#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2be6 s THR 5 N 0.00 3.92 0.19 -5.08 2.01 -1.26 -4.93 115.64 110.49 2be6 s THR 5 Ca 0.00 1.38 -0.15 0.00 0.31 0.00 0.00 61.69 63.23 2be6 s THR 5 Cb 0.00 -3.67 0.16 0.00 0.01 0.00 0.00 72.50 69.01 2be6 s THR 5 CO 0.00 -0.08 1.65 -0.08 -0.69 0.00 0.00 174.62 175.42 2be6 h GLU 6 N 2.31 -0.00 -0.66 4.92 4.57 -2.06 0.14 114.58 123.80 2be6 h GLU 6 Ca -0.48 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 57.63 2be6 h GLU 6 Cb 1.21 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.77 2be6 h GLU 6 CO 0.62 -0.00 0.15 0.93 -1.18 0.00 0.00 179.01 179.52 2be6 h GLU 7 N -0.00 1.05 -0.42 1.92 3.07 -1.99 -0.87 114.58 117.35 2be6 h GLU 7 Ca 0.25 -0.25 0.05 0.00 -0.50 0.00 0.00 59.36 58.91 2be6 h GLU 7 Cb 0.38 -0.14 -0.05 0.00 -0.84 0.00 0.00 28.75 28.10 2be6 h GLU 7 CO -0.53 0.94 0.14 1.96 -1.40 0.00 0.00 179.01 180.12 2be6 h GLN 8 N 1.00 0.30 -0.57 2.33 4.20 -1.82 -1.35 115.11 119.20 2be6 h GLN 8 Ca 0.21 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 2be6 h GLN 8 Cb 0.37 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 2be6 h GLN 8 CO 0.00 0.20 0.30 0.82 -0.67 0.00 0.00 178.83 179.48 2be6 h ILE 9 N 0.31 1.19 -0.83 2.54 2.04 -0.26 -1.53 117.51 120.97 2be6 h ILE 9 Ca 0.19 -0.51 0.08 0.00 1.00 0.00 0.00 64.86 65.62 2be6 h ILE 9 Cb 0.18 0.48 -0.07 0.00 -0.74 0.00 0.00 36.82 36.68 2be6 h ILE 9 CO -0.20 0.21 0.49 0.00 0.00 0.00 0.00 178.15 178.66 2be6 h ALA 10 N 1.13 1.17 -0.60 1.87 0.00 -0.99 -1.05 119.26 120.79 2be6 h ALA 10 Ca 0.20 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 2be6 h ALA 10 Cb 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2be6 h ALA 10 CO -0.03 0.17 0.10 0.93 0.00 0.00 0.00 179.25 180.42 2be6 h GLU 11 N 0.86 0.99 -0.06 0.00 4.39 -0.87 -2.76 114.58 117.12 2be6 h GLU 11 Ca 0.39 -0.26 -0.05 0.00 0.34 0.00 0.00 59.36 59.77 2be6 h GLU 11 Cb 0.29 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 2be6 h GLU 11 CO -0.22 0.93 -0.22 0.74 -1.16 0.00 0.00 179.01 179.08 2be6 h PHE 12 N 0.89 0.10 -0.40 4.33 0.05 -0.79 -2.19 116.94 118.93 2be6 h PHE 12 Ca 0.18 -0.01 -0.05 0.00 3.82 0.00 0.00 57.97 61.91 2be6 h PHE 12 Cb 0.41 -0.03 -0.02 0.00 2.00 0.00 0.00 35.95 38.32 2be6 h PHE 12 CO 0.03 0.31 0.06 -0.22 -0.18 0.00 0.00 178.31 178.31 2be6 h LYS 13 N 0.09 0.67 -0.82 1.51 1.63 -0.94 0.22 116.57 118.93 2be6 h LYS 13 Ca 0.02 -0.18 0.03 0.00 -0.85 0.00 0.00 60.65 59.66 2be6 h LYS 13 Cb 0.44 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 31.95 2be6 h LYS 13 CO 0.03 0.72 0.54 0.93 -3.45 0.00 0.00 179.45 178.22 2be6 h GLU 14 N 0.52 1.00 -0.25 1.90 5.08 -1.21 -1.19 114.58 120.42 2be6 h GLU 14 Ca 0.12 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2be6 h GLU 14 Cb 0.38 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2be6 h GLU 14 CO 0.01 0.66 0.11 0.00 -1.00 0.00 0.00 179.01 178.79 2be6 h ALA 15 N 1.52 0.33 -0.98 3.43 0.00 -1.05 -2.93 119.26 119.58 2be6 h ALA 15 Ca 0.32 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2be6 h ALA 15 Cb 0.01 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2be6 h ALA 15 CO -0.09 -0.09 0.62 0.35 0.00 0.00 0.00 179.25 180.04 2be6 h PHE 16 N 0.27 1.26 0.00 0.00 3.57 -0.62 -1.94 116.94 119.48 2be6 h PHE 16 Ca 0.09 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 2be6 h PHE 16 Cb 0.15 -0.42 -0.00 0.00 2.79 0.00 0.00 35.95 38.46 2be6 h PHE 16 CO -0.02 0.81 -0.04 0.77 -2.23 0.00 0.00 178.31 177.61 2be6 h SER 17 N 1.34 0.00 1.03 0.41 0.02 -1.06 0.26 113.55 115.55 2be6 h SER 17 Ca 0.36 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.27 2be6 h SER 17 Cb -0.11 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2be6 h SER 17 CO -0.07 0.04 -0.19 -0.07 -1.14 0.00 0.00 176.83 175.39 2be6 h LEU 18 N 0.00 0.00 0.02 5.07 3.38 -1.17 -3.26 115.31 119.35 2be6 h LEU 18 Ca -0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2be6 h LEU 18 Cb 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2be6 h LEU 18 CO 0.00 0.19 -1.86 0.49 0.09 0.00 0.00 178.44 177.35 2be6 n PHE 19 N -3.32 0.68 -1.95 1.13 3.01 -0.72 -4.66 117.46 111.63 2be6 n PHE 19 Ca 0.01 0.25 -0.42 0.00 1.01 0.00 0.00 57.45 58.29 2be6 n PHE 19 Cb 0.43 -1.07 -0.01 0.00 -0.01 0.00 0.00 39.48 38.82 2be6 n PHE 19 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2be6 n ASP 20 N -4.12 4.05 0.22 4.37 2.03 0.00 -4.75 116.55 118.35 2be6 n ASP 20 Ca -0.40 -2.85 0.10 0.00 0.52 0.00 0.00 54.79 52.17 2be6 n ASP 20 Cb 0.83 -1.65 0.38 0.00 -0.72 0.00 0.00 41.12 39.96 2be6 n ASP 20 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2be6 h LYS 21 N 6.78 0.00 -0.17 -0.67 1.57 -1.83 -2.43 116.57 119.83 2be6 h LYS 21 Ca 0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 2be6 h LYS 21 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2be6 h LYS 21 CO 1.74 0.21 0.00 -0.40 -0.57 0.00 0.00 179.45 180.43 2be6 n ASP 22 N -3.28 1.60 -1.93 0.86 5.68 -1.26 -4.95 116.55 113.27 2be6 n ASP 22 Ca 0.01 -1.71 -0.19 0.00 -0.50 0.00 0.00 54.79 52.41 2be6 n ASP 22 Cb 0.48 -0.11 -0.05 0.00 -1.14 0.00 0.00 41.12 40.30 2be6 n ASP 22 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2be6 n GLY 23 N 1.11 0.78 0.24 6.12 0.00 -0.91 -4.87 105.19 107.65 2be6 n GLY 23 Ca 0.16 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.32 2be6 n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2be6 n ASP 24 N -1.50 0.83 0.00 1.61 3.85 -1.26 -4.93 116.55 115.14 2be6 n ASP 24 Ca -0.20 -1.01 0.00 0.00 -0.71 0.00 0.00 54.79 52.87 2be6 n ASP 24 Cb 0.64 -0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.41 2be6 n ASP 24 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2be6 n GLY 25 N 1.21 0.75 3.02 6.12 0.00 -1.26 -5.06 105.19 109.96 2be6 n GLY 25 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 2be6 n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2be6 s THR 26 N -2.37 0.48 -0.19 2.61 -4.23 -1.26 -4.08 115.64 106.61 2be6 s THR 26 Ca 0.00 -0.72 -0.12 0.00 -1.18 0.00 0.00 61.69 59.67 2be6 s THR 26 Cb 0.00 -0.49 -0.05 0.00 1.34 0.00 0.00 72.50 73.30 2be6 s THR 26 CO 0.00 -0.17 0.22 -0.63 -0.54 0.00 0.00 174.62 173.50 2be6 s ILE 27 N -0.85 5.34 0.40 2.99 1.01 0.12 -4.71 121.20 125.50 2be6 s ILE 27 Ca -0.05 0.38 0.08 0.00 0.00 0.00 0.00 60.65 61.05 2be6 s ILE 27 Cb -0.07 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.83 2be6 s ILE 27 CO 0.00 0.39 0.43 0.42 0.00 0.00 0.00 174.94 176.18 2be6 s THR 28 N 0.59 2.95 0.38 2.92 -4.23 -1.26 -0.56 115.64 116.44 2be6 s THR 28 Ca 0.12 -1.23 0.06 0.00 -1.18 0.00 0.00 61.69 59.47 2be6 s THR 28 Cb -0.12 -3.05 0.28 0.00 1.34 0.00 0.00 72.50 70.95 2be6 s THR 28 CO 0.02 -0.03 2.01 0.71 -0.54 0.00 0.00 174.62 176.79 2be6 h THR 29 N 0.94 1.07 -0.36 3.99 1.35 -1.89 -1.61 112.91 116.39 2be6 h THR 29 Ca -0.42 -0.23 -0.10 0.00 -0.55 0.00 0.00 66.41 65.11 2be6 h THR 29 Cb 1.27 0.34 -0.01 0.00 -1.73 0.00 0.00 68.15 68.01 2be6 h THR 29 CO 0.54 0.12 -0.16 0.50 -0.25 0.00 0.00 175.52 176.27 2be6 h LYS 30 N 0.67 0.75 -0.76 4.72 3.11 -1.96 0.31 116.57 123.41 2be6 h LYS 30 Ca 0.24 -0.32 -0.01 0.00 -2.81 0.00 0.00 60.65 57.74 2be6 h LYS 30 Cb 0.10 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 31.27 2be6 h LYS 30 CO -0.06 0.93 0.42 0.93 -2.81 0.00 0.00 179.45 178.86 2be6 h GLU 31 N 0.54 1.05 -0.30 1.90 5.08 -1.81 -0.74 114.58 120.30 2be6 h GLU 31 Ca 0.08 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2be6 h GLU 31 Cb 0.70 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2be6 h GLU 31 CO 0.05 0.77 -0.06 1.25 -1.00 0.00 0.00 179.01 180.02 2be6 h LEU 32 N 1.06 0.58 -0.97 1.33 6.46 -1.12 -2.96 115.31 119.69 2be6 h LEU 32 Ca 0.27 -0.36 0.08 0.00 -0.12 0.00 0.00 57.88 57.75 2be6 h LEU 32 Cb 0.03 -0.16 -0.07 0.00 -0.73 0.00 0.00 40.66 39.73 2be6 h LEU 32 CO -0.04 0.80 0.61 1.23 -0.62 0.00 0.00 178.44 180.42 2be6 h GLY 33 N 0.35 1.49 0.96 3.75 0.00 -0.69 -1.43 103.07 107.49 2be6 h GLY 33 Ca 0.08 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.97 2be6 h GLY 33 CO 0.03 0.28 -0.00 -0.84 0.00 0.00 0.00 176.54 176.01 2be6 h THR 34 N 1.09 0.98 -0.09 4.70 2.02 -1.01 0.83 112.91 121.43 2be6 h THR 34 Ca 0.43 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.60 2be6 h THR 34 Cb 0.23 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2be6 h THR 34 CO -0.19 0.00 0.03 0.58 0.37 0.00 0.00 175.52 176.31 2be6 h VAL 35 N 0.00 1.15 -0.70 3.16 2.07 -1.36 -1.39 116.25 119.18 2be6 h VAL 35 Ca 0.01 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 67.16 2be6 h VAL 35 Cb 0.01 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 2be6 h VAL 35 CO -0.02 0.13 0.38 0.24 0.02 0.00 0.00 177.57 178.32 2be6 h MET 36 N -0.02 0.67 -0.19 1.57 2.07 -1.15 -2.21 114.93 115.67 2be6 h MET 36 Ca 0.03 -0.04 -0.07 0.00 -2.07 0.00 0.00 59.70 57.55 2be6 h MET 36 Cb 0.17 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 29.74 2be6 h MET 36 CO -0.00 0.44 -0.19 0.00 1.07 0.00 0.00 176.91 178.23 2be6 h ARG 37 N 0.69 0.32 -0.39 1.72 3.08 -0.62 -2.04 114.38 117.14 2be6 h ARG 37 Ca 0.32 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 2be6 h ARG 37 Cb 0.23 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2be6 h ARG 37 CO -0.20 0.51 0.14 0.66 -1.07 0.00 0.00 179.97 180.00 2be6 h SER 38 N 0.30 0.50 0.00 7.04 4.64 -0.62 -0.43 113.55 124.98 2be6 h SER 38 Ca 0.05 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2be6 h SER 38 Cb 0.51 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2be6 h SER 38 CO 0.03 0.48 0.00 0.18 -0.87 0.00 0.00 176.83 176.65 2be6 n LEU 39 N -4.37 0.00 0.00 5.97 4.77 -0.81 -4.66 117.00 117.90 2be6 n LEU 39 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2be6 n LEU 39 Cb 0.16 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2be6 n LEU 39 CO 0.37 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 2be6 n GLY 40 N 0.65 0.76 3.92 -0.72 0.00 -0.17 -5.06 105.19 104.56 2be6 n GLY 40 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 2be6 n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2be6 s GLN 41 N -0.56 3.53 -0.42 1.61 -0.21 -0.94 -5.00 119.66 117.67 2be6 s GLN 41 Ca 0.00 -0.02 0.08 0.00 0.02 0.00 0.00 55.36 55.44 2be6 s GLN 41 Cb 0.00 -2.51 0.27 0.00 1.00 0.00 0.00 33.01 31.77 2be6 s GLN 41 CO 0.00 -0.03 0.60 -1.71 -2.12 0.00 0.00 175.29 172.03 2be6 n ASN 42 N -1.94 0.85 -4.76 5.90 4.05 -1.26 -3.73 115.26 114.37 2be6 n ASN 42 Ca -0.02 -2.87 -0.41 0.00 0.45 0.00 0.00 54.58 51.74 2be6 n ASN 42 Cb 0.55 -0.64 -0.03 0.00 1.23 0.00 0.00 39.78 40.90 2be6 n ASN 42 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2be6 s PRO 43 N -1.64 4.46 0.97 1.20 0.04 -1.26 -5.02 135.00 133.74 2be6 s PRO 43 Ca 0.37 2.05 -0.12 0.00 0.04 0.00 0.00 61.00 63.34 2be6 s PRO 43 Cb 0.21 -3.14 0.18 0.00 0.04 0.00 0.00 34.50 31.78 2be6 s PRO 43 CO -0.09 -0.07 1.09 0.95 0.04 0.00 0.00 177.00 178.91 2be6 s THR 44 N -0.88 2.36 0.29 1.26 -4.23 -1.26 -4.86 115.64 108.32 2be6 s THR 44 Ca 0.49 0.12 -0.01 0.00 -1.18 0.00 0.00 61.69 61.10 2be6 s THR 44 Cb -0.36 -2.40 0.19 0.00 1.34 0.00 0.00 72.50 71.27 2be6 s THR 44 CO 0.46 -0.15 1.88 -0.33 -0.54 0.00 0.00 174.62 175.94 2be6 h GLU 45 N -1.91 0.91 -0.63 3.99 4.39 -1.99 -1.57 114.58 117.76 2be6 h GLU 45 Ca -0.52 -0.13 -0.09 0.00 0.34 0.00 0.00 59.36 58.96 2be6 h GLU 45 Cb 1.30 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.76 2be6 h GLU 45 CO 0.51 0.73 0.05 0.00 -1.16 0.00 0.00 179.01 179.14 2be6 h ALA 46 N 1.40 0.89 -0.48 3.43 0.00 -2.00 -1.78 119.26 120.73 2be6 h ALA 46 Ca 0.22 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2be6 h ALA 46 Cb 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2be6 h ALA 46 CO -0.02 0.66 0.16 0.93 0.00 0.00 0.00 179.25 180.98 2be6 h GLU 47 N 0.99 0.73 -0.58 0.00 5.08 -1.86 -1.03 114.58 117.93 2be6 h GLU 47 Ca 0.19 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2be6 h GLU 47 Cb 0.50 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 2be6 h GLU 47 CO 0.02 0.69 0.24 -0.07 -1.00 0.00 0.00 179.01 178.89 2be6 h LEU 48 N 0.63 0.75 -0.04 1.33 3.38 -1.18 -0.96 115.31 119.23 2be6 h LEU 48 Ca 0.15 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2be6 h LEU 48 Cb 0.26 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2be6 h LEU 48 CO -0.01 0.67 0.00 -0.61 0.09 0.00 0.00 178.44 178.58 2be6 h GLN 49 N 0.82 0.07 -0.44 1.13 5.75 -1.10 -1.46 115.11 119.88 2be6 h GLN 49 Ca 0.20 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.73 2be6 h GLN 49 Cb 0.14 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 28.64 2be6 h GLN 49 CO -0.02 0.35 0.17 0.22 -2.65 0.00 0.00 178.83 176.89 2be6 h ASP 50 N -0.22 0.20 -0.34 -0.69 3.58 -0.75 0.21 116.42 118.42 2be6 h ASP 50 Ca 0.01 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 2be6 h ASP 50 Cb 0.31 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.37 2be6 h ASP 50 CO 0.00 0.15 0.16 0.24 -2.88 0.00 0.00 179.24 176.91 2be6 h MET 51 N 0.35 0.49 -0.42 0.28 2.86 -1.07 -2.67 114.93 114.75 2be6 h MET 51 Ca 0.20 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.78 2be6 h MET 51 Cb 0.18 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 2be6 h MET 51 CO -0.19 0.45 0.26 0.82 1.06 0.00 0.00 176.91 179.30 2be6 h ILE 52 N 0.41 1.07 -0.44 -1.22 1.08 -0.90 -2.93 117.51 114.58 2be6 h ILE 52 Ca 0.12 -0.18 0.07 0.00 -0.39 0.00 0.00 64.86 64.48 2be6 h ILE 52 Cb 0.12 0.50 -0.02 0.00 -3.07 0.00 0.00 36.82 34.35 2be6 h ILE 52 CO -0.01 0.10 0.30 -1.13 -0.69 0.00 0.00 178.15 176.71 2be6 h ASN 53 N 0.52 0.24 -1.00 1.72 -1.24 -0.35 -0.60 115.58 114.87 2be6 h ASN 53 Ca 0.16 0.00 0.08 0.00 0.71 0.00 0.00 56.30 57.25 2be6 h ASN 53 Cb -0.02 -0.05 -0.07 0.00 0.73 0.00 0.00 38.32 38.91 2be6 h ASN 53 CO -0.06 0.15 0.65 -0.08 -1.29 0.00 0.00 177.43 176.80 2be6 h GLU 54 N 0.27 1.11 0.00 6.67 4.81 -1.28 -2.88 114.58 123.28 2be6 h GLU 54 Ca 0.20 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2be6 h GLU 54 Cb 0.43 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2be6 h GLU 54 CO -0.04 0.73 -1.27 0.28 -0.73 0.00 0.00 179.01 177.98 2be6 n VAL 55 N -4.52 0.32 -2.60 0.32 0.31 -0.36 -4.79 118.33 107.00 2be6 n VAL 55 Ca 0.16 -0.44 -0.43 0.00 -0.01 0.00 0.00 64.34 63.62 2be6 n VAL 55 Cb 0.22 -0.08 -0.00 0.00 -0.91 0.00 0.00 33.84 33.06 2be6 n VAL 55 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2be6 s ASP 56 N -4.69 6.82 0.15 4.52 2.15 -0.44 -4.76 116.67 120.42 2be6 s ASP 56 Ca -0.01 -2.38 -0.17 0.00 0.43 0.00 0.00 52.55 50.42 2be6 s ASP 56 Cb 0.12 -2.57 0.05 0.00 -0.30 0.00 0.00 42.92 40.23 2be6 s ASP 56 CO 0.82 -1.18 1.73 0.00 -0.17 0.00 0.00 175.17 176.37 2be6 h ALA 57 N 7.78 0.33 -0.01 3.66 0.00 -1.86 -1.91 119.26 127.25 2be6 h ALA 57 Ca 0.41 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2be6 h ALA 57 Cb 0.89 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2be6 h ALA 57 CO 1.44 -0.36 -0.03 -0.40 0.00 0.00 0.00 179.25 179.90 2be6 n ASP 58 N -5.11 0.75 -0.99 0.00 5.75 -1.26 -4.94 116.55 110.75 2be6 n ASP 58 Ca 0.01 -1.10 -0.13 0.00 -0.01 0.00 0.00 54.79 53.55 2be6 n ASP 58 Cb 0.15 -0.01 -0.06 0.00 -1.03 0.00 0.00 41.12 40.17 2be6 n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2be6 n GLY 59 N 1.15 1.34 0.00 6.12 0.00 -0.72 -4.87 105.19 108.20 2be6 n GLY 59 Ca 0.19 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.10 2be6 n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2be6 n ASN 60 N -0.58 0.00 0.00 1.61 6.94 -1.26 -4.91 115.26 117.06 2be6 n ASN 60 Ca -0.13 -0.18 0.00 0.00 -0.02 0.00 0.00 54.58 54.25 2be6 n ASN 60 Cb 0.49 -0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.69 2be6 n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2be6 n GLY 61 N 0.51 0.44 3.34 4.83 0.00 -1.26 -5.06 105.19 107.99 2be6 n GLY 61 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 2be6 n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2be6 s THR 62 N -2.10 0.69 -0.21 2.61 -4.23 -1.26 -4.67 115.64 106.47 2be6 s THR 62 Ca 0.00 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.45 2be6 s THR 62 Cb 0.00 -2.67 -0.03 0.00 1.34 0.00 0.00 72.50 71.14 2be6 s THR 62 CO 0.00 -0.00 0.04 -0.63 -0.54 0.00 0.00 174.62 173.49 2be6 s ILE 63 N -3.66 4.26 0.50 2.99 1.01 0.28 -4.79 121.20 121.79 2be6 s ILE 63 Ca 0.38 -0.21 0.03 0.00 0.00 0.00 0.00 60.65 60.85 2be6 s ILE 63 Cb 0.08 -2.94 0.02 0.00 0.01 0.00 0.00 42.46 39.63 2be6 s ILE 63 CO 0.14 0.41 0.70 1.51 0.00 0.00 0.00 174.94 177.70 2be6 s ASP 64 N 1.03 5.43 0.17 3.58 3.84 -1.26 0.14 116.67 129.59 2be6 s ASP 64 Ca 0.03 -0.10 -0.14 0.00 -0.00 0.00 0.00 52.55 52.33 2be6 s ASP 64 Cb -0.14 -0.87 0.07 0.00 -1.38 0.00 0.00 42.92 40.60 2be6 s ASP 64 CO 0.02 -0.99 1.81 0.15 -0.00 0.00 0.00 175.17 176.16 2be6 h PHE 65 N 0.27 0.54 -0.93 2.11 -0.00 -2.00 -1.26 116.94 115.67 2be6 h PHE 65 Ca -0.42 0.02 0.12 0.00 -0.00 0.00 0.00 57.97 57.68 2be6 h PHE 65 Cb 1.29 -0.17 -0.08 0.00 -0.00 0.00 0.00 35.95 36.98 2be6 h PHE 65 CO 0.39 0.31 0.56 -1.35 -0.00 0.00 0.00 178.31 178.21 2be6 h PRO 66 N 0.57 0.86 -0.54 6.41 0.11 -1.96 0.44 132.00 137.90 2be6 h PRO 66 Ca 0.19 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.16 2be6 h PRO 66 Cb 0.00 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 30.90 2be6 h PRO 66 CO -0.08 0.57 0.00 0.93 -0.21 0.00 0.00 178.00 179.21 2be6 h GLU 67 N 0.88 0.91 -0.23 1.05 5.08 -1.82 -0.82 114.58 119.63 2be6 h GLU 67 Ca 0.46 -0.26 -0.04 0.00 -1.00 0.00 0.00 59.36 58.52 2be6 h GLU 67 Cb 0.47 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2be6 h GLU 67 CO -0.27 0.90 0.00 0.35 -1.00 0.00 0.00 179.01 179.00 2be6 h PHE 68 N 0.85 0.45 -0.32 4.33 3.57 -0.14 -2.31 116.94 123.36 2be6 h PHE 68 Ca 0.16 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.60 2be6 h PHE 68 Cb 0.49 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2be6 h PHE 68 CO 0.03 0.58 0.18 1.25 -2.23 0.00 0.00 178.31 178.12 2be6 h LEU 69 N 0.18 0.28 -0.42 0.59 5.85 -0.09 -2.92 115.31 118.79 2be6 h LEU 69 Ca 0.07 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.87 2be6 h LEU 69 Cb 0.40 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.30 2be6 h LEU 69 CO 0.01 0.21 -0.06 0.74 -0.34 0.00 0.00 178.44 179.00 2be6 h THR 70 N 0.37 0.62 -0.78 1.05 2.02 -1.05 0.61 112.91 115.74 2be6 h THR 70 Ca 0.13 -0.01 0.18 0.00 0.77 0.00 0.00 66.41 67.48 2be6 h THR 70 Cb 0.01 0.58 -0.12 0.00 -1.74 0.00 0.00 68.15 66.88 2be6 h THR 70 CO -0.07 0.01 0.15 -0.03 0.37 0.00 0.00 175.52 175.95 2be6 h MET 71 N 0.04 0.21 0.00 6.66 1.85 -1.26 -2.15 114.93 120.28 2be6 h MET 71 Ca 0.20 -0.01 -0.19 0.00 -0.61 0.00 0.00 59.70 59.09 2be6 h MET 71 Cb 0.31 -0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.26 2be6 h MET 71 CO -0.39 0.14 -0.98 0.52 -0.40 0.00 0.00 176.91 175.79 2be6 h MET 72 N 0.21 0.00 -0.11 0.39 2.07 -1.21 -1.59 114.93 114.69 2be6 h MET 72 Ca 0.45 0.00 0.03 0.00 -2.07 0.00 0.00 59.70 58.11 2be6 h MET 72 Cb 0.82 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.55 2be6 h MET 72 CO -0.59 0.79 0.57 0.00 1.07 0.00 0.00 176.91 178.75 2be6 h ALA 73 N 1.14 1.70 0.00 6.32 0.00 0.87 -3.28 119.26 126.01 2be6 h ALA 73 Ca -0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2be6 h ALA 73 Cb 1.70 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 2be6 h ALA 73 CO 0.10 -0.63 -0.25 2.89 0.00 0.00 0.00 179.25 181.36 2be6 n ARG 74 N -2.91 0.12 -1.23 0.00 1.85 -1.11 -5.07 116.66 108.31 2be6 n ARG 74 Ca 0.01 0.05 -0.35 0.00 -1.00 0.00 0.00 57.85 56.56 2be6 n ARG 74 Cb 0.64 -0.72 0.08 0.00 -1.05 0.00 0.00 32.46 31.41 2be6 n ARG 74 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2be6 n LYS 75 N -3.72 0.29 -0.07 2.89 5.02 -0.60 -5.14 118.16 116.83 2be6 n LYS 75 Ca -0.03 0.15 -0.05 0.00 -2.02 0.00 0.00 58.31 56.36 2be6 n LYS 75 Cb 0.13 -2.00 -0.16 0.00 -0.02 0.00 0.00 35.03 32.98 2be6 n LYS 75 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2be6 n GLU 82 N -1.38 0.68 -0.15 1.97 4.71 -1.26 -4.85 120.64 120.36 2be6 n GLU 82 Ca 0.11 -0.05 -0.08 0.00 -0.01 0.00 0.00 57.16 57.13 2be6 n GLU 82 Cb 0.50 -1.53 0.01 0.00 -1.01 0.00 0.00 31.44 29.41 2be6 n GLU 82 CO 0.00 0.00 0.00 1.05 0.09 0.00 0.00 177.13 178.27 2be6 h GLU 83 N 0.00 0.59 -0.20 3.49 -0.00 -2.05 -0.35 114.58 116.05 2be6 h GLU 83 Ca -0.40 -0.04 -0.18 0.00 -0.00 0.00 0.00 59.36 58.74 2be6 h GLU 83 Cb 1.92 -0.13 -0.00 0.00 -0.00 0.00 0.00 28.75 30.54 2be6 h GLU 83 CO 0.02 0.39 -0.62 0.93 -0.00 0.00 0.00 179.01 179.74 2be6 h GLU 84 N 0.60 0.70 -0.73 1.06 3.07 -2.05 -1.71 114.58 115.51 2be6 h GLU 84 Ca 0.16 -0.48 -0.06 0.00 -0.50 0.00 0.00 59.36 58.48 2be6 h GLU 84 Cb -0.06 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.89 2be6 h GLU 84 CO -0.03 1.10 0.23 0.82 -1.40 0.00 0.00 179.01 179.73 2be6 h ILE 85 N 0.52 1.26 -0.41 3.13 2.04 -1.95 -0.53 117.51 121.57 2be6 h ILE 85 Ca -0.01 -0.90 -0.10 0.00 1.00 0.00 0.00 64.86 64.86 2be6 h ILE 85 Cb 1.20 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 2be6 h ILE 85 CO 0.12 0.35 -0.17 0.03 0.00 0.00 0.00 178.15 178.49 2be6 h ARG 86 N 1.09 0.76 -0.09 2.37 3.08 -0.94 -0.44 114.38 120.22 2be6 h ARG 86 Ca 0.24 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2be6 h ARG 86 Cb 0.30 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 2be6 h ARG 86 CO -0.01 0.88 0.04 0.93 -1.07 0.00 0.00 179.97 180.75 2be6 h GLU 87 N 0.68 0.13 -0.29 0.04 5.08 -0.91 -1.81 114.58 117.49 2be6 h GLU 87 Ca 0.11 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 2be6 h GLU 87 Cb 0.66 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 2be6 h GLU 87 CO 0.05 0.21 0.08 0.00 -1.00 0.00 0.00 179.01 178.35 2be6 h ALA 88 N 0.91 0.32 -0.40 3.43 0.00 -0.87 -2.81 119.26 119.84 2be6 h ALA 88 Ca 0.03 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.07 2be6 h ALA 88 Cb 0.13 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 2be6 h ALA 88 CO -0.00 -0.33 -0.13 0.35 0.00 0.00 0.00 179.25 179.14 2be6 h PHE 89 N 0.20 -0.29 -0.04 0.00 3.04 -0.99 -2.01 116.94 116.85 2be6 h PHE 89 Ca 0.13 0.04 0.01 0.00 3.98 0.00 0.00 57.97 62.13 2be6 h PHE 89 Cb 0.12 0.19 -0.00 0.00 2.56 0.00 0.00 35.95 38.82 2be6 h PHE 89 CO -0.15 -0.21 0.03 0.00 -2.02 0.00 0.00 178.31 175.96 2be6 h ARG 90 N -0.04 0.01 -0.49 1.11 3.08 -1.10 0.30 114.38 117.25 2be6 h ARG 90 Ca 0.20 -0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.18 2be6 h ARG 90 Cb 0.34 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2be6 h ARG 90 CO -0.43 0.00 0.04 0.28 -1.07 0.00 0.00 179.97 178.79 2be6 h VAL 91 N 0.01 1.26 0.21 2.04 2.07 -1.12 -3.24 116.25 117.47 2be6 h VAL 91 Ca 0.02 -1.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 2be6 h VAL 91 Cb 0.06 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2be6 h VAL 91 CO -0.00 0.35 -0.10 -0.26 0.02 0.00 0.00 177.57 177.58 2be6 h PHE 92 N 0.70 -0.26 0.00 1.57 -1.00 -1.15 -3.37 116.94 113.43 2be6 h PHE 92 Ca 0.14 -0.01 -0.66 0.00 2.81 0.00 0.00 57.97 60.26 2be6 h PHE 92 Cb 0.45 0.08 -0.00 0.00 3.61 0.00 0.00 35.95 40.10 2be6 h PHE 92 CO 0.03 0.10 3.13 -3.47 -1.61 0.00 0.00 178.31 176.49 2be6 n ASP 93 N -5.04 4.89 0.27 2.17 2.03 0.97 -4.73 116.55 117.11 2be6 n ASP 93 Ca -0.09 -2.70 0.11 0.00 0.52 0.00 0.00 54.79 52.62 2be6 n ASP 93 Cb 0.25 -1.50 0.73 0.00 -0.72 0.00 0.00 41.12 39.88 2be6 n ASP 93 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2be6 h LYS 94 N 6.11 0.00 -0.53 -0.67 1.57 -1.74 -1.69 116.57 119.62 2be6 h LYS 94 Ca 0.61 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.39 2be6 h LYS 94 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2be6 h LYS 94 CO 1.84 0.03 0.00 -0.40 -0.57 0.00 0.00 179.45 180.35 2be6 n ASP 95 N -4.21 3.30 -1.50 0.86 3.85 -1.26 -4.96 116.55 112.63 2be6 n ASP 95 Ca -0.03 -1.97 -0.20 0.00 -0.71 0.00 0.00 54.79 51.88 2be6 n ASP 95 Cb 0.11 -0.35 -0.08 0.00 -1.35 0.00 0.00 41.12 39.45 2be6 n ASP 95 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2be6 n GLY 96 N 1.49 1.88 0.37 6.12 0.00 -0.64 -4.87 105.19 109.55 2be6 n GLY 96 Ca 0.20 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.27 2be6 n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2be6 n ASN 97 N -1.15 1.14 0.00 1.61 6.94 -1.26 -4.91 115.26 117.62 2be6 n ASN 97 Ca -0.20 -1.51 0.00 0.00 -0.02 0.00 0.00 54.58 52.86 2be6 n ASN 97 Cb 0.64 -0.04 0.00 0.00 -2.36 0.00 0.00 39.78 38.02 2be6 n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2be6 n GLY 98 N 1.07 0.76 2.87 4.83 0.00 -1.26 -5.03 105.19 108.44 2be6 n GLY 98 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 2be6 n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2be6 s TYR 99 N -2.77 0.38 -0.30 1.61 1.51 -1.26 -3.87 117.35 112.65 2be6 s TYR 99 Ca 0.00 -0.05 -0.21 0.00 -1.01 0.00 0.00 57.07 55.80 2be6 s TYR 99 Cb 0.00 -0.38 -0.01 0.00 -0.11 0.00 0.00 41.96 41.47 2be6 s TYR 99 CO 0.00 -0.09 0.67 0.42 -1.11 0.00 0.00 175.55 175.43 2be6 s ILE 100 N 0.62 4.91 0.51 2.71 1.01 0.92 -4.84 121.20 127.03 2be6 s ILE 100 Ca -0.06 0.97 -0.02 0.00 0.00 0.00 0.00 60.65 61.53 2be6 s ILE 100 Cb -0.10 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.35 2be6 s ILE 100 CO -0.01 -0.15 0.77 -0.94 0.00 0.00 0.00 174.94 174.62 2be6 s SER 101 N 1.61 5.74 0.23 3.58 1.04 -1.26 -1.06 113.70 123.58 2be6 s SER 101 Ca 0.27 0.47 -0.06 0.00 0.48 0.00 0.00 55.95 57.12 2be6 s SER 101 Cb -0.15 -1.61 0.40 0.00 0.10 0.00 0.00 66.02 64.76 2be6 s SER 101 CO 0.11 -0.85 1.73 0.00 0.98 0.00 0.00 173.24 175.21 2be6 h ALA 102 N 0.15 0.96 -0.72 5.32 0.00 -1.96 -1.08 119.26 121.94 2be6 h ALA 102 Ca -0.46 0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.63 2be6 h ALA 102 Cb 1.25 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.07 2be6 h ALA 102 CO 0.59 -0.21 0.42 0.00 0.00 0.00 0.00 179.25 180.04 2be6 h ALA 103 N 1.51 0.98 -0.33 0.00 0.00 -1.98 0.14 119.26 119.58 2be6 h ALA 103 Ca 0.38 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.16 2be6 h ALA 103 Cb 0.55 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2be6 h ALA 103 CO -0.38 0.10 -0.37 0.93 0.00 0.00 0.00 179.25 179.53 2be6 h GLU 104 N 0.76 0.78 -0.09 0.00 5.08 -1.64 -0.53 114.58 118.94 2be6 h GLU 104 Ca 0.33 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2be6 h GLU 104 Cb 0.20 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2be6 h GLU 104 CO -0.19 1.02 -0.00 1.25 -1.00 0.00 0.00 179.01 180.09 2be6 h LEU 105 N 0.64 0.15 -1.11 1.33 5.85 -0.89 -2.53 115.31 118.76 2be6 h LEU 105 Ca 0.06 -0.31 0.14 0.00 0.84 0.00 0.00 57.88 58.61 2be6 h LEU 105 Cb 0.92 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.83 2be6 h LEU 105 CO 0.08 0.43 0.61 -0.09 -0.34 0.00 0.00 178.44 179.13 2be6 h ARG 106 N -0.13 0.81 0.03 1.25 2.43 -0.67 0.55 114.38 118.64 2be6 h ARG 106 Ca 0.02 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2be6 h ARG 106 Cb 0.35 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2be6 h ARG 106 CO 0.00 0.54 -0.01 1.25 -1.51 0.00 0.00 179.97 180.24 2be6 h HIS 107 N 0.84 -0.03 -0.51 2.20 2.76 -0.76 -0.84 115.15 118.80 2be6 h HIS 107 Ca 0.50 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.60 2be6 h HIS 107 Cb 0.67 0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.62 2be6 h HIS 107 CO -0.00 0.02 0.04 0.28 -1.30 0.00 0.00 177.93 176.97 2be6 h VAL 108 N -0.07 1.26 -0.44 5.26 2.07 -1.08 -2.38 116.25 120.87 2be6 h VAL 108 Ca -0.00 -1.02 0.08 0.00 0.82 0.00 0.00 66.70 66.58 2be6 h VAL 108 Cb 0.06 0.91 -0.07 0.00 -1.52 0.00 0.00 31.29 30.67 2be6 h VAL 108 CO 0.01 0.36 0.04 -0.03 0.02 0.00 0.00 177.57 177.97 2be6 h MET 109 N 0.75 0.15 -0.01 1.57 -1.53 -0.66 -1.89 114.93 113.30 2be6 h MET 109 Ca 0.15 -0.01 -0.19 0.00 -3.44 0.00 0.00 59.70 56.22 2be6 h MET 109 Cb 0.46 -0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 31.47 2be6 h MET 109 CO 0.02 0.10 -0.82 1.79 0.14 0.00 0.00 176.91 178.14 2be6 h THR 110 N 0.16 1.47 -0.88 -0.77 1.35 -1.15 -1.52 112.91 111.57 2be6 h THR 110 Ca 0.22 -2.48 0.03 0.00 -0.55 0.00 0.00 66.41 63.63 2be6 h THR 110 Cb 0.30 2.37 -0.05 0.00 -1.73 0.00 0.00 68.15 69.04 2be6 h THR 110 CO -0.33 0.73 0.58 0.78 -0.25 0.00 0.00 175.52 177.03 2be6 h ASN 111 N 0.12 0.95 0.48 5.36 -0.26 -0.93 -1.59 115.58 119.71 2be6 h ASN 111 Ca -0.04 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.69 2be6 h ASN 111 Cb 1.42 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 38.46 2be6 h ASN 111 CO 0.13 0.66 0.00 0.18 -1.06 0.00 0.00 177.43 177.33 2be6 n LEU 112 N -4.44 0.00 -0.35 1.61 4.77 -0.76 -4.62 117.00 113.21 2be6 n LEU 112 Ca 0.12 0.33 -0.04 0.00 -0.03 0.00 0.00 56.01 56.39 2be6 n LEU 112 Cb 0.10 -0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 40.85 2be6 n LEU 112 CO 0.35 -0.09 -0.04 0.61 -1.33 0.00 0.00 177.39 176.89 2be6 n GLY 113 N 0.60 0.41 0.14 -0.72 0.00 -0.60 -4.98 105.19 100.03 2be6 n GLY 113 Ca 0.09 -0.81 -0.03 0.00 0.00 0.00 0.00 46.02 45.26 2be6 n GLY 113 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2be6 h GLU 114 N 0.00 0.08 -1.90 1.61 4.39 -1.48 -3.49 114.58 113.79 2be6 h GLU 114 Ca -0.08 -0.06 -0.36 0.00 0.34 0.00 0.00 59.36 59.20 2be6 h GLU 114 Cb 0.70 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.30 2be6 h GLU 114 CO 0.10 0.72 -0.41 1.63 -1.16 0.00 0.00 179.01 179.89 2be6 n LYS 115 N -3.77 -1.35 -2.09 2.33 5.02 -1.26 -5.00 118.16 112.04 2be6 n LYS 115 Ca -0.02 0.96 -0.37 0.00 -2.02 0.00 0.00 58.31 56.86 2be6 n LYS 115 Cb 0.66 -5.36 0.01 0.00 -0.02 0.00 0.00 35.03 30.32 2be6 n LYS 115 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2be6 s LEU 116 N -4.71 3.93 0.71 -0.35 1.43 -1.26 -5.03 118.68 113.40 2be6 s LEU 116 Ca 0.00 2.45 -0.11 0.00 -1.03 0.00 0.00 54.13 55.44 2be6 s LEU 116 Cb 0.00 -4.29 0.01 0.00 0.03 0.00 0.00 46.19 41.94 2be6 s LEU 116 CO 0.00 -1.18 1.06 0.28 0.23 0.00 0.00 176.35 176.74 2be6 s THR 117 N -1.48 3.92 0.31 5.49 -1.32 -1.26 -4.83 115.64 116.47 2be6 s THR 117 Ca 0.67 0.63 0.02 0.00 -1.21 0.00 0.00 61.69 61.80 2be6 s THR 117 Cb -0.32 -3.33 0.29 0.00 -1.51 0.00 0.00 72.50 67.63 2be6 s THR 117 CO 0.38 -0.81 1.89 0.44 -2.21 0.00 0.00 174.62 174.31 2be6 h ASP 118 N -0.77 0.87 -0.70 8.08 3.32 -1.99 0.14 116.42 125.37 2be6 h ASP 118 Ca -0.44 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.59 2be6 h ASP 118 Cb 1.21 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.57 2be6 h ASP 118 CO 0.56 0.52 0.28 -0.33 -1.72 0.00 0.00 179.24 178.54 2be6 h GLU 119 N 0.96 1.07 -0.33 3.56 3.07 -1.98 0.19 114.58 121.12 2be6 h GLU 119 Ca 0.42 -0.19 -0.13 0.00 -0.50 0.00 0.00 59.36 58.97 2be6 h GLU 119 Cb 0.35 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 2be6 h GLU 119 CO -0.18 0.88 -0.31 0.93 -1.40 0.00 0.00 179.01 178.92 2be6 h GLU 120 N 1.04 0.71 0.35 2.33 5.08 -1.64 0.25 114.58 122.70 2be6 h GLU 120 Ca 0.24 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2be6 h GLU 120 Cb 0.22 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2be6 h GLU 120 CO -0.02 0.93 -0.27 0.28 -1.00 0.00 0.00 179.01 178.92 2be6 h VAL 121 N 0.60 0.43 -0.96 3.13 2.07 -0.67 -0.29 116.25 120.55 2be6 h VAL 121 Ca 0.07 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.78 2be6 h VAL 121 Cb 0.83 0.43 -0.11 0.00 -1.52 0.00 0.00 31.29 30.92 2be6 h VAL 121 CO 0.07 0.00 0.56 0.44 0.02 0.00 0.00 177.57 178.66 2be6 h ASP 122 N -0.63 0.69 -0.83 0.57 3.32 -0.80 -1.28 116.42 117.46 2be6 h ASP 122 Ca -0.03 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 2be6 h ASP 122 Cb 0.55 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.05 2be6 h ASP 122 CO -0.01 0.23 0.46 -0.33 -1.72 0.00 0.00 179.24 177.87 2be6 h GLU 123 N 0.69 1.15 -0.26 3.56 5.08 -0.11 -1.46 114.58 123.24 2be6 h GLU 123 Ca 0.56 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.78 2be6 h GLU 123 Cb 0.90 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2be6 h GLU 123 CO -0.40 0.84 0.12 0.52 -1.00 0.00 0.00 179.01 179.09 2be6 h MET 124 N 1.16 0.37 0.20 2.33 2.86 0.03 -1.93 114.93 119.94 2be6 h MET 124 Ca 0.29 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.87 2be6 h MET 124 Cb 0.02 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.62 2be6 h MET 124 CO -0.05 0.38 -0.09 0.82 1.06 0.00 0.00 176.91 179.03 2be6 h ILE 125 N 0.28 0.82 -0.67 -1.22 1.08 -1.17 -2.85 117.51 113.78 2be6 h ILE 125 Ca 0.09 -0.07 0.14 0.00 -0.39 0.00 0.00 64.86 64.63 2be6 h ILE 125 Cb 0.14 0.87 -0.11 0.00 -3.07 0.00 0.00 36.82 34.65 2be6 h ILE 125 CO -0.01 0.02 0.05 -0.09 -0.69 0.00 0.00 178.15 177.43 2be6 h ARG 126 N -0.30 0.15 -0.36 2.37 2.43 -1.21 0.47 114.38 117.93 2be6 h ARG 126 Ca -0.03 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 2be6 h ARG 126 Cb 0.23 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2be6 h ARG 126 CO 0.04 0.10 0.05 1.49 -1.51 0.00 0.00 179.97 180.15 2be6 h GLU 127 N 0.16 0.54 0.00 0.20 4.81 -1.19 -2.82 114.58 116.28 2be6 h GLU 127 Ca 0.36 -0.10 -0.12 0.00 -0.13 0.00 0.00 59.36 59.37 2be6 h GLU 127 Cb 0.61 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 2be6 h GLU 127 CO -0.55 0.53 -1.40 0.00 -0.73 0.00 0.00 179.01 176.87 2be6 n ALA 128 N -2.48 2.14 -2.29 2.92 0.00 -0.49 -4.81 120.51 115.50 2be6 n ALA 128 Ca 0.02 -0.49 -0.34 0.00 0.00 0.00 0.00 53.44 52.62 2be6 n ALA 128 Cb 0.21 -0.95 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 2be6 n ALA 128 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2be6 s ASP 129 N -5.55 5.80 0.06 0.00 3.68 0.15 -4.81 116.67 115.99 2be6 s ASP 129 Ca -0.03 -1.69 -0.22 0.00 2.13 0.00 0.00 52.55 52.74 2be6 s ASP 129 Cb 0.09 -2.58 -0.14 0.00 -1.45 0.00 0.00 42.92 38.84 2be6 s ASP 129 CO 0.81 -2.23 1.54 0.40 0.13 0.00 0.00 175.17 175.83 2be6 h ILE 130 N 6.28 1.19 -0.00 4.11 2.04 -1.87 -3.27 117.51 126.00 2be6 h ILE 130 Ca 0.26 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.53 2be6 h ILE 130 Cb 0.94 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 2be6 h ILE 130 CO 1.32 0.17 -0.21 -0.90 0.00 0.00 0.00 178.15 178.53 2be6 n ASP 131 N -4.89 0.21 0.00 1.72 5.68 -1.26 -4.95 116.55 113.06 2be6 n ASP 131 Ca -0.06 0.18 0.00 0.00 -0.50 0.00 0.00 54.79 54.41 2be6 n ASP 131 Cb 0.15 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 2be6 n ASP 131 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2be6 n GLY 132 N 1.50 0.60 0.56 6.12 0.00 -1.23 -4.97 105.19 107.76 2be6 n GLY 132 Ca 0.06 -0.76 0.07 0.00 0.00 0.00 0.00 46.02 45.39 2be6 n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2be6 n ASP 133 N 1.42 1.63 -0.44 1.61 5.75 -1.26 -4.92 116.55 120.35 2be6 n ASP 133 Ca 0.00 -1.88 -0.06 0.00 -0.01 0.00 0.00 54.79 52.84 2be6 n ASP 133 Cb 0.05 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 39.94 2be6 n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2be6 n GLY 134 N 1.04 0.79 3.43 6.12 0.00 -1.26 -5.01 105.19 110.30 2be6 n GLY 134 Ca 0.13 -0.42 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 2be6 n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2be6 s GLN 135 N -2.08 1.36 -0.28 1.61 -0.21 -1.26 -4.57 119.66 114.22 2be6 s GLN 135 Ca 0.00 -1.31 -0.03 0.00 0.02 0.00 0.00 55.36 54.04 2be6 s GLN 135 Cb 0.00 0.40 0.03 0.00 1.00 0.00 0.00 33.01 34.44 2be6 s GLN 135 CO 0.00 -0.52 0.00 0.08 -2.12 0.00 0.00 175.29 172.73 2be6 s VAL 136 N -4.03 3.20 0.88 1.09 1.01 -0.22 -4.70 120.40 117.62 2be6 s VAL 136 Ca 0.25 -1.09 -0.09 0.00 0.00 0.00 0.00 61.98 61.04 2be6 s VAL 136 Cb 0.02 -2.72 0.19 0.00 0.00 0.00 0.00 36.38 33.87 2be6 s VAL 136 CO 0.07 0.04 1.20 0.54 0.00 0.00 0.00 175.10 176.95 2be6 s ASN 137 N 1.34 3.45 0.11 3.32 2.20 -1.26 -0.05 114.94 124.04 2be6 s ASN 137 Ca -0.01 -0.14 -0.19 0.00 -0.94 0.00 0.00 52.86 51.58 2be6 s ASN 137 Cb -0.18 0.04 -0.06 0.00 -2.00 0.00 0.00 41.25 39.05 2be6 s ASN 137 CO -0.01 -2.49 1.64 0.22 -2.94 0.00 0.00 177.10 173.52 2be6 h TYR 138 N -1.24 0.41 -0.90 1.54 5.03 -2.00 -0.80 116.97 119.01 2be6 h TYR 138 Ca -0.40 -0.03 -0.01 0.00 2.58 0.00 0.00 58.73 60.87 2be6 h TYR 138 Cb 1.24 -0.12 -0.04 0.00 1.55 0.00 0.00 36.73 39.35 2be6 h TYR 138 CO -0.92 0.42 0.51 0.93 -1.32 0.00 0.00 178.16 177.78 2be6 h GLU 139 N 0.28 1.25 -0.53 1.82 4.39 -1.94 0.11 114.58 119.95 2be6 h GLU 139 Ca 0.09 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 2be6 h GLU 139 Cb 0.19 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 2be6 h GLU 139 CO -0.01 0.90 0.27 0.93 -1.16 0.00 0.00 179.01 179.94 2be6 h GLU 140 N 1.26 0.75 -0.32 2.33 5.08 -1.83 -2.11 114.58 119.73 2be6 h GLU 140 Ca 0.32 -0.10 0.04 0.00 -1.00 0.00 0.00 59.36 58.62 2be6 h GLU 140 Cb -0.00 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 2be6 h GLU 140 CO -0.05 0.60 0.08 0.35 -1.00 0.00 0.00 179.01 178.99 2be6 h PHE 141 N 0.71 0.15 -0.48 4.33 3.04 -0.64 -2.05 116.94 122.00 2be6 h PHE 141 Ca 0.18 0.02 0.07 0.00 3.98 0.00 0.00 57.97 62.22 2be6 h PHE 141 Cb 0.08 -0.02 -0.06 0.00 2.56 0.00 0.00 35.95 38.52 2be6 h PHE 141 CO -0.01 0.05 0.15 0.28 -2.02 0.00 0.00 178.31 176.76 2be6 h VAL 142 N 0.21 0.82 -0.65 1.41 2.07 -0.67 0.18 116.25 119.62 2be6 h VAL 142 Ca 0.15 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2be6 h VAL 142 Cb 0.15 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 2be6 h VAL 142 CO -0.18 0.06 0.42 1.56 0.02 0.00 0.00 177.57 179.45 2be6 h GLN 143 N 0.32 0.86 -0.10 1.57 1.08 -1.03 -0.01 115.11 117.80 2be6 h GLN 143 Ca 0.23 -0.06 -0.14 0.00 -1.45 0.00 0.00 58.65 57.23 2be6 h GLN 143 Cb 0.25 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 2be6 h GLN 143 CO -0.25 0.57 -0.56 0.52 -0.95 0.00 0.00 178.83 178.16 2be6 h MET 144 N 0.88 0.31 0.00 1.46 2.86 -0.74 -3.12 114.93 116.58 2be6 h MET 144 Ca 0.24 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2be6 h MET 144 Cb -0.09 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.60 2be6 h MET 144 CO -0.05 0.79 0.00 -1.33 1.06 0.00 0.00 176.91 177.38 2be6 n MET 145 N -3.91 0.71 0.00 1.72 2.81 0.58 -5.10 117.12 113.92 2be6 n MET 145 Ca -0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 2be6 n MET 145 Cb 0.59 -1.38 0.00 0.00 -0.71 0.00 0.00 33.22 31.72 2be6 n MET 145 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11