#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 4.32 -0.29 -1.18 0.00 -1.26 -4.96 121.76 118.38 2ke5 s ALA 13 Ca 0.00 -1.52 -0.03 0.00 0.00 0.00 0.00 51.96 50.41 2ke5 s ALA 13 Cb 0.00 -1.69 0.10 0.00 0.00 0.00 0.00 23.12 21.53 2ke5 s ALA 13 CO 0.00 -0.17 0.11 -1.17 0.00 0.00 0.00 175.76 174.54 2ke5 s LEU 14 N -4.28 1.21 -0.18 0.00 1.98 -1.26 -1.35 118.68 114.80 2ke5 s LEU 14 Ca 0.49 -1.40 -0.05 0.00 -2.89 0.00 0.00 54.13 50.27 2ke5 s LEU 14 Cb -0.10 -0.55 -0.03 0.00 0.66 0.00 0.00 46.19 46.17 2ke5 s LEU 14 CO 0.32 -0.43 0.01 -1.00 -1.89 0.00 0.00 176.35 173.37 2ke5 s HIS 15 N 1.91 3.11 -0.13 5.38 3.76 -1.09 -5.03 115.29 123.20 2ke5 s HIS 15 Ca 0.09 -0.21 -0.07 0.00 -0.15 0.00 0.00 55.06 54.72 2ke5 s HIS 15 Cb -0.16 -2.04 -0.04 0.00 1.11 0.00 0.00 32.58 31.44 2ke5 s HIS 15 CO -0.31 -0.03 0.13 0.15 -0.85 0.00 0.00 174.74 173.82 2ke5 s LYS 16 N 0.58 3.55 -0.01 1.40 1.02 -1.26 -2.32 119.74 122.70 2ke5 s LYS 16 Ca 0.00 -0.16 0.06 0.00 0.02 0.00 0.00 55.97 55.90 2ke5 s LYS 16 Cb -0.14 -3.21 -0.02 0.00 -0.52 0.00 0.00 37.83 33.94 2ke5 s LYS 16 CO 0.02 0.69 -0.21 0.54 -0.92 0.00 0.00 175.35 175.48 2ke5 s VAL 17 N -0.78 1.62 -0.17 3.17 0.11 -0.49 0.08 120.40 123.94 2ke5 s VAL 17 Ca 0.14 -0.89 -0.05 0.00 -2.93 0.00 0.00 61.98 58.24 2ke5 s VAL 17 Cb -0.12 -1.35 -0.03 0.00 -1.53 0.00 0.00 36.38 33.35 2ke5 s VAL 17 CO 0.03 0.45 0.01 -0.63 -3.33 0.00 0.00 175.10 171.63 2ke5 s ILE 18 N -0.50 4.31 -0.61 7.04 -1.09 -0.63 -3.73 121.20 125.99 2ke5 s ILE 18 Ca 0.08 -0.21 -0.27 0.00 -2.23 0.00 0.00 60.65 58.03 2ke5 s ILE 18 Cb -0.08 -2.92 0.04 0.00 -1.58 0.00 0.00 42.46 37.92 2ke5 s ILE 18 CO -0.01 0.48 1.13 -0.32 -1.23 0.00 0.00 174.94 174.99 2ke5 s MET 19 N 0.39 3.38 0.44 2.79 1.75 -1.23 -2.18 119.30 124.64 2ke5 s MET 19 Ca -0.01 -0.03 -0.00 0.00 -1.25 0.00 0.00 55.69 54.40 2ke5 s MET 19 Cb -0.13 -4.07 -0.01 0.00 2.84 0.00 0.00 34.83 33.46 2ke5 s MET 19 CO 0.02 -1.73 0.67 0.08 -0.65 0.00 0.00 175.02 173.40 2ke5 s VAL 20 N 4.81 4.16 0.00 10.11 1.01 -0.16 -4.58 120.40 135.75 2ke5 s VAL 20 Ca 0.37 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.90 2ke5 s VAL 20 Cb -0.09 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.75 2ke5 s VAL 20 CO 0.21 -0.39 0.00 0.61 0.00 0.00 0.00 175.10 175.53 2ke5 n GLY 21 N -2.07 1.40 0.26 4.51 0.00 -1.26 -2.87 105.19 105.17 2ke5 n GLY 21 Ca 0.01 -0.83 0.05 0.00 0.00 0.00 0.00 46.02 45.25 2ke5 n GLY 21 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2ke5 h SER 22 N 0.00 0.00 0.00 1.61 0.87 -1.76 -3.43 113.55 110.84 2ke5 h SER 22 Ca 0.00 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2ke5 h SER 22 Cb 0.00 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 2ke5 h SER 22 CO 0.00 -0.03 0.00 0.61 -0.53 0.00 0.00 176.83 176.88 2ke5 n GLY 23 N -1.35 -0.36 0.43 5.77 0.00 -1.26 -4.71 105.19 103.72 2ke5 n GLY 23 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.94 0.00 -0.02 0.00 -1.26 -4.18 105.19 100.66 2ke5 n GLY 24 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 1.61 0.31 -1.26 -4.99 118.33 114.00 2ke5 n VAL 25 Ca 0.00 0.76 0.00 0.00 -0.01 0.00 0.00 64.34 65.09 2ke5 n VAL 25 Cb 0.51 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 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 1.08 0.00 0.23 2.92 0.00 -1.26 -4.96 105.19 103.20 2ke5 n GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ke5 n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ke5 h LYS 27 N 0.00 0.12 0.00 1.61 1.57 -1.93 0.15 116.57 118.09 2ke5 h LYS 27 Ca 0.00 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 2ke5 h LYS 27 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 2ke5 h LYS 27 CO 0.00 0.08 -0.19 0.66 -0.57 0.00 0.00 179.45 179.42 2ke5 h SER 28 N 0.12 0.00 0.26 0.86 4.64 -1.96 -2.52 113.55 114.96 2ke5 h SER 28 Ca 0.31 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.62 2ke5 h SER 28 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2ke5 h SER 28 CO -0.51 0.19 -0.13 0.00 -0.87 0.00 0.00 176.83 175.51 2ke5 h ALA 29 N 1.81 -0.36 0.00 5.18 0.00 -1.10 0.31 119.26 125.09 2ke5 h ALA 29 Ca -0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2ke5 h ALA 29 Cb 0.34 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2ke5 h ALA 29 CO 0.03 -0.71 -0.10 -0.07 0.00 0.00 0.00 179.25 178.40 2ke5 h LEU 30 N -0.37 0.00 -0.25 0.00 -0.00 -1.36 -2.23 115.31 111.11 2ke5 h LEU 30 Ca -0.03 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 57.68 2ke5 h LEU 30 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.95 2ke5 h LEU 30 CO 0.05 0.10 -0.49 0.74 -0.00 0.00 0.00 178.44 178.85 2ke5 h THR 31 N 0.00 1.29 -0.17 0.22 2.02 -0.66 -2.89 112.91 112.72 2ke5 h THR 31 Ca -0.00 -1.69 -0.10 0.00 0.77 0.00 0.00 66.41 65.40 2ke5 h THR 31 Cb 0.28 1.73 -0.00 0.00 -1.74 0.00 0.00 68.15 68.42 2ke5 h THR 31 CO 0.01 0.54 -0.27 -0.07 0.37 0.00 0.00 175.52 176.10 2ke5 h LEU 32 N 0.52 0.54 -1.08 2.58 3.38 0.06 -2.86 115.31 118.44 2ke5 h LEU 32 Ca 0.01 -0.53 0.05 0.00 0.09 0.00 0.00 57.88 57.51 2ke5 h LEU 32 Cb 1.09 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 2ke5 h LEU 32 CO 0.11 0.96 0.62 1.56 0.09 0.00 0.00 178.44 181.78 2ke5 h GLN 33 N 0.13 1.10 0.00 1.13 1.08 -1.49 -0.63 115.11 116.44 2ke5 h GLN 33 Ca 0.01 -0.07 -0.07 0.00 -1.45 0.00 0.00 58.65 57.08 2ke5 h GLN 33 Cb 0.85 -0.25 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 2ke5 h GLN 33 CO 0.06 0.73 -0.34 0.35 -0.95 0.00 0.00 178.83 178.68 2ke5 h PHE 34 N 1.14 0.00 0.00 2.96 3.57 -1.51 0.43 116.94 123.52 2ke5 h PHE 34 Ca 0.40 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.85 2ke5 h PHE 34 Cb 0.12 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 2ke5 h PHE 34 CO -0.00 0.34 -0.29 1.98 -2.23 0.00 0.00 178.31 178.11 2ke5 h MET 35 N 0.00 0.00 -0.00 1.11 4.05 -0.98 -3.40 114.93 115.71 2ke5 h MET 35 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2ke5 h MET 35 Cb 0.88 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.68 2ke5 h MET 35 CO 0.04 0.98 -0.57 0.66 0.23 0.00 0.00 176.91 178.25 2ke5 n TYR 36 N -4.57 0.00 -2.67 1.39 4.01 -0.37 -4.99 117.16 109.96 2ke5 n TYR 36 Ca -0.15 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.38 2ke5 n TYR 36 Cb 0.52 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.56 2ke5 n TYR 36 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2ke5 n ASP 37 N -1.27 -5.85 -3.78 7.72 2.03 0.15 -4.97 116.55 110.57 2ke5 n ASP 37 Ca 0.02 -0.14 -0.11 0.00 0.52 0.00 0.00 54.79 55.08 2ke5 n ASP 37 Cb 0.19 -4.78 -0.08 0.00 -0.72 0.00 0.00 41.12 35.73 2ke5 n ASP 37 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2ke5 s GLU 38 N -5.31 0.78 -0.47 -0.67 2.56 -1.26 -5.04 118.70 109.29 2ke5 s GLU 38 Ca 0.14 -0.54 -0.20 0.00 0.00 0.00 0.00 54.97 54.37 2ke5 s GLU 38 Cb -0.06 0.34 0.04 0.00 2.00 0.00 0.00 34.13 36.44 2ke5 s GLU 38 CO 0.17 -0.25 0.66 0.12 -0.56 0.00 0.00 175.26 175.40 2ke5 s PHE 39 N -2.57 3.04 0.01 5.30 5.36 -1.26 -4.37 117.98 123.48 2ke5 s PHE 39 Ca -0.05 -0.21 0.03 0.00 -0.96 0.00 0.00 56.93 55.74 2ke5 s PHE 39 Cb -0.01 -3.45 -0.01 0.00 -0.34 0.00 0.00 43.02 39.21 2ke5 s PHE 39 CO -0.04 -0.96 -0.08 0.08 -1.46 0.00 0.00 175.22 172.76 2ke5 s VAL 40 N 2.84 0.63 -0.62 3.12 1.01 -1.26 -5.11 120.40 121.01 2ke5 s VAL 40 Ca 0.21 -0.56 -0.23 0.00 0.00 0.00 0.00 61.98 61.40 2ke5 s VAL 40 Cb -0.16 -0.57 0.06 0.00 0.00 0.00 0.00 36.38 35.71 2ke5 s VAL 40 CO 0.17 0.02 0.95 -1.61 0.00 0.00 0.00 175.10 174.63 2ke5 s GLU 41 N -0.59 3.18 -0.29 2.72 2.02 -1.26 -4.96 118.70 119.52 2ke5 s GLU 41 Ca -0.00 -0.65 -0.17 0.00 0.02 0.00 0.00 54.97 54.17 2ke5 s GLU 41 Cb -0.05 -4.17 0.13 0.00 0.10 0.00 0.00 34.13 30.14 2ke5 s GLU 41 CO 0.00 -1.70 0.91 0.34 0.02 0.00 0.00 175.26 174.83 2ke5 s ASP 42 N 3.39 -0.61 -0.01 -0.19 2.15 -1.26 -5.17 116.67 114.97 2ke5 s ASP 42 Ca 0.25 0.98 -0.01 0.00 0.43 0.00 0.00 52.55 54.20 2ke5 s ASP 42 Cb -0.15 1.23 0.01 0.00 -0.30 0.00 0.00 42.92 43.70 2ke5 s ASP 42 CO 0.13 -0.16 0.02 -0.72 -0.17 0.00 0.00 175.17 174.28 2ke5 s TYR 43 N 1.32 -0.01 -0.03 -5.34 1.13 -1.26 -5.07 117.35 108.10 2ke5 s TYR 43 Ca -0.08 0.08 0.06 0.00 -1.41 0.00 0.00 57.07 55.72 2ke5 s TYR 43 Cb -0.04 -0.05 -0.01 0.00 -1.10 0.00 0.00 41.96 40.75 2ke5 s TYR 43 CO -0.15 -0.03 -0.22 -1.21 -2.51 0.00 0.00 175.55 171.43 2ke5 s GLU 44 N 0.29 1.90 0.75 -3.49 0.41 -1.26 -5.13 118.70 112.17 2ke5 s GLU 44 Ca -0.02 -0.78 -0.15 0.00 -0.41 0.00 0.00 54.97 53.60 2ke5 s GLU 44 Cb -0.03 -1.77 0.04 0.00 -1.78 0.00 0.00 34.13 30.58 2ke5 s GLU 44 CO -0.01 0.43 1.15 -2.30 -0.49 0.00 0.00 175.26 174.05 2ke5 n PRO 45 N 2.68 0.50 -2.65 0.39 -0.02 -1.26 -4.92 135.00 129.72 2ke5 n PRO 45 Ca -0.16 0.24 -0.42 0.00 -2.02 0.00 0.00 63.50 61.14 2ke5 n PRO 45 Cb 0.52 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 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 -1.85 4.07 -0.50 3.45 2.01 -1.26 -4.88 115.64 116.68 2ke5 s THR 46 Ca 0.76 0.59 0.03 0.00 0.31 0.00 0.00 61.69 63.37 2ke5 s THR 46 Cb -0.33 -4.71 0.44 0.00 0.01 0.00 0.00 72.50 67.91 2ke5 s THR 46 CO 0.48 -1.39 1.55 0.29 -0.69 0.00 0.00 174.62 174.87 2ke5 n LYS 47 N 8.33 3.19 -1.10 4.92 4.76 -1.26 -4.86 118.16 132.14 2ke5 n LYS 47 Ca 0.05 -3.85 -0.03 0.00 -2.87 0.00 0.00 58.31 51.61 2ke5 n LYS 47 Cb 0.48 -2.28 -0.01 0.00 -1.84 0.00 0.00 35.03 31.38 2ke5 n LYS 47 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ke5 n ALA 48 N -0.73 -0.05 -2.68 7.82 0.00 -1.26 -4.95 120.51 118.66 2ke5 n ALA 48 Ca 0.51 0.05 -0.38 0.00 0.00 0.00 0.00 53.44 53.62 2ke5 n ALA 48 Cb 0.75 -1.33 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 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 -2.16 6.44 0.25 0.00 1.01 -1.26 -5.08 116.67 115.86 2ke5 s ASP 49 Ca 0.00 0.51 0.09 0.00 0.71 0.00 0.00 52.55 53.86 2ke5 s ASP 49 Cb 0.00 -2.22 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 2ke5 s ASP 49 CO 0.00 -0.05 0.02 -0.94 0.21 0.00 0.00 175.17 174.41 2ke5 s SER 50 N 0.97 4.70 0.34 0.27 1.04 -1.26 -4.90 113.70 114.85 2ke5 s SER 50 Ca 0.19 -0.55 0.01 0.00 0.48 0.00 0.00 55.95 56.08 2ke5 s SER 50 Cb -0.15 -0.94 -0.03 0.00 0.10 0.00 0.00 66.02 65.01 2ke5 s SER 50 CO 0.08 0.01 0.53 -0.31 0.98 0.00 0.00 173.24 174.53 2ke5 s TYR 51 N -2.18 3.46 -0.09 5.02 2.02 -1.02 -4.96 117.35 119.59 2ke5 s TYR 51 Ca 0.31 0.26 -0.04 0.00 -0.37 0.00 0.00 57.07 57.23 2ke5 s TYR 51 Cb -0.07 -1.88 0.04 0.00 -0.40 0.00 0.00 41.96 39.65 2ke5 s TYR 51 CO 0.20 0.13 0.21 1.03 -1.57 0.00 0.00 175.55 175.55 2ke5 s ARG 52 N -4.28 0.17 0.03 -0.62 0.52 -1.25 -3.22 118.95 110.29 2ke5 s ARG 52 Ca 0.40 0.47 0.01 0.00 -0.52 0.00 0.00 55.73 56.08 2ke5 s ARG 52 Cb -0.10 -0.13 -0.02 0.00 0.52 0.00 0.00 34.95 35.22 2ke5 s ARG 52 CO 0.35 -0.16 -0.05 0.21 0.02 0.00 0.00 175.30 175.68 2ke5 s LYS 53 N 1.18 0.38 -0.16 3.54 2.20 -1.00 -4.95 119.74 120.94 2ke5 s LYS 53 Ca -0.09 -0.67 -0.06 0.00 -0.36 0.00 0.00 55.97 54.80 2ke5 s LYS 53 Cb -0.10 -0.02 -0.04 0.00 -1.51 0.00 0.00 37.83 36.16 2ke5 s LYS 53 CO -0.07 -0.02 0.04 0.15 -0.36 0.00 0.00 175.35 175.09 2ke5 s LYS 54 N -1.53 3.76 -0.10 4.03 1.02 -1.26 -1.17 119.74 124.48 2ke5 s LYS 54 Ca -0.14 -0.37 -0.09 0.00 0.02 0.00 0.00 55.97 55.40 2ke5 s LYS 54 Cb -0.10 -3.10 0.03 0.00 -0.52 0.00 0.00 37.83 34.14 2ke5 s LYS 54 CO -0.01 0.36 0.27 0.14 -0.92 0.00 0.00 175.35 175.19 2ke5 s VAL 55 N 0.10 -0.01 0.11 3.17 -7.23 -0.86 -5.01 120.40 110.68 2ke5 s VAL 55 Ca 0.04 0.02 -0.28 0.00 -1.81 0.00 0.00 61.98 59.95 2ke5 s VAL 55 Cb -0.12 -0.38 -0.06 0.00 0.56 0.00 0.00 36.38 36.37 2ke5 s VAL 55 CO 0.01 0.01 0.90 0.54 -0.31 0.00 0.00 175.10 176.25 2ke5 s VAL 56 N 0.34 4.51 -0.22 1.32 0.11 -1.26 -1.51 120.40 123.69 2ke5 s VAL 56 Ca -0.02 1.94 -0.02 0.00 -2.93 0.00 0.00 61.98 60.95 2ke5 s VAL 56 Cb -0.03 -4.26 0.07 0.00 -1.53 0.00 0.00 36.38 30.62 2ke5 s VAL 56 CO -0.01 0.36 0.04 -0.76 -3.33 0.00 0.00 175.10 171.39 2ke5 s LEU 57 N -0.20 1.47 -1.30 2.54 1.43 0.02 -4.81 118.68 117.83 2ke5 s LEU 57 Ca 0.43 -1.00 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 2ke5 s LEU 57 Cb -0.23 -0.69 0.01 0.00 0.03 0.00 0.00 46.19 45.30 2ke5 s LEU 57 CO 0.28 -0.32 0.07 -0.67 0.23 0.00 0.00 176.35 175.95 2ke5 n ASP 58 N 4.98 -4.58 0.00 2.29 2.03 -1.26 -0.91 116.55 119.11 2ke5 n ASP 58 Ca -0.08 0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.29 2ke5 n ASP 58 Cb 0.46 -3.84 0.00 0.00 -0.72 0.00 0.00 41.12 37.02 2ke5 n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ke5 n GLY 59 N -0.93 2.81 3.56 0.27 0.00 -1.26 -5.03 105.19 104.60 2ke5 n GLY 59 Ca -0.16 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 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 3.61 -0.26 1.61 2.56 -0.09 -5.02 118.70 121.11 2ke5 s GLU 60 Ca 0.00 0.03 -0.25 0.00 0.00 0.00 0.00 54.97 54.74 2ke5 s GLU 60 Cb 0.00 -3.84 0.00 0.00 2.00 0.00 0.00 34.13 32.29 2ke5 s GLU 60 CO 0.00 -0.83 0.88 -2.00 -0.56 0.00 0.00 175.26 172.75 2ke5 s GLU 61 N 2.84 4.13 0.46 4.30 2.12 -1.26 -0.80 118.70 130.50 2ke5 s GLU 61 Ca 0.26 0.94 0.05 0.00 0.36 0.00 0.00 54.97 56.58 2ke5 s GLU 61 Cb -0.14 -3.67 -0.03 0.00 0.26 0.00 0.00 34.13 30.54 2ke5 s GLU 61 CO 0.16 -0.61 0.12 0.14 -0.54 0.00 0.00 175.26 174.53 2ke5 s VAL 62 N 3.01 1.77 -0.03 3.70 -7.23 -0.57 -4.25 120.40 116.82 2ke5 s VAL 62 Ca 0.37 -1.83 0.02 0.00 -1.81 0.00 0.00 61.98 58.72 2ke5 s VAL 62 Cb -0.15 -2.61 -0.03 0.00 0.56 0.00 0.00 36.38 34.15 2ke5 s VAL 62 CO 0.09 0.00 -0.04 -1.10 -0.31 0.00 0.00 175.10 173.74 2ke5 s GLN 63 N -3.91 2.71 -0.14 4.82 -0.21 -0.46 -2.02 119.66 120.46 2ke5 s GLN 63 Ca 0.27 -0.61 -0.00 0.00 0.02 0.00 0.00 55.36 55.04 2ke5 s GLN 63 Cb 0.04 -2.60 -0.01 0.00 1.00 0.00 0.00 33.01 31.44 2ke5 s GLN 63 CO 0.15 0.64 -0.13 -1.50 -2.12 0.00 0.00 175.29 172.32 2ke5 s ILE 64 N -0.96 2.94 -0.24 1.08 2.07 -0.32 -2.67 121.20 123.10 2ke5 s ILE 64 Ca 0.16 -0.69 -0.03 0.00 -1.41 0.00 0.00 60.65 58.68 2ke5 s ILE 64 Cb -0.11 -2.24 0.01 0.00 0.13 0.00 0.00 42.46 40.25 2ke5 s ILE 64 CO 0.06 0.52 -0.04 -0.62 -1.91 0.00 0.00 174.94 172.94 2ke5 s ASP 65 N 0.56 4.37 -0.06 4.50 -1.08 -0.98 -2.37 116.67 121.61 2ke5 s ASP 65 Ca -0.08 -0.67 0.03 0.00 -0.52 0.00 0.00 52.55 51.31 2ke5 s ASP 65 Cb -0.16 -1.71 -0.02 0.00 -1.46 0.00 0.00 42.92 39.57 2ke5 s ASP 65 CO 0.04 -0.09 -0.15 -0.63 0.52 0.00 0.00 175.17 174.86 2ke5 s ILE 66 N 1.40 3.01 -0.03 4.11 1.01 -1.20 -1.40 121.20 128.11 2ke5 s ILE 66 Ca 0.03 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 59.94 2ke5 s ILE 66 Cb -0.16 -2.18 0.03 0.00 0.01 0.00 0.00 42.46 40.16 2ke5 s ILE 66 CO -0.03 0.58 0.00 -0.22 0.00 0.00 0.00 174.94 175.27 2ke5 s LEU 67 N -0.61 1.21 -0.32 2.97 2.96 -1.24 -2.42 118.68 121.22 2ke5 s LEU 67 Ca 0.09 -0.02 -0.16 0.00 -0.22 0.00 0.00 54.13 53.82 2ke5 s LEU 67 Cb -0.11 -0.19 -0.02 0.00 0.50 0.00 0.00 46.19 46.37 2ke5 s LEU 67 CO 0.01 -0.10 0.40 -0.62 -1.32 0.00 0.00 176.35 174.72 2ke5 s ASP 68 N 0.95 6.23 0.41 3.68 2.15 -1.26 -3.57 116.67 125.26 2ke5 s ASP 68 Ca -0.09 -0.05 0.23 0.00 0.43 0.00 0.00 52.55 53.07 2ke5 s ASP 68 Cb -0.13 -2.22 0.30 0.00 -0.30 0.00 0.00 42.92 40.58 2ke5 s ASP 68 CO -0.02 -0.33 1.55 0.71 -0.17 0.00 0.00 175.17 176.91 2ke5 h THR 69 N 5.52 0.03 -2.30 1.71 1.35 -2.00 -3.44 112.91 113.77 2ke5 h THR 69 Ca -0.30 -1.04 0.15 0.00 -0.55 0.00 0.00 66.41 64.67 2ke5 h THR 69 Cb 1.14 1.97 -0.04 0.00 -1.73 0.00 0.00 68.15 69.49 2ke5 h THR 69 CO 0.70 0.01 -0.20 0.00 -0.25 0.00 0.00 175.52 175.78 2ke5 n ALA 70 N -2.11 -1.50 -2.56 6.62 0.00 -1.26 -4.43 120.51 115.27 2ke5 n ALA 70 Ca 0.04 0.17 -0.42 0.00 0.00 0.00 0.00 53.44 53.23 2ke5 n ALA 70 Cb 0.54 -0.51 -0.03 0.00 0.00 0.00 0.00 19.45 19.45 2ke5 n ALA 70 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ke5 s GLY 71 N -5.97 1.06 0.00 0.00 0.00 -1.26 -4.84 107.32 96.31 2ke5 s GLY 71 Ca 0.00 -0.94 0.20 0.00 0.00 0.00 0.00 44.72 43.97 2ke5 s GLY 71 CO 0.00 2.56 1.56 1.04 0.00 0.00 0.00 173.10 178.26 2ke5 n LEU 72 N 8.73 0.00 0.00 0.66 4.77 -1.26 -4.90 117.00 125.00 2ke5 n LEU 72 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2ke5 n LEU 72 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2ke5 n LEU 72 CO 0.71 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.98 2ke5 n GLU 73 N -0.97 0.00 -3.69 3.23 2.13 -1.26 -4.42 120.64 115.65 2ke5 n GLU 73 Ca 0.15 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.86 2ke5 n GLU 73 Cb 0.07 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.67 2ke5 n GLU 73 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2ke5 s ASP 74 N -4.00 -0.48 0.21 4.31 1.01 -1.26 -5.16 116.67 111.29 2ke5 s ASP 74 Ca 0.00 0.88 -0.04 0.00 0.71 0.00 0.00 52.55 54.10 2ke5 s ASP 74 Cb 0.00 0.78 0.02 0.00 1.01 0.00 0.00 42.92 44.73 2ke5 s ASP 74 CO 0.00 -0.19 0.34 -1.22 0.21 0.00 0.00 175.17 174.30 2ke5 n TYR 75 N 4.34 -1.29 0.02 4.23 4.01 -1.26 -5.09 117.16 122.12 2ke5 n TYR 75 Ca -0.22 -1.22 -0.10 0.00 -0.16 0.00 0.00 57.90 56.20 2ke5 n TYR 75 Cb 0.55 0.39 -0.08 0.00 -0.31 0.00 0.00 39.34 39.89 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 1.86 -0.16 0.00 -0.72 0.00 -2.02 -3.46 119.26 114.77 2ke5 h ALA 76 Ca -0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2ke5 h ALA 76 Cb 0.67 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2ke5 h ALA 76 CO 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 179.25 179.23 2ke5 n ALA 77 N -2.60 0.51 0.29 0.00 0.00 -1.26 -4.97 120.51 112.48 2ke5 n ALA 77 Ca -0.07 -0.05 0.17 0.00 0.00 0.00 0.00 53.44 53.48 2ke5 n ALA 77 Cb 0.26 -0.07 0.90 0.00 0.00 0.00 0.00 19.45 20.55 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 1.57 0.00 -0.16 0.00 2.04 -2.00 -1.93 117.51 117.04 2ke5 h ILE 78 Ca -0.05 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2ke5 h ILE 78 Cb 0.43 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 2ke5 h ILE 78 CO -0.02 0.00 0.07 0.03 0.00 0.00 0.00 178.15 178.23 2ke5 h ARG 79 N 0.00 0.16 -0.73 2.37 3.08 -1.96 -2.26 114.38 115.04 2ke5 h ARG 79 Ca 0.00 -0.01 0.13 0.00 0.07 0.00 0.00 59.98 60.17 2ke5 h ARG 79 Cb 0.28 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 2ke5 h ARG 79 CO 0.00 0.10 0.48 0.22 -1.07 0.00 0.00 179.97 179.71 2ke5 h ASP 80 N 0.16 0.43 -0.55 7.04 1.82 -1.71 -0.76 116.42 122.85 2ke5 h ASP 80 Ca 0.06 0.02 0.04 0.00 -0.39 0.00 0.00 57.03 56.76 2ke5 h ASP 80 Cb 0.01 -0.07 -0.03 0.00 0.68 0.00 0.00 39.33 39.92 2ke5 h ASP 80 CO -0.04 0.23 0.37 -1.13 -1.61 0.00 0.00 179.24 177.05 2ke5 h ASN 81 N 0.46 0.51 0.49 2.28 -0.73 -1.52 -0.74 115.58 116.33 2ke5 h ASN 81 Ca 0.35 -0.00 -0.20 0.00 1.87 0.00 0.00 56.30 58.32 2ke5 h ASN 81 Cb 0.72 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.19 2ke5 h ASN 81 CO -0.11 0.35 -0.86 1.88 -0.37 0.00 0.00 177.43 178.32 2ke5 h TYR 82 N 0.59 0.37 0.00 0.67 0.05 -1.14 -3.18 116.97 114.33 2ke5 h TYR 82 Ca 0.23 -0.20 0.00 0.00 0.05 0.00 0.00 58.73 58.81 2ke5 h TYR 82 Cb 0.17 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.86 2ke5 h TYR 82 CO -0.00 1.00 0.00 0.74 -1.05 0.00 0.00 178.16 178.84 2ke5 h PHE 83 N 0.15 0.00 -0.00 4.88 0.04 -1.24 -3.09 116.94 117.67 2ke5 h PHE 83 Ca -0.05 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.72 2ke5 h PHE 83 Cb 1.47 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.62 2ke5 h PHE 83 CO 0.04 0.00 -0.09 -2.13 -0.60 0.00 0.00 178.31 175.53 2ke5 n ARG 84 N -3.04 0.62 0.00 1.51 0.63 -0.36 -3.24 116.66 112.79 2ke5 n ARG 84 Ca 0.04 -0.17 0.08 0.00 -0.92 0.00 0.00 57.85 56.88 2ke5 n ARG 84 Cb 0.51 -1.50 0.05 0.00 0.45 0.00 0.00 32.46 31.97 2ke5 n ARG 84 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2ke5 n SER 85 N -1.04 2.16 -4.51 6.15 7.64 -1.17 -4.98 113.62 117.87 2ke5 n SER 85 Ca 0.14 -1.58 -0.25 0.00 1.01 0.00 0.00 58.87 58.19 2ke5 n SER 85 Cb 0.27 0.17 -0.10 0.00 -1.01 0.00 0.00 64.21 63.53 2ke5 n SER 85 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2ke5 s GLY 86 N -1.61 1.76 0.00 0.23 0.00 -1.20 -4.96 107.32 101.54 2ke5 s GLY 86 Ca 0.18 -1.69 0.16 0.00 0.00 0.00 0.00 44.72 43.37 2ke5 s GLY 86 CO 0.29 -1.74 0.74 1.18 0.00 0.00 0.00 173.10 173.56 2ke5 n GLU 87 N -0.26 1.66 -4.24 2.90 1.02 -0.77 -4.99 120.64 115.95 2ke5 n GLU 87 Ca -0.09 -0.21 -0.14 0.00 -0.02 0.00 0.00 57.16 56.70 2ke5 n GLU 87 Cb 0.58 -1.27 -0.10 0.00 -0.02 0.00 0.00 31.44 30.62 2ke5 n GLU 87 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2ke5 s GLY 88 N -2.39 1.02 -0.02 0.62 0.00 0.11 -4.65 107.32 102.02 2ke5 s GLY 88 Ca 0.08 -1.45 0.01 0.00 0.00 0.00 0.00 44.72 43.36 2ke5 s GLY 88 CO 0.60 -1.55 -0.03 -1.36 0.00 0.00 0.00 173.10 170.77 2ke5 s PHE 89 N -3.24 0.44 -0.20 1.90 0.08 0.01 -1.61 117.98 115.35 2ke5 s PHE 89 Ca 0.15 -0.07 -0.02 0.00 0.12 0.00 0.00 56.93 57.10 2ke5 s PHE 89 Cb 0.02 -0.40 0.06 0.00 -0.57 0.00 0.00 43.02 42.13 2ke5 s PHE 89 CO 0.00 -0.09 0.03 -1.17 -0.10 0.00 0.00 175.22 173.89 2ke5 s LEU 90 N 0.56 1.36 0.01 -0.37 0.20 -0.93 -3.04 118.68 116.48 2ke5 s LEU 90 Ca -0.06 -0.90 -0.26 0.00 0.69 0.00 0.00 54.13 53.60 2ke5 s LEU 90 Cb -0.09 -0.66 -0.04 0.00 -0.43 0.00 0.00 46.19 44.96 2ke5 s LEU 90 CO -0.01 -0.31 0.82 -0.22 -0.29 0.00 0.00 176.35 176.35 2ke5 s LEU 91 N 1.80 4.40 -0.00 -0.68 2.96 0.30 -0.99 118.68 126.47 2ke5 s LEU 91 Ca -0.01 1.47 0.01 0.00 -0.22 0.00 0.00 54.13 55.38 2ke5 s LEU 91 Cb -0.17 -3.32 -0.00 0.00 0.50 0.00 0.00 46.19 43.20 2ke5 s LEU 91 CO -0.09 -0.10 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.11 2ke5 s VAL 92 N 0.44 0.32 -0.10 1.68 1.01 -1.14 -1.58 120.40 121.03 2ke5 s VAL 92 Ca 0.43 -0.17 -0.25 0.00 0.00 0.00 0.00 61.98 61.98 2ke5 s VAL 92 Cb -0.20 -0.27 0.06 0.00 0.00 0.00 0.00 36.38 35.96 2ke5 s VAL 92 CO 0.24 0.09 0.59 0.72 0.00 0.00 0.00 175.10 176.74 2ke5 s PHE 93 N -0.09 -0.58 0.37 5.22 -0.12 -1.02 -3.94 117.98 117.82 2ke5 s PHE 93 Ca 0.01 1.13 -0.11 0.00 -0.05 0.00 0.00 56.93 57.92 2ke5 s PHE 93 Cb -0.02 0.30 -0.07 0.00 -0.63 0.00 0.00 43.02 42.60 2ke5 s PHE 93 CO -0.00 -0.48 0.73 -1.12 -0.05 0.00 0.00 175.22 174.30 2ke5 s SER 94 N -0.75 6.56 0.04 1.98 0.01 -1.26 -0.53 113.70 119.75 2ke5 s SER 94 Ca -0.08 1.11 -0.16 0.00 1.31 0.00 0.00 55.95 58.13 2ke5 s SER 94 Cb -0.02 -2.31 -0.31 0.00 0.21 0.00 0.00 66.02 63.58 2ke5 s SER 94 CO 0.06 -0.33 1.06 0.16 0.41 0.00 0.00 173.24 174.60 2ke5 h ILE 95 N 1.31 1.29 -0.26 1.44 3.07 -1.71 -3.23 117.51 119.42 2ke5 h ILE 95 Ca -0.47 -2.53 0.07 0.00 1.55 0.00 0.00 64.86 63.48 2ke5 h ILE 95 Cb 1.18 2.82 -0.01 0.00 -0.27 0.00 0.00 36.82 40.54 2ke5 h ILE 95 CO 0.64 0.77 0.24 0.71 -1.05 0.00 0.00 178.15 179.46 2ke5 h THR 96 N 0.22 0.58 -3.53 0.16 1.35 -1.82 -3.22 112.91 106.65 2ke5 h THR 96 Ca -0.21 0.00 -0.72 0.00 -0.55 0.00 0.00 66.41 64.93 2ke5 h THR 96 Cb 1.99 0.82 -0.33 0.00 -1.73 0.00 0.00 68.15 68.90 2ke5 h THR 96 CO 0.25 0.00 -0.17 -1.61 -0.25 0.00 0.00 175.52 173.74 2ke5 s GLU 97 N -4.77 3.04 0.46 4.72 0.41 -1.22 -4.85 118.70 116.48 2ke5 s GLU 97 Ca -0.05 -2.79 0.31 0.00 -0.41 0.00 0.00 54.97 52.03 2ke5 s GLU 97 Cb 0.16 -3.96 1.67 0.00 -1.78 0.00 0.00 34.13 30.23 2ke5 s GLU 97 CO 0.60 -1.22 1.94 1.25 -0.49 0.00 0.00 175.26 177.34 2ke5 h HIS 98 N 6.82 0.00 0.00 1.61 -0.00 -1.76 0.41 115.15 122.23 2ke5 h HIS 98 Ca 0.07 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.33 2ke5 h HIS 98 Cb 0.92 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.32 2ke5 h HIS 98 CO 0.77 0.00 -0.50 1.49 -0.00 0.00 0.00 177.93 179.70 2ke5 h GLU 99 N 0.00 0.00 -0.18 5.26 4.81 -1.90 -3.23 114.58 119.34 2ke5 h GLU 99 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2ke5 h GLU 99 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2ke5 h GLU 99 CO 0.00 0.50 0.07 0.77 -0.73 0.00 0.00 179.01 179.62 2ke5 h SER 100 N 0.00 0.24 -0.98 1.04 0.02 -1.19 -0.70 113.55 111.98 2ke5 h SER 100 Ca -0.00 -0.16 0.10 0.00 -0.84 0.00 0.00 61.79 60.89 2ke5 h SER 100 Cb 1.09 -0.06 -0.08 0.00 0.14 0.00 0.00 62.40 63.49 2ke5 h SER 100 CO 0.06 0.33 0.62 0.15 -1.14 0.00 0.00 176.83 176.86 2ke5 h PHE 101 N 0.14 1.13 0.07 3.45 3.57 -1.66 0.93 116.94 124.57 2ke5 h PHE 101 Ca 0.06 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 2ke5 h PHE 101 Cb 0.16 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.54 2ke5 h PHE 101 CO -0.01 0.50 -0.03 1.79 -2.23 0.00 0.00 178.31 178.32 2ke5 h THR 102 N 1.03 1.23 -0.73 4.41 1.35 -1.58 -3.04 112.91 115.58 2ke5 h THR 102 Ca 0.46 -1.23 0.03 0.00 -0.55 0.00 0.00 66.41 65.12 2ke5 h THR 102 Cb 0.37 2.01 -0.05 0.00 -1.73 0.00 0.00 68.15 68.75 2ke5 h THR 102 CO -0.23 0.30 0.46 0.00 -0.25 0.00 0.00 175.52 175.79 2ke5 h ALA 103 N 0.17 0.96 -0.42 6.62 0.00 -0.88 -1.14 119.26 124.57 2ke5 h ALA 103 Ca -0.01 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.96 2ke5 h ALA 103 Cb 0.56 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2ke5 h ALA 103 CO 0.02 0.24 0.29 1.79 0.00 0.00 0.00 179.25 181.58 2ke5 h THR 104 N 0.89 0.89 0.00 0.00 1.35 -0.89 -0.02 112.91 115.13 2ke5 h THR 104 Ca 0.29 -0.07 -0.03 0.00 -0.55 0.00 0.00 66.41 66.05 2ke5 h THR 104 Cb 0.03 0.66 -0.00 0.00 -1.73 0.00 0.00 68.15 67.11 2ke5 h THR 104 CO -0.11 0.04 -0.14 0.00 -0.25 0.00 0.00 175.52 175.05 2ke5 h ALA 105 N 1.78 1.76 -0.41 6.62 0.00 -1.08 -2.38 119.26 125.56 2ke5 h ALA 105 Ca 0.19 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2ke5 h ALA 105 Cb 0.49 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2ke5 h ALA 105 CO -0.03 0.18 0.10 0.93 0.00 0.00 0.00 179.25 180.42 2ke5 h GLU 106 N 0.00 0.67 0.00 0.00 5.08 -0.98 -2.49 114.58 116.86 2ke5 h GLU 106 Ca -0.00 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2ke5 h GLU 106 Cb 0.25 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2ke5 h GLU 106 CO 0.02 0.68 -0.02 0.74 -1.00 0.00 0.00 179.01 179.43 2ke5 h PHE 107 N 0.53 0.00 -0.88 4.33 -1.00 -1.45 -2.35 116.94 116.12 2ke5 h PHE 107 Ca 0.13 0.00 0.13 0.00 2.81 0.00 0.00 57.97 61.04 2ke5 h PHE 107 Cb 0.32 0.00 -0.09 0.00 3.61 0.00 0.00 35.95 39.79 2ke5 h PHE 107 CO 0.02 0.02 0.49 -0.09 -1.61 0.00 0.00 178.31 177.14 2ke5 h ARG 108 N 0.00 0.71 -0.20 1.51 1.12 -1.33 0.00 114.38 116.19 2ke5 h ARG 108 Ca -0.00 -0.04 -0.15 0.00 -1.11 0.00 0.00 59.98 58.68 2ke5 h ARG 108 Cb 0.06 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 29.85 2ke5 h ARG 108 CO 0.00 0.47 -0.49 0.93 -3.11 0.00 0.00 179.97 177.77 2ke5 h GLU 109 N 0.73 0.55 -0.48 0.20 5.08 -1.54 -3.04 114.58 116.07 2ke5 h GLU 109 Ca 0.46 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 2ke5 h GLU 109 Cb 0.57 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 2ke5 h GLU 109 CO -0.32 0.92 0.21 1.96 -1.00 0.00 0.00 179.01 180.78 2ke5 h GLN 110 N 0.43 0.68 -0.78 2.33 1.08 -1.08 -2.62 115.11 115.16 2ke5 h GLN 110 Ca 0.02 -0.09 0.04 0.00 -1.45 0.00 0.00 58.65 57.17 2ke5 h GLN 110 Cb 1.02 -0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 28.27 2ke5 h GLN 110 CO 0.09 0.55 0.49 0.82 -0.95 0.00 0.00 178.83 179.84 2ke5 h ILE 111 N 0.68 1.10 0.00 2.54 2.04 -1.09 -1.78 117.51 121.00 2ke5 h ILE 111 Ca 0.17 -0.33 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 2ke5 h ILE 111 Cb 0.11 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.25 2ke5 h ILE 111 CO -0.02 0.17 -0.24 -0.07 0.00 0.00 0.00 178.15 178.00 2ke5 h LEU 112 N 0.95 0.00 -0.03 1.44 3.38 -1.53 -3.15 115.31 116.37 2ke5 h LEU 112 Ca 0.32 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.31 2ke5 h LEU 112 Cb 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2ke5 h LEU 112 CO -0.12 0.24 -0.10 0.03 0.09 0.00 0.00 178.44 178.57 2ke5 h ARG 113 N 0.00 -0.16 0.00 1.13 3.08 -1.24 -0.43 114.38 116.76 2ke5 h ARG 113 Ca -0.00 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 2ke5 h ARG 113 Cb 0.56 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2ke5 h ARG 113 CO 0.03 -0.10 -0.17 -0.39 -1.07 0.00 0.00 179.97 178.27 2ke5 h VAL 114 N -0.16 0.54 -2.08 2.04 -1.51 -1.59 -3.14 116.25 110.35 2ke5 h VAL 114 Ca 0.05 -0.82 -0.60 0.00 -1.23 0.00 0.00 66.70 64.10 2ke5 h VAL 114 Cb 0.22 1.55 -0.41 0.00 -2.13 0.00 0.00 31.29 30.52 2ke5 h VAL 114 CO -0.12 0.17 -0.56 0.29 -1.23 0.00 0.00 177.57 176.11 2ke5 n LYS 115 N -3.49 3.38 -0.28 5.19 4.76 -0.67 -4.87 118.16 122.18 2ke5 n LYS 115 Ca -0.01 -4.74 0.21 0.00 -2.87 0.00 0.00 58.31 50.90 2ke5 n LYS 115 Cb 0.33 -2.25 0.52 0.00 -1.84 0.00 0.00 35.03 31.79 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 2.92 2.25 -0.12 7.82 0.00 -1.07 0.04 119.26 131.11 2ke5 h ALA 116 Ca 0.20 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.16 2ke5 h ALA 116 Cb 0.60 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2ke5 h ALA 116 CO 0.85 -0.58 0.01 0.93 0.00 0.00 0.00 179.25 180.46 2ke5 h GLU 117 N 0.39 0.06 -5.31 0.00 4.39 -1.89 -3.49 114.58 108.73 2ke5 h GLU 117 Ca 0.52 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.22 2ke5 h GLU 117 Cb 1.34 -0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 29.88 2ke5 h GLU 117 CO -0.21 0.04 -1.20 -1.91 -1.16 0.00 0.00 179.01 174.57 2ke5 n GLU 118 N -5.10 -3.73 0.00 2.33 2.13 -0.00 -5.02 120.64 111.25 2ke5 n GLU 118 Ca -0.04 2.88 0.00 0.00 0.66 0.00 0.00 57.16 60.66 2ke5 n GLU 118 Cb 0.07 -4.02 0.00 0.00 0.27 0.00 0.00 31.44 27.76 2ke5 n GLU 118 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2ke5 n ASP 119 N 1.88 0.26 -3.20 4.31 5.75 -1.26 -5.01 116.55 119.27 2ke5 n ASP 119 Ca -0.31 0.00 -0.19 0.00 -0.01 0.00 0.00 54.79 54.29 2ke5 n ASP 119 Cb 0.48 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.51 2ke5 n ASP 119 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2ke5 s LYS 120 N -1.39 0.91 -0.45 0.11 -0.14 -1.26 -4.74 119.74 112.78 2ke5 s LYS 120 Ca 0.00 -1.61 -0.23 0.00 -1.36 0.00 0.00 55.97 52.77 2ke5 s LYS 120 Cb 0.00 -0.91 0.03 0.00 -1.68 0.00 0.00 37.83 35.27 2ke5 s LYS 120 CO 0.00 -1.34 0.77 0.42 -0.76 0.00 0.00 175.35 174.44 2ke5 s ILE 121 N 0.51 4.66 -0.75 2.17 -1.09 -1.26 -4.60 121.20 120.84 2ke5 s ILE 121 Ca 0.30 0.36 -0.26 0.00 -2.23 0.00 0.00 60.65 58.82 2ke5 s ILE 121 Cb -0.01 -4.32 0.00 0.00 -1.58 0.00 0.00 42.46 36.56 2ke5 s ILE 121 CO -0.13 -0.72 1.62 -2.84 -1.23 0.00 0.00 174.94 171.64 2ke5 s PRO 122 N 3.25 2.93 0.11 2.79 0.02 -1.26 -4.97 135.00 137.87 2ke5 s PRO 122 Ca 0.29 -0.04 0.09 0.00 0.02 0.00 0.00 61.00 61.36 2ke5 s PRO 122 Cb -0.12 -4.54 -0.04 0.00 0.02 0.00 0.00 34.50 29.81 2ke5 s PRO 122 CO 0.22 -2.56 -0.24 -1.17 -0.33 0.00 0.00 177.00 172.92 2ke5 s LEU 123 N 7.56 2.30 -0.27 -5.54 0.20 -1.25 -0.81 118.68 120.86 2ke5 s LEU 123 Ca 0.54 -0.70 -0.12 0.00 0.69 0.00 0.00 54.13 54.53 2ke5 s LEU 123 Cb -0.09 -1.04 0.10 0.00 -0.43 0.00 0.00 46.19 44.73 2ke5 s LEU 123 CO 0.12 0.12 0.63 -0.22 -0.29 0.00 0.00 176.35 176.70 2ke5 s LEU 124 N -1.92 -0.92 -0.04 -0.68 2.96 -1.17 -4.84 118.68 112.08 2ke5 s LEU 124 Ca 0.10 1.44 -0.02 0.00 -0.22 0.00 0.00 54.13 55.43 2ke5 s LEU 124 Cb -0.10 2.18 -0.04 0.00 0.50 0.00 0.00 46.19 48.74 2ke5 s LEU 124 CO 0.05 -0.23 0.10 0.54 -1.32 0.00 0.00 176.35 175.49 2ke5 s VAL 125 N 2.16 4.98 0.07 1.68 0.11 -1.22 -0.54 120.40 127.63 2ke5 s VAL 125 Ca -0.08 -0.21 -0.05 0.00 -2.93 0.00 0.00 61.98 58.71 2ke5 s VAL 125 Cb -0.08 -3.24 -0.02 0.00 -1.53 0.00 0.00 36.38 31.50 2ke5 s VAL 125 CO -0.18 0.43 0.08 0.54 -3.33 0.00 0.00 175.10 172.64 2ke5 s VAL 126 N -1.15 0.18 -0.06 2.04 0.11 -0.62 -3.33 120.40 117.57 2ke5 s VAL 126 Ca 0.21 -1.49 0.04 0.00 -2.93 0.00 0.00 61.98 57.81 2ke5 s VAL 126 Cb -0.12 -1.43 -0.02 0.00 -1.53 0.00 0.00 36.38 33.28 2ke5 s VAL 126 CO 0.12 -0.82 -0.18 -0.83 -3.33 0.00 0.00 175.10 170.05 2ke5 s GLY 127 N -2.89 1.44 0.52 6.54 0.00 0.34 -2.44 107.32 110.83 2ke5 s GLY 127 Ca 0.06 -1.00 0.06 0.00 0.00 0.00 0.00 44.72 43.84 2ke5 s GLY 127 CO -0.10 -0.65 0.46 -2.01 0.00 0.00 0.00 173.10 170.79 2ke5 n ASN 128 N 2.71 2.53 -1.68 1.64 5.15 0.31 0.04 115.26 125.96 2ke5 n ASN 128 Ca -0.17 -2.72 -0.15 0.00 -0.60 0.00 0.00 54.58 50.94 2ke5 n ASN 128 Cb 0.52 -0.11 -0.05 0.00 -0.53 0.00 0.00 39.78 39.61 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 -1.81 -1.51 0.00 1.20 4.76 -1.23 -2.12 118.16 117.45 2ke5 n LYS 129 Ca 0.01 0.84 0.04 0.00 -2.87 0.00 0.00 58.31 56.33 2ke5 n LYS 129 Cb 0.59 -5.20 0.19 0.00 -1.84 0.00 0.00 35.03 28.77 2ke5 n LYS 129 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2ke5 n SER 130 N -0.98 0.00 0.00 4.39 2.88 -1.01 -2.16 113.62 116.74 2ke5 n SER 130 Ca -0.16 0.39 0.05 0.00 -1.33 0.00 0.00 58.87 57.82 2ke5 n SER 130 Cb 0.52 -0.43 0.25 0.00 -0.75 0.00 0.00 64.21 63.80 2ke5 n SER 130 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2ke5 n ASP 131 N -1.43 0.00 -3.87 -3.46 2.03 -1.26 -3.78 116.55 104.78 2ke5 n ASP 131 Ca 0.03 0.05 -0.28 0.00 0.52 0.00 0.00 54.79 55.10 2ke5 n ASP 131 Cb 0.09 -0.22 -0.12 0.00 -0.72 0.00 0.00 41.12 40.15 2ke5 n ASP 131 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2ke5 s LEU 132 N -2.44 4.53 0.13 -2.67 1.43 -0.92 -4.89 118.68 113.86 2ke5 s LEU 132 Ca 0.10 -3.71 0.22 0.00 -1.03 0.00 0.00 54.13 49.71 2ke5 s LEU 132 Cb 0.06 -1.55 0.87 0.00 0.03 0.00 0.00 46.19 45.61 2ke5 s LEU 132 CO 0.14 -0.11 1.67 -1.84 0.23 0.00 0.00 176.35 176.45 2ke5 n GLU 133 N 2.15 0.12 0.00 1.70 0.28 -1.25 -2.24 120.64 121.40 2ke5 n GLU 133 Ca 0.19 0.28 0.11 0.00 -0.16 0.00 0.00 57.16 57.58 2ke5 n GLU 133 Cb 0.36 -1.69 0.14 0.00 1.43 0.00 0.00 31.44 31.67 2ke5 n GLU 133 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2ke5 n GLU 134 N -1.91 0.24 -0.06 3.44 0.28 -1.26 -4.03 120.64 117.35 2ke5 n GLU 134 Ca 0.04 -0.17 0.05 0.00 -0.16 0.00 0.00 57.16 56.92 2ke5 n GLU 134 Cb 0.26 -1.50 0.07 0.00 1.43 0.00 0.00 31.44 31.70 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 -1.23 1.88 -2.48 3.44 1.74 -0.95 -5.00 116.66 114.06 2ke5 n ARG 135 Ca 0.06 -1.99 -0.43 0.00 -0.77 0.00 0.00 57.85 54.73 2ke5 n ARG 135 Cb 0.35 -1.21 -0.02 0.00 -1.02 0.00 0.00 32.46 30.55 2ke5 n ARG 135 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2ke5 s ARG 136 N -1.88 3.55 -0.03 5.56 3.52 -1.05 -4.25 118.95 124.38 2ke5 s ARG 136 Ca 0.16 0.59 0.06 0.00 -0.13 0.00 0.00 55.73 56.41 2ke5 s ARG 136 Cb 0.14 -4.01 -0.24 0.00 -1.56 0.00 0.00 34.95 29.28 2ke5 s ARG 136 CO 0.02 -1.61 0.71 1.96 -0.81 0.00 0.00 175.30 175.57 2ke5 h GLN 137 N 10.10 0.09 -4.67 5.12 4.20 -1.89 -3.43 115.11 124.63 2ke5 h GLN 137 Ca -0.25 -0.16 -0.71 0.00 0.06 0.00 0.00 58.65 57.59 2ke5 h GLN 137 Cb 1.08 0.06 -0.20 0.00 0.30 0.00 0.00 27.48 28.72 2ke5 h GLN 137 CO 1.14 0.78 0.04 0.54 -0.67 0.00 0.00 178.83 180.66 2ke5 s VAL 138 N -2.61 4.90 0.22 -0.54 0.11 -1.25 -5.03 120.40 116.19 2ke5 s VAL 138 Ca -0.08 -0.93 -0.31 0.00 -2.93 0.00 0.00 61.98 57.73 2ke5 s VAL 138 Cb 0.08 -4.41 -0.11 0.00 -1.53 0.00 0.00 36.38 30.41 2ke5 s VAL 138 CO 0.82 -0.99 1.62 -2.16 -3.33 0.00 0.00 175.10 171.06 2ke5 s PRO 139 N 2.50 4.16 0.28 1.54 0.04 -1.26 -4.87 135.00 137.39 2ke5 s PRO 139 Ca 0.11 2.50 0.01 0.00 0.04 0.00 0.00 61.00 63.66 2ke5 s PRO 139 Cb -0.24 -3.09 0.58 0.00 0.04 0.00 0.00 34.50 31.80 2ke5 s PRO 139 CO 0.07 -0.65 1.79 -0.24 0.04 0.00 0.00 177.00 178.01 2ke5 h VAL 140 N 3.74 0.79 -0.23 -0.36 3.04 -1.97 0.12 116.25 121.38 2ke5 h VAL 140 Ca -0.44 -0.27 0.05 0.00 -1.01 0.00 0.00 66.70 65.03 2ke5 h VAL 140 Cb 1.21 -0.06 -0.04 0.00 -2.01 0.00 0.00 31.29 30.39 2ke5 h VAL 140 CO 0.89 0.14 -0.05 -0.33 -1.01 0.00 0.00 177.57 177.22 2ke5 h GLU 141 N 0.78 0.01 0.00 4.17 5.08 -2.00 0.32 114.58 122.95 2ke5 h GLU 141 Ca 0.50 -0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.73 2ke5 h GLU 141 Cb 0.64 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2ke5 h GLU 141 CO -0.33 0.01 -0.60 1.49 -1.00 0.00 0.00 179.01 178.58 2ke5 h GLU 142 N 0.01 0.00 0.00 2.33 4.81 -1.74 -2.92 114.58 117.08 2ke5 h GLU 142 Ca 0.11 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 2ke5 h GLU 142 Cb 0.17 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2ke5 h GLU 142 CO -0.23 0.60 -0.67 0.00 -0.73 0.00 0.00 179.01 177.98 2ke5 h ALA 143 N 1.40 0.76 -0.11 2.92 0.00 -0.33 -3.10 119.26 120.80 2ke5 h ALA 143 Ca -0.01 -0.61 -0.19 0.00 0.00 0.00 0.00 54.91 54.10 2ke5 h ALA 143 Cb 1.09 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.79 2ke5 h ALA 143 CO 0.08 0.83 -0.69 0.00 0.00 0.00 0.00 179.25 179.47 2ke5 h ARG 144 N 0.00 0.66 -0.40 0.00 3.08 -0.26 -2.58 114.38 114.88 2ke5 h ARG 144 Ca -0.01 -0.57 -0.01 0.00 0.07 0.00 0.00 59.98 59.47 2ke5 h ARG 144 Cb 1.29 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.45 2ke5 h ARG 144 CO 0.09 1.18 0.22 1.03 -1.07 0.00 0.00 179.97 181.41 2ke5 h SER 145 N 0.33 0.51 -0.15 7.04 0.87 -1.56 0.26 113.55 120.85 2ke5 h SER 145 Ca -0.06 -0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.39 2ke5 h SER 145 Cb 1.34 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 63.16 2ke5 h SER 145 CO 0.14 0.46 0.01 0.50 -0.53 0.00 0.00 176.83 177.41 2ke5 h LYS 146 N 0.52 0.27 0.00 2.24 3.11 -1.61 -2.90 116.57 118.19 2ke5 h LYS 146 Ca 0.14 -0.08 -0.07 0.00 -2.81 0.00 0.00 60.65 57.84 2ke5 h LYS 146 Cb 0.07 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.26 2ke5 h LYS 146 CO -0.02 0.47 -0.32 0.00 -2.81 0.00 0.00 179.45 176.77 2ke5 h ALA 147 N 0.78 1.39 -0.19 5.00 0.00 -1.36 -2.54 119.26 122.35 2ke5 h ALA 147 Ca 0.05 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2ke5 h ALA 147 Cb 0.34 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2ke5 h ALA 147 CO 0.01 0.40 -0.03 1.49 0.00 0.00 0.00 179.25 181.11 2ke5 h GLU 148 N 0.00 0.27 -0.80 0.00 4.81 -0.28 -2.52 114.58 116.07 2ke5 h GLU 148 Ca -0.00 -0.05 0.14 0.00 -0.13 0.00 0.00 59.36 59.32 2ke5 h GLU 148 Cb 0.59 -0.05 -0.09 0.00 0.63 0.00 0.00 28.75 29.83 2ke5 h GLU 148 CO 0.04 0.33 0.37 0.93 -0.73 0.00 0.00 179.01 179.95 2ke5 h GLU 149 N 0.27 0.51 0.00 1.92 4.39 -1.31 0.34 114.58 120.71 2ke5 h GLU 149 Ca 0.06 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2ke5 h GLU 149 Cb 0.24 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2ke5 h GLU 149 CO 0.01 0.34 -0.11 -1.49 -1.16 0.00 0.00 179.01 176.60 2ke5 h TRP 150 N 0.53 0.00 0.00 4.33 6.55 -1.60 -3.46 115.95 122.31 2ke5 h TRP 150 Ca 0.44 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.28 2ke5 h TRP 150 Cb 0.63 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.93 2ke5 h TRP 150 CO -0.13 0.11 0.00 0.41 -1.05 0.00 0.00 178.44 177.78 2ke5 n GLY 151 N -0.74 1.82 2.88 1.49 0.00 0.12 -5.10 105.19 105.66 2ke5 n GLY 151 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 2ke5 n GLY 151 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ke5 n VAL 152 N -0.86 0.00 -4.86 1.61 0.24 -1.23 -5.03 118.33 108.20 2ke5 n VAL 152 Ca 0.00 -2.01 -0.30 0.00 -2.04 0.00 0.00 64.34 59.99 2ke5 n VAL 152 Cb 0.00 0.66 -0.15 0.00 -1.47 0.00 0.00 33.84 32.88 2ke5 n VAL 152 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ke5 s GLN 153 N -3.36 1.76 -0.07 7.34 -2.07 -1.26 -3.90 119.66 118.11 2ke5 s GLN 153 Ca 0.14 -1.13 0.03 0.00 -1.82 0.00 0.00 55.36 52.57 2ke5 s GLN 153 Cb 0.01 -1.97 -0.02 0.00 -1.09 0.00 0.00 33.01 29.94 2ke5 s GLN 153 CO 0.10 0.50 -0.13 -0.47 -1.32 0.00 0.00 175.29 173.97 2ke5 s TYR 154 N -0.83 2.75 0.06 9.60 5.04 -1.26 -3.46 117.35 129.25 2ke5 s TYR 154 Ca 0.12 -0.21 0.01 0.00 -2.44 0.00 0.00 57.07 54.55 2ke5 s TYR 154 Cb -0.10 -1.68 -0.03 0.00 0.35 0.00 0.00 41.96 40.50 2ke5 s TYR 154 CO 0.02 0.14 -0.06 0.54 -1.34 0.00 0.00 175.55 174.85 2ke5 s VAL 155 N -0.56 0.49 0.05 3.14 0.11 -1.21 -4.93 120.40 117.50 2ke5 s VAL 155 Ca 0.08 -1.36 -0.17 0.00 -2.93 0.00 0.00 61.98 57.59 2ke5 s VAL 155 Cb -0.12 -0.95 -0.06 0.00 -1.53 0.00 0.00 36.38 33.72 2ke5 s VAL 155 CO 0.01 -0.59 0.51 -1.61 -3.33 0.00 0.00 175.10 170.09 2ke5 s GLU 156 N -2.41 4.07 0.14 1.54 2.02 -1.26 -0.51 118.70 122.29 2ke5 s GLU 156 Ca -0.03 0.59 -0.11 0.00 0.02 0.00 0.00 54.97 55.43 2ke5 s GLU 156 Cb -0.04 -3.20 0.01 0.00 0.10 0.00 0.00 34.13 31.00 2ke5 s GLU 156 CO -0.02 0.64 0.32 0.95 0.02 0.00 0.00 175.26 177.17 2ke5 s THR 157 N -1.14 0.08 -0.22 3.63 -4.23 0.11 -4.86 115.64 109.00 2ke5 s THR 157 Ca 0.28 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 2ke5 s THR 157 Cb -0.18 -1.57 0.06 0.00 1.34 0.00 0.00 72.50 72.15 2ke5 s THR 157 CO 0.17 -0.36 -0.04 -0.44 -0.54 0.00 0.00 174.62 173.41 2ke5 s SER 158 N -2.90 3.56 0.00 3.99 0.01 -1.26 -2.41 113.70 114.68 2ke5 s SER 158 Ca 0.11 -1.04 0.05 0.00 1.31 0.00 0.00 55.95 56.37 2ke5 s SER 158 Cb 0.03 -1.06 0.21 0.00 0.21 0.00 0.00 66.02 65.41 2ke5 s SER 158 CO -0.05 -0.24 1.11 0.00 0.41 0.00 0.00 173.24 174.47 2ke5 n ALA 159 N 4.76 1.26 -0.05 1.44 0.00 -1.26 -0.49 120.51 126.17 2ke5 n ALA 159 Ca -0.12 -0.02 -0.22 0.00 0.00 0.00 0.00 53.44 53.09 2ke5 n ALA 159 Cb 0.45 -1.08 -0.13 0.00 0.00 0.00 0.00 19.45 18.70 2ke5 n ALA 159 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2ke5 h LYS 160 N 0.00 0.14 -0.00 0.00 1.63 -1.97 -3.36 116.57 113.00 2ke5 h LYS 160 Ca 0.00 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 59.56 2ke5 h LYS 160 Cb 0.07 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.79 2ke5 h LYS 160 CO 0.00 1.11 -0.21 0.25 -3.45 0.00 0.00 179.45 177.15 2ke5 n THR 161 N -3.98 0.00 -3.78 1.00 -2.24 -0.91 -4.74 114.28 99.63 2ke5 n THR 161 Ca -0.31 -0.08 -0.32 0.00 -2.27 0.00 0.00 64.05 61.07 2ke5 n THR 161 Cb 0.86 0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 69.16 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 -0.91 -0.79 -0.01 -0.78 -4.01 0.36 -4.81 116.66 105.70 2ke5 n ARG 162 Ca 0.12 0.10 -0.07 0.00 -1.04 0.00 0.00 57.85 56.97 2ke5 n ARG 162 Cb 0.32 -3.49 -0.05 0.00 -3.04 0.00 0.00 32.46 26.19 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 1.15 -0.10 -0.23 2.89 0.00 -1.92 -3.38 119.26 117.67 2ke5 h ALA 163 Ca -0.45 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2ke5 h ALA 163 Cb 1.04 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2ke5 h ALA 163 CO 0.67 -0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.89 2ke5 n ASN 164 N -4.80 3.53 -0.19 0.00 3.02 -1.26 -4.63 115.26 110.92 2ke5 n ASN 164 Ca -0.05 -2.89 -0.07 0.00 -0.03 0.00 0.00 54.58 51.54 2ke5 n ASN 164 Cb 0.20 -0.48 0.07 0.00 -0.61 0.00 0.00 39.78 38.96 2ke5 n ASN 164 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 2ke5 h VAL 165 N 1.55 1.26 0.00 2.41 3.04 -1.86 -2.23 116.25 120.41 2ke5 h VAL 165 Ca 0.00 -1.08 0.00 0.00 -1.01 0.00 0.00 66.70 64.61 2ke5 h VAL 165 Cb 1.28 0.76 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 2ke5 h VAL 165 CO 0.16 0.39 0.00 0.44 -1.01 0.00 0.00 177.57 177.56 2ke5 h ASP 166 N 0.93 0.00 -0.83 3.17 5.19 -1.84 -3.22 116.42 119.82 2ke5 h ASP 166 Ca 0.18 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.60 2ke5 h ASP 166 Cb 0.49 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.96 2ke5 h ASP 166 CO 0.02 0.00 0.55 0.07 -3.12 0.00 0.00 179.24 176.76 2ke5 h LYS 167 N 0.00 1.08 0.00 3.56 5.09 -1.71 -1.71 116.57 122.88 2ke5 h LYS 167 Ca 0.00 -0.07 -0.17 0.00 0.09 0.00 0.00 60.65 60.51 2ke5 h LYS 167 Cb 0.53 -0.24 -0.02 0.00 0.10 0.00 0.00 32.23 32.59 2ke5 h LYS 167 CO 0.00 0.72 -0.79 -0.39 -2.09 0.00 0.00 179.45 176.89 2ke5 h VAL 168 N 1.11 1.51 -0.11 0.07 -1.51 -1.68 -1.94 116.25 113.71 2ke5 h VAL 168 Ca 0.31 -2.78 -0.11 0.00 -1.23 0.00 0.00 66.70 62.88 2ke5 h VAL 168 Cb -0.12 2.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 2ke5 h VAL 168 CO -0.07 0.78 -0.37 -0.26 -1.23 0.00 0.00 177.57 176.42 2ke5 h PHE 169 N 0.00 0.58 -0.12 5.19 0.04 -1.59 -2.32 116.94 118.72 2ke5 h PHE 169 Ca -0.01 -0.24 -0.09 0.00 2.80 0.00 0.00 57.97 60.43 2ke5 h PHE 169 Cb 1.46 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 39.52 2ke5 h PHE 169 CO 0.00 0.98 -0.29 0.74 -0.60 0.00 0.00 178.31 179.14 2ke5 h PHE 170 N 0.01 0.51 -0.30 -0.55 0.04 -1.40 -1.38 116.94 113.88 2ke5 h PHE 170 Ca -0.02 -0.20 0.02 0.00 2.80 0.00 0.00 57.97 60.58 2ke5 h PHE 170 Cb 1.00 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 39.03 2ke5 h PHE 170 CO 0.11 0.91 0.14 0.22 -0.60 0.00 0.00 178.31 179.09 2ke5 h ASP 171 N -0.03 0.20 -0.26 2.17 1.82 -1.45 -1.38 116.42 117.51 2ke5 h ASP 171 Ca -0.00 0.02 -0.13 0.00 -0.39 0.00 0.00 57.03 56.52 2ke5 h ASP 171 Cb 0.90 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.88 2ke5 h ASP 171 CO 0.06 0.15 -0.31 0.25 -1.61 0.00 0.00 179.24 177.78 2ke5 h LEU 172 N 0.30 0.80 -0.15 2.28 5.85 -1.48 -3.01 115.31 119.90 2ke5 h LEU 172 Ca 0.13 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.54 2ke5 h LEU 172 Cb 0.05 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 2ke5 h LEU 172 CO -0.10 1.05 0.04 -0.03 -0.34 0.00 0.00 178.44 179.06 2ke5 h MET 173 N 0.65 0.10 -0.54 1.25 4.05 -0.84 -1.93 114.93 117.66 2ke5 h MET 173 Ca 0.07 -0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.53 2ke5 h MET 173 Cb 0.84 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.59 2ke5 h MET 173 CO 0.07 0.07 0.36 0.00 0.23 0.00 0.00 176.91 177.64 2ke5 h ARG 174 N 0.10 0.57 -0.04 0.39 3.08 -1.24 -2.34 114.38 114.90 2ke5 h ARG 174 Ca 0.07 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 2ke5 h ARG 174 Cb 0.05 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 2ke5 h ARG 174 CO -0.08 0.38 0.01 0.93 -1.07 0.00 0.00 179.97 180.14 2ke5 h GLU 175 N 0.59 0.06 -0.39 0.04 4.39 -1.24 -1.45 114.58 116.59 2ke5 h GLU 175 Ca 0.22 -0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.97 2ke5 h GLU 175 Cb 0.16 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 2ke5 h GLU 175 CO -0.06 0.22 0.26 0.82 -1.16 0.00 0.00 179.01 179.09 2ke5 h ILE 176 N -0.11 0.94 0.13 3.13 2.04 -0.88 0.72 117.51 123.48 2ke5 h ILE 176 Ca 0.01 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 2ke5 h ILE 176 Cb 0.18 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 2ke5 h ILE 176 CO -0.00 0.05 -0.06 0.03 0.00 0.00 0.00 178.15 178.16 2ke5 h ARG 177 N 0.26 -0.17 0.00 2.37 3.08 -1.17 -3.21 114.38 115.53 2ke5 h ARG 177 Ca 0.17 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 2ke5 h ARG 177 Cb 0.35 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 2ke5 h ARG 177 CO -0.03 0.27 -0.44 1.15 -1.07 0.00 0.00 179.97 179.85 2ke5 h THR 178 N -0.91 0.06 0.32 2.04 2.02 -1.05 -3.30 112.91 112.10 2ke5 h THR 178 Ca -0.02 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 2ke5 h THR 178 Cb 0.52 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 2ke5 h THR 178 CO 0.03 0.02 -0.22 0.50 0.37 0.00 0.00 175.52 176.23 2ke5 h LYS 179 N -1.00 -0.50 -0.56 6.66 3.64 0.20 0.32 116.57 125.32 2ke5 h LYS 179 Ca -0.02 0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.31 2ke5 h LYS 179 Cb 0.45 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 2ke5 h LYS 179 CO -0.01 -0.34 -0.01 -0.22 -2.27 0.00 0.00 179.45 176.61 2ke5 h LYS 180 N -0.52 0.98 0.00 1.90 3.64 -1.22 -2.64 116.57 118.71 2ke5 h LYS 180 Ca -0.03 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2ke5 h LYS 180 Cb 0.44 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2ke5 h LYS 180 CO 0.02 0.97 -0.07 -1.33 -2.27 0.00 0.00 179.45 176.76 2ke5 n MET 181 N -4.18 0.14 -0.03 1.90 2.81 -1.16 -3.86 117.12 112.74 2ke5 n MET 181 Ca 0.03 0.11 -0.11 0.00 -1.81 0.00 0.00 57.70 55.91 2ke5 n MET 181 Cb 0.34 -1.65 -0.10 0.00 -0.71 0.00 0.00 33.22 31.10 2ke5 n MET 181 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2ke5 h SER 182 N 0.00 -0.05 -3.50 7.83 4.64 0.01 -3.50 113.55 118.98 2ke5 h SER 182 Ca 0.00 -0.64 0.35 0.00 -0.47 0.00 0.00 61.79 61.03 2ke5 h SER 182 Cb 0.63 0.01 -0.14 0.00 -0.31 0.00 0.00 62.40 62.59 2ke5 h SER 182 CO 0.00 0.70 -0.89 -0.62 -0.87 0.00 0.00 176.83 175.15 2ke5 n GLU 183 N -4.75 -3.00 0.01 4.77 1.02 -1.14 -4.73 120.64 112.82 2ke5 n GLU 183 Ca -0.08 2.26 -0.22 0.00 -0.02 0.00 0.00 57.16 59.10 2ke5 n GLU 183 Cb 0.33 -3.57 -0.14 0.00 -0.02 0.00 0.00 31.44 28.05 2ke5 n GLU 183 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2ke5 h ASN 184 N -1.32 0.39 -0.03 1.62 -0.26 -1.93 -3.51 115.58 110.54 2ke5 h ASN 184 Ca -0.09 -0.86 0.00 0.00 -0.56 0.00 0.00 56.30 54.79 2ke5 h ASN 184 Cb 1.29 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.43 2ke5 h ASN 184 CO 0.05 1.69 0.00 0.29 -1.06 0.00 0.00 177.43 178.40