#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ke5 s ALA 13 N 0.00 3.65 -0.21 -1.18 0.00 -1.26 -4.93 121.76 117.83 2ke5 s ALA 13 Ca 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 51.96 51.73 2ke5 s ALA 13 Cb 0.00 -2.42 0.01 0.00 0.00 0.00 0.00 23.12 20.71 2ke5 s ALA 13 CO 0.00 0.49 -0.10 -1.17 0.00 0.00 0.00 175.76 174.98 2ke5 s LEU 14 N -1.67 2.69 0.13 0.00 2.96 -1.26 -1.43 118.68 120.10 2ke5 s LEU 14 Ca 0.32 -0.58 0.03 0.00 -0.22 0.00 0.00 54.13 53.68 2ke5 s LEU 14 Cb -0.15 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 2ke5 s LEU 14 CO 0.17 -0.04 0.16 -1.00 -1.32 0.00 0.00 176.35 174.33 2ke5 s HIS 15 N 1.38 3.27 0.07 5.38 3.76 -0.58 -5.00 115.29 123.57 2ke5 s HIS 15 Ca 0.04 0.06 0.09 0.00 -0.15 0.00 0.00 55.06 55.11 2ke5 s HIS 15 Cb -0.14 -1.60 -0.03 0.00 1.11 0.00 0.00 32.58 31.92 2ke5 s HIS 15 CO -0.07 0.53 -0.25 0.15 -0.85 0.00 0.00 174.74 174.25 2ke5 s LYS 16 N -2.87 1.58 -0.08 1.40 1.02 -1.26 -0.40 119.74 119.13 2ke5 s LYS 16 Ca 0.32 -1.15 0.02 0.00 0.02 0.00 0.00 55.97 55.18 2ke5 s LYS 16 Cb -0.11 -1.84 0.01 0.00 -0.52 0.00 0.00 37.83 35.37 2ke5 s LYS 16 CO 0.25 0.46 -0.14 0.08 -0.92 0.00 0.00 175.35 175.08 2ke5 s VAL 17 N -0.89 1.31 -0.24 3.17 1.01 0.13 -1.02 120.40 123.87 2ke5 s VAL 17 Ca 0.11 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 2ke5 s VAL 17 Cb -0.10 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.10 2ke5 s VAL 17 CO 0.03 0.40 -0.04 -0.63 0.00 0.00 0.00 175.10 174.86 2ke5 s ILE 18 N 0.75 3.19 -0.71 2.22 -1.09 -0.32 -0.70 121.20 124.55 2ke5 s ILE 18 Ca -0.12 -0.78 -0.27 0.00 -2.23 0.00 0.00 60.65 57.25 2ke5 s ILE 18 Cb -0.16 -2.56 0.03 0.00 -1.58 0.00 0.00 42.46 38.20 2ke5 s ILE 18 CO 0.03 0.27 1.26 -0.04 -1.23 0.00 0.00 174.94 175.23 2ke5 s MET 19 N 1.41 3.25 0.71 2.79 -1.94 -1.07 -1.42 119.30 123.02 2ke5 s MET 19 Ca 0.03 -0.15 -0.06 0.00 -1.71 0.00 0.00 55.69 53.80 2ke5 s MET 19 Cb -0.16 -4.15 0.07 0.00 2.01 0.00 0.00 34.83 32.60 2ke5 s MET 19 CO -0.03 -2.06 1.01 0.08 -0.01 0.00 0.00 175.02 174.01 2ke5 s VAL 20 N 5.59 2.27 0.00 -6.03 1.01 0.92 -4.24 120.40 119.93 2ke5 s VAL 20 Ca 0.36 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2ke5 s VAL 20 Cb -0.08 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.32 2ke5 s VAL 20 CO 0.17 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.88 2ke5 n GLY 21 N -2.92 1.72 0.43 4.51 0.00 -1.26 -3.11 105.19 104.55 2ke5 n GLY 21 Ca 0.09 -0.71 0.24 0.00 0.00 0.00 0.00 46.02 45.64 2ke5 n GLY 21 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ke5 h SER 22 N 0.00 0.31 0.00 1.61 4.64 -1.78 -3.44 113.55 114.89 2ke5 h SER 22 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2ke5 h SER 22 Cb 0.00 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2ke5 h SER 22 CO 0.00 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 2ke5 n GLY 23 N -1.56 -0.19 0.00 -0.77 0.00 -1.26 -4.74 105.19 96.67 2ke5 n GLY 23 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2ke5 n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ke5 n GLY 24 N 0.00 -1.98 0.88 -0.02 0.00 -1.26 -3.62 105.19 99.19 2ke5 n GLY 24 Ca 0.00 0.96 -0.00 0.00 0.00 0.00 0.00 46.02 46.98 2ke5 n GLY 24 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ke5 n VAL 25 N 0.00 0.48 0.00 1.61 0.31 -1.26 -5.05 118.33 114.41 2ke5 n VAL 25 Ca 0.00 0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 2ke5 n VAL 25 Cb 0.00 -1.30 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 2ke5 n VAL 25 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ke5 n GLY 26 N 3.22 0.00 0.23 2.92 0.00 -1.26 -5.01 105.19 105.29 2ke5 n GLY 26 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 2ke5 n GLY 26 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2ke5 h LYS 27 N 0.00 -0.26 -0.03 1.61 2.10 -1.92 -1.25 116.57 116.83 2ke5 h LYS 27 Ca 0.00 0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.66 2ke5 h LYS 27 Cb 0.00 0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2ke5 h LYS 27 CO 0.00 -0.17 -0.03 0.66 -2.00 0.00 0.00 179.45 177.90 2ke5 h SER 28 N -0.27 0.04 0.23 7.07 4.64 -1.92 -2.04 113.55 121.30 2ke5 h SER 28 Ca 0.08 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 2ke5 h SER 28 Cb 0.38 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2ke5 h SER 28 CO -0.23 0.08 -0.11 0.00 -0.87 0.00 0.00 176.83 175.70 2ke5 h ALA 29 N 1.92 -0.31 -0.03 5.18 0.00 -1.67 -2.33 119.26 122.02 2ke5 h ALA 29 Ca 0.01 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.74 2ke5 h ALA 29 Cb 0.09 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ke5 h ALA 29 CO 0.00 -0.49 0.04 -0.07 0.00 0.00 0.00 179.25 178.74 2ke5 h LEU 30 N -0.68 0.00 0.33 0.00 3.38 -1.11 -2.04 115.31 115.20 2ke5 h LEU 30 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2ke5 h LEU 30 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2ke5 h LEU 30 CO 0.05 0.00 -0.16 0.74 0.09 0.00 0.00 178.44 179.16 2ke5 h THR 31 N 0.00 0.68 -0.00 0.22 2.02 -0.94 -2.80 112.91 112.10 2ke5 h THR 31 Ca 0.01 -0.36 -0.04 0.00 0.77 0.00 0.00 66.41 66.80 2ke5 h THR 31 Cb 0.09 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 2ke5 h THR 31 CO -0.00 0.07 -0.21 -0.07 0.37 0.00 0.00 175.52 175.68 2ke5 h LEU 32 N -0.65 0.00 -1.13 2.58 3.38 -0.87 -2.42 115.31 116.21 2ke5 h LEU 32 Ca -0.05 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2ke5 h LEU 32 Cb 0.46 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 2ke5 h LEU 32 CO 0.08 0.21 0.33 1.56 0.09 0.00 0.00 178.44 180.70 2ke5 h GLN 33 N 0.00 0.94 0.00 1.13 1.08 -1.25 -0.93 115.11 116.08 2ke5 h GLN 33 Ca -0.00 -0.12 -0.08 0.00 -1.45 0.00 0.00 58.65 57.00 2ke5 h GLN 33 Cb 0.37 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 2ke5 h GLN 33 CO 0.03 0.72 -0.37 0.35 -0.95 0.00 0.00 178.83 178.61 2ke5 h PHE 34 N 0.94 0.00 0.01 2.96 3.57 -1.17 0.35 116.94 123.59 2ke5 h PHE 34 Ca 0.23 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 2ke5 h PHE 34 Cb 0.09 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 2ke5 h PHE 34 CO 0.01 0.37 -0.28 1.98 -2.23 0.00 0.00 178.31 178.16 2ke5 h MET 35 N 0.00 0.01 -0.01 1.11 4.05 -1.22 -3.39 114.93 115.49 2ke5 h MET 35 Ca -0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 2ke5 h MET 35 Cb 0.93 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.74 2ke5 h MET 35 CO 0.05 1.01 -0.46 0.66 0.23 0.00 0.00 176.91 178.40 2ke5 n TYR 36 N -4.55 0.00 -2.73 1.39 4.02 -0.44 -4.97 117.16 109.88 2ke5 n TYR 36 Ca -0.14 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.56 2ke5 n TYR 36 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 2ke5 n TYR 36 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2ke5 n ASP 37 N -0.45 -4.92 -3.75 7.72 9.92 0.12 -4.94 116.55 120.26 2ke5 n ASP 37 Ca 0.06 -0.08 -0.10 0.00 -0.53 0.00 0.00 54.79 54.14 2ke5 n ASP 37 Cb 0.33 -4.08 -0.06 0.00 -0.64 0.00 0.00 41.12 36.67 2ke5 n ASP 37 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2ke5 s GLU 38 N -5.37 0.91 -0.50 -1.24 2.56 -1.25 -5.05 118.70 108.77 2ke5 s GLU 38 Ca 0.14 -0.72 -0.25 0.00 0.00 0.00 0.00 54.97 54.14 2ke5 s GLU 38 Cb -0.07 0.39 0.03 0.00 2.00 0.00 0.00 34.13 36.48 2ke5 s GLU 38 CO 0.18 -0.32 0.93 0.12 -0.56 0.00 0.00 175.26 175.61 2ke5 s PHE 39 N -3.42 2.87 -0.12 5.30 5.36 -1.26 -4.39 117.98 122.32 2ke5 s PHE 39 Ca 0.01 0.22 0.01 0.00 -0.96 0.00 0.00 56.93 56.21 2ke5 s PHE 39 Cb 0.02 -4.00 -0.01 0.00 -0.34 0.00 0.00 43.02 38.68 2ke5 s PHE 39 CO -0.09 -1.20 -0.15 0.08 -1.46 0.00 0.00 175.22 172.40 2ke5 s VAL 40 N 3.83 2.92 -0.24 3.12 1.01 -1.26 -5.00 120.40 124.79 2ke5 s VAL 40 Ca 0.34 -0.71 0.19 0.00 0.00 0.00 0.00 61.98 61.80 2ke5 s VAL 40 Cb -0.11 -2.21 0.08 0.00 0.00 0.00 0.00 36.38 34.14 2ke5 s VAL 40 CO 0.23 0.53 1.27 -0.08 0.00 0.00 0.00 175.10 177.06 2ke5 h GLU 41 N 6.62 0.00 -7.36 2.72 4.81 -2.03 -3.46 114.58 115.88 2ke5 h GLU 41 Ca -0.26 0.00 -0.51 0.00 -0.13 0.00 0.00 59.36 58.46 2ke5 h GLU 41 Cb 1.21 0.00 0.08 0.00 0.63 0.00 0.00 28.75 30.68 2ke5 h GLU 41 CO 0.54 0.23 0.39 -0.51 -0.73 0.00 0.00 179.01 178.93 2ke5 s ASP 42 N -6.03 5.61 0.18 1.04 1.11 -1.26 -5.07 116.67 112.25 2ke5 s ASP 42 Ca 0.02 1.49 -0.16 0.00 0.18 0.00 0.00 52.55 54.08 2ke5 s ASP 42 Cb 0.08 -2.41 0.06 0.00 1.07 0.00 0.00 42.92 41.71 2ke5 s ASP 42 CO 0.75 -1.28 0.78 0.00 1.18 0.00 0.00 175.17 176.60 2ke5 n TYR 43 N -3.01 -1.39 -3.89 4.23 4.11 -1.26 -5.13 117.16 110.81 2ke5 n TYR 43 Ca 0.07 -1.11 -0.11 0.00 -0.00 0.00 0.00 57.90 56.75 2ke5 n TYR 43 Cb 0.54 0.54 -0.11 0.00 -0.00 0.00 0.00 39.34 40.32 2ke5 n TYR 43 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.86 175.03 2ke5 s GLU 44 N -2.05 0.37 0.58 -3.48 -1.05 -1.26 -5.15 118.70 106.67 2ke5 s GLU 44 Ca 0.17 -0.35 -0.20 0.00 -0.15 0.00 0.00 54.97 54.45 2ke5 s GLU 44 Cb -0.03 0.15 -0.05 0.00 -0.44 0.00 0.00 34.13 33.77 2ke5 s GLU 44 CO 0.05 -0.08 1.09 -2.30 0.95 0.00 0.00 175.26 174.98 2ke5 n PRO 45 N 1.79 1.13 -4.94 -4.83 -0.02 -1.26 -5.01 135.00 121.86 2ke5 n PRO 45 Ca -0.21 0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 61.37 2ke5 n PRO 45 Cb 0.56 -2.29 -0.16 0.00 -0.02 0.00 0.00 33.50 31.60 2ke5 n PRO 45 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2ke5 s THR 46 N -1.43 2.57 0.00 3.45 2.01 -1.26 -4.94 115.64 116.04 2ke5 s THR 46 Ca 0.75 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.91 2ke5 s THR 46 Cb -0.43 -2.04 0.00 0.00 0.01 0.00 0.00 72.50 70.04 2ke5 s THR 46 CO 0.48 0.54 0.00 2.29 -0.69 0.00 0.00 174.62 177.23 2ke5 n LYS 47 N 3.58 0.07 0.00 4.92 2.85 -1.26 -4.97 118.16 123.35 2ke5 n LYS 47 Ca -0.19 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.07 2ke5 n LYS 47 Cb 0.53 -0.61 0.00 0.00 -0.65 0.00 0.00 35.03 34.30 2ke5 n LYS 47 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ke5 n ALA 48 N -1.64 0.23 -2.58 0.58 0.00 -1.26 -5.13 120.51 110.71 2ke5 n ALA 48 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 2ke5 n ALA 48 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.53 2ke5 n ALA 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ke5 s ASP 49 N 0.00 7.24 0.19 0.00 1.11 -1.26 -5.04 116.67 118.90 2ke5 s ASP 49 Ca 0.00 1.81 0.10 0.00 0.18 0.00 0.00 52.55 54.63 2ke5 s ASP 49 Cb 0.00 -2.57 -0.04 0.00 1.07 0.00 0.00 42.92 41.37 2ke5 s ASP 49 CO 0.00 -0.36 -0.20 -0.94 1.18 0.00 0.00 175.17 174.85 2ke5 s SER 50 N 1.05 2.97 0.21 0.27 1.04 -1.26 -4.87 113.70 113.11 2ke5 s SER 50 Ca 0.55 -0.90 -0.08 0.00 0.48 0.00 0.00 55.95 56.00 2ke5 s SER 50 Cb -0.24 -0.20 -0.07 0.00 0.10 0.00 0.00 66.02 65.61 2ke5 s SER 50 CO 0.28 0.00 0.51 -0.31 0.98 0.00 0.00 173.24 174.70 2ke5 s TYR 51 N -2.09 3.44 -0.09 5.02 2.02 -1.12 -4.97 117.35 119.56 2ke5 s TYR 51 Ca 0.19 0.79 -0.07 0.00 -0.37 0.00 0.00 57.07 57.61 2ke5 s TYR 51 Cb -0.06 -2.19 0.03 0.00 -0.40 0.00 0.00 41.96 39.34 2ke5 s TYR 51 CO 0.08 0.30 0.22 1.03 -1.57 0.00 0.00 175.55 175.62 2ke5 s ARG 52 N -2.83 0.24 -0.28 -0.62 0.52 -1.26 -3.54 118.95 111.18 2ke5 s ARG 52 Ca 0.46 0.35 -0.24 0.00 -0.52 0.00 0.00 55.73 55.78 2ke5 s ARG 52 Cb -0.11 0.07 0.13 0.00 0.52 0.00 0.00 34.95 35.56 2ke5 s ARG 52 CO 0.22 -0.06 1.05 -1.59 0.02 0.00 0.00 175.30 174.95 2ke5 s LYS 53 N 0.37 0.45 -0.14 3.54 -2.85 -1.24 -5.03 119.74 114.84 2ke5 s LYS 53 Ca -0.02 0.57 -0.26 0.00 -1.00 0.00 0.00 55.97 55.26 2ke5 s LYS 53 Cb -0.04 0.20 -0.02 0.00 -2.06 0.00 0.00 37.83 35.92 2ke5 s LYS 53 CO -0.02 -0.06 0.87 0.15 0.10 0.00 0.00 175.35 176.40 2ke5 s LYS 54 N 0.39 4.34 0.02 1.78 1.02 -1.26 -3.03 119.74 123.00 2ke5 s LYS 54 Ca 0.02 1.12 0.01 0.00 0.02 0.00 0.00 55.97 57.13 2ke5 s LYS 54 Cb -0.05 -3.56 -0.01 0.00 -0.52 0.00 0.00 37.83 33.69 2ke5 s LYS 54 CO -0.08 -0.30 -0.05 0.14 -0.92 0.00 0.00 175.35 174.14 2ke5 s VAL 55 N 2.03 0.34 0.13 3.17 -7.23 -1.21 -5.03 120.40 112.59 2ke5 s VAL 55 Ca 0.41 -0.57 -0.21 0.00 -1.81 0.00 0.00 61.98 59.81 2ke5 s VAL 55 Cb -0.17 -0.36 -0.07 0.00 0.56 0.00 0.00 36.38 36.33 2ke5 s VAL 55 CO 0.14 -0.16 0.66 0.54 -0.31 0.00 0.00 175.10 175.97 2ke5 s VAL 56 N -0.72 4.61 -0.18 1.32 0.11 -1.26 -1.45 120.40 122.83 2ke5 s VAL 56 Ca -0.05 1.34 -0.05 0.00 -2.93 0.00 0.00 61.98 60.29 2ke5 s VAL 56 Cb -0.05 -3.95 0.07 0.00 -1.53 0.00 0.00 36.38 30.92 2ke5 s VAL 56 CO -0.00 0.46 0.13 -0.22 -3.33 0.00 0.00 175.10 172.14 2ke5 s LEU 57 N -1.35 0.20 -1.45 2.54 2.96 -0.28 -4.85 118.68 116.45 2ke5 s LEU 57 Ca 0.34 -0.47 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 2ke5 s LEU 57 Cb -0.20 -0.05 0.01 0.00 0.50 0.00 0.00 46.19 46.45 2ke5 s LEU 57 CO 0.21 -0.34 0.14 0.47 -1.32 0.00 0.00 176.35 175.52 2ke5 n ASP 58 N 5.29 -5.06 0.00 3.68 8.00 -1.26 -1.15 116.55 126.05 2ke5 n ASP 58 Ca -0.06 -0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.42 2ke5 n ASP 58 Cb 0.49 -4.21 0.00 0.00 -0.02 0.00 0.00 41.12 37.38 2ke5 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ke5 n GLY 59 N -1.04 3.00 3.57 0.44 0.00 -1.26 -5.01 105.19 104.89 2ke5 n GLY 59 Ca -0.17 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 2ke5 n GLY 59 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ke5 s GLU 60 N 0.00 3.64 -0.38 1.61 2.56 -0.30 -5.02 118.70 120.81 2ke5 s GLU 60 Ca 0.00 0.07 -0.27 0.00 0.00 0.00 0.00 54.97 54.77 2ke5 s GLU 60 Cb 0.00 -3.83 0.02 0.00 2.00 0.00 0.00 34.13 32.32 2ke5 s GLU 60 CO 0.00 -0.81 0.97 -2.00 -0.56 0.00 0.00 175.26 172.86 2ke5 s GLU 61 N 2.85 3.83 0.07 4.30 2.12 -1.26 -1.12 118.70 129.48 2ke5 s GLU 61 Ca 0.26 0.61 0.09 0.00 0.36 0.00 0.00 54.97 56.29 2ke5 s GLU 61 Cb -0.14 -3.82 -0.03 0.00 0.26 0.00 0.00 34.13 30.40 2ke5 s GLU 61 CO 0.16 -1.02 -0.25 0.14 -0.54 0.00 0.00 175.26 173.76 2ke5 s VAL 62 N 3.64 2.03 0.17 3.70 -7.23 -0.53 -4.62 120.40 117.55 2ke5 s VAL 62 Ca 0.40 -1.46 -0.29 0.00 -1.81 0.00 0.00 61.98 58.82 2ke5 s VAL 62 Cb -0.11 -1.76 -0.07 0.00 0.56 0.00 0.00 36.38 34.99 2ke5 s VAL 62 CO 0.20 0.22 0.92 -1.10 -0.31 0.00 0.00 175.10 175.03 2ke5 s GLN 63 N -1.50 4.74 -0.01 4.82 -0.21 -0.52 -3.30 119.66 123.69 2ke5 s GLN 63 Ca 0.11 1.41 0.03 0.00 0.02 0.00 0.00 55.36 56.93 2ke5 s GLN 63 Cb -0.10 -3.32 -0.03 0.00 1.00 0.00 0.00 33.01 30.56 2ke5 s GLN 63 CO 0.03 0.39 -0.07 -1.50 -2.12 0.00 0.00 175.29 172.02 2ke5 s ILE 64 N -0.64 3.64 -0.17 1.08 2.07 -1.17 -1.52 121.20 124.49 2ke5 s ILE 64 Ca 0.43 -0.73 -0.01 0.00 -1.41 0.00 0.00 60.65 58.93 2ke5 s ILE 64 Cb -0.24 -2.56 0.05 0.00 0.13 0.00 0.00 42.46 39.84 2ke5 s ILE 64 CO 0.30 0.43 -0.01 -0.62 -1.91 0.00 0.00 174.94 173.14 2ke5 s ASP 65 N -1.29 2.78 -0.07 4.50 -1.08 0.46 -3.60 116.67 118.37 2ke5 s ASP 65 Ca 0.16 -0.70 -0.03 0.00 -0.52 0.00 0.00 52.55 51.47 2ke5 s ASP 65 Cb -0.11 -0.73 -0.04 0.00 -1.46 0.00 0.00 42.92 40.58 2ke5 s ASP 65 CO 0.06 -0.24 0.06 -0.63 0.52 0.00 0.00 175.17 174.94 2ke5 s ILE 66 N 1.75 4.71 -0.20 4.11 1.01 -1.23 0.22 121.20 131.57 2ke5 s ILE 66 Ca -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 60.65 60.43 2ke5 s ILE 66 Cb -0.16 -3.05 0.06 0.00 0.01 0.00 0.00 42.46 39.32 2ke5 s ILE 66 CO -0.07 0.53 0.03 -0.22 0.00 0.00 0.00 174.94 175.21 2ke5 s LEU 67 N -1.17 1.25 -0.07 2.97 1.98 0.12 -2.80 118.68 120.97 2ke5 s LEU 67 Ca 0.17 -0.85 -0.14 0.00 -2.89 0.00 0.00 54.13 50.41 2ke5 s LEU 67 Cb -0.12 -0.62 -0.05 0.00 0.66 0.00 0.00 46.19 46.06 2ke5 s LEU 67 CO 0.06 -0.31 0.36 1.51 -1.89 0.00 0.00 176.35 176.09 2ke5 s ASP 68 N 1.84 6.66 0.20 3.68 1.47 -1.26 -2.60 116.67 126.66 2ke5 s ASP 68 Ca -0.01 0.79 0.03 0.00 1.18 0.00 0.00 52.55 54.54 2ke5 s ASP 68 Cb -0.17 -2.22 0.03 0.00 -0.34 0.00 0.00 42.92 40.21 2ke5 s ASP 68 CO -0.08 0.24 0.22 0.35 0.68 0.00 0.00 175.17 176.58 2ke5 n THR 69 N 2.49 0.00 -4.16 2.11 -2.24 -1.26 -4.91 114.28 106.31 2ke5 n THR 69 Ca -0.13 -0.71 -0.15 0.00 -2.27 0.00 0.00 64.05 60.78 2ke5 n THR 69 Cb 0.52 -0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 68.07 2ke5 n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ke5 s ALA 70 N -2.26 1.08 -0.58 6.98 0.00 -1.26 -4.56 121.76 121.16 2ke5 s ALA 70 Ca 0.17 -1.66 -0.26 0.00 0.00 0.00 0.00 51.96 50.20 2ke5 s ALA 70 Cb -0.01 1.28 -0.10 0.00 0.00 0.00 0.00 23.12 24.29 2ke5 s ALA 70 CO 0.11 -0.73 2.45 0.41 0.00 0.00 0.00 175.76 178.00 2ke5 n GLY 71 N -0.53 0.07 0.00 0.00 0.00 -1.24 -4.76 105.19 98.74 2ke5 n GLY 71 Ca 0.03 0.69 0.06 0.00 0.00 0.00 0.00 46.02 46.80 2ke5 n GLY 71 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ke5 n LEU 72 N 15.37 0.00 0.00 0.99 4.77 -1.26 -4.92 117.00 131.96 2ke5 n LEU 72 Ca 0.42 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2ke5 n LEU 72 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2ke5 n LEU 72 CO 0.73 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 176.17 2ke5 n GLU 73 N -0.73 0.00 -3.51 3.23 1.02 -1.26 -4.37 120.64 115.02 2ke5 n GLU 73 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2ke5 n GLU 73 Cb 0.04 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.41 2ke5 n GLU 73 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2ke5 s ASP 74 N -4.00 -0.42 0.00 1.62 -1.08 -1.26 -5.14 116.67 106.39 2ke5 s ASP 74 Ca 0.00 0.63 0.00 0.00 -0.52 0.00 0.00 52.55 52.66 2ke5 s ASP 74 Cb 0.00 1.33 0.00 0.00 -1.46 0.00 0.00 42.92 42.79 2ke5 s ASP 74 CO 0.00 -0.09 0.00 -1.22 0.52 0.00 0.00 175.17 174.38 2ke5 n TYR 75 N 4.16 -0.13 0.08 -5.34 4.01 -1.26 -5.08 117.16 113.59 2ke5 n TYR 75 Ca -0.14 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.49 2ke5 n TYR 75 Cb 0.55 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.51 2ke5 n TYR 75 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2ke5 h ALA 76 N 1.13 -0.26 0.00 -0.72 0.00 -2.03 -3.45 119.26 113.94 2ke5 h ALA 76 Ca 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2ke5 h ALA 76 Cb 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2ke5 h ALA 76 CO 0.00 -0.37 -0.05 0.00 0.00 0.00 0.00 179.25 178.84 2ke5 n ALA 77 N -2.53 0.39 0.30 0.00 0.00 -1.26 -4.97 120.51 112.44 2ke5 n ALA 77 Ca -0.08 -0.11 0.20 0.00 0.00 0.00 0.00 53.44 53.45 2ke5 n ALA 77 Cb 0.26 -0.14 1.07 0.00 0.00 0.00 0.00 19.45 20.64 2ke5 n ALA 77 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2ke5 h ILE 78 N 1.58 0.00 -0.24 0.00 2.04 -2.01 -2.04 117.51 116.84 2ke5 h ILE 78 Ca -0.09 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 2ke5 h ILE 78 Cb 0.56 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2ke5 h ILE 78 CO -0.05 0.00 0.04 0.03 0.00 0.00 0.00 178.15 178.17 2ke5 h ARG 79 N 0.00 0.40 -0.61 2.37 3.08 -1.96 -2.69 114.38 114.98 2ke5 h ARG 79 Ca 0.00 -0.11 0.16 0.00 0.07 0.00 0.00 59.98 60.10 2ke5 h ARG 79 Cb 0.00 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 2ke5 h ARG 79 CO 0.00 0.53 0.43 -0.44 -1.07 0.00 0.00 179.97 179.42 2ke5 h ASP 80 N 0.21 0.10 -0.28 7.04 5.19 -1.72 -2.12 116.42 124.84 2ke5 h ASP 80 Ca 0.07 0.01 0.06 0.00 -0.62 0.00 0.00 57.03 56.55 2ke5 h ASP 80 Cb 0.32 -0.01 -0.06 0.00 0.18 0.00 0.00 39.33 39.75 2ke5 h ASP 80 CO 0.00 0.05 -0.15 -1.13 -3.12 0.00 0.00 179.24 174.90 2ke5 h ASN 81 N 0.10 -0.49 -0.18 6.45 -1.24 -1.56 0.37 115.58 119.03 2ke5 h ASN 81 Ca 0.29 0.11 -0.01 0.00 0.71 0.00 0.00 56.30 57.41 2ke5 h ASN 81 Cb 1.01 0.27 -0.01 0.00 0.73 0.00 0.00 38.32 40.32 2ke5 h ASN 81 CO -0.03 -0.18 0.08 1.88 -1.29 0.00 0.00 177.43 177.88 2ke5 h TYR 82 N -0.12 0.26 0.00 0.67 0.05 -1.49 -2.09 116.97 114.26 2ke5 h TYR 82 Ca 0.15 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.91 2ke5 h TYR 82 Cb 0.34 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.00 2ke5 h TYR 82 CO -0.34 0.30 0.00 0.74 -1.05 0.00 0.00 178.16 177.82 2ke5 h PHE 83 N 0.14 0.00 0.10 4.88 0.04 -1.39 -2.57 116.94 118.13 2ke5 h PHE 83 Ca 0.06 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.67 2ke5 h PHE 83 Cb 0.14 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.30 2ke5 h PHE 83 CO -0.02 0.00 -0.75 -0.09 -0.60 0.00 0.00 178.31 176.85 2ke5 h ARG 84 N 0.00 0.20 -0.12 1.51 2.43 -0.27 -3.28 114.38 114.86 2ke5 h ARG 84 Ca 0.00 -0.35 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2ke5 h ARG 84 Cb 0.11 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2ke5 h ARG 84 CO 0.00 1.17 0.00 0.45 -1.51 0.00 0.00 179.97 180.08 2ke5 n SER 85 N -4.22 0.12 -4.55 -3.80 2.88 -0.94 -4.80 113.62 98.30 2ke5 n SER 85 Ca -0.16 -1.75 -0.26 0.00 -1.33 0.00 0.00 58.87 55.38 2ke5 n SER 85 Cb 0.75 -0.06 -0.11 0.00 -0.75 0.00 0.00 64.21 64.04 2ke5 n SER 85 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ke5 s GLY 86 N -0.99 2.27 -0.02 0.46 0.00 -1.11 -5.02 107.32 102.91 2ke5 s GLY 86 Ca 0.00 -2.16 -0.05 0.00 0.00 0.00 0.00 44.72 42.50 2ke5 s GLY 86 CO 0.00 -2.01 -0.11 1.18 0.00 0.00 0.00 173.10 172.17 2ke5 n GLU 87 N -0.83 0.16 -3.47 2.90 -0.58 -1.25 -4.97 120.64 112.60 2ke5 n GLU 87 Ca -0.05 0.06 -0.33 0.00 -0.42 0.00 0.00 57.16 56.43 2ke5 n GLU 87 Cb 0.66 -0.69 -0.05 0.00 -0.57 0.00 0.00 31.44 30.78 2ke5 n GLU 87 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2ke5 s GLY 88 N -3.93 2.31 0.03 0.62 0.00 -0.19 -4.68 107.32 101.48 2ke5 s GLY 88 Ca -0.09 -0.31 0.08 0.00 0.00 0.00 0.00 44.72 44.40 2ke5 s GLY 88 CO 0.13 -0.15 -0.23 -1.36 0.00 0.00 0.00 173.10 171.49 2ke5 s PHE 89 N -1.68 2.02 -0.20 1.90 0.08 -1.13 -1.17 117.98 117.80 2ke5 s PHE 89 Ca 0.43 -0.39 -0.01 0.00 0.12 0.00 0.00 56.93 57.08 2ke5 s PHE 89 Cb -0.12 -1.24 0.05 0.00 -0.57 0.00 0.00 43.02 41.15 2ke5 s PHE 89 CO 0.21 0.06 -0.02 -0.51 -0.10 0.00 0.00 175.22 174.87 2ke5 s LEU 90 N -1.00 1.78 0.17 -0.37 1.43 -0.51 -2.44 118.68 117.75 2ke5 s LEU 90 Ca 0.09 -0.90 -0.27 0.00 -1.03 0.00 0.00 54.13 52.02 2ke5 s LEU 90 Cb -0.09 -0.88 -0.08 0.00 0.03 0.00 0.00 46.19 45.17 2ke5 s LEU 90 CO 0.01 -0.25 0.85 -0.22 0.23 0.00 0.00 176.35 176.98 2ke5 s LEU 91 N 1.64 4.59 -0.06 1.79 2.96 -0.55 -0.06 118.68 128.98 2ke5 s LEU 91 Ca -0.02 1.75 0.00 0.00 -0.22 0.00 0.00 54.13 55.64 2ke5 s LEU 91 Cb -0.17 -3.43 0.02 0.00 0.50 0.00 0.00 46.19 43.11 2ke5 s LEU 91 CO -0.07 0.14 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.37 2ke5 s VAL 92 N -0.90 0.56 -0.10 1.68 1.01 -1.18 -1.06 120.40 120.42 2ke5 s VAL 92 Ca 0.39 -0.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.19 2ke5 s VAL 92 Cb -0.24 -0.63 0.03 0.00 0.00 0.00 0.00 36.38 35.54 2ke5 s VAL 92 CO 0.28 0.26 0.29 0.72 0.00 0.00 0.00 175.10 176.65 2ke5 s PHE 93 N 1.36 -0.29 0.36 5.22 -0.12 -1.17 -3.73 117.98 119.61 2ke5 s PHE 93 Ca -0.04 0.69 -0.17 0.00 -0.05 0.00 0.00 56.93 57.37 2ke5 s PHE 93 Cb -0.13 0.10 -0.10 0.00 -0.63 0.00 0.00 43.02 42.26 2ke5 s PHE 93 CO -0.03 -0.19 0.81 -1.12 -0.05 0.00 0.00 175.22 174.65 2ke5 s SER 94 N -0.07 6.82 0.14 1.98 0.01 -1.26 -1.49 113.70 119.84 2ke5 s SER 94 Ca -0.02 1.41 0.01 0.00 1.31 0.00 0.00 55.95 58.66 2ke5 s SER 94 Cb -0.03 -2.43 -0.07 0.00 0.21 0.00 0.00 66.02 63.70 2ke5 s SER 94 CO 0.01 -0.26 1.32 0.16 0.41 0.00 0.00 173.24 174.88 2ke5 h ILE 95 N 1.91 1.49 0.00 1.44 3.07 -1.77 -3.18 117.51 120.48 2ke5 h ILE 95 Ca -0.48 -2.70 0.00 0.00 1.55 0.00 0.00 64.86 63.23 2ke5 h ILE 95 Cb 1.18 2.55 0.00 0.00 -0.27 0.00 0.00 36.82 40.27 2ke5 h ILE 95 CO 0.64 0.79 0.00 0.00 -1.05 0.00 0.00 178.15 178.53 2ke5 h THR 96 N 0.12 0.00 -3.39 0.16 1.03 -1.84 -0.21 112.91 108.77 2ke5 h THR 96 Ca -0.06 -0.83 -0.74 0.00 -0.01 0.00 0.00 66.41 64.78 2ke5 h THR 96 Cb 1.60 1.82 -0.29 0.00 -1.07 0.00 0.00 68.15 70.21 2ke5 h THR 96 CO 0.15 0.00 -0.28 -1.61 -0.01 0.00 0.00 175.52 173.77 2ke5 s GLU 97 N -3.36 2.74 0.64 0.00 0.41 -1.20 -4.67 118.70 113.26 2ke5 s GLU 97 Ca 0.05 -1.98 0.42 0.00 -0.41 0.00 0.00 54.97 53.04 2ke5 s GLU 97 Cb 0.06 -4.03 2.16 0.00 -1.78 0.00 0.00 34.13 30.54 2ke5 s GLU 97 CO 0.62 -1.23 2.28 1.25 -0.49 0.00 0.00 175.26 177.70 2ke5 h HIS 98 N 8.20 0.00 0.00 1.61 -0.00 -1.79 -1.25 115.15 121.92 2ke5 h HIS 98 Ca -0.14 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.12 2ke5 h HIS 98 Cb 1.05 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.45 2ke5 h HIS 98 CO 0.73 0.00 -0.50 1.05 -0.00 0.00 0.00 177.93 179.21 2ke5 h GLU 99 N 0.00 0.00 0.21 5.26 4.11 -1.91 -3.11 114.58 119.15 2ke5 h GLU 99 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 2ke5 h GLU 99 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2ke5 h GLU 99 CO 0.00 0.50 -0.10 0.77 0.07 0.00 0.00 179.01 180.24 2ke5 h SER 100 N 0.00 -0.24 -0.85 3.06 0.02 -1.51 -1.26 113.55 112.77 2ke5 h SER 100 Ca -0.00 -0.27 0.08 0.00 -0.84 0.00 0.00 61.79 60.75 2ke5 h SER 100 Cb 1.09 0.06 -0.07 0.00 0.14 0.00 0.00 62.40 63.62 2ke5 h SER 100 CO 0.06 0.20 0.51 0.15 -1.14 0.00 0.00 176.83 176.62 2ke5 h PHE 101 N -0.74 0.94 0.16 3.45 3.57 -1.63 0.60 116.94 123.30 2ke5 h PHE 101 Ca -0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2ke5 h PHE 101 Cb 0.50 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.94 2ke5 h PHE 101 CO 0.05 0.44 -0.08 1.79 -2.23 0.00 0.00 178.31 178.28 2ke5 h THR 102 N 0.90 0.94 -0.54 4.41 1.35 -1.58 -2.85 112.91 115.54 2ke5 h THR 102 Ca 0.39 -1.01 0.01 0.00 -0.55 0.00 0.00 66.41 65.25 2ke5 h THR 102 Cb 0.26 1.50 -0.03 0.00 -1.73 0.00 0.00 68.15 68.15 2ke5 h THR 102 CO -0.21 0.21 0.36 0.00 -0.25 0.00 0.00 175.52 175.64 2ke5 h ALA 103 N -0.09 0.69 -0.43 6.62 0.00 -1.11 -1.86 119.26 123.08 2ke5 h ALA 103 Ca -0.02 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.92 2ke5 h ALA 103 Cb 0.52 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2ke5 h ALA 103 CO 0.04 0.12 0.29 1.79 0.00 0.00 0.00 179.25 181.49 2ke5 h THR 104 N 0.73 0.92 -0.30 0.00 1.35 -0.96 -1.11 112.91 113.54 2ke5 h THR 104 Ca 0.20 -0.09 0.04 0.00 -0.55 0.00 0.00 66.41 66.01 2ke5 h THR 104 Cb -0.08 0.63 -0.02 0.00 -1.73 0.00 0.00 68.15 66.95 2ke5 h THR 104 CO -0.05 0.05 0.21 0.00 -0.25 0.00 0.00 175.52 175.48 2ke5 h ALA 105 N 1.78 2.01 -0.30 6.62 0.00 -1.08 -2.10 119.26 126.19 2ke5 h ALA 105 Ca 0.19 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 2ke5 h ALA 105 Cb 0.42 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2ke5 h ALA 105 CO -0.04 -0.07 -0.14 0.93 0.00 0.00 0.00 179.25 179.93 2ke5 h GLU 106 N 0.22 0.63 -0.22 0.00 5.08 -1.23 -2.89 114.58 116.16 2ke5 h GLU 106 Ca 0.13 -0.27 0.06 0.00 -1.00 0.00 0.00 59.36 58.28 2ke5 h GLU 106 Cb 0.25 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2ke5 h GLU 106 CO -0.02 0.85 0.27 0.74 -1.00 0.00 0.00 179.01 179.84 2ke5 h PHE 107 N 0.38 0.00 -0.22 4.33 -1.00 -1.43 -2.29 116.94 116.72 2ke5 h PHE 107 Ca 0.07 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.90 2ke5 h PHE 107 Cb 0.66 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 40.16 2ke5 h PHE 107 CO 0.06 0.00 -0.18 -0.09 -1.61 0.00 0.00 178.31 176.49 2ke5 h ARG 108 N 0.00 -0.17 -0.24 1.51 1.12 -1.46 -0.62 114.38 114.52 2ke5 h ARG 108 Ca 0.10 0.01 -0.16 0.00 -1.11 0.00 0.00 59.98 58.82 2ke5 h ARG 108 Cb 0.63 0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 30.63 2ke5 h ARG 108 CO -0.00 -0.11 -0.50 0.93 -3.11 0.00 0.00 179.97 177.17 2ke5 h GLU 109 N -0.18 0.67 -0.73 0.20 5.08 -1.58 -3.10 114.58 114.94 2ke5 h GLU 109 Ca 0.13 -0.40 0.09 0.00 -1.00 0.00 0.00 59.36 58.18 2ke5 h GLU 109 Cb 0.37 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 2ke5 h GLU 109 CO -0.33 1.01 0.48 1.96 -1.00 0.00 0.00 179.01 181.13 2ke5 h GLN 110 N 0.53 0.63 -0.87 2.33 1.08 -1.26 -1.45 115.11 116.09 2ke5 h GLN 110 Ca 0.02 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.16 2ke5 h GLN 110 Cb 1.06 -0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 28.31 2ke5 h GLN 110 CO 0.10 0.41 0.46 0.82 -0.95 0.00 0.00 178.83 179.68 2ke5 h ILE 111 N 0.64 1.26 0.00 2.54 2.04 -1.05 -2.28 117.51 120.66 2ke5 h ILE 111 Ca 0.33 -0.65 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 2ke5 h ILE 111 Cb 0.44 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 2ke5 h ILE 111 CO -0.12 0.29 -0.22 -0.07 0.00 0.00 0.00 178.15 178.04 2ke5 h LEU 112 N 1.22 0.00 -0.38 1.44 3.38 -1.35 -3.19 115.31 116.44 2ke5 h LEU 112 Ca 0.30 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.35 2ke5 h LEU 112 Cb 0.05 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.72 2ke5 h LEU 112 CO -0.05 0.22 -0.14 0.03 0.09 0.00 0.00 178.44 178.59 2ke5 h ARG 113 N 0.00 -0.07 -0.24 1.13 2.47 -1.22 -1.34 114.38 115.11 2ke5 h ARG 113 Ca -0.00 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.61 2ke5 h ARG 113 Cb 0.53 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.86 2ke5 h ARG 113 CO 0.03 -0.04 -0.34 -0.39 0.56 0.00 0.00 179.97 179.79 2ke5 h VAL 114 N -0.07 1.29 -1.95 2.04 -1.51 -1.67 -3.24 116.25 111.13 2ke5 h VAL 114 Ca 0.19 -1.44 -0.79 0.00 -1.23 0.00 0.00 66.70 63.43 2ke5 h VAL 114 Cb 0.35 1.47 -0.23 0.00 -2.13 0.00 0.00 31.29 30.76 2ke5 h VAL 114 CO -0.43 0.45 1.42 0.29 -1.23 0.00 0.00 177.57 178.08 2ke5 n LYS 115 N -4.07 5.19 0.11 5.19 4.76 -0.53 -4.63 118.16 124.18 2ke5 n LYS 115 Ca -0.01 -4.33 0.13 0.00 -2.87 0.00 0.00 58.31 51.23 2ke5 n LYS 115 Cb 0.47 -2.52 0.30 0.00 -1.84 0.00 0.00 35.03 31.44 2ke5 n LYS 115 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ke5 h ALA 116 N 4.35 0.87 0.00 7.82 0.00 -1.53 -3.25 119.26 127.52 2ke5 h ALA 116 Ca 0.58 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.35 2ke5 h ALA 116 Cb 0.32 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2ke5 h ALA 116 CO 1.27 0.00 -2.06 -1.91 0.00 0.00 0.00 179.25 176.54 2ke5 n GLU 117 N -2.33 0.67 -2.76 0.00 2.13 -1.26 -4.96 120.64 112.13 2ke5 n GLU 117 Ca 0.05 -0.09 -0.30 0.00 0.66 0.00 0.00 57.16 57.47 2ke5 n GLU 117 Cb 0.45 -1.55 -0.03 0.00 0.27 0.00 0.00 31.44 30.58 2ke5 n GLU 117 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2ke5 s GLU 118 N -3.11 3.79 -0.02 5.31 2.56 -1.23 -5.04 118.70 120.96 2ke5 s GLU 118 Ca -0.08 0.53 -0.03 0.00 0.00 0.00 0.00 54.97 55.39 2ke5 s GLU 118 Cb 0.11 -2.35 -0.01 0.00 2.00 0.00 0.00 34.13 33.88 2ke5 s GLU 118 CO 0.87 -0.08 -0.06 -3.47 -0.56 0.00 0.00 175.26 171.96 2ke5 n ASP 119 N -1.40 0.41 -4.59 -1.70 2.03 -1.26 -4.92 116.55 105.12 2ke5 n ASP 119 Ca 0.03 0.07 -0.43 0.00 0.52 0.00 0.00 54.79 54.98 2ke5 n ASP 119 Cb 0.54 -0.40 -0.02 0.00 -0.72 0.00 0.00 41.12 40.52 2ke5 n ASP 119 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2ke5 s LYS 120 N -1.40 3.55 -0.29 -0.67 2.47 -1.26 -5.00 119.74 117.14 2ke5 s LYS 120 Ca -0.05 0.70 -0.09 0.00 -1.56 0.00 0.00 55.97 54.98 2ke5 s LYS 120 Cb 0.01 -4.02 -0.01 0.00 -1.46 0.00 0.00 37.83 32.35 2ke5 s LYS 120 CO 0.07 -1.61 0.12 0.42 0.16 0.00 0.00 175.35 174.51 2ke5 s ILE 121 N 5.30 4.44 -0.15 5.43 -1.09 -1.26 -4.75 121.20 129.12 2ke5 s ILE 121 Ca 0.55 -0.38 -0.29 0.00 -2.23 0.00 0.00 60.65 58.30 2ke5 s ILE 121 Cb -0.11 -3.21 -0.04 0.00 -1.58 0.00 0.00 42.46 37.52 2ke5 s ILE 121 CO 0.31 0.15 1.58 -2.16 -1.23 0.00 0.00 174.94 173.59 2ke5 s PRO 122 N 1.60 4.01 0.05 2.79 0.04 -1.26 -4.99 135.00 137.24 2ke5 s PRO 122 Ca 0.05 1.87 -0.03 0.00 0.04 0.00 0.00 61.00 62.93 2ke5 s PRO 122 Cb -0.16 -3.98 -0.03 0.00 0.04 0.00 0.00 34.50 30.37 2ke5 s PRO 122 CO 0.05 -1.03 0.04 -1.17 0.04 0.00 0.00 177.00 174.92 2ke5 s LEU 123 N 4.51 2.13 -0.25 -3.56 2.96 -1.26 -2.85 118.68 120.36 2ke5 s LEU 123 Ca 0.70 -0.80 -0.15 0.00 -0.22 0.00 0.00 54.13 53.66 2ke5 s LEU 123 Cb -0.28 0.43 0.07 0.00 0.50 0.00 0.00 46.19 46.91 2ke5 s LEU 123 CO 0.27 -0.58 0.62 -0.22 -1.32 0.00 0.00 176.35 175.12 2ke5 s LEU 124 N -2.63 -0.70 -0.04 -0.68 0.20 -1.02 -4.86 118.68 108.96 2ke5 s LEU 124 Ca 0.02 1.35 -0.01 0.00 0.69 0.00 0.00 54.13 56.18 2ke5 s LEU 124 Cb 0.04 2.11 -0.04 0.00 -0.43 0.00 0.00 46.19 47.88 2ke5 s LEU 124 CO -0.08 -0.23 0.06 0.54 -0.29 0.00 0.00 176.35 176.35 2ke5 s VAL 125 N 1.48 4.63 0.17 1.68 0.11 -1.26 -1.49 120.40 125.73 2ke5 s VAL 125 Ca -0.09 -0.32 0.03 0.00 -2.93 0.00 0.00 61.98 58.67 2ke5 s VAL 125 Cb -0.06 -3.06 -0.05 0.00 -1.53 0.00 0.00 36.38 31.69 2ke5 s VAL 125 CO -0.17 0.45 -0.04 0.54 -3.33 0.00 0.00 175.10 172.55 2ke5 s VAL 126 N -1.08 0.93 -0.09 2.04 0.11 -0.22 -3.41 120.40 118.67 2ke5 s VAL 126 Ca 0.19 -2.02 0.01 0.00 -2.93 0.00 0.00 61.98 57.24 2ke5 s VAL 126 Cb -0.12 -2.04 0.02 0.00 -1.53 0.00 0.00 36.38 32.71 2ke5 s VAL 126 CO 0.09 -0.57 -0.12 -0.83 -3.33 0.00 0.00 175.10 170.35 2ke5 s GLY 127 N -3.19 0.87 0.61 6.54 0.00 -0.56 -3.03 107.32 108.56 2ke5 s GLY 127 Ca 0.21 -0.54 0.06 0.00 0.00 0.00 0.00 44.72 44.46 2ke5 s GLY 127 CO 0.03 0.35 0.85 -2.01 0.00 0.00 0.00 173.10 172.31 2ke5 n ASN 128 N 4.24 1.83 -1.99 1.64 5.15 -0.55 0.21 115.26 125.78 2ke5 n ASN 128 Ca -0.19 -2.38 -0.18 0.00 -0.60 0.00 0.00 54.58 51.24 2ke5 n ASN 128 Cb 0.51 -0.48 -0.04 0.00 -0.53 0.00 0.00 39.78 39.24 2ke5 n ASN 128 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2ke5 n LYS 129 N -2.42 -1.66 0.32 1.20 4.76 -1.24 -2.63 118.16 116.50 2ke5 n LYS 129 Ca 0.16 0.94 0.21 0.00 -2.87 0.00 0.00 58.31 56.75 2ke5 n LYS 129 Cb 0.58 -5.44 1.08 0.00 -1.84 0.00 0.00 35.03 29.42 2ke5 n LYS 129 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 2ke5 h SER 130 N 0.00 0.00 0.15 4.39 0.02 -1.72 -0.91 113.55 115.48 2ke5 h SER 130 Ca -0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 2ke5 h SER 130 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2ke5 h SER 130 CO 0.51 0.00 0.00 -0.67 -1.14 0.00 0.00 176.83 175.53 2ke5 n ASP 131 N -3.10 0.00 -4.17 3.07 2.03 -1.26 -4.01 116.55 109.10 2ke5 n ASP 131 Ca -0.02 -0.12 -0.40 0.00 0.52 0.00 0.00 54.79 54.77 2ke5 n ASP 131 Cb 0.13 -0.17 -0.03 0.00 -0.72 0.00 0.00 41.12 40.33 2ke5 n ASP 131 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2ke5 n LEU 132 N -1.17 4.96 0.24 -2.67 4.77 -0.35 -4.83 117.00 117.95 2ke5 n LEU 132 Ca 0.08 -5.12 0.15 0.00 -0.03 0.00 0.00 56.01 51.10 2ke5 n LEU 132 Cb 0.08 -1.26 0.53 0.00 -2.33 0.00 0.00 43.42 40.45 2ke5 n LEU 132 CO 0.09 1.51 0.93 1.05 -1.33 0.00 0.00 177.39 179.64 2ke5 h GLU 133 N 6.13 0.00 0.04 3.23 4.11 -1.85 -2.28 114.58 123.96 2ke5 h GLU 133 Ca 0.18 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.26 2ke5 h GLU 133 Cb 0.81 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.01 2ke5 h GLU 133 CO 0.97 0.00 -2.06 -0.85 0.07 0.00 0.00 179.01 177.15 2ke5 n GLU 134 N -2.94 0.68 -0.01 1.06 0.28 -1.26 -4.13 120.64 114.32 2ke5 n GLU 134 Ca 0.02 0.20 0.14 0.00 -0.16 0.00 0.00 57.16 57.36 2ke5 n GLU 134 Cb 0.35 -1.67 0.63 0.00 1.43 0.00 0.00 31.44 32.18 2ke5 n GLU 134 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2ke5 n ARG 135 N -3.15 1.48 -1.59 3.44 1.74 -1.20 -4.86 116.66 112.52 2ke5 n ARG 135 Ca -0.29 -0.70 -0.42 0.00 -0.77 0.00 0.00 57.85 55.67 2ke5 n ARG 135 Cb 1.06 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 31.00 2ke5 n ARG 135 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2ke5 n ARG 136 N -0.14 1.75 0.02 5.56 0.63 -0.86 -3.98 116.66 119.64 2ke5 n ARG 136 Ca 0.20 0.42 -0.05 0.00 -0.92 0.00 0.00 57.85 57.50 2ke5 n ARG 136 Cb 0.28 -3.27 -0.11 0.00 0.45 0.00 0.00 32.46 29.82 2ke5 n ARG 136 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 2ke5 h GLN 137 N 15.99 0.00 -4.69 -0.14 5.75 -1.31 -3.44 115.11 127.28 2ke5 h GLN 137 Ca -0.37 0.00 -0.69 0.00 -0.15 0.00 0.00 58.65 57.44 2ke5 h GLN 137 Cb 1.25 0.00 -0.32 0.00 1.07 0.00 0.00 27.48 29.47 2ke5 h GLN 137 CO 1.00 0.50 -0.65 0.08 -2.65 0.00 0.00 178.83 177.11 2ke5 s VAL 138 N -2.74 3.19 0.05 2.39 1.01 -1.11 -5.04 120.40 118.16 2ke5 s VAL 138 Ca -0.03 -1.49 -0.34 0.00 0.00 0.00 0.00 61.98 60.12 2ke5 s VAL 138 Cb 0.08 -2.91 -0.13 0.00 0.00 0.00 0.00 36.38 33.42 2ke5 s VAL 138 CO 0.81 -0.25 1.68 -0.81 0.00 0.00 0.00 175.10 176.54 2ke5 n PRO 139 N 4.65 2.07 -0.30 2.72 -0.04 -1.26 -4.83 135.00 138.00 2ke5 n PRO 139 Ca -0.11 0.75 0.13 0.00 -0.04 0.00 0.00 63.50 64.24 2ke5 n PRO 139 Cb 0.43 -2.54 0.31 0.00 -0.04 0.00 0.00 33.50 31.66 2ke5 n PRO 139 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2ke5 h VAL 140 N 4.32 0.44 -0.30 0.52 3.04 -1.98 0.26 116.25 122.55 2ke5 h VAL 140 Ca -0.46 -0.12 0.05 0.00 -1.01 0.00 0.00 66.70 65.15 2ke5 h VAL 140 Cb 1.27 0.05 -0.04 0.00 -2.01 0.00 0.00 31.29 30.56 2ke5 h VAL 140 CO 0.91 0.06 0.03 -0.33 -1.01 0.00 0.00 177.57 177.23 2ke5 h GLU 141 N 0.35 0.13 -0.34 4.17 5.08 -2.00 -0.87 114.58 121.09 2ke5 h GLU 141 Ca 0.56 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.85 2ke5 h GLU 141 Cb 1.08 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2ke5 h GLU 141 CO -0.56 0.08 -0.03 1.49 -1.00 0.00 0.00 179.01 179.00 2ke5 h GLU 142 N 0.13 0.54 0.00 2.33 4.81 -1.36 -2.10 114.58 118.93 2ke5 h GLU 142 Ca 0.14 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 2ke5 h GLU 142 Cb 0.18 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 2ke5 h GLU 142 CO -0.22 0.59 -0.29 0.00 -0.73 0.00 0.00 179.01 178.37 2ke5 h ALA 143 N 1.46 1.43 -0.00 2.92 0.00 -0.21 -2.90 119.26 121.95 2ke5 h ALA 143 Ca 0.11 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2ke5 h ALA 143 Cb 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2ke5 h ALA 143 CO 0.02 0.36 -0.23 0.00 0.00 0.00 0.00 179.25 179.39 2ke5 h ARG 144 N 0.00 0.16 -0.91 0.00 3.08 -0.54 -1.44 114.38 114.73 2ke5 h ARG 144 Ca -0.00 -0.17 0.15 0.00 0.07 0.00 0.00 59.98 60.02 2ke5 h ARG 144 Cb 0.54 0.05 -0.09 0.00 0.08 0.00 0.00 29.97 30.54 2ke5 h ARG 144 CO 0.04 0.91 0.52 1.03 -1.07 0.00 0.00 179.97 181.40 2ke5 h SER 145 N -0.52 0.68 0.01 7.04 0.87 -1.36 -0.95 113.55 119.33 2ke5 h SER 145 Ca -0.03 0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 2ke5 h SER 145 Cb 0.99 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.92 2ke5 h SER 145 CO 0.05 0.30 -0.28 0.50 -0.53 0.00 0.00 176.83 176.87 2ke5 h LYS 146 N 0.74 0.17 -0.71 2.24 3.11 -1.59 -3.22 116.57 117.32 2ke5 h LYS 146 Ca 0.49 -0.20 0.21 0.00 -2.81 0.00 0.00 60.65 58.34 2ke5 h LYS 146 Cb 0.65 0.06 -0.03 0.00 -1.00 0.00 0.00 32.23 31.92 2ke5 h LYS 146 CO -0.34 0.96 0.60 0.00 -2.81 0.00 0.00 179.45 177.87 2ke5 h ALA 147 N 0.21 2.56 -0.07 5.00 0.00 -0.70 0.57 119.26 126.83 2ke5 h ALA 147 Ca -0.04 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2ke5 h ALA 147 Cb 1.07 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2ke5 h ALA 147 CO 0.05 -0.97 -0.51 1.49 0.00 0.00 0.00 179.25 179.32 2ke5 h GLU 148 N 0.00 0.19 -0.66 0.00 4.81 -1.19 -2.95 114.58 114.78 2ke5 h GLU 148 Ca 0.34 -0.11 0.13 0.00 -0.13 0.00 0.00 59.36 59.59 2ke5 h GLU 148 Cb 1.53 0.01 -0.10 0.00 0.63 0.00 0.00 28.75 30.82 2ke5 h GLU 148 CO -0.00 0.66 0.13 0.93 -0.73 0.00 0.00 179.01 180.00 2ke5 h GLU 149 N 0.15 0.24 0.00 1.92 5.08 0.09 0.35 114.58 122.41 2ke5 h GLU 149 Ca 0.00 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2ke5 h GLU 149 Cb 0.95 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 2ke5 h GLU 149 CO 0.08 0.16 -0.16 -1.49 -1.00 0.00 0.00 179.01 176.60 2ke5 h TRP 150 N 0.25 0.00 0.00 4.33 6.55 -1.63 -3.46 115.95 121.99 2ke5 h TRP 150 Ca 0.36 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.20 2ke5 h TRP 150 Cb 0.57 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.87 2ke5 h TRP 150 CO -0.27 0.16 0.00 0.41 -1.05 0.00 0.00 178.44 177.69 2ke5 n GLY 151 N -0.46 1.36 3.66 1.49 0.00 0.12 -5.10 105.19 106.26 2ke5 n GLY 151 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2ke5 n GLY 151 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ke5 s VAL 152 N -2.00 0.95 -0.13 1.61 -7.23 -1.12 -5.02 120.40 107.45 2ke5 s VAL 152 Ca 0.00 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.19 2ke5 s VAL 152 Cb 0.00 -2.24 -0.00 0.00 0.56 0.00 0.00 36.38 34.70 2ke5 s VAL 152 CO 0.00 0.00 -0.18 0.00 -0.31 0.00 0.00 175.10 174.61 2ke5 s GLN 153 N -3.81 3.16 0.01 4.82 -2.07 -1.26 -3.33 119.66 117.18 2ke5 s GLN 153 Ca 0.13 -0.79 -0.12 0.00 -1.82 0.00 0.00 55.36 52.76 2ke5 s GLN 153 Cb 0.02 -2.51 -0.05 0.00 -1.09 0.00 0.00 33.01 29.38 2ke5 s GLN 153 CO 0.08 0.08 0.36 -0.47 -1.32 0.00 0.00 175.29 174.01 2ke5 s TYR 154 N 0.63 3.66 0.05 9.60 5.04 -1.26 -4.16 117.35 130.90 2ke5 s TYR 154 Ca -0.10 0.84 0.01 0.00 -2.44 0.00 0.00 57.07 55.38 2ke5 s TYR 154 Cb -0.16 -2.18 -0.03 0.00 0.35 0.00 0.00 41.96 39.94 2ke5 s TYR 154 CO 0.03 0.62 -0.06 0.08 -1.34 0.00 0.00 175.55 174.88 2ke5 s VAL 155 N -1.18 0.46 0.11 3.14 1.01 -1.22 -4.87 120.40 117.85 2ke5 s VAL 155 Ca 0.26 -1.38 -0.17 0.00 0.00 0.00 0.00 61.98 60.68 2ke5 s VAL 155 Cb -0.15 -0.96 -0.07 0.00 0.00 0.00 0.00 36.38 35.20 2ke5 s VAL 155 CO 0.14 -0.62 0.57 -1.61 0.00 0.00 0.00 175.10 173.57 2ke5 s GLU 156 N -2.50 4.10 0.13 2.72 2.02 -1.26 -1.49 118.70 122.42 2ke5 s GLU 156 Ca -0.03 0.63 -0.11 0.00 0.02 0.00 0.00 54.97 55.48 2ke5 s GLU 156 Cb -0.03 -3.08 0.01 0.00 0.10 0.00 0.00 34.13 31.13 2ke5 s GLU 156 CO -0.03 0.55 0.30 0.95 0.02 0.00 0.00 175.26 177.06 2ke5 s THR 157 N -1.29 0.09 -0.19 3.63 -4.23 0.13 -4.76 115.64 109.02 2ke5 s THR 157 Ca 0.34 -1.06 -0.02 0.00 -1.18 0.00 0.00 61.69 59.76 2ke5 s THR 157 Cb -0.17 -1.48 0.06 0.00 1.34 0.00 0.00 72.50 72.24 2ke5 s THR 157 CO 0.19 -0.41 0.01 -0.55 -0.54 0.00 0.00 174.62 173.32 2ke5 s SER 158 N -2.88 2.98 0.00 3.99 0.15 -1.26 -2.68 113.70 113.99 2ke5 s SER 158 Ca 0.09 -0.82 0.00 0.00 0.70 0.00 0.00 55.95 55.92 2ke5 s SER 158 Cb 0.03 -0.73 0.01 0.00 -1.71 0.00 0.00 66.02 63.62 2ke5 s SER 158 CO -0.07 -0.27 0.83 0.00 1.20 0.00 0.00 173.24 174.93 2ke5 n ALA 159 N 4.97 1.18 -0.08 5.45 0.00 -1.26 0.15 120.51 130.92 2ke5 n ALA 159 Ca -0.10 -0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.12 2ke5 n ALA 159 Cb 0.47 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 18.79 2ke5 n ALA 159 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2ke5 n LYS 160 N -1.33 0.66 0.00 0.00 3.00 -1.26 -4.35 118.16 114.88 2ke5 n LYS 160 Ca 0.00 0.29 0.12 0.00 -0.00 0.00 0.00 58.31 58.72 2ke5 n LYS 160 Cb 0.00 -1.63 0.22 0.00 0.00 0.00 0.00 35.03 33.62 2ke5 n LYS 160 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2ke5 n THR 161 N -3.74 0.00 -3.79 3.15 -2.24 -0.73 -4.70 114.28 102.23 2ke5 n THR 161 Ca -0.40 -0.07 -0.32 0.00 -2.27 0.00 0.00 64.05 61.00 2ke5 n THR 161 Cb 0.93 0.49 -0.06 0.00 -2.10 0.00 0.00 70.33 69.60 2ke5 n THR 161 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2ke5 n ARG 162 N -1.07 -0.90 0.08 -0.78 -4.01 0.12 -4.81 116.66 105.29 2ke5 n ARG 162 Ca 0.08 0.10 -0.10 0.00 -1.04 0.00 0.00 57.85 56.90 2ke5 n ARG 162 Cb 0.35 -3.74 -0.06 0.00 -3.04 0.00 0.00 32.46 25.97 2ke5 n ARG 162 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2ke5 h ALA 163 N 1.11 -0.29 -0.25 2.89 0.00 -1.93 -3.37 119.26 117.42 2ke5 h ALA 163 Ca -0.44 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2ke5 h ALA 163 Cb 1.08 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2ke5 h ALA 163 CO 0.66 -0.34 0.00 0.09 0.00 0.00 0.00 179.25 179.67 2ke5 n ASN 164 N -4.97 3.30 -0.23 0.00 4.13 -1.26 -4.63 115.26 111.61 2ke5 n ASN 164 Ca -0.07 -2.61 -0.08 0.00 1.68 0.00 0.00 54.58 53.50 2ke5 n ASN 164 Cb 0.24 -0.39 0.03 0.00 -1.54 0.00 0.00 39.78 38.12 2ke5 n ASN 164 CO 0.00 0.00 0.00 1.62 0.28 0.00 0.00 177.26 179.16 2ke5 h VAL 165 N 1.61 1.26 0.00 2.41 3.04 -1.88 -2.33 116.25 120.36 2ke5 h VAL 165 Ca 0.00 -1.01 0.00 0.00 -1.01 0.00 0.00 66.70 64.68 2ke5 h VAL 165 Cb 1.10 0.69 0.00 0.00 -2.01 0.00 0.00 31.29 31.07 2ke5 h VAL 165 CO 0.11 0.38 0.00 0.47 -1.01 0.00 0.00 177.57 177.52 2ke5 n ASP 166 N -4.27 0.69 -0.17 3.17 9.92 -1.26 -3.37 116.55 121.26 2ke5 n ASP 166 Ca 0.04 0.63 -0.08 0.00 -0.53 0.00 0.00 54.79 54.85 2ke5 n ASP 166 Cb 0.28 -0.79 0.01 0.00 -0.64 0.00 0.00 41.12 39.98 2ke5 n ASP 166 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2ke5 h LYS 167 N 0.00 0.72 -0.06 -1.24 3.64 -1.72 -1.91 116.57 116.01 2ke5 h LYS 167 Ca 0.00 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.14 2ke5 h LYS 167 Cb 0.47 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2ke5 h LYS 167 CO 0.00 0.60 -0.56 -0.39 -2.27 0.00 0.00 179.45 176.83 2ke5 h VAL 168 N 0.67 1.38 -0.08 2.00 -1.51 -1.66 -0.77 116.25 116.27 2ke5 h VAL 168 Ca 0.17 -1.91 -0.02 0.00 -1.23 0.00 0.00 66.70 63.72 2ke5 h VAL 168 Cb 0.11 1.97 -0.00 0.00 -2.13 0.00 0.00 31.29 31.24 2ke5 h VAL 168 CO -0.02 0.56 -0.04 -0.26 -1.23 0.00 0.00 177.57 176.58 2ke5 h PHE 169 N 0.13 0.19 -0.25 5.19 0.04 -1.63 -1.74 116.94 118.87 2ke5 h PHE 169 Ca -0.00 -0.05 -0.19 0.00 2.80 0.00 0.00 57.97 60.53 2ke5 h PHE 169 Cb 1.03 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.14 2ke5 h PHE 169 CO 0.01 0.53 -0.58 0.74 -0.60 0.00 0.00 178.31 178.42 2ke5 h PHE 170 N -0.20 1.06 0.10 -0.55 0.04 -1.36 -2.47 116.94 113.55 2ke5 h PHE 170 Ca 0.02 -0.40 -0.01 0.00 2.80 0.00 0.00 57.97 60.38 2ke5 h PHE 170 Cb 0.48 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.44 2ke5 h PHE 170 CO 0.07 1.22 -0.05 0.22 -0.60 0.00 0.00 178.31 179.17 2ke5 h ASP 171 N 0.59 -0.12 -0.93 2.17 1.82 -1.18 -2.37 116.42 116.41 2ke5 h ASP 171 Ca -0.00 -0.04 -0.00 0.00 -0.39 0.00 0.00 57.03 56.60 2ke5 h ASP 171 Cb 1.19 0.03 -0.05 0.00 0.68 0.00 0.00 39.33 41.19 2ke5 h ASP 171 CO 0.13 -0.03 0.58 0.25 -1.61 0.00 0.00 179.24 178.55 2ke5 h LEU 172 N -0.19 1.10 -1.18 2.28 5.85 -1.38 -2.08 115.31 119.71 2ke5 h LEU 172 Ca -0.01 -0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.73 2ke5 h LEU 172 Cb 0.15 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 2ke5 h LEU 172 CO 0.02 0.83 0.58 -0.03 -0.34 0.00 0.00 178.44 179.50 2ke5 h MET 173 N 1.27 0.92 -0.16 1.25 4.05 -1.19 -0.62 114.93 120.45 2ke5 h MET 173 Ca 0.33 -0.06 -0.13 0.00 -0.28 0.00 0.00 59.70 59.57 2ke5 h MET 173 Cb -0.08 -0.21 -0.01 0.00 -0.80 0.00 0.00 31.60 30.50 2ke5 h MET 173 CO -0.07 0.61 -0.45 0.00 0.23 0.00 0.00 176.91 177.23 2ke5 h ARG 174 N 0.95 0.40 -0.25 0.39 3.08 -0.86 -3.18 114.38 114.91 2ke5 h ARG 174 Ca 0.40 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 60.25 2ke5 h ARG 174 Cb 0.31 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 2ke5 h ARG 174 CO -0.16 0.78 0.13 0.93 -1.07 0.00 0.00 179.97 180.57 2ke5 h GLU 175 N 0.32 0.26 -0.45 0.04 4.39 -0.64 -0.94 114.58 117.56 2ke5 h GLU 175 Ca 0.02 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.78 2ke5 h GLU 175 Cb 0.93 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.49 2ke5 h GLU 175 CO 0.08 0.17 0.31 0.82 -1.16 0.00 0.00 179.01 179.23 2ke5 h ILE 176 N 0.27 0.94 0.18 3.13 2.04 -1.45 0.65 117.51 123.27 2ke5 h ILE 176 Ca 0.10 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2ke5 h ILE 176 Cb 0.02 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2ke5 h ILE 176 CO -0.06 0.06 -0.09 0.03 0.00 0.00 0.00 178.15 178.09 2ke5 h ARG 177 N 0.32 -0.23 0.00 2.37 3.08 -1.41 -3.18 114.38 115.33 2ke5 h ARG 177 Ca 0.20 0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 2ke5 h ARG 177 Cb 0.38 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 2ke5 h ARG 177 CO -0.05 0.04 -0.43 1.15 -1.07 0.00 0.00 179.97 179.61 2ke5 h THR 178 N -1.01 0.12 0.28 2.04 2.02 -1.02 -3.30 112.91 112.05 2ke5 h THR 178 Ca -0.02 -1.13 -0.00 0.00 0.77 0.00 0.00 66.41 66.02 2ke5 h THR 178 Cb 0.38 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2ke5 h THR 178 CO 0.04 0.04 -0.22 0.50 0.37 0.00 0.00 175.52 176.25 2ke5 h LYS 179 N -1.00 -0.49 0.52 6.66 3.64 -0.00 -1.22 116.57 124.68 2ke5 h LYS 179 Ca -0.03 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 2ke5 h LYS 179 Cb 0.46 0.11 0.01 0.00 -0.41 0.00 0.00 32.23 32.40 2ke5 h LYS 179 CO -0.02 -0.32 -0.25 -0.22 -2.27 0.00 0.00 179.45 176.37 2ke5 h LYS 180 N -0.51 -0.67 0.00 1.90 3.64 -0.86 -2.62 116.57 117.45 2ke5 h LYS 180 Ca -0.02 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2ke5 h LYS 180 Cb 0.44 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2ke5 h LYS 180 CO -0.01 -0.39 0.00 -1.33 -2.27 0.00 0.00 179.45 175.45 2ke5 n MET 181 N -5.33 0.09 0.10 1.90 2.81 -1.20 -2.67 117.12 112.82 2ke5 n MET 181 Ca -0.12 0.54 -0.08 0.00 -1.81 0.00 0.00 57.70 56.23 2ke5 n MET 181 Cb 0.32 -1.76 -0.05 0.00 -0.71 0.00 0.00 33.22 31.02 2ke5 n MET 181 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2ke5 h SER 182 N 0.00 -0.30 -5.05 7.83 0.87 -0.83 -3.50 113.55 112.57 2ke5 h SER 182 Ca 0.00 -0.12 0.01 0.00 -1.23 0.00 0.00 61.79 60.45 2ke5 h SER 182 Cb 0.06 0.08 -0.11 0.00 -0.44 0.00 0.00 62.40 61.99 2ke5 h SER 182 CO 0.00 0.19 -1.48 -0.62 -0.53 0.00 0.00 176.83 174.39 2ke5 n GLU 183 N -5.01 -4.38 -2.51 2.24 1.02 -1.09 -4.93 120.64 105.97 2ke5 n GLU 183 Ca -0.06 3.33 -0.40 0.00 -0.02 0.00 0.00 57.16 60.01 2ke5 n GLU 183 Cb 0.20 -5.12 -0.04 0.00 -0.02 0.00 0.00 31.44 26.46 2ke5 n GLU 183 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2ke5 s ASN 184 N -0.87 7.31 0.00 1.62 -0.87 -1.26 -5.07 114.94 115.80 2ke5 s ASN 184 Ca -0.23 2.22 0.13 0.00 -1.57 0.00 0.00 52.86 53.41 2ke5 s ASN 184 Cb 0.02 -2.62 0.76 0.00 -0.02 0.00 0.00 41.25 39.38 2ke5 s ASN 184 CO 0.79 -0.11 1.19 0.29 -2.57 0.00 0.00 177.10 176.68