#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ek5 n PRO 4 N 0.00 1.21 -0.03 1.45 -0.02 -1.26 -4.78 135.00 131.56 2ek5 n PRO 4 Ca 0.00 0.46 -0.11 0.00 -2.02 0.00 0.00 63.50 61.84 2ek5 n PRO 4 Cb 0.00 -2.43 -0.05 0.00 -0.02 0.00 0.00 33.50 31.01 2ek5 n PRO 4 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2ek5 h LEU 5 N 0.78 -1.19 -1.98 2.45 7.12 -2.00 -1.92 115.31 118.57 2ek5 h LEU 5 Ca -0.50 0.17 0.08 0.00 0.13 0.00 0.00 57.88 57.77 2ek5 h LEU 5 Cb 1.34 0.51 -0.01 0.00 -0.53 0.00 0.00 40.66 41.96 2ek5 h LEU 5 CO 0.54 -0.38 0.22 0.10 -0.13 0.00 0.00 178.44 178.78 2ek5 h TYR 6 N -0.40 0.03 0.00 1.25 -0.00 -1.92 0.09 116.97 116.02 2ek5 h TYR 6 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.84 2ek5 h TYR 6 Cb 0.58 -0.01 0.00 0.00 -0.00 0.00 0.00 36.73 37.30 2ek5 h TYR 6 CO -0.49 0.02 -0.63 0.36 -0.00 0.00 0.00 178.16 177.42 2ek5 n LYS 7 N -4.45 0.24 -0.05 0.10 2.85 -0.98 -2.60 118.16 113.27 2ek5 n LYS 7 Ca 0.04 0.06 -0.16 0.00 -1.05 0.00 0.00 58.31 57.20 2ek5 n LYS 7 Cb 0.37 -1.64 -0.06 0.00 -0.65 0.00 0.00 35.03 33.04 2ek5 n LYS 7 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 2ek5 h GLN 8 N 0.00 0.73 0.00 -1.58 4.20 -0.21 -0.79 115.11 117.46 2ek5 h GLN 8 Ca 0.00 -0.53 -0.08 0.00 0.06 0.00 0.00 58.65 58.10 2ek5 h GLN 8 Cb 0.70 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 2ek5 h GLN 8 CO 0.00 1.15 -0.39 -0.84 -0.67 0.00 0.00 178.83 178.08 2ek5 h ILE 9 N 0.44 0.75 -0.06 2.54 -0.00 -1.51 -2.43 117.51 117.24 2ek5 h ILE 9 Ca -0.02 -1.77 -0.15 0.00 -0.00 0.00 0.00 64.86 62.92 2ek5 h ILE 9 Cb 1.20 2.15 -0.01 0.00 -0.00 0.00 0.00 36.82 40.16 2ek5 h ILE 9 CO 0.12 0.38 -0.64 0.00 -0.00 0.00 0.00 178.15 178.01 2ek5 h ALA 10 N 1.61 0.80 -0.06 0.16 0.00 -1.35 -2.50 119.26 117.92 2ek5 h ALA 10 Ca -0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 54.91 54.22 2ek5 h ALA 10 Cb 1.12 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2ek5 h ALA 10 CO 0.05 0.76 -0.50 1.03 0.00 0.00 0.00 179.25 180.58 2ek5 h SER 11 N 0.17 0.16 -0.25 0.00 0.87 -0.82 -1.89 113.55 111.79 2ek5 h SER 11 Ca -0.01 -0.08 -0.14 0.00 -1.23 0.00 0.00 61.79 60.34 2ek5 h SER 11 Cb 1.16 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.07 2ek5 h SER 11 CO 0.10 0.63 -0.33 -0.07 -0.53 0.00 0.00 176.83 176.63 2ek5 h LEU 12 N 0.12 0.81 -0.33 2.23 -0.00 -1.14 0.17 115.31 117.16 2ek5 h LEU 12 Ca 0.00 -0.34 -0.05 0.00 -0.00 0.00 0.00 57.88 57.49 2ek5 h LEU 12 Cb 0.93 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 41.35 2ek5 h LEU 12 CO 0.07 1.07 -0.01 0.40 -0.00 0.00 0.00 178.44 179.97 2ek5 h ILE 13 N 0.65 1.26 -0.63 1.22 2.04 -1.26 -1.36 117.51 119.42 2ek5 h ILE 13 Ca 0.07 -0.98 0.04 0.00 1.00 0.00 0.00 64.86 64.98 2ek5 h ILE 13 Cb 0.87 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 2ek5 h ILE 13 CO 0.08 0.32 0.38 -0.33 0.00 0.00 0.00 178.15 178.60 2ek5 h GLU 14 N 0.38 0.71 -0.58 2.37 5.08 -1.07 -0.96 114.58 120.51 2ek5 h GLU 14 Ca 0.09 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.48 2ek5 h GLU 14 Cb 0.46 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.49 2ek5 h GLU 14 CO 0.02 0.47 0.27 -0.44 -1.00 0.00 0.00 179.01 178.33 2ek5 h ASP 15 N 0.73 0.36 -0.33 1.42 3.32 -0.33 -0.31 116.42 121.28 2ek5 h ASP 15 Ca 0.26 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.32 2ek5 h ASP 15 Cb 0.07 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2ek5 h ASP 15 CO -0.12 0.23 0.09 0.28 -1.72 0.00 0.00 179.24 178.00 2ek5 h SER 16 N 0.51 0.56 -0.15 6.45 0.02 -0.29 0.21 113.55 120.86 2ek5 h SER 16 Ca 0.27 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 2ek5 h SER 16 Cb 0.24 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 2ek5 h SER 16 CO -0.22 0.56 0.02 0.40 -1.14 0.00 0.00 176.83 176.45 2ek5 h ILE 17 N 0.59 1.23 -0.80 3.27 2.04 -0.05 0.12 117.51 123.91 2ek5 h ILE 17 Ca 0.14 -0.75 0.03 0.00 1.00 0.00 0.00 64.86 65.27 2ek5 h ILE 17 Cb 0.24 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 2ek5 h ILE 17 CO -0.00 0.22 0.51 0.58 0.00 0.00 0.00 178.15 179.46 2ek5 h VAL 18 N 0.01 1.13 0.00 1.67 2.07 -0.56 -1.13 116.25 119.44 2ek5 h VAL 18 Ca 0.04 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2ek5 h VAL 18 Cb 0.33 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 2ek5 h VAL 18 CO 0.00 0.18 0.00 0.44 0.02 0.00 0.00 177.57 178.22 2ek5 h ASP 19 N 1.01 0.00 0.00 0.57 3.32 -0.32 -3.46 116.42 117.53 2ek5 h ASP 19 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 2ek5 h ASP 19 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2ek5 h ASP 19 CO -0.11 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.02 2ek5 n GLY 20 N -0.01 0.80 0.30 2.75 0.00 -0.00 -4.88 105.19 104.15 2ek5 n GLY 20 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 2ek5 n GLY 20 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ek5 h THR 21 N 0.00 1.16 -3.56 2.61 2.02 -1.09 -3.35 112.91 110.70 2ek5 h THR 21 Ca 0.00 -0.50 -0.67 0.00 0.77 0.00 0.00 66.41 66.01 2ek5 h THR 21 Cb 0.00 0.67 -0.34 0.00 -1.74 0.00 0.00 68.15 66.74 2ek5 h THR 21 CO 0.00 0.19 -0.78 -0.76 0.37 0.00 0.00 175.52 174.55 2ek5 s LEU 22 N -9.33 3.15 0.56 2.58 1.43 -0.90 -5.00 118.68 111.17 2ek5 s LEU 22 Ca -0.08 -1.03 -0.08 0.00 -1.03 0.00 0.00 54.13 51.91 2ek5 s LEU 22 Cb 0.16 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.75 2ek5 s LEU 22 CO 0.75 -0.14 0.92 -0.44 0.23 0.00 0.00 176.35 177.68 2ek5 s SER 23 N 1.25 6.15 0.36 2.29 0.01 -1.26 -4.34 113.70 118.16 2ek5 s SER 23 Ca -0.02 1.14 -0.27 0.00 1.31 0.00 0.00 55.95 58.10 2ek5 s SER 23 Cb -0.17 -2.28 -0.12 0.00 0.21 0.00 0.00 66.02 63.65 2ek5 s SER 23 CO -0.06 -0.79 1.27 -0.38 0.41 0.00 0.00 173.24 173.69 2ek5 n ILE 24 N -2.54 2.12 -1.35 1.44 2.08 -1.26 -1.50 119.36 118.35 2ek5 n ILE 24 Ca 0.04 -0.50 -0.12 0.00 0.56 0.00 0.00 62.75 62.73 2ek5 n ILE 24 Cb 0.55 -1.54 -0.05 0.00 -0.75 0.00 0.00 39.64 37.85 2ek5 n ILE 24 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2ek5 n ASP 25 N 0.66 -5.40 -4.86 4.38 8.00 0.17 -4.92 116.55 114.58 2ek5 n ASP 25 Ca 0.05 0.29 -0.34 0.00 0.71 0.00 0.00 54.79 55.51 2ek5 n ASP 25 Cb 0.37 -3.95 -0.06 0.00 -0.02 0.00 0.00 41.12 37.46 2ek5 n ASP 25 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2ek5 s GLN 26 N -2.93 3.86 0.17 -1.24 0.74 -0.56 -4.77 119.66 114.93 2ek5 s GLN 26 Ca 0.00 0.32 -0.30 0.00 0.05 0.00 0.00 55.36 55.43 2ek5 s GLN 26 Cb 0.00 -2.88 -0.07 0.00 1.10 0.00 0.00 33.01 31.15 2ek5 s GLN 26 CO 0.00 0.47 1.12 0.50 -0.55 0.00 0.00 175.29 176.83 2ek5 s ARG 27 N -2.17 4.56 0.42 1.67 3.52 -1.26 -2.08 118.95 123.61 2ek5 s ARG 27 Ca 0.39 1.75 -0.04 0.00 -0.13 0.00 0.00 55.73 57.69 2ek5 s ARG 27 Cb -0.14 -3.28 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 2ek5 s ARG 27 CO 0.20 0.02 0.70 0.14 -0.81 0.00 0.00 175.30 175.54 2ek5 s VAL 28 N -0.08 4.96 0.57 7.11 -7.23 -1.26 -4.97 120.40 119.50 2ek5 s VAL 28 Ca 0.51 0.05 -0.20 0.00 -1.81 0.00 0.00 61.98 60.53 2ek5 s VAL 28 Cb -0.30 -3.84 -0.06 0.00 0.56 0.00 0.00 36.38 32.74 2ek5 s VAL 28 CO 0.35 -0.69 1.01 -2.65 -0.31 0.00 0.00 175.10 172.80 2ek5 n PRO 29 N -1.92 1.04 -1.85 4.82 -0.02 -1.26 -4.97 135.00 130.83 2ek5 n PRO 29 Ca -0.01 0.40 -0.31 0.00 -2.02 0.00 0.00 63.50 61.55 2ek5 n PRO 29 Cb 0.55 -2.19 0.02 0.00 -0.02 0.00 0.00 33.50 31.86 2ek5 n PRO 29 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2ek5 s SER 30 N -1.14 6.03 0.34 2.55 1.04 -1.26 -4.82 113.70 116.44 2ek5 s SER 30 Ca 0.73 1.50 0.08 0.00 0.48 0.00 0.00 55.95 58.74 2ek5 s SER 30 Cb -0.44 -2.48 0.78 0.00 0.10 0.00 0.00 66.02 63.98 2ek5 s SER 30 CO 0.49 -1.00 1.85 0.71 0.98 0.00 0.00 173.24 176.27 2ek5 h THR 31 N -0.27 0.83 0.26 2.02 1.35 -1.93 0.17 112.91 115.35 2ek5 h THR 31 Ca -0.44 -0.25 -0.01 0.00 -0.55 0.00 0.00 66.41 65.15 2ek5 h THR 31 Cb 1.20 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 2ek5 h THR 31 CO 0.60 0.13 -0.13 0.78 -0.25 0.00 0.00 175.52 176.66 2ek5 h ASN 32 N 0.74 -0.30 1.21 5.36 4.21 -1.92 -2.12 115.58 122.77 2ek5 h ASN 32 Ca 0.47 -0.11 0.00 0.00 1.21 0.00 0.00 56.30 57.87 2ek5 h ASN 32 Cb 0.72 0.08 0.00 0.00 -1.12 0.00 0.00 38.32 38.00 2ek5 h ASN 32 CO -0.23 -0.06 0.00 1.05 -1.29 0.00 0.00 177.43 176.89 2ek5 h GLU 33 N -0.53 0.00 0.06 0.81 4.11 -1.73 -2.46 114.58 114.83 2ek5 h GLU 33 Ca -0.04 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.39 2ek5 h GLU 33 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2ek5 h GLU 33 CO 0.06 0.00 -0.03 -0.07 0.07 0.00 0.00 179.01 179.04 2ek5 h LEU 34 N 0.00 -0.07 0.51 3.06 3.38 -0.59 -3.03 115.31 118.56 2ek5 h LEU 34 Ca 0.00 -0.58 -0.02 0.00 0.09 0.00 0.00 57.88 57.38 2ek5 h LEU 34 Cb 0.61 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2ek5 h LEU 34 CO 0.00 0.61 -0.42 0.00 0.09 0.00 0.00 178.44 178.72 2ek5 h ALA 35 N -0.02 -1.13 -0.43 1.53 0.00 -1.35 0.29 119.26 118.14 2ek5 h ALA 35 Ca -0.01 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 54.85 2ek5 h ALA 35 Cb 0.64 0.62 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 2ek5 h ALA 35 CO 0.01 -1.14 0.68 0.00 0.00 0.00 0.00 179.25 178.80 2ek5 h ALA 36 N -1.13 2.14 0.00 0.00 0.00 -1.59 0.44 119.26 119.13 2ek5 h ALA 36 Ca -0.07 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.55 2ek5 h ALA 36 Cb 0.76 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 2ek5 h ALA 36 CO -0.01 -0.90 -2.19 0.34 0.00 0.00 0.00 179.25 176.50 2ek5 n PHE 37 N -3.27 0.16 -0.03 0.00 7.35 -0.66 -4.33 117.46 116.67 2ek5 n PHE 37 Ca 0.08 0.05 0.09 0.00 -0.76 0.00 0.00 57.45 56.92 2ek5 n PHE 37 Cb 0.84 -0.93 0.21 0.00 0.35 0.00 0.00 39.48 39.95 2ek5 n PHE 37 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 2ek5 n HIS 38 N -2.70 0.59 -3.46 -5.13 8.25 0.92 -4.95 115.22 108.75 2ek5 n HIS 38 Ca -0.25 -0.38 -0.18 0.00 -0.26 0.00 0.00 57.72 56.66 2ek5 n HIS 38 Cb 1.02 -0.01 0.09 0.00 1.12 0.00 0.00 29.99 32.21 2ek5 n HIS 38 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ek5 n ARG 39 N 1.17 -6.59 -4.34 -0.41 5.12 0.13 -4.98 116.66 106.75 2ek5 n ARG 39 Ca 0.17 0.83 -0.18 0.00 -1.93 0.00 0.00 57.85 56.75 2ek5 n ARG 39 Cb 0.53 -5.83 -0.10 0.00 -1.16 0.00 0.00 32.46 25.90 2ek5 n ARG 39 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2ek5 s ILE 40 N -3.38 0.62 -0.04 0.55 1.01 -0.96 -5.05 121.20 113.95 2ek5 s ILE 40 Ca 0.03 -2.00 -0.18 0.00 0.00 0.00 0.00 60.65 58.50 2ek5 s ILE 40 Cb -0.01 -2.64 -0.05 0.00 0.01 0.00 0.00 42.46 39.77 2ek5 s ILE 40 CO 0.74 0.00 0.51 0.54 0.00 0.00 0.00 174.94 176.72 2ek5 s ASN 41 N -3.35 6.83 0.58 3.58 4.22 -1.26 -4.41 114.94 121.12 2ek5 s ASN 41 Ca 0.37 0.99 0.33 0.00 -2.14 0.00 0.00 52.86 52.41 2ek5 s ASN 41 Cb 0.07 -2.31 1.34 0.00 1.28 0.00 0.00 41.25 41.63 2ek5 s ASN 41 CO 0.14 0.12 1.61 1.55 -2.04 0.00 0.00 177.10 178.48 2ek5 h PRO 42 N 5.82 0.00 0.25 3.55 0.13 -1.94 0.71 132.00 140.51 2ek5 h PRO 42 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 2ek5 h PRO 42 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2ek5 h PRO 42 CO 0.70 0.00 -0.12 0.00 -0.23 0.00 0.00 178.00 178.35 2ek5 h ALA 43 N 1.03 -0.33 -0.05 -0.56 0.00 -1.92 -0.15 119.26 117.28 2ek5 h ALA 43 Ca 0.51 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.37 2ek5 h ALA 43 Cb 2.48 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 20.35 2ek5 h ALA 43 CO -0.01 -0.67 -0.27 1.15 0.00 0.00 0.00 179.25 179.45 2ek5 h THR 44 N -0.37 0.38 -0.32 0.00 2.02 -1.25 0.18 112.91 113.54 2ek5 h THR 44 Ca -0.03 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.22 2ek5 h THR 44 Cb 0.28 0.38 -0.08 0.00 -1.74 0.00 0.00 68.15 66.99 2ek5 h THR 44 CO 0.06 0.00 -0.26 0.00 0.37 0.00 0.00 175.52 175.69 2ek5 h ALA 45 N 0.45 -0.10 -0.82 6.16 0.00 -1.47 0.27 119.26 123.74 2ek5 h ALA 45 Ca 0.08 0.10 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2ek5 h ALA 45 Cb 0.50 0.56 -0.08 0.00 0.00 0.00 0.00 17.79 18.77 2ek5 h ALA 45 CO -0.27 -0.66 0.45 -0.09 0.00 0.00 0.00 179.25 178.67 2ek5 h ARG 46 N -0.23 0.69 -0.28 0.00 9.65 -0.22 0.21 114.38 124.20 2ek5 h ARG 46 Ca 0.16 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2ek5 h ARG 46 Cb 0.48 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 2ek5 h ARG 46 CO -0.46 0.46 0.16 -0.91 2.80 0.00 0.00 179.97 182.03 2ek5 h ASN 47 N 0.71 0.35 0.00 -3.80 -0.26 0.14 0.39 115.58 113.12 2ek5 h ASN 47 Ca 0.42 -0.07 0.01 0.00 -0.56 0.00 0.00 56.30 56.09 2ek5 h ASN 47 Cb 0.46 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.62 2ek5 h ASN 47 CO -0.29 0.32 -0.05 1.23 -1.06 0.00 0.00 177.43 177.58 2ek5 h GLY 48 N 0.35 -0.05 0.81 2.83 0.00 0.95 -1.24 103.07 106.72 2ek5 h GLY 48 Ca 0.10 0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.52 2ek5 h GLY 48 CO -0.02 -0.06 0.37 1.41 0.00 0.00 0.00 176.54 178.25 2ek5 h LEU 49 N -0.09 0.59 -0.52 3.11 -0.00 -0.43 -2.09 115.31 115.89 2ek5 h LEU 49 Ca 0.02 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.91 2ek5 h LEU 49 Cb 0.11 -0.11 -0.03 0.00 -0.00 0.00 0.00 40.66 40.63 2ek5 h LEU 49 CO -0.05 0.40 0.33 0.74 -0.00 0.00 0.00 178.44 179.86 2ek5 h THR 50 N 0.72 1.15 -0.74 0.22 2.02 -0.69 0.67 112.91 116.25 2ek5 h THR 50 Ca 0.26 -0.30 0.10 0.00 0.77 0.00 0.00 66.41 67.25 2ek5 h THR 50 Cb 0.07 0.42 -0.08 0.00 -1.74 0.00 0.00 68.15 66.82 2ek5 h THR 50 CO -0.13 0.14 0.37 0.25 0.37 0.00 0.00 175.52 176.53 2ek5 h LEU 51 N 0.70 0.47 -0.44 2.58 5.85 -0.74 0.11 115.31 123.84 2ek5 h LEU 51 Ca 0.19 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.85 2ek5 h LEU 51 Cb -0.05 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2ek5 h LEU 51 CO -0.04 0.26 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.04 2ek5 h LEU 52 N 0.61 0.94 -0.65 2.25 3.38 -0.65 -1.57 115.31 119.62 2ek5 h LEU 52 Ca 0.37 -0.40 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2ek5 h LEU 52 Cb 0.43 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2ek5 h LEU 52 CO -0.29 1.13 0.02 0.58 0.09 0.00 0.00 178.44 179.97 2ek5 h VAL 53 N 0.74 1.26 -0.74 1.22 2.07 -0.05 -1.18 116.25 119.58 2ek5 h VAL 53 Ca 0.10 -1.13 -0.04 0.00 0.82 0.00 0.00 66.70 66.45 2ek5 h VAL 53 Cb 0.77 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 2ek5 h VAL 53 CO 0.06 0.41 0.30 -0.33 0.02 0.00 0.00 177.57 178.03 2ek5 h GLU 54 N 0.98 1.11 0.00 1.57 4.39 -0.72 -1.31 114.58 120.61 2ek5 h GLU 54 Ca 0.18 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2ek5 h GLU 54 Cb 0.53 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 2ek5 h GLU 54 CO 0.03 0.91 0.00 0.00 -1.16 0.00 0.00 179.01 178.78 2ek5 n ALA 55 N -2.41 1.70 -0.72 3.43 0.00 -0.60 -4.85 120.51 117.05 2ek5 n ALA 55 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2ek5 n ALA 55 Cb 0.18 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.36 2ek5 n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ek5 n GLY 56 N 0.08 0.83 0.20 0.00 0.00 -0.49 -4.91 105.19 100.90 2ek5 n GLY 56 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 2ek5 n GLY 56 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2ek5 h ILE 57 N 0.00 1.32 -3.58 -0.61 2.04 -1.46 -3.43 117.51 111.78 2ek5 h ILE 57 Ca 0.00 -1.62 -0.63 0.00 1.00 0.00 0.00 64.86 63.60 2ek5 h ILE 57 Cb 0.00 1.72 -0.20 0.00 -0.74 0.00 0.00 36.82 37.59 2ek5 h ILE 57 CO 0.00 0.49 -0.83 -0.76 0.00 0.00 0.00 178.15 177.05 2ek5 s LEU 58 N -8.25 2.37 0.06 1.44 1.02 -1.12 -1.72 118.68 112.48 2ek5 s LEU 58 Ca -0.05 -0.79 0.01 0.00 0.02 0.00 0.00 54.13 53.31 2ek5 s LEU 58 Cb 0.13 -1.09 -0.03 0.00 0.02 0.00 0.00 46.19 45.21 2ek5 s LEU 58 CO 0.79 0.11 -0.06 -0.72 0.02 0.00 0.00 176.35 176.49 2ek5 s TYR 59 N -1.42 0.66 -0.06 0.29 -0.85 0.43 -4.24 117.35 112.16 2ek5 s TYR 59 Ca 0.15 -0.79 -0.01 0.00 -0.52 0.00 0.00 57.07 55.90 2ek5 s TYR 59 Cb -0.09 -0.41 -0.04 0.00 0.38 0.00 0.00 41.96 41.81 2ek5 s TYR 59 CO 0.07 -0.19 0.03 0.15 -1.52 0.00 0.00 175.55 174.09 2ek5 s LYS 60 N -2.95 3.00 -0.26 -3.49 1.02 -1.26 0.35 119.74 116.15 2ek5 s LYS 60 Ca 0.01 -0.44 -0.06 0.00 0.02 0.00 0.00 55.97 55.51 2ek5 s LYS 60 Cb -0.00 -2.82 -0.01 0.00 -0.52 0.00 0.00 37.83 34.49 2ek5 s LYS 60 CO -0.04 0.68 0.03 0.15 -0.92 0.00 0.00 175.35 175.25 2ek5 s LYS 61 N -1.21 3.32 -0.37 1.68 1.02 -0.79 -4.99 119.74 118.40 2ek5 s LYS 61 Ca 0.17 -0.69 -0.34 0.00 0.02 0.00 0.00 55.97 55.13 2ek5 s LYS 61 Cb -0.12 -3.22 -0.15 0.00 -0.52 0.00 0.00 37.83 33.83 2ek5 s LYS 61 CO 0.06 -0.29 1.18 -2.13 -0.92 0.00 0.00 175.35 173.25 2ek5 n ARG 62 N 4.85 0.00 -0.46 1.68 3.00 -1.26 -0.72 116.66 123.75 2ek5 n ARG 62 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.69 2ek5 n ARG 62 Cb 0.50 -1.10 0.00 0.00 0.00 0.00 0.00 32.46 31.86 2ek5 n ARG 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2ek5 n GLY 63 N 3.01 0.53 0.01 5.14 0.00 -1.26 -4.78 105.19 107.84 2ek5 n GLY 63 Ca 0.23 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.30 2ek5 n GLY 63 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ek5 n ILE 64 N -2.00 0.11 0.00 -0.61 -0.00 0.10 -5.29 119.36 111.67 2ek5 n ILE 64 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 62.75 62.44 2ek5 n ILE 64 Cb 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 39.64 39.73 2ek5 n ILE 64 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2ek5 n GLY 65 N 1.87 0.71 0.00 7.39 0.00 -1.18 -4.98 105.19 109.00 2ek5 n GLY 65 Ca -0.05 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2ek5 n GLY 65 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ek5 n PHE 67 N 0.00 0.00 -2.43 1.61 3.01 0.15 -1.89 117.46 117.91 2ek5 n PHE 67 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 2ek5 n PHE 67 Cb 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.45 2ek5 n PHE 67 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2ek5 s VAL 68 N -2.00 4.27 0.44 -4.37 1.01 -0.88 -0.43 120.40 118.43 2ek5 s VAL 68 Ca 0.00 1.52 -0.23 0.00 0.00 0.00 0.00 61.98 63.27 2ek5 s VAL 68 Cb 0.00 -4.03 -0.08 0.00 0.00 0.00 0.00 36.38 32.27 2ek5 s VAL 68 CO 0.00 -0.19 1.07 -0.94 0.00 0.00 0.00 175.10 175.04 2ek5 s SER 69 N 2.10 6.47 0.61 3.32 1.04 -0.70 0.45 113.70 126.99 2ek5 s SER 69 Ca 0.55 2.07 0.32 0.00 0.48 0.00 0.00 55.95 59.37 2ek5 s SER 69 Cb -0.21 -2.58 1.87 0.00 0.10 0.00 0.00 66.02 65.20 2ek5 s SER 69 CO 0.16 -0.70 2.19 0.00 0.98 0.00 0.00 173.24 175.88 2ek5 h ALA 70 N 2.09 1.51 -0.13 5.32 0.00 -1.93 0.14 119.26 126.26 2ek5 h ALA 70 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2ek5 h ALA 70 Cb 1.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2ek5 h ALA 70 CO 0.61 -0.14 0.00 1.04 0.00 0.00 0.00 179.25 180.75 2ek5 n GLN 71 N -3.60 1.72 0.06 0.00 6.02 -1.26 -4.40 117.38 115.92 2ek5 n GLN 71 Ca -0.01 -1.08 -0.11 0.00 -0.01 0.00 0.00 57.00 55.79 2ek5 n GLN 71 Cb 0.20 -1.42 -0.05 0.00 1.02 0.00 0.00 30.24 29.99 2ek5 n GLN 71 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ek5 h ALA 72 N 4.14 -0.18 -0.66 -1.58 0.00 -0.95 -1.99 119.26 118.05 2ek5 h ALA 72 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.04 2ek5 h ALA 72 Cb 0.50 0.24 -0.10 0.00 0.00 0.00 0.00 17.79 18.43 2ek5 h ALA 72 CO 0.00 -0.64 0.15 -1.35 0.00 0.00 0.00 179.25 177.41 2ek5 h PRO 73 N -0.24 0.26 -0.24 0.00 0.11 -1.79 -0.17 132.00 129.92 2ek5 h PRO 73 Ca 0.04 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.94 2ek5 h PRO 73 Cb 0.29 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.35 2ek5 h PRO 73 CO -0.12 0.17 -0.60 0.00 -0.21 0.00 0.00 178.00 177.23 2ek5 h ALA 74 N 1.54 0.46 -0.77 -0.75 0.00 -1.85 -1.47 119.26 116.42 2ek5 h ALA 74 Ca 0.36 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 2ek5 h ALA 74 Cb 0.56 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2ek5 h ALA 74 CO -0.45 0.69 0.29 -0.07 0.00 0.00 0.00 179.25 179.71 2ek5 h LEU 75 N 0.61 1.06 -0.57 0.00 3.38 -0.86 0.02 115.31 118.95 2ek5 h LEU 75 Ca -0.00 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 2ek5 h LEU 75 Cb 1.21 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 2ek5 h LEU 75 CO 0.13 0.95 -0.42 0.40 0.09 0.00 0.00 178.44 179.59 2ek5 h ILE 76 N 1.12 1.30 -0.32 1.22 2.04 -0.99 -1.06 117.51 120.82 2ek5 h ILE 76 Ca 0.25 -1.61 -0.12 0.00 1.00 0.00 0.00 64.86 64.38 2ek5 h ILE 76 Cb 0.23 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 2ek5 h ILE 76 CO -0.02 0.51 -0.31 -0.09 0.00 0.00 0.00 178.15 178.24 2ek5 h ARG 77 N 0.54 0.68 -0.20 2.37 1.12 -0.88 -2.08 114.38 115.93 2ek5 h ARG 77 Ca 0.04 -0.31 -0.02 0.00 -1.11 0.00 0.00 59.98 58.58 2ek5 h ARG 77 Cb 0.96 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.90 2ek5 h ARG 77 CO 0.09 0.91 0.03 1.49 -3.11 0.00 0.00 179.97 179.38 2ek5 h GLU 78 N 0.58 0.33 -0.84 0.20 4.81 -0.78 -1.87 114.58 117.00 2ek5 h GLU 78 Ca 0.07 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2ek5 h GLU 78 Cb 0.82 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.12 2ek5 h GLU 78 CO 0.07 0.49 0.56 0.00 -0.73 0.00 0.00 179.01 179.39 2ek5 h ARG 79 N 0.13 1.11 0.00 1.92 3.08 -1.11 -2.26 114.38 117.24 2ek5 h ARG 79 Ca 0.06 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 2ek5 h ARG 79 Cb 0.31 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2ek5 h ARG 79 CO 0.00 0.73 -0.34 0.00 -1.07 0.00 0.00 179.97 179.30 2ek5 h ARG 80 N 1.14 0.00 -0.19 0.04 3.08 -1.24 -0.78 114.38 116.43 2ek5 h ARG 80 Ca 0.31 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.19 2ek5 h ARG 80 Cb -0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.93 2ek5 h ARG 80 CO -0.07 0.34 -0.53 -0.44 -1.07 0.00 0.00 179.97 178.20 2ek5 h ASP 81 N 0.00 0.80 -0.62 7.04 3.32 -1.00 -1.45 116.42 124.51 2ek5 h ASP 81 Ca -0.00 -0.58 0.00 0.00 0.02 0.00 0.00 57.03 56.47 2ek5 h ASP 81 Cb 0.87 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.16 2ek5 h ASP 81 CO 0.04 1.24 0.40 0.00 -1.72 0.00 0.00 179.24 179.20 2ek5 h ALA 82 N 0.58 0.79 -0.49 3.45 0.00 -1.15 0.33 119.26 122.78 2ek5 h ALA 82 Ca -0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2ek5 h ALA 82 Cb 1.15 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2ek5 h ALA 82 CO 0.11 0.25 0.29 0.00 0.00 0.00 0.00 179.25 179.91 2ek5 h ALA 83 N 1.21 0.63 -0.45 0.00 0.00 -1.07 0.87 119.26 120.45 2ek5 h ALA 83 Ca 0.23 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2ek5 h ALA 83 Cb -0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2ek5 h ALA 83 CO -0.05 0.12 0.27 0.35 0.00 0.00 0.00 179.25 179.94 2ek5 h PHE 84 N 0.66 0.59 -0.46 0.00 3.57 -0.59 -0.25 116.94 120.46 2ek5 h PHE 84 Ca 0.18 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2ek5 h PHE 84 Cb -0.00 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 2ek5 h PHE 84 CO -0.03 0.41 0.30 0.00 -2.23 0.00 0.00 178.31 176.77 2ek5 h ALA 85 N 1.13 0.58 -0.27 2.41 0.00 0.16 -0.20 119.26 123.07 2ek5 h ALA 85 Ca 0.16 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2ek5 h ALA 85 Cb -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2ek5 h ALA 85 CO -0.03 0.03 -0.34 0.00 0.00 0.00 0.00 179.25 178.91 2ek5 h ALA 86 N 1.16 0.91 0.16 0.00 0.00 -0.61 0.33 119.26 121.21 2ek5 h ALA 86 Ca 0.17 -0.41 -0.21 0.00 0.00 0.00 0.00 54.91 54.46 2ek5 h ALA 86 Cb -0.06 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 17.63 2ek5 h ALA 86 CO -0.04 0.62 -0.94 1.15 0.00 0.00 0.00 179.25 180.04 2ek5 h THR 87 N 0.50 1.46 0.00 0.00 2.02 -0.84 -3.40 112.91 112.64 2ek5 h THR 87 Ca 0.05 -2.56 -0.18 0.00 0.77 0.00 0.00 66.41 64.49 2ek5 h THR 87 Cb 0.82 3.17 -0.03 0.00 -1.74 0.00 0.00 68.15 70.37 2ek5 h THR 87 CO 0.07 0.73 -1.68 -1.22 0.37 0.00 0.00 175.52 173.79 2ek5 n TYR 88 N -4.05 0.00 -0.00 3.16 4.02 -0.11 -4.66 117.16 115.52 2ek5 n TYR 88 Ca -0.15 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.65 2ek5 n TYR 88 Cb 0.87 -0.47 -0.07 0.00 -0.02 0.00 0.00 39.34 39.66 2ek5 n TYR 88 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2ek5 h VAL 89 N 0.00 0.86 -0.56 -0.72 2.07 -1.37 -3.13 116.25 113.39 2ek5 h VAL 89 Ca -0.27 -1.40 0.11 0.00 0.82 0.00 0.00 66.70 65.96 2ek5 h VAL 89 Cb 1.45 1.54 -0.11 0.00 -1.52 0.00 0.00 31.29 32.65 2ek5 h VAL 89 CO -0.03 0.26 -0.14 0.00 0.02 0.00 0.00 177.57 177.68 2ek5 h ALA 90 N -0.42 0.38 -0.57 1.67 0.00 -0.60 -0.96 119.26 118.76 2ek5 h ALA 90 Ca -0.01 0.22 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 2ek5 h ALA 90 Cb 0.52 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2ek5 h ALA 90 CO 0.02 -0.43 0.02 -1.00 0.00 0.00 0.00 179.25 177.86 2ek5 h PRO 91 N 0.00 0.96 -0.57 0.00 0.13 -1.78 -1.87 132.00 128.87 2ek5 h PRO 91 Ca 0.27 -0.27 0.04 0.00 -0.87 0.00 0.00 66.00 65.17 2ek5 h PRO 91 Cb 0.41 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.40 2ek5 h PRO 91 CO -0.58 0.93 0.32 1.25 -0.23 0.00 0.00 178.00 179.69 2ek5 h LEU 92 N 0.89 0.48 -0.07 1.56 5.85 -1.20 -0.61 115.31 122.20 2ek5 h LEU 92 Ca 0.17 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2ek5 h LEU 92 Cb 0.49 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 2ek5 h LEU 92 CO 0.02 0.33 0.03 0.40 -0.34 0.00 0.00 178.44 178.88 2ek5 h ILE 93 N 0.61 1.15 -0.61 4.05 1.08 -0.97 0.21 117.51 123.04 2ek5 h ILE 93 Ca 0.25 -0.46 -0.07 0.00 -0.39 0.00 0.00 64.86 64.19 2ek5 h ILE 93 Cb 0.11 1.32 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 2ek5 h ILE 93 CO -0.14 0.13 0.10 0.44 -0.69 0.00 0.00 178.15 177.99 2ek5 h ASP 94 N -0.05 0.93 -0.33 1.72 3.32 -1.13 -1.26 116.42 119.62 2ek5 h ASP 94 Ca 0.02 -0.21 -0.14 0.00 0.02 0.00 0.00 57.03 56.73 2ek5 h ASP 94 Cb 0.18 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 2ek5 h ASP 94 CO -0.00 0.93 -0.32 -0.08 -1.72 0.00 0.00 179.24 178.05 2ek5 h GLU 95 N 0.93 0.86 -0.79 3.56 4.57 -1.07 -2.19 114.58 120.43 2ek5 h GLU 95 Ca 0.19 -0.41 0.03 0.00 -1.18 0.00 0.00 59.36 57.99 2ek5 h GLU 95 Cb 0.40 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.93 2ek5 h GLU 95 CO 0.01 1.05 0.50 1.03 -1.18 0.00 0.00 179.01 180.43 2ek5 h SER 96 N 0.72 0.83 -0.32 1.04 0.87 -0.46 -1.27 113.55 114.96 2ek5 h SER 96 Ca 0.07 -0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.50 2ek5 h SER 96 Cb 0.89 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 2ek5 h SER 96 CO 0.08 0.57 -0.30 0.40 -0.53 0.00 0.00 176.83 177.05 2ek5 h ILE 97 N 0.98 1.29 -0.38 2.23 2.04 -1.12 -0.03 117.51 122.52 2ek5 h ILE 97 Ca 0.32 -1.47 -0.00 0.00 1.00 0.00 0.00 64.86 64.71 2ek5 h ILE 97 Cb 0.03 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 2ek5 h ILE 97 CO -0.12 0.48 0.22 -0.74 0.00 0.00 0.00 178.15 177.98 2ek5 h HIS 98 N 0.54 0.49 -0.01 1.37 2.76 -0.98 -2.00 115.15 117.32 2ek5 h HIS 98 Ca 0.05 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2ek5 h HIS 98 Cb 0.88 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 29.67 2ek5 h HIS 98 CO 0.07 0.34 -0.14 1.28 -1.30 0.00 0.00 177.93 178.17 2ek5 n LEU 99 N -4.45 1.25 -0.35 0.26 7.99 -0.52 -4.96 117.00 116.22 2ek5 n LEU 99 Ca 0.03 -0.37 0.00 0.00 -0.01 0.00 0.00 56.01 55.65 2ek5 n LEU 99 Cb 0.09 -0.07 0.00 0.00 -0.11 0.00 0.00 43.42 43.33 2ek5 n LEU 99 CO 0.36 0.22 0.00 0.61 -1.51 0.00 0.00 177.39 177.07 2ek5 n GLY 100 N 1.27 0.79 3.80 -0.72 0.00 -0.75 -5.05 105.19 104.52 2ek5 n GLY 100 Ca 0.15 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 2ek5 n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ek5 s PHE 101 N -2.70 3.49 0.52 1.61 0.08 -0.08 -5.04 117.98 115.87 2ek5 s PHE 101 Ca 0.00 0.42 -0.17 0.00 0.12 0.00 0.00 56.93 57.30 2ek5 s PHE 101 Cb 0.00 -2.05 -0.07 0.00 -0.57 0.00 0.00 43.02 40.32 2ek5 s PHE 101 CO 0.00 0.50 1.00 -0.08 -0.10 0.00 0.00 175.22 176.54 2ek5 s THR 102 N -0.30 4.27 0.29 0.64 -1.32 -1.26 -4.51 115.64 113.45 2ek5 s THR 102 Ca 0.11 1.15 0.01 0.00 -1.21 0.00 0.00 61.69 61.75 2ek5 s THR 102 Cb -0.11 -3.60 0.29 0.00 -1.51 0.00 0.00 72.50 67.56 2ek5 s THR 102 CO 0.01 -0.56 1.86 -0.09 -2.21 0.00 0.00 174.62 173.63 2ek5 h ARG 103 N 0.97 0.98 -0.92 7.08 2.43 -1.98 -0.40 114.38 122.54 2ek5 h ARG 103 Ca -0.47 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 58.66 2ek5 h ARG 103 Cb 1.20 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.48 2ek5 h ARG 103 CO 0.60 0.65 0.60 0.00 -1.51 0.00 0.00 179.97 180.31 2ek5 h ALA 104 N 1.52 1.19 -0.70 2.80 0.00 -2.00 -1.53 119.26 120.55 2ek5 h ALA 104 Ca 0.46 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.27 2ek5 h ALA 104 Cb 0.39 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2ek5 h ALA 104 CO -0.22 0.52 0.24 -0.09 0.00 0.00 0.00 179.25 179.70 2ek5 h ARG 105 N 1.20 1.06 -0.44 0.00 9.65 -1.46 -2.14 114.38 122.25 2ek5 h ARG 105 Ca 0.35 -0.20 -0.10 0.00 -1.10 0.00 0.00 59.98 58.93 2ek5 h ARG 105 Cb -0.07 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.32 2ek5 h ARG 105 CO -0.10 0.89 -0.12 0.82 2.80 0.00 0.00 179.97 184.26 2ek5 h ILE 106 N 1.03 1.26 -0.65 1.20 1.08 -0.66 0.13 117.51 120.90 2ek5 h ILE 106 Ca 0.23 -1.20 -0.02 0.00 -0.39 0.00 0.00 64.86 63.49 2ek5 h ILE 106 Cb 0.25 1.05 -0.03 0.00 -3.07 0.00 0.00 36.82 35.02 2ek5 h ILE 106 CO -0.01 0.41 0.34 0.45 -0.69 0.00 0.00 178.15 178.65 2ek5 h HIS 107 N 0.73 0.91 -0.43 1.37 3.86 -0.91 -0.10 115.15 120.57 2ek5 h HIS 107 Ca 0.12 -0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.22 2ek5 h HIS 107 Cb 0.61 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.78 2ek5 h HIS 107 CO 0.03 0.66 -0.07 0.00 0.86 0.00 0.00 177.93 179.42 2ek5 h ALA 108 N 1.16 1.07 -0.45 2.45 0.00 -1.03 -2.57 119.26 119.89 2ek5 h ALA 108 Ca 0.23 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 2ek5 h ALA 108 Cb 0.07 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2ek5 h ALA 108 CO -0.03 0.58 -0.14 1.25 0.00 0.00 0.00 179.25 180.90 2ek5 h LEU 109 N 0.69 0.84 -0.43 0.00 5.85 -0.41 0.40 115.31 122.26 2ek5 h LEU 109 Ca 0.12 -0.28 0.06 0.00 0.84 0.00 0.00 57.88 58.63 2ek5 h LEU 109 Cb 0.52 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 2ek5 h LEU 109 CO 0.03 0.99 0.11 -0.07 -0.34 0.00 0.00 178.44 179.16 2ek5 h LEU 110 N 0.75 0.05 -0.54 2.25 4.07 -0.65 -0.45 115.31 120.79 2ek5 h LEU 110 Ca 0.12 0.07 -0.15 0.00 0.08 0.00 0.00 57.88 57.99 2ek5 h LEU 110 Cb 0.66 0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.47 2ek5 h LEU 110 CO 0.05 0.06 -0.46 0.44 -1.08 0.00 0.00 178.44 177.45 2ek5 h ASP 111 N 0.25 0.71 0.29 -0.43 3.32 -1.14 -1.78 116.42 117.63 2ek5 h ASP 111 Ca 0.21 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 2ek5 h ASP 111 Cb 0.24 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 2ek5 h ASP 111 CO -0.25 1.06 -0.16 1.56 -1.72 0.00 0.00 179.24 179.73 2ek5 h GLN 112 N 0.52 -0.41 -0.78 3.56 4.20 -0.43 0.21 115.11 121.99 2ek5 h GLN 112 Ca 0.03 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2ek5 h GLN 112 Cb 1.00 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.84 2ek5 h GLN 112 CO 0.09 -0.27 0.50 0.28 -0.67 0.00 0.00 178.83 178.76 2ek5 h VAL 113 N -0.43 1.20 -0.14 -0.54 2.07 -1.10 0.13 116.25 117.45 2ek5 h VAL 113 Ca -0.03 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2ek5 h VAL 113 Cb 0.34 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2ek5 h VAL 113 CO 0.05 0.20 0.05 0.00 0.02 0.00 0.00 177.57 177.89 2ek5 h ALA 114 N 1.49 0.18 -0.49 1.67 0.00 -0.82 -2.68 119.26 118.62 2ek5 h ALA 114 Ca 0.28 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2ek5 h ALA 114 Cb -0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2ek5 h ALA 114 CO -0.06 -0.21 0.17 0.93 0.00 0.00 0.00 179.25 180.08 2ek5 h GLU 115 N 0.05 0.71 -0.20 0.00 5.08 -0.01 -1.11 114.58 119.10 2ek5 h GLU 115 Ca 0.04 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2ek5 h GLU 115 Cb 0.21 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2ek5 h GLU 115 CO -0.00 0.61 0.05 0.66 -1.00 0.00 0.00 179.01 179.33 2ek5 h SER 116 N 0.70 0.24 0.69 1.42 4.64 -0.49 0.75 113.55 121.50 2ek5 h SER 116 Ca 0.16 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2ek5 h SER 116 Cb 0.19 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2ek5 h SER 116 CO -0.01 0.25 -0.09 -1.14 -0.87 0.00 0.00 176.83 174.97 2ek5 n ARG 117 N -4.43 0.25 0.00 4.77 0.63 -0.78 -4.92 116.66 112.19 2ek5 n ARG 117 Ca -0.00 -0.05 0.00 0.00 -0.92 0.00 0.00 57.85 56.88 2ek5 n ARG 117 Cb 0.14 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.55 2ek5 n ARG 117 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ek5 n GLY 118 N 1.40 0.77 3.56 5.14 0.00 0.26 -5.03 105.19 111.28 2ek5 n GLY 118 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2ek5 n GLY 118 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ek5 s LEU 119 N 0.00 3.38 0.00 0.99 1.43 -0.49 -4.94 118.68 119.05 2ek5 s LEU 119 Ca 0.00 -1.12 0.00 0.00 -1.03 0.00 0.00 54.13 51.98 2ek5 s LEU 119 Cb 0.00 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.65 2ek5 s LEU 119 CO 0.00 -1.93 0.00 -1.22 0.23 0.00 0.00 176.35 173.43