#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ke5 n ALA 13 N 0.00 -0.73 -3.75 -1.18 0.00 -1.26 -4.78 120.51 108.81 2ke5 n ALA 13 Ca 0.00 -0.53 -0.23 0.00 0.00 0.00 0.00 53.44 52.68 2ke5 n ALA 13 Cb 0.00 -2.20 -0.18 0.00 0.00 0.00 0.00 19.45 17.07 2ke5 n ALA 13 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2ke5 s LEU 14 N -6.51 0.53 0.12 0.00 0.20 -1.26 -1.72 118.68 110.04 2ke5 s LEU 14 Ca 0.68 -0.08 0.05 0.00 0.69 0.00 0.00 54.13 55.46 2ke5 s LEU 14 Cb -0.24 -0.39 -0.04 0.00 -0.43 0.00 0.00 46.19 45.09 2ke5 s LEU 14 CO 0.57 -0.21 0.04 -1.00 -0.29 0.00 0.00 176.35 175.47 2ke5 s HIS 15 N 2.00 3.03 -0.21 5.38 3.76 -0.57 -5.00 115.29 123.68 2ke5 s HIS 15 Ca 0.05 -0.03 -0.01 0.00 -0.15 0.00 0.00 55.06 54.92 2ke5 s HIS 15 Cb -0.12 -1.52 0.06 0.00 1.11 0.00 0.00 32.58 32.11 2ke5 s HIS 15 CO -0.05 0.50 -0.01 0.15 -0.85 0.00 0.00 174.74 174.48 2ke5 s LYS 16 N -2.62 1.18 -0.20 1.40 1.02 -1.26 -0.12 119.74 119.13 2ke5 s LYS 16 Ca 0.28 -0.71 -0.07 0.00 0.02 0.00 0.00 55.97 55.48 2ke5 s LYS 16 Cb -0.11 -2.35 -0.04 0.00 -0.52 0.00 0.00 37.83 34.81 2ke5 s LYS 16 CO 0.20 -0.61 0.06 0.54 -0.92 0.00 0.00 175.35 174.63 2ke5 s VAL 17 N 1.61 4.63 -0.30 3.17 0.11 -0.08 -0.29 120.40 129.27 2ke5 s VAL 17 Ca -0.03 -0.08 -0.07 0.00 -2.93 0.00 0.00 61.98 58.87 2ke5 s VAL 17 Cb -0.18 -3.11 0.01 0.00 -1.53 0.00 0.00 36.38 31.57 2ke5 s VAL 17 CO -0.07 0.42 0.08 -0.63 -3.33 0.00 0.00 175.10 171.57 2ke5 s ILE 18 N 0.76 3.95 -0.82 7.04 -1.09 -0.91 -3.85 121.20 126.29 2ke5 s ILE 18 Ca 0.03 -0.71 -0.25 0.00 -2.23 0.00 0.00 60.65 57.49 2ke5 s ILE 18 Cb -0.13 -3.04 -0.08 0.00 -1.58 0.00 0.00 42.46 37.62 2ke5 s ILE 18 CO 0.02 0.07 2.12 -0.04 -1.23 0.00 0.00 174.94 175.88 2ke5 s MET 19 N 1.49 2.21 0.35 2.79 -1.94 -1.26 -2.05 119.30 120.89 2ke5 s MET 19 Ca 0.02 0.15 0.07 0.00 -1.71 0.00 0.00 55.69 54.22 2ke5 s MET 19 Cb -0.17 -4.88 -0.01 0.00 2.01 0.00 0.00 34.83 31.78 2ke5 s MET 19 CO 0.02 -3.69 0.47 0.54 -0.01 0.00 0.00 175.02 172.36 2ke5 s VAL 20 N 11.74 3.79 -0.22 -6.03 0.11 0.42 -4.79 120.40 125.42 2ke5 s VAL 20 Ca 0.79 -1.04 0.00 0.00 -2.93 0.00 0.00 61.98 58.80 2ke5 s VAL 20 Cb -0.10 -3.30 0.00 0.00 -1.53 0.00 0.00 36.38 31.45 2ke5 s VAL 20 CO 0.06 -0.12 0.00 0.61 -3.33 0.00 0.00 175.10 172.31 2ke5 n GLY 21 N -1.65 -0.76 0.21 6.54 0.00 -1.26 -1.42 105.19 106.85 2ke5 n GLY 21 Ca 0.01 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 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 0.72 0.00 1.61 4.64 -1.77 -3.40 113.55 115.34 2ke5 h SER 22 Ca 0.00 -0.44 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ke5 h SER 22 Cb 0.00 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.88 2ke5 h SER 22 CO 0.00 1.20 0.00 0.61 -0.87 0.00 0.00 176.83 177.77 2ke5 n GLY 23 N 0.50 1.23 2.35 -0.77 0.00 -1.26 -4.74 105.19 102.49 2ke5 n GLY 23 Ca -0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 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 2.95 1.56 -0.02 0.00 -1.26 -4.58 105.19 103.85 2ke5 n GLY 24 Ca 0.00 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 1.86 0.00 0.00 1.61 0.31 -1.26 -4.95 118.33 115.91 2ke5 n VAL 25 Ca 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 2ke5 n VAL 25 Cb 0.48 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 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 1.89 0.07 0.36 2.92 0.00 -1.26 -4.96 105.19 104.21 2ke5 n GLY 26 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 0.00 1.61 2.10 -1.93 0.19 116.57 118.54 2ke5 h LYS 27 Ca 0.00 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.43 2ke5 h LYS 27 Cb 0.00 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.30 2ke5 h LYS 27 CO 0.00 0.00 -1.14 0.66 -2.00 0.00 0.00 179.45 176.97 2ke5 h SER 28 N 0.00 0.00 0.18 7.07 4.64 -1.95 -3.24 113.55 120.25 2ke5 h SER 28 Ca 0.12 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2ke5 h SER 28 Cb 0.73 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2ke5 h SER 28 CO -0.00 0.94 -0.12 0.00 -0.87 0.00 0.00 176.83 176.78 2ke5 h ALA 29 N 1.06 -0.28 0.00 5.18 0.00 -1.00 0.12 119.26 124.34 2ke5 h ALA 29 Ca -0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2ke5 h ALA 29 Cb 1.78 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.72 2ke5 h ALA 29 CO 0.11 -0.66 -0.06 -0.07 0.00 0.00 0.00 179.25 178.57 2ke5 h LEU 30 N -0.29 0.00 -0.15 0.00 -0.00 -1.67 -2.23 115.31 110.98 2ke5 h LEU 30 Ca -0.02 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.79 2ke5 h LEU 30 Cb 0.25 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.91 2ke5 h LEU 30 CO 0.01 0.06 -0.21 0.74 -0.00 0.00 0.00 178.44 179.05 2ke5 h THR 31 N 0.00 1.36 0.00 0.22 2.02 -1.03 -2.32 112.91 113.17 2ke5 h THR 31 Ca -0.00 -1.42 -0.10 0.00 0.77 0.00 0.00 66.41 65.66 2ke5 h THR 31 Cb 0.17 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.51 2ke5 h THR 31 CO 0.01 0.42 -0.48 -0.07 0.37 0.00 0.00 175.52 175.77 2ke5 h LEU 32 N 0.01 0.00 -0.16 2.58 3.38 -0.36 -2.07 115.31 118.70 2ke5 h LEU 32 Ca 0.02 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.76 2ke5 h LEU 32 Cb 0.77 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.53 2ke5 h LEU 32 CO 0.05 0.48 -0.89 1.56 0.09 0.00 0.00 178.44 179.72 2ke5 h GLN 33 N 0.00 0.60 -0.17 1.13 1.08 -1.42 0.79 115.11 117.12 2ke5 h GLN 33 Ca -0.00 -0.57 -0.21 0.00 -1.45 0.00 0.00 58.65 56.42 2ke5 h GLN 33 Cb 0.87 0.14 0.01 0.00 -0.05 0.00 0.00 27.48 28.45 2ke5 h GLN 33 CO 0.06 1.19 -0.70 0.35 -0.95 0.00 0.00 178.83 178.78 2ke5 h PHE 34 N 0.37 1.03 0.00 2.96 3.57 -1.33 -0.25 116.94 123.29 2ke5 h PHE 34 Ca -0.08 -0.44 -0.05 0.00 3.53 0.00 0.00 57.97 60.93 2ke5 h PHE 34 Cb 1.52 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.09 2ke5 h PHE 34 CO 0.08 1.27 -0.28 0.52 -2.23 0.00 0.00 178.31 177.66 2ke5 h MET 35 N 0.51 0.00 0.00 1.11 2.86 -1.44 -3.41 114.93 114.56 2ke5 h MET 35 Ca -0.04 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.46 2ke5 h MET 35 Cb 1.32 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.96 2ke5 h MET 35 CO 0.15 0.99 -1.99 0.66 1.06 0.00 0.00 176.91 177.78 2ke5 n TYR 36 N -4.57 0.00 -2.97 -0.22 4.01 0.14 -5.00 117.16 108.55 2ke5 n TYR 36 Ca -0.15 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.39 2ke5 n TYR 36 Cb 0.52 -0.61 0.04 0.00 -0.31 0.00 0.00 39.34 38.98 2ke5 n TYR 36 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2ke5 n ASP 37 N -2.36 -5.67 -3.76 7.72 8.00 -0.11 -4.97 116.55 115.40 2ke5 n ASP 37 Ca -0.14 -0.27 -0.13 0.00 0.71 0.00 0.00 54.79 54.95 2ke5 n ASP 37 Cb 0.74 -4.49 -0.14 0.00 -0.02 0.00 0.00 41.12 37.21 2ke5 n ASP 37 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2ke5 s GLU 38 N -5.62 0.11 -0.42 -1.24 2.12 -1.25 -4.98 118.70 107.44 2ke5 s GLU 38 Ca 0.29 0.36 -0.23 0.00 0.36 0.00 0.00 54.97 55.75 2ke5 s GLU 38 Cb -0.13 -0.14 0.02 0.00 0.26 0.00 0.00 34.13 34.14 2ke5 s GLU 38 CO 0.36 -0.15 0.76 0.12 -0.54 0.00 0.00 175.26 175.82 2ke5 s PHE 39 N 1.03 3.04 -0.04 5.30 5.36 -1.26 -4.56 117.98 126.86 2ke5 s PHE 39 Ca -0.08 0.28 0.05 0.00 -0.96 0.00 0.00 56.93 56.22 2ke5 s PHE 39 Cb -0.10 -3.53 -0.01 0.00 -0.34 0.00 0.00 43.02 39.05 2ke5 s PHE 39 CO -0.05 -0.88 -0.18 0.08 -1.46 0.00 0.00 175.22 172.73 2ke5 s VAL 40 N 3.16 1.45 0.28 3.12 1.01 -1.26 -5.02 120.40 123.14 2ke5 s VAL 40 Ca 0.29 -0.74 0.29 0.00 0.00 0.00 0.00 61.98 61.82 2ke5 s VAL 40 Cb -0.13 -1.23 0.31 0.00 0.00 0.00 0.00 36.38 35.33 2ke5 s VAL 40 CO 0.20 0.41 2.00 -0.33 0.00 0.00 0.00 175.10 177.38 2ke5 h GLU 41 N 6.09 0.00 -7.23 2.72 3.07 -2.05 -3.44 114.58 113.74 2ke5 h GLU 41 Ca -0.34 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.00 2ke5 h GLU 41 Cb 1.17 0.00 0.14 0.00 -0.84 0.00 0.00 28.75 29.22 2ke5 h GLU 41 CO 0.48 0.12 0.34 0.34 -1.40 0.00 0.00 179.01 178.89 2ke5 s ASP 42 N -5.98 4.35 -0.05 1.42 2.15 -1.26 -5.06 116.67 112.23 2ke5 s ASP 42 Ca -0.01 2.10 -0.27 0.00 0.43 0.00 0.00 52.55 54.80 2ke5 s ASP 42 Cb 0.11 -2.56 0.06 0.00 -0.30 0.00 0.00 42.92 40.23 2ke5 s ASP 42 CO 0.58 -2.15 0.60 -0.47 -0.17 0.00 0.00 175.17 173.56 2ke5 s TYR 43 N -2.40 -0.57 0.06 -5.34 5.04 -1.26 -5.17 117.35 107.71 2ke5 s TYR 43 Ca 0.68 0.98 0.06 0.00 -2.44 0.00 0.00 57.07 56.35 2ke5 s TYR 43 Cb -0.23 0.34 -0.03 0.00 0.35 0.00 0.00 41.96 42.40 2ke5 s TYR 43 CO 0.48 -0.55 -0.16 -1.21 -1.34 0.00 0.00 175.55 172.77 2ke5 s GLU 44 N -1.15 1.02 0.69 4.97 2.02 -1.26 -5.15 118.70 119.85 2ke5 s GLU 44 Ca -0.11 -0.90 -0.12 0.00 0.02 0.00 0.00 54.97 53.86 2ke5 s GLU 44 Cb -0.01 -1.09 0.01 0.00 0.10 0.00 0.00 34.13 33.14 2ke5 s GLU 44 CO 0.08 0.26 1.08 -2.14 0.02 0.00 0.00 175.26 174.57 2ke5 s PRO 45 N -1.40 2.76 -0.45 0.39 0.02 -1.26 -4.99 135.00 130.08 2ke5 s PRO 45 Ca 0.03 1.16 -0.27 0.00 0.02 0.00 0.00 61.00 61.94 2ke5 s PRO 45 Cb -0.09 -1.96 0.03 0.00 0.02 0.00 0.00 34.50 32.50 2ke5 s PRO 45 CO 0.02 -1.25 1.00 0.99 -0.33 0.00 0.00 177.00 177.43 2ke5 s THR 46 N -2.74 4.40 -0.23 0.99 2.01 -1.26 -4.90 115.64 113.90 2ke5 s THR 46 Ca 0.62 1.00 0.00 0.00 0.31 0.00 0.00 61.69 63.62 2ke5 s THR 46 Cb -0.17 -4.48 0.23 0.00 0.01 0.00 0.00 72.50 68.10 2ke5 s THR 46 CO 0.49 -0.84 1.71 2.29 -0.69 0.00 0.00 174.62 177.58 2ke5 n LYS 47 N 7.32 1.62 -1.09 4.92 2.85 -1.26 -4.77 118.16 127.76 2ke5 n LYS 47 Ca 0.08 -1.32 -0.03 0.00 -1.05 0.00 0.00 58.31 56.00 2ke5 n LYS 47 Cb 0.49 -1.52 -0.01 0.00 -0.65 0.00 0.00 35.03 33.34 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 0.15 -0.05 -2.71 0.58 0.00 -1.26 -4.96 120.51 112.27 2ke5 n ALA 48 Ca 0.26 0.05 -0.36 0.00 0.00 0.00 0.00 53.44 53.39 2ke5 n ALA 48 Cb 0.78 -1.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.85 2ke5 n ALA 48 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ke5 s ASP 49 N -2.15 6.20 0.31 0.00 2.15 -1.26 -5.09 116.67 116.83 2ke5 s ASP 49 Ca 0.00 0.22 -0.00 0.00 0.43 0.00 0.00 52.55 53.20 2ke5 s ASP 49 Cb 0.00 -2.10 -0.04 0.00 -0.30 0.00 0.00 42.92 40.48 2ke5 s ASP 49 CO 0.00 0.13 0.51 -0.44 -0.17 0.00 0.00 175.17 175.21 2ke5 s SER 50 N 0.60 6.33 -0.07 -0.34 0.01 -1.26 -4.91 113.70 114.05 2ke5 s SER 50 Ca 0.09 0.45 -0.05 0.00 1.31 0.00 0.00 55.95 57.75 2ke5 s SER 50 Cb -0.12 -2.03 -0.04 0.00 0.21 0.00 0.00 66.02 64.04 2ke5 s SER 50 CO 0.01 -0.23 0.16 -0.31 0.41 0.00 0.00 173.24 173.27 2ke5 s TYR 51 N -2.20 3.57 -0.15 2.43 2.02 -0.52 -4.97 117.35 117.54 2ke5 s TYR 51 Ca 0.40 0.45 -0.14 0.00 -0.37 0.00 0.00 57.07 57.41 2ke5 s TYR 51 Cb -0.10 -1.89 0.04 0.00 -0.40 0.00 0.00 41.96 39.61 2ke5 s TYR 51 CO 0.34 0.70 0.39 0.50 -1.57 0.00 0.00 175.55 175.91 2ke5 s ARG 52 N -1.41 0.47 0.20 -0.62 3.52 -1.26 -1.70 118.95 118.15 2ke5 s ARG 52 Ca 0.20 0.54 -0.18 0.00 -0.13 0.00 0.00 55.73 56.16 2ke5 s ARG 52 Cb -0.12 0.23 0.03 0.00 -1.56 0.00 0.00 34.95 33.52 2ke5 s ARG 52 CO 0.10 -0.06 0.54 -1.59 -0.81 0.00 0.00 175.30 173.49 2ke5 s LYS 53 N 0.18 1.41 -0.20 5.12 -2.85 -1.14 -4.99 119.74 117.27 2ke5 s LYS 53 Ca -0.00 -0.86 -0.17 0.00 -1.00 0.00 0.00 55.97 53.94 2ke5 s LYS 53 Cb -0.03 0.53 -0.04 0.00 -2.06 0.00 0.00 37.83 36.24 2ke5 s LYS 53 CO 0.01 -0.60 0.46 0.15 0.10 0.00 0.00 175.35 175.46 2ke5 s LYS 54 N -3.87 4.18 0.05 1.78 1.02 -1.26 -2.02 119.74 119.61 2ke5 s LYS 54 Ca 0.09 0.31 0.03 0.00 0.02 0.00 0.00 55.97 56.42 2ke5 s LYS 54 Cb -0.01 -3.55 -0.03 0.00 -0.52 0.00 0.00 37.83 33.72 2ke5 s LYS 54 CO -0.02 -0.09 -0.09 0.14 -0.92 0.00 0.00 175.35 174.36 2ke5 s VAL 55 N 1.47 0.67 -0.00 3.17 -7.23 -0.85 -5.02 120.40 112.62 2ke5 s VAL 55 Ca 0.22 -1.14 -0.08 0.00 -1.81 0.00 0.00 61.98 59.17 2ke5 s VAL 55 Cb -0.15 -0.73 -0.05 0.00 0.56 0.00 0.00 36.38 36.01 2ke5 s VAL 55 CO 0.09 -0.35 0.28 -0.69 -0.31 0.00 0.00 175.10 174.11 2ke5 s VAL 56 N -1.39 5.28 -0.21 1.32 1.01 -1.26 -0.62 120.40 124.53 2ke5 s VAL 56 Ca -0.08 0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 2ke5 s VAL 56 Cb -0.10 -3.57 0.09 0.00 0.00 0.00 0.00 36.38 32.80 2ke5 s VAL 56 CO 0.01 0.41 0.18 -0.22 0.00 0.00 0.00 175.10 175.48 2ke5 s LEU 57 N -1.62 0.08 -1.34 3.92 2.96 -0.11 -4.86 118.68 117.71 2ke5 s LEU 57 Ca 0.26 -0.48 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 2ke5 s LEU 57 Cb -0.13 0.14 0.01 0.00 0.50 0.00 0.00 46.19 46.70 2ke5 s LEU 57 CO 0.14 -0.35 0.09 0.47 -1.32 0.00 0.00 176.35 175.39 2ke5 n ASP 58 N 5.30 -4.69 0.00 3.68 9.92 -1.26 -1.18 116.55 128.33 2ke5 n ASP 58 Ca -0.06 0.04 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 2ke5 n ASP 58 Cb 0.48 -3.92 0.00 0.00 -0.64 0.00 0.00 41.12 37.04 2ke5 n ASP 58 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ke5 n GLY 59 N -0.96 3.09 3.63 0.44 0.00 -1.26 -5.02 105.19 105.11 2ke5 n GLY 59 Ca -0.16 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.58 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 4.03 -0.33 1.61 2.12 -0.32 -5.00 118.70 120.80 2ke5 s GLU 60 Ca 0.00 1.01 -0.25 0.00 0.36 0.00 0.00 54.97 56.09 2ke5 s GLU 60 Cb 0.00 -3.75 0.01 0.00 0.26 0.00 0.00 34.13 30.65 2ke5 s GLU 60 CO 0.00 -0.93 0.87 -2.00 -0.54 0.00 0.00 175.26 172.66 2ke5 s GLU 61 N 3.68 3.91 0.15 4.30 2.12 -1.26 -0.93 118.70 130.67 2ke5 s GLU 61 Ca 0.45 0.62 0.08 0.00 0.36 0.00 0.00 54.97 56.48 2ke5 s GLU 61 Cb -0.12 -3.76 -0.04 0.00 0.26 0.00 0.00 34.13 30.47 2ke5 s GLU 61 CO 0.16 -0.82 -0.18 0.14 -0.54 0.00 0.00 175.26 174.03 2ke5 s VAL 62 N 3.24 1.71 0.14 3.70 -7.23 0.21 -4.60 120.40 117.57 2ke5 s VAL 62 Ca 0.36 -1.85 -0.16 0.00 -1.81 0.00 0.00 61.98 58.52 2ke5 s VAL 62 Cb -0.13 -1.76 -0.07 0.00 0.56 0.00 0.00 36.38 34.98 2ke5 s VAL 62 CO 0.15 -0.31 0.58 -1.10 -0.31 0.00 0.00 175.10 174.11 2ke5 s GLN 63 N -2.70 4.07 0.04 4.82 -0.21 -0.70 -2.00 119.66 122.97 2ke5 s GLN 63 Ca 0.14 0.60 0.06 0.00 0.02 0.00 0.00 55.36 56.18 2ke5 s GLN 63 Cb -0.06 -2.99 -0.03 0.00 1.00 0.00 0.00 33.01 30.92 2ke5 s GLN 63 CO 0.06 0.50 -0.13 -1.50 -2.12 0.00 0.00 175.29 172.10 2ke5 s ILE 64 N -1.39 3.18 -0.11 1.08 2.07 -0.86 -1.51 121.20 123.66 2ke5 s ILE 64 Ca 0.36 -1.06 -0.00 0.00 -1.41 0.00 0.00 60.65 58.54 2ke5 s ILE 64 Cb -0.16 -2.38 0.02 0.00 0.13 0.00 0.00 42.46 40.07 2ke5 s ILE 64 CO 0.19 0.32 -0.08 -0.62 -1.91 0.00 0.00 174.94 172.83 2ke5 s ASP 65 N -1.57 2.15 -0.02 4.50 -1.08 0.82 -2.87 116.67 118.61 2ke5 s ASP 65 Ca 0.17 -0.31 0.08 0.00 -0.52 0.00 0.00 52.55 51.96 2ke5 s ASP 65 Cb -0.11 -0.86 -0.02 0.00 -1.46 0.00 0.00 42.92 40.48 2ke5 s ASP 65 CO 0.07 -0.10 -0.25 -0.63 0.52 0.00 0.00 175.17 174.78 2ke5 s ILE 66 N 1.57 2.12 -0.08 4.11 1.01 -0.69 -0.90 121.20 128.34 2ke5 s ILE 66 Ca 0.03 -1.09 -0.03 0.00 0.00 0.00 0.00 60.65 59.55 2ke5 s ILE 66 Cb -0.13 -1.73 0.05 0.00 0.01 0.00 0.00 42.46 40.65 2ke5 s ILE 66 CO -0.07 0.57 0.16 -0.22 0.00 0.00 0.00 174.94 175.38 2ke5 s LEU 67 N -0.64 0.11 0.10 2.97 1.98 -1.25 -1.44 118.68 120.51 2ke5 s LEU 67 Ca 0.10 0.33 -0.13 0.00 -2.89 0.00 0.00 54.13 51.55 2ke5 s LEU 67 Cb -0.10 0.31 -0.06 0.00 0.66 0.00 0.00 46.19 46.99 2ke5 s LEU 67 CO -0.01 -0.22 0.48 -0.62 -1.89 0.00 0.00 176.35 174.09 2ke5 s ASP 68 N 2.03 6.76 -0.15 3.68 -1.08 -1.26 -4.28 116.67 122.37 2ke5 s ASP 68 Ca 0.00 0.96 0.01 0.00 -0.52 0.00 0.00 52.55 53.00 2ke5 s ASP 68 Cb -0.12 -2.24 -0.10 0.00 -1.46 0.00 0.00 42.92 39.00 2ke5 s ASP 68 CO -0.06 0.16 -0.14 0.35 0.52 0.00 0.00 175.17 176.01 2ke5 n THR 69 N 1.00 0.87 -3.71 1.71 -2.24 -1.26 -4.87 114.28 105.78 2ke5 n THR 69 Ca -0.08 -0.33 0.04 0.00 -2.27 0.00 0.00 64.05 61.42 2ke5 n THR 69 Cb 0.52 -1.08 -0.01 0.00 -2.10 0.00 0.00 70.33 67.66 2ke5 n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ke5 n ALA 70 N -2.99 -0.89 -1.90 6.98 0.00 -1.26 -4.32 120.51 116.13 2ke5 n ALA 70 Ca -0.27 0.10 -0.35 0.00 0.00 0.00 0.00 53.44 52.92 2ke5 n ALA 70 Cb 0.78 -0.30 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 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 -5.69 -0.01 -0.00 0.00 0.00 -1.26 -4.78 107.32 95.58 2ke5 s GLY 71 Ca 0.00 -0.61 0.02 0.00 0.00 0.00 0.00 44.72 44.13 2ke5 s GLY 71 CO 0.00 3.64 0.99 1.04 0.00 0.00 0.00 173.10 178.77 2ke5 n LEU 72 N 13.95 0.38 0.00 0.66 4.77 -1.26 -4.83 117.00 130.67 2ke5 n LEU 72 Ca 0.28 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2ke5 n LEU 72 Cb 0.52 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2ke5 n LEU 72 CO 0.69 0.09 0.00 -0.62 -1.33 0.00 0.00 177.39 176.22 2ke5 n GLU 73 N -0.31 -1.05 -1.51 3.23 -0.58 -1.26 -4.52 120.64 114.63 2ke5 n GLU 73 Ca 0.02 0.26 0.00 0.00 -0.42 0.00 0.00 57.16 57.02 2ke5 n GLU 73 Cb 0.07 -4.52 0.00 0.00 -0.57 0.00 0.00 31.44 26.42 2ke5 n GLU 73 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2ke5 n ASP 74 N -0.53 -8.08 -0.24 1.62 -0.08 -1.26 -5.10 116.55 102.88 2ke5 n ASP 74 Ca 0.00 1.12 0.00 0.00 -1.51 0.00 0.00 54.79 54.40 2ke5 n ASP 74 Cb 0.26 -4.06 0.00 0.00 2.34 0.00 0.00 41.12 39.67 2ke5 n ASP 74 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2ke5 n TYR 75 N 0.01 -0.08 0.05 -0.67 4.01 -1.26 -5.06 117.16 114.16 2ke5 n TYR 75 Ca 0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.63 2ke5 n TYR 75 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 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 1.33 -0.35 0.00 -0.72 0.00 -1.99 -3.42 119.26 114.11 2ke5 h ALA 76 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2ke5 h ALA 76 Cb 0.00 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2ke5 h ALA 76 CO 0.00 -0.77 -0.04 0.00 0.00 0.00 0.00 179.25 178.45 2ke5 n ALA 77 N -2.70 0.52 0.25 0.00 0.00 -1.26 -4.97 120.51 112.35 2ke5 n ALA 77 Ca -0.04 -0.09 0.18 0.00 0.00 0.00 0.00 53.44 53.49 2ke5 n ALA 77 Cb 0.30 -0.10 0.91 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 1.68 0.31 -0.19 0.00 2.04 -1.99 -1.74 117.51 117.62 2ke5 h ILE 78 Ca -0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2ke5 h ILE 78 Cb 0.51 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 2ke5 h ILE 78 CO -0.04 0.00 0.12 0.03 0.00 0.00 0.00 178.15 178.26 2ke5 h ARG 79 N 0.00 0.25 -0.43 2.37 2.47 -1.93 -2.62 114.38 114.48 2ke5 h ARG 79 Ca 0.05 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.73 2ke5 h ARG 79 Cb 0.41 -0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 2ke5 h ARG 79 CO -0.00 0.18 0.16 -0.44 0.56 0.00 0.00 179.97 180.42 2ke5 h ASP 80 N 0.24 0.56 -0.82 7.04 3.32 -1.66 -2.50 116.42 122.60 2ke5 h ASP 80 Ca 0.07 -0.07 0.14 0.00 0.02 0.00 0.00 57.03 57.19 2ke5 h ASP 80 Cb -0.01 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 39.33 2ke5 h ASP 80 CO -0.01 0.53 0.54 0.78 -1.72 0.00 0.00 179.24 179.35 2ke5 h ASN 81 N 0.62 0.55 0.18 6.45 -0.26 -1.45 -1.20 115.58 120.47 2ke5 h ASN 81 Ca 0.15 0.03 -0.27 0.00 -0.56 0.00 0.00 56.30 55.65 2ke5 h ASN 81 Cb 0.15 -0.08 0.02 0.00 -1.06 0.00 0.00 38.32 37.35 2ke5 h ASN 81 CO -0.01 0.29 -1.10 1.88 -1.06 0.00 0.00 177.43 177.42 2ke5 h TYR 82 N 0.59 0.88 0.00 1.19 0.05 -1.43 -3.16 116.97 115.09 2ke5 h TYR 82 Ca 0.41 -0.52 0.00 0.00 0.05 0.00 0.00 58.73 58.67 2ke5 h TYR 82 Cb 0.74 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.39 2ke5 h TYR 82 CO -0.00 1.36 0.00 0.74 -1.05 0.00 0.00 178.16 179.20 2ke5 h PHE 83 N 0.29 0.00 -0.19 4.88 0.04 -1.18 -2.59 116.94 118.20 2ke5 h PHE 83 Ca -0.14 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.43 2ke5 h PHE 83 Cb 1.76 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.92 2ke5 h PHE 83 CO 0.09 0.00 -0.68 0.00 -0.60 0.00 0.00 178.31 177.12 2ke5 h ARG 84 N 0.00 0.75 0.00 1.51 3.08 -1.23 -2.85 114.38 115.65 2ke5 h ARG 84 Ca 0.00 -0.55 0.00 0.00 0.07 0.00 0.00 59.98 59.50 2ke5 h ARG 84 Cb 0.36 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2ke5 h ARG 84 CO 0.00 1.17 0.00 -1.13 -1.07 0.00 0.00 179.97 178.94 2ke5 n SER 85 N -3.95 0.00 -4.64 7.04 3.41 -0.98 -4.80 113.62 109.70 2ke5 n SER 85 Ca -0.06 -1.07 -0.25 0.00 -0.26 0.00 0.00 58.87 57.23 2ke5 n SER 85 Cb 0.69 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.55 2ke5 n SER 85 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2ke5 s GLY 86 N -1.82 2.21 0.00 5.00 0.00 -1.08 -5.00 107.32 106.64 2ke5 s GLY 86 Ca 0.34 -2.06 -0.00 0.00 0.00 0.00 0.00 44.72 42.99 2ke5 s GLY 86 CO 0.26 -1.95 -0.00 1.18 0.00 0.00 0.00 173.10 172.59 2ke5 n GLU 87 N -1.00 0.00 -2.57 2.90 -0.58 -0.84 -4.96 120.64 113.59 2ke5 n GLU 87 Ca -0.04 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.42 2ke5 n GLU 87 Cb 0.64 -0.17 -0.01 0.00 -0.57 0.00 0.00 31.44 31.33 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 -3.00 1.65 0.02 0.62 0.00 0.61 -4.81 107.32 102.40 2ke5 s GLY 88 Ca -0.00 -0.35 0.07 0.00 0.00 0.00 0.00 44.72 44.44 2ke5 s GLY 88 CO 0.00 -0.16 -0.20 -1.36 0.00 0.00 0.00 173.10 171.38 2ke5 s PHE 89 N -2.71 1.80 -0.28 1.90 0.08 -0.80 -2.14 117.98 115.82 2ke5 s PHE 89 Ca 0.50 -0.36 0.01 0.00 0.12 0.00 0.00 56.93 57.19 2ke5 s PHE 89 Cb -0.10 -1.10 0.08 0.00 -0.57 0.00 0.00 43.02 41.32 2ke5 s PHE 89 CO 0.43 0.04 0.02 -1.17 -0.10 0.00 0.00 175.22 174.44 2ke5 s LEU 90 N -0.91 2.86 -0.08 -0.37 0.20 -0.87 -2.72 118.68 116.81 2ke5 s LEU 90 Ca 0.07 -1.51 -0.27 0.00 0.69 0.00 0.00 54.13 53.11 2ke5 s LEU 90 Cb -0.08 -1.14 -0.02 0.00 -0.43 0.00 0.00 46.19 44.51 2ke5 s LEU 90 CO 0.01 -0.33 0.89 -0.22 -0.29 0.00 0.00 176.35 176.41 2ke5 s LEU 91 N 1.38 4.29 0.00 -0.68 2.96 0.77 -0.43 118.68 126.97 2ke5 s LEU 91 Ca 0.03 1.42 0.01 0.00 -0.22 0.00 0.00 54.13 55.37 2ke5 s LEU 91 Cb -0.18 -3.38 -0.00 0.00 0.50 0.00 0.00 46.19 43.12 2ke5 s LEU 91 CO -0.13 -0.30 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.87 2ke5 s VAL 92 N 1.43 0.33 0.25 1.68 1.01 -0.50 -0.55 120.40 124.05 2ke5 s VAL 92 Ca 0.45 -0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 2ke5 s VAL 92 Cb -0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 2ke5 s VAL 92 CO 0.20 0.05 0.34 0.72 0.00 0.00 0.00 175.10 176.41 2ke5 s PHE 93 N -0.20 0.84 -0.18 5.22 -0.12 -0.93 -3.81 117.98 118.80 2ke5 s PHE 93 Ca 0.01 -1.10 -0.06 0.00 -0.05 0.00 0.00 56.93 55.72 2ke5 s PHE 93 Cb -0.02 -0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 42.16 2ke5 s PHE 93 CO -0.00 -0.88 0.04 -1.12 -0.05 0.00 0.00 175.22 173.21 2ke5 s SER 94 N -3.12 5.41 0.53 1.98 0.01 -1.26 -1.39 113.70 115.85 2ke5 s SER 94 Ca 0.31 0.02 0.27 0.00 1.31 0.00 0.00 55.95 57.86 2ke5 s SER 94 Cb 0.02 -1.92 1.51 0.00 0.21 0.00 0.00 66.02 65.84 2ke5 s SER 94 CO 0.13 0.17 2.11 0.16 0.41 0.00 0.00 173.24 176.22 2ke5 h ILE 95 N 4.95 0.60 0.00 1.44 3.07 -1.86 -0.92 117.51 124.79 2ke5 h ILE 95 Ca -0.35 -0.41 0.00 0.00 1.55 0.00 0.00 64.86 65.65 2ke5 h ILE 95 Cb 1.17 1.26 0.00 0.00 -0.27 0.00 0.00 36.82 38.98 2ke5 h ILE 95 CO 0.68 0.09 -0.44 1.07 -1.05 0.00 0.00 178.15 178.51 2ke5 n THR 96 N -3.75 0.36 -3.77 0.16 5.66 -1.26 -1.05 114.28 110.64 2ke5 n THR 96 Ca -0.02 -0.24 -0.36 0.00 -3.05 0.00 0.00 64.05 60.38 2ke5 n THR 96 Cb 0.20 -0.22 -0.11 0.00 -1.55 0.00 0.00 70.33 68.65 2ke5 n THR 96 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2ke5 s GLU 97 N -3.13 2.29 0.43 1.09 0.41 -0.35 -4.49 118.70 114.95 2ke5 s GLU 97 Ca 0.08 -2.27 0.30 0.00 -0.41 0.00 0.00 54.97 52.67 2ke5 s GLU 97 Cb 0.14 -3.63 1.52 0.00 -1.78 0.00 0.00 34.13 30.37 2ke5 s GLU 97 CO 0.68 -1.13 1.90 1.25 -0.49 0.00 0.00 175.26 177.48 2ke5 h HIS 98 N 7.36 0.00 0.00 1.61 -0.00 -1.81 -0.98 115.15 121.33 2ke5 h HIS 98 Ca -0.06 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.22 2ke5 h HIS 98 Cb 0.98 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.38 2ke5 h HIS 98 CO 0.63 0.00 -0.44 0.93 -0.00 0.00 0.00 177.93 179.05 2ke5 h GLU 99 N 0.00 0.00 0.08 5.26 5.08 -1.91 -3.18 114.58 119.91 2ke5 h GLU 99 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ke5 h GLU 99 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2ke5 h GLU 99 CO 0.00 0.44 -0.04 0.77 -1.00 0.00 0.00 179.01 179.18 2ke5 h SER 100 N 0.00 -0.09 -0.84 1.42 0.02 -1.47 -3.05 113.55 109.54 2ke5 h SER 100 Ca -0.00 -0.49 0.21 0.00 -0.84 0.00 0.00 61.79 60.66 2ke5 h SER 100 Cb 1.01 0.02 -0.05 0.00 0.14 0.00 0.00 62.40 63.53 2ke5 h SER 100 CO 0.06 0.57 0.57 0.15 -1.14 0.00 0.00 176.83 177.04 2ke5 h PHE 101 N -0.89 0.32 0.17 3.45 3.04 -1.63 0.12 116.94 121.52 2ke5 h PHE 101 Ca -0.01 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 2ke5 h PHE 101 Cb 0.58 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 38.99 2ke5 h PHE 101 CO 0.13 0.09 -0.08 1.79 -2.02 0.00 0.00 178.31 178.22 2ke5 h THR 102 N 0.25 0.83 -0.43 4.41 1.35 -1.62 -3.19 112.91 114.51 2ke5 h THR 102 Ca 0.42 -1.12 -0.08 0.00 -0.55 0.00 0.00 66.41 65.08 2ke5 h THR 102 Cb 1.26 1.39 -0.02 0.00 -1.73 0.00 0.00 68.15 69.05 2ke5 h THR 102 CO -0.10 0.21 -0.07 0.00 -0.25 0.00 0.00 175.52 175.31 2ke5 h ALA 103 N -0.32 1.07 -0.94 6.62 0.00 -1.35 -2.62 119.26 121.73 2ke5 h ALA 103 Ca -0.02 -0.29 0.16 0.00 0.00 0.00 0.00 54.91 54.76 2ke5 h ALA 103 Cb 0.52 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.06 2ke5 h ALA 103 CO 0.04 0.57 0.60 1.79 0.00 0.00 0.00 179.25 182.25 2ke5 h THR 104 N 0.68 0.79 -0.01 0.00 1.35 -0.87 0.25 112.91 115.09 2ke5 h THR 104 Ca 0.12 -0.24 -0.16 0.00 -0.55 0.00 0.00 66.41 65.57 2ke5 h THR 104 Cb 0.52 0.02 -0.02 0.00 -1.73 0.00 0.00 68.15 66.94 2ke5 h THR 104 CO 0.03 0.13 -0.76 0.00 -0.25 0.00 0.00 175.52 174.66 2ke5 h ALA 105 N 1.60 0.72 -0.02 6.62 0.00 -1.46 -3.09 119.26 123.63 2ke5 h ALA 105 Ca 0.49 -0.68 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 2ke5 h ALA 105 Cb 0.82 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2ke5 h ALA 105 CO -0.26 0.91 -0.55 1.49 0.00 0.00 0.00 179.25 180.85 2ke5 h GLU 106 N 0.04 0.06 0.00 0.00 4.57 -0.37 -2.94 114.58 115.94 2ke5 h GLU 106 Ca -0.02 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.09 2ke5 h GLU 106 Cb 1.35 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.93 2ke5 h GLU 106 CO 0.10 0.59 -0.17 0.74 -1.18 0.00 0.00 179.01 179.10 2ke5 h PHE 107 N 0.05 0.00 -1.01 0.92 -1.00 -0.80 -2.99 116.94 112.10 2ke5 h PHE 107 Ca -0.00 0.00 0.24 0.00 2.81 0.00 0.00 57.97 61.02 2ke5 h PHE 107 Cb 0.98 0.00 -0.10 0.00 3.61 0.00 0.00 35.95 40.44 2ke5 h PHE 107 CO 0.01 0.17 0.64 0.00 -1.61 0.00 0.00 178.31 177.52 2ke5 h ARG 108 N 0.00 0.47 -0.38 1.51 3.08 -1.57 0.33 114.38 117.82 2ke5 h ARG 108 Ca -0.00 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 2ke5 h ARG 108 Cb 0.51 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 2ke5 h ARG 108 CO 0.02 0.31 -0.19 0.93 -1.07 0.00 0.00 179.97 179.98 2ke5 h GLU 109 N 0.49 0.72 0.00 0.04 4.39 -1.73 -2.51 114.58 115.99 2ke5 h GLU 109 Ca 0.59 -0.27 -0.08 0.00 0.34 0.00 0.00 59.36 59.94 2ke5 h GLU 109 Cb 1.32 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.91 2ke5 h GLU 109 CO -0.32 0.86 -0.38 1.96 -1.16 0.00 0.00 179.01 179.97 2ke5 h GLN 110 N 0.64 0.00 -0.29 2.33 1.08 -0.57 -2.97 115.11 115.34 2ke5 h GLN 110 Ca 0.10 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.15 2ke5 h GLN 110 Cb 0.67 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.09 2ke5 h GLN 110 CO 0.05 0.38 -0.42 0.82 -0.95 0.00 0.00 178.83 178.71 2ke5 h ILE 111 N 0.00 1.29 0.00 2.54 2.04 -0.72 -2.97 117.51 119.69 2ke5 h ILE 111 Ca -0.00 -1.59 -0.05 0.00 1.00 0.00 0.00 64.86 64.21 2ke5 h ILE 111 Cb 0.84 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 2ke5 h ILE 111 CO 0.05 0.51 -0.25 -0.07 0.00 0.00 0.00 178.15 178.39 2ke5 h LEU 112 N 0.57 0.00 -0.38 1.44 3.38 -1.32 -3.21 115.31 115.79 2ke5 h LEU 112 Ca 0.04 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.09 2ke5 h LEU 112 Cb 0.96 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.62 2ke5 h LEU 112 CO 0.09 0.25 -0.18 0.03 0.09 0.00 0.00 178.44 178.72 2ke5 h ARG 113 N 0.00 -0.11 -0.27 1.13 2.47 -1.49 -0.26 114.38 115.85 2ke5 h ARG 113 Ca -0.00 0.01 -0.07 0.00 -1.26 0.00 0.00 59.98 58.66 2ke5 h ARG 113 Cb 0.60 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.93 2ke5 h ARG 113 CO 0.03 -0.07 -0.12 -0.39 0.56 0.00 0.00 179.97 179.97 2ke5 h VAL 114 N -0.12 1.22 -2.14 2.04 -1.51 -1.71 -3.09 116.25 110.94 2ke5 h VAL 114 Ca 0.19 -0.98 -0.70 0.00 -1.23 0.00 0.00 66.70 63.98 2ke5 h VAL 114 Cb 0.40 1.16 -0.34 0.00 -2.13 0.00 0.00 31.29 30.38 2ke5 h VAL 114 CO -0.45 0.32 0.20 0.29 -1.23 0.00 0.00 177.57 176.69 2ke5 n LYS 115 N -4.21 4.04 -0.33 5.19 4.76 -0.34 -4.85 118.16 122.42 2ke5 n LYS 115 Ca 0.00 -4.58 0.15 0.00 -2.87 0.00 0.00 58.31 51.01 2ke5 n LYS 115 Cb 0.31 -2.33 0.34 0.00 -1.84 0.00 0.00 35.03 31.51 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 3.39 1.59 -0.37 7.82 0.00 -1.03 0.38 119.26 131.05 2ke5 h ALA 116 Ca 0.36 0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.46 2ke5 h ALA 116 Cb 0.42 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 2ke5 h ALA 116 CO 1.04 -0.27 0.07 0.93 0.00 0.00 0.00 179.25 181.02 2ke5 h GLU 117 N 0.52 0.19 -5.33 0.00 5.08 -1.88 -3.48 114.58 109.67 2ke5 h GLU 117 Ca 0.59 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.94 2ke5 h GLU 117 Cb 1.09 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.22 2ke5 h GLU 117 CO -0.48 0.12 -1.17 -1.91 -1.00 0.00 0.00 179.01 174.57 2ke5 n GLU 118 N -5.10 -3.55 0.00 2.33 2.13 0.12 -5.02 120.64 111.56 2ke5 n GLU 118 Ca 0.02 2.78 0.00 0.00 0.66 0.00 0.00 57.16 60.62 2ke5 n GLU 118 Cb 0.17 -4.10 0.00 0.00 0.27 0.00 0.00 31.44 27.78 2ke5 n GLU 118 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2ke5 n ASP 119 N 1.67 1.00 -3.11 4.31 9.92 -1.26 -4.98 116.55 124.10 2ke5 n ASP 119 Ca -0.25 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 53.84 2ke5 n ASP 119 Cb 0.41 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.85 2ke5 n ASP 119 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2ke5 n LYS 120 N -2.43 0.41 -2.65 -1.24 4.76 -1.26 -4.50 118.16 111.25 2ke5 n LYS 120 Ca 0.00 -2.69 -0.43 0.00 -2.87 0.00 0.00 58.31 52.32 2ke5 n LYS 120 Cb 0.27 -1.53 -0.03 0.00 -1.84 0.00 0.00 35.03 31.90 2ke5 n LYS 120 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ke5 s ILE 121 N 0.22 4.20 -0.61 -0.18 -1.09 -1.26 -4.50 121.20 117.98 2ke5 s ILE 121 Ca 0.32 0.96 -0.26 0.00 -2.23 0.00 0.00 60.65 59.45 2ke5 s ILE 121 Cb 0.06 -4.61 0.04 0.00 -1.58 0.00 0.00 42.46 36.37 2ke5 s ILE 121 CO -0.14 -1.10 1.08 -2.16 -1.23 0.00 0.00 174.94 171.39 2ke5 s PRO 122 N 4.46 3.33 0.32 2.79 0.04 -1.26 -5.01 135.00 139.66 2ke5 s PRO 122 Ca 0.43 -0.18 0.10 0.00 0.04 0.00 0.00 61.00 61.39 2ke5 s PRO 122 Cb -0.08 -4.09 -0.05 0.00 0.04 0.00 0.00 34.50 30.32 2ke5 s PRO 122 CO 0.28 -1.71 -0.03 -1.17 0.04 0.00 0.00 177.00 174.40 2ke5 s LEU 123 N 4.60 2.94 -0.28 -3.56 2.96 -1.26 -1.91 118.68 122.17 2ke5 s LEU 123 Ca 0.34 -0.95 -0.10 0.00 -0.22 0.00 0.00 54.13 53.20 2ke5 s LEU 123 Cb -0.11 -1.36 0.12 0.00 0.50 0.00 0.00 46.19 45.34 2ke5 s LEU 123 CO 0.19 -0.14 0.61 -0.22 -1.32 0.00 0.00 176.35 175.47 2ke5 s LEU 124 N -3.67 -1.03 -0.12 -0.68 2.96 -1.10 -4.85 118.68 110.20 2ke5 s LEU 124 Ca 0.33 1.47 -0.07 0.00 -0.22 0.00 0.00 54.13 55.64 2ke5 s LEU 124 Cb -0.02 2.15 -0.04 0.00 0.50 0.00 0.00 46.19 48.78 2ke5 s LEU 124 CO 0.19 -0.22 0.15 0.54 -1.32 0.00 0.00 176.35 175.68 2ke5 s VAL 125 N 2.70 5.49 0.01 1.68 0.11 -1.26 -0.16 120.40 128.96 2ke5 s VAL 125 Ca -0.06 0.24 -0.07 0.00 -2.93 0.00 0.00 61.98 59.16 2ke5 s VAL 125 Cb -0.11 -3.42 -0.00 0.00 -1.53 0.00 0.00 36.38 31.32 2ke5 s VAL 125 CO -0.18 0.61 0.12 -0.69 -3.33 0.00 0.00 175.10 171.64 2ke5 s VAL 126 N -1.00 0.09 -0.13 2.04 1.01 0.29 -2.98 120.40 119.72 2ke5 s VAL 126 Ca 0.15 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.41 2ke5 s VAL 126 Cb -0.12 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 35.81 2ke5 s VAL 126 CO 0.04 -0.41 -0.18 -0.83 0.00 0.00 0.00 175.10 173.73 2ke5 s GLY 127 N -1.46 1.19 0.00 4.51 0.00 -0.88 -2.18 107.32 108.50 2ke5 s GLY 127 Ca -0.14 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.67 2ke5 s GLY 127 CO 0.01 0.16 0.00 1.16 0.00 0.00 0.00 173.10 174.43 2ke5 n ASN 128 N 4.22 0.00 -1.52 1.64 6.94 -0.49 -1.47 115.26 124.57 2ke5 n ASN 128 Ca -0.19 -0.44 -0.17 0.00 -0.02 0.00 0.00 54.58 53.76 2ke5 n ASN 128 Cb 0.51 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.86 2ke5 n ASN 128 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2ke5 n LYS 129 N -0.44 -1.39 0.23 -3.83 4.76 -1.25 -3.52 118.16 112.72 2ke5 n LYS 129 Ca 0.00 0.99 0.16 0.00 -2.87 0.00 0.00 58.31 56.59 2ke5 n LYS 129 Cb 0.00 -5.31 0.83 0.00 -1.84 0.00 0.00 35.03 28.71 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 0.00 4.39 0.02 -1.78 -0.81 113.55 115.37 2ke5 h SER 130 Ca -0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2ke5 h SER 130 Cb 1.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2ke5 h SER 130 CO 0.50 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.29 2ke5 n ASP 131 N -2.62 0.29 -3.78 3.07 5.68 -1.26 -4.29 116.55 113.64 2ke5 n ASP 131 Ca -0.02 -1.95 -0.28 0.00 -0.50 0.00 0.00 54.79 52.04 2ke5 n ASP 131 Cb 0.08 -0.14 -0.11 0.00 -1.14 0.00 0.00 41.12 39.80 2ke5 n ASP 131 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2ke5 n LEU 132 N -0.35 2.48 0.26 -2.12 4.77 -0.31 -4.90 117.00 116.83 2ke5 n LEU 132 Ca 0.00 -5.09 0.16 0.00 -0.03 0.00 0.00 56.01 51.05 2ke5 n LEU 132 Cb 0.07 -0.53 0.54 0.00 -2.33 0.00 0.00 43.42 41.18 2ke5 n LEU 132 CO 0.00 1.80 0.94 -0.33 -1.33 0.00 0.00 177.39 178.47 2ke5 h GLU 133 N 5.32 0.00 0.10 3.23 5.08 -1.85 -2.57 114.58 123.89 2ke5 h GLU 133 Ca 0.17 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.17 2ke5 h GLU 133 Cb 0.77 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 2ke5 h GLU 133 CO 0.67 0.00 -2.03 -0.85 -1.00 0.00 0.00 179.01 175.80 2ke5 n GLU 134 N -3.10 0.74 -0.01 2.33 0.28 -1.26 -4.05 120.64 115.57 2ke5 n GLU 134 Ca 0.02 0.25 0.13 0.00 -0.16 0.00 0.00 57.16 57.39 2ke5 n GLU 134 Cb 0.37 -1.69 0.69 0.00 1.43 0.00 0.00 31.44 32.24 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 -3.40 1.14 -1.82 3.44 1.74 -1.21 -4.82 116.66 111.72 2ke5 n ARG 135 Ca -0.32 -0.20 -0.42 0.00 -0.77 0.00 0.00 57.85 56.14 2ke5 n ARG 135 Cb 1.04 -1.40 -0.03 0.00 -1.02 0.00 0.00 32.46 31.05 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 -1.98 3.07 -0.08 5.56 3.52 -0.97 -4.11 118.95 123.96 2ke5 s ARG 136 Ca 0.37 1.56 0.08 0.00 -0.13 0.00 0.00 55.73 57.61 2ke5 s ARG 136 Cb 0.18 -4.32 -0.24 0.00 -1.56 0.00 0.00 34.95 29.01 2ke5 s ARG 136 CO 0.29 -2.18 0.52 1.04 -0.81 0.00 0.00 175.30 174.17 2ke5 n GLN 137 N 8.67 0.67 -3.68 5.12 1.13 -0.22 -4.78 117.38 124.30 2ke5 n GLN 137 Ca 0.27 0.26 -0.39 0.00 -1.94 0.00 0.00 57.00 55.20 2ke5 n GLN 137 Cb 0.47 -1.75 -0.12 0.00 0.11 0.00 0.00 30.24 28.96 2ke5 n GLN 137 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2ke5 s VAL 138 N -2.58 4.22 -0.05 5.09 1.01 -0.49 -4.99 120.40 122.61 2ke5 s VAL 138 Ca -0.10 -0.85 -0.37 0.00 0.00 0.00 0.00 61.98 60.66 2ke5 s VAL 138 Cb 0.07 -3.30 -0.15 0.00 0.00 0.00 0.00 36.38 33.00 2ke5 s VAL 138 CO 0.81 -0.12 1.63 -2.65 0.00 0.00 0.00 175.10 174.77 2ke5 n PRO 139 N 4.91 1.57 -0.35 2.72 -0.02 -1.26 -4.83 135.00 137.74 2ke5 n PRO 139 Ca -0.13 0.57 0.15 0.00 -2.02 0.00 0.00 63.50 62.08 2ke5 n PRO 139 Cb 0.46 -2.30 0.35 0.00 -0.02 0.00 0.00 33.50 32.00 2ke5 n PRO 139 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 2ke5 h VAL 140 N 4.45 0.62 -0.17 -1.45 3.04 -1.97 0.19 116.25 120.96 2ke5 h VAL 140 Ca -0.47 -0.23 -0.02 0.00 -1.01 0.00 0.00 66.70 64.97 2ke5 h VAL 140 Cb 1.30 -0.11 -0.01 0.00 -2.01 0.00 0.00 31.29 30.46 2ke5 h VAL 140 CO 0.89 0.12 0.03 -0.33 -1.01 0.00 0.00 177.57 177.27 2ke5 h GLU 141 N 0.67 0.28 -0.14 4.17 5.08 -2.01 -2.64 114.58 119.99 2ke5 h GLU 141 Ca 0.61 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.93 2ke5 h GLU 141 Cb 1.07 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 2ke5 h GLU 141 CO -0.43 0.45 0.10 1.49 -1.00 0.00 0.00 179.01 179.61 2ke5 h GLU 142 N 0.06 0.05 0.00 2.33 4.81 -1.38 -0.04 114.58 120.41 2ke5 h GLU 142 Ca 0.05 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.18 2ke5 h GLU 142 Cb 0.31 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2ke5 h GLU 142 CO 0.00 0.04 -0.47 0.00 -0.73 0.00 0.00 179.01 177.85 2ke5 h ALA 143 N 1.93 1.08 -0.07 2.92 0.00 -0.81 -3.01 119.26 121.31 2ke5 h ALA 143 Ca 0.06 -0.43 -0.19 0.00 0.00 0.00 0.00 54.91 54.36 2ke5 h ALA 143 Cb 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2ke5 h ALA 143 CO -0.01 0.59 -0.75 0.00 0.00 0.00 0.00 179.25 179.08 2ke5 h ARG 144 N 0.00 0.38 -0.24 0.00 3.08 -0.70 -1.45 114.38 115.44 2ke5 h ARG 144 Ca -0.00 -0.32 -0.03 0.00 0.07 0.00 0.00 59.98 59.69 2ke5 h ARG 144 Cb 0.91 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 2ke5 h ARG 144 CO 0.06 0.97 0.02 1.03 -1.07 0.00 0.00 179.97 180.98 2ke5 h SER 145 N 0.25 0.40 -0.07 7.04 0.87 -1.35 -1.66 113.55 119.04 2ke5 h SER 145 Ca -0.03 -0.28 -0.08 0.00 -1.23 0.00 0.00 61.79 60.17 2ke5 h SER 145 Cb 1.33 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2ke5 h SER 145 CO 0.13 0.58 -0.27 0.50 -0.53 0.00 0.00 176.83 177.23 2ke5 h LYS 146 N 0.20 0.30 -0.30 2.24 3.11 -1.59 -3.30 116.57 117.25 2ke5 h LYS 146 Ca 0.07 -0.24 0.05 0.00 -2.81 0.00 0.00 60.65 57.72 2ke5 h LYS 146 Cb 0.36 0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.59 2ke5 h LYS 146 CO 0.01 0.87 0.03 0.00 -2.81 0.00 0.00 179.45 177.55 2ke5 h ALA 147 N 0.43 0.29 -0.92 5.00 0.00 -1.30 -1.62 119.26 121.14 2ke5 h ALA 147 Ca -0.02 0.07 0.25 0.00 0.00 0.00 0.00 54.91 55.21 2ke5 h ALA 147 Cb 0.92 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 2ke5 h ALA 147 CO 0.06 -0.38 0.64 1.49 0.00 0.00 0.00 179.25 181.06 2ke5 h GLU 148 N 0.13 0.12 -0.87 0.00 4.57 -1.34 -0.38 114.58 116.82 2ke5 h GLU 148 Ca 0.14 -0.01 0.14 0.00 -1.18 0.00 0.00 59.36 58.45 2ke5 h GLU 148 Cb 0.17 -0.03 -0.09 0.00 -0.16 0.00 0.00 28.75 28.64 2ke5 h GLU 148 CO -0.21 0.08 0.48 0.93 -1.18 0.00 0.00 179.01 179.11 2ke5 h GLU 149 N 0.13 0.67 0.00 1.92 4.39 -1.36 0.30 114.58 120.63 2ke5 h GLU 149 Ca 0.46 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.12 2ke5 h GLU 149 Cb 1.59 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.09 2ke5 h GLU 149 CO -0.07 0.44 0.00 0.91 -1.16 0.00 0.00 179.01 179.13 2ke5 n TRP 150 N -4.82 0.00 -1.84 4.33 8.01 -0.15 -4.79 117.44 118.18 2ke5 n TRP 150 Ca 0.17 0.00 -0.12 0.00 -1.31 0.00 0.00 57.50 56.25 2ke5 n TRP 150 Cb 0.42 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 29.70 2ke5 n TRP 150 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2ke5 n GLY 151 N 0.08 0.49 3.30 6.99 0.00 0.11 -4.97 105.19 111.19 2ke5 n GLY 151 Ca 0.01 -0.43 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.52 1.68 -0.17 1.61 -7.23 -1.24 -5.01 120.40 107.52 2ke5 s VAL 152 Ca 0.00 -1.81 -0.15 0.00 -1.81 0.00 0.00 61.98 58.21 2ke5 s VAL 152 Cb 0.00 -1.72 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 2ke5 s VAL 152 CO 0.00 -0.31 0.34 0.00 -0.31 0.00 0.00 175.10 174.82 2ke5 s GLN 153 N -2.64 4.24 -0.17 4.82 -2.07 -1.26 -3.51 119.66 119.07 2ke5 s GLN 153 Ca 0.13 0.15 -0.15 0.00 -1.82 0.00 0.00 55.36 53.67 2ke5 s GLN 153 Cb -0.06 -3.46 -0.04 0.00 -1.09 0.00 0.00 33.01 28.36 2ke5 s GLN 153 CO 0.05 0.15 0.35 -0.47 -1.32 0.00 0.00 175.29 174.06 2ke5 s TYR 154 N 0.71 3.43 0.18 9.60 5.04 -1.26 -4.06 117.35 131.00 2ke5 s TYR 154 Ca 0.18 0.63 0.10 0.00 -2.44 0.00 0.00 57.07 55.54 2ke5 s TYR 154 Cb -0.14 -2.43 -0.04 0.00 0.35 0.00 0.00 41.96 39.70 2ke5 s TYR 154 CO 0.06 0.14 -0.22 0.54 -1.34 0.00 0.00 175.55 174.73 2ke5 s VAL 155 N 0.79 2.14 -0.04 3.14 0.11 -1.16 -4.99 120.40 120.40 2ke5 s VAL 155 Ca 0.18 -1.97 -0.16 0.00 -2.93 0.00 0.00 61.98 57.10 2ke5 s VAL 155 Cb -0.14 -2.00 -0.05 0.00 -1.53 0.00 0.00 36.38 32.66 2ke5 s VAL 155 CO 0.06 -0.18 0.44 -1.61 -3.33 0.00 0.00 175.10 170.48 2ke5 s GLU 156 N -2.68 4.11 0.24 1.54 2.02 -1.26 -2.07 118.70 120.60 2ke5 s GLU 156 Ca 0.18 0.45 -0.00 0.00 0.02 0.00 0.00 54.97 55.62 2ke5 s GLU 156 Cb -0.07 -3.30 -0.03 0.00 0.10 0.00 0.00 34.13 30.82 2ke5 s GLU 156 CO 0.08 0.49 0.22 0.95 0.02 0.00 0.00 175.26 177.02 2ke5 s THR 157 N -0.46 0.00 -0.22 3.63 -4.23 -0.55 -4.73 115.64 109.09 2ke5 s THR 157 Ca 0.25 -1.92 -0.03 0.00 -1.18 0.00 0.00 61.69 58.80 2ke5 s THR 157 Cb -0.16 -2.48 0.11 0.00 1.34 0.00 0.00 72.50 71.31 2ke5 s THR 157 CO 0.13 0.00 0.31 -0.44 -0.54 0.00 0.00 174.62 174.08 2ke5 s SER 158 N -3.20 0.67 0.00 3.99 0.01 -1.26 -3.34 113.70 110.57 2ke5 s SER 158 Ca 0.37 0.10 0.09 0.00 1.31 0.00 0.00 55.95 57.82 2ke5 s SER 158 Cb 0.05 0.81 0.48 0.00 0.21 0.00 0.00 66.02 67.57 2ke5 s SER 158 CO 0.16 -0.30 1.05 0.00 0.41 0.00 0.00 173.24 174.55 2ke5 n ALA 159 N 5.35 1.72 -0.12 1.44 0.00 -1.26 -0.34 120.51 127.30 2ke5 n ALA 159 Ca -0.05 -0.05 -0.17 0.00 0.00 0.00 0.00 53.44 53.17 2ke5 n ALA 159 Cb 0.50 -1.14 -0.13 0.00 0.00 0.00 0.00 19.45 18.68 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 -1.12 0.66 0.00 0.00 3.00 -1.26 -4.44 118.16 115.00 2ke5 n LYS 160 Ca 0.06 0.14 0.12 0.00 -0.00 0.00 0.00 58.31 58.63 2ke5 n LYS 160 Cb 0.05 -1.54 0.11 0.00 0.00 0.00 0.00 35.03 33.65 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 -3.22 0.00 -3.66 3.15 -2.24 -0.89 -4.87 114.28 102.54 2ke5 n THR 161 Ca -0.44 -0.26 -0.30 0.00 -2.27 0.00 0.00 64.05 60.79 2ke5 n THR 161 Cb 1.01 1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 70.25 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 0.00 -0.91 -0.02 -0.78 -4.01 0.54 -4.80 116.66 106.68 2ke5 n ARG 162 Ca 0.11 0.10 -0.07 0.00 -1.04 0.00 0.00 57.85 56.95 2ke5 n ARG 162 Cb 0.45 -3.54 -0.05 0.00 -3.04 0.00 0.00 32.46 26.28 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 1.16 -0.09 -0.30 2.89 0.00 -1.93 -3.39 119.26 117.60 2ke5 h ALA 163 Ca -0.42 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2ke5 h ALA 163 Cb 1.02 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2ke5 h ALA 163 CO 0.63 -0.10 0.00 0.09 0.00 0.00 0.00 179.25 179.87 2ke5 n ASN 164 N -4.79 2.80 -0.25 0.00 4.13 -1.26 -4.60 115.26 111.29 2ke5 n ASN 164 Ca -0.05 -2.00 -0.07 0.00 1.68 0.00 0.00 54.58 54.14 2ke5 n ASN 164 Cb 0.20 -0.20 0.04 0.00 -1.54 0.00 0.00 39.78 38.29 2ke5 n ASN 164 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 2ke5 h VAL 165 N 1.74 1.26 0.00 2.41 2.07 -1.86 -1.71 116.25 120.16 2ke5 h VAL 165 Ca 0.00 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.58 2ke5 h VAL 165 Cb 0.70 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2ke5 h VAL 165 CO 0.00 0.36 0.00 -0.90 0.02 0.00 0.00 177.57 177.05 2ke5 n ASP 166 N -4.27 0.68 0.09 0.57 5.68 -1.26 -2.92 116.55 115.12 2ke5 n ASP 166 Ca 0.05 0.63 -0.06 0.00 -0.50 0.00 0.00 54.79 54.91 2ke5 n ASP 166 Cb 0.25 -0.79 -0.01 0.00 -1.14 0.00 0.00 41.12 39.42 2ke5 n ASP 166 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2ke5 h LYS 167 N 0.00 0.05 -0.00 0.11 3.11 -1.60 -3.07 116.57 115.17 2ke5 h LYS 167 Ca 0.00 -0.06 -0.14 0.00 -2.81 0.00 0.00 60.65 57.64 2ke5 h LYS 167 Cb 0.48 0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 31.71 2ke5 h LYS 167 CO 0.00 0.89 -0.64 -0.39 -2.81 0.00 0.00 179.45 176.49 2ke5 h VAL 168 N 0.02 1.46 -0.04 2.00 -1.51 -1.41 -1.40 116.25 115.39 2ke5 h VAL 168 Ca -0.02 -2.21 -0.13 0.00 -1.23 0.00 0.00 66.70 63.11 2ke5 h VAL 168 Cb 1.53 2.19 0.01 0.00 -2.13 0.00 0.00 31.29 32.88 2ke5 h VAL 168 CO 0.12 0.63 -0.49 -0.26 -1.23 0.00 0.00 177.57 176.34 2ke5 h PHE 169 N 0.00 0.56 -0.01 5.19 0.04 -1.66 -2.95 116.94 118.10 2ke5 h PHE 169 Ca -0.01 -0.28 -0.13 0.00 2.80 0.00 0.00 57.97 60.36 2ke5 h PHE 169 Cb 1.14 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 39.20 2ke5 h PHE 169 CO 0.00 1.07 -0.59 0.74 -0.60 0.00 0.00 178.31 178.93 2ke5 h PHE 170 N -0.11 0.06 0.31 -0.55 0.04 -1.56 -2.69 116.94 112.43 2ke5 h PHE 170 Ca -0.05 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.68 2ke5 h PHE 170 Cb 1.18 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.32 2ke5 h PHE 170 CO 0.14 0.62 -0.15 0.22 -0.60 0.00 0.00 178.31 178.54 2ke5 h ASP 171 N 0.03 -0.35 -0.00 2.17 1.82 -1.30 -3.05 116.42 115.75 2ke5 h ASP 171 Ca -0.01 -0.13 -0.04 0.00 -0.39 0.00 0.00 57.03 56.46 2ke5 h ASP 171 Cb 1.05 0.09 -0.01 0.00 0.68 0.00 0.00 39.33 41.14 2ke5 h ASP 171 CO 0.08 -0.07 -0.10 0.25 -1.61 0.00 0.00 179.24 177.79 2ke5 h LEU 172 N -0.64 0.23 -1.29 2.28 5.85 -1.57 -2.58 115.31 117.59 2ke5 h LEU 172 Ca -0.04 -0.04 0.14 0.00 0.84 0.00 0.00 57.88 58.78 2ke5 h LEU 172 Cb 0.45 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.36 2ke5 h LEU 172 CO 0.07 0.36 0.57 -0.03 -0.34 0.00 0.00 178.44 179.07 2ke5 h MET 173 N 0.23 0.67 -0.29 1.25 4.05 -1.37 -0.31 114.93 119.17 2ke5 h MET 173 Ca 0.05 -0.04 -0.14 0.00 -0.28 0.00 0.00 59.70 59.29 2ke5 h MET 173 Cb 0.33 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.97 2ke5 h MET 173 CO 0.02 0.44 -0.38 0.00 0.23 0.00 0.00 176.91 177.22 2ke5 h ARG 174 N 0.69 0.68 -0.23 0.39 3.08 -1.42 -2.99 114.38 114.58 2ke5 h ARG 174 Ca 0.44 -0.34 0.01 0.00 0.07 0.00 0.00 59.98 60.16 2ke5 h ARG 174 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 2ke5 h ARG 174 CO -0.20 0.94 0.14 0.93 -1.07 0.00 0.00 179.97 180.71 2ke5 h GLU 175 N 0.56 0.28 -0.33 0.04 4.39 -1.10 -1.14 114.58 117.27 2ke5 h GLU 175 Ca 0.05 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.77 2ke5 h GLU 175 Cb 0.90 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 2ke5 h GLU 175 CO 0.08 0.18 0.23 0.82 -1.16 0.00 0.00 179.01 179.16 2ke5 h ILE 176 N 0.29 0.99 0.16 3.13 2.04 -1.39 0.51 117.51 123.24 2ke5 h ILE 176 Ca 0.09 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2ke5 h ILE 176 Cb -0.02 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2ke5 h ILE 176 CO -0.03 0.05 -0.08 0.03 0.00 0.00 0.00 178.15 178.12 2ke5 h ARG 177 N 0.29 -0.21 0.00 2.37 3.08 -1.23 -3.19 114.38 115.49 2ke5 h ARG 177 Ca 0.14 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 2ke5 h ARG 177 Cb 0.20 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 2ke5 h ARG 177 CO -0.03 0.20 -0.42 1.15 -1.07 0.00 0.00 179.97 179.80 2ke5 h THR 178 N -0.89 0.08 0.24 2.04 2.02 -1.07 -3.29 112.91 112.03 2ke5 h THR 178 Ca -0.02 -1.08 0.00 0.00 0.77 0.00 0.00 66.41 66.08 2ke5 h THR 178 Cb 0.51 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2ke5 h THR 178 CO 0.04 0.03 -0.23 0.50 0.37 0.00 0.00 175.52 176.22 2ke5 h LYS 179 N -1.00 -0.48 0.15 6.66 3.64 -0.21 -0.26 116.57 125.06 2ke5 h LYS 179 Ca -0.02 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2ke5 h LYS 179 Cb 0.44 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2ke5 h LYS 179 CO -0.01 -0.32 -0.07 -0.22 -2.27 0.00 0.00 179.45 176.56 2ke5 h LYS 180 N -0.50 -0.19 0.00 1.90 3.64 -1.37 -2.65 116.57 117.40 2ke5 h LYS 180 Ca -0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2ke5 h LYS 180 Cb 0.46 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2ke5 h LYS 180 CO -0.04 0.05 0.00 -1.33 -2.27 0.00 0.00 179.45 175.86 2ke5 n MET 181 N -5.08 0.12 0.31 1.90 2.81 -1.20 -3.03 117.12 112.95 2ke5 n MET 181 Ca -0.09 0.50 -0.13 0.00 -1.81 0.00 0.00 57.70 56.18 2ke5 n MET 181 Cb 0.18 -1.81 -0.06 0.00 -0.71 0.00 0.00 33.22 30.83 2ke5 n MET 181 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2ke5 h SER 182 N 0.00 -0.69 -4.72 7.83 0.02 -0.66 -3.50 113.55 111.83 2ke5 h SER 182 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2ke5 h SER 182 Cb 0.16 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 2ke5 h SER 182 CO 0.00 -0.35 -1.00 -0.62 -1.14 0.00 0.00 176.83 173.72 2ke5 n GLU 183 N -5.00 -5.16 0.03 3.45 1.02 -1.17 -4.84 120.64 108.97 2ke5 n GLU 183 Ca -0.10 3.75 0.12 0.00 -0.02 0.00 0.00 57.16 60.91 2ke5 n GLU 183 Cb 0.32 -4.73 0.50 0.00 -0.02 0.00 0.00 31.44 27.51 2ke5 n GLU 183 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2ke5 n ASN 184 N 1.82 0.22 0.00 1.62 6.94 -1.26 -5.11 115.26 119.49 2ke5 n ASN 184 Ca -0.02 0.53 0.00 0.00 -0.02 0.00 0.00 54.58 55.07 2ke5 n ASN 184 Cb 0.02 -0.59 0.00 0.00 -2.36 0.00 0.00 39.78 36.86 2ke5 n ASN 184 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40