#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 0.96 -4.58 1.61 3.41 -1.26 -4.85 113.62 108.92 2ej4 n SER 2 Ca 0.00 0.12 -0.41 0.00 -0.26 0.00 0.00 58.87 58.32 2ej4 n SER 2 Cb 0.00 0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 2ej4 n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2ej4 s SER 3 N -6.10 5.43 0.00 4.04 0.15 -1.26 -4.70 113.70 111.26 2ej4 s SER 3 Ca -0.15 1.07 0.00 0.00 0.70 0.00 0.00 55.95 57.57 2ej4 s SER 3 Cb 0.07 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 2ej4 s SER 3 CO 0.77 -2.12 0.00 0.61 1.20 0.00 0.00 173.24 173.71 2ej4 n GLY 4 N 5.64 -0.02 3.22 9.45 0.00 -1.26 -5.15 105.19 117.06 2ej4 n GLY 4 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 2ej4 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ej4 s SER 5 N -1.27 1.45 0.23 1.61 0.01 -1.26 -5.17 113.70 109.31 2ej4 s SER 5 Ca 0.00 -1.03 0.00 0.00 1.31 0.00 0.00 55.95 56.23 2ej4 s SER 5 Cb 0.00 0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.28 2ej4 s SER 5 CO 0.00 -0.42 0.04 -1.54 0.41 0.00 0.00 173.24 171.73 2ej4 n SER 6 N -0.14 2.47 0.00 2.44 3.41 -1.26 -5.15 113.62 115.38 2ej4 n SER 6 Ca -0.11 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.53 2ej4 n SER 6 Cb 0.61 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.69 2ej4 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ej4 n GLY 7 N 2.21 2.48 3.92 5.00 0.00 -1.26 -5.17 105.19 112.37 2ej4 n GLY 7 Ca -0.08 0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 2ej4 n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ej4 s GLN 8 N 0.00 3.49 0.07 1.61 0.00 -1.26 -5.06 119.66 118.51 2ej4 s GLN 8 Ca 0.00 -0.36 -0.31 0.00 -0.00 0.00 0.00 55.36 54.69 2ej4 s GLN 8 Cb 0.00 -2.96 -0.07 0.00 0.00 0.00 0.00 33.01 29.98 2ej4 s GLN 8 CO 0.00 0.54 1.40 -1.25 0.00 0.00 0.00 175.29 175.98 2ej4 s PRO 9 N -2.70 4.31 0.76 9.60 0.04 -1.26 -4.97 135.00 140.78 2ej4 s PRO 9 Ca 0.37 2.03 -0.16 0.00 0.04 0.00 0.00 61.00 63.27 2ej4 s PRO 9 Cb -0.12 -3.39 -0.07 0.00 0.04 0.00 0.00 34.50 30.95 2ej4 s PRO 9 CO 0.27 -0.49 0.13 1.51 0.04 0.00 0.00 177.00 178.46 2ej4 n ILE 10 N 4.25 0.88 -3.32 0.56 3.06 -1.26 -5.01 119.36 118.52 2ej4 n ILE 10 Ca 0.12 -0.41 0.00 0.00 -2.50 0.00 0.00 62.75 59.96 2ej4 n ILE 10 Cb 0.43 -0.44 0.00 0.00 0.54 0.00 0.00 39.64 40.17 2ej4 n ILE 10 CO 0.00 0.00 0.00 2.29 -2.50 0.00 0.00 176.55 176.34 2ej4 n LYS 11 N 0.19 2.25 -0.48 9.51 2.85 -1.26 -5.12 118.16 126.10 2ej4 n LYS 11 Ca 0.07 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 57.04 2ej4 n LYS 11 Cb 0.51 0.00 0.25 0.00 -0.65 0.00 0.00 35.03 35.14 2ej4 n LYS 11 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ej4 n GLN 12 N -0.26 -2.63 -4.55 -1.58 10.64 -1.26 -5.03 117.38 112.71 2ej4 n GLN 12 Ca 0.00 -0.75 -0.27 0.00 -1.83 0.00 0.00 57.00 54.15 2ej4 n GLN 12 Cb 0.00 -2.02 -0.17 0.00 -0.86 0.00 0.00 30.24 27.19 2ej4 n GLN 12 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.06 173.40 2ej4 s GLU 13 N -4.20 2.02 -0.14 2.61 -1.05 -1.26 -4.74 118.70 111.95 2ej4 s GLU 13 Ca 0.65 -0.50 -0.27 0.00 -0.15 0.00 0.00 54.97 54.70 2ej4 s GLU 13 Cb -0.21 -1.70 -0.26 0.00 -0.44 0.00 0.00 34.13 31.52 2ej4 s GLU 13 CO 0.65 -0.02 0.72 -0.07 0.95 0.00 0.00 175.26 177.49 2ej4 h LEU 14 N 7.21 0.07 -1.00 1.83 3.38 -1.94 -3.49 115.31 121.37 2ej4 h LEU 14 Ca -0.30 -0.94 0.00 0.00 0.09 0.00 0.00 57.88 56.73 2ej4 h LEU 14 Cb 1.18 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2ej4 h LEU 14 CO 0.47 1.11 -0.75 -1.20 0.09 0.00 0.00 178.44 178.17 2ej4 n SER 15 N -4.52 -7.83 -4.43 -0.43 7.64 -1.26 -4.81 113.62 97.99 2ej4 n SER 15 Ca -0.13 1.06 -0.44 0.00 1.01 0.00 0.00 58.87 60.37 2ej4 n SER 15 Cb 0.55 -3.78 -0.03 0.00 -1.01 0.00 0.00 64.21 59.94 2ej4 n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ej4 n LYS 17 N 6.76 2.61 -3.22 0.00 4.76 -1.26 -1.72 118.16 126.09 2ej4 n LYS 17 Ca 0.05 -1.57 -0.46 0.00 -2.87 0.00 0.00 58.31 53.46 2ej4 n LYS 17 Cb 0.46 -2.44 -0.03 0.00 -1.84 0.00 0.00 35.03 31.18 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 2.34 3.39 -0.85 2.13 -0.11 -1.26 -3.04 118.94 121.54 2ej4 s TRP 18 Ca 0.56 -1.52 -0.20 0.00 1.22 0.00 0.00 56.10 56.16 2ej4 s TRP 18 Cb 0.18 -3.92 0.11 0.00 -1.50 0.00 0.00 33.47 28.34 2ej4 s TRP 18 CO -0.03 -1.13 1.08 0.42 -4.62 0.00 0.00 176.95 172.66 2ej4 s ILE 19 N 1.39 4.60 1.33 5.86 1.01 -1.25 -1.48 121.20 132.66 2ej4 s ILE 19 Ca 0.15 -1.21 -0.20 0.00 0.00 0.00 0.00 60.65 59.39 2ej4 s ILE 19 Cb -0.17 -4.75 0.32 0.00 0.01 0.00 0.00 42.46 37.86 2ej4 s ILE 19 CO -0.03 -1.49 0.74 -0.67 0.00 0.00 0.00 174.94 173.49 2ej4 n ASP 20 N 6.91 -3.55 -4.02 3.58 2.03 -1.26 -4.39 116.55 115.86 2ej4 n ASP 20 Ca 0.16 -0.65 -0.26 0.00 0.52 0.00 0.00 54.79 54.56 2ej4 n ASP 20 Cb 0.48 -0.98 -0.17 0.00 -0.72 0.00 0.00 41.12 39.73 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 -4.55 1.80 0.00 -0.67 2.12 -1.26 -4.69 118.70 111.45 2ej4 s GLU 21 Ca 0.60 -0.43 0.00 0.00 0.36 0.00 0.00 54.97 55.50 2ej4 s GLU 21 Cb -0.13 -1.53 0.00 0.00 0.26 0.00 0.00 34.13 32.73 2ej4 s GLU 21 CO 0.53 -0.02 0.00 0.00 -0.54 0.00 0.00 175.26 175.23 2ej4 n ALA 22 N 4.00 0.00 -1.16 6.30 0.00 -1.26 -4.93 120.51 123.47 2ej4 n ALA 22 Ca -0.21 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.84 2ej4 n ALA 22 Cb 0.51 -0.47 -0.02 0.00 0.00 0.00 0.00 19.45 19.48 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 -1.82 0.00 -0.27 0.00 10.64 -1.26 -4.70 117.38 119.97 2ej4 n GLN 23 Ca 0.00 0.00 0.12 0.00 -1.83 0.00 0.00 57.00 55.29 2ej4 n GLN 23 Cb 0.06 -0.85 0.23 0.00 -0.86 0.00 0.00 30.24 28.82 2ej4 n GLN 23 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 2ej4 n LEU 24 N 1.80 -0.09 -4.91 2.61 0.00 -1.26 -4.31 117.00 110.84 2ej4 n LEU 24 Ca 0.13 1.33 -0.27 0.00 0.00 0.00 0.00 56.01 57.21 2ej4 n LEU 24 Cb 0.26 -0.49 -0.01 0.00 0.00 0.00 0.00 43.42 43.18 2ej4 n LEU 24 CO 0.47 -1.35 0.38 -0.55 0.00 0.00 0.00 177.39 176.34 2ej4 s SER 25 N -5.00 6.29 0.15 1.96 0.15 -1.26 -5.11 113.70 110.88 2ej4 s SER 25 Ca -0.10 0.83 -0.16 0.00 0.70 0.00 0.00 55.95 57.22 2ej4 s SER 25 Cb 0.23 -2.20 0.03 0.00 -1.71 0.00 0.00 66.02 62.37 2ej4 s SER 25 CO 0.61 -0.50 0.44 -0.13 1.20 0.00 0.00 173.24 174.86 2ej4 s ARG 26 N -4.58 1.18 0.89 5.44 1.81 -1.26 -4.45 118.95 117.97 2ej4 s ARG 26 Ca 0.46 -0.78 -0.11 0.00 -1.72 0.00 0.00 55.73 53.57 2ej4 s ARG 26 Cb -0.10 0.48 0.12 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 0.00 175.30 174.41 2ej4 s PRO 27 N -3.84 1.31 -0.85 3.54 0.04 -1.26 -4.95 135.00 129.00 2ej4 s PRO 27 Ca 0.06 0.84 -0.19 0.00 0.04 0.00 0.00 61.00 61.75 2ej4 s PRO 27 Cb 0.01 -1.81 -0.23 0.00 0.04 0.00 0.00 34.50 32.51 2ej4 s PRO 27 CO -0.08 -2.21 2.11 1.63 0.04 0.00 0.00 177.00 178.49 2ej4 n LYS 28 N -3.86 0.00 -3.10 4.56 5.02 -1.26 -4.85 118.16 114.67 2ej4 n LYS 28 Ca 0.07 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.07 2ej4 n LYS 28 Cb 0.55 -1.10 -0.03 0.00 -0.02 0.00 0.00 35.03 34.43 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 6.96 3.71 0.08 1.97 -2.85 -1.26 -4.96 119.74 123.40 2ej4 s LYS 29 Ca 1.14 0.25 -0.24 0.00 -1.00 0.00 0.00 55.97 56.12 2ej4 s LYS 29 Cb -0.93 -2.52 -0.06 0.00 -2.06 0.00 0.00 37.83 32.26 2ej4 s LYS 29 CO 0.44 0.09 0.75 -1.54 0.10 0.00 0.00 175.35 175.19 2ej4 s SER 30 N -3.13 7.24 0.57 0.03 1.04 -1.26 -4.09 113.70 114.10 2ej4 s SER 30 Ca 0.48 1.48 0.29 0.00 0.48 0.00 0.00 55.95 58.68 2ej4 s SER 30 Cb -0.10 -2.46 1.45 0.00 0.10 0.00 0.00 66.02 65.00 2ej4 s SER 30 CO 0.30 0.10 1.87 0.00 0.98 0.00 0.00 173.24 176.49 2ej4 n ASP 32 N -3.86 0.00 -1.13 0.00 9.92 -0.70 -4.87 116.55 115.91 2ej4 n ASP 32 Ca 0.12 0.00 0.14 0.00 -0.53 0.00 0.00 54.79 54.52 2ej4 n ASP 32 Cb 0.79 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 41.23 2ej4 n ASP 32 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2ej4 n ARG 33 N 0.00 -2.22 -3.69 -1.24 3.00 -1.26 0.15 116.66 111.40 2ej4 n ARG 33 Ca 0.00 1.55 -0.10 0.00 -0.01 0.00 0.00 57.85 59.29 2ej4 n ARG 33 Cb 0.00 -2.74 -0.10 0.00 0.00 0.00 0.00 32.46 29.62 2ej4 n ARG 33 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2ej4 s THR 34 N -2.47 -0.02 0.12 0.55 -4.23 -1.26 -4.03 115.64 104.30 2ej4 s THR 34 Ca 0.00 0.08 0.06 0.00 -1.18 0.00 0.00 61.69 60.65 2ej4 s THR 34 Cb 0.00 -0.66 -0.04 0.00 1.34 0.00 0.00 72.50 73.14 2ej4 s THR 34 CO 0.00 0.03 -0.15 -0.36 -0.54 0.00 0.00 174.62 173.60 2ej4 s PHE 35 N 1.44 1.45 -0.12 3.99 0.40 -1.26 -4.92 117.98 118.95 2ej4 s PHE 35 Ca -0.10 -0.53 0.19 0.00 -0.60 0.00 0.00 56.93 55.90 2ej4 s PHE 35 Cb -0.08 -0.76 -0.28 0.00 0.51 0.00 0.00 43.02 42.41 2ej4 s PHE 35 CO -0.14 0.16 0.24 0.43 0.70 0.00 0.00 175.22 176.61 2ej4 n SER 36 N 0.61 0.11 -4.17 1.36 7.64 -1.26 -3.50 113.62 114.41 2ej4 n SER 36 Ca -0.16 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.45 2ej4 n SER 36 Cb 0.56 1.42 -0.16 0.00 -1.01 0.00 0.00 64.21 65.03 2ej4 n SER 36 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2ej4 s THR 37 N -2.92 1.58 0.43 0.44 -4.23 -1.26 -4.92 115.64 104.76 2ej4 s THR 37 Ca -0.09 -0.81 0.20 0.00 -1.18 0.00 0.00 61.69 59.82 2ej4 s THR 37 Cb 0.09 -1.35 0.40 0.00 1.34 0.00 0.00 72.50 72.98 2ej4 s THR 37 CO 0.85 0.45 1.84 -0.03 -0.54 0.00 0.00 174.62 177.18 2ej4 h MET 38 N 6.17 0.34 -0.17 3.99 4.05 -2.01 -1.14 114.93 126.15 2ej4 h MET 38 Ca -0.33 -0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.12 2ej4 h MET 38 Cb 1.17 -0.08 -0.06 0.00 -0.80 0.00 0.00 31.60 31.84 2ej4 h MET 38 CO 0.48 0.22 -0.20 1.25 0.23 0.00 0.00 176.91 178.89 2ej4 h HIS 39 N 0.35 -0.52 -0.36 1.39 -0.00 -1.99 -1.90 115.15 112.12 2ej4 h HIS 39 Ca 0.50 0.03 0.08 0.00 -0.00 0.00 0.00 60.37 60.98 2ej4 h HIS 39 Cb 1.35 0.25 -0.08 0.00 -0.00 0.00 0.00 27.41 28.94 2ej4 h HIS 39 CO -0.00 -0.28 -0.16 0.93 -0.00 0.00 0.00 177.93 178.42 2ej4 h GLU 40 N -0.23 -0.09 -0.10 5.26 4.39 -1.62 0.12 114.58 122.31 2ej4 h GLU 40 Ca 0.11 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.86 2ej4 h GLU 40 Cb 0.40 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.01 2ej4 h GLU 40 CO -0.31 -0.06 -0.35 1.25 -1.16 0.00 0.00 179.01 178.38 2ej4 h LEU 41 N -0.10 -1.07 -1.12 1.33 5.85 -1.40 1.31 115.31 120.12 2ej4 h LEU 41 Ca 0.18 0.15 0.05 0.00 0.84 0.00 0.00 57.88 59.10 2ej4 h LEU 41 Cb 0.37 0.45 -0.06 0.00 0.37 0.00 0.00 40.66 41.79 2ej4 h LEU 41 CO -0.43 -0.38 0.60 0.58 -0.34 0.00 0.00 178.44 178.47 2ej4 h VAL 42 N -0.44 1.12 0.00 1.05 2.07 -0.79 -0.34 116.25 118.92 2ej4 h VAL 42 Ca 0.08 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2ej4 h VAL 42 Cb 0.57 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2ej4 h VAL 42 CO -0.35 0.20 0.00 0.74 0.02 0.00 0.00 177.57 178.18 2ej4 h THR 43 N 1.10 0.00 0.06 2.57 2.02 0.41 -3.18 112.91 115.90 2ej4 h THR 43 Ca 0.38 -0.65 -0.00 0.00 0.77 0.00 0.00 66.41 66.90 2ej4 h THR 43 Cb 0.09 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2ej4 h THR 43 CO -0.13 0.00 -0.03 -0.74 0.37 0.00 0.00 175.52 174.99 2ej4 h HIS 44 N 0.00 -0.08 0.00 3.16 6.17 0.34 -3.24 115.15 121.51 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 0.80 0.03 0.00 0.00 2.52 0.00 0.00 27.41 30.75 2ej4 h HIS 44 CO 0.00 -0.05 0.14 0.28 0.71 0.00 0.00 177.93 179.01 2ej4 n VAL 45 N -2.88 1.05 0.14 5.26 0.31 -0.86 0.32 118.33 121.67 2ej4 n VAL 45 Ca -0.01 0.67 -0.06 0.00 -0.01 0.00 0.00 64.34 64.93 2ej4 n VAL 45 Cb 0.03 -1.67 -0.03 0.00 -0.91 0.00 0.00 33.84 31.26 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 -1.61 0.30 112.91 116.18 2ej4 h THR 46 Ca 0.00 -0.33 -0.34 0.00 0.77 0.00 0.00 66.41 66.51 2ej4 h THR 46 Cb 0.27 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.65 2ej4 h THR 46 CO 0.00 0.00 -1.90 1.15 0.37 0.00 0.00 175.52 175.14 2ej4 n MET 47 N -4.03 0.65 -0.34 6.66 0.00 -0.99 0.17 117.12 119.22 2ej4 n MET 47 Ca -0.05 0.36 0.13 0.00 0.00 0.00 0.00 57.70 58.14 2ej4 n MET 47 Cb 0.16 -1.66 0.33 0.00 0.00 0.00 0.00 33.22 32.05 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 -0.49 0.74 0.00 3.17 4.39 -0.36 -2.32 114.58 119.71 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 1.69 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 30.17 2ej4 h GLU 48 CO -0.13 0.49 0.00 0.72 -1.16 0.00 0.00 179.01 178.93 2ej4 n HIS 49 N -4.72 0.00 -0.38 4.33 8.25 -1.21 -4.71 115.22 116.78 2ej4 n HIS 49 Ca 0.22 0.00 0.38 0.00 -0.26 0.00 0.00 57.72 58.07 2ej4 n HIS 49 Cb 0.56 0.00 0.73 0.00 1.12 0.00 0.00 29.99 32.40 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 0.23 -3.21 1.59 2.07 -0.09 -3.47 116.25 113.37 2ej4 h VAL 50 Ca 0.00 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.84 2ej4 h VAL 50 Cb 0.00 0.26 -0.15 0.00 -1.52 0.00 0.00 31.29 29.87 2ej4 h VAL 50 CO 0.00 0.00 -1.01 0.61 0.02 0.00 0.00 177.57 177.19 2ej4 n GLY 51 N -1.78 -2.70 0.77 2.17 0.00 0.44 -4.78 105.19 99.30 2ej4 n GLY 51 Ca 0.29 -0.91 -0.07 0.00 0.00 0.00 0.00 46.02 45.32 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 -4.15 -3.68 0.00 -0.02 0.00 -1.26 -4.69 105.19 91.39 2ej4 n GLY 52 Ca -0.06 -1.21 0.07 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.83 0.33 -0.56 1.61 -0.04 -1.26 -2.28 135.00 129.97 2ej4 n PRO 53 Ca 0.03 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.65 2ej4 n PRO 53 Cb 0.14 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.41 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 -1.16 3.46 -2.78 0.54 -0.58 -1.26 -4.95 120.64 113.90 2ej4 n GLU 54 Ca 0.09 -2.47 -0.31 0.00 -0.42 0.00 0.00 57.16 54.05 2ej4 n GLU 54 Cb 0.09 -1.85 -0.04 0.00 -0.57 0.00 0.00 31.44 29.08 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 -1.89 3.84 -0.31 3.49 -0.44 -0.97 -5.06 119.66 118.33 2ej4 s GLN 55 Ca 0.44 0.61 -0.01 0.00 -2.50 0.00 0.00 55.36 53.90 2ej4 s GLN 55 Cb 0.29 -2.33 0.06 0.00 -1.64 0.00 0.00 33.01 29.39 2ej4 s GLN 55 CO 0.20 -0.07 0.02 -0.80 0.50 0.00 0.00 175.29 175.14 2ej4 s ASN 56 N -3.04 4.89 0.00 6.67 -0.87 -1.26 -4.86 114.94 116.47 2ej4 s ASN 56 Ca 0.53 -1.45 0.00 0.00 -1.57 0.00 0.00 52.86 50.37 2ej4 s ASN 56 Cb -0.10 -1.71 0.00 0.00 -0.02 0.00 0.00 41.25 39.42 2ej4 s ASN 56 CO 0.30 -0.30 0.00 -3.20 -2.57 0.00 0.00 177.10 171.33 2ej4 n ASN 57 N 4.57 -1.76 -4.55 -1.22 4.05 -1.26 -5.03 115.26 110.06 2ej4 n ASN 57 Ca -0.10 0.00 -0.40 0.00 0.45 0.00 0.00 54.58 54.53 2ej4 n ASN 57 Cb 0.43 -0.88 -0.10 0.00 1.23 0.00 0.00 39.78 40.45 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 3.22 0.08 1.20 3.76 -1.26 -5.07 115.29 117.23 2ej4 s HIS 58 Ca 0.00 -0.08 0.06 0.00 -0.15 0.00 0.00 55.06 54.89 2ej4 s HIS 58 Cb 0.00 -2.51 -0.03 0.00 1.11 0.00 0.00 32.58 31.15 2ej4 s HIS 58 CO 0.00 -0.33 -0.15 0.08 -0.85 0.00 0.00 174.74 173.48 2ej4 s VAL 59 N 1.81 1.24 -0.74 -0.90 1.01 -1.26 -3.56 120.40 118.00 2ej4 s VAL 59 Ca 0.08 -1.40 -0.20 0.00 0.00 0.00 0.00 61.98 60.45 2ej4 s VAL 59 Cb -0.17 -1.22 0.10 0.00 0.00 0.00 0.00 36.38 35.10 2ej4 s VAL 59 CO 0.11 -0.22 0.96 0.00 0.00 0.00 0.00 175.10 175.94 2ej4 s TYR 61 N 3.18 3.31 0.26 0.00 2.02 -1.26 -2.62 117.35 122.24 2ej4 s TYR 61 Ca 0.23 0.56 -0.13 0.00 -0.37 0.00 0.00 57.07 57.37 2ej4 s TYR 61 Cb -0.14 -2.59 0.00 0.00 -0.40 0.00 0.00 41.96 38.83 2ej4 s TYR 61 CO 0.02 -0.15 0.52 -0.46 -1.57 0.00 0.00 175.55 173.90 2ej4 s TRP 62 N 1.81 0.36 0.00 2.71 -0.11 -1.26 -3.80 118.94 118.65 2ej4 s TRP 62 Ca 0.18 -0.73 -0.18 0.00 1.22 0.00 0.00 56.10 56.59 2ej4 s TRP 62 Cb -0.15 0.25 -0.34 0.00 -1.50 0.00 0.00 33.47 31.72 2ej4 s TRP 62 CO 0.09 -1.06 0.97 1.49 -4.62 0.00 0.00 176.95 173.82 2ej4 h GLU 63 N 2.21 0.46 -2.16 5.86 4.81 -1.90 -3.39 114.58 120.46 2ej4 h GLU 63 Ca -0.26 -0.78 -0.57 0.00 -0.13 0.00 0.00 59.36 57.62 2ej4 h GLU 63 Cb 1.25 0.29 -0.41 0.00 0.63 0.00 0.00 28.75 30.51 2ej4 h GLU 63 CO 0.35 1.37 -0.79 -0.85 -0.73 0.00 0.00 179.01 178.36 2ej4 n GLU 64 N -3.87 2.21 -4.31 1.92 0.28 -1.26 -5.08 120.64 110.53 2ej4 n GLU 64 Ca -0.16 -4.29 -0.33 0.00 -0.16 0.00 0.00 57.16 52.22 2ej4 n GLU 64 Cb 1.00 -1.99 -0.09 0.00 1.43 0.00 0.00 31.44 31.79 2ej4 n GLU 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2ej4 h PRO 66 N 4.47 0.69 0.00 0.00 0.13 -1.98 -2.94 132.00 132.38 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 0.98 0.00 0.54 -0.23 0.00 0.00 178.00 179.85 2ej4 n ARG 67 N -4.27 0.21 -1.75 0.86 1.74 -1.26 -4.86 116.66 107.32 2ej4 n ARG 67 Ca -0.04 0.38 -0.15 0.00 -0.77 0.00 0.00 57.85 57.28 2ej4 n ARG 67 Cb 0.47 -1.86 -0.04 0.00 -1.02 0.00 0.00 32.46 30.00 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 -2.24 -1.57 -0.48 5.56 1.02 -1.11 -2.65 120.64 119.17 2ej4 n GLU 68 Ca 0.03 0.81 0.00 0.00 -0.02 0.00 0.00 57.16 57.98 2ej4 n GLU 68 Cb 0.27 -5.20 0.00 0.00 -0.02 0.00 0.00 31.44 26.49 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 -0.46 0.77 3.37 0.62 0.00 -1.08 -4.97 105.19 103.44 2ej4 n GLY 69 Ca -0.15 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 2ej4 n GLY 69 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ej4 s LYS 70 N -1.65 3.20 0.43 1.61 2.20 -1.08 -4.72 119.74 119.72 2ej4 s LYS 70 Ca 0.00 -0.79 -0.24 0.00 -0.36 0.00 0.00 55.97 54.58 2ej4 s LYS 70 Cb 0.00 -3.40 -0.10 0.00 -1.51 0.00 0.00 37.83 32.82 2ej4 s LYS 70 CO 0.00 -0.41 1.00 -1.13 -0.36 0.00 0.00 175.35 174.45 2ej4 n SER 71 N 4.89 1.19 -3.46 1.43 3.41 -1.26 -4.44 113.62 115.38 2ej4 n SER 71 Ca -0.15 1.01 -0.12 0.00 -0.26 0.00 0.00 58.87 59.36 2ej4 n SER 71 Cb 0.49 -1.35 0.06 0.00 -0.26 0.00 0.00 64.21 63.14 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 -0.59 -2.97 1.21 7.33 3.01 -1.23 -5.01 117.46 119.20 2ej4 n PHE 72 Ca 0.10 -1.02 0.13 0.00 1.01 0.00 0.00 57.45 57.66 2ej4 n PHE 72 Cb 0.40 -0.37 0.27 0.00 -0.01 0.00 0.00 39.48 39.78 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 -1.91 1.89 -4.05 -1.08 5.02 -1.26 -4.95 118.16 111.81 2ej4 n LYS 73 Ca 0.09 -1.39 -0.10 0.00 -2.02 0.00 0.00 58.31 54.89 2ej4 n LYS 73 Cb 0.32 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.80 2ej4 n LYS 73 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ej4 s ALA 74 N -2.07 0.16 -0.11 7.82 0.00 -1.26 -5.05 121.76 121.24 2ej4 s ALA 74 Ca 0.31 -1.11 -0.28 0.00 0.00 0.00 0.00 51.96 50.88 2ej4 s ALA 74 Cb 0.20 1.15 -0.25 0.00 0.00 0.00 0.00 23.12 24.23 2ej4 s ALA 74 CO 0.35 -0.79 0.90 -0.22 0.00 0.00 0.00 175.76 176.01 2ej4 h LYS 75 N 2.34 0.00 -0.30 0.00 1.63 -1.98 -3.33 116.57 114.94 2ej4 h LYS 75 Ca -0.29 -0.01 -0.11 0.00 -0.85 0.00 0.00 60.65 59.40 2ej4 h LYS 75 Cb 1.25 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.87 2ej4 h LYS 75 CO 0.40 0.87 -0.26 0.10 -3.45 0.00 0.00 179.45 177.10 2ej4 h TYR 76 N -0.86 0.67 0.00 1.91 -0.00 -2.00 -2.72 116.97 113.98 2ej4 h TYR 76 Ca -0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 58.73 58.58 2ej4 h TYR 76 Cb 0.87 -0.16 0.00 0.00 -0.00 0.00 0.00 36.73 37.44 2ej4 h TYR 76 CO 0.23 0.80 0.52 0.87 -0.00 0.00 0.00 178.16 180.58 2ej4 h LYS 77 N 0.51 0.00 0.00 0.10 1.57 -1.98 -0.93 116.57 115.84 2ej4 h LYS 77 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2ej4 h LYS 77 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 2ej4 h LYS 77 CO 0.06 0.00 -0.05 1.25 -0.57 0.00 0.00 179.45 180.13 2ej4 h LEU 78 N 0.00 0.00 -2.20 2.94 5.85 -1.62 -3.23 115.31 117.04 2ej4 h LEU 78 Ca 0.00 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.78 2ej4 h LEU 78 Cb 1.04 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 2ej4 h LEU 78 CO 0.00 0.52 0.25 0.58 -0.34 0.00 0.00 178.44 179.45 2ej4 h VAL 79 N -0.99 0.39 -0.27 1.05 2.07 -1.35 -0.35 116.25 116.80 2ej4 h VAL 79 Ca 0.00 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2ej4 h VAL 79 Cb 0.05 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2ej4 h VAL 79 CO 0.00 0.00 -0.13 -1.13 0.02 0.00 0.00 177.57 176.33 2ej4 h ASN 80 N 0.00 0.59 1.61 0.57 -1.24 -1.35 -3.03 115.58 112.74 2ej4 h ASN 80 Ca 0.09 -0.41 -0.06 0.00 0.71 0.00 0.00 56.30 56.63 2ej4 h ASN 80 Cb 0.58 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.46 2ej4 h ASN 80 CO -0.00 0.87 -0.29 -0.74 -1.29 0.00 0.00 177.43 175.98 2ej4 h HIS 81 N 0.31 0.00 -0.52 0.67 2.76 -1.20 -3.24 115.15 113.93 2ej4 h HIS 81 Ca 0.06 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.19 2ej4 h HIS 81 Cb 0.65 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.58 2ej4 h HIS 81 CO 0.06 0.29 0.15 0.82 -1.30 0.00 0.00 177.93 177.95 2ej4 h ILE 82 N 0.00 1.21 -0.44 6.26 2.04 -1.02 -2.89 117.51 122.68 2ej4 h ILE 82 Ca -0.00 -0.75 0.08 0.00 1.00 0.00 0.00 64.86 65.19 2ej4 h ILE 82 Cb 1.18 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 37.85 2ej4 h ILE 82 CO 0.04 0.28 0.03 0.03 0.00 0.00 0.00 178.15 178.53 2ej4 h ARG 83 N 0.76 0.14 -1.10 2.37 3.08 -1.56 0.48 114.38 118.56 2ej4 h ARG 83 Ca 0.17 -0.01 0.32 0.00 0.07 0.00 0.00 59.98 60.53 2ej4 h ARG 83 Cb 0.25 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 2ej4 h ARG 83 CO -0.01 0.09 0.91 -0.24 -1.07 0.00 0.00 179.97 179.65 2ej4 h VAL 84 N 0.14 0.27 0.10 2.04 3.04 -1.69 0.20 116.25 120.36 2ej4 h VAL 84 Ca 0.22 0.00 -0.28 0.00 -1.01 0.00 0.00 66.70 65.63 2ej4 h VAL 84 Cb 0.30 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 29.91 2ej4 h VAL 84 CO -0.34 0.00 -1.46 0.45 -1.01 0.00 0.00 177.57 175.21 2ej4 h HIS 85 N 0.00 0.37 -0.73 3.17 3.86 -1.05 -3.37 115.15 117.41 2ej4 h HIS 85 Ca 0.52 -0.27 0.09 0.00 -1.16 0.00 0.00 60.37 59.55 2ej4 h HIS 85 Cb 2.33 -0.01 -0.07 0.00 1.06 0.00 0.00 27.41 30.71 2ej4 h HIS 85 CO 0.00 1.57 0.37 1.79 0.86 0.00 0.00 177.93 182.52 2ej4 h THR 86 N -0.36 0.86 0.00 2.45 1.35 0.15 -3.46 112.91 113.90 2ej4 h THR 86 Ca -0.33 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 2ej4 h THR 86 Cb 1.72 0.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2ej4 h THR 86 CO 0.02 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 2ej4 n GLY 87 N -1.30 1.18 0.00 5.82 0.00 -0.32 -5.10 105.19 105.47 2ej4 n GLY 87 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.45 2.82 -1.06 1.61 2.13 -1.25 -5.07 120.64 118.38 2ej4 n GLU 88 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 2ej4 n GLU 88 Cb 0.00 0.00 0.14 0.00 0.27 0.00 0.00 31.44 31.85 2ej4 n GLU 88 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2ej4 s LYS 89 N 2.12 1.42 -0.25 5.31 1.02 -1.26 -4.88 119.74 123.23 2ej4 s LYS 89 Ca 0.00 1.13 -0.27 0.00 0.02 0.00 0.00 55.97 56.85 2ej4 s LYS 89 Cb 0.00 -1.80 0.15 0.00 -0.52 0.00 0.00 37.83 35.66 2ej4 s LYS 89 CO 0.00 -2.22 1.18 0.45 -0.92 0.00 0.00 175.35 173.85 2ej4 s SER 90 N -3.17 -0.25 0.00 2.83 0.15 -1.26 -4.73 113.70 107.27 2ej4 s SER 90 Ca 0.64 0.39 0.00 0.00 0.70 0.00 0.00 55.95 57.68 2ej4 s SER 90 Cb -0.19 0.36 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 2ej4 s SER 90 CO 0.57 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.47 2ej4 n GLY 91 N 1.30 4.32 3.77 9.45 0.00 -1.26 -5.15 105.19 117.62 2ej4 n GLY 91 Ca -0.09 -1.73 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 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 -1.53 3.53 0.00 1.61 0.04 -1.26 -5.04 135.00 132.34 2ej4 s PRO 92 Ca 0.00 1.68 0.00 0.00 0.04 0.00 0.00 61.00 62.72 2ej4 s PRO 92 Cb 0.00 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2ej4 s PRO 92 CO 0.00 -0.72 0.00 -1.13 0.04 0.00 0.00 177.00 175.19 2ej4 n SER 93 N -0.95 -1.14 -3.85 6.66 3.41 -1.26 -5.04 113.62 111.46 2ej4 n SER 93 Ca 0.10 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 2ej4 n SER 93 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2ej4 n SER 93 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ej4 n SER 94 N -2.95 -0.00 -0.85 4.04 3.41 -1.26 -5.30 113.62 110.70 2ej4 n SER 94 Ca 0.00 -0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.72 2ej4 n SER 94 Cb 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.04 2ej4 n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49