#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1un5 h SER 4 N 0.00 0.00 -0.14 0.00 0.02 -2.02 -2.60 113.55 108.80 1un5 h SER 4 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 1un5 h SER 4 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1un5 h SER 4 CO 0.00 0.60 -0.36 0.03 -1.14 0.00 0.00 176.83 175.96 1un5 h ARG 5 N 0.00 0.49 -0.39 3.45 2.47 -1.96 -1.78 114.38 116.66 1un5 h ARG 5 Ca -0.11 -0.34 -0.05 0.00 -1.26 0.00 0.00 59.98 58.23 1un5 h ARG 5 Cb 1.55 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 29.90 1un5 h ARG 5 CO 0.06 0.95 0.07 -0.92 0.56 0.00 0.00 179.97 180.69 1un5 h TYR 6 N 0.11 0.68 -0.32 3.04 3.20 -1.75 0.21 116.97 122.14 1un5 h TYR 6 Ca -0.00 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.71 1un5 h TYR 6 Cb 0.97 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.03 1un5 h TYR 6 CO 0.10 0.68 -0.07 1.15 -1.64 0.00 0.00 178.16 178.39 1un5 h THR 7 N 0.49 1.22 -0.55 1.81 2.02 -1.57 -0.97 112.91 115.36 1un5 h THR 7 Ca 0.12 -0.91 -0.08 0.00 0.77 0.00 0.00 66.41 66.31 1un5 h THR 7 Cb 0.36 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1un5 h THR 7 CO 0.01 0.30 0.03 -0.74 0.37 0.00 0.00 175.52 175.49 1un5 h HIS 8 N 0.49 1.02 0.09 3.16 -0.00 -0.83 -1.57 115.15 117.51 1un5 h HIS 8 Ca 0.10 -0.17 -0.00 0.00 -0.00 0.00 0.00 60.37 60.30 1un5 h HIS 8 Cb 0.42 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.56 1un5 h HIS 8 CO 0.01 0.92 -0.04 0.35 -0.00 0.00 0.00 177.93 179.17 1un5 h PHE 9 N 0.83 -0.12 -0.70 5.26 3.57 -0.30 -2.15 116.94 123.34 1un5 h PHE 9 Ca 0.16 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.71 1un5 h PHE 9 Cb 0.49 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.22 1un5 h PHE 9 CO 0.04 0.01 0.41 -0.07 -2.23 0.00 0.00 178.31 176.46 1un5 h LEU 10 N -0.21 0.63 -0.50 0.59 4.07 -1.16 0.33 115.31 119.06 1un5 h LEU 10 Ca -0.01 0.02 0.05 0.00 0.08 0.00 0.00 57.88 58.02 1un5 h LEU 10 Cb 0.17 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 41.75 1un5 h LEU 10 CO 0.02 0.42 0.23 0.74 -1.08 0.00 0.00 178.44 178.77 1un5 h THR 11 N 0.77 0.92 0.00 0.22 2.02 -1.26 -0.98 112.91 114.60 1un5 h THR 11 Ca 0.30 -0.16 -0.04 0.00 0.77 0.00 0.00 66.41 67.28 1un5 h THR 11 Cb 0.13 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1un5 h THR 11 CO -0.16 0.08 -0.73 1.56 0.37 0.00 0.00 175.52 176.65 1un5 h GLN 12 N 0.45 0.00 0.00 6.66 4.20 -0.68 -3.42 115.11 122.33 1un5 h GLN 12 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 1un5 h GLN 12 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1un5 h GLN 12 CO -0.18 0.12 0.00 0.72 -0.67 0.00 0.00 178.83 178.82 1un5 n HIS 13 N -2.91 0.00 -4.76 2.96 8.25 0.11 -4.72 115.22 114.15 1un5 n HIS 13 Ca -0.00 -0.01 -0.31 0.00 -0.26 0.00 0.00 57.72 57.15 1un5 n HIS 13 Cb 0.62 -0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.56 1un5 n HIS 13 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1un5 s TYR 14 N -0.01 2.33 -0.21 4.41 5.04 -0.38 -0.21 117.35 128.33 1un5 s TYR 14 Ca 0.00 -1.07 -0.04 0.00 -2.44 0.00 0.00 57.07 53.52 1un5 s TYR 14 Cb 0.00 -1.61 0.07 0.00 0.35 0.00 0.00 41.96 40.77 1un5 s TYR 14 CO 0.00 -0.49 0.08 0.34 -1.34 0.00 0.00 175.55 174.14 1un5 s ASP 15 N 0.72 2.80 0.10 4.32 2.15 -0.03 -4.77 116.67 121.95 1un5 s ASP 15 Ca -0.11 -0.85 -0.27 0.00 0.43 0.00 0.00 52.55 51.76 1un5 s ASP 15 Cb -0.16 -0.38 -0.12 0.00 -0.30 0.00 0.00 42.92 41.96 1un5 s ASP 15 CO 0.02 -0.36 1.66 0.00 -0.17 0.00 0.00 175.17 176.32 1un5 h ALA 16 N 8.36 -0.40 -2.43 3.66 0.00 -1.80 -3.35 119.26 123.30 1un5 h ALA 16 Ca -0.16 -0.06 -0.59 0.00 0.00 0.00 0.00 54.91 54.10 1un5 h ALA 16 Cb 1.11 0.29 -0.39 0.00 0.00 0.00 0.00 17.79 18.80 1un5 h ALA 16 CO 0.34 -0.75 -0.93 1.63 0.00 0.00 0.00 179.25 179.54 1un5 n LYS 17 N -5.33 0.51 -1.57 0.00 4.01 -1.26 -1.42 118.16 113.10 1un5 n LYS 17 Ca -0.08 -3.39 -0.33 0.00 -0.51 0.00 0.00 58.31 54.00 1un5 n LYS 17 Cb 0.24 -1.73 0.07 0.00 -0.51 0.00 0.00 35.03 33.10 1un5 n LYS 17 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1un5 s PRO 18 N -0.31 2.53 -0.24 1.97 0.04 -1.26 -5.03 135.00 132.70 1un5 s PRO 18 Ca 0.32 1.40 -0.03 0.00 0.04 0.00 0.00 61.00 62.73 1un5 s PRO 18 Cb 0.04 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.68 1un5 s PRO 18 CO -0.18 -1.46 -0.05 -0.65 0.04 0.00 0.00 177.00 174.69 1un5 s GLN 19 N -4.26 3.05 0.00 4.56 -0.21 -1.26 -4.88 119.66 116.66 1un5 s GLN 19 Ca 0.67 -0.84 0.00 0.00 0.02 0.00 0.00 55.36 55.21 1un5 s GLN 19 Cb -0.21 -3.00 0.00 0.00 1.00 0.00 0.00 33.01 30.80 1un5 s GLN 19 CO 0.46 -0.33 0.00 0.41 -2.12 0.00 0.00 175.29 173.71 1un5 n GLY 20 N 4.73 2.08 3.19 3.09 0.00 -1.26 -4.68 105.19 112.33 1un5 n GLY 20 Ca -0.17 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.31 1un5 n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1un5 n ARG 21 N 0.00 -5.92 -2.04 1.61 1.74 -1.26 -5.02 116.66 105.78 1un5 n ARG 21 Ca 0.00 0.85 -0.09 0.00 -0.77 0.00 0.00 57.85 57.85 1un5 n ARG 21 Cb 0.00 -5.72 0.02 0.00 -1.02 0.00 0.00 32.46 25.73 1un5 n ARG 21 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1un5 n ASP 22 N -2.57 1.18 -0.19 0.55 3.85 -1.26 -4.64 116.55 113.46 1un5 n ASP 22 Ca -0.06 -1.67 -0.03 0.00 -0.71 0.00 0.00 54.79 52.31 1un5 n ASP 22 Cb 0.60 -0.11 0.03 0.00 -1.35 0.00 0.00 41.12 40.29 1un5 n ASP 22 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 1un5 h ASP 23 N 0.13 -0.85 0.28 -1.12 5.19 -1.88 -1.47 116.42 116.69 1un5 h ASP 23 Ca -0.12 0.20 -0.02 0.00 -0.62 0.00 0.00 57.03 56.47 1un5 h ASP 23 Cb 0.50 0.47 -0.00 0.00 0.18 0.00 0.00 39.33 40.48 1un5 h ASP 23 CO 0.18 -0.26 -0.12 0.03 -3.12 0.00 0.00 179.24 175.95 1un5 h ARG 24 N -0.10 0.00 -0.21 3.56 -0.00 -1.96 -1.78 114.38 113.89 1un5 h ARG 24 Ca 0.26 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.69 1un5 h ARG 24 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.47 1un5 h ARG 24 CO -0.64 0.12 -0.05 -0.92 0.00 0.00 0.00 179.97 178.48 1un5 h TYR 25 N 0.00 0.45 0.51 3.04 3.20 -1.59 -3.04 116.97 119.55 1un5 h TYR 25 Ca -0.00 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 1un5 h TYR 25 Cb 0.28 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1un5 h TYR 25 CO 0.00 0.65 -0.24 0.00 -1.64 0.00 0.00 178.16 176.93 1un5 h GLU 27 N -0.71 0.62 0.04 0.00 5.08 -1.50 -0.14 114.58 117.98 1un5 h GLU 27 Ca -0.07 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 1un5 h GLU 27 Cb 0.53 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1un5 h GLU 27 CO 0.11 0.41 -0.32 1.03 -1.00 0.00 0.00 179.01 179.25 1un5 h SER 28 N 0.64 0.14 0.23 1.42 0.87 -1.38 -2.95 113.55 112.51 1un5 h SER 28 Ca 0.56 -0.96 -0.08 0.00 -1.23 0.00 0.00 61.79 60.08 1un5 h SER 28 Cb 1.05 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.95 1un5 h SER 28 CO -0.33 1.15 -0.33 -0.29 -0.53 0.00 0.00 176.83 176.49 1un5 h ILE 29 N -0.81 1.26 -0.79 2.23 2.10 -0.93 -1.50 117.51 119.07 1un5 h ILE 29 Ca -0.06 -1.26 -0.05 0.00 1.08 0.00 0.00 64.86 64.57 1un5 h ILE 29 Cb 1.21 1.57 -0.03 0.00 -1.09 0.00 0.00 36.82 38.48 1un5 h ILE 29 CO 0.03 0.37 0.31 0.24 -1.08 0.00 0.00 178.15 178.03 1un5 h MET 30 N 0.14 1.19 0.10 2.19 2.86 -1.13 -2.34 114.93 117.94 1un5 h MET 30 Ca 0.02 -0.22 -0.00 0.00 -2.06 0.00 0.00 59.70 57.43 1un5 h MET 30 Cb 0.66 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1un5 h MET 30 CO 0.05 0.97 -0.05 -0.09 1.06 0.00 0.00 176.91 178.85 1un5 h ARG 31 N 1.15 -0.13 0.00 1.72 2.43 -1.34 -0.94 114.38 117.28 1un5 h ARG 31 Ca 0.26 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.43 1un5 h ARG 31 Cb 0.23 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1un5 h ARG 31 CO -0.02 0.27 -0.05 -0.09 -1.51 0.00 0.00 179.97 178.57 1un5 h ARG 32 N -0.56 0.00 -0.74 0.20 2.43 -1.27 -1.76 114.38 112.68 1un5 h ARG 32 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1un5 h ARG 32 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1un5 h ARG 32 CO 0.02 0.05 0.00 0.54 -1.51 0.00 0.00 179.97 179.07 1un5 n ARG 33 N -4.44 2.77 -1.54 0.20 5.12 -0.88 -4.94 116.66 112.95 1un5 n ARG 33 Ca -0.03 -2.68 -0.04 0.00 -1.93 0.00 0.00 57.85 53.17 1un5 n ARG 33 Cb 0.13 -1.59 -0.01 0.00 -1.16 0.00 0.00 32.46 29.83 1un5 n ARG 33 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1un5 n GLY 34 N 1.65 0.48 1.26 -0.13 0.00 -0.66 -4.93 105.19 102.87 1un5 n GLY 34 Ca 0.25 -0.81 0.09 0.00 0.00 0.00 0.00 46.02 45.56 1un5 n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1un5 n LEU 35 N -0.53 3.68 -0.00 0.99 4.77 -0.36 -4.13 117.00 121.42 1un5 n LEU 35 Ca -0.05 -1.85 0.00 0.00 -0.03 0.00 0.00 56.01 54.09 1un5 n LEU 35 Cb 0.31 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1un5 n LEU 35 CO 0.06 0.80 0.27 0.35 -1.33 0.00 0.00 177.39 177.54 1un5 n THR 36 N 1.21 0.06 -0.10 -5.08 -2.24 -1.24 -2.15 114.28 104.74 1un5 n THR 36 Ca 0.22 -0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.84 1un5 n THR 36 Cb 0.63 0.97 -0.02 0.00 -2.10 0.00 0.00 70.33 69.81 1un5 n THR 36 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1un5 h SER 37 N 0.00 0.39 0.00 3.42 4.64 -1.91 -3.39 113.55 116.70 1un5 h SER 37 Ca 0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1un5 h SER 37 Cb 0.97 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 1un5 h SER 37 CO 0.00 0.35 -0.57 0.47 -0.87 0.00 0.00 176.83 176.20 1un5 n ASP 38 N -4.81 1.52 -4.66 4.97 9.92 -1.26 -5.01 116.55 117.21 1un5 n ASP 38 Ca -0.01 0.24 -0.32 0.00 -0.53 0.00 0.00 54.79 54.16 1un5 n ASP 38 Cb 0.06 -0.57 -0.09 0.00 -0.64 0.00 0.00 41.12 39.89 1un5 n ASP 38 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1un5 s ARG 39 N -2.45 2.73 -0.27 -1.24 6.06 -1.26 -4.58 118.95 117.94 1un5 s ARG 39 Ca -0.17 -0.64 -0.29 0.00 -2.50 0.00 0.00 55.73 52.14 1un5 s ARG 39 Cb 0.02 -2.63 -0.02 0.00 0.06 0.00 0.00 34.95 32.38 1un5 s ARG 39 CO 0.25 0.62 1.65 0.00 -2.50 0.00 0.00 175.30 175.31 1un5 s LYS 41 N 4.96 4.14 0.20 0.00 2.20 -0.91 -4.91 119.74 125.42 1un5 s LYS 41 Ca 0.73 2.60 -0.09 0.00 -0.36 0.00 0.00 55.97 58.85 1un5 s LYS 41 Cb -0.23 -3.67 0.14 0.00 -1.51 0.00 0.00 37.83 32.55 1un5 s LYS 41 CO 0.31 -0.86 1.76 -1.35 -0.36 0.00 0.00 175.35 174.85 1un5 h PRO 42 N 8.87 1.12 -2.99 4.03 0.11 -1.93 -3.42 132.00 137.79 1un5 h PRO 42 Ca -0.46 -0.21 -0.16 0.00 0.11 0.00 0.00 66.00 65.28 1un5 h PRO 42 Cb 1.22 -0.18 -0.26 0.00 0.11 0.00 0.00 31.00 31.89 1un5 h PRO 42 CO 0.95 0.92 -0.38 -1.50 -0.21 0.00 0.00 178.00 177.78 1un5 s ILE 43 N -5.54 -0.01 -0.16 4.15 2.07 -1.26 -0.22 121.20 120.24 1un5 s ILE 43 Ca -0.12 0.03 -0.14 0.00 -1.41 0.00 0.00 60.65 59.01 1un5 s ILE 43 Cb 0.15 -0.43 0.04 0.00 0.13 0.00 0.00 42.46 42.36 1un5 s ILE 43 CO 0.83 0.01 0.41 0.21 -1.91 0.00 0.00 174.94 174.49 1un5 s ASN 44 N 0.39 -0.44 -0.14 4.50 2.47 -0.17 -5.00 114.94 116.55 1un5 s ASN 44 Ca -0.02 0.84 0.00 0.00 0.42 0.00 0.00 52.86 54.10 1un5 s ASN 44 Cb -0.04 0.83 -0.01 0.00 -1.45 0.00 0.00 41.25 40.59 1un5 s ASN 44 CO -0.02 -0.15 -0.14 -0.89 -3.72 0.00 0.00 177.10 172.18 1un5 s THR 45 N 0.37 2.89 -0.13 -5.21 2.01 -1.26 -0.28 115.64 114.02 1un5 s THR 45 Ca -0.01 -0.71 -0.09 0.00 0.31 0.00 0.00 61.69 61.19 1un5 s THR 45 Cb -0.04 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 1un5 s THR 45 CO -0.01 0.52 0.18 -0.36 -0.69 0.00 0.00 174.62 174.25 1un5 s PHE 46 N 0.54 3.55 -0.08 4.92 0.40 0.01 -4.52 117.98 122.81 1un5 s PHE 46 Ca -0.09 0.53 -0.05 0.00 -0.60 0.00 0.00 56.93 56.72 1un5 s PHE 46 Cb -0.16 -2.06 -0.04 0.00 0.51 0.00 0.00 43.02 41.27 1un5 s PHE 46 CO 0.04 0.58 0.14 0.42 0.70 0.00 0.00 175.22 177.10 1un5 s ILE 47 N -0.56 5.38 0.32 0.64 1.01 0.71 -1.16 121.20 127.52 1un5 s ILE 47 Ca 0.14 0.03 0.10 0.00 0.00 0.00 0.00 60.65 60.92 1un5 s ILE 47 Cb -0.12 -3.40 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 1un5 s ILE 47 CO 0.03 0.51 -0.02 -1.00 0.00 0.00 0.00 174.94 174.46 1un5 s HIS 48 N -1.13 2.53 0.00 3.97 3.76 -0.19 -0.85 115.29 123.38 1un5 s HIS 48 Ca 0.19 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.72 1un5 s HIS 48 Cb -0.12 -1.36 0.00 0.00 1.11 0.00 0.00 32.58 32.21 1un5 s HIS 48 CO 0.09 0.54 0.00 0.41 -0.85 0.00 0.00 174.74 174.93 1un5 n GLY 49 N -0.89 -0.21 3.87 -2.22 0.00 -0.50 -4.35 105.19 100.88 1un5 n GLY 49 Ca -0.05 -1.97 -0.34 0.00 0.00 0.00 0.00 46.02 43.66 1un5 n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1un5 s ASN 50 N -4.00 6.63 0.34 1.61 6.03 -1.26 -4.54 114.94 119.74 1un5 s ASN 50 Ca 0.00 0.80 0.06 0.00 -1.03 0.00 0.00 52.86 52.69 1un5 s ASN 50 Cb 0.00 -2.18 0.73 0.00 -3.03 0.00 0.00 41.25 36.77 1un5 s ASN 50 CO 0.00 0.11 1.89 0.11 -2.03 0.00 0.00 177.10 177.18 1un5 h LYS 51 N 3.39 0.77 -0.07 3.55 1.57 -1.98 -2.90 116.57 120.89 1un5 h LYS 51 Ca -0.48 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.19 1un5 h LYS 51 Cb 1.18 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 1un5 h LYS 51 CO 0.68 0.51 -0.23 0.00 -0.57 0.00 0.00 179.45 179.84 1un5 h ARG 52 N 0.79 0.12 -0.05 3.15 3.08 -1.99 -1.06 114.38 118.42 1un5 h ARG 52 Ca 0.42 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.30 1un5 h ARG 52 Cb 0.52 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1un5 h ARG 52 CO -0.18 0.35 -0.58 0.77 -1.07 0.00 0.00 179.97 179.26 1un5 h SER 53 N 0.11 0.19 -0.04 7.04 0.02 -1.93 -2.49 113.55 116.45 1un5 h SER 53 Ca 0.02 -0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 60.80 1un5 h SER 53 Cb 0.48 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1un5 h SER 53 CO 0.03 0.73 -0.21 0.40 -1.14 0.00 0.00 176.83 176.65 1un5 h ILE 54 N 0.13 1.47 0.00 3.27 2.04 -1.31 -3.20 117.51 119.91 1un5 h ILE 54 Ca -0.00 -1.69 -0.01 0.00 1.00 0.00 0.00 64.86 64.16 1un5 h ILE 54 Cb 1.06 2.45 -0.00 0.00 -0.74 0.00 0.00 36.82 39.59 1un5 h ILE 54 CO 0.09 0.47 -0.06 0.07 0.00 0.00 0.00 178.15 178.72 1un5 h LYS 55 N -0.36 0.00 0.00 2.37 2.10 -1.33 -2.26 116.57 117.10 1un5 h LYS 55 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1un5 h LYS 55 Cb 0.87 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.20 1un5 h LYS 55 CO 0.04 0.06 0.00 0.00 -2.00 0.00 0.00 179.45 177.55 1un5 n ALA 56 N -2.13 1.51 0.28 0.07 0.00 -0.94 -1.74 120.51 117.56 1un5 n ALA 56 Ca 0.01 0.02 0.16 0.00 0.00 0.00 0.00 53.44 53.63 1un5 n ALA 56 Cb 0.35 -1.25 0.75 0.00 0.00 0.00 0.00 19.45 19.30 1un5 n ALA 56 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1un5 h ILE 57 N 0.00 0.20 0.00 0.00 2.04 -1.44 -2.70 117.51 115.61 1un5 h ILE 57 Ca 0.00 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 1un5 h ILE 57 Cb 0.22 1.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.73 1un5 h ILE 57 CO 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 178.15 178.13 1un5 s GLU 59 N -3.52 2.44 0.00 0.00 -1.05 -1.14 -4.93 118.70 110.49 1un5 s GLU 59 Ca 0.03 -1.65 0.07 0.00 -0.15 0.00 0.00 54.97 53.26 1un5 s GLU 59 Cb 0.08 -2.28 0.32 0.00 -0.44 0.00 0.00 34.13 31.81 1un5 s GLU 59 CO 0.60 -0.25 1.11 0.27 0.95 0.00 0.00 175.26 177.94 1un5 n ASN 60 N -1.54 0.00 -0.11 0.83 2.04 -1.26 -2.86 115.26 112.36 1un5 n ASN 60 Ca 0.02 0.27 -0.10 0.00 -0.44 0.00 0.00 54.58 54.34 1un5 n ASN 60 Cb 0.63 -0.34 -0.02 0.00 -2.53 0.00 0.00 39.78 37.52 1un5 n ASN 60 CO 0.00 0.00 0.00 0.07 -0.44 0.00 0.00 177.26 176.89 1un5 h LYS 61 N 0.00 0.51 -0.02 -3.83 2.10 -1.93 -3.35 116.57 110.05 1un5 h LYS 61 Ca 0.00 -0.10 -0.16 0.00 -2.00 0.00 0.00 60.65 58.39 1un5 h LYS 61 Cb 0.08 -0.08 -0.33 0.00 -0.90 0.00 0.00 32.23 31.00 1un5 h LYS 61 CO 0.00 0.52 -0.95 -1.71 -2.00 0.00 0.00 179.45 175.31 1un5 n ASN 62 N -4.69 1.17 -3.67 7.07 5.15 -1.03 -4.95 115.26 114.31 1un5 n ASN 62 Ca -0.01 -2.32 -0.12 0.00 -0.60 0.00 0.00 54.58 51.52 1un5 n ASN 62 Cb 0.15 -0.34 -0.06 0.00 -0.53 0.00 0.00 39.78 38.99 1un5 n ASN 62 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1un5 s GLY 63 N -2.29 -0.25 0.08 8.20 0.00 -1.13 -2.16 107.32 109.77 1un5 s GLY 63 Ca 0.34 0.20 0.06 0.00 0.00 0.00 0.00 44.72 45.32 1un5 s GLY 63 CO -0.15 -0.06 -0.16 -1.31 0.00 0.00 0.00 173.10 171.42 1un5 s ASN 64 N -2.18 1.95 0.41 1.64 0.02 -0.26 -4.50 114.94 112.02 1un5 s ASN 64 Ca -0.03 -0.65 -0.25 0.00 -1.02 0.00 0.00 52.86 50.91 1un5 s ASN 64 Cb -0.00 -0.08 -0.11 0.00 0.02 0.00 0.00 41.25 41.08 1un5 s ASN 64 CO -0.04 -0.04 1.03 -2.65 0.02 0.00 0.00 177.10 175.42 1un5 n PRO 65 N 1.19 1.41 -3.73 -0.60 -0.02 -1.26 -1.20 135.00 130.78 1un5 n PRO 65 Ca -0.20 0.50 -0.13 0.00 -2.02 0.00 0.00 63.50 61.65 1un5 n PRO 65 Cb 0.54 -2.06 -0.14 0.00 -0.02 0.00 0.00 33.50 31.82 1un5 n PRO 65 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1un5 s HIS 66 N -1.25 -0.26 0.00 6.00 2.46 -0.04 -4.71 115.29 117.48 1un5 s HIS 66 Ca 0.63 0.67 0.00 0.00 0.47 0.00 0.00 55.06 56.83 1un5 s HIS 66 Cb -0.56 -0.02 0.00 0.00 -0.13 0.00 0.00 32.58 31.87 1un5 s HIS 66 CO 0.57 -0.22 0.00 0.54 -2.47 0.00 0.00 174.74 173.17 1un5 n ARG 67 N 4.33 0.00 -3.50 2.88 5.12 -1.26 -1.93 116.66 122.29 1un5 n ARG 67 Ca -0.24 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.26 1un5 n ARG 67 Cb 0.52 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.76 1un5 n ARG 67 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 1un5 s GLU 68 N 0.00 2.90 -0.26 5.56 -1.05 -1.26 -4.64 118.70 119.96 1un5 s GLU 68 Ca 0.00 -2.16 0.00 0.00 -0.15 0.00 0.00 54.97 52.66 1un5 s GLU 68 Cb 0.00 -4.08 0.00 0.00 -0.44 0.00 0.00 34.13 29.61 1un5 s GLU 68 CO 0.00 -1.24 0.00 0.27 0.95 0.00 0.00 175.26 175.24 1un5 n ASN 69 N 4.32 -3.07 -4.78 0.83 2.04 -1.25 -5.04 115.26 108.31 1un5 n ASN 69 Ca 0.02 0.05 -0.23 0.00 -0.44 0.00 0.00 54.58 53.98 1un5 n ASN 69 Cb 0.42 -1.02 -0.06 0.00 -2.53 0.00 0.00 39.78 36.59 1un5 n ASN 69 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1un5 s LEU 70 N -0.59 3.23 -0.00 -4.53 1.43 -0.82 -4.59 118.68 112.82 1un5 s LEU 70 Ca 0.00 -0.92 0.01 0.00 -1.03 0.00 0.00 54.13 52.19 1un5 s LEU 70 Cb 0.00 -1.69 -0.00 0.00 0.03 0.00 0.00 46.19 44.53 1un5 s LEU 70 CO 0.00 -0.54 -0.04 -0.13 0.23 0.00 0.00 176.35 175.87 1un5 s ARG 71 N -3.97 0.34 -0.08 1.70 0.52 0.22 -0.86 118.95 116.83 1un5 s ARG 71 Ca 0.43 -0.15 0.05 0.00 -0.52 0.00 0.00 55.73 55.53 1un5 s ARG 71 Cb 0.01 -0.33 -0.01 0.00 0.52 0.00 0.00 34.95 35.13 1un5 s ARG 71 CO 0.24 0.09 -0.23 -1.50 0.02 0.00 0.00 175.30 173.92 1un5 s ILE 72 N -0.10 2.18 0.50 1.52 2.07 -0.34 -0.87 121.20 126.16 1un5 s ILE 72 Ca 0.02 -1.00 -0.21 0.00 -1.41 0.00 0.00 60.65 58.05 1un5 s ILE 72 Cb -0.02 -1.82 -0.07 0.00 0.13 0.00 0.00 42.46 40.69 1un5 s ILE 72 CO -0.00 0.56 1.12 -0.94 -1.91 0.00 0.00 174.94 173.77 1un5 s SER 73 N 0.06 6.01 0.15 4.50 1.04 -0.40 -1.11 113.70 123.95 1un5 s SER 73 Ca -0.10 2.17 0.09 0.00 0.48 0.00 0.00 55.95 58.59 1un5 s SER 73 Cb -0.16 -2.58 -0.15 0.00 0.10 0.00 0.00 66.02 63.23 1un5 s SER 73 CO 0.06 -1.02 1.27 0.11 0.98 0.00 0.00 173.24 174.64 1un5 h LYS 74 N 1.59 0.00 -6.20 4.02 1.57 -1.77 -3.43 116.57 112.34 1un5 h LYS 74 Ca -0.50 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.81 1un5 h LYS 74 Cb 1.25 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 1un5 h LYS 74 CO 0.59 0.85 -0.45 -1.54 -0.57 0.00 0.00 179.45 178.32 1un5 s SER 75 N -6.60 6.01 0.06 0.86 1.04 -1.26 -5.02 113.70 108.79 1un5 s SER 75 Ca 0.01 -0.07 -0.08 0.00 0.48 0.00 0.00 55.95 56.30 1un5 s SER 75 Cb 0.09 -1.63 -0.05 0.00 0.10 0.00 0.00 66.02 64.53 1un5 s SER 75 CO 0.80 -0.10 0.34 -0.44 0.98 0.00 0.00 173.24 174.82 1un5 s SER 76 N -3.96 6.56 0.20 7.02 0.01 -1.26 -4.22 113.70 118.05 1un5 s SER 76 Ca 0.35 0.67 0.11 0.00 1.31 0.00 0.00 55.95 58.39 1un5 s SER 76 Cb -0.09 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 1un5 s SER 76 CO 0.28 0.19 -0.24 -0.36 0.41 0.00 0.00 173.24 173.52 1un5 s PHE 77 N -1.40 2.30 -0.02 2.43 0.40 0.72 -4.86 117.98 117.54 1un5 s PHE 77 Ca 0.32 -0.36 -0.30 0.00 -0.60 0.00 0.00 56.93 55.99 1un5 s PHE 77 Cb -0.13 -1.12 -0.03 0.00 0.51 0.00 0.00 43.02 42.25 1un5 s PHE 77 CO 0.18 0.52 1.00 -0.65 0.70 0.00 0.00 175.22 176.97 1un5 s GLN 78 N -2.76 4.52 0.11 0.44 -1.52 -1.26 -1.89 119.66 117.30 1un5 s GLN 78 Ca 0.22 1.43 0.04 0.00 -1.95 0.00 0.00 55.36 55.10 1un5 s GLN 78 Cb -0.08 -3.48 -0.04 0.00 -0.22 0.00 0.00 33.01 29.20 1un5 s GLN 78 CO 0.10 -0.13 -0.11 0.14 -0.25 0.00 0.00 175.29 175.04 1un5 s VAL 79 N 1.28 1.08 -0.10 1.09 -7.23 -0.69 -1.02 120.40 114.80 1un5 s VAL 79 Ca 0.51 -1.67 -0.01 0.00 -1.81 0.00 0.00 61.98 59.00 1un5 s VAL 79 Cb -0.21 -1.43 0.03 0.00 0.56 0.00 0.00 36.38 35.34 1un5 s VAL 79 CO 0.25 -0.51 -0.04 -0.89 -0.31 0.00 0.00 175.10 173.60 1un5 s THR 80 N -2.35 0.76 -0.18 5.32 2.01 -0.31 -0.68 115.64 120.20 1un5 s THR 80 Ca 0.07 -0.15 -0.14 0.00 0.31 0.00 0.00 61.69 61.78 1un5 s THR 80 Cb -0.03 -0.86 -0.05 0.00 0.01 0.00 0.00 72.50 71.58 1un5 s THR 80 CO 0.01 0.30 0.30 -0.89 -0.69 0.00 0.00 174.62 173.64 1un5 s THR 81 N 1.81 5.29 -0.29 -0.82 2.01 0.74 -0.81 115.64 123.58 1un5 s THR 81 Ca 0.05 0.53 -0.07 0.00 0.31 0.00 0.00 61.69 62.51 1un5 s THR 81 Cb -0.13 -3.63 0.01 0.00 0.01 0.00 0.00 72.50 68.76 1un5 s THR 81 CO -0.07 0.35 0.08 0.00 -0.69 0.00 0.00 174.62 174.29 1un5 s LYS 83 N 1.51 3.25 0.26 0.00 2.47 -0.55 -1.00 119.74 125.68 1un5 s LYS 83 Ca 0.03 -0.74 -0.31 0.00 -1.56 0.00 0.00 55.97 53.40 1un5 s LYS 83 Cb -0.17 -2.63 -0.12 0.00 -1.46 0.00 0.00 37.83 33.46 1un5 s LYS 83 CO 0.02 0.06 1.65 -0.11 0.16 0.00 0.00 175.35 177.14 1un5 n LEU 84 N 3.94 4.25 -4.20 5.43 7.94 0.69 -1.57 117.00 133.48 1un5 n LEU 84 Ca -0.19 1.11 -0.32 0.00 -1.11 0.00 0.00 56.01 55.51 1un5 n LEU 84 Cb 0.52 -1.59 -0.17 0.00 0.53 0.00 0.00 43.42 42.71 1un5 n LEU 84 CO 0.29 0.18 -0.55 -2.28 -1.11 0.00 0.00 177.39 173.92 1un5 s HIS 85 N 0.44 2.55 -2.49 1.96 5.65 -0.30 -4.90 115.29 118.19 1un5 s HIS 85 Ca 0.68 -1.11 0.00 0.00 0.25 0.00 0.00 55.06 54.88 1un5 s HIS 85 Cb -0.50 -1.71 0.00 0.00 -1.18 0.00 0.00 32.58 29.19 1un5 s HIS 85 CO 0.42 -0.47 0.00 0.41 -0.65 0.00 0.00 174.74 174.45 1un5 n GLY 86 N 3.69 0.93 0.07 1.59 0.00 -1.26 -4.48 105.19 105.73 1un5 n GLY 86 Ca -0.19 -2.14 -0.09 0.00 0.00 0.00 0.00 46.02 43.60 1un5 n GLY 86 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1un5 h GLY 87 N 0.00 0.00 -2.76 -0.02 0.00 -2.01 -3.48 103.07 94.81 1un5 h GLY 87 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 1un5 h GLY 87 CO 0.00 0.00 0.17 -1.35 0.00 0.00 0.00 176.54 175.36 1un5 s SER 88 N -6.00 6.86 0.00 0.19 1.04 -1.26 -4.98 113.70 109.55 1un5 s SER 88 Ca -0.13 1.42 0.30 0.00 0.48 0.00 0.00 55.95 58.02 1un5 s SER 88 Cb -0.01 -2.43 1.81 0.00 0.10 0.00 0.00 66.02 65.49 1un5 s SER 88 CO 0.39 -0.22 2.16 -0.81 0.98 0.00 0.00 173.24 175.75 1un5 n PRO 89 N -0.30 1.00 -3.85 4.02 -0.04 -1.26 -4.92 135.00 129.64 1un5 n PRO 89 Ca 0.04 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.16 1un5 n PRO 89 Cb 0.53 -1.47 -0.05 0.00 -0.04 0.00 0.00 33.50 32.46 1un5 n PRO 89 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1un5 s TRP 90 N -2.00 3.56 0.52 0.54 0.52 -1.26 0.15 118.94 120.98 1un5 s TRP 90 Ca 0.45 0.45 -0.20 0.00 0.02 0.00 0.00 56.10 56.82 1un5 s TRP 90 Cb 0.21 -1.89 -0.09 0.00 -1.15 0.00 0.00 33.47 30.54 1un5 s TRP 90 CO 0.35 0.65 0.68 -2.30 0.02 0.00 0.00 176.95 176.34 1un5 n PRO 91 N 1.11 0.72 -2.74 4.98 -0.02 -1.26 -4.43 135.00 133.35 1un5 n PRO 91 Ca -0.12 0.27 -0.37 0.00 -2.02 0.00 0.00 63.50 61.26 1un5 n PRO 91 Cb 0.53 -1.80 -0.06 0.00 -0.02 0.00 0.00 33.50 32.15 1un5 n PRO 91 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1un5 s PRO 92 N -2.09 4.51 -0.26 0.52 0.02 -1.26 -5.11 135.00 131.33 1un5 s PRO 92 Ca 0.68 1.36 -0.14 0.00 0.02 0.00 0.00 61.00 62.92 1un5 s PRO 92 Cb -0.49 -2.75 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 1un5 s PRO 92 CO 0.54 0.20 0.34 0.00 -0.33 0.00 0.00 177.00 177.75 1un5 s GLN 94 N 1.90 3.71 -0.01 0.00 -0.21 -1.26 -4.89 119.66 118.90 1un5 s GLN 94 Ca 0.14 -0.32 0.04 0.00 0.02 0.00 0.00 55.36 55.24 1un5 s GLN 94 Cb -0.16 -3.13 -0.01 0.00 1.00 0.00 0.00 33.01 30.71 1un5 s GLN 94 CO 0.10 0.43 -0.14 0.71 -2.12 0.00 0.00 175.29 174.27 1un5 s TYR 95 N -0.08 1.25 -0.17 0.91 2.02 -1.26 -1.15 117.35 118.86 1un5 s TYR 95 Ca 0.07 -0.24 -0.09 0.00 -0.37 0.00 0.00 57.07 56.44 1un5 s TYR 95 Cb -0.12 -0.80 -0.05 0.00 -0.40 0.00 0.00 41.96 40.59 1un5 s TYR 95 CO 0.01 -0.02 0.14 1.03 -1.57 0.00 0.00 175.55 175.14 1un5 s ARG 96 N -0.34 3.95 0.01 -0.62 3.00 -0.61 -4.60 118.95 119.73 1un5 s ARG 96 Ca 0.05 -0.18 -0.12 0.00 0.00 0.00 0.00 55.73 55.48 1un5 s ARG 96 Cb -0.05 -3.35 -0.05 0.00 0.00 0.00 0.00 34.95 31.50 1un5 s ARG 96 CO -0.00 0.45 0.36 0.00 0.00 0.00 0.00 175.30 176.11 1un5 s ALA 97 N -0.09 3.74 -0.21 2.13 0.00 -1.26 -1.49 121.76 124.59 1un5 s ALA 97 Ca 0.10 -0.34 -0.01 0.00 0.00 0.00 0.00 51.96 51.71 1un5 s ALA 97 Cb -0.11 -2.28 0.06 0.00 0.00 0.00 0.00 23.12 20.79 1un5 s ALA 97 CO 0.00 0.53 0.00 0.99 0.00 0.00 0.00 175.76 177.29 1un5 s THR 98 N -1.18 0.94 0.18 0.00 2.01 0.98 -4.84 115.64 113.73 1un5 s THR 98 Ca 0.25 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 1un5 s THR 98 Cb -0.15 -1.35 -0.07 0.00 0.01 0.00 0.00 72.50 70.93 1un5 s THR 98 CO 0.14 -0.17 0.94 0.00 -0.69 0.00 0.00 174.62 174.84 1un5 s ALA 99 N 1.67 3.30 0.36 7.40 0.00 -1.26 -0.18 121.76 133.04 1un5 s ALA 99 Ca -0.03 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.52 1un5 s ALA 99 Cb -0.18 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1un5 s ALA 99 CO -0.07 0.11 0.46 0.20 0.00 0.00 0.00 175.76 176.45 1un5 s GLY 100 N -0.64 1.74 -0.26 0.00 0.00 0.14 -4.99 107.32 103.31 1un5 s GLY 100 Ca 0.43 -1.67 -0.02 0.00 0.00 0.00 0.00 44.72 43.47 1un5 s GLY 100 CO 0.31 -1.09 0.26 -0.12 0.00 0.00 0.00 173.10 172.46 1un5 s PHE 101 N -2.95 -0.37 0.33 1.90 5.36 -1.26 -1.71 117.98 119.27 1un5 s PHE 101 Ca 0.33 -0.01 -0.17 0.00 -0.96 0.00 0.00 56.93 56.11 1un5 s PHE 101 Cb -0.00 -0.42 0.06 0.00 -0.34 0.00 0.00 43.02 42.32 1un5 s PHE 101 CO 0.23 -0.79 0.88 -0.98 -1.46 0.00 0.00 175.22 173.10 1un5 s ARG 102 N 2.35 1.96 0.70 10.12 1.70 -0.79 -4.89 118.95 130.10 1un5 s ARG 102 Ca 0.09 -1.27 -0.11 0.00 -0.47 0.00 0.00 55.73 53.96 1un5 s ARG 102 Cb -0.15 0.54 0.01 0.00 -0.57 0.00 0.00 34.95 34.79 1un5 s ARG 102 CO -0.25 -0.92 1.08 0.54 -1.08 0.00 0.00 175.30 174.67 1un5 s ASN 103 N -3.20 5.47 0.20 -2.89 4.22 -1.26 -0.20 114.94 117.28 1un5 s ASN 103 Ca 0.18 1.25 0.09 0.00 -2.14 0.00 0.00 52.86 52.25 1un5 s ASN 103 Cb -0.04 -2.10 -0.04 0.00 1.28 0.00 0.00 41.25 40.34 1un5 s ASN 103 CO 0.10 -1.34 -0.18 0.68 -2.04 0.00 0.00 177.10 174.32 1un5 s VAL 104 N -3.27 1.96 -0.15 3.54 -7.23 -1.26 -4.90 120.40 109.09 1un5 s VAL 104 Ca 0.58 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 1un5 s VAL 104 Cb -0.12 -2.01 -0.00 0.00 0.56 0.00 0.00 36.38 34.81 1un5 s VAL 104 CO 0.53 -0.40 -0.16 -0.69 -0.31 0.00 0.00 175.10 174.07 1un5 s VAL 105 N -2.37 2.64 0.14 1.32 1.01 -1.26 -1.28 120.40 120.59 1un5 s VAL 105 Ca 0.21 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1un5 s VAL 105 Cb -0.04 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1un5 s VAL 105 CO 0.08 0.52 -0.04 0.68 0.00 0.00 0.00 175.10 176.34 1un5 s VAL 106 N 0.76 0.73 -0.07 2.92 -7.23 -0.05 -1.45 120.40 116.01 1un5 s VAL 106 Ca -0.06 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 1un5 s VAL 106 Cb -0.15 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.86 1un5 s VAL 106 CO 0.01 -0.69 -0.05 0.00 -0.31 0.00 0.00 175.10 174.06 1un5 s ALA 107 N -3.61 3.05 0.06 1.32 0.00 -0.51 -0.61 121.76 121.47 1un5 s ALA 107 Ca 0.18 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.30 1un5 s ALA 107 Cb 0.05 -1.28 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 1un5 s ALA 107 CO -0.00 0.58 0.00 0.00 0.00 0.00 0.00 175.76 176.33 1un5 s GLU 109 N -2.06 1.03 -1.46 0.00 2.12 0.31 -4.87 118.70 113.77 1un5 s GLU 109 Ca 0.24 -0.14 -0.02 0.00 0.36 0.00 0.00 54.97 55.41 1un5 s GLU 109 Cb -0.12 -1.07 0.00 0.00 0.26 0.00 0.00 34.13 33.21 1un5 s GLU 109 CO 0.16 -0.13 0.24 0.09 -0.54 0.00 0.00 175.26 175.08 1un5 n ASN 110 N 4.35 -0.04 0.00 -1.70 3.02 -1.26 -0.82 115.26 118.82 1un5 n ASN 110 Ca -0.19 -1.15 0.00 0.00 -0.03 0.00 0.00 54.58 53.21 1un5 n ASN 110 Cb 0.51 -2.30 0.00 0.00 -0.61 0.00 0.00 39.78 37.38 1un5 n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1un5 n GLY 111 N -2.27 0.39 3.35 7.41 0.00 -1.26 -5.02 105.19 107.78 1un5 n GLY 111 Ca -0.30 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 1un5 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1un5 s LEU 112 N 0.00 2.27 0.10 0.99 1.43 0.00 -4.81 118.68 118.66 1un5 s LEU 112 Ca 0.00 -0.68 -0.30 0.00 -1.03 0.00 0.00 54.13 52.12 1un5 s LEU 112 Cb 0.00 -1.14 -0.06 0.00 0.03 0.00 0.00 46.19 45.01 1un5 s LEU 112 CO 0.00 0.17 1.20 -2.84 0.23 0.00 0.00 176.35 175.11 1un5 s PRO 113 N -1.76 4.46 0.00 1.29 0.02 -1.26 0.11 135.00 137.86 1un5 s PRO 113 Ca 0.11 1.80 0.00 0.00 0.02 0.00 0.00 61.00 62.93 1un5 s PRO 113 Cb -0.10 -3.31 0.00 0.00 0.02 0.00 0.00 34.50 31.11 1un5 s PRO 113 CO 0.04 -0.19 0.18 1.33 -0.33 0.00 0.00 177.00 178.03 1un5 n VAL 114 N 3.45 0.00 -3.69 3.83 0.24 -0.21 -4.34 118.33 117.61 1un5 n VAL 114 Ca 0.07 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.34 61.98 1un5 n VAL 114 Cb 0.46 1.30 -0.09 0.00 -1.47 0.00 0.00 33.84 34.04 1un5 n VAL 114 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1un5 s HIS 115 N -0.19 -0.61 -0.17 6.34 5.65 -1.19 -4.70 115.29 120.42 1un5 s HIS 115 Ca 0.00 1.44 -0.03 0.00 0.25 0.00 0.00 55.06 56.72 1un5 s HIS 115 Cb 0.00 0.24 -0.02 0.00 -1.18 0.00 0.00 32.58 31.62 1un5 s HIS 115 CO 0.00 -0.30 -0.06 -1.17 -0.65 0.00 0.00 174.74 172.56 1un5 s LEU 116 N 0.51 3.01 -0.53 8.88 2.96 -1.26 -1.42 118.68 130.83 1un5 s LEU 116 Ca -0.02 -0.27 -0.28 0.00 -0.22 0.00 0.00 54.13 53.34 1un5 s LEU 116 Cb -0.04 -1.73 0.00 0.00 0.50 0.00 0.00 46.19 44.92 1un5 s LEU 116 CO -0.02 0.10 1.53 -0.62 -1.32 0.00 0.00 176.35 176.01 1un5 s ASP 117 N 0.78 5.98 0.31 3.68 -1.08 -0.53 -4.87 116.67 120.94 1un5 s ASP 117 Ca -0.02 0.46 0.26 0.00 -0.52 0.00 0.00 52.55 52.73 1un5 s ASP 117 Cb -0.15 -2.54 0.82 0.00 -1.46 0.00 0.00 42.92 39.59 1un5 s ASP 117 CO 0.02 -1.79 1.75 1.56 0.52 0.00 0.00 175.17 177.23 1un5 h GLN 118 N 11.85 0.00 -0.99 4.34 1.08 -1.98 -3.33 115.11 126.09 1un5 h GLN 118 Ca -0.28 0.00 0.14 0.00 -1.45 0.00 0.00 58.65 57.07 1un5 h GLN 118 Cb 1.11 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 28.46 1un5 h GLN 118 CO 1.16 0.00 0.62 0.66 -0.95 0.00 0.00 178.83 180.32 1un5 h SER 119 N 0.00 0.84 0.41 1.46 4.64 -1.96 -0.53 113.55 118.41 1un5 h SER 119 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1un5 h SER 119 Cb 0.68 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1un5 h SER 119 CO 0.00 0.40 0.00 2.30 -0.87 0.00 0.00 176.83 178.66 1un5 n ILE 120 N -4.64 0.83 0.66 0.95 -5.35 -1.25 -2.35 119.36 108.20 1un5 n ILE 120 Ca 0.20 0.21 0.07 0.00 -0.27 0.00 0.00 62.75 62.95 1un5 n ILE 120 Cb 0.44 -0.96 -0.07 0.00 -1.74 0.00 0.00 39.64 37.32 1un5 n ILE 120 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1un5 n PHE 121 N -1.41 0.00 -2.39 4.28 3.01 -0.22 -4.82 117.46 115.91 1un5 n PHE 121 Ca 0.05 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.12 1un5 n PHE 121 Cb 0.15 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.59 1un5 n PHE 121 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1un5 s ARG 122 N -2.23 3.08 0.00 -1.08 0.52 -0.99 -5.06 118.95 113.18 1un5 s ARG 122 Ca 0.07 -0.22 0.00 0.00 -0.52 0.00 0.00 55.73 55.06 1un5 s ARG 122 Cb 0.11 -4.54 0.00 0.00 0.52 0.00 0.00 34.95 31.04 1un5 s ARG 122 CO 0.54 -2.41 0.00 0.54 0.02 0.00 0.00 175.30 173.99