#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ej4 n SER 2 N 0.00 2.16 -4.94 1.61 2.88 -1.26 -5.15 113.62 108.93 2ej4 n SER 2 Ca 0.00 -1.73 -0.25 0.00 -1.33 0.00 0.00 58.87 55.56 2ej4 n SER 2 Cb 0.00 0.07 0.04 0.00 -0.75 0.00 0.00 64.21 63.57 2ej4 n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2ej4 s SER 3 N -2.03 5.39 -0.02 -3.46 1.04 -1.26 -5.02 113.70 108.33 2ej4 s SER 3 Ca 0.04 0.45 0.17 0.00 0.48 0.00 0.00 55.95 57.08 2ej4 s SER 3 Cb -0.00 -1.38 -0.25 0.00 0.10 0.00 0.00 66.02 64.49 2ej4 s SER 3 CO 0.03 -1.15 0.41 0.61 0.98 0.00 0.00 173.24 174.12 2ej4 n GLY 4 N -2.54 -0.73 2.78 7.32 0.00 -1.26 -4.88 105.19 105.89 2ej4 n GLY 4 Ca 0.05 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.51 2ej4 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ej4 s SER 5 N -3.72 1.47 -0.30 1.61 0.15 -1.26 -5.11 113.70 106.53 2ej4 s SER 5 Ca -0.04 -0.65 -0.13 0.00 0.70 0.00 0.00 55.95 55.83 2ej4 s SER 5 Cb 0.11 0.59 0.15 0.00 -1.71 0.00 0.00 66.02 65.15 2ej4 s SER 5 CO 0.69 -0.38 0.83 -0.55 1.20 0.00 0.00 173.24 175.03 2ej4 s SER 6 N 2.39 -0.84 0.00 5.45 0.15 -1.26 -5.11 113.70 114.47 2ej4 s SER 6 Ca 0.09 1.17 0.00 0.00 0.70 0.00 0.00 55.95 57.91 2ej4 s SER 6 Cb -0.14 1.92 0.00 0.00 -1.71 0.00 0.00 66.02 66.09 2ej4 s SER 6 CO -0.31 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.58 2ej4 n GLY 7 N 5.10 0.35 3.75 9.45 0.00 -1.26 -5.04 105.19 117.55 2ej4 n GLY 7 Ca -0.11 -1.25 -0.37 0.00 0.00 0.00 0.00 46.02 44.29 2ej4 n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ej4 s GLN 8 N 0.00 3.05 0.12 1.61 -1.52 -1.26 -4.94 119.66 116.72 2ej4 s GLN 8 Ca 0.00 2.06 -0.31 0.00 -1.95 0.00 0.00 55.36 55.17 2ej4 s GLN 8 Cb 0.00 -2.12 -0.08 0.00 -0.22 0.00 0.00 33.01 30.59 2ej4 s GLN 8 CO 0.00 -1.21 1.35 -1.25 -0.25 0.00 0.00 175.29 173.94 2ej4 s PRO 9 N -3.07 4.34 0.86 2.91 0.04 -1.26 -4.97 135.00 133.85 2ej4 s PRO 9 Ca 0.74 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 63.66 2ej4 s PRO 9 Cb -0.36 -3.25 -0.08 0.00 0.04 0.00 0.00 34.50 30.85 2ej4 s PRO 9 CO 0.42 -0.38 -0.10 1.51 0.04 0.00 0.00 177.00 178.48 2ej4 n ILE 10 N 3.70 0.40 -0.58 0.56 3.06 -1.26 -4.91 119.36 120.33 2ej4 n ILE 10 Ca 0.10 -0.40 -0.29 0.00 -2.50 0.00 0.00 62.75 59.67 2ej4 n ILE 10 Cb 0.43 -0.33 0.24 0.00 0.54 0.00 0.00 39.64 40.52 2ej4 n ILE 10 CO 0.00 0.00 0.00 -1.59 -2.50 0.00 0.00 176.55 172.46 2ej4 s LYS 11 N -2.46 -0.67 0.93 9.51 -2.85 -1.26 -5.01 119.74 117.94 2ej4 s LYS 11 Ca 0.52 0.93 -0.13 0.00 -1.00 0.00 0.00 55.97 56.29 2ej4 s LYS 11 Cb -0.27 -1.58 0.15 0.00 -2.06 0.00 0.00 37.83 34.07 2ej4 s LYS 11 CO 0.71 -3.58 1.15 1.14 0.10 0.00 0.00 175.35 174.87 2ej4 s GLN 12 N -4.49 0.98 -0.21 1.78 -2.07 -1.26 -5.06 119.66 109.32 2ej4 s GLN 12 Ca 0.68 0.21 0.01 0.00 -1.82 0.00 0.00 55.36 54.44 2ej4 s GLN 12 Cb -0.25 -1.83 0.03 0.00 -1.09 0.00 0.00 33.01 29.88 2ej4 s GLN 12 CO 0.64 -2.29 -0.15 -1.83 -1.32 0.00 0.00 175.29 170.33 2ej4 s GLU 13 N -5.34 2.79 0.12 9.60 -1.05 -1.26 -4.78 118.70 118.78 2ej4 s GLU 13 Ca 0.65 -0.98 -0.30 0.00 -0.15 0.00 0.00 54.97 54.19 2ej4 s GLU 13 Cb -0.13 -2.72 -0.06 0.00 -0.44 0.00 0.00 34.13 30.77 2ej4 s GLU 13 CO 0.53 -0.33 1.00 -0.51 0.95 0.00 0.00 175.26 176.91 2ej4 s LEU 14 N 1.25 4.49 0.03 1.83 1.43 -0.62 -4.84 118.68 122.26 2ej4 s LEU 14 Ca 0.01 1.87 0.06 0.00 -1.03 0.00 0.00 54.13 55.05 2ej4 s LEU 14 Cb -0.15 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.44 2ej4 s LEU 14 CO -0.10 -0.12 -0.17 -0.44 0.23 0.00 0.00 176.35 175.76 2ej4 s SER 15 N 0.02 3.86 -0.77 2.29 0.01 -1.26 -0.89 113.70 116.96 2ej4 s SER 15 Ca 0.48 -0.38 -0.16 0.00 1.31 0.00 0.00 55.95 57.21 2ej4 s SER 15 Cb -0.25 -0.67 0.18 0.00 0.21 0.00 0.00 66.02 65.49 2ej4 s SER 15 CO 0.31 0.27 0.77 0.00 0.41 0.00 0.00 173.24 175.00 2ej4 n LYS 17 N 4.81 3.12 -3.27 0.00 4.76 -1.26 -1.97 118.16 124.36 2ej4 n LYS 17 Ca 0.08 -1.87 -0.46 0.00 -2.87 0.00 0.00 58.31 53.20 2ej4 n LYS 17 Cb 0.46 -2.61 -0.05 0.00 -1.84 0.00 0.00 35.03 30.99 2ej4 n LYS 17 CO 0.00 0.00 0.00 -0.46 -1.37 0.00 0.00 177.40 175.57 2ej4 s TRP 18 N 2.25 3.24 -1.01 2.13 -0.11 -1.26 -2.94 118.94 121.24 2ej4 s TRP 18 Ca 0.63 -1.29 -0.17 0.00 1.22 0.00 0.00 56.10 56.50 2ej4 s TRP 18 Cb 0.18 -3.84 0.15 0.00 -1.50 0.00 0.00 33.47 28.46 2ej4 s TRP 18 CO -0.05 -1.07 1.20 0.42 -4.62 0.00 0.00 176.95 172.83 2ej4 s ILE 19 N 1.69 4.92 0.00 5.86 1.01 -1.18 -0.77 121.20 132.73 2ej4 s ILE 19 Ca 0.06 -2.02 0.00 0.00 0.00 0.00 0.00 60.65 58.69 2ej4 s ILE 19 Cb -0.27 -4.79 0.00 0.00 0.01 0.00 0.00 42.46 37.40 2ej4 s ILE 19 CO 0.03 -1.50 0.00 -0.67 0.00 0.00 0.00 174.94 172.79 2ej4 n ASP 20 N 5.99 0.00 0.08 3.58 -0.08 -1.26 -4.49 116.55 120.36 2ej4 n ASP 20 Ca 0.27 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.55 2ej4 n ASP 20 Cb 0.47 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.93 2ej4 n ASP 20 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2ej4 n GLU 21 N 0.00 0.00 0.00 -0.67 2.13 -1.26 -4.81 120.64 116.03 2ej4 n GLU 21 Ca 0.00 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.90 2ej4 n GLU 21 Cb 0.00 0.00 0.47 0.00 0.27 0.00 0.00 31.44 32.18 2ej4 n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2ej4 n ALA 22 N -2.97 2.46 -1.34 4.31 0.00 -1.26 -4.85 120.51 116.86 2ej4 n ALA 22 Ca 0.00 -0.10 -0.36 0.00 0.00 0.00 0.00 53.44 52.98 2ej4 n ALA 22 Cb 0.00 -1.25 0.07 0.00 0.00 0.00 0.00 19.45 18.27 2ej4 n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ej4 n GLN 23 N -0.78 0.43 0.05 0.00 10.64 -1.26 -4.92 117.38 121.54 2ej4 n GLN 23 Ca 0.12 0.19 -0.13 0.00 -1.83 0.00 0.00 57.00 55.35 2ej4 n GLN 23 Cb 0.05 -2.00 -0.02 0.00 -0.86 0.00 0.00 30.24 27.42 2ej4 n GLN 23 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 2ej4 h LEU 24 N -0.23 0.59 -8.66 2.61 3.38 -2.01 -3.42 115.31 107.57 2ej4 h LEU 24 Ca -0.46 -0.42 -0.56 0.00 0.09 0.00 0.00 57.88 56.53 2ej4 h LEU 24 Cb 1.35 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.85 2ej4 h LEU 24 CO 0.45 1.19 0.97 -0.44 0.09 0.00 0.00 178.44 180.70 2ej4 s SER 25 N -7.04 6.52 0.30 -0.43 0.01 -1.26 -5.01 113.70 106.78 2ej4 s SER 25 Ca -0.07 0.33 0.10 0.00 1.31 0.00 0.00 55.95 57.62 2ej4 s SER 25 Cb 0.09 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.72 2ej4 s SER 25 CO 0.86 -1.38 -0.08 -0.13 0.41 0.00 0.00 173.24 172.92 2ej4 s ARG 26 N 4.75 1.97 0.95 12.44 1.81 -1.26 -4.20 118.95 135.41 2ej4 s ARG 26 Ca 0.47 -1.68 -0.12 0.00 -1.72 0.00 0.00 55.73 52.67 2ej4 s ARG 26 Cb -0.08 -1.92 0.16 0.00 -0.45 0.00 0.00 34.95 32.67 2ej4 s ARG 26 CO 0.29 0.26 1.09 -1.25 -0.68 0.00 0.00 175.30 175.02 2ej4 s PRO 27 N -3.62 0.81 -0.97 3.54 0.04 -1.26 -4.97 135.00 128.57 2ej4 s PRO 27 Ca 0.32 0.67 -0.29 0.00 0.04 0.00 0.00 61.00 61.74 2ej4 s PRO 27 Cb -0.03 -1.77 -0.22 0.00 0.04 0.00 0.00 34.50 32.52 2ej4 s PRO 27 CO 0.18 -2.51 2.64 1.63 0.04 0.00 0.00 177.00 178.98 2ej4 n LYS 28 N -4.05 0.06 -4.33 4.56 5.02 -1.26 -4.88 118.16 113.28 2ej4 n LYS 28 Ca 0.06 -0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.09 2ej4 n LYS 28 Cb 0.56 -1.59 -0.09 0.00 -0.02 0.00 0.00 35.03 33.89 2ej4 n LYS 28 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2ej4 s LYS 29 N 8.81 1.99 0.08 1.97 0.00 -1.26 -4.99 119.74 126.35 2ej4 s LYS 29 Ca 1.33 -1.41 -0.31 0.00 0.00 0.00 0.00 55.97 55.59 2ej4 s LYS 29 Cb -1.16 -2.06 -0.10 0.00 0.00 0.00 0.00 37.83 34.51 2ej4 s LYS 29 CO 0.48 0.40 1.87 -1.12 0.00 0.00 0.00 175.35 176.98 2ej4 s SER 30 N -3.10 6.44 0.37 0.03 0.01 -1.26 -4.37 113.70 111.83 2ej4 s SER 30 Ca 0.27 2.70 0.21 0.00 1.31 0.00 0.00 55.95 60.44 2ej4 s SER 30 Cb -0.08 -2.55 1.29 0.00 0.21 0.00 0.00 66.02 64.90 2ej4 s SER 30 CO 0.16 -1.02 1.61 0.00 0.41 0.00 0.00 173.24 174.40 2ej4 n ASP 32 N -5.10 -8.08 0.00 0.00 2.03 -0.83 -5.00 116.55 99.58 2ej4 n ASP 32 Ca 0.36 1.73 0.00 0.00 0.52 0.00 0.00 54.79 57.41 2ej4 n ASP 32 Cb 1.24 -4.89 0.00 0.00 -0.72 0.00 0.00 41.12 36.74 2ej4 n ASP 32 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2ej4 n ARG 33 N -2.99 -1.30 -3.58 -0.67 5.12 -1.26 -4.68 116.66 107.29 2ej4 n ARG 33 Ca -0.02 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.72 2ej4 n ARG 33 Cb 0.52 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.67 2ej4 n ARG 33 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2ej4 s THR 34 N -2.00 -0.28 -0.02 0.55 -4.23 -1.24 -4.05 115.64 104.37 2ej4 s THR 34 Ca 0.00 0.09 0.07 0.00 -1.18 0.00 0.00 61.69 60.66 2ej4 s THR 34 Cb 0.00 -0.51 -0.02 0.00 1.34 0.00 0.00 72.50 73.32 2ej4 s THR 34 CO 0.00 -0.06 -0.23 -0.36 -0.54 0.00 0.00 174.62 173.44 2ej4 s PHE 35 N 2.30 2.05 0.00 3.99 0.08 -0.07 -4.93 117.98 121.41 2ej4 s PHE 35 Ca 0.04 -0.41 0.08 0.00 0.12 0.00 0.00 56.93 56.76 2ej4 s PHE 35 Cb -0.14 -1.32 -0.23 0.00 -0.57 0.00 0.00 43.02 40.75 2ej4 s PHE 35 CO -0.09 -0.05 0.84 0.77 -0.10 0.00 0.00 175.22 176.59 2ej4 h SER 36 N 5.63 0.09 -3.55 1.36 0.02 -1.89 -1.64 113.55 113.57 2ej4 h SER 36 Ca -0.40 -0.14 -0.68 0.00 -0.84 0.00 0.00 61.79 59.73 2ej4 h SER 36 Cb 1.14 -0.03 -0.17 0.00 0.14 0.00 0.00 62.40 63.48 2ej4 h SER 36 CO 0.47 1.12 -0.68 0.42 -1.14 0.00 0.00 176.83 177.03 2ej4 s THR 37 N -2.63 3.85 0.49 -2.27 -4.23 -1.26 -4.91 115.64 104.67 2ej4 s THR 37 Ca -0.05 -0.57 0.21 0.00 -1.18 0.00 0.00 61.69 60.10 2ej4 s THR 37 Cb 0.08 -2.64 0.26 0.00 1.34 0.00 0.00 72.50 71.55 2ej4 s THR 37 CO 0.82 0.49 2.10 -0.03 -0.54 0.00 0.00 174.62 177.47 2ej4 h MET 38 N 4.83 0.00 -0.68 3.99 4.05 -2.01 -2.15 114.93 122.97 2ej4 h MET 38 Ca -0.49 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 58.89 2ej4 h MET 38 Cb 1.17 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.94 2ej4 h MET 38 CO 0.54 0.09 0.25 1.25 0.23 0.00 0.00 176.91 179.27 2ej4 h HIS 39 N 0.00 1.03 0.19 1.39 -0.00 -1.99 -3.00 115.15 112.77 2ej4 h HIS 39 Ca -0.00 -0.07 -0.01 0.00 -0.00 0.00 0.00 60.37 60.29 2ej4 h HIS 39 Cb 0.19 -0.31 -0.00 0.00 -0.00 0.00 0.00 27.41 27.29 2ej4 h HIS 39 CO 0.00 0.80 -0.15 0.93 -0.00 0.00 0.00 177.93 179.51 2ej4 h GLU 40 N 0.99 -0.31 -0.96 5.26 4.39 -1.79 0.10 114.58 122.26 2ej4 h GLU 40 Ca 0.23 0.02 0.12 0.00 0.34 0.00 0.00 59.36 60.07 2ej4 h GLU 40 Cb 0.22 0.07 -0.14 0.00 -0.10 0.00 0.00 28.75 28.80 2ej4 h GLU 40 CO -0.02 -0.21 -0.49 1.25 -1.16 0.00 0.00 179.01 178.39 2ej4 h LEU 41 N -0.32 -1.78 -1.17 1.33 5.85 -1.63 1.24 115.31 118.84 2ej4 h LEU 41 Ca -0.02 0.31 0.09 0.00 0.84 0.00 0.00 57.88 59.10 2ej4 h LEU 41 Cb 0.27 0.84 -0.06 0.00 0.37 0.00 0.00 40.66 42.08 2ej4 h LEU 41 CO 0.01 -0.27 0.59 0.58 -0.34 0.00 0.00 178.44 179.00 2ej4 h VAL 42 N -0.02 0.99 0.00 1.05 2.07 -1.45 0.14 116.25 119.03 2ej4 h VAL 42 Ca 0.25 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2ej4 h VAL 42 Cb 0.51 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2ej4 h VAL 42 CO -0.94 0.17 -0.00 0.41 0.02 0.00 0.00 177.57 177.23 2ej4 n THR 43 N -4.53 0.33 -0.02 2.57 -1.04 0.25 -3.27 114.28 108.58 2ej4 n THR 43 Ca 0.15 -0.16 -0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2ej4 n THR 43 Cb 0.28 -0.54 -0.00 0.00 -1.82 0.00 0.00 70.33 68.25 2ej4 n THR 43 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 2ej4 h HIS 44 N 0.00 0.00 0.00 -1.42 6.17 0.39 -3.30 115.15 116.99 2ej4 h HIS 44 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 2ej4 h HIS 44 Cb 0.63 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.56 2ej4 h HIS 44 CO 0.00 0.00 0.16 0.28 0.71 0.00 0.00 177.93 179.08 2ej4 n VAL 45 N -2.89 0.93 0.13 5.26 0.31 -0.75 0.38 118.33 121.70 2ej4 n VAL 45 Ca -0.00 0.70 -0.06 0.00 -0.01 0.00 0.00 64.34 64.96 2ej4 n VAL 45 Cb 0.02 -1.70 -0.03 0.00 -0.91 0.00 0.00 33.84 31.22 2ej4 n VAL 45 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2ej4 h THR 46 N 0.00 0.00 0.04 2.52 2.02 -1.66 0.22 112.91 116.04 2ej4 h THR 46 Ca 0.00 -0.32 -0.34 0.00 0.77 0.00 0.00 66.41 66.53 2ej4 h THR 46 Cb 0.32 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.69 2ej4 h THR 46 CO 0.00 0.00 -1.88 1.15 0.37 0.00 0.00 175.52 175.16 2ej4 n MET 47 N -3.91 0.64 -0.33 6.66 0.00 -0.98 0.68 117.12 119.88 2ej4 n MET 47 Ca -0.05 0.37 0.14 0.00 0.00 0.00 0.00 57.70 58.17 2ej4 n MET 47 Cb 0.15 -1.66 0.36 0.00 0.00 0.00 0.00 33.22 32.07 2ej4 n MET 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2ej4 h GLU 48 N -0.58 0.67 0.00 3.17 4.39 -0.31 -2.15 114.58 119.77 2ej4 h GLU 48 Ca -0.47 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.19 2ej4 h GLU 48 Cb 1.65 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.14 2ej4 h GLU 48 CO -0.16 0.45 0.00 0.72 -1.16 0.00 0.00 179.01 178.86 2ej4 n HIS 49 N -4.70 0.00 -0.34 4.33 8.25 -1.19 -4.70 115.22 116.86 2ej4 n HIS 49 Ca 0.23 0.00 0.36 0.00 -0.26 0.00 0.00 57.72 58.05 2ej4 n HIS 49 Cb 0.60 0.00 0.66 0.00 1.12 0.00 0.00 29.99 32.37 2ej4 n HIS 49 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2ej4 h VAL 50 N 0.00 0.13 0.00 1.59 2.07 -0.29 -3.44 116.25 116.31 2ej4 h VAL 50 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2ej4 h VAL 50 Cb 0.00 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.94 2ej4 h VAL 50 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 2ej4 n GLY 51 N -1.76 1.94 0.00 2.17 0.00 0.21 -4.73 105.19 103.02 2ej4 n GLY 51 Ca 0.28 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2ej4 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ej4 n GLY 52 N 0.00 0.79 0.00 -0.02 0.00 -1.15 -4.29 105.19 100.52 2ej4 n GLY 52 Ca 0.00 -2.06 0.07 0.00 0.00 0.00 0.00 46.02 44.04 2ej4 n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ej4 n PRO 53 N 0.00 0.26 -2.95 1.61 -0.04 -1.26 -3.42 135.00 129.19 2ej4 n PRO 53 Ca 0.00 0.12 -0.26 0.00 -0.04 0.00 0.00 63.50 63.32 2ej4 n PRO 53 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 2ej4 n PRO 53 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2ej4 n GLU 54 N -1.24 3.06 -4.29 0.54 1.02 -1.26 -5.03 120.64 113.44 2ej4 n GLU 54 Ca 0.08 -4.74 -0.17 0.00 -0.02 0.00 0.00 57.16 52.31 2ej4 n GLU 54 Cb 0.11 -2.19 -0.10 0.00 -0.02 0.00 0.00 31.44 29.23 2ej4 n GLU 54 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2ej4 s GLN 55 N -3.39 1.16 -0.32 3.49 0.74 -1.22 -5.03 119.66 115.09 2ej4 s GLN 55 Ca 0.48 -1.43 -0.03 0.00 0.05 0.00 0.00 55.36 54.43 2ej4 s GLN 55 Cb 0.29 -0.94 0.05 0.00 1.10 0.00 0.00 33.01 33.50 2ej4 s GLN 55 CO -0.14 0.16 0.04 1.21 -0.55 0.00 0.00 175.29 176.01 2ej4 s ASN 56 N -2.95 5.04 0.00 6.67 3.84 -1.26 -4.86 114.94 121.41 2ej4 s ASN 56 Ca 0.16 -1.25 0.00 0.00 0.21 0.00 0.00 52.86 51.98 2ej4 s ASN 56 Cb -0.02 -1.77 0.00 0.00 -0.55 0.00 0.00 41.25 38.92 2ej4 s ASN 56 CO 0.04 -0.29 0.00 -3.20 -2.79 0.00 0.00 177.10 170.86 2ej4 n ASN 57 N 4.68 -1.92 -4.59 -4.21 4.05 -1.26 -5.00 115.26 107.01 2ej4 n ASN 57 Ca -0.13 0.00 -0.41 0.00 0.45 0.00 0.00 54.58 54.49 2ej4 n ASN 57 Cb 0.44 -0.96 -0.07 0.00 1.23 0.00 0.00 39.78 40.42 2ej4 n ASN 57 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 2ej4 s HIS 58 N 0.00 3.20 0.03 1.20 3.76 -1.26 -4.99 115.29 117.23 2ej4 s HIS 58 Ca 0.00 0.49 0.04 0.00 -0.15 0.00 0.00 55.06 55.44 2ej4 s HIS 58 Cb 0.00 -2.97 -0.02 0.00 1.11 0.00 0.00 32.58 30.70 2ej4 s HIS 58 CO 0.00 -0.48 -0.13 0.08 -0.85 0.00 0.00 174.74 173.36 2ej4 s VAL 59 N 2.55 0.99 -0.31 -0.90 1.01 -1.26 -0.41 120.40 122.07 2ej4 s VAL 59 Ca 0.24 -0.86 -0.17 0.00 0.00 0.00 0.00 61.98 61.19 2ej4 s VAL 59 Cb -0.15 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 2ej4 s VAL 59 CO 0.12 0.03 0.45 0.00 0.00 0.00 0.00 175.10 175.71 2ej4 s TYR 61 N 2.23 3.18 0.18 0.00 2.02 -1.26 -1.87 117.35 121.83 2ej4 s TYR 61 Ca 0.17 -1.63 -0.04 0.00 -0.37 0.00 0.00 57.07 55.19 2ej4 s TYR 61 Cb -0.16 -2.12 -0.03 0.00 -0.40 0.00 0.00 41.96 39.25 2ej4 s TYR 61 CO 0.11 -0.75 0.18 -0.46 -1.57 0.00 0.00 175.55 173.07 2ej4 s TRP 62 N 1.32 0.81 0.09 2.71 -0.11 -1.26 -3.11 118.94 119.39 2ej4 s TRP 62 Ca -0.02 -1.12 0.03 0.00 1.22 0.00 0.00 56.10 56.20 2ej4 s TRP 62 Cb -0.18 -0.34 -0.24 0.00 -1.50 0.00 0.00 33.47 31.21 2ej4 s TRP 62 CO -0.01 -0.66 1.19 1.49 -4.62 0.00 0.00 176.95 174.33 2ej4 h GLU 63 N 2.63 0.11 -2.04 5.86 4.81 -1.91 -3.39 114.58 120.65 2ej4 h GLU 63 Ca -0.34 -0.19 -0.50 0.00 -0.13 0.00 0.00 59.36 58.21 2ej4 h GLU 63 Cb 1.23 0.07 -0.40 0.00 0.63 0.00 0.00 28.75 30.28 2ej4 h GLU 63 CO 0.52 1.07 -1.10 0.39 -0.73 0.00 0.00 179.01 179.15 2ej4 n GLU 64 N -3.41 1.30 -4.28 1.92 1.02 -1.26 -5.10 120.64 110.83 2ej4 n GLU 64 Ca -0.04 -3.60 -0.33 0.00 -0.02 0.00 0.00 57.16 53.17 2ej4 n GLU 64 Cb 0.98 -1.76 -0.09 0.00 -0.02 0.00 0.00 31.44 30.55 2ej4 n GLU 64 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ej4 h PRO 66 N 4.46 0.69 0.00 0.00 0.13 -1.99 -2.94 132.00 132.36 2ej4 h PRO 66 Ca -0.49 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 2ej4 h PRO 66 Cb 1.18 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2ej4 h PRO 66 CO 0.57 0.97 0.00 0.54 -0.23 0.00 0.00 178.00 179.86 2ej4 n ARG 67 N -4.28 0.21 -1.90 0.86 1.74 -1.26 -4.84 116.66 107.19 2ej4 n ARG 67 Ca -0.04 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 2ej4 n ARG 67 Cb 0.46 -1.87 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 2ej4 n ARG 67 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ej4 n GLU 68 N -2.27 -2.22 -1.10 5.56 1.02 -1.11 0.19 120.64 120.70 2ej4 n GLU 68 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2ej4 n GLU 68 Cb 0.27 -4.19 0.00 0.00 -0.02 0.00 0.00 31.44 27.50 2ej4 n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ej4 n GLY 69 N -0.31 1.06 0.00 0.62 0.00 -0.78 -4.95 105.19 100.84 2ej4 n GLY 69 Ca 0.00 -0.35 0.04 0.00 0.00 0.00 0.00 46.02 45.71 2ej4 n GLY 69 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2ej4 n LYS 70 N -0.49 0.13 0.00 1.61 4.81 0.49 -4.72 118.16 120.00 2ej4 n LYS 70 Ca 0.00 0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.63 2ej4 n LYS 70 Cb 0.24 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.79 2ej4 n LYS 70 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2ej4 n SER 71 N -1.27 0.00 0.00 3.14 3.41 -1.26 -5.00 113.62 112.64 2ej4 n SER 71 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 2ej4 n SER 71 Cb 0.07 0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2ej4 n SER 71 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2ej4 n PHE 72 N -1.48 0.00 0.00 7.33 3.01 0.46 -4.92 117.46 121.86 2ej4 n PHE 72 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2ej4 n PHE 72 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 2ej4 n PHE 72 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2ej4 n LYS 73 N -1.69 0.00 -4.04 -1.08 4.81 -1.21 -4.91 118.16 110.03 2ej4 n LYS 73 Ca 0.00 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 57.09 2ej4 n LYS 73 Cb 0.28 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.20 2ej4 n LYS 73 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ej4 s ALA 74 N -0.14 3.04 0.05 3.14 0.00 -1.26 -4.56 121.76 122.02 2ej4 s ALA 74 Ca 0.00 -1.00 -0.13 0.00 0.00 0.00 0.00 51.96 50.82 2ej4 s ALA 74 Cb 0.00 -1.79 -0.05 0.00 0.00 0.00 0.00 23.12 21.28 2ej4 s ALA 74 CO 0.00 -0.18 1.22 -0.22 0.00 0.00 0.00 175.76 176.58 2ej4 h LYS 75 N 7.55 -0.20 -1.23 0.00 3.11 -1.91 0.15 116.57 124.04 2ej4 h LYS 75 Ca -0.36 0.01 0.35 0.00 -2.81 0.00 0.00 60.65 57.85 2ej4 h LYS 75 Cb 1.18 0.05 -0.07 0.00 -1.00 0.00 0.00 32.23 32.38 2ej4 h LYS 75 CO 0.61 -0.13 0.86 0.10 -2.81 0.00 0.00 179.45 178.08 2ej4 h TYR 76 N -0.21 0.20 -0.10 1.91 -0.00 -1.96 1.01 116.97 117.83 2ej4 h TYR 76 Ca 0.02 0.01 -0.15 0.00 -0.00 0.00 0.00 58.73 58.61 2ej4 h TYR 76 Cb 0.26 -0.06 -0.01 0.00 -0.00 0.00 0.00 36.73 36.92 2ej4 h TYR 76 CO -0.56 -0.01 -0.58 0.87 -0.00 0.00 0.00 178.16 177.88 2ej4 h LYS 77 N 0.10 0.33 0.19 0.10 1.57 -1.13 -1.00 116.57 116.74 2ej4 h LYS 77 Ca 0.63 -0.22 -0.28 0.00 -1.87 0.00 0.00 60.65 58.91 2ej4 h LYS 77 Cb 2.25 0.03 0.03 0.00 0.08 0.00 0.00 32.23 34.62 2ej4 h LYS 77 CO -0.11 0.82 -1.20 1.25 -0.57 0.00 0.00 179.45 179.63 2ej4 h LEU 78 N 0.25 0.72 -1.06 2.94 5.85 0.29 -3.19 115.31 121.12 2ej4 h LEU 78 Ca -0.00 -0.91 -0.10 0.00 0.84 0.00 0.00 57.88 57.71 2ej4 h LEU 78 Cb 1.09 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 2ej4 h LEU 78 CO 0.10 1.58 -0.44 0.58 -0.34 0.00 0.00 178.44 179.91 2ej4 h VAL 79 N -0.01 1.32 -0.51 1.05 2.07 -0.83 -1.89 116.25 117.45 2ej4 h VAL 79 Ca -0.21 -1.54 -0.06 0.00 0.82 0.00 0.00 66.70 65.71 2ej4 h VAL 79 Cb 1.94 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 33.49 2ej4 h VAL 79 CO 0.23 0.45 0.08 0.78 0.02 0.00 0.00 177.57 179.12 2ej4 h ASN 80 N 0.05 0.82 0.51 0.57 4.21 -1.25 -2.94 115.58 117.55 2ej4 h ASN 80 Ca 0.00 -0.26 -0.18 0.00 1.21 0.00 0.00 56.30 57.07 2ej4 h ASN 80 Cb 0.80 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.77 2ej4 h ASN 80 CO 0.06 0.88 -0.78 -0.74 -1.29 0.00 0.00 177.43 175.56 2ej4 h HIS 81 N 0.73 0.29 -0.93 1.19 -0.00 -1.51 -3.20 115.15 111.73 2ej4 h HIS 81 Ca 0.16 -0.15 0.15 0.00 -0.00 0.00 0.00 60.37 60.53 2ej4 h HIS 81 Cb 0.41 -0.04 -0.08 0.00 -0.00 0.00 0.00 27.41 27.70 2ej4 h HIS 81 CO 0.03 0.91 0.59 0.82 -0.00 0.00 0.00 177.93 180.28 2ej4 h ILE 82 N 0.13 0.83 -0.56 6.26 2.04 -1.16 -1.60 117.51 123.44 2ej4 h ILE 82 Ca -0.03 -0.26 0.11 0.00 1.00 0.00 0.00 64.86 65.68 2ej4 h ILE 82 Cb 1.37 0.01 -0.09 0.00 -0.74 0.00 0.00 36.82 37.36 2ej4 h ILE 82 CO 0.12 0.14 -0.01 0.03 0.00 0.00 0.00 178.15 178.43 2ej4 h ARG 83 N 0.76 0.11 -1.14 2.37 3.08 -1.52 0.97 114.38 119.00 2ej4 h ARG 83 Ca 0.48 -0.01 0.33 0.00 0.07 0.00 0.00 59.98 60.85 2ej4 h ARG 83 Cb 0.71 -0.02 -0.11 0.00 0.08 0.00 0.00 29.97 30.63 2ej4 h ARG 83 CO -0.24 0.07 0.74 -0.24 -1.07 0.00 0.00 179.97 179.23 2ej4 h VAL 84 N 0.11 0.37 0.18 2.04 3.04 -1.47 -0.33 116.25 120.19 2ej4 h VAL 84 Ca 0.29 -0.09 -0.01 0.00 -1.01 0.00 0.00 66.70 65.88 2ej4 h VAL 84 Cb 0.45 0.08 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 2ej4 h VAL 84 CO -0.48 0.05 -0.08 0.45 -1.01 0.00 0.00 177.57 176.49 2ej4 h HIS 85 N 0.27 -0.22 -1.18 3.17 3.86 -0.92 -3.26 115.15 116.87 2ej4 h HIS 85 Ca 0.68 -0.01 0.34 0.00 -1.16 0.00 0.00 60.37 60.22 2ej4 h HIS 85 Cb 1.91 0.07 -0.06 0.00 1.06 0.00 0.00 27.41 30.39 2ej4 h HIS 85 CO -0.00 0.10 0.83 1.79 0.86 0.00 0.00 177.93 181.50 2ej4 h THR 86 N -0.99 0.41 0.00 2.45 1.35 -0.69 -3.44 112.91 112.00 2ej4 h THR 86 Ca -0.02 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2ej4 h THR 86 Cb 0.41 0.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.13 2ej4 h THR 86 CO 0.04 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.94 2ej4 n GLY 87 N -1.69 0.59 0.00 5.82 0.00 -0.25 -5.08 105.19 104.58 2ej4 n GLY 87 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2ej4 n GLY 87 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ej4 n GLU 88 N -2.00 2.16 -1.62 1.61 2.13 -1.20 -4.93 120.64 116.79 2ej4 n GLU 88 Ca 0.00 0.00 -0.50 0.00 0.66 0.00 0.00 57.16 57.32 2ej4 n GLU 88 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 2ej4 n GLU 88 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2ej4 n LYS 89 N 0.00 1.53 -0.85 5.31 5.02 -1.26 -4.75 118.16 123.16 2ej4 n LYS 89 Ca 0.00 0.55 -0.09 0.00 -2.02 0.00 0.00 58.31 56.75 2ej4 n LYS 89 Cb 0.00 -2.24 -0.08 0.00 -0.02 0.00 0.00 35.03 32.69 2ej4 n LYS 89 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2ej4 n SER 90 N 2.90 5.51 -3.56 4.39 7.64 -1.26 -4.43 113.62 124.82 2ej4 n SER 90 Ca 0.18 -2.58 -0.33 0.00 1.01 0.00 0.00 58.87 57.15 2ej4 n SER 90 Cb 0.23 -1.26 0.01 0.00 -1.01 0.00 0.00 64.21 62.18 2ej4 n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ej4 n GLY 91 N 1.77 -2.61 3.77 0.23 0.00 -1.26 -4.87 105.19 102.22 2ej4 n GLY 91 Ca 0.26 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2ej4 n GLY 91 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ej4 s PRO 92 N -0.84 3.34 -0.05 1.61 0.04 -1.26 -4.83 135.00 133.00 2ej4 s PRO 92 Ca 0.48 1.60 -0.27 0.00 0.04 0.00 0.00 61.00 62.86 2ej4 s PRO 92 Cb -0.44 -2.00 -0.22 0.00 0.04 0.00 0.00 34.50 31.88 2ej4 s PRO 92 CO 0.55 -0.86 1.13 0.66 0.04 0.00 0.00 177.00 178.52 2ej4 h SER 93 N 1.16 -0.00 -3.57 6.66 4.64 -1.90 -3.42 113.55 117.12 2ej4 h SER 93 Ca -0.50 -0.62 -0.70 0.00 -0.47 0.00 0.00 61.79 59.50 2ej4 h SER 93 Cb 1.26 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.16 2ej4 h SER 93 CO 0.57 0.62 -0.35 -0.94 -0.87 0.00 0.00 176.83 175.86 2ej4 s SER 94 N -5.83 6.14 0.00 4.97 1.04 -1.26 -4.84 113.70 113.92 2ej4 s SER 94 Ca -0.17 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 55.60 2ej4 s SER 94 Cb 0.00 -2.18 0.00 0.00 0.10 0.00 0.00 66.02 63.94 2ej4 s SER 94 CO 0.68 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 175.07