0.44 -0.04 0.00 -0.02 0.00 0.00 41.25 41.31 1uht s ASN 66 CO 0.73 -0.90 0.04 0.26 -2.57 0.00 0.00 177.10 174.65 1uht s TRP 67 N -3.96 3.11 0.01 2.20 0.52 -1.26 0.14 118.94 119.71 1uht s TRP 67 Ca 0.17 0.06 -0.06 0.00 0.02 0.00 0.00 56.10 56.28 1uht s TRP 67 Cb 0.03 -1.62 -0.00 0.00 -1.15 0.00 0.00 33.47 30.73 1uht s TRP 67 CO -0.00 0.50 0.12 0.14 0.02 0.00 0.00 176.95 177.72 1uht s VAL 68 N -1.28 0.10 0.06 4.03 -7.23 -0.06 0.21 120.40 116.22 1uht s VAL 68 Ca 0.26 -0.80 0.08 0.00 -1.81 0.00 0.00 61.98 59.71 1uht s VAL 68 Cb -0.12 -0.52 -0.03 0.00 0.56 0.00 0.00 36.38 36.27 1uht s VAL 68 CO 0.18 -0.44 -0.22 -0.51 -0.31 0.00 0.00 175.10 173.80 1uht s ILE 69 N -1.66 2.53 -0.05 -0.62 2.07 0.12 -2.69 121.20 120.90 1uht s ILE 69 Ca -0.13 -1.34 -0.02 0.00 -1.41 0.00 0.00 60.65 57.75 1uht s ILE 69 Cb -0.06 -2.05 0.03 0.00 0.13 0.00 0.00 42.46 40.50 1uht s ILE 69 CO 0.00 0.30 0.08 -1.58 -1.91 0.00 0.00 174.94 171.83 1uht s GLN 70 N -1.50 -0.04 -0.53 3.50 0.74 -1.22 -2.40 119.66 118.21 1uht s GLN 70 Ca 0.14 0.37 -0.25 0.00 0.05 0.00 0.00 55.36 55.66 1uht s GLN 70 Cb -0.10 -0.38 0.04 0.00 1.10 0.00 0.00 33.01 33.66 1uht s GLN 70 CO 0.05 -0.27 0.98 0.34 -0.55 0.00 0.00 175.29 175.84 1uht s ASP 71 N 1.85 6.40 -0.79 6.67 2.15 -1.24 -2.90 116.67 128.81 1uht s ASP 71 Ca 0.00 -0.15 -0.08 0.00 0.43 0.00 0.00 52.55 52.75 1uht s ASP 71 Cb -0.12 -2.46 -0.07 0.00 -0.30 0.00 0.00 42.92 39.97 1uht s ASP 71 CO -0.04 -1.23 1.96 0.18 -0.17 0.00 0.00 175.17 175.88 1uht n LEU 72 N 7.57 4.27 -4.08 -1.34 4.32 -1.02 -3.63 117.00 123.09 1uht n LEU 72 Ca 0.04 -2.70 -0.31 0.00 -0.02 0.00 0.00 56.01 53.03 1uht n LEU 72 Cb 0.48 -1.03 -0.08 0.00 -1.62 0.00 0.00 43.42 41.17 1uht n LEU 72 CO 0.65 0.24 -0.29 0.61 -1.22 0.00 0.00 177.39 177.37 1uht n GLY 73 N 3.94 -0.20 3.48 -0.72 0.00 -1.26 -4.78 105.19 105.64 1uht n GLY 73 Ca 0.41 0.11 -0.29 0.00 0.00 0.00 0.00 46.02 46.26 1uht n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uht s SER 74 N -3.65 0.70 0.49 1.61 1.04 -1.24 -4.98 113.70 107.67 1uht s SER 74 Ca 0.30 1.25 -0.20 0.00 0.48 0.00 0.00 55.95 57.78 1uht s SER 74 Cb -0.18 -1.91 -0.08 0.00 0.10 0.00 0.00 66.02 63.95 1uht s SER 74 CO 0.86 -4.33 1.03 -0.44 0.98 0.00 0.00 173.24 171.34 1uht s SER 75 N -2.87 6.37 0.00 7.02 0.01 -1.26 -4.04 113.70 118.92 1uht s SER 75 Ca 0.68 1.88 0.00 0.00 1.31 0.00 0.00 55.95 59.83 1uht s SER 75 Cb -0.21 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.47 1uht s SER 75 CO 0.62 -0.76 0.00 0.59 0.41 0.00 0.00 173.24 174.09 1uht n ASN 76 N -1.04 0.00 0.00 2.44 3.02 -1.26 -4.67 115.26 113.75 1uht n ASN 76 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.64 1uht n ASN 76 Cb 0.53 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 1uht n ASN 76 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uht n GLY 77 N 0.00 4.23 3.95 7.41 0.00 -1.26 -5.13 105.19 114.39 1uht n GLY 77 Ca 0.00 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.09 5.15 -0.04 2.61 2.01 -1.26 -4.68 115.64 117.33 1uht s THR 78 Ca 0.00 -0.58 0.01 0.00 0.31 0.00 0.00 61.69 61.44 1uht s THR 78 Cb 0.00 -3.85 0.02 0.00 0.01 0.00 0.00 72.50 68.68 1uht s THR 78 CO 0.00 -0.47 -0.05 -0.76 -0.69 0.00 0.00 174.62 172.65 1uht s LEU 79 N -4.14 1.42 -0.25 4.42 1.43 -0.74 -1.39 118.68 119.43 1uht s LEU 79 Ca 0.38 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 1uht s LEU 79 Cb -0.10 -0.46 0.04 0.00 0.03 0.00 0.00 46.19 45.70 1uht s LEU 79 CO 0.34 -0.03 -0.09 -0.22 0.23 0.00 0.00 176.35 176.57 1uht s LEU 80 N 0.78 3.24 0.00 1.79 2.96 0.17 -0.68 118.68 126.94 1uht s LEU 80 Ca -0.11 -1.09 0.00 0.00 -0.22 0.00 0.00 54.13 52.71 1uht s LEU 80 Cb -0.14 -1.60 0.00 0.00 0.50 0.00 0.00 46.19 44.95 1uht s LEU 80 CO 0.01 -0.15 0.00 0.59 -1.32 0.00 0.00 176.35 175.47 1uht n ASN 81 N 4.57 0.00 -2.86 3.68 3.02 0.83 -1.92 115.26 122.59 1uht n ASN 81 Ca -0.16 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.28 1uht n ASN 81 Cb 0.45 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.67 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 1.75 -0.86 -3.64 6.41 7.64 -1.26 -4.79 113.62 118.87 1uht n SER 82 Ca 0.00 -3.18 -0.06 0.00 1.01 0.00 0.00 58.87 56.64 1uht n SER 82 Cb 0.00 0.72 -0.07 0.00 -1.01 0.00 0.00 64.21 63.85 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 -1.83 -0.24 -0.12 6.43 3.84 -0.81 -5.13 114.94 117.08 1uht s ASN 83 Ca 0.28 0.43 -0.29 0.00 0.21 0.00 0.00 52.86 53.48 1uht s ASN 83 Cb 0.35 0.42 -0.01 0.00 -0.55 0.00 0.00 41.25 41.46 1uht s ASN 83 CO -0.06 -0.10 1.06 0.00 -2.79 0.00 0.00 177.10 175.21 1uht s ALA 84 N -0.07 3.48 1.27 1.71 0.00 -1.26 0.44 121.76 127.33 1uht s ALA 84 Ca 0.05 0.39 -0.19 0.00 0.00 0.00 0.00 51.96 52.21 1uht s ALA 84 Cb -0.04 -3.48 0.31 0.00 0.00 0.00 0.00 23.12 19.91 1uht s ALA 84 CO -0.10 -0.74 1.03 -0.51 0.00 0.00 0.00 175.76 175.45 1uht s LEU 85 N 2.33 0.11 0.04 0.00 1.43 -0.48 -4.92 118.68 117.19 1uht s LEU 85 Ca 0.49 0.85 0.02 0.00 -1.03 0.00 0.00 54.13 54.46 1uht s LEU 85 Cb -0.19 -2.52 -0.02 0.00 0.03 0.00 0.00 46.19 43.48 1uht s LEU 85 CO 0.16 -4.52 -0.07 -0.62 0.23 0.00 0.00 176.35 171.53 1uht s ASP 86 N -3.43 0.83 0.15 2.29 2.15 -1.26 -4.73 116.67 112.66 1uht s ASP 86 Ca 0.69 -0.49 -0.03 0.00 0.43 0.00 0.00 52.55 53.15 1uht s ASP 86 Cb -0.13 0.02 -0.04 0.00 -0.30 0.00 0.00 42.92 42.47 1uht s ASP 86 CO 0.58 -0.17 1.35 1.55 -0.17 0.00 0.00 175.17 178.31 1uht h PRO 87 N 4.69 0.41 -0.80 4.34 0.13 -1.98 -3.07 132.00 135.72 1uht h PRO 87 Ca -0.35 -0.40 -0.15 0.00 -0.87 0.00 0.00 66.00 64.23 1uht h PRO 87 Cb 1.20 0.10 -0.09 0.00 0.13 0.00 0.00 31.00 32.35 1uht h PRO 87 CO 0.42 1.06 0.19 0.39 -0.23 0.00 0.00 178.00 179.83 1uht n GLU 88 N -3.78 3.20 -3.71 0.86 1.02 -1.26 -4.78 120.64 112.18 1uht n GLU 88 Ca -0.06 -2.34 -0.13 0.00 -0.02 0.00 0.00 57.16 54.60 1uht n GLU 88 Cb 0.79 -2.01 -0.09 0.00 -0.02 0.00 0.00 31.44 30.10 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 -2.39 0.00 -0.08 2.62 2.01 -1.16 -5.16 115.64 111.49 1uht s THR 89 Ca 0.42 -0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.42 1uht s THR 89 Cb 0.33 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 72.19 1uht s THR 89 CO 0.11 -0.01 -0.16 -0.55 -0.69 0.00 0.00 174.62 173.32 1uht s SER 90 N 0.13 2.18 0.23 3.53 0.15 -1.26 -4.12 113.70 114.54 1uht s SER 90 Ca -0.01 -0.38 0.07 0.00 0.70 0.00 0.00 55.95 56.33 1uht s SER 90 Cb -0.03 -1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 63.24 1uht s SER 90 CO 0.01 0.07 0.17 -0.69 1.20 0.00 0.00 173.24 174.00 1uht s VAL 91 N 0.60 4.40 -0.03 4.45 1.01 -1.01 -4.90 120.40 124.91 1uht s VAL 91 Ca -0.15 -1.35 -0.24 0.00 0.00 0.00 0.00 61.98 60.24 1uht s VAL 91 Cb -0.16 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1uht s VAL 91 CO 0.05 -0.29 0.74 0.54 0.00 0.00 0.00 175.10 176.14 1uht s ASN 92 N -3.63 7.07 0.71 3.32 4.22 -1.26 0.15 114.94 125.51 1uht s ASN 92 Ca 0.32 1.29 -0.13 0.00 -2.14 0.00 0.00 52.86 52.20 1uht s ASN 92 Cb -0.08 -2.44 0.03 0.00 1.28 0.00 0.00 41.25 40.04 1uht s ASN 92 CO 0.24 -0.09 1.11 -0.76 -2.04 0.00 0.00 177.10 175.56 1uht s LEU 93 N 0.58 3.25 0.01 3.54 1.43 0.13 -4.87 118.68 122.75 1uht s LEU 93 Ca 0.39 1.97 -0.03 0.00 -1.03 0.00 0.00 54.13 55.43 1uht s LEU 93 Cb -0.19 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.48 1uht s LEU 93 CO 0.20 -1.85 0.04 -0.83 0.23 0.00 0.00 176.35 174.14 1uht s GLY 94 N -2.83 0.15 0.01 -3.19 0.00 -1.26 -4.68 107.32 95.52 1uht s GLY 94 Ca 0.65 -0.37 -0.30 0.00 0.00 0.00 0.00 44.72 44.71 1uht s GLY 94 CO 0.47 -0.45 1.43 -0.35 0.00 0.00 0.00 173.10 174.20 1uht s ASP 95 N -1.30 6.82 0.00 1.64 2.15 -1.26 -1.96 116.67 122.76 1uht s ASP 95 Ca -0.14 2.16 0.00 0.00 0.43 0.00 0.00 52.55 55.00 1uht s ASP 95 Cb -0.08 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.98 1uht s ASP 95 CO -0.00 -0.74 0.00 0.61 -0.17 0.00 0.00 175.17 174.87 1uht n GLY 96 N 3.69 0.67 3.80 2.66 0.00 0.51 -4.98 105.19 111.55 1uht n GLY 96 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1uht n GLY 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uht s ASP 97 N -2.70 5.81 -0.25 1.61 2.15 -0.83 -4.79 116.67 117.68 1uht s ASP 97 Ca 0.00 1.88 0.02 0.00 0.43 0.00 0.00 52.55 54.87 1uht s ASP 97 Cb 0.00 -2.54 0.06 0.00 -0.30 0.00 0.00 42.92 40.14 1uht s ASP 97 CO 0.00 -1.15 -0.08 -0.69 -0.17 0.00 0.00 175.17 173.08 1uht s VAL 98 N -2.32 1.80 -0.43 1.11 1.01 -1.26 -1.35 120.40 118.96 1uht s VAL 98 Ca 0.65 -1.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.04 1uht s VAL 98 Cb -0.17 -2.00 0.02 0.00 0.00 0.00 0.00 36.38 34.23 1uht s VAL 98 CO 0.34 -0.08 0.56 -0.63 0.00 0.00 0.00 175.10 175.29 1uht s ILE 99 N 1.27 4.93 -0.47 2.22 1.01 0.35 -0.12 121.20 130.40 1uht s ILE 99 Ca -0.07 -0.05 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 1uht s ILE 99 Cb -0.19 -4.13 0.07 0.00 0.01 0.00 0.00 42.46 38.21 1uht s ILE 99 CO -0.06 -0.51 0.40 -0.54 0.00 0.00 0.00 174.94 174.23 1uht s LYS 100 N 2.54 2.99 0.28 2.79 1.02 0.14 0.20 119.74 129.70 1uht s LYS 100 Ca 0.18 -1.27 0.07 0.00 0.02 0.00 0.00 55.97 54.97 1uht s LYS 100 Cb -0.15 -4.11 -0.06 0.00 -0.52 0.00 0.00 37.83 32.99 1uht s LYS 100 CO 0.17 -1.01 -0.07 -0.48 -0.92 0.00 0.00 175.35 173.03 1uht s LEU 101 N 1.72 2.51 0.00 3.17 2.34 -0.14 -1.79 118.68 126.48 1uht s LEU 101 Ca 0.05 -1.17 0.00 0.00 0.06 0.00 0.00 54.13 53.07 1uht s LEU 101 Cb -0.23 -0.68 0.00 0.00 -0.56 0.00 0.00 46.19 44.72 1uht s LEU 101 CO 0.07 -0.30 0.00 0.61 -1.06 0.00 0.00 176.35 175.67 1uht n GLY 102 N -0.58 1.83 0.03 -3.48 0.00 -1.26 -2.72 105.19 99.02 1uht n GLY 102 Ca -0.06 -0.51 -0.03 0.00 0.00 0.00 0.00 46.02 45.42 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 13.01 0.20 -2.56 1.61 1.02 -1.26 -4.82 120.64 127.84 1uht n GLU 103 Ca 0.00 0.08 -0.19 0.00 -0.02 0.00 0.00 57.16 57.03 1uht n GLU 103 Cb 0.00 -0.86 0.01 0.00 -0.02 0.00 0.00 31.44 30.57 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 -3.25 2.43 -4.28 -0.32 4.02 -1.26 -5.04 117.16 109.46 1uht n TYR 104 Ca -0.05 -2.97 -0.33 0.00 -0.01 0.00 0.00 57.90 54.54 1uht n TYR 104 Cb 0.20 -0.21 -0.15 0.00 -0.02 0.00 0.00 39.34 39.15 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 -4.49 2.49 -0.06 -0.72 2.01 -1.10 0.23 115.64 114.00 1uht s THR 105 Ca 0.39 -0.81 0.05 0.00 0.31 0.00 0.00 61.69 61.62 1uht s THR 105 Cb 0.43 -2.06 -0.00 0.00 0.01 0.00 0.00 72.50 70.87 1uht s THR 105 CO -0.09 0.51 -0.20 -0.44 -0.69 0.00 0.00 174.62 173.71 1uht s SER 106 N 1.11 2.57 -0.05 3.53 0.01 -1.25 -0.97 113.70 118.65 1uht s SER 106 Ca 0.00 -0.43 0.06 0.00 1.31 0.00 0.00 55.95 56.89 1uht s SER 106 Cb -0.14 -0.86 -0.01 0.00 0.21 0.00 0.00 66.02 65.22 1uht s SER 106 CO -0.06 0.17 -0.24 -0.63 0.41 0.00 0.00 173.24 172.89 1uht s ILE 107 N 0.11 2.00 -0.03 1.44 1.01 0.13 -2.00 121.20 123.85 1uht s ILE 107 Ca -0.08 -1.04 -0.02 0.00 0.00 0.00 0.00 60.65 59.51 1uht s ILE 107 Cb -0.14 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 1uht s ILE 107 CO 0.04 0.56 0.11 -0.22 0.00 0.00 0.00 174.94 175.42 1uht s LEU 108 N -0.17 4.06 -0.24 2.97 2.96 0.33 0.13 118.68 128.72 1uht s LEU 108 Ca -0.03 0.25 -0.08 0.00 -0.22 0.00 0.00 54.13 54.05 1uht s LEU 108 Cb -0.13 -2.26 -0.04 0.00 0.50 0.00 0.00 46.19 44.26 1uht s LEU 108 CO 0.03 0.31 0.10 -0.69 -1.32 0.00 0.00 176.35 174.78 1uht s VAL 109 N -1.16 4.62 -0.08 1.68 1.01 -0.46 -0.49 120.40 125.52 1uht s VAL 109 Ca 0.21 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.14 1uht s VAL 109 Cb -0.12 -3.16 0.02 0.00 0.00 0.00 0.00 36.38 33.12 1uht s VAL 109 CO 0.12 0.34 -0.11 0.20 0.00 0.00 0.00 175.10 175.65 1uht s ASN 110 N 1.44 1.89 -0.49 3.32 0.02 -0.67 0.19 114.94 120.64 1uht s ASN 110 Ca 0.06 -0.30 -0.19 0.00 -1.02 0.00 0.00 52.86 51.40 1uht s ASN 110 Cb -0.15 -0.84 0.05 0.00 0.02 0.00 0.00 41.25 40.33 1uht s ASN 110 CO 0.05 -0.00 0.62 -0.36 0.02 0.00 0.00 177.10 177.43 1uht s PHE 111 N 0.92 3.05 -0.19 2.20 0.08 -1.26 -0.81 117.98 121.98 1uht s PHE 111 Ca -0.10 -0.40 -0.15 0.00 0.12 0.00 0.00 56.93 56.40 1uht s PHE 111 Cb -0.15 -3.45 -0.04 0.00 -0.57 0.00 0.00 43.02 38.80 1uht s PHE 111 CO 0.01 -0.98 0.35 0.08 -0.10 0.00 0.00 175.22 174.58 1uht s VAL 112 N 2.67 5.25 -0.07 -0.44 1.01 -0.50 -4.83 120.40 123.48 1uht s VAL 112 Ca 0.17 0.62 -0.02 0.00 0.00 0.00 0.00 61.98 62.75 1uht s VAL 112 Cb -0.18 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1uht s VAL 112 CO 0.14 0.31 -0.08 -0.24 0.00 0.00 0.00 175.10 175.23 1uht n SER 113 N 4.14 1.86 -1.64 3.32 2.88 -1.26 0.99 113.62 123.92 1uht n SER 113 Ca -0.10 0.03 -0.02 0.00 -1.33 0.00 0.00 58.87 57.45 1uht n SER 113 Cb 0.51 -0.16 -0.01 0.00 -0.75 0.00 0.00 64.21 63.81 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 2.84 4.05 3.80 0.46 0.00 -1.26 -4.95 105.19 110.13 1uht n GLY 114 Ca -0.13 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.63 1uht n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uht s PRO 115 N -2.11 3.53 0.19 1.61 0.04 -1.26 -5.07 135.00 131.93 1uht s PRO 115 Ca 0.01 1.23 -0.16 0.00 0.04 0.00 0.00 61.00 62.12 1uht s PRO 115 Cb 0.00 -2.06 0.02 0.00 0.04 0.00 0.00 34.50 32.50 1uht s PRO 115 CO 0.01 -0.64 0.48 0.45 0.04 0.00 0.00 177.00 177.34 1uht s SER 116 N -2.56 -0.20 -0.22 6.66 0.15 -1.26 -5.04 113.70 111.23 1uht s SER 116 Ca 0.64 -0.55 -0.04 0.00 0.70 0.00 0.00 55.95 56.70 1uht s SER 116 Cb -0.15 0.55 0.01 0.00 -1.71 0.00 0.00 66.02 64.71 1uht s SER 116 CO 0.31 -1.02 0.10 -0.24 1.20 0.00 0.00 173.24 173.59 1uht n SER 117 N -0.32 -7.33 -0.11 5.45 2.88 -1.26 -5.27 113.62 107.67 1uht n SER 117 Ca -0.10 0.88 0.01 0.00 -1.33 0.00 0.00 58.87 58.33 1uht n SER 117 Cb 0.63 -3.72 0.01 0.00 -0.75 0.00 0.00 64.21 60.37 1uht n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42