#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1udl h SER 2 N 0.00 0.45 -6.97 1.61 4.64 -2.05 -3.46 113.55 107.78 1udl h SER 2 Ca 0.00 0.01 -0.59 0.00 -0.47 0.00 0.00 61.79 60.74 1udl h SER 2 Cb 0.00 -0.08 -0.29 0.00 -0.31 0.00 0.00 62.40 61.72 1udl h SER 2 CO 0.00 0.32 -0.88 -1.54 -0.87 0.00 0.00 176.83 173.86 1udl n SER 3 N -4.83 -2.29 0.00 4.97 3.41 -1.26 -4.47 113.62 109.16 1udl n SER 3 Ca 0.04 -1.14 0.00 0.00 -0.26 0.00 0.00 58.87 57.51 1udl n SER 3 Cb 0.10 -2.17 0.00 0.00 -0.26 0.00 0.00 64.21 61.88 1udl n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1udl n GLY 4 N -1.33 -1.32 3.56 5.00 0.00 -1.26 -4.92 105.19 104.93 1udl n GLY 4 Ca 0.06 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.49 1udl n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1udl s SER 5 N -2.06 5.39 -0.43 1.61 0.15 -1.26 -4.91 113.70 112.19 1udl s SER 5 Ca 0.00 0.66 -0.27 0.00 0.70 0.00 0.00 55.95 57.04 1udl s SER 5 Cb 0.00 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.75 1udl s SER 5 CO 0.00 -2.22 1.99 -0.44 1.20 0.00 0.00 173.24 173.77 1udl s SER 6 N 7.81 5.37 0.00 5.45 0.01 -1.26 -4.44 113.70 126.64 1udl s SER 6 Ca 0.73 1.07 0.00 0.00 1.31 0.00 0.00 55.95 59.05 1udl s SER 6 Cb -0.16 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.56 1udl s SER 6 CO 0.25 -2.17 0.00 0.61 0.41 0.00 0.00 173.24 172.34 1udl n GLY 7 N 5.66 0.00 3.62 3.44 0.00 -1.26 -5.15 105.19 111.51 1udl n GLY 7 Ca 0.26 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.92 1udl n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1udl s GLN 8 N 0.00 3.99 -0.17 1.61 -2.07 -1.26 -4.97 119.66 116.79 1udl s GLN 8 Ca 0.00 -0.32 -0.09 0.00 -1.82 0.00 0.00 55.36 53.13 1udl s GLN 8 Cb 0.00 -3.41 -0.07 0.00 -1.09 0.00 0.00 33.01 28.44 1udl s GLN 8 CO 0.00 0.09 -0.23 1.17 -1.32 0.00 0.00 175.29 175.00 1udl n LYS 9 N 4.14 0.38 0.00 9.60 3.00 -1.26 -5.07 118.16 128.95 1udl n LYS 9 Ca -0.16 0.16 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1udl n LYS 9 Cb 0.52 -1.14 0.00 0.00 0.00 0.00 0.00 35.03 34.41 1udl n LYS 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1udl n GLY 10 N 1.91 3.96 3.72 3.14 0.00 -1.26 -5.10 105.19 111.55 1udl n GLY 10 Ca -0.32 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.42 1udl n GLY 10 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1udl s TRP 11 N 0.00 3.51 -0.03 1.61 -0.11 -1.26 -5.04 118.94 117.62 1udl s TRP 11 Ca 0.00 1.43 0.05 0.00 1.22 0.00 0.00 56.10 58.80 1udl s TRP 11 Cb 0.00 -3.34 -0.01 0.00 -1.50 0.00 0.00 33.47 28.62 1udl s TRP 11 CO 0.00 -0.93 -0.18 -0.59 -4.62 0.00 0.00 176.95 170.62 1udl s PHE 12 N 0.76 1.74 1.24 5.86 -0.12 -1.26 -5.15 117.98 121.06 1udl s PHE 12 Ca 0.56 -0.41 -0.21 0.00 -0.05 0.00 0.00 56.93 56.81 1udl s PHE 12 Cb -0.28 -1.14 0.31 0.00 -0.63 0.00 0.00 43.02 41.27 1udl s PHE 12 CO 0.30 -0.10 1.10 -0.35 -0.05 0.00 0.00 175.22 176.13 1udl n PRO 13 N 2.86 -3.17 -0.17 1.99 -0.04 -1.26 -5.01 135.00 130.21 1udl n PRO 13 Ca -0.16 -1.76 0.07 0.00 -0.04 0.00 0.00 63.50 61.61 1udl n PRO 13 Cb 0.53 -1.65 0.10 0.00 -0.04 0.00 0.00 33.50 32.45 1udl n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1udl n ALA 14 N -4.89 2.19 -2.58 0.55 0.00 -1.26 -5.05 120.51 109.47 1udl n ALA 14 Ca -0.21 -2.21 -0.24 0.00 0.00 0.00 0.00 53.44 50.79 1udl n ALA 14 Cb 0.59 -0.40 -0.08 0.00 0.00 0.00 0.00 19.45 19.56 1udl n ALA 14 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1udl s SER 15 N -2.39 4.25 -0.38 0.00 1.04 -1.26 -5.11 113.70 109.85 1udl s SER 15 Ca 0.24 -0.81 -0.08 0.00 0.48 0.00 0.00 55.95 55.78 1udl s SER 15 Cb 0.21 -0.65 0.06 0.00 0.10 0.00 0.00 66.02 65.74 1udl s SER 15 CO 0.02 -0.05 0.18 -2.28 0.98 0.00 0.00 173.24 172.10 1udl s HIS 16 N -2.41 3.31 -0.04 5.02 2.46 -1.26 -5.08 115.29 117.28 1udl s HIS 16 Ca 0.32 -1.46 -0.01 0.00 0.47 0.00 0.00 55.06 54.37 1udl s HIS 16 Cb -0.05 -2.62 -0.04 0.00 -0.13 0.00 0.00 32.58 29.75 1udl s HIS 16 CO 0.19 -0.78 0.06 0.54 -2.47 0.00 0.00 174.74 172.27 1udl s VAL 17 N 1.42 4.65 -0.25 0.89 0.11 -1.26 -5.02 120.40 120.94 1udl s VAL 17 Ca 0.01 -0.30 0.09 0.00 -2.93 0.00 0.00 61.98 58.86 1udl s VAL 17 Cb -0.21 -3.06 0.44 0.00 -1.53 0.00 0.00 36.38 32.02 1udl s VAL 17 CO 0.03 0.46 1.20 0.29 -3.33 0.00 0.00 175.10 173.76 1udl n LYS 18 N 1.59 2.54 -4.41 1.54 5.02 -1.26 -5.03 118.16 118.15 1udl n LYS 18 Ca -0.16 -3.71 -0.31 0.00 -2.02 0.00 0.00 58.31 52.11 1udl n LYS 18 Cb 0.53 -1.92 -0.10 0.00 -0.02 0.00 0.00 35.03 33.52 1udl n LYS 18 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 1udl s LEU 19 N -3.39 3.08 -0.21 -0.35 0.05 -1.26 -5.12 118.68 111.47 1udl s LEU 19 Ca 0.44 -0.25 -0.27 0.00 0.05 0.00 0.00 54.13 54.10 1udl s LEU 19 Cb 0.39 -1.81 0.08 0.00 -2.05 0.00 0.00 46.19 42.80 1udl s LEU 19 CO -0.02 0.24 0.74 -1.48 -0.55 0.00 0.00 176.35 175.29 1udl s LEU 20 N -1.69 -0.69 -0.05 1.48 2.34 -1.26 -5.18 118.68 113.63 1udl s LEU 20 Ca 0.18 1.19 -0.31 0.00 0.06 0.00 0.00 54.13 55.25 1udl s LEU 20 Cb -0.11 2.42 0.13 0.00 -0.56 0.00 0.00 46.19 48.07 1udl s LEU 20 CO 0.10 -0.33 1.33 -0.83 -1.06 0.00 0.00 176.35 175.55 1udl s GLY 21 N -0.07 -0.43 -0.36 -3.48 0.00 -1.26 -5.12 107.32 96.60 1udl s GLY 21 Ca -0.03 0.81 -0.28 0.00 0.00 0.00 0.00 44.72 45.22 1udl s GLY 21 CO 0.03 0.16 1.70 2.56 0.00 0.00 0.00 173.10 177.55 1udl s PRO 22 N -2.31 3.36 0.37 2.90 0.04 -1.26 -4.99 135.00 133.11 1udl s PRO 22 Ca 0.14 1.27 0.08 0.00 0.04 0.00 0.00 61.00 62.54 1udl s PRO 22 Cb 0.05 -4.16 -0.06 0.00 0.04 0.00 0.00 34.50 30.37 1udl s PRO 22 CO -0.05 -1.82 0.01 -1.12 0.04 0.00 0.00 177.00 174.07 1udl s SER 23 N 5.64 4.06 0.44 6.66 0.01 -1.26 -5.15 113.70 124.09 1udl s SER 23 Ca 0.75 -1.12 0.04 0.00 1.31 0.00 0.00 55.95 56.92 1udl s SER 23 Cb -0.20 -0.46 0.01 0.00 0.21 0.00 0.00 66.02 65.58 1udl s SER 23 CO 0.33 -0.32 0.62 -0.55 0.41 0.00 0.00 173.24 173.73 1udl s SER 24 N -3.72 5.71 -0.16 2.44 0.15 -1.26 -5.10 113.70 111.75 1udl s SER 24 Ca 0.35 -0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.96 1udl s SER 24 Cb 0.03 -1.13 0.00 0.00 -1.71 0.00 0.00 66.02 63.21 1udl s SER 24 CO 0.19 -0.74 -0.16 -1.61 1.20 0.00 0.00 173.24 172.12 1udl s GLU 25 N -4.46 3.18 -0.03 5.44 0.41 -1.26 -5.11 118.70 116.86 1udl s GLU 25 Ca 0.51 -0.76 -0.14 0.00 -0.41 0.00 0.00 54.97 54.16 1udl s GLU 25 Cb -0.10 -2.62 -0.05 0.00 -1.78 0.00 0.00 34.13 29.57 1udl s GLU 25 CO 0.35 -0.03 0.38 1.03 -0.49 0.00 0.00 175.26 176.50 1udl s ARG 26 N 0.92 3.94 -0.14 1.61 0.52 -1.26 -4.98 118.95 119.54 1udl s ARG 26 Ca -0.04 0.34 0.15 0.00 -0.52 0.00 0.00 55.73 55.66 1udl s ARG 26 Cb -0.15 -3.25 0.39 0.00 0.52 0.00 0.00 34.95 32.46 1udl s ARG 26 CO -0.02 0.62 1.19 0.00 0.02 0.00 0.00 175.30 177.11 1udl n ALA 27 N 2.14 3.14 -2.24 2.13 0.00 -1.26 -5.06 120.51 119.36 1udl n ALA 27 Ca -0.14 -2.91 -0.42 0.00 0.00 0.00 0.00 53.44 49.97 1udl n ALA 27 Cb 0.52 -0.45 -0.03 0.00 0.00 0.00 0.00 19.45 19.50 1udl n ALA 27 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1udl s THR 28 N -2.32 3.61 0.29 0.00 -4.23 -1.26 -4.92 115.64 106.80 1udl s THR 28 Ca 0.35 1.09 0.07 0.00 -1.18 0.00 0.00 61.69 62.02 1udl s THR 28 Cb 0.35 -3.70 0.02 0.00 1.34 0.00 0.00 72.50 70.51 1udl s THR 28 CO -0.08 0.05 1.67 1.55 -0.54 0.00 0.00 174.62 177.27 1udl h PRO 29 N 7.26 0.20 -6.54 3.99 0.13 -2.07 -3.43 132.00 131.54 1udl h PRO 29 Ca -0.40 -0.11 -0.53 0.00 -0.87 0.00 0.00 66.00 64.09 1udl h PRO 29 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.34 1udl h PRO 29 CO 0.87 0.63 0.54 0.00 -0.23 0.00 0.00 178.00 179.82 1udl s ALA 30 N -4.02 3.39 0.14 -0.56 0.00 -1.26 -5.04 121.76 114.41 1udl s ALA 30 Ca -0.04 0.86 0.06 0.00 0.00 0.00 0.00 51.96 52.84 1udl s ALA 30 Cb 0.13 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 1udl s ALA 30 CO 0.77 -0.38 0.02 -0.59 0.00 0.00 0.00 175.76 175.58 1udl s PHE 31 N 0.66 2.94 -0.27 0.00 -0.12 -1.26 -5.11 117.98 114.81 1udl s PHE 31 Ca 0.56 -0.08 -0.01 0.00 -0.05 0.00 0.00 56.93 57.35 1udl s PHE 31 Cb -0.30 -1.46 0.09 0.00 -0.63 0.00 0.00 43.02 40.72 1udl s PHE 31 CO 0.31 0.50 0.07 -1.01 -0.05 0.00 0.00 175.22 175.04 1udl s HIS 32 N -1.56 1.58 0.99 3.49 3.76 -1.26 -5.14 115.29 117.15 1udl s HIS 32 Ca 0.27 -1.51 -0.12 0.00 -0.15 0.00 0.00 55.06 53.55 1udl s HIS 32 Cb -0.10 -1.52 0.18 0.00 1.11 0.00 0.00 32.58 32.25 1udl s HIS 32 CO 0.19 -0.80 1.09 -1.25 -0.85 0.00 0.00 174.74 173.12 1udl s PRO 33 N 1.66 0.52 -0.07 8.40 0.04 -1.26 -4.97 135.00 139.32 1udl s PRO 33 Ca 0.06 0.56 -0.03 0.00 0.04 0.00 0.00 61.00 61.63 1udl s PRO 33 Cb -0.17 -1.74 -0.26 0.00 0.04 0.00 0.00 34.50 32.36 1udl s PRO 33 CO -0.19 -2.68 0.56 -0.39 0.04 0.00 0.00 177.00 174.33 1udl h VAL 34 N -1.86 0.81 -2.80 -0.36 -1.51 -0.60 -3.48 116.25 106.46 1udl h VAL 34 Ca -0.54 -2.52 0.07 0.00 -1.23 0.00 0.00 66.70 62.48 1udl h VAL 34 Cb 1.32 2.57 -0.03 0.00 -2.13 0.00 0.00 31.29 33.02 1udl h VAL 34 CO 0.57 0.80 0.36 0.00 -1.23 0.00 0.00 177.57 178.07 1udl s GLN 36 N -2.85 2.48 0.39 0.00 0.74 -1.26 -0.99 119.66 118.17 1udl s GLN 36 Ca 0.15 -0.65 0.04 0.00 0.05 0.00 0.00 55.36 54.95 1udl s GLN 36 Cb -0.04 -2.13 -0.05 0.00 1.10 0.00 0.00 33.01 31.89 1udl s GLN 36 CO 0.08 -0.11 0.05 0.14 -0.55 0.00 0.00 175.29 174.89 1udl s VAL 37 N 1.11 1.28 0.07 1.34 -7.23 -0.13 -3.11 120.40 113.73 1udl s VAL 37 Ca -0.03 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.20 1udl s VAL 37 Cb -0.14 -2.66 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 1udl s VAL 37 CO -0.05 0.00 -0.16 -0.51 -0.31 0.00 0.00 175.10 174.07 1udl s ILE 38 N -3.07 1.29 0.10 -0.62 2.07 -0.66 -2.68 121.20 117.64 1udl s ILE 38 Ca 0.29 -1.30 -0.31 0.00 -1.41 0.00 0.00 60.65 57.92 1udl s ILE 38 Cb 0.07 -1.20 -0.07 0.00 0.13 0.00 0.00 42.46 41.38 1udl s ILE 38 CO 0.14 -0.11 1.37 0.00 -1.91 0.00 0.00 174.94 174.42 1udl s ALA 39 N -1.13 3.56 0.02 1.50 0.00 -1.22 -0.00 121.76 124.48 1udl s ALA 39 Ca 0.01 1.06 0.09 0.00 0.00 0.00 0.00 51.96 53.13 1udl s ALA 39 Cb -0.09 -3.53 -0.23 0.00 0.00 0.00 0.00 23.12 19.27 1udl s ALA 39 CO 0.03 -0.61 0.90 0.52 0.00 0.00 0.00 175.76 176.60 1udl h MET 40 N 6.89 0.02 -4.39 0.00 0.00 -1.66 -0.30 114.93 115.49 1udl h MET 40 Ca -0.42 -0.03 -0.16 0.00 0.00 0.00 0.00 59.70 59.10 1udl h MET 40 Cb 1.21 0.01 -0.15 0.00 0.00 0.00 0.00 31.60 32.67 1udl h MET 40 CO 0.86 0.72 -0.69 0.71 0.00 0.00 0.00 176.91 178.52 1udl s TYR 41 N -2.64 0.65 -0.60 -0.22 1.51 -1.26 -4.82 117.35 109.97 1udl s TYR 41 Ca -0.03 -0.99 -0.26 0.00 -1.01 0.00 0.00 57.07 54.78 1udl s TYR 41 Cb 0.09 -0.43 -0.05 0.00 -0.11 0.00 0.00 41.96 41.46 1udl s TYR 41 CO 0.82 -0.29 2.10 0.16 -1.11 0.00 0.00 175.55 177.24 1udl s ASP 42 N -2.90 4.86 -0.12 2.29 -4.77 -1.26 -3.60 116.67 111.16 1udl s ASP 42 Ca 0.08 0.50 -0.20 0.00 -3.30 0.00 0.00 52.55 49.63 1udl s ASP 42 Cb 0.06 -2.52 -0.04 0.00 -1.09 0.00 0.00 42.92 39.33 1udl s ASP 42 CO -0.08 -2.69 0.59 -0.47 0.70 0.00 0.00 175.17 173.22 1udl s TYR 43 N 10.69 3.49 -0.35 2.11 6.14 -0.41 -4.87 117.35 134.15 1udl s TYR 43 Ca 0.80 1.01 0.03 0.00 0.64 0.00 0.00 57.07 59.55 1udl s TYR 43 Cb -0.14 -2.70 0.10 0.00 0.42 0.00 0.00 41.96 39.65 1udl s TYR 43 CO 0.20 0.05 0.07 0.00 0.64 0.00 0.00 175.55 176.50 1udl s ALA 44 N 1.03 2.93 -0.08 3.97 0.00 -1.26 -0.05 121.76 128.29 1udl s ALA 44 Ca 0.30 -2.54 -0.38 0.00 0.00 0.00 0.00 51.96 49.34 1udl s ALA 44 Cb -0.16 -2.01 -0.16 0.00 0.00 0.00 0.00 23.12 20.78 1udl s ALA 44 CO 0.13 -1.70 1.51 0.00 0.00 0.00 0.00 175.76 175.70 1udl n ALA 45 N 4.28 -0.72 0.54 0.00 0.00 -1.23 -4.81 120.51 118.57 1udl n ALA 45 Ca 0.03 0.46 0.09 0.00 0.00 0.00 0.00 53.44 54.03 1udl n ALA 45 Cb 0.42 -2.13 0.39 0.00 0.00 0.00 0.00 19.45 18.13 1udl n ALA 45 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1udl n ASN 46 N 3.73 0.17 -3.58 0.00 3.02 -1.26 -4.83 115.26 112.51 1udl n ASN 46 Ca 0.22 0.54 -0.06 0.00 -0.03 0.00 0.00 54.58 55.25 1udl n ASN 46 Cb 0.16 -0.57 -0.02 0.00 -0.61 0.00 0.00 39.78 38.74 1udl n ASN 46 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1udl s ASN 47 N -3.31 -0.28 0.51 6.41 6.03 -1.26 -4.99 114.94 118.04 1udl s ASN 47 Ca 0.07 -0.11 0.19 0.00 -1.03 0.00 0.00 52.86 51.98 1udl s ASN 47 Cb 0.11 0.37 1.03 0.00 -3.03 0.00 0.00 41.25 39.73 1udl s ASN 47 CO 0.33 -0.63 1.53 -0.33 -2.03 0.00 0.00 177.10 175.97 1udl h GLU 48 N 2.00 0.00 -0.16 3.55 4.39 -2.03 0.43 114.58 122.76 1udl h GLU 48 Ca -0.22 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.34 1udl h GLU 48 Cb 1.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.87 1udl h GLU 48 CO 0.29 0.00 -0.49 -0.44 -1.16 0.00 0.00 179.01 177.21 1udl h ASP 49 N 0.00 0.47 -1.86 1.42 3.32 -1.97 -3.45 116.42 114.35 1udl h ASP 49 Ca 0.00 -0.23 -0.45 0.00 0.02 0.00 0.00 57.03 56.37 1udl h ASP 49 Cb 0.79 -0.13 0.04 0.00 0.22 0.00 0.00 39.33 40.25 1udl h ASP 49 CO 0.00 0.88 -0.07 -1.61 -1.72 0.00 0.00 179.24 176.72 1udl s GLU 50 N -4.06 2.38 -0.18 3.56 2.02 0.15 -3.60 118.70 118.98 1udl s GLU 50 Ca -0.06 -1.12 -0.06 0.00 0.02 0.00 0.00 54.97 53.75 1udl s GLU 50 Cb 0.12 -2.55 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 1udl s GLU 50 CO 0.81 -0.79 0.03 -1.17 0.02 0.00 0.00 175.26 174.16 1udl s LEU 51 N -4.73 3.57 -0.26 1.80 0.20 -0.81 -4.42 118.68 114.03 1udl s LEU 51 Ca 0.59 -0.03 -0.10 0.00 0.69 0.00 0.00 54.13 55.29 1udl s LEU 51 Cb -0.08 -1.89 -0.04 0.00 -0.43 0.00 0.00 46.19 43.74 1udl s LEU 51 CO 0.38 0.15 0.14 -0.55 -0.29 0.00 0.00 176.35 176.18 1udl s SER 52 N 0.50 5.71 0.26 3.68 0.15 -1.26 -3.52 113.70 119.22 1udl s SER 52 Ca 0.01 -0.06 -0.03 0.00 0.70 0.00 0.00 55.95 56.57 1udl s SER 52 Cb -0.13 -2.04 -0.02 0.00 -1.71 0.00 0.00 66.02 62.11 1udl s SER 52 CO 0.02 -0.02 0.31 0.72 1.20 0.00 0.00 173.24 175.47 1udl s PHE 53 N 1.56 1.02 0.01 3.44 -0.71 0.93 -4.89 117.98 119.34 1udl s PHE 53 Ca 0.07 -1.24 0.08 0.00 -1.04 0.00 0.00 56.93 54.80 1udl s PHE 53 Cb -0.15 -0.29 -0.02 0.00 -1.21 0.00 0.00 43.02 41.34 1udl s PHE 53 CO 0.07 -0.87 -0.24 -1.12 -1.34 0.00 0.00 175.22 171.73 1udl s SER 54 N -3.17 2.86 -0.33 1.98 0.01 -1.26 -1.29 113.70 112.49 1udl s SER 54 Ca 0.33 -0.49 -0.33 0.00 1.31 0.00 0.00 55.95 56.77 1udl s SER 54 Cb 0.03 -0.29 -0.14 0.00 0.21 0.00 0.00 66.02 65.82 1udl s SER 54 CO 0.15 0.27 1.12 1.17 0.41 0.00 0.00 173.24 176.36 1udl n LYS 55 N 2.20 0.00 -0.57 12.44 4.81 -1.24 -0.78 118.16 135.02 1udl n LYS 55 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 1udl n LYS 55 Cb 0.52 -1.07 0.00 0.00 0.02 0.00 0.00 35.03 34.50 1udl n LYS 55 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1udl n GLY 56 N 2.74 0.96 3.88 3.14 0.00 -0.12 -4.94 105.19 110.84 1udl n GLY 56 Ca 0.22 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 1udl n GLY 56 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1udl s GLN 57 N -1.35 3.68 -0.57 1.61 2.00 0.04 -4.84 119.66 120.23 1udl s GLN 57 Ca 0.00 0.50 -0.26 0.00 -2.00 0.00 0.00 55.36 53.60 1udl s GLN 57 Cb 0.00 -2.29 0.04 0.00 0.80 0.00 0.00 33.01 31.56 1udl s GLN 57 CO 0.00 -0.23 1.07 -1.17 -0.50 0.00 0.00 175.29 174.46 1udl s LEU 58 N -4.45 3.76 -0.09 3.68 2.96 -1.26 -3.45 118.68 119.83 1udl s LEU 58 Ca 0.52 -0.11 0.04 0.00 -0.22 0.00 0.00 54.13 54.35 1udl s LEU 58 Cb -0.10 -3.00 0.00 0.00 0.50 0.00 0.00 46.19 43.58 1udl s LEU 58 CO 0.41 -1.36 -0.22 -0.63 -1.32 0.00 0.00 176.35 173.22 1udl s ILE 59 N 4.48 1.90 -0.34 6.68 1.01 -1.09 -4.04 121.20 129.80 1udl s ILE 59 Ca 0.37 -0.94 0.04 0.00 0.00 0.00 0.00 60.65 60.12 1udl s ILE 59 Cb -0.10 -1.65 0.10 0.00 0.01 0.00 0.00 42.46 40.83 1udl s ILE 59 CO 0.22 0.53 0.06 0.20 0.00 0.00 0.00 174.94 175.95 1udl s ASN 60 N 0.31 4.71 0.07 3.58 -0.87 -1.20 -0.95 114.94 120.59 1udl s ASN 60 Ca -0.16 -2.13 -0.32 0.00 -1.57 0.00 0.00 52.86 48.68 1udl s ASN 60 Cb -0.17 -1.57 -0.11 0.00 -0.02 0.00 0.00 41.25 39.38 1udl s ASN 60 CO 0.07 -0.38 1.81 0.52 -2.57 0.00 0.00 177.10 176.56 1udl n VAL 61 N 4.28 0.39 -0.06 1.60 0.31 -0.16 -3.31 118.33 121.38 1udl n VAL 61 Ca 0.04 -0.07 -0.08 0.00 -0.01 0.00 0.00 64.34 64.21 1udl n VAL 61 Cb 0.42 -1.97 -0.07 0.00 -0.91 0.00 0.00 33.84 31.31 1udl n VAL 61 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1udl n MET 62 N 5.64 0.95 -3.58 5.55 2.81 0.78 -0.02 117.12 129.25 1udl n MET 62 Ca 0.19 0.05 -0.26 0.00 -1.81 0.00 0.00 57.70 55.87 1udl n MET 62 Cb 0.34 -1.27 -0.16 0.00 -0.71 0.00 0.00 33.22 31.42 1udl n MET 62 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1udl s ASN 63 N -5.00 2.66 -0.36 7.83 2.47 -1.24 -4.13 114.94 117.17 1udl s ASN 63 Ca -0.14 -0.81 0.06 0.00 0.42 0.00 0.00 52.86 52.39 1udl s ASN 63 Cb 0.04 -0.23 0.45 0.00 -1.45 0.00 0.00 41.25 40.06 1udl s ASN 63 CO 0.35 -0.38 1.24 2.29 -3.72 0.00 0.00 177.10 176.89 1udl n LYS 64 N 5.27 3.50 -0.17 0.43 2.85 -1.26 -2.62 118.16 126.16 1udl n LYS 64 Ca -0.07 -4.18 0.24 0.00 -1.05 0.00 0.00 58.31 53.26 1udl n LYS 64 Cb 0.47 -2.27 0.65 0.00 -0.65 0.00 0.00 35.03 33.23 1udl n LYS 64 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 177.40 177.73 1udl h ASP 65 N 2.28 0.13 -3.37 -5.58 2.03 -1.95 -3.38 116.42 106.58 1udl h ASP 65 Ca 0.37 0.01 -0.64 0.00 -0.73 0.00 0.00 57.03 56.04 1udl h ASP 65 Cb 1.32 -0.01 -0.23 0.00 -0.83 0.00 0.00 39.33 39.58 1udl h ASP 65 CO 0.85 0.05 -0.67 -1.81 -1.03 0.00 0.00 179.24 176.62 1udl s ASP 66 N -5.72 4.73 0.00 4.15 1.01 -1.26 -4.97 116.67 114.61 1udl s ASP 66 Ca -0.06 -0.20 0.15 0.00 0.71 0.00 0.00 52.55 53.15 1udl s ASP 66 Cb 0.22 -1.79 0.88 0.00 1.01 0.00 0.00 42.92 43.23 1udl s ASP 66 CO 0.77 0.10 1.30 -0.81 0.21 0.00 0.00 175.17 176.74 1udl n PRO 67 N 3.98 0.48 -0.11 8.23 -0.04 -1.26 -3.03 135.00 143.26 1udl n PRO 67 Ca -0.17 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.06 1udl n PRO 67 Cb 0.52 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 1udl n PRO 67 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1udl n ASP 68 N -0.98 1.89 -4.21 3.54 8.00 -1.26 -4.72 116.55 118.81 1udl n ASP 68 Ca 0.11 0.41 -0.23 0.00 0.71 0.00 0.00 54.79 55.79 1udl n ASP 68 Cb 0.05 -0.92 -0.13 0.00 -0.02 0.00 0.00 41.12 40.10 1udl n ASP 68 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1udl s TRP 69 N -2.41 1.56 0.16 1.24 0.52 -1.17 -0.98 118.94 117.87 1udl s TRP 69 Ca -0.31 -0.37 0.08 0.00 0.02 0.00 0.00 56.10 55.52 1udl s TRP 69 Cb 0.08 -0.92 -0.04 0.00 -1.15 0.00 0.00 33.47 31.44 1udl s TRP 69 CO 0.54 0.08 -0.18 -1.58 0.02 0.00 0.00 176.95 175.83 1udl s TRP 70 N -0.88 1.80 -0.18 -1.98 0.51 0.61 -4.30 118.94 114.52 1udl s TRP 70 Ca 0.05 -0.47 -0.03 0.00 -2.12 0.00 0.00 56.10 53.52 1udl s TRP 70 Cb -0.09 -0.90 -0.02 0.00 -0.81 0.00 0.00 33.47 31.65 1udl s TRP 70 CO 0.02 0.32 -0.05 -1.14 -0.51 0.00 0.00 176.95 175.59 1udl s GLN 71 N -2.77 3.51 0.37 4.98 0.74 -1.08 -2.77 119.66 122.64 1udl s GLN 71 Ca 0.15 -0.59 0.06 0.00 0.05 0.00 0.00 55.36 55.03 1udl s GLN 71 Cb -0.06 -2.92 -0.03 0.00 1.10 0.00 0.00 33.01 31.11 1udl s GLN 71 CO 0.06 0.05 0.21 0.20 -0.55 0.00 0.00 175.29 175.27 1udl s GLY 72 N 0.83 2.46 0.19 2.59 0.00 -1.26 -0.16 107.32 111.98 1udl s GLY 72 Ca -0.01 -1.67 0.08 0.00 0.00 0.00 0.00 44.72 43.11 1udl s GLY 72 CO 0.01 -1.63 -0.15 -1.83 0.00 0.00 0.00 173.10 169.51 1udl s GLU 73 N -3.57 1.29 -0.28 2.90 -1.05 -1.21 -3.52 118.70 113.26 1udl s GLU 73 Ca 0.33 -1.53 0.01 0.00 -0.15 0.00 0.00 54.97 53.62 1udl s GLU 73 Cb 0.02 -1.11 0.16 0.00 -0.44 0.00 0.00 34.13 32.77 1udl s GLU 73 CO 0.22 0.19 0.46 0.42 0.95 0.00 0.00 175.26 177.50 1udl s ILE 74 N -2.81 -0.75 -1.22 1.83 1.01 0.14 -3.23 121.20 116.17 1udl s ILE 74 Ca 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 60.65 60.72 1udl s ILE 74 Cb -0.01 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.52 1udl s ILE 74 CO 0.06 -0.14 1.01 0.59 0.00 0.00 0.00 174.94 176.47 1udl n ASN 75 N 5.38 -2.45 0.00 3.58 3.02 -1.26 -1.64 115.26 121.88 1udl n ASN 75 Ca -0.00 -0.62 0.00 0.00 -0.03 0.00 0.00 54.58 53.93 1udl n ASN 75 Cb 0.51 -5.09 0.00 0.00 -0.61 0.00 0.00 39.78 34.58 1udl n ASN 75 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1udl n GLY 76 N -1.23 0.33 3.68 7.41 0.00 -1.26 -5.00 105.19 109.11 1udl n GLY 76 Ca -0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 1udl n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1udl s VAL 77 N -1.66 4.19 0.08 1.61 0.11 -0.65 -5.12 120.40 118.95 1udl s VAL 77 Ca 0.00 -0.46 0.07 0.00 -2.93 0.00 0.00 61.98 58.66 1udl s VAL 77 Cb 0.00 -2.82 -0.03 0.00 -1.53 0.00 0.00 36.38 32.00 1udl s VAL 77 CO 0.00 0.48 -0.18 0.42 -3.33 0.00 0.00 175.10 172.49 1udl s THR 78 N -0.99 1.44 0.00 5.04 -4.23 -1.26 0.27 115.64 115.90 1udl s THR 78 Ca 0.17 -1.40 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 1udl s THR 78 Cb -0.11 -1.33 0.00 0.00 1.34 0.00 0.00 72.50 72.40 1udl s THR 78 CO 0.07 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 1udl n GLY 79 N 1.24 2.49 3.01 3.99 0.00 -1.23 -4.84 105.19 109.85 1udl n GLY 79 Ca -0.20 -0.55 -0.20 0.00 0.00 0.00 0.00 46.02 45.07 1udl n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1udl s LEU 80 N 0.00 1.87 0.03 0.99 1.43 -1.24 -4.28 118.68 117.48 1udl s LEU 80 Ca 0.00 -0.18 -0.21 0.00 -1.03 0.00 0.00 54.13 52.71 1udl s LEU 80 Cb 0.00 -0.53 0.04 0.00 0.03 0.00 0.00 46.19 45.74 1udl s LEU 80 CO 0.00 0.08 0.47 0.72 0.23 0.00 0.00 176.35 177.86 1udl s PHE 81 N 0.05 -0.36 0.44 0.29 -0.12 -1.12 -1.92 117.98 115.24 1udl s PHE 81 Ca -0.01 0.44 -0.24 0.00 -0.05 0.00 0.00 56.93 57.08 1udl s PHE 81 Cb -0.07 0.27 -0.08 0.00 -0.63 0.00 0.00 43.02 42.52 1udl s PHE 81 CO 0.00 -0.58 1.17 -1.25 -0.05 0.00 0.00 175.22 174.52 1udl s PRO 82 N -2.15 3.85 0.00 1.99 0.04 -1.26 -0.29 135.00 137.19 1udl s PRO 82 Ca -0.07 1.81 0.12 0.00 0.04 0.00 0.00 61.00 62.90 1udl s PRO 82 Cb -0.01 -2.50 0.70 0.00 0.04 0.00 0.00 34.50 32.73 1udl s PRO 82 CO 0.00 -0.48 1.27 -1.13 0.04 0.00 0.00 177.00 176.70 1udl n SER 83 N -0.29 0.00 -0.82 6.66 3.41 -0.15 -2.31 113.62 120.12 1udl n SER 83 Ca 0.06 -1.15 0.10 0.00 -0.26 0.00 0.00 58.87 57.62 1udl n SER 83 Cb 0.47 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.53 1udl n SER 83 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1udl n ASN 84 N -0.74 2.74 -0.73 4.04 6.94 -1.26 -4.25 115.26 122.00 1udl n ASN 84 Ca 0.09 -1.83 0.08 0.00 -0.02 0.00 0.00 54.58 52.90 1udl n ASN 84 Cb 0.04 -0.06 0.21 0.00 -2.36 0.00 0.00 39.78 37.62 1udl n ASN 84 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1udl n TYR 85 N 1.10 0.71 -3.96 -2.53 4.02 -0.98 -4.98 117.16 110.56 1udl n TYR 85 Ca 0.12 -0.78 -0.09 0.00 -0.01 0.00 0.00 57.90 57.14 1udl n TYR 85 Cb 0.49 -0.22 -0.11 0.00 -0.02 0.00 0.00 39.34 39.48 1udl n TYR 85 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1udl s VAL 86 N -2.30 0.10 -0.10 -0.72 -7.23 -1.26 -1.69 120.40 107.20 1udl s VAL 86 Ca 0.35 -0.85 0.01 0.00 -1.81 0.00 0.00 61.98 59.68 1udl s VAL 86 Cb 0.27 -0.29 0.02 0.00 0.56 0.00 0.00 36.38 36.93 1udl s VAL 86 CO 0.10 -0.47 -0.14 -0.75 -0.31 0.00 0.00 175.10 173.53 1udl s LYS 87 N -1.42 2.05 -0.36 4.82 2.47 1.00 -4.87 119.74 123.43 1udl s LYS 87 Ca -0.16 -0.50 -0.33 0.00 -1.56 0.00 0.00 55.97 53.42 1udl s LYS 87 Cb -0.09 -1.78 -0.10 0.00 -1.46 0.00 0.00 37.83 34.39 1udl s LYS 87 CO -0.00 -0.08 2.23 -1.33 0.16 0.00 0.00 175.35 176.33 1udl n MET 88 N 4.24 1.19 -0.32 4.03 2.81 -1.26 -1.65 117.12 126.16 1udl n MET 88 Ca -0.19 0.30 0.16 0.00 -1.81 0.00 0.00 57.70 56.17 1udl n MET 88 Cb 0.51 -2.62 0.35 0.00 -0.71 0.00 0.00 33.22 30.75 1udl n MET 88 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1udl h THR 89 N 7.17 0.47 -5.87 2.03 1.35 -1.86 -3.46 112.91 112.75 1udl h THR 89 Ca -0.29 -0.15 -0.41 0.00 -0.55 0.00 0.00 66.41 65.01 1udl h THR 89 Cb 1.30 -0.02 0.12 0.00 -1.73 0.00 0.00 68.15 67.83 1udl h THR 89 CO 1.03 0.08 -0.69 0.41 -0.25 0.00 0.00 175.52 176.10 1udl n THR 90 N -5.00 -2.87 -0.20 6.82 -1.04 -1.26 -4.88 114.28 105.85 1udl n THR 90 Ca 0.25 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.26 1udl n THR 90 Cb 0.73 -3.86 0.09 0.00 -1.82 0.00 0.00 70.33 65.47 1udl n THR 90 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1udl h ASP 91 N -2.62 -0.33 -3.09 8.00 3.32 -1.92 -3.39 116.42 116.39 1udl h ASP 91 Ca -0.57 0.16 -0.63 0.00 0.02 0.00 0.00 57.03 56.00 1udl h ASP 91 Cb 1.37 0.29 -0.12 0.00 0.22 0.00 0.00 39.33 41.09 1udl h ASP 91 CO 0.57 -0.13 -0.52 -0.44 -1.72 0.00 0.00 179.24 177.00 1udl s SER 92 N -5.23 6.01 0.01 6.45 0.01 -1.26 -5.10 113.70 114.59 1udl s SER 92 Ca -0.14 0.25 -0.03 0.00 1.31 0.00 0.00 55.95 57.34 1udl s SER 92 Cb 0.19 -1.99 -0.04 0.00 0.21 0.00 0.00 66.02 64.39 1udl s SER 92 CO 0.74 0.27 0.22 -0.44 0.41 0.00 0.00 173.24 174.43 1udl s SER 93 N -0.19 6.40 0.48 2.44 0.01 -1.26 -4.95 113.70 116.63 1udl s SER 93 Ca 0.09 0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.75 1udl s SER 93 Cb -0.12 -2.02 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1udl s SER 93 CO 0.01 0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.51 1udl n GLY 94 N 0.86 -4.36 3.77 3.44 0.00 -1.26 -4.93 105.19 102.70 1udl n GLY 94 Ca -0.10 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.83 1udl n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1udl s PRO 95 N -4.25 2.30 0.20 1.61 0.04 -1.26 -4.94 135.00 128.70 1udl s PRO 95 Ca 0.00 1.19 -0.32 0.00 0.04 0.00 0.00 61.00 61.90 1udl s PRO 95 Cb 0.00 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.51 1udl s PRO 95 CO 0.00 -1.61 1.60 0.45 0.04 0.00 0.00 177.00 177.48 1udl n SER 96 N -3.43 3.42 -4.14 6.66 2.88 -1.26 -4.95 113.62 112.80 1udl n SER 96 Ca 0.09 1.09 -0.39 0.00 -1.33 0.00 0.00 58.87 58.34 1udl n SER 96 Cb 0.53 -1.49 -0.08 0.00 -0.75 0.00 0.00 64.21 62.42 1udl n SER 96 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1udl s SER 97 N 0.85 5.59 0.00 -3.46 0.15 -1.26 -5.30 113.70 110.27 1udl s SER 97 Ca 0.74 -2.90 0.00 0.00 0.70 0.00 0.00 55.95 54.49 1udl s SER 97 Cb -0.60 -1.93 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 1udl s SER 97 CO 0.39 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 175.05