#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ej4 s SER 2 N 0.00 6.93 -0.06 1.61 0.01 -1.26 -5.06 113.70 115.87 2ej4 s SER 2 Ca 0.00 1.98 0.00 0.00 1.31 0.00 0.00 55.95 59.24 2ej4 s SER 2 Cb 0.00 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.67 2ej4 s SER 2 CO 0.00 -0.37 -0.05 -0.55 0.41 0.00 0.00 173.24 172.68 2ej4 s SER 3 N -1.58 1.42 0.00 2.44 0.15 -1.26 -5.10 113.70 109.77 2ej4 s SER 3 Ca 0.56 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.03 2ej4 s SER 3 Cb -0.21 -0.57 0.00 0.00 -1.71 0.00 0.00 66.02 63.54 2ej4 s SER 3 CO 0.26 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2ej4 n GLY 4 N 4.41 4.60 3.78 9.45 0.00 -1.26 -5.13 105.19 121.04 2ej4 n GLY 4 Ca -0.18 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 44.74 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 0.00 6.89 0.45 1.61 0.15 -1.26 -5.05 113.70 116.48 2ej4 s SER 5 Ca 0.00 2.06 0.03 0.00 0.70 0.00 0.00 55.95 58.74 2ej4 s SER 5 Cb 0.00 -2.59 0.01 0.00 -1.71 0.00 0.00 66.02 61.72 2ej4 s SER 5 CO 0.00 -0.40 0.65 -0.55 1.20 0.00 0.00 173.24 174.14 2ej4 s SER 6 N -1.45 5.69 -0.46 5.45 0.15 -1.26 -5.09 113.70 116.74 2ej4 s SER 6 Ca 0.55 0.03 0.03 0.00 0.70 0.00 0.00 55.95 57.26 2ej4 s SER 6 Cb -0.23 -1.20 0.21 0.00 -1.71 0.00 0.00 66.02 63.08 2ej4 s SER 6 CO 0.30 -0.77 0.88 0.61 1.20 0.00 0.00 173.24 175.45 2ej4 n GLY 7 N -2.04 -0.85 3.49 9.45 0.00 -1.26 -5.15 105.19 108.84 2ej4 n GLY 7 Ca 0.04 0.66 -0.41 0.00 0.00 0.00 0.00 46.02 46.31 2ej4 n GLY 7 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ej4 n GLN 8 N 2.60 0.72 -2.26 1.61 3.00 -1.26 -4.91 117.38 116.89 2ej4 n GLN 8 Ca 0.14 0.26 -0.38 0.00 -0.01 0.00 0.00 57.00 57.02 2ej4 n GLN 8 Cb 0.60 -1.66 -0.02 0.00 0.00 0.00 0.00 30.24 29.17 2ej4 n GLN 8 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2ej4 s PRO 9 N -1.78 3.97 0.99 -1.09 0.04 -1.26 -4.97 135.00 130.90 2ej4 s PRO 9 Ca 0.64 1.86 -0.16 0.00 0.04 0.00 0.00 61.00 63.38 2ej4 s PRO 9 Cb -0.56 -2.62 -0.11 0.00 0.04 0.00 0.00 34.50 31.24 2ej4 s PRO 9 CO 0.57 -0.40 -0.57 1.51 0.04 0.00 0.00 177.00 178.15 2ej4 n ILE 10 N -0.06 0.00 -4.08 0.56 3.06 -1.26 -4.97 119.36 112.61 2ej4 n ILE 10 Ca 0.05 -0.43 -0.27 0.00 -2.50 0.00 0.00 62.75 59.60 2ej4 n ILE 10 Cb 0.46 -0.13 -0.06 0.00 0.54 0.00 0.00 39.64 40.46 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 -2.34 2.87 0.41 9.51 -2.85 -1.26 -5.13 119.74 120.96 2ej4 s LYS 11 Ca 0.43 -0.83 0.02 0.00 -1.00 0.00 0.00 55.97 54.59 2ej4 s LYS 11 Cb -0.18 -2.66 -0.01 0.00 -2.06 0.00 0.00 37.83 32.93 2ej4 s LYS 11 CO 0.80 0.51 0.61 1.14 0.10 0.00 0.00 175.35 178.50 2ej4 s GLN 12 N -2.90 3.11 -0.45 1.78 1.03 -1.26 -5.08 119.66 115.89 2ej4 s GLN 12 Ca 0.30 -0.62 0.01 0.00 0.04 0.00 0.00 55.36 55.10 2ej4 s GLN 12 Cb -0.11 -2.64 0.12 0.00 0.03 0.00 0.00 33.01 30.42 2ej4 s GLN 12 CO 0.23 -0.15 0.20 -1.83 -2.54 0.00 0.00 175.29 171.20 2ej4 s GLU 13 N -4.44 1.91 0.23 9.60 -1.05 -1.26 -4.43 118.70 119.26 2ej4 s GLU 13 Ca 0.47 -2.16 -0.06 0.00 -0.15 0.00 0.00 54.97 53.07 2ej4 s GLU 13 Cb -0.10 -3.41 0.34 0.00 -0.44 0.00 0.00 34.13 30.51 2ej4 s GLU 13 CO 0.36 -1.05 1.81 -0.07 0.95 0.00 0.00 175.26 177.26 2ej4 h LEU 14 N 7.35 0.63 -0.62 1.83 3.38 -1.84 -3.47 115.31 122.57 2ej4 h LEU 14 Ca -0.07 0.04 0.28 0.00 0.09 0.00 0.00 57.88 58.22 2ej4 h LEU 14 Cb 0.98 -0.08 -0.16 0.00 0.09 0.00 0.00 40.66 41.49 2ej4 h LEU 14 CO 0.64 0.38 -1.19 -0.24 0.09 0.00 0.00 178.44 178.12 2ej4 n SER 15 N -4.75 -7.62 -3.91 -0.43 2.88 -1.26 -4.84 113.62 93.68 2ej4 n SER 15 Ca 0.12 1.48 -0.30 0.00 -1.33 0.00 0.00 58.87 58.83 2ej4 n SER 15 Cb 0.23 -4.80 -0.14 0.00 -0.75 0.00 0.00 64.21 58.75 2ej4 n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ej4 n LYS 17 N 3.69 2.83 -3.21 0.00 4.76 -1.26 -3.29 118.16 121.68 2ej4 n LYS 17 Ca 0.05 -1.61 -0.46 0.00 -2.87 0.00 0.00 58.31 53.42 2ej4 n LYS 17 Cb 0.36 -2.42 -0.02 0.00 -1.84 0.00 0.00 35.03 31.11 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 1.77 3.52 -0.95 2.13 -0.11 -1.26 -2.98 118.94 121.05 2ej4 s TRP 18 Ca 0.66 -1.73 -0.24 0.00 1.22 0.00 0.00 56.10 56.00 2ej4 s TRP 18 Cb 0.23 -3.95 0.05 0.00 -1.50 0.00 0.00 33.47 28.29 2ej4 s TRP 18 CO -0.03 -1.14 1.41 0.42 -4.62 0.00 0.00 176.95 172.98 2ej4 s ILE 19 N 1.06 3.88 1.22 5.86 1.01 -1.26 -0.09 121.20 132.88 2ej4 s ILE 19 Ca 0.21 -0.49 -0.18 0.00 0.00 0.00 0.00 60.65 60.18 2ej4 s ILE 19 Cb -0.11 -5.03 0.27 0.00 0.01 0.00 0.00 42.46 37.61 2ej4 s ILE 19 CO -0.08 -1.92 0.60 -0.67 0.00 0.00 0.00 174.94 172.88 2ej4 n ASP 20 N 9.00 -3.46 -4.10 3.58 2.03 -1.25 -4.47 116.55 117.87 2ej4 n ASP 20 Ca 0.26 -0.59 -0.27 0.00 0.52 0.00 0.00 54.79 54.71 2ej4 n ASP 20 Cb 0.51 -0.90 -0.17 0.00 -0.72 0.00 0.00 41.12 39.84 2ej4 n ASP 20 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2ej4 s GLU 21 N -4.21 2.17 0.00 -0.67 2.12 -1.26 -4.67 118.70 112.18 2ej4 s GLU 21 Ca 0.51 -0.59 0.00 0.00 0.36 0.00 0.00 54.97 55.26 2ej4 s GLU 21 Cb -0.10 -1.72 0.00 0.00 0.26 0.00 0.00 34.13 32.57 2ej4 s GLU 21 CO 0.45 0.09 0.00 0.00 -0.54 0.00 0.00 175.26 175.27 2ej4 n ALA 22 N 3.67 0.00 -1.07 6.30 0.00 -1.26 -4.93 120.51 123.22 2ej4 n ALA 22 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.87 2ej4 n ALA 22 Cb 0.52 -0.42 -0.02 0.00 0.00 0.00 0.00 19.45 19.53 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 -2.00 0.00 -0.32 0.00 10.64 -1.26 -4.71 117.38 119.74 2ej4 n GLN 23 Ca 0.00 0.00 0.14 0.00 -1.83 0.00 0.00 57.00 55.31 2ej4 n GLN 23 Cb 0.00 -0.78 0.27 0.00 -0.86 0.00 0.00 30.24 28.86 2ej4 n GLN 23 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2ej4 n LEU 24 N 1.65 -0.11 -4.89 2.61 4.32 -1.26 -4.35 117.00 114.97 2ej4 n LEU 24 Ca 0.12 1.55 -0.29 0.00 -0.02 0.00 0.00 56.01 57.37 2ej4 n LEU 24 Cb 0.23 -0.56 -0.01 0.00 -1.62 0.00 0.00 43.42 41.46 2ej4 n LEU 24 CO 0.44 -1.57 0.50 -0.44 -1.22 0.00 0.00 177.39 175.10 2ej4 s SER 25 N -5.00 6.35 0.15 -1.43 0.01 -1.26 -5.10 113.70 107.42 2ej4 s SER 25 Ca -0.12 1.11 -0.16 0.00 1.31 0.00 0.00 55.95 58.09 2ej4 s SER 25 Cb 0.27 -2.32 0.03 0.00 0.21 0.00 0.00 66.02 64.20 2ej4 s SER 25 CO 0.71 -0.58 0.44 -0.13 0.41 0.00 0.00 173.24 174.09 2ej4 s ARG 26 N -4.51 1.18 0.89 12.44 1.81 -1.26 -4.45 118.95 125.04 2ej4 s ARG 26 Ca 0.50 -0.78 -0.11 0.00 -1.72 0.00 0.00 55.73 53.62 2ej4 s ARG 26 Cb -0.10 0.48 0.13 0.00 -0.45 0.00 0.00 34.95 35.01 2ej4 s ARG 26 CO 0.42 -0.47 1.09 -1.25 -0.68 0.00 0.00 175.30 174.40 2ej4 s PRO 27 N -3.83 1.27 -0.93 3.54 0.04 -1.26 -4.94 135.00 128.89 2ej4 s PRO 27 Ca 0.06 0.83 -0.15 0.00 0.04 0.00 0.00 61.00 61.78 2ej4 s PRO 27 Cb 0.01 -1.81 -0.28 0.00 0.04 0.00 0.00 34.50 32.46 2ej4 s PRO 27 CO -0.08 -2.23 2.14 1.63 0.04 0.00 0.00 177.00 178.50 2ej4 n LYS 28 N -3.88 0.00 -3.00 4.56 5.02 -1.26 -4.85 118.16 114.75 2ej4 n LYS 28 Ca 0.07 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.15 2ej4 n LYS 28 Cb 0.55 -1.07 0.01 0.00 -0.02 0.00 0.00 35.03 34.51 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 7.04 2.92 0.45 1.97 -2.85 -1.26 -4.95 119.74 123.07 2ej4 s LYS 29 Ca 1.23 -0.73 -0.24 0.00 -1.00 0.00 0.00 55.97 55.23 2ej4 s LYS 29 Cb -0.90 -2.61 -0.07 0.00 -2.06 0.00 0.00 37.83 32.18 2ej4 s LYS 29 CO 0.50 -0.32 1.22 -1.54 0.10 0.00 0.00 175.35 175.31 2ej4 s SER 30 N -4.27 6.11 0.25 0.03 1.04 -1.26 -3.95 113.70 111.65 2ej4 s SER 30 Ca 0.50 2.43 -0.08 0.00 0.48 0.00 0.00 55.95 59.29 2ej4 s SER 30 Cb -0.10 -2.61 0.42 0.00 0.10 0.00 0.00 66.02 63.83 2ej4 s SER 30 CO 0.36 -0.97 1.60 0.00 0.98 0.00 0.00 173.24 175.21 2ej4 n ASP 32 N -5.49 -1.71 -3.67 0.00 -0.08 -1.21 -5.00 116.55 99.39 2ej4 n ASP 32 Ca 0.14 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.44 2ej4 n ASP 32 Cb 0.47 -0.86 0.00 0.00 2.34 0.00 0.00 41.12 43.08 2ej4 n ASP 32 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2ej4 s ARG 33 N -2.65 0.42 -0.22 -0.67 1.81 -1.26 -4.90 118.95 111.48 2ej4 s ARG 33 Ca 0.00 -0.25 -0.04 0.00 -1.72 0.00 0.00 55.73 53.71 2ej4 s ARG 33 Cb 0.00 0.13 0.11 0.00 -0.45 0.00 0.00 34.95 34.75 2ej4 s ARG 33 CO 0.00 -0.20 0.39 0.95 -0.68 0.00 0.00 175.30 175.76 2ej4 s THR 34 N -2.28 -0.61 0.33 0.02 -4.23 -1.26 -4.05 115.64 103.56 2ej4 s THR 34 Ca 0.19 0.04 0.09 0.00 -1.18 0.00 0.00 61.69 60.84 2ej4 s THR 34 Cb 0.03 -0.74 -0.06 0.00 1.34 0.00 0.00 72.50 73.07 2ej4 s THR 34 CO -0.03 -0.03 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.56 2ej4 s PHE 35 N 2.57 2.36 -0.04 3.99 0.40 -1.26 -4.91 117.98 121.09 2ej4 s PHE 35 Ca 0.07 -0.50 0.03 0.00 -0.60 0.00 0.00 56.93 55.92 2ej4 s PHE 35 Cb -0.14 -1.33 -0.04 0.00 0.51 0.00 0.00 43.02 42.02 2ej4 s PHE 35 CO -0.14 0.57 0.00 0.45 0.70 0.00 0.00 175.22 176.80 2ej4 n SER 36 N -0.76 4.06 -4.79 1.36 2.88 -1.26 -2.62 113.62 112.49 2ej4 n SER 36 Ca -0.05 -0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.13 2ej4 n SER 36 Cb 0.63 0.47 -0.08 0.00 -0.75 0.00 0.00 64.21 64.49 2ej4 n SER 36 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2ej4 s THR 37 N -2.08 4.94 0.49 2.46 -4.23 -1.26 -4.79 115.64 111.16 2ej4 s THR 37 Ca -0.02 -0.03 0.27 0.00 -1.18 0.00 0.00 61.69 60.73 2ej4 s THR 37 Cb 0.01 -3.13 0.31 0.00 1.34 0.00 0.00 72.50 71.03 2ej4 s THR 37 CO 0.14 0.60 2.14 -0.03 -0.54 0.00 0.00 174.62 176.92 2ej4 h MET 38 N 5.00 0.00 -0.43 3.99 4.05 -2.00 -2.37 114.93 123.18 2ej4 h MET 38 Ca -0.53 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 58.81 2ej4 h MET 38 Cb 1.21 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.00 2ej4 h MET 38 CO 0.57 0.08 -0.05 1.25 0.23 0.00 0.00 176.91 178.98 2ej4 h HIS 39 N 0.00 0.89 0.42 1.39 -0.00 -1.99 -2.97 115.15 112.88 2ej4 h HIS 39 Ca -0.00 -0.17 -0.02 0.00 -0.00 0.00 0.00 60.37 60.18 2ej4 h HIS 39 Cb 0.20 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 27.37 2ej4 h HIS 39 CO 0.00 0.88 -0.33 0.93 -0.00 0.00 0.00 177.93 179.41 2ej4 h GLU 40 N 0.63 -0.70 -0.75 5.26 4.39 -1.83 0.13 114.58 121.71 2ej4 h GLU 40 Ca 0.12 0.05 0.07 0.00 0.34 0.00 0.00 59.36 59.94 2ej4 h GLU 40 Cb 0.57 0.16 -0.10 0.00 -0.10 0.00 0.00 28.75 29.27 2ej4 h GLU 40 CO 0.03 -0.47 -0.57 1.25 -1.16 0.00 0.00 179.01 178.09 2ej4 h LEU 41 N -0.73 -2.02 -1.41 1.33 5.85 -1.62 1.84 115.31 118.55 2ej4 h LEU 41 Ca -0.06 0.29 0.11 0.00 0.84 0.00 0.00 57.88 59.06 2ej4 h LEU 41 Cb 0.61 0.87 -0.05 0.00 0.37 0.00 0.00 40.66 42.46 2ej4 h LEU 41 CO 0.01 -0.30 0.51 0.58 -0.34 0.00 0.00 178.44 178.89 2ej4 h VAL 42 N -0.17 0.91 0.00 1.05 2.07 -1.46 0.15 116.25 118.80 2ej4 h VAL 42 Ca 0.13 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2ej4 h VAL 42 Cb 0.49 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2ej4 h VAL 42 CO -0.80 0.12 -0.12 0.74 0.02 0.00 0.00 177.57 177.54 2ej4 h THR 43 N 0.65 0.00 0.05 2.57 2.02 0.28 -3.22 112.91 115.25 2ej4 h THR 43 Ca 0.36 -0.66 -0.00 0.00 0.77 0.00 0.00 66.41 66.88 2ej4 h THR 43 Cb 0.53 1.59 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 2ej4 h THR 43 CO -0.14 0.00 -0.02 -0.74 0.37 0.00 0.00 175.52 174.99 2ej4 h HIS 44 N 0.00 -0.06 0.00 3.16 6.17 0.54 -3.23 115.15 121.73 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 0.83 0.02 0.00 0.00 2.52 0.00 0.00 27.41 30.78 2ej4 h HIS 44 CO 0.00 -0.04 0.16 0.28 0.71 0.00 0.00 177.93 179.05 2ej4 n VAL 45 N -2.81 0.90 0.13 5.26 0.31 -0.86 0.41 118.33 121.67 2ej4 n VAL 45 Ca -0.01 0.71 -0.06 0.00 -0.01 0.00 0.00 64.34 64.97 2ej4 n VAL 45 Cb 0.03 -1.71 -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 0.03 2.52 2.02 -1.62 0.22 112.91 116.09 2ej4 h THR 46 Ca 0.00 -0.33 -0.33 0.00 0.77 0.00 0.00 66.41 66.52 2ej4 h THR 46 Cb 0.33 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.70 2ej4 h THR 46 CO 0.00 0.00 -1.85 1.15 0.37 0.00 0.00 175.52 175.19 2ej4 n MET 47 N -3.92 0.63 -0.35 6.66 0.00 -0.97 0.14 117.12 119.31 2ej4 n MET 47 Ca -0.05 0.38 0.13 0.00 0.00 0.00 0.00 57.70 58.17 2ej4 n MET 47 Cb 0.15 -1.66 0.32 0.00 0.00 0.00 0.00 33.22 32.03 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 -0.61 0.74 0.00 3.17 4.39 -0.26 -2.11 114.58 119.91 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 1.63 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 30.11 2ej4 h GLU 48 CO -0.16 0.49 0.00 0.72 -1.16 0.00 0.00 179.01 178.90 2ej4 n HIS 49 N -4.75 0.00 -0.47 4.33 8.25 -1.19 -4.71 115.22 116.69 2ej4 n HIS 49 Ca 0.23 0.00 0.41 0.00 -0.26 0.00 0.00 57.72 58.10 2ej4 n HIS 49 Cb 0.57 0.00 0.75 0.00 1.12 0.00 0.00 29.99 32.43 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 0.25 -3.20 1.59 2.07 -0.27 -3.47 116.25 113.22 2ej4 h VAL 50 Ca 0.00 -0.01 0.36 0.00 0.82 0.00 0.00 66.70 67.87 2ej4 h VAL 50 Cb 0.00 0.21 -0.13 0.00 -1.52 0.00 0.00 31.29 29.84 2ej4 h VAL 50 CO 0.00 0.01 -0.81 0.61 0.02 0.00 0.00 177.57 177.40 2ej4 n GLY 51 N -1.78 -2.51 0.00 2.17 0.00 0.38 -4.83 105.19 98.63 2ej4 n GLY 51 Ca 0.33 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 -4.21 -1.19 0.00 -0.02 0.00 -1.26 -4.64 105.19 93.87 2ej4 n GLY 52 Ca -0.03 -1.59 0.08 0.00 0.00 0.00 0.00 46.02 44.48 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 -0.35 0.45 -1.01 1.61 -0.04 -1.26 -2.57 135.00 131.83 2ej4 n PRO 53 Ca 0.00 0.02 -0.13 0.00 -0.04 0.00 0.00 63.50 63.35 2ej4 n PRO 53 Cb 0.00 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.17 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 -1.04 2.30 -4.07 0.54 -0.58 -1.26 -4.98 120.64 111.55 2ej4 n GLU 54 Ca 0.11 -3.08 -0.25 0.00 -0.42 0.00 0.00 57.16 53.52 2ej4 n GLU 54 Cb 0.06 -2.03 -0.05 0.00 -0.57 0.00 0.00 31.44 28.85 2ej4 n GLU 54 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2ej4 s GLN 55 N -3.23 2.98 -0.33 3.49 -0.44 -1.06 -5.10 119.66 115.98 2ej4 s GLN 55 Ca 0.51 -0.90 -0.04 0.00 -2.50 0.00 0.00 55.36 52.44 2ej4 s GLN 55 Cb 0.44 -2.66 0.05 0.00 -1.64 0.00 0.00 33.01 29.20 2ej4 s GLN 55 CO 0.07 0.46 0.08 1.21 0.50 0.00 0.00 175.29 177.60 2ej4 s ASN 56 N -3.38 5.14 0.01 6.67 2.47 -1.26 -4.91 114.94 119.68 2ej4 s ASN 56 Ca 0.32 -1.30 0.00 0.00 0.42 0.00 0.00 52.86 52.30 2ej4 s ASN 56 Cb -0.09 -1.80 0.00 0.00 -1.45 0.00 0.00 41.25 37.90 2ej4 s ASN 56 CO 0.25 -0.33 0.00 -3.20 -3.72 0.00 0.00 177.10 170.10 2ej4 n ASN 57 N 4.71 -2.84 -4.19 -4.21 4.05 -1.26 -5.02 115.26 106.51 2ej4 n ASN 57 Ca -0.12 0.19 -0.35 0.00 0.45 0.00 0.00 54.58 54.76 2ej4 n ASN 57 Cb 0.44 -1.47 -0.14 0.00 1.23 0.00 0.00 39.78 39.84 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 -0.06 3.24 0.07 1.20 3.76 -1.26 -5.05 115.29 117.18 2ej4 s HIS 58 Ca 0.00 -1.78 0.06 0.00 -0.15 0.00 0.00 55.06 53.19 2ej4 s HIS 58 Cb 0.00 -2.12 -0.03 0.00 1.11 0.00 0.00 32.58 31.55 2ej4 s HIS 58 CO 0.00 -0.78 -0.16 0.08 -0.85 0.00 0.00 174.74 173.02 2ej4 s VAL 59 N 1.28 1.32 -0.66 -0.90 1.01 -1.26 -4.34 120.40 116.85 2ej4 s VAL 59 Ca -0.04 -1.28 -0.23 0.00 0.00 0.00 0.00 61.98 60.43 2ej4 s VAL 59 Cb -0.19 -1.21 0.06 0.00 0.00 0.00 0.00 36.38 35.03 2ej4 s VAL 59 CO -0.01 -0.08 1.01 0.00 0.00 0.00 0.00 175.10 176.02 2ej4 s TYR 61 N 4.31 3.37 0.17 0.00 2.02 -1.26 -3.98 117.35 121.98 2ej4 s TYR 61 Ca 0.25 0.44 -0.23 0.00 -0.37 0.00 0.00 57.07 57.16 2ej4 s TYR 61 Cb -0.15 -2.36 0.06 0.00 -0.40 0.00 0.00 41.96 39.12 2ej4 s TYR 61 CO 0.12 0.10 0.62 -0.46 -1.57 0.00 0.00 175.55 174.36 2ej4 s TRP 62 N 0.94 -0.48 0.12 2.71 -0.11 -1.26 -4.03 118.94 116.83 2ej4 s TRP 62 Ca 0.13 0.24 -0.12 0.00 1.22 0.00 0.00 56.10 57.57 2ej4 s TRP 62 Cb -0.13 0.58 -0.11 0.00 -1.50 0.00 0.00 33.47 32.31 2ej4 s TRP 62 CO 0.05 -0.90 1.37 1.49 -4.62 0.00 0.00 176.95 174.34 2ej4 h GLU 63 N 2.00 0.84 -2.16 5.86 4.81 -1.91 -3.36 114.58 120.66 2ej4 h GLU 63 Ca -0.32 -0.59 -0.58 0.00 -0.13 0.00 0.00 59.36 57.74 2ej4 h GLU 63 Cb 1.30 0.09 -0.41 0.00 0.63 0.00 0.00 28.75 30.36 2ej4 h GLU 63 CO 0.36 1.21 -0.76 0.39 -0.73 0.00 0.00 179.01 179.49 2ej4 n GLU 64 N -3.98 2.21 -4.38 1.92 -0.58 -1.26 -5.08 120.64 109.50 2ej4 n GLU 64 Ca -0.06 -4.33 -0.33 0.00 -0.42 0.00 0.00 57.16 52.03 2ej4 n GLU 64 Cb 0.68 -2.01 -0.10 0.00 -0.57 0.00 0.00 31.44 29.45 2ej4 n GLU 64 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ej4 h PRO 66 N 4.50 0.69 0.00 0.00 0.13 -1.96 -2.94 132.00 132.42 2ej4 h PRO 66 Ca -0.49 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 2ej4 h PRO 66 Cb 1.17 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2ej4 h PRO 66 CO 0.55 0.98 0.00 0.00 -0.23 0.00 0.00 178.00 179.30 2ej4 h ARG 67 N 0.43 0.00 -4.57 0.86 3.08 -1.92 -3.46 114.38 108.81 2ej4 h ARG 67 Ca 0.04 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.96 2ej4 h ARG 67 Cb 0.85 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.82 2ej4 h ARG 67 CO 0.07 0.00 -0.19 0.39 -1.07 0.00 0.00 179.97 179.17 2ej4 n GLU 68 N -2.33 -1.99 0.00 0.04 1.02 -1.11 0.78 120.64 117.05 2ej4 n GLU 68 Ca 0.02 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2ej4 n GLU 68 Cb 0.27 -3.36 0.00 0.00 -0.02 0.00 0.00 31.44 28.33 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 -0.53 3.79 2.43 0.62 0.00 -1.26 -5.07 105.19 105.18 2ej4 n GLY 69 Ca 0.03 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 2ej4 n GLY 69 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ej4 n LYS 70 N 0.00 0.00 0.00 1.61 5.02 0.23 -4.31 118.16 120.71 2ej4 n LYS 70 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2ej4 n LYS 70 Cb 0.00 -1.10 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 2ej4 n LYS 70 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2ej4 n SER 71 N 6.00 0.00 -2.29 4.39 3.41 -1.26 -4.65 113.62 119.22 2ej4 n SER 71 Ca 0.42 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.94 2ej4 n SER 71 Cb -0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 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 -0.30 0.01 0.87 7.33 3.01 -1.26 -5.00 117.46 122.12 2ej4 n PHE 72 Ca 0.00 -0.97 0.10 0.00 1.01 0.00 0.00 57.45 57.59 2ej4 n PHE 72 Cb 0.00 0.01 -0.12 0.00 -0.01 0.00 0.00 39.48 39.36 2ej4 n PHE 72 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2ej4 n LYS 73 N -0.33 0.28 -3.99 -1.08 4.76 -1.26 -4.96 118.16 111.59 2ej4 n LYS 73 Ca -0.02 -0.02 -0.10 0.00 -2.87 0.00 0.00 58.31 55.31 2ej4 n LYS 73 Cb 0.22 -1.47 -0.11 0.00 -1.84 0.00 0.00 35.03 31.83 2ej4 n LYS 73 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ej4 s ALA 74 N -2.98 0.18 0.08 7.82 0.00 -1.26 -5.07 121.76 120.53 2ej4 s ALA 74 Ca 0.06 -0.57 -0.34 0.00 0.00 0.00 0.00 51.96 51.12 2ej4 s ALA 74 Cb 0.15 0.12 -0.16 0.00 0.00 0.00 0.00 23.12 23.23 2ej4 s ALA 74 CO 0.84 -0.12 1.59 -0.22 0.00 0.00 0.00 175.76 177.85 2ej4 h LYS 75 N 4.76 -0.91 -0.35 0.00 3.64 -1.97 -2.92 116.57 118.82 2ej4 h LYS 75 Ca -0.32 0.06 0.07 0.00 -1.27 0.00 0.00 60.65 59.19 2ej4 h LYS 75 Cb 1.21 0.21 -0.07 0.00 -0.41 0.00 0.00 32.23 33.17 2ej4 h LYS 75 CO 0.42 -0.61 -0.10 0.10 -2.27 0.00 0.00 179.45 176.99 2ej4 h TYR 76 N -0.94 -0.22 -1.45 1.91 -0.00 -2.00 0.10 116.97 114.36 2ej4 h TYR 76 Ca -0.06 0.03 0.42 0.00 0.00 0.00 0.00 58.73 59.12 2ej4 h TYR 76 Cb 0.80 0.15 -0.06 0.00 0.00 0.00 0.00 36.73 37.63 2ej4 h TYR 76 CO -0.18 -0.17 1.27 0.87 -0.00 0.00 0.00 178.16 179.95 2ej4 h LYS 77 N -0.02 0.00 0.13 0.10 1.57 -1.94 -0.04 116.57 116.37 2ej4 h LYS 77 Ca 0.17 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2ej4 h LYS 77 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2ej4 h LYS 77 CO -0.38 0.00 -0.06 1.25 -0.57 0.00 0.00 179.45 179.69 2ej4 h LEU 78 N 0.00 -0.14 -1.81 2.94 5.85 -0.92 -3.00 115.31 118.22 2ej4 h LEU 78 Ca 0.69 0.00 0.24 0.00 0.84 0.00 0.00 57.88 59.65 2ej4 h LEU 78 Cb 3.23 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 44.26 2ej4 h LEU 78 CO -0.01 -0.02 0.74 0.58 -0.34 0.00 0.00 178.44 179.39 2ej4 h VAL 79 N -0.33 0.32 -0.10 1.05 2.07 -1.10 0.16 116.25 118.31 2ej4 h VAL 79 Ca -0.02 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 2ej4 h VAL 79 Cb 0.13 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2ej4 h VAL 79 CO 0.03 0.00 0.00 -1.13 0.02 0.00 0.00 177.57 176.49 2ej4 h ASN 80 N 0.00 0.18 0.39 0.57 -1.24 -1.31 -2.94 115.58 111.23 2ej4 h ASN 80 Ca 0.39 -0.30 -0.12 0.00 0.71 0.00 0.00 56.30 56.98 2ej4 h ASN 80 Cb 1.87 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 40.86 2ej4 h ASN 80 CO -0.00 0.43 -0.51 -0.74 -1.29 0.00 0.00 177.43 175.32 2ej4 h HIS 81 N -0.08 0.17 -0.91 0.67 2.76 -0.59 -3.08 115.15 114.09 2ej4 h HIS 81 Ca 0.03 -0.06 0.07 0.00 -2.20 0.00 0.00 60.37 58.22 2ej4 h HIS 81 Cb 0.34 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 29.20 2ej4 h HIS 81 CO 0.03 0.62 0.56 0.82 -1.30 0.00 0.00 177.93 178.67 2ej4 h ILE 82 N 0.11 1.02 -0.70 6.26 2.04 -1.14 -2.33 117.51 122.76 2ej4 h ILE 82 Ca 0.00 -0.34 0.15 0.00 1.00 0.00 0.00 64.86 65.67 2ej4 h ILE 82 Cb 0.95 -0.07 -0.13 0.00 -0.74 0.00 0.00 36.82 36.83 2ej4 h ILE 82 CO 0.07 0.18 -0.09 0.03 0.00 0.00 0.00 178.15 178.35 2ej4 h ARG 83 N 1.00 0.04 -1.07 2.37 3.08 -1.43 0.61 114.38 118.99 2ej4 h ARG 83 Ca 0.41 -0.00 0.31 0.00 0.07 0.00 0.00 59.98 60.76 2ej4 h ARG 83 Cb 0.23 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 2ej4 h ARG 83 CO -0.19 0.03 0.84 -0.24 -1.07 0.00 0.00 179.97 179.34 2ej4 h VAL 84 N 0.05 0.35 0.00 2.04 3.04 -1.58 -0.22 116.25 119.93 2ej4 h VAL 84 Ca 0.36 0.00 -0.13 0.00 -1.01 0.00 0.00 66.70 65.92 2ej4 h VAL 84 Cb 0.59 0.39 -0.02 0.00 -2.01 0.00 0.00 31.29 30.24 2ej4 h VAL 84 CO -0.67 0.00 -0.83 0.45 -1.01 0.00 0.00 177.57 175.51 2ej4 h HIS 85 N 0.00 0.00 -1.08 3.17 3.86 0.06 -3.35 115.15 117.81 2ej4 h HIS 85 Ca 0.51 0.00 0.31 0.00 -1.16 0.00 0.00 60.37 60.03 2ej4 h HIS 85 Cb 2.19 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 30.61 2ej4 h HIS 85 CO 0.00 0.98 0.77 1.79 0.86 0.00 0.00 177.93 182.33 2ej4 h THR 86 N -1.00 0.46 0.00 2.45 1.35 -0.10 -3.44 112.91 112.63 2ej4 h THR 86 Ca -0.20 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 2ej4 h THR 86 Cb 0.99 0.45 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 2ej4 h THR 86 CO -0.12 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.76 2ej4 n GLY 87 N -1.74 0.74 0.00 5.82 0.00 -0.20 -4.98 105.19 104.82 2ej4 n GLY 87 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.15 1.56 -0.89 1.61 2.13 -1.22 -5.05 120.64 116.63 2ej4 n GLU 88 Ca 0.00 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.70 2ej4 n GLU 88 Cb 0.00 0.00 0.08 0.00 0.27 0.00 0.00 31.44 31.79 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 -0.46 -1.83 5.31 5.02 -1.26 -4.84 118.16 120.10 2ej4 n LYS 89 Ca 0.00 -0.92 -0.23 0.00 -2.02 0.00 0.00 58.31 55.14 2ej4 n LYS 89 Cb 0.00 -0.56 0.15 0.00 -0.02 0.00 0.00 35.03 34.60 2ej4 n LYS 89 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ej4 n SER 90 N -3.32 0.47 -4.90 4.39 2.88 -1.26 -4.67 113.62 107.19 2ej4 n SER 90 Ca 0.07 -1.60 -0.33 0.00 -1.33 0.00 0.00 58.87 55.68 2ej4 n SER 90 Cb 0.25 -0.74 -0.05 0.00 -0.75 0.00 0.00 64.21 62.92 2ej4 n SER 90 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ej4 s GLY 91 N -5.16 2.21 0.31 0.46 0.00 -1.26 -5.08 107.32 98.80 2ej4 s GLY 91 Ca 0.61 -0.71 -0.29 0.00 0.00 0.00 0.00 44.72 44.32 2ej4 s GLY 91 CO 0.42 -0.61 1.23 2.56 0.00 0.00 0.00 173.10 176.69 2ej4 s PRO 92 N -2.15 4.45 -0.49 2.90 0.04 -1.26 -4.11 135.00 134.39 2ej4 s PRO 92 Ca 0.31 2.05 -0.32 0.00 0.04 0.00 0.00 61.00 63.08 2ej4 s PRO 92 Cb -0.13 -3.10 0.05 0.00 0.04 0.00 0.00 34.50 31.36 2ej4 s PRO 92 CO 0.21 -0.04 0.63 0.43 0.04 0.00 0.00 177.00 178.27 2ej4 n SER 93 N 0.92 -5.13 -4.70 6.66 7.64 -1.26 -4.85 113.62 112.90 2ej4 n SER 93 Ca -0.00 -0.29 -0.42 0.00 1.01 0.00 0.00 58.87 59.17 2ej4 n SER 93 Cb 0.43 -1.52 -0.03 0.00 -1.01 0.00 0.00 64.21 62.08 2ej4 n SER 93 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2ej4 s SER 94 N -1.63 7.31 0.00 6.43 0.15 -1.26 -5.16 113.70 119.55 2ej4 s SER 94 Ca 0.32 1.60 0.23 0.00 0.70 0.00 0.00 55.95 58.79 2ej4 s SER 94 Cb -0.03 -2.56 0.18 0.00 -1.71 0.00 0.00 66.02 61.90 2ej4 s SER 94 CO 0.85 -0.32 1.22 0.61 1.20 0.00 0.00 173.24 176.79