#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ek4 s VAL 2 N 0.00 0.00 -0.12 3.17 0.11 -0.35 -4.63 120.40 118.58 2ek4 s VAL 2 Ca 0.00 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.08 2ek4 s VAL 2 Cb 0.00 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.86 2ek4 s VAL 2 CO 0.00 0.00 -0.20 -0.22 -3.33 0.00 0.00 175.10 171.35 2ek4 s LEU 3 N -1.76 1.99 -0.15 2.54 2.96 -0.30 0.19 118.68 124.16 2ek4 s LEU 3 Ca -0.00 -0.53 -0.03 0.00 -0.22 0.00 0.00 54.13 53.34 2ek4 s LEU 3 Cb -0.01 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.34 2ek4 s LEU 3 CO -0.02 0.09 -0.04 -0.31 -1.32 0.00 0.00 176.35 174.74 2ek4 s TYR 4 N 0.71 3.02 -0.41 5.38 2.02 0.13 -1.13 117.35 127.07 2ek4 s TYR 4 Ca -0.11 -0.28 -0.15 0.00 -0.37 0.00 0.00 57.07 56.16 2ek4 s TYR 4 Cb -0.16 -1.95 0.02 0.00 -0.40 0.00 0.00 41.96 39.47 2ek4 s TYR 4 CO 0.02 -0.02 0.31 -0.06 -1.57 0.00 0.00 175.55 174.23 2ek4 s PHE 5 N 0.30 3.23 -0.17 2.71 0.40 0.35 -0.19 117.98 124.61 2ek4 s PHE 5 Ca -0.04 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 55.73 2ek4 s PHE 5 Cb -0.14 -2.61 0.00 0.00 0.51 0.00 0.00 43.02 40.79 2ek4 s PHE 5 CO 0.03 -0.59 -0.16 0.42 0.70 0.00 0.00 175.22 175.62 2ek4 s ILE 6 N 1.71 2.54 0.25 0.64 1.01 -0.39 -0.28 121.20 126.67 2ek4 s ILE 6 Ca 0.06 -0.80 -0.29 0.00 0.00 0.00 0.00 60.65 59.61 2ek4 s ILE 6 Cb -0.19 -2.08 -0.09 0.00 0.01 0.00 0.00 42.46 40.11 2ek4 s ILE 6 CO 0.10 0.51 0.93 -0.83 0.00 0.00 0.00 174.94 175.66 2ek4 s GLY 7 N 1.05 3.07 0.00 6.18 0.00 -0.60 -2.20 107.32 114.83 2ek4 s GLY 7 Ca -0.01 0.60 0.23 0.00 0.00 0.00 0.00 44.72 45.54 2ek4 s GLY 7 CO -0.04 1.15 1.18 1.03 0.00 0.00 0.00 173.10 176.42 2ek4 n MET 8 N 1.38 0.44 0.00 2.90 2.81 0.73 -4.54 117.12 120.83 2ek4 n MET 8 Ca -0.02 -0.33 0.00 0.00 -1.81 0.00 0.00 57.70 55.55 2ek4 n MET 8 Cb 0.47 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.49 2ek4 n MET 8 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ek4 n GLY 9 N 1.45 -2.63 0.29 3.03 0.00 -1.05 -2.71 105.19 103.57 2ek4 n GLY 9 Ca 0.07 -1.82 -0.15 0.00 0.00 0.00 0.00 46.02 44.13 2ek4 n GLY 9 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ek4 h LEU 10 N 0.00 -0.57 0.00 0.99 3.38 -1.83 0.41 115.31 117.69 2ek4 h LEU 10 Ca 0.00 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 2ek4 h LEU 10 Cb 0.00 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2ek4 h LEU 10 CO 0.00 -0.23 -0.84 0.00 0.09 0.00 0.00 178.44 177.46 2ek4 n TYR 11 N -5.28 0.00 -4.52 1.13 9.36 -1.25 -4.62 117.16 111.97 2ek4 n TYR 11 Ca -0.11 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 60.86 2ek4 n TYR 11 Cb 0.31 -0.16 -0.06 0.00 -0.63 0.00 0.00 39.34 38.80 2ek4 n TYR 11 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 2ek4 n ASP 12 N -3.45 1.79 0.31 2.98 5.68 -1.26 -1.50 116.55 121.10 2ek4 n ASP 12 Ca -0.08 -2.99 0.18 0.00 -0.50 0.00 0.00 54.79 51.40 2ek4 n ASP 12 Cb 0.38 0.77 1.00 0.00 -1.14 0.00 0.00 41.12 42.12 2ek4 n ASP 12 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2ek4 h GLU 13 N 0.00 0.00 0.00 0.11 9.09 -1.85 -1.88 114.58 120.04 2ek4 h GLU 13 Ca -0.32 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.09 2ek4 h GLU 13 Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 2ek4 h GLU 13 CO 0.51 0.02 0.00 0.54 0.05 0.00 0.00 179.01 180.13 2ek4 n ARG 14 N -3.37 0.77 -0.02 1.06 1.74 -1.26 -3.19 116.66 112.39 2ek4 n ARG 14 Ca -0.02 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.18 2ek4 n ARG 14 Cb 0.13 -1.50 0.59 0.00 -1.02 0.00 0.00 32.46 30.66 2ek4 n ARG 14 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2ek4 n ASP 15 N -1.11 0.65 -4.80 0.55 8.00 -0.71 -4.81 116.55 114.32 2ek4 n ASP 15 Ca 0.20 -1.41 -0.35 0.00 0.71 0.00 0.00 54.79 53.94 2ek4 n ASP 15 Cb 0.16 -0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 41.18 2ek4 n ASP 15 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2ek4 s ILE 16 N -1.95 4.09 0.68 0.53 2.07 -1.10 -4.06 121.20 121.47 2ek4 s ILE 16 Ca 0.35 1.49 -0.11 0.00 -1.41 0.00 0.00 60.65 60.97 2ek4 s ILE 16 Cb 0.17 -3.72 0.00 0.00 0.13 0.00 0.00 42.46 39.05 2ek4 s ILE 16 CO 0.28 -0.10 1.06 0.42 -1.91 0.00 0.00 174.94 174.69 2ek4 s THR 17 N -1.86 4.12 0.25 4.00 -4.23 -1.26 -4.88 115.64 111.78 2ek4 s THR 17 Ca 0.58 0.69 -0.06 0.00 -1.18 0.00 0.00 61.69 61.73 2ek4 s THR 17 Cb -0.16 -3.47 0.26 0.00 1.34 0.00 0.00 72.50 70.47 2ek4 s THR 17 CO 0.21 -0.90 1.93 0.58 -0.54 0.00 0.00 174.62 175.89 2ek4 h VAL 18 N -0.66 1.24 -0.15 2.29 2.07 -1.96 -1.49 116.25 117.59 2ek4 h VAL 18 Ca -0.44 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 66.66 2ek4 h VAL 18 Cb 1.21 -0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 2ek4 h VAL 18 CO 0.58 0.25 -0.11 0.50 0.02 0.00 0.00 177.57 178.80 2ek4 h LYS 19 N 1.35 -0.11 -0.86 1.57 3.64 -1.97 -0.94 116.57 119.25 2ek4 h LYS 19 Ca 0.37 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.74 2ek4 h LYS 19 Cb -0.13 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.68 2ek4 h LYS 19 CO -0.09 -0.07 0.46 0.78 -2.27 0.00 0.00 179.45 178.26 2ek4 h GLY 20 N -0.12 1.28 0.76 5.01 0.00 -1.76 -1.98 103.07 106.27 2ek4 h GLY 20 Ca 0.09 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 2ek4 h GLY 20 CO -0.22 0.56 0.01 -2.00 0.00 0.00 0.00 176.54 174.89 2ek4 h LEU 21 N 1.20 0.08 -1.24 3.11 5.85 -0.88 -0.22 115.31 123.20 2ek4 h LEU 21 Ca 0.30 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 2ek4 h LEU 21 Cb 0.04 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2ek4 h LEU 21 CO -0.05 0.32 0.22 -0.33 -0.34 0.00 0.00 178.44 178.25 2ek4 h GLU 22 N -0.17 0.74 -0.06 1.25 4.39 -1.09 -1.02 114.58 118.62 2ek4 h GLU 22 Ca 0.01 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 2ek4 h GLU 22 Cb 0.27 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 2ek4 h GLU 22 CO 0.00 0.61 -0.19 0.82 -1.16 0.00 0.00 179.01 179.09 2ek4 h ILE 23 N 0.74 1.43 -0.40 3.13 2.04 -1.28 -3.23 117.51 119.95 2ek4 h ILE 23 Ca 0.18 -1.57 0.05 0.00 1.00 0.00 0.00 64.86 64.52 2ek4 h ILE 23 Cb 0.13 2.30 -0.05 0.00 -0.74 0.00 0.00 36.82 38.46 2ek4 h ILE 23 CO -0.02 0.44 0.11 0.00 0.00 0.00 0.00 178.15 178.68 2ek4 h ALA 24 N 0.45 0.45 -0.99 1.87 0.00 -0.80 -2.10 119.26 118.13 2ek4 h ALA 24 Ca -0.01 0.06 0.25 0.00 0.00 0.00 0.00 54.91 55.22 2ek4 h ALA 24 Cb 0.81 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 2ek4 h ALA 24 CO 0.04 -0.29 0.66 0.87 0.00 0.00 0.00 179.25 180.53 2ek4 h LYS 25 N 0.25 0.34 -0.16 0.00 1.57 -1.24 -1.13 116.57 116.20 2ek4 h LYS 25 Ca 0.19 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2ek4 h LYS 25 Cb 0.20 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.43 2ek4 h LYS 25 CO -0.22 0.23 0.00 1.63 -0.57 0.00 0.00 179.45 180.52 2ek4 n LYS 26 N -4.53 2.05 -2.38 3.15 4.76 -0.81 -4.94 118.16 115.46 2ek4 n LYS 26 Ca 0.23 -1.56 -0.33 0.00 -2.87 0.00 0.00 58.31 53.78 2ek4 n LYS 26 Cb 0.84 -1.46 -0.03 0.00 -1.84 0.00 0.00 35.03 32.54 2ek4 n LYS 26 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ek4 h ASP 28 N 1.00 0.75 -4.21 0.00 3.32 -1.20 -3.46 116.42 112.63 2ek4 h ASP 28 Ca -0.47 -0.66 -0.36 0.00 0.02 0.00 0.00 57.03 55.56 2ek4 h ASP 28 Cb 1.20 -0.23 -0.26 0.00 0.22 0.00 0.00 39.33 40.25 2ek4 h ASP 28 CO 0.60 1.47 -0.77 -0.31 -1.72 0.00 0.00 179.24 178.51 2ek4 s TYR 29 N -3.11 0.76 -0.14 4.55 2.02 -1.14 -5.04 117.35 115.25 2ek4 s TYR 29 Ca -0.08 -0.25 -0.00 0.00 -0.37 0.00 0.00 57.07 56.37 2ek4 s TYR 29 Cb 0.07 -0.47 0.03 0.00 -0.40 0.00 0.00 41.96 41.19 2ek4 s TYR 29 CO 0.91 -0.02 -0.07 0.08 -1.57 0.00 0.00 175.55 174.88 2ek4 s VAL 30 N -0.56 1.14 0.30 0.71 1.01 -1.26 -1.59 120.40 120.15 2ek4 s VAL 30 Ca -0.00 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 61.56 2ek4 s VAL 30 Cb -0.05 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2ek4 s VAL 30 CO 0.00 0.27 0.17 -0.36 0.00 0.00 0.00 175.10 175.18 2ek4 s PHE 31 N 1.64 2.86 0.00 5.22 0.40 0.16 -1.68 117.98 126.58 2ek4 s PHE 31 Ca 0.03 -0.26 -0.28 0.00 -0.60 0.00 0.00 56.93 55.82 2ek4 s PHE 31 Cb -0.14 -1.54 0.09 0.00 0.51 0.00 0.00 43.02 41.94 2ek4 s PHE 31 CO -0.08 0.39 0.77 0.00 0.70 0.00 0.00 175.22 177.00 2ek4 s ALA 32 N -2.30 -1.77 0.06 5.36 0.00 -0.73 0.04 121.76 122.43 2ek4 s ALA 32 Ca 0.36 1.05 0.05 0.00 0.00 0.00 0.00 51.96 53.42 2ek4 s ALA 32 Cb -0.05 0.24 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 2ek4 s ALA 32 CO 0.24 -0.56 -0.13 -1.83 0.00 0.00 0.00 175.76 173.48 2ek4 s GLU 33 N -2.42 0.80 -0.21 0.00 4.04 -0.76 0.14 118.70 120.30 2ek4 s GLU 33 Ca -0.02 -0.90 0.20 0.00 0.04 0.00 0.00 54.97 54.29 2ek4 s GLU 33 Cb -0.01 -0.79 0.48 0.00 0.02 0.00 0.00 34.13 33.84 2ek4 s GLU 33 CO -0.03 0.18 1.14 1.19 -1.84 0.00 0.00 175.26 175.90 2ek4 n PHE 34 N 1.40 1.20 0.15 4.83 3.72 -1.26 -4.22 117.46 123.28 2ek4 n PHE 34 Ca -0.21 -1.79 0.05 0.00 -0.05 0.00 0.00 57.45 55.45 2ek4 n PHE 34 Cb 0.54 -0.24 -0.06 0.00 -0.94 0.00 0.00 39.48 38.78 2ek4 n PHE 34 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2ek4 n TYR 35 N -0.44 0.00 0.56 1.38 0.18 -1.26 -4.53 117.16 113.05 2ek4 n TYR 35 Ca 0.14 0.00 0.13 0.00 1.88 0.00 0.00 57.90 60.05 2ek4 n TYR 35 Cb 0.89 -0.14 0.33 0.00 -0.38 0.00 0.00 39.34 40.05 2ek4 n TYR 35 CO 0.00 0.00 0.00 1.79 -2.08 0.00 0.00 176.86 176.57 2ek4 h THR 36 N 0.00 0.00 -2.74 -3.48 1.35 -1.97 -3.42 112.91 102.65 2ek4 h THR 36 Ca 0.00 -0.55 0.09 0.00 -0.55 0.00 0.00 66.41 65.40 2ek4 h THR 36 Cb 0.35 1.46 -0.02 0.00 -1.73 0.00 0.00 68.15 68.22 2ek4 h THR 36 CO 0.00 0.00 0.47 -0.55 -0.25 0.00 0.00 175.52 175.19 2ek4 s SER 37 N -4.68 0.02 -0.14 5.36 0.15 -1.26 -5.04 113.70 108.10 2ek4 s SER 37 Ca 0.09 -0.89 0.01 0.00 0.70 0.00 0.00 55.95 55.86 2ek4 s SER 37 Cb 0.12 0.65 0.02 0.00 -1.71 0.00 0.00 66.02 65.09 2ek4 s SER 37 CO 0.63 -1.29 -0.18 -0.22 1.20 0.00 0.00 173.24 173.39 2ek4 s LEU 38 N -3.31 1.89 -0.82 3.45 2.96 -1.26 -4.86 118.68 116.74 2ek4 s LEU 38 Ca 0.20 -0.53 -0.14 0.00 -0.22 0.00 0.00 54.13 53.44 2ek4 s LEU 38 Cb -0.04 -1.28 0.22 0.00 0.50 0.00 0.00 46.19 45.59 2ek4 s LEU 38 CO 0.08 0.01 0.76 -0.04 -1.32 0.00 0.00 176.35 175.84 2ek4 s MET 39 N 1.14 3.59 0.11 1.98 -1.94 -1.26 -4.56 119.30 118.35 2ek4 s MET 39 Ca -0.01 -2.44 0.16 0.00 -1.71 0.00 0.00 55.69 51.68 2ek4 s MET 39 Cb -0.14 -4.42 0.68 0.00 2.01 0.00 0.00 34.83 32.96 2ek4 s MET 39 CO -0.06 -1.29 1.48 0.00 -0.01 0.00 0.00 175.02 175.14 2ek4 n ALA 40 N 4.01 1.49 -0.36 3.03 0.00 -1.22 -3.37 120.51 124.09 2ek4 n ALA 40 Ca 0.13 0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.66 2ek4 n ALA 40 Cb 0.47 -1.25 0.20 0.00 0.00 0.00 0.00 19.45 18.86 2ek4 n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ek4 n GLY 41 N -0.38 2.97 1.09 0.00 0.00 -0.56 -5.04 105.19 103.27 2ek4 n GLY 41 Ca 0.02 -0.55 -0.07 0.00 0.00 0.00 0.00 46.02 45.42 2ek4 n GLY 41 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2ek4 n THR 42 N 0.45 0.00 -3.95 2.61 5.66 -1.22 -4.64 114.28 113.19 2ek4 n THR 42 Ca 0.15 -0.82 -0.10 0.00 -3.05 0.00 0.00 64.05 60.23 2ek4 n THR 42 Cb 0.55 0.40 -0.07 0.00 -1.55 0.00 0.00 70.33 69.67 2ek4 n THR 42 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2ek4 s THR 43 N -2.43 0.06 0.18 1.09 -4.23 -1.26 -5.02 115.64 104.03 2ek4 s THR 43 Ca 0.13 -1.37 -0.12 0.00 -1.18 0.00 0.00 61.69 59.15 2ek4 s THR 43 Cb 0.01 -1.84 0.10 0.00 1.34 0.00 0.00 72.50 72.10 2ek4 s THR 43 CO 0.09 -0.29 1.78 0.25 -0.54 0.00 0.00 174.62 175.91 2ek4 h LEU 44 N 2.53 0.82 -0.53 4.79 5.85 -1.99 -2.60 115.31 124.18 2ek4 h LEU 44 Ca -0.32 -0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.36 2ek4 h LEU 44 Cb 1.23 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.98 2ek4 h LEU 44 CO 0.48 0.71 0.17 1.23 -0.34 0.00 0.00 178.44 180.69 2ek4 h GLY 45 N 0.87 0.71 1.51 3.75 0.00 -1.98 0.32 103.07 108.24 2ek4 h GLY 45 Ca 0.22 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.39 2ek4 h GLY 45 CO -0.03 -0.02 -0.07 3.21 0.00 0.00 0.00 176.54 179.63 2ek4 h ARG 46 N 0.34 0.59 -0.09 4.80 3.08 -1.93 0.26 114.38 121.44 2ek4 h ARG 46 Ca 0.26 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 2ek4 h ARG 46 Cb 0.31 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 2ek4 h ARG 46 CO -0.28 0.67 -0.06 0.82 -1.07 0.00 0.00 179.97 180.04 2ek4 h ILE 47 N 0.55 1.34 -0.52 2.04 2.04 -0.89 0.13 117.51 122.20 2ek4 h ILE 47 Ca 0.11 -1.15 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 2ek4 h ILE 47 Cb 0.46 1.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 2ek4 h ILE 47 CO 0.02 0.32 0.30 1.56 0.00 0.00 0.00 178.15 180.36 2ek4 h GLN 48 N -0.20 0.72 -0.53 2.37 4.20 -0.20 0.43 115.11 121.90 2ek4 h GLN 48 Ca 0.02 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.68 2ek4 h GLN 48 Cb 0.54 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.14 2ek4 h GLN 48 CO 0.02 0.54 0.31 -0.22 -0.67 0.00 0.00 178.83 178.81 2ek4 h LYS 49 N 0.70 0.60 -0.57 1.46 3.64 -0.42 1.35 116.57 123.32 2ek4 h LYS 49 Ca 0.19 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2ek4 h LYS 49 Cb 0.02 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 2ek4 h LYS 49 CO -0.03 0.40 0.15 1.25 -2.27 0.00 0.00 179.45 178.94 2ek4 h LEU 50 N 0.62 0.86 0.00 5.20 5.85 -0.47 -3.04 115.31 124.32 2ek4 h LEU 50 Ca 0.21 -0.23 -0.18 0.00 0.84 0.00 0.00 57.88 58.53 2ek4 h LEU 50 Cb 0.03 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 2ek4 h LEU 50 CO -0.10 0.86 -0.90 0.40 -0.34 0.00 0.00 178.44 178.36 2ek4 h ILE 51 N 0.81 1.32 -0.27 4.05 2.04 -0.56 -3.48 117.51 121.43 2ek4 h ILE 51 Ca 0.18 -2.92 -0.06 0.00 1.00 0.00 0.00 64.86 63.06 2ek4 h ILE 51 Cb 0.33 2.64 -0.01 0.00 -0.74 0.00 0.00 36.82 39.04 2ek4 h ILE 51 CO 0.00 0.75 -0.06 0.61 0.00 0.00 0.00 178.15 179.45 2ek4 n GLY 52 N 1.32 0.44 3.14 5.37 0.00 0.46 -4.46 105.19 111.47 2ek4 n GLY 52 Ca -0.01 -0.86 -0.11 0.00 0.00 0.00 0.00 46.02 45.04 2ek4 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ek4 s LYS 53 N -3.12 0.76 -0.14 1.61 -0.14 -1.12 -5.04 119.74 112.56 2ek4 s LYS 53 Ca 0.00 -1.22 -0.27 0.00 -1.36 0.00 0.00 55.97 53.12 2ek4 s LYS 53 Cb 0.00 -0.19 -0.01 0.00 -1.68 0.00 0.00 37.83 35.94 2ek4 s LYS 53 CO 0.00 -0.01 0.90 -2.00 -0.76 0.00 0.00 175.35 173.48 2ek4 s GLU 54 N -3.42 4.36 -0.19 1.68 2.12 -1.26 -4.59 118.70 117.41 2ek4 s GLU 54 Ca 0.07 1.17 -0.07 0.00 0.36 0.00 0.00 54.97 56.50 2ek4 s GLU 54 Cb 0.03 -3.55 -0.04 0.00 0.26 0.00 0.00 34.13 30.82 2ek4 s GLU 54 CO -0.04 -0.30 0.06 0.42 -0.54 0.00 0.00 175.26 174.86 2ek4 s ILE 55 N 2.00 4.75 -0.33 -3.70 1.01 -1.26 -4.38 121.20 119.29 2ek4 s ILE 55 Ca 0.42 -0.05 -0.16 0.00 0.00 0.00 0.00 60.65 60.87 2ek4 s ILE 55 Cb -0.17 -3.14 -0.01 0.00 0.01 0.00 0.00 42.46 39.14 2ek4 s ILE 55 CO 0.15 0.45 0.39 -0.60 0.00 0.00 0.00 174.94 175.33 2ek4 s ARG 56 N 0.46 3.63 -0.01 2.79 3.52 -0.68 -4.96 118.95 123.70 2ek4 s ARG 56 Ca 0.03 -0.31 -0.30 0.00 -0.13 0.00 0.00 55.73 55.02 2ek4 s ARG 56 Cb -0.13 -3.79 -0.03 0.00 -1.56 0.00 0.00 34.95 29.45 2ek4 s ARG 56 CO 0.01 -0.52 0.98 0.08 -0.81 0.00 0.00 175.30 175.04 2ek4 s VAL 57 N 2.09 4.87 0.03 7.11 1.01 -1.26 -1.77 120.40 132.48 2ek4 s VAL 57 Ca 0.13 2.04 0.02 0.00 0.00 0.00 0.00 61.98 64.18 2ek4 s VAL 57 Cb -0.16 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 2ek4 s VAL 57 CO 0.12 0.15 0.03 -0.76 0.00 0.00 0.00 175.10 174.63 2ek4 s LEU 58 N 1.10 3.61 0.63 3.92 1.43 0.12 -4.94 118.68 124.55 2ek4 s LEU 58 Ca 0.51 -0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.57 2ek4 s LEU 58 Cb -0.21 -2.18 0.06 0.00 0.03 0.00 0.00 46.19 43.89 2ek4 s LEU 58 CO 0.27 0.24 0.89 -0.94 0.23 0.00 0.00 176.35 177.03 2ek4 s SER 59 N -1.91 4.96 0.24 2.29 1.04 -1.26 -4.48 113.70 114.58 2ek4 s SER 59 Ca 0.23 0.08 -0.07 0.00 0.48 0.00 0.00 55.95 56.67 2ek4 s SER 59 Cb -0.12 -0.80 0.24 0.00 0.10 0.00 0.00 66.02 65.44 2ek4 s SER 59 CO 0.15 -1.42 1.90 -0.09 0.98 0.00 0.00 173.24 174.76 2ek4 h ARG 60 N -0.25 1.29 -0.49 4.02 2.43 -1.99 -1.64 114.38 117.74 2ek4 h ARG 60 Ca -0.42 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 58.59 2ek4 h ARG 60 Cb 1.30 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 2ek4 h ARG 60 CO 0.52 0.88 0.11 1.49 -1.51 0.00 0.00 179.97 181.46 2ek4 h GLU 61 N 1.31 0.80 -0.59 0.20 4.81 -1.97 0.30 114.58 119.44 2ek4 h GLU 61 Ca 0.35 -0.20 0.07 0.00 -0.13 0.00 0.00 59.36 59.44 2ek4 h GLU 61 Cb -0.09 -0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.13 2ek4 h GLU 61 CO -0.07 0.78 0.28 -0.44 -0.73 0.00 0.00 179.01 178.83 2ek4 h ASP 62 N 0.68 0.36 0.30 1.04 3.32 -1.77 -0.15 116.42 120.20 2ek4 h ASP 62 Ca 0.15 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 2ek4 h ASP 62 Cb 0.35 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2ek4 h ASP 62 CO 0.00 0.23 -0.14 0.58 -1.72 0.00 0.00 179.24 178.19 2ek4 h VAL 63 N 0.51 0.00 -0.44 -1.35 2.07 -1.06 0.03 116.25 116.01 2ek4 h VAL 63 Ca 0.28 -0.59 0.03 0.00 0.82 0.00 0.00 66.70 67.23 2ek4 h VAL 63 Cb 0.25 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 2ek4 h VAL 63 CO -0.22 0.00 0.30 -0.33 0.02 0.00 0.00 177.57 177.33 2ek4 h GLU 64 N -1.00 0.48 0.00 1.57 5.08 -0.42 -2.38 114.58 117.91 2ek4 h GLU 64 Ca -0.04 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2ek4 h GLU 64 Cb 0.31 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2ek4 h GLU 64 CO 0.07 0.31 -1.57 1.28 -1.00 0.00 0.00 179.01 178.10 2ek4 n LEU 65 N -4.48 0.00 -0.22 1.33 4.77 -0.08 -4.78 117.00 113.54 2ek4 n LEU 65 Ca 0.05 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.09 2ek4 n LEU 65 Cb 0.15 0.08 0.08 0.00 -2.33 0.00 0.00 43.42 41.41 2ek4 n LEU 65 CO 0.35 0.08 0.45 0.59 -1.33 0.00 0.00 177.39 177.53 2ek4 n ASN 66 N -2.05 1.48 -0.07 -1.43 5.03 -0.12 -4.82 115.26 113.29 2ek4 n ASN 66 Ca -0.07 -2.64 -0.07 0.00 0.87 0.00 0.00 54.58 52.66 2ek4 n ASN 66 Cb 0.47 -0.33 -0.01 0.00 -1.02 0.00 0.00 39.78 38.89 2ek4 n ASN 66 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 2ek4 h PHE 67 N 0.00 -0.04 0.00 3.10 3.57 -0.68 0.27 116.94 123.15 2ek4 h PHE 67 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2ek4 h PHE 67 Cb 1.12 0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.93 2ek4 h PHE 67 CO 0.03 -0.06 0.00 -0.85 -2.23 0.00 0.00 178.31 175.20 2ek4 n GLU 68 N -5.17 0.01 -0.08 1.11 0.00 -1.26 -0.72 120.64 114.52 2ek4 n GLU 68 Ca -0.01 0.32 -0.07 0.00 0.00 0.00 0.00 57.16 57.40 2ek4 n GLU 68 Cb 0.15 -1.50 -0.13 0.00 0.00 0.00 0.00 31.44 29.96 2ek4 n GLU 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2ek4 n ASN 69 N -1.49 0.99 -0.13 -1.84 5.03 0.01 -4.09 115.26 113.75 2ek4 n ASN 69 Ca 0.03 0.00 -0.28 0.00 0.87 0.00 0.00 54.58 55.19 2ek4 n ASN 69 Cb 0.12 0.93 -0.10 0.00 -1.02 0.00 0.00 39.78 39.70 2ek4 n ASN 69 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 2ek4 n ILE 70 N -2.58 1.53 -0.08 2.41 5.41 0.74 -4.66 119.36 122.13 2ek4 n ILE 70 Ca -0.26 -0.31 -0.07 0.00 1.00 0.00 0.00 62.75 63.11 2ek4 n ILE 70 Cb 1.01 -1.92 -0.03 0.00 -0.71 0.00 0.00 39.64 37.99 2ek4 n ILE 70 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2ek4 h VAL 71 N -1.00 0.16 -0.96 1.39 2.07 -1.12 -3.41 116.25 113.38 2ek4 h VAL 71 Ca -0.63 -1.20 0.21 0.00 0.82 0.00 0.00 66.70 65.89 2ek4 h VAL 71 Cb 1.55 0.38 -0.11 0.00 -1.52 0.00 0.00 31.29 31.59 2ek4 h VAL 71 CO -0.38 0.05 0.54 -0.07 0.02 0.00 0.00 177.57 177.73 2ek4 h LEU 72 N -1.00 0.63 -0.65 2.57 3.38 -1.69 -1.76 115.31 116.80 2ek4 h LEU 72 Ca -0.06 0.12 0.11 0.00 0.09 0.00 0.00 57.88 58.14 2ek4 h LEU 72 Cb 0.63 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.32 2ek4 h LEU 72 CO -0.04 0.16 0.23 -0.65 0.09 0.00 0.00 178.44 178.24 2ek4 h PRO 73 N 0.62 0.39 0.00 1.13 0.11 -1.80 -0.88 132.00 131.57 2ek4 h PRO 73 Ca 0.58 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.59 2ek4 h PRO 73 Cb 1.00 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 2ek4 h PRO 73 CO -0.44 0.26 -0.38 -0.07 -0.21 0.00 0.00 178.00 177.16 2ek4 h LEU 74 N 0.40 0.00 -0.99 2.35 3.38 -1.55 -2.95 115.31 115.95 2ek4 h LEU 74 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2ek4 h LEU 74 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2ek4 h LEU 74 CO -0.34 0.38 0.00 0.00 0.09 0.00 0.00 178.44 178.56 2ek4 h ALA 75 N 1.62 1.00 0.00 1.53 0.00 -0.88 -1.59 119.26 120.94 2ek4 h ALA 75 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2ek4 h ALA 75 Cb 0.73 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2ek4 h ALA 75 CO 0.05 0.00 -0.69 0.87 0.00 0.00 0.00 179.25 179.48 2ek4 h LYS 76 N 0.00 0.00 -0.00 0.00 1.57 -1.33 -2.85 116.57 113.95 2ek4 h LYS 76 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ek4 h LYS 76 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2ek4 h LYS 76 CO 0.00 0.69 -0.04 0.39 -0.57 0.00 0.00 179.45 179.92 2ek4 n GLU 77 N -3.59 0.94 -3.83 3.15 -0.58 -1.12 -4.63 120.64 110.98 2ek4 n GLU 77 Ca -0.00 -0.60 -0.15 0.00 -0.42 0.00 0.00 57.16 55.99 2ek4 n GLU 77 Cb 0.71 -1.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.53 2ek4 n GLU 77 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2ek4 n ASN 78 N -0.04 -0.90 -4.49 1.62 3.02 -0.61 -4.63 115.26 109.23 2ek4 n ASN 78 Ca 0.02 -2.80 -0.39 0.00 -0.03 0.00 0.00 54.58 51.38 2ek4 n ASN 78 Cb 0.10 1.84 -0.11 0.00 -0.61 0.00 0.00 39.78 41.00 2ek4 n ASN 78 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2ek4 s ASP 79 N -2.98 5.80 0.01 6.41 1.11 -1.26 -1.22 116.67 124.55 2ek4 s ASP 79 Ca 0.30 -0.45 0.07 0.00 0.18 0.00 0.00 52.55 52.65 2ek4 s ASP 79 Cb 0.00 -2.07 -0.03 0.00 1.07 0.00 0.00 42.92 41.90 2ek4 s ASP 79 CO 0.22 -0.20 -0.19 -0.69 1.18 0.00 0.00 175.17 175.48 2ek4 s VAL 80 N 1.67 2.65 -0.03 -1.27 1.01 0.13 -0.65 120.40 123.92 2ek4 s VAL 80 Ca 0.05 -1.09 0.06 0.00 0.00 0.00 0.00 61.98 61.01 2ek4 s VAL 80 Cb -0.17 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 2ek4 s VAL 80 CO 0.08 0.44 -0.22 0.00 0.00 0.00 0.00 175.10 175.40 2ek4 s ALA 81 N -0.82 2.35 -0.24 5.51 0.00 -0.62 0.21 121.76 128.15 2ek4 s ALA 81 Ca 0.13 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.02 2ek4 s ALA 81 Cb -0.10 -0.70 0.06 0.00 0.00 0.00 0.00 23.12 22.38 2ek4 s ALA 81 CO 0.03 0.54 -0.04 0.12 0.00 0.00 0.00 175.76 176.40 2ek4 s PHE 82 N -0.67 2.48 0.15 0.00 5.36 0.73 0.36 117.98 126.40 2ek4 s PHE 82 Ca 0.11 -1.85 -0.09 0.00 -0.96 0.00 0.00 56.93 54.14 2ek4 s PHE 82 Cb -0.10 -1.67 -0.06 0.00 -0.34 0.00 0.00 43.02 40.84 2ek4 s PHE 82 CO -0.00 -0.79 0.45 -0.51 -1.46 0.00 0.00 175.22 172.91 2ek4 s LEU 83 N 1.36 4.27 0.07 6.12 1.43 0.11 -1.27 118.68 130.77 2ek4 s LEU 83 Ca -0.04 0.80 -0.09 0.00 -1.03 0.00 0.00 54.13 53.76 2ek4 s LEU 83 Cb -0.19 -3.31 0.00 0.00 0.03 0.00 0.00 46.19 42.72 2ek4 s LEU 83 CO -0.07 0.06 0.20 0.42 0.23 0.00 0.00 176.35 177.19 2ek4 s THR 84 N -1.60 0.12 0.94 5.49 -4.23 -0.93 -1.83 115.64 113.61 2ek4 s THR 84 Ca 0.40 -1.03 -0.11 0.00 -1.18 0.00 0.00 61.69 59.77 2ek4 s THR 84 Cb -0.13 -1.14 0.16 0.00 1.34 0.00 0.00 72.50 72.73 2ek4 s THR 84 CO 0.21 -0.57 1.10 -2.84 -0.54 0.00 0.00 174.62 171.98 2ek4 s PRO 85 N -3.26 0.84 1.33 3.99 0.02 -1.26 -0.20 135.00 136.46 2ek4 s PRO 85 Ca 0.00 1.15 0.00 0.00 0.02 0.00 0.00 61.00 62.18 2ek4 s PRO 85 Cb 0.02 -1.74 0.00 0.00 0.02 0.00 0.00 34.50 32.81 2ek4 s PRO 85 CO -0.08 -2.63 0.00 0.41 -0.33 0.00 0.00 177.00 174.38 2ek4 n GLY 86 N -0.22 1.89 3.71 0.52 0.00 0.14 -4.13 105.19 107.10 2ek4 n GLY 86 Ca 0.08 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2ek4 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ek4 s ASP 87 N -4.00 6.43 0.61 1.61 -1.08 -1.25 -2.54 116.67 116.44 2ek4 s ASP 87 Ca 0.00 0.50 0.29 0.00 -0.52 0.00 0.00 52.55 52.81 2ek4 s ASP 87 Cb 0.00 -2.19 1.51 0.00 -1.46 0.00 0.00 42.92 40.78 2ek4 s ASP 87 CO 0.00 0.06 1.91 1.55 0.52 0.00 0.00 175.17 179.21 2ek4 h PRO 88 N 6.87 0.00 -0.31 4.34 0.13 -1.85 -2.60 132.00 138.57 2ek4 h PRO 88 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2ek4 h PRO 88 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2ek4 h PRO 88 CO 0.74 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.79 2ek4 n LEU 89 N -3.54 2.85 -4.56 1.56 4.77 -1.26 -4.48 117.00 112.35 2ek4 n LEU 89 Ca 0.05 -1.72 -0.40 0.00 -0.03 0.00 0.00 56.01 53.91 2ek4 n LEU 89 Cb 0.58 -0.20 -0.10 0.00 -2.33 0.00 0.00 43.42 41.37 2ek4 n LEU 89 CO 0.24 0.67 -0.01 -0.69 -1.33 0.00 0.00 177.39 176.28 2ek4 s VAL 90 N -1.03 5.20 -1.39 4.08 1.01 -0.98 -4.38 120.40 122.90 2ek4 s VAL 90 Ca 0.25 0.14 -0.10 0.00 0.00 0.00 0.00 61.98 62.27 2ek4 s VAL 90 Cb 0.14 -3.75 0.03 0.00 0.00 0.00 0.00 36.38 32.80 2ek4 s VAL 90 CO 0.19 0.01 1.14 0.00 0.00 0.00 0.00 175.10 176.43 2ek4 n ALA 91 N 5.30 -1.33 -2.28 5.51 0.00 -1.26 -4.88 120.51 121.57 2ek4 n ALA 91 Ca -0.10 0.34 -0.18 0.00 0.00 0.00 0.00 53.44 53.50 2ek4 n ALA 91 Cb 0.50 -5.19 -0.08 0.00 0.00 0.00 0.00 19.45 14.67 2ek4 n ALA 91 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2ek4 s THR 92 N -3.32 0.01 -0.19 0.00 -4.23 -1.26 -5.05 115.64 101.60 2ek4 s THR 92 Ca 0.58 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.25 2ek4 s THR 92 Cb -0.27 -2.50 0.51 0.00 1.34 0.00 0.00 72.50 71.59 2ek4 s THR 92 CO 0.75 0.00 1.41 0.35 -0.54 0.00 0.00 174.62 176.59 2ek4 n THR 93 N -0.58 2.30 0.28 3.99 -2.24 -1.26 -4.66 114.28 112.11 2ek4 n THR 93 Ca 0.06 -2.01 0.16 0.00 -2.27 0.00 0.00 64.05 59.99 2ek4 n THR 93 Cb 0.63 -0.27 0.80 0.00 -2.10 0.00 0.00 70.33 69.39 2ek4 n THR 93 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2ek4 h HIS 94 N 1.56 0.00 -0.84 4.78 -0.00 -1.92 -2.87 115.15 115.86 2ek4 h HIS 94 Ca 0.03 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.44 2ek4 h HIS 94 Cb 1.45 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 28.81 2ek4 h HIS 94 CO 0.53 0.07 0.55 0.00 -0.00 0.00 0.00 177.93 179.07 2ek4 h ALA 95 N 1.93 1.51 0.00 2.45 0.00 -1.83 -0.05 119.26 123.27 2ek4 h ALA 95 Ca -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2ek4 h ALA 95 Cb 0.36 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2ek4 h ALA 95 CO 0.01 0.40 -0.05 1.49 0.00 0.00 0.00 179.25 181.10 2ek4 h GLU 96 N 1.01 0.00 0.00 0.00 4.22 -1.89 -1.06 114.58 116.86 2ek4 h GLU 96 Ca 0.34 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.78 2ek4 h GLU 96 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2ek4 h GLU 96 CO -0.11 0.05 0.00 -0.07 -2.18 0.00 0.00 179.01 176.70 2ek4 h LEU 97 N 0.00 0.00 -0.50 1.64 3.38 -1.15 -1.79 115.31 116.89 2ek4 h LEU 97 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 2ek4 h LEU 97 Cb 0.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2ek4 h LEU 97 CO 0.01 0.00 -0.75 0.03 0.09 0.00 0.00 178.44 177.82 2ek4 h ARG 98 N 0.00 0.04 -0.24 1.13 3.08 -1.28 -1.74 114.38 115.36 2ek4 h ARG 98 Ca 0.00 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 2ek4 h ARG 98 Cb 0.30 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2ek4 h ARG 98 CO 0.00 0.77 -0.09 0.82 -1.07 0.00 0.00 179.97 180.39 2ek4 h ILE 99 N 0.02 1.29 -0.85 2.04 2.04 -1.46 -0.56 117.51 120.04 2ek4 h ILE 99 Ca -0.01 -1.14 -0.00 0.00 1.00 0.00 0.00 64.86 64.71 2ek4 h ILE 99 Cb 1.32 1.54 -0.04 0.00 -0.74 0.00 0.00 36.82 38.90 2ek4 h ILE 99 CO 0.10 0.35 0.52 0.03 0.00 0.00 0.00 178.15 179.16 2ek4 h ARG 100 N 0.21 1.15 -0.22 2.37 3.08 -1.44 -0.03 114.38 119.50 2ek4 h ARG 100 Ca 0.06 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2ek4 h ARG 100 Cb 0.58 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 2ek4 h ARG 100 CO 0.03 0.79 0.10 0.00 -1.07 0.00 0.00 179.97 179.82 2ek4 h ALA 101 N 1.41 0.29 0.37 0.04 0.00 -1.05 -2.19 119.26 118.13 2ek4 h ALA 101 Ca 0.31 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2ek4 h ALA 101 Cb -0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2ek4 h ALA 101 CO -0.06 -0.14 -0.32 -0.22 0.00 0.00 0.00 179.25 178.51 2ek4 h LYS 102 N 0.22 -0.68 0.00 0.00 3.64 -0.36 0.36 116.57 119.75 2ek4 h LYS 102 Ca 0.08 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2ek4 h LYS 102 Cb 0.15 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2ek4 h LYS 102 CO -0.01 -0.45 0.04 0.00 -2.27 0.00 0.00 179.45 176.76 2ek4 h ARG 103 N -0.71 0.00 -0.32 1.90 3.08 -0.94 0.83 114.38 118.23 2ek4 h ARG 103 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2ek4 h ARG 103 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 2ek4 h ARG 103 CO -0.04 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.86 2ek4 n ALA 104 N -1.78 2.44 -1.18 0.04 0.00 -0.63 -4.94 120.51 114.46 2ek4 n ALA 104 Ca -0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 53.44 52.50 2ek4 n ALA 104 Cb 0.08 -0.91 -0.01 0.00 0.00 0.00 0.00 19.45 18.60 2ek4 n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ek4 n GLY 105 N 1.43 0.63 3.49 0.00 0.00 0.29 -5.01 105.19 106.02 2ek4 n GLY 105 Ca 0.18 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 2ek4 n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ek4 s VAL 106 N -2.14 4.25 0.25 1.61 1.01 0.02 -5.01 120.40 120.39 2ek4 s VAL 106 Ca 0.00 -0.21 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 2ek4 s VAL 106 Cb 0.00 -2.94 -0.09 0.00 0.00 0.00 0.00 36.38 33.35 2ek4 s VAL 106 CO 0.00 0.40 1.05 -1.61 0.00 0.00 0.00 175.10 174.95 2ek4 s GLU 107 N 1.06 4.69 0.08 2.72 0.41 -1.26 -3.65 118.70 122.75 2ek4 s GLU 107 Ca 0.03 1.70 0.07 0.00 -0.41 0.00 0.00 54.97 56.36 2ek4 s GLU 107 Cb -0.14 -3.23 -0.03 0.00 -1.78 0.00 0.00 34.13 28.95 2ek4 s GLU 107 CO 0.02 0.27 -0.18 -1.54 -0.49 0.00 0.00 175.26 173.35 2ek4 s SER 108 N -0.82 2.15 0.07 -0.19 1.04 -1.26 -1.14 113.70 113.55 2ek4 s SER 108 Ca 0.44 -0.61 0.05 0.00 0.48 0.00 0.00 55.95 56.31 2ek4 s SER 108 Cb -0.30 -0.12 -0.03 0.00 0.10 0.00 0.00 66.02 65.68 2ek4 s SER 108 CO 0.37 0.03 -0.14 -0.31 0.98 0.00 0.00 173.24 174.18 2ek4 s TYR 109 N -1.11 1.18 -0.16 5.02 1.51 -0.29 -4.97 117.35 118.54 2ek4 s TYR 109 Ca 0.03 -0.47 -0.00 0.00 -1.01 0.00 0.00 57.07 55.62 2ek4 s TYR 109 Cb -0.10 -0.66 -0.00 0.00 -0.11 0.00 0.00 41.96 41.09 2ek4 s TYR 109 CO 0.03 0.05 -0.14 0.08 -1.11 0.00 0.00 175.55 174.45 2ek4 s VAL 110 N -1.33 2.73 -0.33 0.71 1.01 -1.26 -0.50 120.40 121.44 2ek4 s VAL 110 Ca -0.02 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 2ek4 s VAL 110 Cb -0.10 -2.16 0.04 0.00 0.00 0.00 0.00 36.38 34.16 2ek4 s VAL 110 CO 0.02 0.51 0.09 -0.63 0.00 0.00 0.00 175.10 175.09 2ek4 s ILE 111 N 0.81 3.65 0.91 2.22 -1.09 0.61 -4.96 121.20 123.35 2ek4 s ILE 111 Ca -0.05 -1.18 -0.12 0.00 -2.23 0.00 0.00 60.65 57.08 2ek4 s ILE 111 Cb -0.15 -3.07 0.13 0.00 -1.58 0.00 0.00 42.46 37.79 2ek4 s ILE 111 CO 0.00 -0.17 1.10 -1.00 -1.23 0.00 0.00 174.94 173.64 2ek4 s HIS 112 N 1.38 2.39 0.19 3.97 3.76 -1.26 -1.55 115.29 124.17 2ek4 s HIS 112 Ca -0.02 1.11 -0.15 0.00 -0.15 0.00 0.00 55.06 55.84 2ek4 s HIS 112 Cb -0.20 -3.21 0.02 0.00 1.11 0.00 0.00 32.58 30.30 2ek4 s HIS 112 CO 0.02 -2.40 0.47 0.00 -0.85 0.00 0.00 174.74 171.98 2ek4 s ALA 113 N -3.03 -0.69 0.31 -1.40 0.00 -1.26 -4.57 121.76 111.11 2ek4 s ALA 113 Ca 0.63 -0.41 -0.30 0.00 0.00 0.00 0.00 51.96 51.88 2ek4 s ALA 113 Cb -0.17 0.87 -0.12 0.00 0.00 0.00 0.00 23.12 23.70 2ek4 s ALA 113 CO 0.56 -0.78 1.54 -0.35 0.00 0.00 0.00 175.76 176.73 2ek4 n PRO 114 N -0.32 2.61 -4.36 0.00 -0.04 -1.26 -4.20 135.00 127.43 2ek4 n PRO 114 Ca -0.09 0.93 -0.27 0.00 -0.04 0.00 0.00 63.50 64.03 2ek4 n PRO 114 Cb 0.62 -2.68 -0.11 0.00 -0.04 0.00 0.00 33.50 31.30 2ek4 n PRO 114 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2ek4 s SER 115 N 0.30 3.80 0.38 3.54 0.15 -1.26 -3.41 113.70 117.20 2ek4 s SER 115 Ca 0.61 -0.73 0.07 0.00 0.70 0.00 0.00 55.95 56.61 2ek4 s SER 115 Cb -0.51 -0.46 0.76 0.00 -1.71 0.00 0.00 66.02 64.10 2ek4 s SER 115 CO 0.53 0.12 1.96 -0.29 1.20 0.00 0.00 173.24 176.76 2ek4 h ILE 116 N 3.05 1.15 -0.80 6.45 6.09 -1.97 -1.25 117.51 130.23 2ek4 h ILE 116 Ca -0.47 -0.53 0.13 0.00 -1.37 0.00 0.00 64.86 62.62 2ek4 h ILE 116 Cb 1.20 0.83 -0.06 0.00 0.47 0.00 0.00 36.82 39.27 2ek4 h ILE 116 CO 0.50 0.19 0.52 0.22 -3.07 0.00 0.00 178.15 176.52 2ek4 h TYR 117 N 0.45 0.66 0.00 2.19 3.20 -1.98 -2.26 116.97 119.23 2ek4 h TYR 117 Ca 0.11 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.85 2ek4 h TYR 117 Cb 0.18 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 2ek4 h TYR 117 CO 0.01 0.27 -2.11 -1.13 -1.64 0.00 0.00 178.16 173.55 2ek4 n SER 118 N -4.51 0.05 0.12 -2.11 3.41 -1.00 -4.18 113.62 105.40 2ek4 n SER 118 Ca 0.15 0.02 0.10 0.00 -0.26 0.00 0.00 58.87 58.88 2ek4 n SER 118 Cb 0.45 1.52 0.47 0.00 -0.26 0.00 0.00 64.21 66.39 2ek4 n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ek4 n ALA 119 N -2.45 1.27 0.30 7.33 0.00 -0.51 -1.40 120.51 125.06 2ek4 n ALA 119 Ca -0.15 0.13 0.19 0.00 0.00 0.00 0.00 53.44 53.61 2ek4 n ALA 119 Cb 0.81 -1.30 1.03 0.00 0.00 0.00 0.00 19.45 19.99 2ek4 n ALA 119 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2ek4 h VAL 120 N 0.00 0.00 -0.67 0.00 -1.51 -1.65 -1.33 116.25 111.09 2ek4 h VAL 120 Ca 0.00 0.00 0.19 0.00 -1.23 0.00 0.00 66.70 65.66 2ek4 h VAL 120 Cb 0.13 0.84 -0.03 0.00 -2.13 0.00 0.00 31.29 30.10 2ek4 h VAL 120 CO 0.00 0.00 0.53 1.23 -1.23 0.00 0.00 177.57 178.10 2ek4 h GLY 121 N 0.00 0.00 2.00 5.19 0.00 -1.51 0.15 103.07 108.90 2ek4 h GLY 121 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ek4 h GLY 121 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 176.54 181.05 2ek4 n ILE 122 N -4.14 0.96 0.97 2.60 3.06 -0.50 -1.93 119.36 120.37 2ek4 n ILE 122 Ca 0.13 0.25 0.14 0.00 -2.50 0.00 0.00 62.75 60.77 2ek4 n ILE 122 Cb 0.78 -1.07 0.60 0.00 0.54 0.00 0.00 39.64 40.49 2ek4 n ILE 122 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2ek4 n THR 123 N -1.76 0.05 -0.03 9.51 -2.24 0.52 -4.91 114.28 115.42 2ek4 n THR 123 Ca 0.03 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2ek4 n THR 123 Cb 0.19 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 2ek4 n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ek4 n GLY 124 N 1.48 1.30 3.72 3.38 0.00 -0.81 -4.55 105.19 109.70 2ek4 n GLY 124 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2ek4 n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ek4 s LEU 125 N 0.00 4.42 0.01 0.99 1.43 -1.26 -4.56 118.68 119.72 2ek4 s LEU 125 Ca 0.00 1.75 -0.30 0.00 -1.03 0.00 0.00 54.13 54.55 2ek4 s LEU 125 Cb 0.00 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.55 2ek4 s LEU 125 CO 0.00 -0.20 2.00 1.41 0.23 0.00 0.00 176.35 179.79 2ek4 n HIS 126 N 3.41 2.46 0.27 0.29 8.25 -1.26 -4.68 115.22 123.96 2ek4 n HIS 126 Ca 0.05 -0.35 0.11 0.00 -0.26 0.00 0.00 57.72 57.28 2ek4 n HIS 126 Cb 0.50 -2.79 0.75 0.00 1.12 0.00 0.00 29.99 29.56 2ek4 n HIS 126 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 2ek4 h ILE 127 N 5.76 0.73 0.00 1.59 2.10 -1.93 -0.92 117.51 124.84 2ek4 h ILE 127 Ca -0.49 -0.26 0.00 0.00 1.08 0.00 0.00 64.86 65.19 2ek4 h ILE 127 Cb 1.24 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 38.12 2ek4 h ILE 127 CO 0.94 0.06 0.00 0.00 -1.08 0.00 0.00 178.15 178.08 2ek4 n TYR 128 N -4.00 0.88 1.24 2.19 4.11 -1.26 -2.84 117.16 117.48 2ek4 n TYR 128 Ca -0.03 0.33 0.11 0.00 -0.00 0.00 0.00 57.90 58.31 2ek4 n TYR 128 Cb 0.15 -1.03 0.39 0.00 -0.00 0.00 0.00 39.34 38.86 2ek4 n TYR 128 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 2ek4 n LYS 129 N -2.28 1.75 -2.74 -3.48 5.02 -0.35 -4.87 118.16 111.21 2ek4 n LYS 129 Ca 0.03 -1.12 -0.39 0.00 -2.02 0.00 0.00 58.31 54.81 2ek4 n LYS 129 Cb 0.27 -1.41 -0.06 0.00 -0.02 0.00 0.00 35.03 33.81 2ek4 n LYS 129 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2ek4 s PHE 130 N -1.81 3.86 0.00 2.13 0.40 -1.13 -0.66 117.98 120.76 2ek4 s PHE 130 Ca 0.33 1.86 0.00 0.00 -0.60 0.00 0.00 56.93 58.52 2ek4 s PHE 130 Cb 0.18 -2.98 0.00 0.00 0.51 0.00 0.00 43.02 40.73 2ek4 s PHE 130 CO 0.28 0.30 0.00 0.41 0.70 0.00 0.00 175.22 176.91 2ek4 n GLY 131 N 1.18 2.61 3.68 4.36 0.00 0.27 -4.80 105.19 112.48 2ek4 n GLY 131 Ca -0.01 -1.86 -0.40 0.00 0.00 0.00 0.00 46.02 43.76 2ek4 n GLY 131 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2ek4 n LYS 132 N 0.00 1.52 -3.73 1.61 4.81 -1.26 -4.80 118.16 116.31 2ek4 n LYS 132 Ca 0.00 0.55 -0.21 0.00 -0.87 0.00 0.00 58.31 57.78 2ek4 n LYS 132 Cb 0.00 -2.32 -0.04 0.00 0.02 0.00 0.00 35.03 32.69 2ek4 n LYS 132 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2ek4 s SER 133 N -0.84 5.07 0.26 3.14 0.01 -1.26 -4.37 113.70 115.71 2ek4 s SER 133 Ca 0.68 -0.68 -0.15 0.00 1.31 0.00 0.00 55.95 57.11 2ek4 s SER 133 Cb -0.47 -0.72 0.00 0.00 0.21 0.00 0.00 66.02 65.04 2ek4 s SER 133 CO 0.53 -0.51 0.56 0.00 0.41 0.00 0.00 173.24 174.23 2ek4 s ALA 134 N -2.42 -0.52 -0.12 1.44 0.00 -0.78 -5.00 121.76 114.37 2ek4 s ALA 134 Ca 0.44 -0.72 0.03 0.00 0.00 0.00 0.00 51.96 51.71 2ek4 s ALA 134 Cb -0.04 1.00 0.00 0.00 0.00 0.00 0.00 23.12 24.08 2ek4 s ALA 134 CO 0.27 -0.91 -0.22 0.99 0.00 0.00 0.00 175.76 175.88 2ek4 s THR 135 N -3.93 2.13 -0.55 0.00 2.01 -1.26 -0.52 115.64 113.53 2ek4 s THR 135 Ca 0.19 -0.98 -0.25 0.00 0.31 0.00 0.00 61.69 60.96 2ek4 s THR 135 Cb -0.02 -1.83 0.04 0.00 0.01 0.00 0.00 72.50 70.69 2ek4 s THR 135 CO 0.09 0.55 0.97 -0.69 -0.69 0.00 0.00 174.62 174.85 2ek4 s VAL 136 N 0.53 4.35 -0.09 3.82 1.01 -0.49 -4.71 120.40 124.84 2ek4 s VAL 136 Ca -0.14 0.39 -0.09 0.00 0.00 0.00 0.00 61.98 62.14 2ek4 s VAL 136 Cb -0.17 -4.55 -0.04 0.00 0.00 0.00 0.00 36.38 31.62 2ek4 s VAL 136 CO 0.05 -1.11 0.21 0.00 0.00 0.00 0.00 175.10 174.25 2ek4 s ALA 137 N 4.04 3.83 0.21 5.51 0.00 -1.26 -1.98 121.76 132.12 2ek4 s ALA 137 Ca 0.32 -0.53 -0.32 0.00 0.00 0.00 0.00 51.96 51.44 2ek4 s ALA 137 Cb -0.12 -2.08 -0.12 0.00 0.00 0.00 0.00 23.12 20.81 2ek4 s ALA 137 CO 0.21 0.58 1.68 0.71 0.00 0.00 0.00 175.76 178.94 2ek4 s TYR 138 N -1.05 2.92 0.66 0.00 2.02 -1.26 -4.70 117.35 115.94 2ek4 s TYR 138 Ca 0.18 0.44 -0.16 0.00 -0.37 0.00 0.00 57.07 57.15 2ek4 s TYR 138 Cb -0.13 -4.10 0.00 0.00 -0.40 0.00 0.00 41.96 37.33 2ek4 s TYR 138 CO 0.07 -4.09 1.18 -2.14 -1.57 0.00 0.00 175.55 169.00 2ek4 s PRO 139 N 0.98 2.61 -0.05 -1.71 0.02 -1.26 -4.85 135.00 130.73 2ek4 s PRO 139 Ca 0.73 1.70 -0.02 0.00 0.02 0.00 0.00 61.00 63.43 2ek4 s PRO 139 Cb -0.49 -1.90 0.03 0.00 0.02 0.00 0.00 34.50 32.17 2ek4 s PRO 139 CO 0.34 -1.46 0.03 -1.83 -0.33 0.00 0.00 177.00 173.75 2ek4 s GLU 140 N -3.72 0.24 7.38 5.54 -1.05 -0.19 -5.02 118.70 121.86 2ek4 s GLU 140 Ca 0.74 0.25 0.00 0.00 -0.15 0.00 0.00 54.97 55.81 2ek4 s GLU 140 Cb -0.28 -0.72 0.00 0.00 -0.44 0.00 0.00 34.13 32.70 2ek4 s GLU 140 CO 0.40 -0.31 0.00 0.41 0.95 0.00 0.00 175.26 176.70 2ek4 n GLY 141 N 5.21 3.18 0.24 -3.83 0.00 -1.26 -1.28 105.19 107.45 2ek4 n GLY 141 Ca -0.05 -0.21 0.14 0.00 0.00 0.00 0.00 46.02 45.89 2ek4 n GLY 141 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ek4 n ASN 142 N 4.36 0.89 -4.61 1.61 5.03 -1.26 -4.81 115.26 116.47 2ek4 n ASN 142 Ca 0.00 -0.91 -0.42 0.00 0.87 0.00 0.00 54.58 54.12 2ek4 n ASN 142 Cb 0.00 0.03 -0.05 0.00 -1.02 0.00 0.00 39.78 38.74 2ek4 n ASN 142 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 2ek4 s TRP 143 N -2.37 3.22 -0.38 3.10 -0.11 -0.41 -5.01 118.94 116.98 2ek4 s TRP 143 Ca 0.30 0.80 0.04 0.00 1.22 0.00 0.00 56.10 58.45 2ek4 s TRP 143 Cb 0.20 -3.13 0.11 0.00 -1.50 0.00 0.00 33.47 29.15 2ek4 s TRP 143 CO 0.46 -0.51 0.10 0.12 -4.62 0.00 0.00 176.95 172.50 2ek4 s PHE 144 N 2.84 3.64 0.44 5.86 2.19 -1.26 -1.02 117.98 130.66 2ek4 s PHE 144 Ca 0.31 -3.02 -0.25 0.00 0.33 0.00 0.00 56.93 54.30 2ek4 s PHE 144 Cb -0.14 -2.92 -0.09 0.00 -1.31 0.00 0.00 43.02 38.55 2ek4 s PHE 144 CO 0.12 -0.91 1.34 -2.30 1.83 0.00 0.00 175.22 175.30 2ek4 n PRO 145 N 4.02 2.07 0.00 10.12 -0.02 -1.26 -4.94 135.00 144.99 2ek4 n PRO 145 Ca 0.04 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 2ek4 n PRO 145 Cb 0.40 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 2ek4 n PRO 145 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2ek4 n THR 146 N -0.22 0.00 -0.09 3.45 -2.24 -1.26 -4.92 114.28 109.01 2ek4 n THR 146 Ca 0.06 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 62.03 2ek4 n THR 146 Cb 0.40 0.93 0.62 0.00 -2.10 0.00 0.00 70.33 70.18 2ek4 n THR 146 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2ek4 h SER 147 N 0.00 0.16 0.04 3.42 4.64 -1.95 0.29 113.55 120.15 2ek4 h SER 147 Ca 0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2ek4 h SER 147 Cb 0.15 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2ek4 h SER 147 CO 0.00 0.08 -0.02 0.10 -0.87 0.00 0.00 176.83 176.13 2ek4 h TYR 148 N 0.17 0.00 -0.55 4.77 -0.00 -1.91 -0.33 116.97 119.13 2ek4 h TYR 148 Ca 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.93 2ek4 h TYR 148 Cb 1.02 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.73 2ek4 h TYR 148 CO -0.00 0.02 -0.12 -0.92 -0.00 0.00 0.00 178.16 177.14 2ek4 h TYR 149 N 0.00 1.17 -0.06 0.10 3.20 -1.32 -2.65 116.97 117.41 2ek4 h TYR 149 Ca -0.00 -0.25 -0.08 0.00 3.14 0.00 0.00 58.73 61.54 2ek4 h TYR 149 Cb 0.04 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 2ek4 h TYR 149 CO 0.00 1.08 -0.33 -0.44 -1.64 0.00 0.00 178.16 176.83 2ek4 h ASP 150 N 0.92 0.11 -0.17 -2.11 3.32 -1.14 -2.44 116.42 114.92 2ek4 h ASP 150 Ca 0.14 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 2ek4 h ASP 150 Cb 0.69 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 2ek4 h ASP 150 CO 0.05 0.44 -0.01 0.58 -1.72 0.00 0.00 179.24 178.58 2ek4 h VAL 151 N 0.10 1.27 -0.43 -1.35 2.07 -1.16 -1.06 116.25 115.69 2ek4 h VAL 151 Ca 0.01 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.68 2ek4 h VAL 151 Cb 0.64 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.89 2ek4 h VAL 151 CO 0.05 0.27 0.16 0.40 0.02 0.00 0.00 177.57 178.47 2ek4 h ILE 152 N 0.04 0.89 -0.12 4.57 2.04 -1.29 -0.53 117.51 123.10 2ek4 h ILE 152 Ca 0.05 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.81 2ek4 h ILE 152 Cb 0.41 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2ek4 h ILE 152 CO 0.01 0.06 0.00 0.50 0.00 0.00 0.00 178.15 178.72 2ek4 h LYS 153 N 0.33 0.04 -0.12 2.37 3.64 -1.30 0.22 116.57 121.75 2ek4 h LYS 153 Ca 0.20 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2ek4 h LYS 153 Cb 0.17 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2ek4 h LYS 153 CO -0.19 0.03 0.08 1.49 -2.27 0.00 0.00 179.45 178.59 2ek4 h GLU 154 N 0.04 0.16 -0.28 1.90 4.81 -0.84 -1.45 114.58 118.93 2ek4 h GLU 154 Ca 0.06 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 2ek4 h GLU 154 Cb 0.07 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2ek4 h GLU 154 CO -0.10 0.11 0.15 -0.91 -0.73 0.00 0.00 179.01 177.54 2ek4 h ASN 155 N 0.16 0.35 -0.99 1.04 2.35 -0.88 -2.92 115.58 114.68 2ek4 h ASN 155 Ca 0.04 -0.09 0.07 0.00 -0.55 0.00 0.00 56.30 55.77 2ek4 h ASN 155 Cb -0.01 -0.09 -0.07 0.00 0.05 0.00 0.00 38.32 38.20 2ek4 h ASN 155 CO -0.01 0.34 0.64 0.00 -1.65 0.00 0.00 177.43 176.74 2ek4 h ALA 156 N 1.02 1.38 0.00 -0.83 0.00 -0.40 0.38 119.26 120.81 2ek4 h ALA 156 Ca 0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2ek4 h ALA 156 Cb 0.07 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2ek4 h ALA 156 CO -0.02 0.42 -0.11 0.93 0.00 0.00 0.00 179.25 180.48 2ek4 h GLU 157 N 1.15 0.00 -0.02 0.00 5.08 -1.08 -1.29 114.58 118.42 2ek4 h GLU 157 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 2ek4 h GLU 157 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2ek4 h GLU 157 CO -0.18 0.11 -0.11 0.54 -1.00 0.00 0.00 179.01 178.36 2ek4 n ARG 158 N -4.08 1.57 -1.03 2.33 1.74 -0.06 -4.94 116.66 112.20 2ek4 n ARG 158 Ca -0.02 -1.08 -0.01 0.00 -0.77 0.00 0.00 57.85 55.97 2ek4 n ARG 158 Cb 0.19 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.15 2ek4 n ARG 158 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ek4 n GLY 159 N 1.28 0.49 3.90 -0.13 0.00 -0.49 -4.97 105.19 105.27 2ek4 n GLY 159 Ca 0.15 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 2ek4 n GLY 159 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ek4 s LEU 160 N -0.22 4.17 0.46 0.99 1.43 -0.14 -2.57 118.68 122.81 2ek4 s LEU 160 Ca 0.00 0.66 -0.18 0.00 -1.03 0.00 0.00 54.13 53.59 2ek4 s LEU 160 Cb 0.00 -3.43 -0.09 0.00 0.03 0.00 0.00 46.19 42.70 2ek4 s LEU 160 CO 0.00 -0.07 0.94 -1.00 0.23 0.00 0.00 176.35 176.46 2ek4 s HIS 161 N -1.86 3.40 -0.17 0.29 3.76 0.16 -3.35 115.29 117.52 2ek4 s HIS 161 Ca 0.43 1.47 0.01 0.00 -0.15 0.00 0.00 55.06 56.82 2ek4 s HIS 161 Cb -0.11 -2.77 0.01 0.00 1.11 0.00 0.00 32.58 30.82 2ek4 s HIS 161 CO 0.26 -0.23 -0.18 0.99 -0.85 0.00 0.00 174.74 174.74 2ek4 s THR 162 N -2.41 2.32 -0.20 1.30 2.01 0.24 -0.57 115.64 118.34 2ek4 s THR 162 Ca 0.59 -0.87 -0.17 0.00 0.31 0.00 0.00 61.69 61.56 2ek4 s THR 162 Cb -0.10 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 2ek4 s THR 162 CO 0.24 0.52 0.43 -0.22 -0.69 0.00 0.00 174.62 174.90 2ek4 s LEU 163 N 1.10 4.16 -0.30 4.42 2.96 -1.26 -1.63 118.68 128.12 2ek4 s LEU 163 Ca 0.00 0.57 -0.01 0.00 -0.22 0.00 0.00 54.13 54.47 2ek4 s LEU 163 Cb -0.14 -2.57 0.06 0.00 0.50 0.00 0.00 46.19 44.04 2ek4 s LEU 163 CO -0.07 -0.10 -0.00 -0.76 -1.32 0.00 0.00 176.35 174.10 2ek4 s LEU 164 N 1.35 3.96 0.42 -0.68 1.43 0.22 -1.86 118.68 123.52 2ek4 s LEU 164 Ca 0.20 -1.40 -0.24 0.00 -1.03 0.00 0.00 54.13 51.66 2ek4 s LEU 164 Cb -0.15 -1.68 -0.08 0.00 0.03 0.00 0.00 46.19 44.30 2ek4 s LEU 164 CO 0.08 -0.27 1.10 -0.36 0.23 0.00 0.00 176.35 177.13 2ek4 s PHE 165 N 1.19 3.11 -0.00 0.29 0.08 0.32 -2.26 117.98 120.71 2ek4 s PHE 165 Ca -0.04 1.60 -0.00 0.00 0.12 0.00 0.00 56.93 58.60 2ek4 s PHE 165 Cb -0.20 -3.24 -0.04 0.00 -0.57 0.00 0.00 43.02 38.98 2ek4 s PHE 165 CO -0.02 -1.00 0.07 -0.51 -0.10 0.00 0.00 175.22 173.66 2ek4 s LEU 166 N -2.78 3.86 0.90 -0.37 1.43 -1.26 -1.39 118.68 119.08 2ek4 s LEU 166 Ca 0.60 0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.71 2ek4 s LEU 166 Cb -0.25 -2.25 0.09 0.00 0.03 0.00 0.00 46.19 43.81 2ek4 s LEU 166 CO 0.31 0.27 0.87 -0.67 0.23 0.00 0.00 176.35 177.36 2ek4 n ASP 167 N 1.20 -0.46 -3.69 2.29 -0.08 -0.84 -4.82 116.55 110.16 2ek4 n ASP 167 Ca -0.13 0.43 -0.11 0.00 -1.51 0.00 0.00 54.79 53.47 2ek4 n ASP 167 Cb 0.53 -1.38 -0.10 0.00 2.34 0.00 0.00 41.12 42.51 2ek4 n ASP 167 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 2ek4 s ILE 168 N -2.43 -0.01 -0.64 5.18 2.07 -1.26 -2.16 121.20 121.94 2ek4 s ILE 168 Ca 0.64 0.05 0.05 0.00 -1.41 0.00 0.00 60.65 59.98 2ek4 s ILE 168 Cb -0.24 -0.69 0.17 0.00 0.13 0.00 0.00 42.46 41.83 2ek4 s ILE 168 CO 0.60 0.02 0.46 -0.54 -1.91 0.00 0.00 174.94 173.57 2ek4 s LYS 169 N 1.10 2.15 0.22 3.50 -0.14 0.49 -5.00 119.74 122.06 2ek4 s LYS 169 Ca -0.07 -3.09 -0.09 0.00 -1.36 0.00 0.00 55.97 51.37 2ek4 s LYS 169 Cb -0.06 -3.03 0.33 0.00 -1.68 0.00 0.00 37.83 33.38 2ek4 s LYS 169 CO -0.10 -1.30 1.71 0.00 -0.76 0.00 0.00 175.35 174.90 2ek4 h ALA 170 N 5.48 0.78 -0.81 5.17 0.00 -1.81 0.21 119.26 128.28 2ek4 h ALA 170 Ca 0.16 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 2ek4 h ALA 170 Cb 0.79 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 2ek4 h ALA 170 CO 0.65 -0.28 0.35 0.93 0.00 0.00 0.00 179.25 180.89 2ek4 h GLU 171 N 0.30 1.20 -0.00 0.00 5.08 -1.94 0.39 114.58 119.61 2ek4 h GLU 171 Ca 0.33 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2ek4 h GLU 171 Cb 0.50 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2ek4 h GLU 171 CO -0.40 0.96 -0.00 1.63 -1.00 0.00 0.00 179.01 180.20 2ek4 n LYS 172 N -4.28 0.64 -2.80 2.33 5.02 -0.79 -4.91 118.16 113.37 2ek4 n LYS 172 Ca 0.08 -0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.15 2ek4 n LYS 172 Cb 0.17 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.70 2ek4 n LYS 172 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2ek4 n ARG 173 N -1.18 -3.74 -3.55 1.97 1.74 0.54 -4.97 116.66 107.46 2ek4 n ARG 173 Ca 0.18 0.92 -0.38 0.00 -0.77 0.00 0.00 57.85 57.80 2ek4 n ARG 173 Cb 0.19 -5.66 -0.10 0.00 -1.02 0.00 0.00 32.46 25.88 2ek4 n ARG 173 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2ek4 s MET 174 N -5.45 4.03 -0.25 5.56 -1.94 0.01 -4.98 119.30 116.28 2ek4 s MET 174 Ca 0.20 -0.17 0.00 0.00 -1.71 0.00 0.00 55.69 54.01 2ek4 s MET 174 Cb -0.09 -3.60 0.07 0.00 2.01 0.00 0.00 34.83 33.22 2ek4 s MET 174 CO 0.25 -0.10 -0.01 0.71 -0.01 0.00 0.00 175.02 175.86 2ek4 s TYR 175 N 1.52 2.22 0.15 -0.03 2.02 -1.26 -0.38 117.35 121.58 2ek4 s TYR 175 Ca 0.10 -1.73 -0.32 0.00 -0.37 0.00 0.00 57.07 54.74 2ek4 s TYR 175 Cb -0.15 -1.64 -0.12 0.00 -0.40 0.00 0.00 41.96 39.65 2ek4 s TYR 175 CO 0.08 -0.78 1.74 -0.12 -1.57 0.00 0.00 175.55 174.90 2ek4 n MET 176 N 4.71 2.58 -2.68 -0.62 0.00 -0.92 -4.93 117.12 115.27 2ek4 n MET 176 Ca -0.09 0.94 -0.25 0.00 -0.00 0.00 0.00 57.70 58.30 2ek4 n MET 176 Cb 0.44 -2.78 0.02 0.00 0.00 0.00 0.00 33.22 30.90 2ek4 n MET 176 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2ek4 s THR 177 N 1.82 3.89 0.39 1.12 -4.23 -1.26 -4.40 115.64 112.98 2ek4 s THR 177 Ca 0.79 -0.21 0.17 0.00 -1.18 0.00 0.00 61.69 61.26 2ek4 s THR 177 Cb -0.55 -3.49 0.17 0.00 1.34 0.00 0.00 72.50 69.96 2ek4 s THR 177 CO 0.37 -0.43 1.93 0.00 -0.54 0.00 0.00 174.62 175.94 2ek4 h ALA 178 N 0.12 1.44 0.00 3.99 0.00 -1.91 -2.19 119.26 120.72 2ek4 h ALA 178 Ca -0.46 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.22 2ek4 h ALA 178 Cb 1.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2ek4 h ALA 178 CO 0.59 0.32 -0.00 -0.91 0.00 0.00 0.00 179.25 179.25 2ek4 h ASN 179 N 0.00 -0.00 -0.69 0.00 4.21 -1.91 -0.64 115.58 116.55 2ek4 h ASN 179 Ca -0.00 -0.15 -0.01 0.00 1.21 0.00 0.00 56.30 57.34 2ek4 h ASN 179 Cb 0.50 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.66 2ek4 h ASN 179 CO 0.03 0.15 0.39 -0.33 -1.29 0.00 0.00 177.43 176.39 2ek4 h GLU 180 N -0.16 0.97 -0.69 0.81 5.08 -1.81 -0.68 114.58 118.10 2ek4 h GLU 180 Ca -0.00 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 2ek4 h GLU 180 Cb 0.16 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 2ek4 h GLU 180 CO 0.00 0.70 0.18 0.00 -1.00 0.00 0.00 179.01 178.89 2ek4 h ALA 181 N 1.46 0.91 -0.49 3.43 0.00 -1.16 -1.23 119.26 122.17 2ek4 h ALA 181 Ca 0.25 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2ek4 h ALA 181 Cb 0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2ek4 h ALA 181 CO -0.04 0.62 0.09 0.52 0.00 0.00 0.00 179.25 180.44 2ek4 h MET 182 N 1.03 0.80 -0.12 0.00 2.86 -0.38 -1.66 114.93 117.46 2ek4 h MET 182 Ca 0.22 -0.21 0.01 0.00 -2.06 0.00 0.00 59.70 57.66 2ek4 h MET 182 Cb 0.35 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2ek4 h MET 182 CO 0.00 0.79 0.05 0.93 1.06 0.00 0.00 176.91 179.74 2ek4 h GLU 183 N 0.68 0.11 -0.91 1.72 4.39 -0.88 -1.67 114.58 118.01 2ek4 h GLU 183 Ca 0.15 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.88 2ek4 h GLU 183 Cb 0.37 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.94 2ek4 h GLU 183 CO 0.01 0.08 0.59 -0.07 -1.16 0.00 0.00 179.01 178.45 2ek4 h LEU 184 N 0.12 0.98 -0.85 1.33 3.38 -1.11 -2.20 115.31 116.96 2ek4 h LEU 184 Ca 0.05 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2ek4 h LEU 184 Cb 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2ek4 h LEU 184 CO -0.04 0.67 -0.01 -0.07 0.09 0.00 0.00 178.44 179.08 2ek4 h LEU 185 N 1.14 0.82 -0.79 1.67 3.38 -0.97 -1.35 115.31 119.22 2ek4 h LEU 185 Ca 0.37 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 2ek4 h LEU 185 Cb 0.02 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2ek4 h LEU 185 CO -0.12 0.89 -0.09 -0.07 0.09 0.00 0.00 178.44 179.13 2ek4 h LEU 186 N 0.79 0.81 -0.69 1.67 3.38 -0.89 -0.19 115.31 120.19 2ek4 h LEU 186 Ca 0.15 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2ek4 h LEU 186 Cb 0.48 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 2ek4 h LEU 186 CO 0.02 0.93 0.13 0.11 0.09 0.00 0.00 178.44 179.72 2ek4 h LYS 187 N 0.74 1.13 -0.23 1.13 1.57 -1.04 -1.18 116.57 118.68 2ek4 h LYS 187 Ca 0.13 -0.29 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 2ek4 h LYS 187 Cb 0.58 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 2ek4 h LYS 187 CO 0.04 1.01 -0.31 0.28 -0.57 0.00 0.00 179.45 179.91 2ek4 h VAL 188 N 1.05 1.28 -0.60 0.50 2.07 -0.89 -2.31 116.25 117.36 2ek4 h VAL 188 Ca 0.21 -1.37 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 2ek4 h VAL 188 Cb 0.42 1.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2ek4 h VAL 188 CO 0.01 0.43 0.25 -0.08 0.02 0.00 0.00 177.57 178.19 2ek4 h GLU 189 N 0.40 0.89 -0.46 1.57 4.57 -0.53 -0.26 114.58 120.76 2ek4 h GLU 189 Ca 0.05 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.06 2ek4 h GLU 189 Cb 0.74 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.16 2ek4 h GLU 189 CO 0.06 0.75 0.22 -0.44 -1.18 0.00 0.00 179.01 178.42 2ek4 h ASP 190 N 0.83 0.56 0.39 1.04 3.32 -0.93 1.75 116.42 123.38 2ek4 h ASP 190 Ca 0.20 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 2ek4 h ASP 190 Cb 0.19 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.60 2ek4 h ASP 190 CO -0.02 0.48 -0.19 0.24 -1.72 0.00 0.00 179.24 178.04 2ek4 h MET 191 N 0.64 -0.51 0.06 3.56 2.86 -0.81 -3.37 114.93 117.36 2ek4 h MET 191 Ca 0.16 0.03 -0.30 0.00 -2.06 0.00 0.00 59.70 57.54 2ek4 h MET 191 Cb 0.06 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 2ek4 h MET 191 CO -0.02 -0.20 -1.59 0.87 1.06 0.00 0.00 176.91 177.03 2ek4 h LYS 192 N -0.95 0.12 -5.89 1.72 1.57 -0.96 -3.49 116.57 108.69 2ek4 h LYS 192 Ca -0.05 -0.21 -0.38 0.00 -1.87 0.00 0.00 60.65 58.14 2ek4 h LYS 192 Cb 0.54 0.08 0.11 0.00 0.08 0.00 0.00 32.23 33.04 2ek4 h LYS 192 CO 0.09 0.87 -0.78 1.63 -0.57 0.00 0.00 179.45 180.69 2ek4 n LYS 193 N -3.29 -6.02 -0.13 3.15 5.02 0.60 -4.91 118.16 112.57 2ek4 n LYS 193 Ca -0.17 0.74 0.11 0.00 -2.02 0.00 0.00 58.31 56.98 2ek4 n LYS 193 Cb 1.03 -5.58 0.28 0.00 -0.02 0.00 0.00 35.03 30.75 2ek4 n LYS 193 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ek4 n GLY 194 N -1.44 1.06 2.38 0.72 0.00 -1.26 -4.92 105.19 101.72 2ek4 n GLY 194 Ca -0.24 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.02 2ek4 n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ek4 n GLY 195 N 1.34 -0.28 0.14 -0.02 0.00 -1.26 -4.91 105.19 100.19 2ek4 n GLY 195 Ca 0.18 -0.19 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 2ek4 n GLY 195 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ek4 n VAL 196 N -4.05 1.78 -3.65 1.61 0.31 -1.26 -4.85 118.33 108.21 2ek4 n VAL 196 Ca -0.17 -0.62 -0.27 0.00 -0.01 0.00 0.00 64.34 63.27 2ek4 n VAL 196 Cb 0.64 -1.76 -0.17 0.00 -0.91 0.00 0.00 33.84 31.64 2ek4 n VAL 196 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2ek4 s PHE 197 N -2.55 0.50 0.29 3.52 5.36 -1.26 -4.98 117.98 118.87 2ek4 s PHE 197 Ca -0.22 -0.55 0.04 0.00 -0.96 0.00 0.00 56.93 55.24 2ek4 s PHE 197 Cb 0.06 -0.83 -0.02 0.00 -0.34 0.00 0.00 43.02 41.90 2ek4 s PHE 197 CO 0.76 -0.57 0.15 0.25 -1.46 0.00 0.00 175.22 174.35 2ek4 n THR 198 N 5.19 0.00 0.29 0.12 -2.24 -1.26 -4.65 114.28 111.73 2ek4 n THR 198 Ca -0.07 -1.81 0.14 0.00 -2.27 0.00 0.00 64.05 60.03 2ek4 n THR 198 Cb 0.48 0.74 0.86 0.00 -2.10 0.00 0.00 70.33 70.31 2ek4 n THR 198 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2ek4 h ASP 199 N 1.34 0.00 -0.01 3.42 3.32 -1.99 -1.87 116.42 120.64 2ek4 h ASP 199 Ca -0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.83 2ek4 h ASP 199 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2ek4 h ASP 199 CO 0.34 0.02 -0.01 0.47 -1.72 0.00 0.00 179.24 178.34 2ek4 n ASP 200 N -3.90 1.70 -4.74 6.45 8.00 -1.26 -1.47 116.55 121.34 2ek4 n ASP 200 Ca -0.03 -1.55 -0.41 0.00 0.71 0.00 0.00 54.79 53.51 2ek4 n ASP 200 Cb 0.11 0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.18 2ek4 n ASP 200 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2ek4 s THR 201 N -2.02 3.47 0.04 -3.53 2.01 -0.70 -4.80 115.64 110.11 2ek4 s THR 201 Ca 0.36 1.23 -0.28 0.00 0.31 0.00 0.00 61.69 63.31 2ek4 s THR 201 Cb 0.21 -3.78 -0.05 0.00 0.01 0.00 0.00 72.50 68.89 2ek4 s THR 201 CO 0.34 0.19 0.87 -0.22 -0.69 0.00 0.00 174.62 175.11 2ek4 s LEU 202 N -0.17 4.42 0.18 4.42 2.96 -1.26 -1.52 118.68 127.71 2ek4 s LEU 202 Ca 0.54 1.57 0.02 0.00 -0.22 0.00 0.00 54.13 56.03 2ek4 s LEU 202 Cb -0.34 -3.40 -0.05 0.00 0.50 0.00 0.00 46.19 42.90 2ek4 s LEU 202 CO 0.37 -0.10 0.01 0.68 -1.32 0.00 0.00 176.35 175.99 2ek4 s VAL 203 N 0.38 0.65 -0.03 1.68 -7.23 0.13 -4.21 120.40 111.77 2ek4 s VAL 203 Ca 0.44 -1.98 0.03 0.00 -1.81 0.00 0.00 61.98 58.66 2ek4 s VAL 203 Cb -0.21 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.55 2ek4 s VAL 203 CO 0.26 -0.42 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.84 2ek4 s VAL 204 N -3.68 0.86 -0.08 1.32 1.01 0.33 -1.53 120.40 118.63 2ek4 s VAL 204 Ca 0.26 -0.40 0.05 0.00 0.00 0.00 0.00 61.98 61.89 2ek4 s VAL 204 Cb 0.06 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 2ek4 s VAL 204 CO 0.05 0.27 -0.23 -0.69 0.00 0.00 0.00 175.10 174.49 2ek4 s VAL 205 N 0.21 2.15 -0.13 2.92 1.01 0.20 -0.76 120.40 125.99 2ek4 s VAL 205 Ca -0.04 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 60.94 2ek4 s VAL 205 Cb -0.09 -1.81 0.02 0.00 0.00 0.00 0.00 36.38 34.50 2ek4 s VAL 205 CO 0.01 0.56 -0.12 -0.22 0.00 0.00 0.00 175.10 175.33 2ek4 s LEU 206 N 0.09 1.52 -0.05 3.92 2.96 -1.13 -1.06 118.68 124.94 2ek4 s LEU 206 Ca -0.11 -0.42 0.05 0.00 -0.22 0.00 0.00 54.13 53.44 2ek4 s LEU 206 Cb -0.16 -1.06 -0.01 0.00 0.50 0.00 0.00 46.19 45.47 2ek4 s LEU 206 CO 0.06 -0.07 -0.21 0.00 -1.32 0.00 0.00 176.35 174.81 2ek4 s ALA 207 N 1.50 1.81 -1.30 5.97 0.00 -0.06 -1.77 121.76 127.92 2ek4 s ALA 207 Ca 0.04 -0.86 -0.01 0.00 0.00 0.00 0.00 51.96 51.13 2ek4 s ALA 207 Cb -0.13 -0.56 -0.00 0.00 0.00 0.00 0.00 23.12 22.43 2ek4 s ALA 207 CO -0.09 0.35 0.71 0.54 0.00 0.00 0.00 175.76 177.27 2ek4 n ARG 208 N 2.99 -4.79 -1.89 0.00 1.74 -0.29 -1.58 116.66 112.84 2ek4 n ARG 208 Ca -0.17 0.62 -0.39 0.00 -0.77 0.00 0.00 57.85 57.14 2ek4 n ARG 208 Cb 0.52 -5.17 0.02 0.00 -1.02 0.00 0.00 32.46 26.81 2ek4 n ARG 208 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ek4 s ALA 209 N -3.66 3.01 0.00 7.54 0.00 -1.26 -2.47 121.76 124.92 2ek4 s ALA 209 Ca 0.02 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.28 2ek4 s ALA 209 Cb -0.01 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.58 2ek4 s ALA 209 CO 0.81 -1.16 0.00 0.41 0.00 0.00 0.00 175.76 175.82 2ek4 n GLY 210 N 0.64 2.50 3.85 0.00 0.00 -1.26 -3.92 105.19 107.00 2ek4 n GLY 210 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2ek4 n GLY 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ek4 s SER 211 N -0.01 5.06 0.38 1.61 1.04 -1.03 -4.68 113.70 116.07 2ek4 s SER 211 Ca 0.00 1.22 0.16 0.00 0.48 0.00 0.00 55.95 57.81 2ek4 s SER 211 Cb 0.00 -2.00 0.77 0.00 0.10 0.00 0.00 66.02 64.89 2ek4 s SER 211 CO 0.00 -1.60 1.81 -0.07 0.98 0.00 0.00 173.24 174.36 2ek4 h LEU 212 N -0.83 0.00 -6.17 2.42 -0.00 -1.97 -3.34 115.31 105.42 2ek4 h LEU 212 Ca -0.46 0.00 -0.60 0.00 -0.00 0.00 0.00 57.88 56.83 2ek4 h LEU 212 Cb 1.26 0.00 -0.42 0.00 -0.00 0.00 0.00 40.66 41.50 2ek4 h LEU 212 CO 0.62 0.37 -0.65 0.59 -0.00 0.00 0.00 178.44 179.37 2ek4 n ASN 213 N -3.82 3.39 -4.75 -0.43 3.02 -1.26 -5.09 115.26 106.31 2ek4 n ASN 213 Ca -0.01 -3.37 -0.30 0.00 -0.03 0.00 0.00 54.58 50.87 2ek4 n ASN 213 Cb 0.44 -0.67 0.13 0.00 -0.61 0.00 0.00 39.78 39.07 2ek4 n ASN 213 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2ek4 s PRO 214 N -2.35 1.40 -0.31 3.52 0.04 -1.26 -5.00 135.00 131.05 2ek4 s PRO 214 Ca 0.39 0.66 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 2ek4 s PRO 214 Cb 0.15 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.83 2ek4 s PRO 214 CO -0.02 -2.10 0.18 0.99 0.04 0.00 0.00 177.00 176.09 2ek4 s THR 215 N -3.05 4.92 -0.26 1.26 2.01 -0.61 -4.94 115.64 114.97 2ek4 s THR 215 Ca 0.63 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 62.44 2ek4 s THR 215 Cb -0.17 -3.46 0.06 0.00 0.01 0.00 0.00 72.50 68.94 2ek4 s THR 215 CO 0.56 0.11 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.86 2ek4 s ILE 216 N 1.68 2.26 0.00 1.82 1.01 -1.26 -0.88 121.20 125.83 2ek4 s ILE 216 Ca 0.06 -1.56 0.03 0.00 0.00 0.00 0.00 60.65 59.17 2ek4 s ILE 216 Cb -0.17 -2.31 -0.01 0.00 0.01 0.00 0.00 42.46 39.99 2ek4 s ILE 216 CO 0.08 -0.00 -0.09 -0.13 0.00 0.00 0.00 174.94 174.80 2ek4 s ARG 217 N 1.13 0.67 0.01 2.79 1.81 -0.22 -4.36 118.95 120.78 2ek4 s ARG 217 Ca -0.08 -0.37 0.03 0.00 -1.72 0.00 0.00 55.73 53.59 2ek4 s ARG 217 Cb -0.20 -0.63 -0.01 0.00 -0.45 0.00 0.00 34.95 33.66 2ek4 s ARG 217 CO -0.05 0.17 -0.10 0.00 -0.68 0.00 0.00 175.30 174.64 2ek4 s ALA 218 N -0.35 0.79 0.00 2.13 0.00 -0.95 0.58 121.76 123.95 2ek4 s ALA 218 Ca 0.02 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.44 2ek4 s ALA 218 Cb -0.04 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2ek4 s ALA 218 CO -0.00 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.32 2ek4 n GLY 219 N 2.41 -1.83 3.78 0.00 0.00 -0.58 -3.75 105.19 105.22 2ek4 n GLY 219 Ca -0.16 -1.14 -0.37 0.00 0.00 0.00 0.00 46.02 44.35 2ek4 n GLY 219 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ek4 s TYR 220 N -2.42 3.65 0.27 1.61 2.02 -1.26 -0.69 117.35 120.52 2ek4 s TYR 220 Ca 0.00 1.77 -0.00 0.00 -0.37 0.00 0.00 57.07 58.46 2ek4 s TYR 220 Cb 0.00 -2.94 0.58 0.00 -0.40 0.00 0.00 41.96 39.21 2ek4 s TYR 220 CO 0.00 0.13 1.72 0.28 -1.57 0.00 0.00 175.55 176.11 2ek4 h VAL 221 N 2.56 0.58 -0.51 0.71 2.07 -1.14 -0.05 116.25 120.46 2ek4 h VAL 221 Ca -0.47 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.00 2ek4 h VAL 221 Cb 1.19 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 2ek4 h VAL 221 CO 0.65 0.08 0.35 0.07 0.02 0.00 0.00 177.57 178.74 2ek4 h LYS 222 N 0.44 0.24 0.00 1.57 2.10 -1.54 0.19 116.57 119.57 2ek4 h LYS 222 Ca 0.48 -0.01 -0.18 0.00 -2.00 0.00 0.00 60.65 58.94 2ek4 h LYS 222 Cb 0.82 -0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 32.06 2ek4 h LYS 222 CO -0.46 0.16 -1.68 -0.25 -2.00 0.00 0.00 179.45 175.22 2ek4 n ASP 223 N -4.45 0.57 -0.02 7.07 8.00 -0.14 -4.47 116.55 123.10 2ek4 n ASP 223 Ca 0.08 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.84 2ek4 n ASP 223 Cb 0.41 0.60 -0.13 0.00 -0.02 0.00 0.00 41.12 41.97 2ek4 n ASP 223 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2ek4 n LEU 224 N -2.76 0.30 -0.25 0.64 4.32 -0.54 -4.39 117.00 114.32 2ek4 n LEU 224 Ca -0.13 0.13 0.32 0.00 -0.02 0.00 0.00 56.01 56.31 2ek4 n LEU 224 Cb 0.85 0.19 0.73 0.00 -1.62 0.00 0.00 43.42 43.58 2ek4 n LEU 224 CO 0.43 0.21 1.30 -0.29 -1.22 0.00 0.00 177.39 177.82 2ek4 h ILE 225 N 0.00 0.43 -0.17 -0.08 2.10 -0.86 0.18 117.51 119.11 2ek4 h ILE 225 Ca -0.24 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.70 2ek4 h ILE 225 Cb 1.61 0.45 0.00 0.00 -1.09 0.00 0.00 36.82 37.79 2ek4 h ILE 225 CO 0.02 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.63 2ek4 n ARG 226 N -4.13 1.68 -2.40 2.19 1.74 -1.26 -4.68 116.66 109.79 2ek4 n ARG 226 Ca 0.22 -1.57 -0.34 0.00 -0.77 0.00 0.00 57.85 55.39 2ek4 n ARG 226 Cb 1.13 -1.22 -0.02 0.00 -1.02 0.00 0.00 32.46 31.33 2ek4 n ARG 226 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2ek4 s GLU 227 N -0.93 3.63 -0.31 5.56 2.12 0.05 -5.01 118.70 123.81 2ek4 s GLU 227 Ca 0.17 1.37 -0.19 0.00 0.36 0.00 0.00 54.97 56.68 2ek4 s GLU 227 Cb 0.10 -2.07 -0.01 0.00 0.26 0.00 0.00 34.13 32.41 2ek4 s GLU 227 CO 0.14 -0.57 0.56 0.34 -0.54 0.00 0.00 175.26 175.19 2ek4 s ASP 228 N -2.11 6.41 -0.06 -1.70 -1.08 -1.26 -4.91 116.67 111.96 2ek4 s ASP 228 Ca 0.67 0.29 0.18 0.00 -0.52 0.00 0.00 52.55 53.17 2ek4 s ASP 228 Cb -0.17 -2.30 0.60 0.00 -1.46 0.00 0.00 42.92 39.59 2ek4 s ASP 228 CO 0.24 -0.44 1.51 0.49 0.52 0.00 0.00 175.17 177.49 2ek4 n PHE 229 N 5.76 1.08 -1.00 -5.34 3.72 -1.26 -5.08 117.46 115.34 2ek4 n PHE 229 Ca -0.03 -0.58 0.00 0.00 -0.05 0.00 0.00 57.45 56.79 2ek4 n PHE 229 Cb 0.49 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 2ek4 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ek4 n GLY 230 N 1.02 -2.49 3.69 1.37 0.00 -1.26 -4.77 105.19 102.76 2ek4 n GLY 230 Ca 0.22 -1.62 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 2ek4 n GLY 230 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ek4 s ASP 231 N -2.35 3.33 0.98 1.61 1.01 -1.26 -5.03 116.67 114.97 2ek4 s ASP 231 Ca 0.00 1.96 -0.14 0.00 0.71 0.00 0.00 52.55 55.07 2ek4 s ASP 231 Cb 0.00 -2.50 0.18 0.00 1.01 0.00 0.00 42.92 41.61 2ek4 s ASP 231 CO 0.00 -2.80 1.15 -2.16 0.21 0.00 0.00 175.17 171.57 2ek4 s PRO 232 N -4.75 0.54 0.50 8.23 0.04 -1.26 -4.53 135.00 133.77 2ek4 s PRO 232 Ca 0.65 0.15 -0.18 0.00 0.04 0.00 0.00 61.00 61.65 2ek4 s PRO 232 Cb -0.21 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 2ek4 s PRO 232 CO 0.58 -2.57 1.00 -1.25 0.04 0.00 0.00 177.00 174.79 2ek4 s PRO 233 N -5.35 3.88 0.16 0.56 0.04 -1.26 -4.71 135.00 128.32 2ek4 s PRO 233 Ca 0.67 1.12 0.07 0.00 0.04 0.00 0.00 61.00 62.90 2ek4 s PRO 233 Cb -0.13 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 2ek4 s PRO 233 CO 0.54 -0.33 -0.16 -1.01 0.04 0.00 0.00 177.00 176.08 2ek4 s HIS 234 N -2.35 1.64 0.04 0.56 3.76 -1.26 -1.14 115.29 116.55 2ek4 s HIS 234 Ca 0.62 -0.54 0.03 0.00 -0.15 0.00 0.00 55.06 55.02 2ek4 s HIS 234 Cb -0.12 -0.81 -0.02 0.00 1.11 0.00 0.00 32.58 32.73 2ek4 s HIS 234 CO 0.25 0.28 -0.09 0.96 -0.85 0.00 0.00 174.74 175.29 2ek4 s ILE 235 N -2.41 0.64 -0.01 0.60 -4.36 -0.73 -4.24 121.20 110.71 2ek4 s ILE 235 Ca 0.16 -1.02 0.05 0.00 -0.26 0.00 0.00 60.65 59.58 2ek4 s ILE 235 Cb -0.04 -0.67 -0.03 0.00 1.25 0.00 0.00 42.46 42.97 2ek4 s ILE 235 CO 0.05 -0.29 -0.16 -0.22 0.24 0.00 0.00 174.94 174.56 2ek4 s LEU 236 N -1.44 2.65 -0.04 0.37 2.96 -0.96 -2.82 118.68 119.40 2ek4 s LEU 236 Ca -0.07 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.55 2ek4 s LEU 236 Cb -0.09 -1.54 0.01 0.00 0.50 0.00 0.00 46.19 45.07 2ek4 s LEU 236 CO 0.01 0.30 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.61 2ek4 s ILE 237 N -0.82 0.90 -0.39 6.68 1.01 0.06 -0.61 121.20 128.03 2ek4 s ILE 237 Ca 0.13 -0.39 -0.04 0.00 0.00 0.00 0.00 60.65 60.34 2ek4 s ILE 237 Cb -0.11 -0.81 0.09 0.00 0.01 0.00 0.00 42.46 41.64 2ek4 s ILE 237 CO 0.03 0.29 0.17 -0.69 0.00 0.00 0.00 174.94 174.74 2ek4 s VAL 238 N 0.38 3.48 0.65 2.92 1.01 -0.65 -0.51 120.40 127.68 2ek4 s VAL 238 Ca -0.07 -1.72 -0.16 0.00 0.00 0.00 0.00 61.98 60.03 2ek4 s VAL 238 Cb -0.11 -3.23 -0.00 0.00 0.00 0.00 0.00 36.38 33.04 2ek4 s VAL 238 CO 0.01 -0.51 1.17 -2.84 0.00 0.00 0.00 175.10 172.93 2ek4 s PRO 239 N 1.25 2.70 0.00 2.72 0.02 -1.26 -0.59 135.00 139.84 2ek4 s PRO 239 Ca 0.04 1.64 0.00 0.00 0.02 0.00 0.00 61.00 62.70 2ek4 s PRO 239 Cb -0.22 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.38 2ek4 s PRO 239 CO -0.02 -1.37 0.00 0.41 -0.33 0.00 0.00 177.00 175.69 2ek4 n GLY 240 N 0.11 1.17 3.71 0.52 0.00 -1.21 -4.83 105.19 104.66 2ek4 n GLY 240 Ca 0.12 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 2ek4 n GLY 240 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ek4 s LYS 241 N 3.34 4.54 0.16 1.61 2.20 -1.06 -4.95 119.74 125.58 2ek4 s LYS 241 Ca 0.00 1.55 -0.13 0.00 -0.36 0.00 0.00 55.97 57.03 2ek4 s LYS 241 Cb 0.00 -3.40 -0.07 0.00 -1.51 0.00 0.00 37.83 32.85 2ek4 s LYS 241 CO 0.00 -0.08 0.54 -0.51 -0.36 0.00 0.00 175.35 174.94 2ek4 s LEU 242 N 0.82 4.30 0.42 5.43 1.43 -1.26 -4.91 118.68 124.92 2ek4 s LEU 242 Ca 0.53 1.03 -0.10 0.00 -1.03 0.00 0.00 54.13 54.57 2ek4 s LEU 242 Cb -0.24 -3.34 -0.06 0.00 0.03 0.00 0.00 46.19 42.58 2ek4 s LEU 242 CO 0.29 0.07 0.78 -1.00 0.23 0.00 0.00 176.35 176.72 2ek4 s HIS 243 N -1.53 3.49 0.20 0.29 3.76 -1.26 -4.93 115.29 115.30 2ek4 s HIS 243 Ca 0.39 1.01 -0.11 0.00 -0.15 0.00 0.00 55.06 56.20 2ek4 s HIS 243 Cb -0.14 -2.42 0.22 0.00 1.11 0.00 0.00 32.58 31.35 2ek4 s HIS 243 CO 0.19 -0.14 1.74 0.82 -0.85 0.00 0.00 174.74 176.50 2ek4 h ILE 244 N 0.93 0.79 0.00 0.60 5.03 -1.98 -1.50 117.51 121.38 2ek4 h ILE 244 Ca -0.47 -0.13 -0.04 0.00 -0.12 0.00 0.00 64.86 64.10 2ek4 h ILE 244 Cb 1.19 0.39 -0.01 0.00 -3.03 0.00 0.00 36.82 35.36 2ek4 h ILE 244 CO 0.63 0.07 -0.19 1.62 -0.68 0.00 0.00 178.15 179.60 2ek4 h VAL 245 N 0.37 0.62 0.02 1.67 3.04 -1.98 0.20 116.25 120.20 2ek4 h VAL 245 Ca 0.27 -0.85 -0.00 0.00 -1.01 0.00 0.00 66.70 65.11 2ek4 h VAL 245 Cb 0.32 1.55 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 2ek4 h VAL 245 CO -0.28 0.19 -0.01 -0.33 -1.01 0.00 0.00 177.57 176.13 2ek4 h GLU 246 N 0.00 -0.03 -0.58 4.17 5.08 -1.54 -1.91 114.58 119.77 2ek4 h GLU 246 Ca -0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2ek4 h GLU 246 Cb 0.54 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 2ek4 h GLU 246 CO 0.02 0.39 0.36 0.00 -1.00 0.00 0.00 179.01 178.79 2ek4 h ALA 247 N 0.52 0.75 -0.66 3.43 0.00 -1.01 -0.70 119.26 121.59 2ek4 h ALA 247 Ca -0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2ek4 h ALA 247 Cb 0.43 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 2ek4 h ALA 247 CO 0.00 0.11 0.33 0.93 0.00 0.00 0.00 179.25 180.62 2ek4 h GLU 248 N 0.73 0.56 -0.21 0.00 5.08 -0.93 -1.09 114.58 118.72 2ek4 h GLU 248 Ca 0.23 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 2ek4 h GLU 248 Cb -0.01 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2ek4 h GLU 248 CO -0.08 0.37 0.03 -0.92 -1.00 0.00 0.00 179.01 177.41 2ek4 h TYR 249 N 0.58 0.38 -0.86 4.33 5.03 -0.59 -0.37 116.97 125.47 2ek4 h TYR 249 Ca 0.32 -0.05 0.08 0.00 2.58 0.00 0.00 58.73 61.66 2ek4 h TYR 249 Cb 0.30 -0.10 -0.06 0.00 1.55 0.00 0.00 36.73 38.42 2ek4 h TYR 249 CO -0.11 0.49 0.56 -0.07 -1.32 0.00 0.00 178.16 177.71 2ek4 h LEU 250 N 0.15 0.80 -0.00 2.82 3.38 -0.64 0.32 115.31 122.14 2ek4 h LEU 250 Ca 0.06 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2ek4 h LEU 250 Cb 0.32 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2ek4 h LEU 250 CO 0.00 0.50 -0.01 0.58 0.09 0.00 0.00 178.44 179.60 2ek4 h VAL 251 N 0.90 1.54 -0.28 1.22 2.07 -0.99 -1.11 116.25 119.60 2ek4 h VAL 251 Ca 0.38 -1.61 -0.16 0.00 0.82 0.00 0.00 66.70 66.13 2ek4 h VAL 251 Cb 0.31 2.64 -0.00 0.00 -1.52 0.00 0.00 31.29 32.71 2ek4 h VAL 251 CO -0.15 0.42 -0.49 -0.33 0.02 0.00 0.00 177.57 177.04 2ek4 h GLU 252 N -0.67 0.75 0.00 1.57 4.39 -0.81 -3.08 114.58 116.74 2ek4 h GLU 252 Ca -0.00 -0.44 -0.33 0.00 0.34 0.00 0.00 59.36 58.93 2ek4 h GLU 252 Cb 0.69 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.32 2ek4 h GLU 252 CO 0.00 1.07 -2.25 -0.89 -1.16 0.00 0.00 179.01 175.78 2ek4 n ILE 253 N -4.01 1.26 -0.38 3.13 2.08 0.11 -4.58 119.36 116.96 2ek4 n ILE 253 Ca -0.03 -0.57 0.11 0.00 0.56 0.00 0.00 62.75 62.82 2ek4 n ILE 253 Cb 0.58 -1.06 0.31 0.00 -0.75 0.00 0.00 39.64 38.72 2ek4 n ILE 253 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2ek4 n ALA 254 N -3.00 2.44 -3.22 -1.39 0.00 -0.66 -4.92 120.51 109.76 2ek4 n ALA 254 Ca -0.36 -1.33 -0.23 0.00 0.00 0.00 0.00 53.44 51.52 2ek4 n ALA 254 Cb 0.97 -0.88 0.04 0.00 0.00 0.00 0.00 19.45 19.57 2ek4 n ALA 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ek4 n GLY 255 N 1.45 -0.52 3.82 0.00 0.00 -0.81 -2.24 105.19 106.88 2ek4 n GLY 255 Ca 0.23 0.15 -0.32 0.00 0.00 0.00 0.00 46.02 46.09 2ek4 n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ek4 s ALA 256 N -3.17 2.73 0.19 4.61 0.00 -0.51 -4.76 121.76 120.85 2ek4 s ALA 256 Ca 0.39 0.19 -0.33 0.00 0.00 0.00 0.00 51.96 52.21 2ek4 s ALA 256 Cb -0.18 -3.19 -0.13 0.00 0.00 0.00 0.00 23.12 19.63 2ek4 s ALA 256 CO 0.48 -1.01 1.66 -2.30 0.00 0.00 0.00 175.76 174.59 2ek4 n PRO 257 N -2.65 2.53 0.24 0.00 -0.02 -1.26 -4.59 135.00 129.24 2ek4 n PRO 257 Ca 0.08 0.91 0.17 0.00 -2.02 0.00 0.00 63.50 62.64 2ek4 n PRO 257 Cb 0.53 -2.73 0.79 0.00 -0.02 0.00 0.00 33.50 32.07 2ek4 n PRO 257 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ek4 h ARG 258 N 6.39 0.00 0.00 -0.52 3.08 -1.95 -1.31 114.38 120.08 2ek4 h ARG 258 Ca -0.44 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.60 2ek4 h ARG 258 Cb 1.22 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.27 2ek4 h ARG 258 CO 0.93 0.00 -0.05 1.05 -1.07 0.00 0.00 179.97 180.83 2ek4 h GLU 259 N 0.00 0.00 0.00 0.04 4.11 -1.98 -1.80 114.58 114.94 2ek4 h GLU 259 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.51 2ek4 h GLU 259 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2ek4 h GLU 259 CO -0.00 0.05 0.00 0.44 0.07 0.00 0.00 179.01 179.57 2ek4 n ILE 260 N -3.38 0.74 0.11 -1.06 -5.35 -0.49 -1.98 119.36 107.95 2ek4 n ILE 260 Ca -0.02 0.14 0.14 0.00 -0.27 0.00 0.00 62.75 62.74 2ek4 n ILE 260 Cb 0.18 -0.92 0.65 0.00 -1.74 0.00 0.00 39.64 37.82 2ek4 n ILE 260 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 2ek4 h LEU 261 N 0.00 0.03 -8.09 7.28 3.38 -1.53 -3.33 115.31 113.05 2ek4 h LEU 261 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 2ek4 h LEU 261 Cb 0.38 -0.01 -0.13 0.00 0.09 0.00 0.00 40.66 40.99 2ek4 h LEU 261 CO 0.00 0.02 1.14 -0.13 0.09 0.00 0.00 178.44 179.56 2ek4 s ARG 262 N -5.07 3.52 0.45 1.13 0.52 -0.84 -4.96 118.95 113.71 2ek4 s ARG 262 Ca -0.05 -1.26 -0.21 0.00 -0.52 0.00 0.00 55.73 53.69 2ek4 s ARG 262 Cb 0.18 -5.01 -0.10 0.00 0.52 0.00 0.00 34.95 30.54 2ek4 s ARG 262 CO 0.71 -2.01 0.97 0.08 0.02 0.00 0.00 175.30 175.07 2ek4 s VAL 263 N 4.11 4.26 -0.84 3.52 1.01 -1.25 -5.01 120.40 126.20 2ek4 s VAL 263 Ca 0.38 1.39 -0.10 0.00 0.00 0.00 0.00 61.98 63.65 2ek4 s VAL 263 Cb -0.04 -3.57 0.22 0.00 0.00 0.00 0.00 36.38 32.99 2ek4 s VAL 263 CO -0.06 -0.32 0.75 0.20 0.00 0.00 0.00 175.10 175.67 2ek4 s ASN 264 N -2.19 6.44 0.00 3.32 0.01 -1.26 -5.16 114.94 116.10 2ek4 s ASN 264 Ca 0.63 -2.98 0.00 0.00 -0.71 0.00 0.00 52.86 49.80 2ek4 s ASN 264 Cb -0.11 -2.10 0.00 0.00 0.41 0.00 0.00 41.25 39.45 2ek4 s ASN 264 CO 0.16 -0.44 0.46 1.33 -1.51 0.00 0.00 177.10 177.09