#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 1.17 -0.22 -1.18 0.00 -1.26 -4.80 121.76 115.47 2ke5 s ALA 13 Ca 0.00 -0.95 -0.04 0.00 0.00 0.00 0.00 51.96 50.96 2ke5 s ALA 13 Cb 0.00 -2.88 0.08 0.00 0.00 0.00 0.00 23.12 20.32 2ke5 s ALA 13 CO 0.00 -3.13 0.10 -1.17 0.00 0.00 0.00 175.76 171.57 2ke5 s LEU 14 N -6.55 0.49 0.02 0.00 0.20 -1.26 -1.60 118.68 109.97 2ke5 s LEU 14 Ca 0.71 -0.89 0.02 0.00 0.69 0.00 0.00 54.13 54.66 2ke5 s LEU 14 Cb -0.09 -0.31 -0.04 0.00 -0.43 0.00 0.00 46.19 45.33 2ke5 s LEU 14 CO 0.55 -0.38 0.01 -1.00 -0.29 0.00 0.00 176.35 175.24 2ke5 s HIS 15 N 2.10 3.08 -0.17 5.38 3.76 -0.32 -5.01 115.29 124.11 2ke5 s HIS 15 Ca 0.05 0.07 0.01 0.00 -0.15 0.00 0.00 55.06 55.03 2ke5 s HIS 15 Cb -0.16 -1.65 0.03 0.00 1.11 0.00 0.00 32.58 31.92 2ke5 s HIS 15 CO -0.20 0.48 -0.12 0.15 -0.85 0.00 0.00 174.74 174.20 2ke5 s LYS 16 N -1.76 2.10 -0.32 1.40 1.02 -1.26 -0.62 119.74 120.30 2ke5 s LYS 16 Ca 0.22 -0.69 -0.11 0.00 0.02 0.00 0.00 55.97 55.40 2ke5 s LYS 16 Cb -0.12 -2.25 -0.02 0.00 -0.52 0.00 0.00 37.83 34.93 2ke5 s LYS 16 CO 0.13 -0.34 0.20 0.54 -0.92 0.00 0.00 175.35 174.95 2ke5 s VAL 17 N 1.45 5.00 -0.08 3.17 0.11 -0.87 -0.55 120.40 128.63 2ke5 s VAL 17 Ca 0.02 -0.24 -0.24 0.00 -2.93 0.00 0.00 61.98 58.58 2ke5 s VAL 17 Cb -0.15 -3.53 -0.03 0.00 -1.53 0.00 0.00 36.38 31.14 2ke5 s VAL 17 CO -0.09 0.06 0.75 -0.63 -3.33 0.00 0.00 175.10 171.86 2ke5 s ILE 18 N 1.68 5.00 -0.89 7.04 -1.09 -1.07 -4.04 121.20 127.83 2ke5 s ILE 18 Ca 0.06 1.52 -0.22 0.00 -2.23 0.00 0.00 60.65 59.78 2ke5 s ILE 18 Cb -0.17 -4.08 0.07 0.00 -1.58 0.00 0.00 42.46 36.71 2ke5 s ILE 18 CO 0.09 0.20 1.25 -0.32 -1.23 0.00 0.00 174.94 174.92 2ke5 s MET 19 N 1.10 3.45 0.21 2.79 1.75 -1.24 -1.36 119.30 126.00 2ke5 s MET 19 Ca 0.39 -1.13 0.09 0.00 -1.25 0.00 0.00 55.69 53.79 2ke5 s MET 19 Cb -0.18 -4.86 -0.04 0.00 2.84 0.00 0.00 34.83 32.59 2ke5 s MET 19 CO 0.18 -2.01 -0.07 0.54 -0.65 0.00 0.00 175.02 173.01 2ke5 s VAL 20 N 4.27 3.26 0.00 10.11 0.11 -0.57 -4.69 120.40 132.90 2ke5 s VAL 20 Ca 0.36 -1.74 0.00 0.00 -2.93 0.00 0.00 61.98 57.68 2ke5 s VAL 20 Cb -0.05 -2.65 0.00 0.00 -1.53 0.00 0.00 36.38 32.14 2ke5 s VAL 20 CO -0.03 -0.19 0.00 0.61 -3.33 0.00 0.00 175.10 172.17 2ke5 n GLY 21 N -0.23 -0.91 5.04 6.54 0.00 -1.26 -1.23 105.19 113.13 2ke5 n GLY 21 Ca -0.09 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.59 2ke5 n GLY 21 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ke5 n SER 22 N 0.00 0.00 0.00 1.61 2.88 -1.26 -4.49 113.62 112.36 2ke5 n SER 22 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2ke5 n SER 22 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2ke5 n SER 22 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ke5 n GLY 23 N 0.00 -2.02 2.71 0.46 0.00 -1.26 -4.75 105.19 100.33 2ke5 n GLY 23 Ca 0.00 0.72 -0.42 0.00 0.00 0.00 0.00 46.02 46.33 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 4.64 0.49 -0.02 0.00 -1.26 -3.97 105.19 105.07 2ke5 n GLY 24 Ca 0.00 -1.85 -0.07 0.00 0.00 0.00 0.00 46.02 44.10 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 3.81 0.44 0.00 1.61 0.31 -1.26 -5.03 118.33 118.21 2ke5 n VAL 25 Ca 0.51 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.71 2ke5 n VAL 25 Cb 0.35 -1.31 0.00 0.00 -0.91 0.00 0.00 33.84 31.97 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 2.73 0.64 0.37 2.92 0.00 -1.26 -4.85 105.19 105.73 2ke5 n GLY 26 Ca -0.15 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.04 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 0.15 -0.01 1.61 1.57 -1.85 0.20 116.57 118.25 2ke5 h LYS 27 Ca 0.00 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 2ke5 h LYS 27 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2ke5 h LYS 27 CO 0.00 0.10 -0.44 0.66 -0.57 0.00 0.00 179.45 179.21 2ke5 h SER 28 N 0.16 0.02 0.16 0.86 4.64 -1.90 -2.77 113.55 114.71 2ke5 h SER 28 Ca 0.26 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 2ke5 h SER 28 Cb 0.81 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2ke5 h SER 28 CO -0.04 0.45 -0.08 0.00 -0.87 0.00 0.00 176.83 176.30 2ke5 h ALA 29 N 1.55 -0.22 -0.15 5.18 0.00 -0.94 0.37 119.26 125.05 2ke5 h ALA 29 Ca -0.00 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.78 2ke5 h ALA 29 Cb 0.78 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2ke5 h ALA 29 CO 0.06 -0.46 0.18 -0.07 0.00 0.00 0.00 179.25 178.95 2ke5 h LEU 30 N -0.53 0.00 0.01 0.00 -0.00 -1.48 -1.66 115.31 111.66 2ke5 h LEU 30 Ca -0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.86 2ke5 h LEU 30 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 2ke5 h LEU 30 CO 0.04 0.00 -0.01 0.74 -0.00 0.00 0.00 178.44 179.21 2ke5 h THR 31 N 0.00 1.49 -0.86 0.22 2.02 -1.08 -3.15 112.91 111.55 2ke5 h THR 31 Ca 0.07 -1.62 0.01 0.00 0.77 0.00 0.00 66.41 65.64 2ke5 h THR 31 Cb 0.42 2.57 -0.04 0.00 -1.74 0.00 0.00 68.15 69.36 2ke5 h THR 31 CO -0.00 0.41 0.57 -0.07 0.37 0.00 0.00 175.52 176.80 2ke5 h LEU 32 N -0.73 0.99 -0.67 2.58 3.38 -0.04 -1.68 115.31 119.13 2ke5 h LEU 32 Ca -0.00 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2ke5 h LEU 32 Cb 0.69 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 2ke5 h LEU 32 CO 0.00 0.71 0.14 1.56 0.09 0.00 0.00 178.44 180.95 2ke5 h GLN 33 N 1.16 1.09 -0.02 1.13 1.08 -1.50 -0.74 115.11 117.32 2ke5 h GLN 33 Ca 0.32 -0.27 -0.14 0.00 -1.45 0.00 0.00 58.65 57.10 2ke5 h GLN 33 Cb -0.12 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.15 2ke5 h GLN 33 CO -0.07 0.98 -0.65 0.35 -0.95 0.00 0.00 178.83 178.49 2ke5 h PHE 34 N 1.02 0.09 0.02 2.96 3.57 -1.42 0.25 116.94 123.42 2ke5 h PHE 34 Ca 0.21 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 2ke5 h PHE 34 Cb 0.40 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.12 2ke5 h PHE 34 CO 0.03 0.69 -0.15 0.52 -2.23 0.00 0.00 178.31 177.18 2ke5 h MET 35 N 0.05 0.04 -0.00 1.11 2.86 -1.09 -3.39 114.93 114.49 2ke5 h MET 35 Ca -0.01 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2ke5 h MET 35 Cb 1.15 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.84 2ke5 h MET 35 CO 0.09 1.03 -0.37 0.66 1.06 0.00 0.00 176.91 179.38 2ke5 n TYR 36 N -4.54 0.00 -3.69 -0.22 4.01 -0.30 -5.00 117.16 107.41 2ke5 n TYR 36 Ca -0.11 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.39 2ke5 n TYR 36 Cb 0.53 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.61 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 -0.84 -3.41 -3.68 7.72 2.03 0.88 -4.98 116.55 114.28 2ke5 n ASP 37 Ca 0.03 -0.72 -0.10 0.00 0.52 0.00 0.00 54.79 54.52 2ke5 n ASP 37 Cb 0.18 -4.39 -0.09 0.00 -0.72 0.00 0.00 41.12 36.09 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 -6.12 0.52 -0.55 -0.67 2.56 -1.26 -5.04 118.70 108.13 2ke5 s GLU 38 Ca 0.31 0.90 -0.24 0.00 0.00 0.00 0.00 54.97 55.94 2ke5 s GLU 38 Cb -0.15 0.07 0.04 0.00 2.00 0.00 0.00 34.13 36.09 2ke5 s GLU 38 CO 0.79 -0.14 0.96 0.12 -0.56 0.00 0.00 175.26 176.42 2ke5 s PHE 39 N 1.29 2.78 0.00 5.30 5.36 -1.26 -4.44 117.98 127.02 2ke5 s PHE 39 Ca -0.08 0.02 0.07 0.00 -0.96 0.00 0.00 56.93 55.98 2ke5 s PHE 39 Cb -0.07 -4.10 -0.03 0.00 -0.34 0.00 0.00 43.02 38.48 2ke5 s PHE 39 CO -0.13 -1.36 -0.22 0.54 -1.46 0.00 0.00 175.22 172.59 2ke5 s VAL 40 N 4.01 2.42 0.24 3.12 0.11 -1.26 -5.03 120.40 124.02 2ke5 s VAL 40 Ca 0.31 -1.12 -0.02 0.00 -2.93 0.00 0.00 61.98 58.22 2ke5 s VAL 40 Cb -0.12 -1.93 0.07 0.00 -1.53 0.00 0.00 36.38 32.87 2ke5 s VAL 40 CO 0.20 0.48 1.69 -0.33 -3.33 0.00 0.00 175.10 173.81 2ke5 h GLU 41 N 5.10 0.74 -6.83 1.54 5.08 -2.06 -3.43 114.58 114.72 2ke5 h GLU 41 Ca -0.45 -0.25 -0.53 0.00 -1.00 0.00 0.00 59.36 57.12 2ke5 h GLU 41 Cb 1.14 -0.06 0.07 0.00 0.50 0.00 0.00 28.75 30.41 2ke5 h GLU 41 CO 0.47 0.84 0.75 0.34 -1.00 0.00 0.00 179.01 180.41 2ke5 s ASP 42 N -6.72 6.58 0.29 1.42 -1.08 -1.26 -5.03 116.67 110.88 2ke5 s ASP 42 Ca -0.09 2.79 0.10 0.00 -0.52 0.00 0.00 52.55 54.83 2ke5 s ASP 42 Cb 0.14 -2.64 -0.06 0.00 -1.46 0.00 0.00 42.92 38.90 2ke5 s ASP 42 CO 0.82 -0.72 -0.14 -0.72 0.52 0.00 0.00 175.17 174.93 2ke5 s TYR 43 N -0.55 2.23 -0.31 -5.34 1.13 -1.26 -5.13 117.35 108.11 2ke5 s TYR 43 Ca 0.56 -0.46 0.00 0.00 -1.41 0.00 0.00 57.07 55.76 2ke5 s TYR 43 Cb -0.43 -1.12 0.10 0.00 -1.10 0.00 0.00 41.96 39.41 2ke5 s TYR 43 CO 0.51 0.58 0.08 -1.21 -2.51 0.00 0.00 175.55 173.00 2ke5 s GLU 44 N -3.59 0.87 0.32 -3.49 2.02 -1.26 -5.12 118.70 108.45 2ke5 s GLU 44 Ca 0.30 -1.20 -0.29 0.00 0.02 0.00 0.00 54.97 53.80 2ke5 s GLU 44 Cb -0.01 -2.22 -0.10 0.00 0.10 0.00 0.00 34.13 31.90 2ke5 s GLU 44 CO 0.14 -0.96 1.28 -1.25 0.02 0.00 0.00 175.26 174.50 2ke5 s PRO 45 N 1.49 4.39 0.22 0.39 0.04 -1.26 -4.97 135.00 135.30 2ke5 s PRO 45 Ca 0.09 2.16 -0.18 0.00 0.04 0.00 0.00 61.00 63.11 2ke5 s PRO 45 Cb -0.18 -3.09 -0.08 0.00 0.04 0.00 0.00 34.50 31.19 2ke5 s PRO 45 CO -0.21 -0.15 0.70 0.99 0.04 0.00 0.00 177.00 178.37 2ke5 s THR 46 N -1.04 4.62 0.00 1.26 2.01 -1.26 -4.95 115.64 116.27 2ke5 s THR 46 Ca 0.49 1.18 0.00 0.00 0.31 0.00 0.00 61.69 63.67 2ke5 s THR 46 Cb -0.39 -3.81 0.00 0.00 0.01 0.00 0.00 72.50 68.31 2ke5 s THR 46 CO 0.50 0.17 0.00 1.17 -0.69 0.00 0.00 174.62 175.78 2ke5 n LYS 47 N 0.62 0.00 0.00 4.92 3.00 -1.26 -4.92 118.16 120.53 2ke5 n LYS 47 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.29 2ke5 n LYS 47 Cb 0.51 -0.52 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2ke5 n LYS 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ke5 n ALA 48 N -1.90 0.00 -2.19 3.14 0.00 -1.26 -5.11 120.51 113.19 2ke5 n ALA 48 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 2ke5 n ALA 48 Cb 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.51 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 0.00 7.29 0.19 0.00 2.15 -1.26 -5.07 116.67 119.97 2ke5 s ASP 49 Ca 0.00 1.53 0.07 0.00 0.43 0.00 0.00 52.55 54.58 2ke5 s ASP 49 Cb 0.00 -2.48 -0.04 0.00 -0.30 0.00 0.00 42.92 40.10 2ke5 s ASP 49 CO 0.00 0.12 0.06 -0.44 -0.17 0.00 0.00 175.17 174.74 2ke5 s SER 50 N -0.64 5.01 0.19 -0.34 0.01 -1.26 -4.68 113.70 111.99 2ke5 s SER 50 Ca 0.37 -0.35 0.07 0.00 1.31 0.00 0.00 55.95 57.35 2ke5 s SER 50 Cb -0.22 -1.14 -0.04 0.00 0.21 0.00 0.00 66.02 64.83 2ke5 s SER 50 CO 0.24 0.06 0.02 -0.31 0.41 0.00 0.00 173.24 173.66 2ke5 s TYR 51 N -1.87 2.86 -0.00 2.43 2.02 -0.78 -4.99 117.35 117.02 2ke5 s TYR 51 Ca 0.29 -0.14 -0.14 0.00 -0.37 0.00 0.00 57.07 56.72 2ke5 s TYR 51 Cb -0.09 -1.36 0.02 0.00 -0.40 0.00 0.00 41.96 40.13 2ke5 s TYR 51 CO 0.21 0.53 0.28 0.50 -1.57 0.00 0.00 175.55 175.50 2ke5 s ARG 52 N -3.10 0.67 -0.06 -0.62 3.52 -1.26 -2.56 118.95 115.53 2ke5 s ARG 52 Ca 0.28 -0.28 -0.29 0.00 -0.13 0.00 0.00 55.73 55.31 2ke5 s ARG 52 Cb -0.09 0.29 0.10 0.00 -1.56 0.00 0.00 34.95 33.70 2ke5 s ARG 52 CO 0.19 -0.19 0.87 0.21 -0.81 0.00 0.00 175.30 175.58 2ke5 s LYS 53 N -1.56 0.80 -0.14 5.12 2.20 -0.84 -5.00 119.74 120.32 2ke5 s LYS 53 Ca -0.12 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.46 2ke5 s LYS 53 Cb -0.05 0.37 -0.01 0.00 -1.51 0.00 0.00 37.83 36.64 2ke5 s LYS 53 CO 0.03 -0.30 -0.15 0.15 -0.36 0.00 0.00 175.35 174.72 2ke5 s LYS 54 N -2.00 3.27 0.06 4.03 1.02 -1.26 -1.41 119.74 123.45 2ke5 s LYS 54 Ca -0.01 -0.74 -0.00 0.00 0.02 0.00 0.00 55.97 55.24 2ke5 s LYS 54 Cb -0.01 -2.59 -0.04 0.00 -0.52 0.00 0.00 37.83 34.67 2ke5 s LYS 54 CO -0.02 0.11 -0.04 0.14 -0.92 0.00 0.00 175.35 174.63 2ke5 s VAL 55 N 0.58 0.31 0.06 3.17 -7.23 -1.21 -5.06 120.40 111.01 2ke5 s VAL 55 Ca -0.09 -1.82 -0.16 0.00 -1.81 0.00 0.00 61.98 58.11 2ke5 s VAL 55 Cb -0.16 -1.53 -0.06 0.00 0.56 0.00 0.00 36.38 35.19 2ke5 s VAL 55 CO 0.03 -0.97 0.49 -0.69 -0.31 0.00 0.00 175.10 173.66 2ke5 s VAL 56 N -3.82 4.90 -0.29 1.32 1.01 -1.26 -3.14 120.40 119.12 2ke5 s VAL 56 Ca 0.07 0.92 -0.04 0.00 0.00 0.00 0.00 61.98 62.94 2ke5 s VAL 56 Cb 0.07 -3.77 0.10 0.00 0.00 0.00 0.00 36.38 32.78 2ke5 s VAL 56 CO -0.09 0.47 0.14 -0.22 0.00 0.00 0.00 175.10 175.40 2ke5 s LEU 57 N -1.37 0.49 -1.43 3.92 2.96 0.43 -4.85 118.68 118.82 2ke5 s LEU 57 Ca 0.29 -1.26 -0.01 0.00 -0.22 0.00 0.00 54.13 52.93 2ke5 s LEU 57 Cb -0.17 -0.28 0.00 0.00 0.50 0.00 0.00 46.19 46.24 2ke5 s LEU 57 CO 0.17 -0.43 0.09 0.47 -1.32 0.00 0.00 176.35 175.33 2ke5 n ASP 58 N 5.24 -4.99 0.00 3.68 9.92 -1.26 -1.09 116.55 128.04 2ke5 n ASP 58 Ca -0.05 0.02 0.00 0.00 -0.53 0.00 0.00 54.79 54.22 2ke5 n ASP 58 Cb 0.42 -4.17 0.00 0.00 -0.64 0.00 0.00 41.12 36.74 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 -0.99 3.01 3.70 0.44 0.00 -1.26 -5.03 105.19 105.05 2ke5 n GLY 59 Ca -0.18 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 2ke5 n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ke5 s GLU 60 N 0.00 4.50 -0.35 1.61 0.41 -0.25 -5.02 118.70 119.60 2ke5 s GLU 60 Ca 0.00 1.44 -0.13 0.00 -0.41 0.00 0.00 54.97 55.87 2ke5 s GLU 60 Cb 0.00 -3.48 -0.01 0.00 -1.78 0.00 0.00 34.13 28.86 2ke5 s GLU 60 CO 0.00 -0.16 0.24 -2.00 -0.49 0.00 0.00 175.26 172.85 2ke5 s GLU 61 N 1.38 3.37 0.23 1.61 2.12 -1.26 -0.43 118.70 125.71 2ke5 s GLU 61 Ca 0.51 -0.73 0.11 0.00 0.36 0.00 0.00 54.97 55.22 2ke5 s GLU 61 Cb -0.21 -3.81 -0.05 0.00 0.26 0.00 0.00 34.13 30.33 2ke5 s GLU 61 CO 0.25 -0.50 -0.21 0.14 -0.54 0.00 0.00 175.26 174.40 2ke5 s VAL 62 N 1.70 2.27 -0.00 3.70 -7.23 -1.19 -4.36 120.40 115.28 2ke5 s VAL 62 Ca 0.06 -2.19 -0.11 0.00 -1.81 0.00 0.00 61.98 57.92 2ke5 s VAL 62 Cb -0.18 -2.15 -0.05 0.00 0.56 0.00 0.00 36.38 34.56 2ke5 s VAL 62 CO 0.10 -0.31 0.34 -1.10 -0.31 0.00 0.00 175.10 173.82 2ke5 s GLN 63 N -3.14 3.76 0.03 4.82 -0.21 -0.63 -3.36 119.66 120.93 2ke5 s GLN 63 Ca 0.24 0.21 0.08 0.00 0.02 0.00 0.00 55.36 55.91 2ke5 s GLN 63 Cb -0.06 -3.15 -0.03 0.00 1.00 0.00 0.00 33.01 30.78 2ke5 s GLN 63 CO 0.11 0.67 -0.21 -1.50 -2.12 0.00 0.00 175.29 172.24 2ke5 s ILE 64 N -1.17 2.52 -0.06 1.08 2.07 -0.50 -1.18 121.20 123.96 2ke5 s ILE 64 Ca 0.25 -1.22 -0.01 0.00 -1.41 0.00 0.00 60.65 58.26 2ke5 s ILE 64 Cb -0.15 -2.01 0.03 0.00 0.13 0.00 0.00 42.46 40.45 2ke5 s ILE 64 CO 0.13 0.39 0.00 -0.62 -1.91 0.00 0.00 174.94 172.93 2ke5 s ASP 65 N -1.25 1.38 -0.20 4.50 -1.08 0.21 -1.99 116.67 118.24 2ke5 s ASP 65 Ca 0.13 -0.07 -0.06 0.00 -0.52 0.00 0.00 52.55 52.03 2ke5 s ASP 65 Cb -0.10 -0.40 -0.03 0.00 -1.46 0.00 0.00 42.92 40.93 2ke5 s ASP 65 CO 0.03 -0.18 0.02 -0.63 0.52 0.00 0.00 175.17 174.94 2ke5 s ILE 66 N 1.80 4.25 -0.04 4.11 1.01 -1.06 -2.05 121.20 129.22 2ke5 s ILE 66 Ca 0.02 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.49 2ke5 s ILE 66 Cb -0.13 -2.92 -0.00 0.00 0.01 0.00 0.00 42.46 39.43 2ke5 s ILE 66 CO -0.04 0.43 -0.13 -0.22 0.00 0.00 0.00 174.94 174.98 2ke5 s LEU 67 N 0.81 1.85 0.18 2.97 1.98 -1.26 -1.86 118.68 123.36 2ke5 s LEU 67 Ca 0.02 -0.28 0.00 0.00 -2.89 0.00 0.00 54.13 50.98 2ke5 s LEU 67 Cb -0.14 -0.78 0.00 0.00 0.66 0.00 0.00 46.19 45.93 2ke5 s LEU 67 CO 0.02 0.11 0.00 -0.67 -1.89 0.00 0.00 176.35 173.92 2ke5 n ASP 68 N 3.22 -7.23 -0.16 3.68 2.03 -1.26 -4.10 116.55 112.72 2ke5 n ASP 68 Ca -0.18 1.02 0.01 0.00 0.52 0.00 0.00 54.79 56.16 2ke5 n ASP 68 Cb 0.53 -3.93 0.01 0.00 -0.72 0.00 0.00 41.12 37.02 2ke5 n ASP 68 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2ke5 n THR 69 N 1.22 0.33 -4.35 5.18 -2.24 -1.26 -3.73 114.28 109.42 2ke5 n THR 69 Ca 0.00 -0.36 -0.25 0.00 -2.27 0.00 0.00 64.05 61.17 2ke5 n THR 69 Cb 0.00 0.65 -0.09 0.00 -2.10 0.00 0.00 70.33 68.80 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 -0.42 3.19 0.05 6.98 0.00 -1.26 -2.78 121.76 127.52 2ke5 s ALA 70 Ca 0.03 -1.97 -0.30 0.00 0.00 0.00 0.00 51.96 49.72 2ke5 s ALA 70 Cb 0.03 -0.35 -0.09 0.00 0.00 0.00 0.00 23.12 22.71 2ke5 s ALA 70 CO 0.00 0.06 1.96 0.20 0.00 0.00 0.00 175.76 177.98 2ke5 s GLY 71 N -3.71 1.44 -0.11 0.00 0.00 -1.25 -4.85 107.32 98.83 2ke5 s GLY 71 Ca 0.35 1.35 0.03 0.00 0.00 0.00 0.00 44.72 46.45 2ke5 s GLY 71 CO 0.19 3.44 1.09 1.04 0.00 0.00 0.00 173.10 178.87 2ke5 n LEU 72 N 7.32 3.34 0.04 0.66 4.77 -1.26 -3.81 117.00 128.06 2ke5 n LEU 72 Ca 0.20 -1.71 0.12 0.00 -0.03 0.00 0.00 56.01 54.58 2ke5 n LEU 72 Cb 0.41 -0.59 0.16 0.00 -2.33 0.00 0.00 43.42 41.07 2ke5 n LEU 72 CO 0.68 0.51 0.29 -1.84 -1.33 0.00 0.00 177.39 175.70 2ke5 n GLU 73 N 0.10 0.24 -0.01 3.23 0.28 -1.26 -3.78 120.64 119.43 2ke5 n GLU 73 Ca 0.14 0.05 0.07 0.00 -0.16 0.00 0.00 57.16 57.27 2ke5 n GLU 73 Cb 0.72 -1.63 0.41 0.00 1.43 0.00 0.00 31.44 32.36 2ke5 n GLU 73 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2ke5 n ASP 74 N -1.97 0.17 -4.27 -1.84 8.00 -1.25 -4.75 116.55 110.64 2ke5 n ASP 74 Ca 0.03 -1.58 -0.32 0.00 0.71 0.00 0.00 54.79 53.63 2ke5 n ASP 74 Cb 0.42 -0.01 -0.16 0.00 -0.02 0.00 0.00 41.12 41.34 2ke5 n ASP 74 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2ke5 s TYR 75 N -1.97 2.45 0.01 1.24 2.02 -1.25 -5.04 117.35 114.81 2ke5 s TYR 75 Ca 0.22 -0.72 -0.22 0.00 -0.37 0.00 0.00 57.07 55.98 2ke5 s TYR 75 Cb 0.10 -1.61 -0.18 0.00 -0.40 0.00 0.00 41.96 39.87 2ke5 s TYR 75 CO 0.17 -0.21 1.22 0.00 -1.57 0.00 0.00 175.55 175.16 2ke5 h ALA 76 N 6.07 0.13 0.00 3.71 0.00 -1.90 -3.42 119.26 123.85 2ke5 h ALA 76 Ca -0.32 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2ke5 h ALA 76 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2ke5 h ALA 76 CO 0.47 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.83 2ke5 n ALA 77 N -2.47 0.70 0.20 0.00 0.00 -1.26 -4.84 120.51 112.84 2ke5 n ALA 77 Ca -0.08 -0.25 0.12 0.00 0.00 0.00 0.00 53.44 53.23 2ke5 n ALA 77 Cb 0.43 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.99 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 2.40 0.00 -0.70 0.00 2.04 -1.96 -3.32 117.51 115.98 2ke5 h ILE 78 Ca 0.00 -0.96 0.01 0.00 1.00 0.00 0.00 64.86 64.92 2ke5 h ILE 78 Cb 0.85 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.61 2ke5 h ILE 78 CO 0.00 0.00 0.46 0.08 0.00 0.00 0.00 178.15 178.69 2ke5 h ARG 79 N 0.00 0.90 -0.30 2.37 0.11 -1.82 -1.72 114.38 113.92 2ke5 h ARG 79 Ca 0.00 -0.05 -0.00 0.00 0.10 0.00 0.00 59.98 60.02 2ke5 h ARG 79 Cb 0.98 -0.20 -0.02 0.00 1.11 0.00 0.00 29.97 31.84 2ke5 h ARG 79 CO 0.00 0.59 0.18 -0.44 0.10 0.00 0.00 179.97 180.40 2ke5 h ASP 80 N 0.93 0.35 -0.86 0.08 5.19 -1.93 -1.96 116.42 118.21 2ke5 h ASP 80 Ca 0.26 -0.01 0.19 0.00 -0.62 0.00 0.00 57.03 56.85 2ke5 h ASP 80 Cb -0.08 -0.09 -0.06 0.00 0.18 0.00 0.00 39.33 39.28 2ke5 h ASP 80 CO -0.06 0.28 0.58 -1.13 -3.12 0.00 0.00 179.24 175.78 2ke5 h ASN 81 N 0.41 0.38 -0.03 6.45 -0.00 -1.52 -0.66 115.58 120.61 2ke5 h ASN 81 Ca 0.11 0.04 -0.08 0.00 -0.00 0.00 0.00 56.30 56.36 2ke5 h ASN 81 Cb -0.01 -0.04 0.00 0.00 -0.00 0.00 0.00 38.32 38.28 2ke5 h ASN 81 CO -0.02 0.16 -0.29 1.88 -0.00 0.00 0.00 177.43 179.16 2ke5 h TYR 82 N 0.38 0.36 0.00 0.67 -1.99 -1.47 -2.18 116.97 112.74 2ke5 h TYR 82 Ca 0.44 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 60.99 2ke5 h TYR 82 Cb 1.12 -0.05 -0.00 0.00 2.00 0.00 0.00 36.73 39.80 2ke5 h TYR 82 CO -0.00 0.93 -0.06 0.74 -0.00 0.00 0.00 178.16 179.76 2ke5 h PHE 83 N -0.31 0.00 0.20 4.88 0.04 -1.30 -2.48 116.94 117.97 2ke5 h PHE 83 Ca -0.03 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.40 2ke5 h PHE 83 Cb 0.98 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.15 2ke5 h PHE 83 CO 0.15 0.06 -1.64 0.00 -0.60 0.00 0.00 178.31 176.28 2ke5 h ARG 84 N 0.00 0.41 0.00 1.51 3.08 -1.15 -3.27 114.38 114.96 2ke5 h ARG 84 Ca -0.00 -0.71 0.00 0.00 0.07 0.00 0.00 59.98 59.34 2ke5 h ARG 84 Cb 0.19 0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2ke5 h ARG 84 CO 0.01 1.32 0.00 -1.13 -1.07 0.00 0.00 179.97 179.10 2ke5 n SER 85 N -3.60 0.00 -4.83 7.04 3.41 -0.82 -4.78 113.62 110.03 2ke5 n SER 85 Ca -0.21 -0.52 -0.26 0.00 -0.26 0.00 0.00 58.87 57.62 2ke5 n SER 85 Cb 1.08 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.93 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 -2.12 2.43 0.00 5.00 0.00 -1.01 -5.07 107.32 106.54 2ke5 s GLY 86 Ca 0.29 -1.46 -0.00 0.00 0.00 0.00 0.00 44.72 43.55 2ke5 s GLY 86 CO 0.26 -1.94 -0.00 1.18 0.00 0.00 0.00 173.10 172.59 2ke5 n GLU 87 N -1.52 0.01 -2.96 2.90 1.02 -1.23 -4.99 120.64 113.87 2ke5 n GLU 87 Ca -0.03 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.93 2ke5 n GLU 87 Cb 0.64 -0.51 0.01 0.00 -0.02 0.00 0.00 31.44 31.57 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 -4.96 1.93 -0.00 0.62 0.00 0.29 -4.76 107.32 100.43 2ke5 s GLY 88 Ca -0.00 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.10 2ke5 s GLY 88 CO 0.01 -1.42 0.00 -1.36 0.00 0.00 0.00 173.10 170.32 2ke5 s PHE 89 N -2.41 0.02 -0.28 1.90 0.08 -1.22 -2.61 117.98 113.47 2ke5 s PHE 89 Ca 0.55 0.01 -0.00 0.00 0.12 0.00 0.00 56.93 57.61 2ke5 s PHE 89 Cb -0.10 -0.04 0.08 0.00 -0.57 0.00 0.00 43.02 42.39 2ke5 s PHE 89 CO 0.34 -0.01 0.05 -1.17 -0.10 0.00 0.00 175.22 174.33 2ke5 s LEU 90 N 0.14 2.32 -0.14 -0.37 2.96 -0.46 -3.58 118.68 119.55 2ke5 s LEU 90 Ca -0.01 -1.43 -0.24 0.00 -0.22 0.00 0.00 54.13 52.22 2ke5 s LEU 90 Cb -0.02 -0.94 -0.02 0.00 0.50 0.00 0.00 46.19 45.71 2ke5 s LEU 90 CO -0.00 -0.36 0.76 -0.22 -1.32 0.00 0.00 176.35 175.21 2ke5 s LEU 91 N 1.56 4.22 -0.01 -0.68 1.98 -0.72 -1.51 118.68 123.52 2ke5 s LEU 91 Ca 0.05 1.13 0.00 0.00 -2.89 0.00 0.00 54.13 52.43 2ke5 s LEU 91 Cb -0.18 -3.14 0.01 0.00 0.66 0.00 0.00 46.19 43.55 2ke5 s LEU 91 CO -0.17 -0.28 -0.01 -0.69 -1.89 0.00 0.00 176.35 173.32 2ke5 s VAL 92 N 1.64 0.13 0.03 1.68 1.01 -0.37 -0.99 120.40 123.53 2ke5 s VAL 92 Ca 0.37 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2ke5 s VAL 92 Cb -0.17 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 2ke5 s VAL 92 CO 0.14 0.08 -0.05 0.72 0.00 0.00 0.00 175.10 175.99 2ke5 s PHE 93 N 0.45 0.47 -0.01 5.22 -0.12 -0.80 -4.18 117.98 119.01 2ke5 s PHE 93 Ca -0.04 -0.55 -0.20 0.00 -0.05 0.00 0.00 56.93 56.08 2ke5 s PHE 93 Cb -0.07 -0.30 -0.05 0.00 -0.63 0.00 0.00 43.02 41.97 2ke5 s PHE 93 CO -0.01 -0.15 0.59 -1.12 -0.05 0.00 0.00 175.22 174.48 2ke5 s SER 94 N -1.63 6.95 0.33 1.98 0.01 -1.26 -0.89 113.70 119.18 2ke5 s SER 94 Ca -0.11 1.14 0.08 0.00 1.31 0.00 0.00 55.95 58.37 2ke5 s SER 94 Cb -0.09 -2.36 0.57 0.00 0.21 0.00 0.00 66.02 64.36 2ke5 s SER 94 CO -0.01 0.09 1.77 0.16 0.41 0.00 0.00 173.24 175.67 2ke5 h ILE 95 N 4.18 1.28 0.00 1.44 3.07 -1.86 -2.54 117.51 123.08 2ke5 h ILE 95 Ca -0.45 -1.32 -0.04 0.00 1.55 0.00 0.00 64.86 64.60 2ke5 h ILE 95 Cb 1.20 1.59 -0.01 0.00 -0.27 0.00 0.00 36.82 39.33 2ke5 h ILE 95 CO 0.70 0.39 -0.20 0.71 -1.05 0.00 0.00 178.15 178.70 2ke5 h THR 96 N 0.17 0.69 -3.45 0.16 1.35 -1.86 -3.24 112.91 106.73 2ke5 h THR 96 Ca 0.02 -0.87 -0.70 0.00 -0.55 0.00 0.00 66.41 64.31 2ke5 h THR 96 Cb 0.69 1.55 -0.33 0.00 -1.73 0.00 0.00 68.15 68.33 2ke5 h THR 96 CO 0.05 0.20 -0.50 -1.61 -0.25 0.00 0.00 175.52 173.41 2ke5 s GLU 97 N -4.00 2.13 0.41 4.72 0.41 -0.95 -4.93 118.70 116.49 2ke5 s GLU 97 Ca -0.02 -1.84 0.29 0.00 -0.41 0.00 0.00 54.97 52.99 2ke5 s GLU 97 Cb 0.12 -3.67 1.45 0.00 -1.78 0.00 0.00 34.13 30.26 2ke5 s GLU 97 CO 0.63 -1.11 1.87 1.25 -0.49 0.00 0.00 175.26 177.41 2ke5 h HIS 98 N 8.09 0.00 0.00 1.61 -0.00 -1.76 -1.43 115.15 121.67 2ke5 h HIS 98 Ca -0.14 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.13 2ke5 h HIS 98 Cb 1.05 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.44 2ke5 h HIS 98 CO 0.58 0.00 -0.49 0.93 -0.00 0.00 0.00 177.93 178.95 2ke5 h GLU 99 N 0.00 0.00 0.18 5.26 5.08 -1.91 -3.13 114.58 120.06 2ke5 h GLU 99 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 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 0.49 -0.09 0.66 -1.00 0.00 0.00 179.01 179.07 2ke5 h SER 100 N 0.00 -0.20 -0.99 1.42 4.64 -1.53 -1.34 113.55 115.54 2ke5 h SER 100 Ca -0.00 -0.32 0.18 0.00 -0.47 0.00 0.00 61.79 61.17 2ke5 h SER 100 Cb 1.01 0.05 -0.10 0.00 -0.31 0.00 0.00 62.40 63.05 2ke5 h SER 100 CO 0.06 0.28 0.61 0.15 -0.87 0.00 0.00 176.83 177.07 2ke5 h PHE 101 N -0.77 1.01 0.14 4.77 3.57 -1.64 0.93 116.94 124.94 2ke5 h PHE 101 Ca -0.02 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2ke5 h PHE 101 Cb 0.52 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.95 2ke5 h PHE 101 CO 0.07 0.25 -0.07 1.79 -2.23 0.00 0.00 178.31 178.13 2ke5 h THR 102 N 0.75 0.94 -0.95 4.41 1.35 -1.55 -3.26 112.91 114.59 2ke5 h THR 102 Ca 0.56 -1.20 0.04 0.00 -0.55 0.00 0.00 66.41 65.26 2ke5 h THR 102 Cb 0.89 1.58 -0.05 0.00 -1.73 0.00 0.00 68.15 68.83 2ke5 h THR 102 CO -0.34 0.25 0.63 0.00 -0.25 0.00 0.00 175.52 175.80 2ke5 h ALA 103 N -0.22 1.39 -0.55 6.62 0.00 -0.87 -1.27 119.26 124.35 2ke5 h ALA 103 Ca -0.02 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 54.98 2ke5 h ALA 103 Cb 0.54 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2ke5 h ALA 103 CO 0.03 0.52 0.39 1.79 0.00 0.00 0.00 179.25 181.98 2ke5 h THR 104 N 1.20 0.79 -0.43 0.00 1.35 -0.92 -0.42 112.91 114.48 2ke5 h THR 104 Ca 0.38 -0.05 -0.07 0.00 -0.55 0.00 0.00 66.41 66.12 2ke5 h THR 104 Cb 0.01 0.63 -0.02 0.00 -1.73 0.00 0.00 68.15 67.04 2ke5 h THR 104 CO -0.12 0.03 -0.01 0.00 -0.25 0.00 0.00 175.52 175.16 2ke5 h ALA 105 N 1.73 1.17 -0.77 6.62 0.00 -1.26 -2.69 119.26 124.06 2ke5 h ALA 105 Ca 0.26 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2ke5 h ALA 105 Cb 0.85 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2ke5 h ALA 105 CO -0.04 0.54 0.32 0.93 0.00 0.00 0.00 179.25 181.01 2ke5 h GLU 106 N 0.66 1.13 0.00 0.00 4.39 -1.12 -2.23 114.58 117.41 2ke5 h GLU 106 Ca 0.13 -0.20 -0.04 0.00 0.34 0.00 0.00 59.36 59.60 2ke5 h GLU 106 Cb 0.43 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2ke5 h GLU 106 CO 0.02 0.91 -0.19 0.74 -1.16 0.00 0.00 179.01 179.33 2ke5 h PHE 107 N 1.10 0.00 -0.77 4.33 -1.00 -1.43 -2.99 116.94 116.18 2ke5 h PHE 107 Ca 0.26 0.00 0.15 0.00 2.81 0.00 0.00 57.97 61.19 2ke5 h PHE 107 Cb 0.19 0.00 -0.10 0.00 3.61 0.00 0.00 35.95 39.65 2ke5 h PHE 107 CO 0.02 0.19 0.30 -0.09 -1.61 0.00 0.00 178.31 177.11 2ke5 h ARG 108 N 0.00 0.40 -0.26 1.51 2.43 -1.10 -0.59 114.38 116.77 2ke5 h ARG 108 Ca -0.00 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.00 2ke5 h ARG 108 Cb 0.50 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2ke5 h ARG 108 CO 0.02 0.27 -0.40 0.93 -1.51 0.00 0.00 179.97 179.28 2ke5 h GLU 109 N 0.42 0.72 -0.80 0.20 5.08 -1.64 -3.16 114.58 115.40 2ke5 h GLU 109 Ca 0.43 -0.43 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 2ke5 h GLU 109 Cb 0.69 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.93 2ke5 h GLU 109 CO -0.43 1.06 0.52 1.96 -1.00 0.00 0.00 179.01 181.12 2ke5 h GLN 110 N 0.45 0.73 -0.32 2.33 1.08 -1.23 -1.56 115.11 116.60 2ke5 h GLN 110 Ca 0.02 -0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.19 2ke5 h GLN 110 Cb 0.99 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 28.23 2ke5 h GLN 110 CO 0.09 0.49 0.18 0.82 -0.95 0.00 0.00 178.83 179.45 2ke5 h ILE 111 N 0.76 1.02 0.00 2.54 2.04 -1.13 -2.18 117.51 120.56 2ke5 h ILE 111 Ca 0.37 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 66.02 2ke5 h ILE 111 Cb 0.42 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2ke5 h ILE 111 CO -0.14 0.07 -0.40 -0.07 0.00 0.00 0.00 178.15 177.61 2ke5 h LEU 112 N 0.36 0.00 0.10 1.44 3.38 -1.37 -3.14 115.31 116.08 2ke5 h LEU 112 Ca 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2ke5 h LEU 112 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2ke5 h LEU 112 CO -0.07 0.40 -0.05 0.03 0.09 0.00 0.00 178.44 178.84 2ke5 h ARG 113 N 0.00 -0.13 0.00 1.13 3.08 -0.69 0.26 114.38 118.04 2ke5 h ARG 113 Ca -0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ke5 h ARG 113 Cb 0.71 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.79 2ke5 h ARG 113 CO 0.05 -0.04 0.00 1.33 -1.07 0.00 0.00 179.97 180.24 2ke5 n VAL 114 N -5.13 0.97 -1.72 2.04 0.24 -1.03 -2.12 118.33 111.59 2ke5 n VAL 114 Ca -0.08 0.37 0.06 0.00 -2.04 0.00 0.00 64.34 62.65 2ke5 n VAL 114 Cb 0.10 -1.30 0.16 0.00 -1.47 0.00 0.00 33.84 31.33 2ke5 n VAL 114 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2ke5 n LYS 115 N -2.11 1.23 0.30 7.34 4.76 -0.81 -4.77 118.16 124.11 2ke5 n LYS 115 Ca 0.01 -2.93 0.16 0.00 -2.87 0.00 0.00 58.31 52.68 2ke5 n LYS 115 Cb 0.16 -1.28 0.96 0.00 -1.84 0.00 0.00 35.03 33.03 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 0.87 1.46 0.00 7.82 0.00 0.05 0.10 119.26 129.56 2ke5 h ALA 116 Ca -0.04 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 2ke5 h ALA 116 Cb 1.17 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2ke5 h ALA 116 CO 0.02 0.00 -0.61 0.93 0.00 0.00 0.00 179.25 179.59 2ke5 h GLU 117 N 0.00 0.00 0.00 0.00 3.07 -1.85 -3.46 114.58 112.34 2ke5 h GLU 117 Ca -0.00 0.00 -0.37 0.00 -0.50 0.00 0.00 59.36 58.49 2ke5 h GLU 117 Cb 0.00 0.00 0.13 0.00 -0.84 0.00 0.00 28.75 28.04 2ke5 h GLU 117 CO 0.00 0.56 0.29 0.39 -1.40 0.00 0.00 179.01 178.85 2ke5 n GLU 118 N -3.23 -0.80 0.08 2.33 -0.58 0.02 -5.07 120.64 113.39 2ke5 n GLU 118 Ca 0.01 -1.89 0.00 0.00 -0.42 0.00 0.00 57.16 54.86 2ke5 n GLU 118 Cb 0.77 -1.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.64 2ke5 n GLU 118 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2ke5 n ASP 119 N -3.51 0.73 -4.60 1.62 9.92 -1.26 -5.01 116.55 114.43 2ke5 n ASP 119 Ca 0.14 0.25 -0.43 0.00 -0.53 0.00 0.00 54.79 54.22 2ke5 n ASP 119 Cb 0.49 -0.11 -0.03 0.00 -0.64 0.00 0.00 41.12 40.83 2ke5 n ASP 119 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2ke5 s LYS 120 N -2.00 3.77 -0.35 -1.24 3.01 -1.26 -5.01 119.74 116.66 2ke5 s LYS 120 Ca 0.00 0.57 -0.02 0.00 -1.01 0.00 0.00 55.97 55.52 2ke5 s LYS 120 Cb 0.00 -3.86 0.08 0.00 -1.01 0.00 0.00 37.83 33.04 2ke5 s LYS 120 CO 0.00 -1.17 0.10 0.42 0.51 0.00 0.00 175.35 175.21 2ke5 s ILE 121 N 3.95 3.04 0.16 2.17 -1.09 -1.26 -4.76 121.20 123.41 2ke5 s ILE 121 Ca 0.43 -1.80 -0.31 0.00 -2.23 0.00 0.00 60.65 56.74 2ke5 s ILE 121 Cb -0.10 -2.96 -0.09 0.00 -1.58 0.00 0.00 42.46 37.74 2ke5 s ILE 121 CO 0.25 -0.43 1.46 -2.16 -1.23 0.00 0.00 174.94 172.83 2ke5 s PRO 122 N 1.16 4.28 0.06 2.79 0.04 -1.26 -5.02 135.00 137.05 2ke5 s PRO 122 Ca 0.03 2.22 -0.05 0.00 0.04 0.00 0.00 61.00 63.24 2ke5 s PRO 122 Cb -0.21 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 2ke5 s PRO 122 CO -0.03 -0.48 0.07 -1.17 0.04 0.00 0.00 177.00 175.43 2ke5 s LEU 123 N 0.79 1.98 -0.30 -3.56 2.96 -1.26 -3.40 118.68 115.88 2ke5 s LEU 123 Ca 0.65 -0.78 -0.13 0.00 -0.22 0.00 0.00 54.13 53.65 2ke5 s LEU 123 Cb -0.40 0.57 0.15 0.00 0.50 0.00 0.00 46.19 47.01 2ke5 s LEU 123 CO 0.33 -0.62 0.87 -0.22 -1.32 0.00 0.00 176.35 175.39 2ke5 s LEU 124 N -2.72 -0.77 -0.05 -0.68 2.96 -1.23 -4.86 118.68 111.33 2ke5 s LEU 124 Ca 0.04 1.07 -0.04 0.00 -0.22 0.00 0.00 54.13 54.98 2ke5 s LEU 124 Cb 0.05 1.89 -0.04 0.00 0.50 0.00 0.00 46.19 48.59 2ke5 s LEU 124 CO -0.09 -0.15 0.14 0.54 -1.32 0.00 0.00 176.35 175.47 2ke5 s VAL 125 N 2.54 5.30 -0.01 1.68 0.11 -1.26 -1.75 120.40 127.02 2ke5 s VAL 125 Ca -0.04 -0.08 -0.05 0.00 -2.93 0.00 0.00 61.98 58.88 2ke5 s VAL 125 Cb -0.08 -3.40 0.00 0.00 -1.53 0.00 0.00 36.38 31.37 2ke5 s VAL 125 CO -0.18 0.44 0.10 -0.69 -3.33 0.00 0.00 175.10 171.44 2ke5 s VAL 126 N -1.19 0.06 -0.15 2.04 1.01 -0.17 -3.08 120.40 118.93 2ke5 s VAL 126 Ca 0.22 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.64 2ke5 s VAL 126 Cb -0.12 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2ke5 s VAL 126 CO 0.12 -0.29 -0.04 -0.83 0.00 0.00 0.00 175.10 174.07 2ke5 s GLY 127 N -0.97 1.72 0.31 4.51 0.00 -0.59 -1.90 107.32 110.39 2ke5 s GLY 127 Ca -0.11 -0.82 0.01 0.00 0.00 0.00 0.00 44.72 43.81 2ke5 s GLY 127 CO 0.01 -0.08 0.42 -2.01 0.00 0.00 0.00 173.10 171.44 2ke5 n ASN 128 N 3.51 0.70 -1.07 1.64 5.15 -0.07 -0.55 115.26 124.57 2ke5 n ASN 128 Ca -0.17 -1.56 -0.13 0.00 -0.60 0.00 0.00 54.58 52.12 2ke5 n ASN 128 Cb 0.52 -0.26 -0.05 0.00 -0.53 0.00 0.00 39.78 39.46 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 -1.75 -1.58 0.16 1.20 4.76 -1.24 -2.97 118.16 116.75 2ke5 n LYS 129 Ca 0.07 0.88 0.10 0.00 -2.87 0.00 0.00 58.31 56.49 2ke5 n LYS 129 Cb 0.26 -5.18 0.55 0.00 -1.84 0.00 0.00 35.03 28.83 2ke5 n LYS 129 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2ke5 n SER 130 N -0.88 0.52 0.00 4.39 7.64 -1.09 -0.97 113.62 123.24 2ke5 n SER 130 Ca -0.13 0.73 0.07 0.00 1.01 0.00 0.00 58.87 60.55 2ke5 n SER 130 Cb 0.55 -0.79 0.39 0.00 -1.01 0.00 0.00 64.21 63.34 2ke5 n SER 130 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2ke5 n ASP 131 N -2.22 0.00 -2.78 6.43 5.75 -1.26 -3.31 116.55 119.17 2ke5 n ASP 131 Ca -0.01 -0.94 -0.21 0.00 -0.01 0.00 0.00 54.79 53.62 2ke5 n ASP 131 Cb 0.07 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.15 2ke5 n ASP 131 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2ke5 n LEU 132 N -0.80 3.22 0.04 -2.12 4.77 -0.14 -4.86 117.00 117.10 2ke5 n LEU 132 Ca 0.10 -4.98 0.06 0.00 -0.03 0.00 0.00 56.01 51.16 2ke5 n LEU 132 Cb 0.04 -0.07 0.26 0.00 -2.33 0.00 0.00 43.42 41.32 2ke5 n LEU 132 CO 0.07 2.13 0.68 -1.84 -1.33 0.00 0.00 177.39 177.10 2ke5 n GLU 133 N -0.19 0.04 0.22 3.23 0.28 -1.21 -1.65 120.64 121.38 2ke5 n GLU 133 Ca 0.28 0.42 0.12 0.00 -0.16 0.00 0.00 57.16 57.81 2ke5 n GLU 133 Cb 0.62 -1.61 0.31 0.00 1.43 0.00 0.00 31.44 32.20 2ke5 n GLU 133 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2ke5 h GLU 134 N 0.00 0.00 0.00 3.44 4.11 -1.92 -3.27 114.58 116.95 2ke5 h GLU 134 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2ke5 h GLU 134 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2ke5 h GLU 134 CO 0.00 0.09 -0.18 2.89 0.07 0.00 0.00 179.01 181.88 2ke5 n ARG 135 N -3.15 0.86 -1.69 1.06 1.85 -0.66 -5.04 116.66 109.89 2ke5 n ARG 135 Ca 0.02 -1.84 -0.42 0.00 -1.00 0.00 0.00 57.85 54.61 2ke5 n ARG 135 Cb 0.49 -1.06 -0.03 0.00 -1.05 0.00 0.00 32.46 30.81 2ke5 n ARG 135 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 2ke5 s ARG 136 N -1.58 3.05 0.18 2.89 3.52 -0.98 -4.77 118.95 121.26 2ke5 s ARG 136 Ca 0.17 1.80 0.01 0.00 -0.13 0.00 0.00 55.73 57.58 2ke5 s ARG 136 Cb 0.15 -4.36 0.05 0.00 -1.56 0.00 0.00 34.95 29.22 2ke5 s ARG 136 CO 0.02 -2.20 1.42 1.96 -0.81 0.00 0.00 175.30 175.68 2ke5 h GLN 137 N 15.10 0.27 -4.72 5.12 1.08 -1.91 -3.41 115.11 126.64 2ke5 h GLN 137 Ca -0.37 -0.25 -0.70 0.00 -1.45 0.00 0.00 58.65 55.87 2ke5 h GLN 137 Cb 1.23 0.06 -0.20 0.00 -0.05 0.00 0.00 27.48 28.52 2ke5 h GLN 137 CO 1.00 0.94 -0.16 0.08 -0.95 0.00 0.00 178.83 179.74 2ke5 s VAL 138 N -3.40 5.06 0.22 -0.54 1.01 -1.26 -5.05 120.40 116.45 2ke5 s VAL 138 Ca -0.04 -0.62 -0.32 0.00 0.00 0.00 0.00 61.98 61.00 2ke5 s VAL 138 Cb 0.10 -4.16 -0.13 0.00 0.00 0.00 0.00 36.38 32.20 2ke5 s VAL 138 CO 0.83 -0.60 1.55 -2.65 0.00 0.00 0.00 175.10 174.22 2ke5 n PRO 139 N 5.68 2.33 -0.36 2.72 -0.02 -1.26 -4.85 135.00 139.23 2ke5 n PRO 139 Ca -0.09 0.83 0.03 0.00 -2.02 0.00 0.00 63.50 62.25 2ke5 n PRO 139 Cb 0.46 -2.58 0.18 0.00 -0.02 0.00 0.00 33.50 31.54 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 3.40 1.09 -0.71 -1.45 3.04 -1.96 0.12 116.25 119.77 2ke5 h VAL 140 Ca -0.45 -0.40 -0.06 0.00 -1.01 0.00 0.00 66.70 64.78 2ke5 h VAL 140 Cb 1.25 -0.18 -0.03 0.00 -2.01 0.00 0.00 31.29 30.32 2ke5 h VAL 140 CO 0.84 0.21 0.20 -0.33 -1.01 0.00 0.00 177.57 177.48 2ke5 h GLU 141 N 1.17 1.13 0.00 4.17 5.08 -2.00 -0.50 114.58 123.63 2ke5 h GLU 141 Ca 0.43 -0.26 -0.12 0.00 -1.00 0.00 0.00 59.36 58.41 2ke5 h GLU 141 Cb 0.16 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2ke5 h GLU 141 CO -0.17 0.98 -0.58 1.49 -1.00 0.00 0.00 179.01 179.73 2ke5 h GLU 142 N 1.07 0.00 0.10 2.33 4.81 -1.72 -2.83 114.58 118.34 2ke5 h GLU 142 Ca 0.23 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2ke5 h GLU 142 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 2ke5 h GLU 142 CO -0.00 0.58 -0.05 0.00 -0.73 0.00 0.00 179.01 178.81 2ke5 h ALA 143 N 1.42 -0.13 -0.59 2.92 0.00 -0.41 -3.06 119.26 119.41 2ke5 h ALA 143 Ca -0.01 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.72 2ke5 h ALA 143 Cb 1.16 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 2ke5 h ALA 143 CO 0.08 -0.25 0.24 0.00 0.00 0.00 0.00 179.25 179.32 2ke5 h ARG 144 N -0.79 0.42 -0.42 0.00 3.08 -1.17 0.21 114.38 115.71 2ke5 h ARG 144 Ca -0.01 -0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.10 2ke5 h ARG 144 Cb 0.57 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 2ke5 h ARG 144 CO 0.02 0.28 0.29 1.03 -1.07 0.00 0.00 179.97 180.52 2ke5 h SER 145 N 0.43 0.16 -0.01 7.04 0.87 -1.58 -1.48 113.55 118.98 2ke5 h SER 145 Ca 0.29 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.81 2ke5 h SER 145 Cb 0.32 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 2ke5 h SER 145 CO -0.27 0.10 -0.16 0.50 -0.53 0.00 0.00 176.83 176.47 2ke5 h LYS 146 N 0.18 0.12 -0.76 2.24 3.11 -0.91 -3.30 116.57 117.26 2ke5 h LYS 146 Ca 0.19 -0.12 0.10 0.00 -2.81 0.00 0.00 60.65 58.02 2ke5 h LYS 146 Cb 0.53 0.03 -0.08 0.00 -1.00 0.00 0.00 32.23 31.71 2ke5 h LYS 146 CO -0.03 0.84 0.40 0.00 -2.81 0.00 0.00 179.45 177.85 2ke5 h ALA 147 N 0.28 1.08 -0.69 5.00 0.00 -0.40 -0.19 119.26 124.35 2ke5 h ALA 147 Ca -0.02 0.05 0.16 0.00 0.00 0.00 0.00 54.91 55.10 2ke5 h ALA 147 Cb 0.89 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 2ke5 h ALA 147 CO 0.03 -0.01 0.47 1.49 0.00 0.00 0.00 179.25 181.23 2ke5 h GLU 148 N 0.66 0.25 -0.55 0.00 4.81 -0.83 -1.59 114.58 117.32 2ke5 h GLU 148 Ca 0.38 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.70 2ke5 h GLU 148 Cb 0.41 -0.06 -0.09 0.00 0.63 0.00 0.00 28.75 29.65 2ke5 h GLU 148 CO -0.28 0.16 0.04 0.93 -0.73 0.00 0.00 179.01 179.14 2ke5 h GLU 149 N 0.26 0.16 0.00 1.92 4.39 -1.09 0.21 114.58 120.41 2ke5 h GLU 149 Ca 0.33 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 60.01 2ke5 h GLU 149 Cb 0.95 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.56 2ke5 h GLU 149 CO -0.07 0.10 -0.09 -1.49 -1.16 0.00 0.00 179.01 176.30 2ke5 h TRP 150 N 0.16 0.00 0.00 4.33 6.55 -1.40 -3.46 115.95 122.13 2ke5 h TRP 150 Ca 0.28 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.12 2ke5 h TRP 150 Cb 0.43 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.73 2ke5 h TRP 150 CO -0.30 0.09 0.00 0.41 -1.05 0.00 0.00 178.44 177.59 2ke5 n GLY 151 N 0.30 1.21 3.81 1.49 0.00 0.72 -5.10 105.19 107.61 2ke5 n GLY 151 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 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 2.00 -0.12 1.61 -7.23 -1.04 -4.96 120.40 108.67 2ke5 s VAL 152 Ca 0.00 -1.64 0.02 0.00 -1.81 0.00 0.00 61.98 58.55 2ke5 s VAL 152 Cb 0.00 -2.64 -0.01 0.00 0.56 0.00 0.00 36.38 34.29 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 -4.04 3.22 -0.08 4.82 -2.07 -1.26 -2.24 119.66 118.01 2ke5 s GLN 153 Ca 0.35 -0.76 -0.14 0.00 -1.82 0.00 0.00 55.36 52.99 2ke5 s GLN 153 Cb 0.01 -2.49 -0.05 0.00 -1.09 0.00 0.00 33.01 29.39 2ke5 s GLN 153 CO 0.20 0.21 0.35 -0.47 -1.32 0.00 0.00 175.29 174.26 2ke5 s TYR 154 N 0.31 3.60 0.05 9.60 5.04 -1.26 -4.12 117.35 130.57 2ke5 s TYR 154 Ca -0.13 0.80 0.06 0.00 -2.44 0.00 0.00 57.07 55.35 2ke5 s TYR 154 Cb -0.17 -2.30 -0.02 0.00 0.35 0.00 0.00 41.96 39.82 2ke5 s TYR 154 CO 0.07 0.47 -0.16 0.08 -1.34 0.00 0.00 175.55 174.66 2ke5 s VAL 155 N -0.36 1.31 -0.04 3.14 1.01 -1.18 -4.79 120.40 119.51 2ke5 s VAL 155 Ca 0.21 -1.15 -0.20 0.00 0.00 0.00 0.00 61.98 60.84 2ke5 s VAL 155 Cb -0.15 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 2ke5 s VAL 155 CO 0.09 0.02 0.56 -1.61 0.00 0.00 0.00 175.10 174.16 2ke5 s GLU 156 N -1.31 4.31 -0.00 2.72 2.02 -1.26 -1.55 118.70 123.62 2ke5 s GLU 156 Ca 0.03 0.66 -0.05 0.00 0.02 0.00 0.00 54.97 55.63 2ke5 s GLU 156 Cb -0.09 -3.37 -0.00 0.00 0.10 0.00 0.00 34.13 30.78 2ke5 s GLU 156 CO 0.02 0.31 0.09 0.95 0.02 0.00 0.00 175.26 176.65 2ke5 s THR 157 N 0.04 0.08 -0.26 3.63 -4.23 0.29 -4.86 115.64 110.32 2ke5 s THR 157 Ca 0.30 -0.64 0.02 0.00 -1.18 0.00 0.00 61.69 60.19 2ke5 s THR 157 Cb -0.17 -0.34 0.07 0.00 1.34 0.00 0.00 72.50 73.39 2ke5 s THR 157 CO 0.15 -0.35 -0.04 -0.94 -0.54 0.00 0.00 174.62 172.90 2ke5 s SER 158 N -1.17 4.18 0.25 3.99 1.04 -1.26 -2.68 113.70 118.05 2ke5 s SER 158 Ca -0.13 -1.42 0.17 0.00 0.48 0.00 0.00 55.95 55.05 2ke5 s SER 158 Cb -0.07 -1.34 0.92 0.00 0.10 0.00 0.00 66.02 65.63 2ke5 s SER 158 CO 0.01 -0.26 1.52 0.00 0.98 0.00 0.00 173.24 175.50 2ke5 n ALA 159 N 4.55 1.07 -0.11 5.32 0.00 -1.26 -0.64 120.51 129.44 2ke5 n ALA 159 Ca -0.10 0.15 -0.14 0.00 0.00 0.00 0.00 53.44 53.36 2ke5 n ALA 159 Cb 0.43 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 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 0.92 0.00 0.00 1.63 -2.00 -3.21 116.57 113.92 2ke5 h LYS 160 Ca 0.00 -0.51 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 2ke5 h LYS 160 Cb 0.02 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.68 2ke5 h LYS 160 CO 0.00 1.16 -1.29 0.25 -3.45 0.00 0.00 179.45 176.12 2ke5 n THR 161 N -4.05 0.00 -3.13 1.00 -2.24 -0.49 -4.92 114.28 100.45 2ke5 n THR 161 Ca -0.03 -0.15 -0.20 0.00 -2.27 0.00 0.00 64.05 61.40 2ke5 n THR 161 Cb 0.57 0.69 -0.00 0.00 -2.10 0.00 0.00 70.33 69.49 2ke5 n THR 161 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ke5 n ARG 162 N -1.73 -3.27 -0.01 -0.78 1.74 0.19 -4.87 116.66 107.93 2ke5 n ARG 162 Ca 0.02 0.52 -0.07 0.00 -0.77 0.00 0.00 57.85 57.55 2ke5 n ARG 162 Cb 0.40 -5.22 -0.06 0.00 -1.02 0.00 0.00 32.46 26.57 2ke5 n ARG 162 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ke5 h ALA 163 N 0.98 -0.10 -0.31 7.54 0.00 -1.92 -3.39 119.26 122.07 2ke5 h ALA 163 Ca -0.40 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2ke5 h ALA 163 Cb 1.27 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2ke5 h ALA 163 CO 0.49 -0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.71 2ke5 n ASN 164 N -4.80 3.31 -0.18 0.00 4.13 -1.26 -4.59 115.26 111.87 2ke5 n ASN 164 Ca -0.05 -2.41 -0.10 0.00 1.68 0.00 0.00 54.58 53.70 2ke5 n ASN 164 Cb 0.22 -0.36 0.01 0.00 -1.54 0.00 0.00 39.78 38.11 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 1.92 1.26 0.00 2.41 3.04 -1.87 -2.41 116.25 120.60 2ke5 h VAL 165 Ca 0.00 -1.07 0.00 0.00 -1.01 0.00 0.00 66.70 64.62 2ke5 h VAL 165 Cb 1.02 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 2ke5 h VAL 165 CO 0.09 0.38 0.00 0.44 -1.01 0.00 0.00 177.57 177.47 2ke5 h ASP 166 N 0.79 0.00 -0.69 3.17 5.19 -1.82 -3.24 116.42 119.81 2ke5 h ASP 166 Ca 0.15 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.58 2ke5 h ASP 166 Cb 0.50 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.98 2ke5 h ASP 166 CO 0.02 0.00 0.46 0.50 -3.12 0.00 0.00 179.24 177.10 2ke5 h LYS 167 N 0.00 0.86 -0.12 3.56 3.11 -1.70 -1.78 116.57 120.50 2ke5 h LYS 167 Ca 0.00 -0.05 -0.15 0.00 -2.81 0.00 0.00 60.65 57.64 2ke5 h LYS 167 Cb 0.71 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.74 2ke5 h LYS 167 CO 0.00 0.57 -0.55 -0.24 -2.81 0.00 0.00 179.45 176.42 2ke5 h VAL 168 N 0.88 1.35 -0.27 2.00 3.04 -1.61 -0.37 116.25 121.28 2ke5 h VAL 168 Ca 0.27 -1.84 -0.14 0.00 -1.01 0.00 0.00 66.70 63.97 2ke5 h VAL 168 Cb -0.01 1.86 -0.00 0.00 -2.01 0.00 0.00 31.29 31.12 2ke5 h VAL 168 CO -0.07 0.56 -0.40 -0.26 -1.01 0.00 0.00 177.57 176.39 2ke5 h PHE 169 N 0.28 0.91 -0.14 3.17 -1.00 -1.58 -0.75 116.94 117.83 2ke5 h PHE 169 Ca 0.00 -0.31 -0.18 0.00 2.81 0.00 0.00 57.97 60.29 2ke5 h PHE 169 Cb 1.06 -0.18 -0.00 0.00 3.61 0.00 0.00 35.95 40.44 2ke5 h PHE 169 CO 0.03 1.09 -0.67 0.74 -1.61 0.00 0.00 178.31 177.89 2ke5 h PHE 170 N 0.48 0.74 0.17 -0.55 0.04 -1.31 -2.40 116.94 114.12 2ke5 h PHE 170 Ca 0.03 -0.30 -0.01 0.00 2.80 0.00 0.00 57.97 60.49 2ke5 h PHE 170 Cb 0.99 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 39.02 2ke5 h PHE 170 CO 0.08 1.07 -0.08 0.22 -0.60 0.00 0.00 178.31 179.00 2ke5 h ASP 171 N 0.41 -0.19 -0.33 2.17 1.82 -1.06 -3.21 116.42 116.03 2ke5 h ASP 171 Ca -0.02 -0.34 0.04 0.00 -0.39 0.00 0.00 57.03 56.31 2ke5 h ASP 171 Cb 1.24 0.05 -0.02 0.00 0.68 0.00 0.00 39.33 41.28 2ke5 h ASP 171 CO 0.12 0.33 0.22 0.25 -1.61 0.00 0.00 179.24 178.55 2ke5 h LEU 172 N -0.80 0.26 -0.32 2.28 5.85 -1.24 -2.46 115.31 118.88 2ke5 h LEU 172 Ca -0.02 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.73 2ke5 h LEU 172 Cb 0.52 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 2ke5 h LEU 172 CO 0.04 0.18 0.11 -0.03 -0.34 0.00 0.00 178.44 178.40 2ke5 h MET 173 N 0.30 0.24 -0.84 1.25 4.05 -1.45 -1.97 114.93 116.52 2ke5 h MET 173 Ca 0.14 -0.01 0.09 0.00 -0.28 0.00 0.00 59.70 59.64 2ke5 h MET 173 Cb 0.18 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.86 2ke5 h MET 173 CO -0.03 0.16 0.55 0.00 0.23 0.00 0.00 176.91 177.82 2ke5 h ARG 174 N 0.25 0.79 -0.56 0.39 3.08 -1.44 -1.16 114.38 115.73 2ke5 h ARG 174 Ca 0.14 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.05 2ke5 h ARG 174 Cb 0.11 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 2ke5 h ARG 174 CO -0.15 0.52 -0.04 0.93 -1.07 0.00 0.00 179.97 180.16 2ke5 h GLU 175 N 0.81 1.01 -0.45 0.04 4.39 -1.39 -1.90 114.58 117.08 2ke5 h GLU 175 Ca 0.39 -0.33 -0.03 0.00 0.34 0.00 0.00 59.36 59.72 2ke5 h GLU 175 Cb 0.41 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 2ke5 h GLU 175 CO -0.15 1.01 0.14 0.82 -1.16 0.00 0.00 179.01 179.67 2ke5 h ILE 176 N 0.91 1.19 -0.00 3.13 2.04 -0.67 0.39 117.51 124.49 2ke5 h ILE 176 Ca 0.16 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 65.32 2ke5 h ILE 176 Cb 0.59 0.69 0.01 0.00 -0.74 0.00 0.00 36.82 37.36 2ke5 h ILE 176 CO 0.04 0.24 -0.26 0.03 0.00 0.00 0.00 178.15 178.20 2ke5 h ARG 177 N 0.65 0.18 0.00 2.37 3.08 -1.22 -3.00 114.38 116.44 2ke5 h ARG 177 Ca 0.15 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2ke5 h ARG 177 Cb 0.19 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 2ke5 h ARG 177 CO -0.01 0.92 -0.42 1.15 -1.07 0.00 0.00 179.97 180.55 2ke5 h THR 178 N -0.50 0.09 0.29 2.04 2.02 -1.27 -3.32 112.91 112.26 2ke5 h THR 178 Ca -0.03 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.04 2ke5 h THR 178 Cb 1.01 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2ke5 h THR 178 CO 0.05 0.03 -0.14 0.50 0.37 0.00 0.00 175.52 176.33 2ke5 h LYS 179 N -1.00 -0.38 0.63 6.66 3.64 -0.48 -1.85 116.57 123.80 2ke5 h LYS 179 Ca -0.02 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2ke5 h LYS 179 Cb 0.44 0.09 0.01 0.00 -0.41 0.00 0.00 32.23 32.35 2ke5 h LYS 179 CO -0.01 -0.08 -0.30 -0.22 -2.27 0.00 0.00 179.45 176.57 2ke5 h LYS 180 N -0.69 -0.82 0.00 1.90 3.11 -1.28 -2.50 116.57 116.30 2ke5 h LYS 180 Ca -0.04 0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.86 2ke5 h LYS 180 Cb 0.48 0.19 0.00 0.00 -1.00 0.00 0.00 32.23 31.89 2ke5 h LYS 180 CO 0.07 -0.54 0.00 0.52 -2.81 0.00 0.00 179.45 176.68 2ke5 h MET 181 N -0.86 0.00 0.89 1.90 2.86 -1.62 -2.96 114.93 115.13 2ke5 h MET 181 Ca -0.09 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.51 2ke5 h MET 181 Cb 0.66 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.32 2ke5 h MET 181 CO 0.14 0.00 -0.44 1.03 1.06 0.00 0.00 176.91 178.71 2ke5 h SER 182 N 0.00 -1.04 -3.35 1.22 0.87 -0.85 -3.49 113.55 106.91 2ke5 h SER 182 Ca 0.00 0.04 0.38 0.00 -1.23 0.00 0.00 61.79 60.98 2ke5 h SER 182 Cb 0.10 0.27 -0.13 0.00 -0.44 0.00 0.00 62.40 62.20 2ke5 h SER 182 CO 0.00 -0.73 -0.78 -0.62 -0.53 0.00 0.00 176.83 174.17 2ke5 n GLU 183 N -5.61 -3.09 -2.42 2.24 -0.58 -1.12 -4.74 120.64 105.32 2ke5 n GLU 183 Ca -0.16 2.21 -0.41 0.00 -0.42 0.00 0.00 57.16 58.39 2ke5 n GLU 183 Cb 0.48 -3.71 -0.04 0.00 -0.57 0.00 0.00 31.44 27.60 2ke5 n GLU 183 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2ke5 s ASN 184 N -7.22 7.15 0.00 1.62 4.22 -1.26 -4.97 114.94 114.48 2ke5 s ASN 184 Ca 0.00 2.21 0.00 0.00 -2.14 0.00 0.00 52.86 52.93 2ke5 s ASN 184 Cb 0.00 -2.61 0.00 0.00 1.28 0.00 0.00 41.25 39.92 2ke5 s ASN 184 CO 0.00 -0.30 0.00 0.29 -2.04 0.00 0.00 177.10 175.05