#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i5o h THR 2 N 0.00 1.56 -5.08 1.12 2.02 -2.05 -3.49 112.91 107.00 1i5o h THR 2 Ca 0.00 -3.14 -0.13 0.00 0.77 0.00 0.00 66.41 63.90 1i5o h THR 2 Cb 0.00 2.90 0.00 0.00 -1.74 0.00 0.00 68.15 69.31 1i5o h THR 2 CO 0.00 0.91 -0.32 1.57 0.37 0.00 0.00 175.52 178.05 1i5o n HIS 3 N -3.49 -0.60 -2.15 3.16 -0.00 -1.26 -4.80 115.22 106.08 1i5o n HIS 3 Ca -0.06 0.25 -0.40 0.00 0.46 0.00 0.00 57.72 57.96 1i5o n HIS 3 Cb 0.99 -0.71 0.00 0.00 -0.12 0.00 0.00 29.99 30.15 1i5o n HIS 3 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1i5o n ASP 4 N -0.18 7.69 -4.57 0.26 2.03 -1.26 -4.86 116.55 115.66 1i5o n ASP 4 Ca -0.08 -3.24 -0.43 0.00 0.52 0.00 0.00 54.79 51.56 1i5o n ASP 4 Cb 0.19 -1.34 -0.01 0.00 -0.72 0.00 0.00 41.12 39.25 1i5o n ASP 4 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1i5o s ASN 5 N 0.07 6.78 0.33 1.67 3.84 -1.26 -4.44 114.94 121.93 1i5o s ASN 5 Ca 0.50 -2.27 0.23 0.00 0.21 0.00 0.00 52.86 51.53 1i5o s ASN 5 Cb 0.18 -2.56 0.23 0.00 -0.55 0.00 0.00 41.25 38.54 1i5o s ASN 5 CO -0.09 -1.21 1.39 0.11 -2.79 0.00 0.00 177.10 174.51 1i5o h LYS 6 N 8.03 0.00 0.00 0.43 1.79 -1.92 -3.44 116.57 121.46 1i5o h LYS 6 Ca 0.38 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.85 1i5o h LYS 6 Cb 0.90 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 1i5o h LYS 6 CO 1.43 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 181.08 1i5o n LEU 7 N -2.87 0.00 -4.72 2.94 4.77 -1.26 -5.15 117.00 110.71 1i5o n LEU 7 Ca 0.02 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.63 1i5o n LEU 7 Cb 0.53 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.56 1i5o n LEU 7 CO 0.36 0.00 0.11 0.00 -1.33 0.00 0.00 177.39 176.53 1i5o s GLN 8 N -0.81 4.31 0.16 3.23 -2.07 -1.26 -4.96 119.66 118.27 1i5o s GLN 8 Ca 0.00 0.33 0.00 0.00 -1.82 0.00 0.00 55.36 53.87 1i5o s GLN 8 Cb 0.00 -3.44 0.00 0.00 -1.09 0.00 0.00 33.01 28.48 1i5o s GLN 8 CO 0.00 0.18 0.00 1.33 -1.32 0.00 0.00 175.29 175.48 1i5o n VAL 9 N 3.66 -1.42 0.00 3.63 0.24 -1.26 -4.33 118.33 118.85 1i5o n VAL 9 Ca -0.09 0.66 0.00 0.00 -2.04 0.00 0.00 64.34 62.88 1i5o n VAL 9 Cb 0.52 -0.94 0.00 0.00 -1.47 0.00 0.00 33.84 31.94 1i5o n VAL 9 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1i5o n GLU 10 N -1.28 1.44 -3.60 7.34 1.02 -1.26 -4.59 120.64 119.71 1i5o n GLU 10 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1i5o n GLU 10 Cb 0.04 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.40 1i5o n GLU 10 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1i5o s ALA 11 N -3.34 -1.94 0.06 0.62 0.00 -1.26 -4.97 121.76 110.93 1i5o s ALA 11 Ca 0.00 1.70 0.01 0.00 0.00 0.00 0.00 51.96 53.67 1i5o s ALA 11 Cb 0.00 -1.00 -0.00 0.00 0.00 0.00 0.00 23.12 22.12 1i5o s ALA 11 CO 0.00 -0.28 0.02 0.44 0.00 0.00 0.00 175.76 175.94 1i5o n ILE 12 N 1.39 0.00 0.00 0.00 -0.00 -1.26 -5.11 119.36 114.38 1i5o n ILE 12 Ca -0.12 -0.35 0.00 0.00 -0.00 0.00 0.00 62.75 62.28 1i5o n ILE 12 Cb 0.57 0.12 0.00 0.00 -0.00 0.00 0.00 39.64 40.33 1i5o n ILE 12 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1i5o n LYS 13 N -0.14 0.00 -3.35 6.28 4.81 -1.26 -4.27 118.16 120.22 1i5o n LYS 13 Ca -0.01 0.14 -0.19 0.00 -0.87 0.00 0.00 58.31 57.38 1i5o n LYS 13 Cb 0.09 -0.52 -0.01 0.00 0.02 0.00 0.00 35.03 34.61 1i5o n LYS 13 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1i5o s ARG 14 N -0.49 2.77 0.00 1.64 0.52 -1.25 -2.15 118.95 119.99 1i5o s ARG 14 Ca 0.00 -1.30 0.00 0.00 -0.52 0.00 0.00 55.73 53.91 1i5o s ARG 14 Cb 0.00 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.86 1i5o s ARG 14 CO 0.00 -0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.58 1i5o n GLY 15 N -1.66 0.58 2.97 -3.53 0.00 0.56 -1.28 105.19 102.82 1i5o n GLY 15 Ca 0.04 -2.16 -0.22 0.00 0.00 0.00 0.00 46.02 43.68 1i5o n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i5o s THR 16 N -0.85 0.81 -0.42 2.61 2.01 0.30 -1.36 115.64 118.74 1i5o s THR 16 Ca 0.00 -0.32 0.04 0.00 0.31 0.00 0.00 61.69 61.72 1i5o s THR 16 Cb 0.00 -0.76 0.11 0.00 0.01 0.00 0.00 72.50 71.87 1i5o s THR 16 CO 0.00 0.27 0.15 -0.69 -0.69 0.00 0.00 174.62 173.66 1i5o s VAL 17 N 0.58 2.49 -0.06 3.82 1.01 -0.98 -0.26 120.40 126.99 1i5o s VAL 17 Ca -0.10 -2.75 -0.30 0.00 0.00 0.00 0.00 61.98 58.83 1i5o s VAL 17 Cb -0.13 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 1i5o s VAL 17 CO 0.01 -0.69 1.46 -0.63 0.00 0.00 0.00 175.10 175.25 1i5o s ILE 18 N 0.40 3.79 0.11 2.22 1.01 0.42 -2.79 121.20 126.36 1i5o s ILE 18 Ca 0.13 1.06 0.04 0.00 0.00 0.00 0.00 60.65 61.88 1i5o s ILE 18 Cb -0.22 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 1i5o s ILE 18 CO -0.04 -0.06 -0.11 -0.62 0.00 0.00 0.00 174.94 174.11 1i5o s ASP 19 N 2.43 1.62 -0.77 3.58 2.15 -1.13 -2.20 116.67 122.35 1i5o s ASP 19 Ca 0.65 -0.86 -0.03 0.00 0.43 0.00 0.00 52.55 52.74 1i5o s ASP 19 Cb -0.30 -0.01 0.00 0.00 -0.30 0.00 0.00 42.92 42.32 1i5o s ASP 19 CO 0.25 -0.26 0.66 1.41 -0.17 0.00 0.00 175.17 177.06 1i5o n HIS 20 N 0.39 -1.56 -2.96 -5.34 8.25 -1.23 0.29 115.22 113.05 1i5o n HIS 20 Ca -0.15 0.59 -0.40 0.00 -0.26 0.00 0.00 57.72 57.50 1i5o n HIS 20 Cb 0.58 -3.58 -0.04 0.00 1.12 0.00 0.00 29.99 28.07 1i5o n HIS 20 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1i5o s ILE 21 N -3.20 4.99 -0.11 1.59 1.01 -0.91 -3.76 121.20 120.82 1i5o s ILE 21 Ca 0.21 1.60 -0.29 0.00 0.00 0.00 0.00 60.65 62.17 1i5o s ILE 21 Cb -0.09 -4.11 -0.01 0.00 0.01 0.00 0.00 42.46 38.25 1i5o s ILE 21 CO 0.44 0.24 0.97 -2.16 0.00 0.00 0.00 174.94 174.42 1i5o s PRO 22 N 0.80 4.41 0.03 2.79 0.04 -1.26 0.88 135.00 142.69 1i5o s PRO 22 Ca 0.41 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.77 1i5o s PRO 22 Cb -0.19 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.81 1i5o s PRO 22 CO 0.21 -0.29 0.00 0.00 0.04 0.00 0.00 177.00 176.95 1i5o n ALA 23 N 4.95 0.00 -0.64 8.56 0.00 -1.23 -2.66 120.51 129.48 1i5o n ALA 23 Ca 0.08 0.00 0.50 0.00 0.00 0.00 0.00 53.44 54.01 1i5o n ALA 23 Cb 0.49 0.00 0.79 0.00 0.00 0.00 0.00 19.45 20.73 1i5o n ALA 23 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1i5o h GLN 24 N 0.00 0.00 -0.84 0.00 1.08 -1.94 -3.19 115.11 110.23 1i5o h GLN 24 Ca 0.00 -0.00 0.23 0.00 -1.45 0.00 0.00 58.65 57.43 1i5o h GLN 24 Cb 0.00 -0.00 -0.16 0.00 -0.05 0.00 0.00 27.48 27.27 1i5o h GLN 24 CO 0.00 0.00 0.01 -0.89 -0.95 0.00 0.00 178.83 177.00 1i5o n ILE 25 N -4.15 -0.35 -0.30 2.54 2.08 -1.09 -1.66 119.36 116.43 1i5o n ILE 25 Ca 0.43 1.85 0.07 0.00 0.56 0.00 0.00 62.75 65.66 1i5o n ILE 25 Cb 1.89 -2.69 0.17 0.00 -0.75 0.00 0.00 39.64 38.26 1i5o n ILE 25 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1i5o h GLY 26 N 0.00 0.85 0.76 7.39 0.00 -1.75 0.45 103.07 110.77 1i5o h GLY 26 Ca 0.50 0.21 0.03 0.00 0.00 0.00 0.00 47.33 48.07 1i5o h GLY 26 CO -0.79 -0.37 0.11 -2.75 0.00 0.00 0.00 176.54 172.74 1i5o h PHE 27 N 0.03 0.20 -0.40 5.60 3.57 -1.62 -1.77 116.94 122.55 1i5o h PHE 27 Ca 0.46 0.02 0.06 0.00 3.53 0.00 0.00 57.97 62.04 1i5o h PHE 27 Cb 0.81 -0.05 -0.09 0.00 2.79 0.00 0.00 35.95 39.42 1i5o h PHE 27 CO -0.57 0.09 -0.46 0.87 -2.23 0.00 0.00 178.31 176.02 1i5o h LYS 28 N 0.25 -0.34 -0.65 1.11 1.57 -0.28 -0.28 116.57 117.94 1i5o h LYS 28 Ca 0.13 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 59.01 1i5o h LYS 28 Cb 0.10 0.08 -0.10 0.00 0.08 0.00 0.00 32.23 32.38 1i5o h LYS 28 CO -0.13 -0.23 -0.56 -0.07 -0.57 0.00 0.00 179.45 177.90 1i5o h LEU 29 N -0.35 -1.93 -0.60 2.94 3.38 -0.32 0.41 115.31 118.83 1i5o h LEU 29 Ca 0.12 0.28 0.10 0.00 0.09 0.00 0.00 57.88 58.47 1i5o h LEU 29 Cb 0.59 0.83 -0.08 0.00 0.09 0.00 0.00 40.66 42.09 1i5o h LEU 29 CO -0.58 -0.33 0.18 -0.07 0.09 0.00 0.00 178.44 177.73 1i5o h LEU 30 N -0.23 0.12 0.66 1.67 3.38 -0.81 0.24 115.31 120.35 1i5o h LEU 30 Ca 0.12 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1i5o h LEU 30 Cb 0.53 0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.39 1i5o h LEU 30 CO -0.74 0.07 -0.32 0.28 0.09 0.00 0.00 178.44 177.82 1i5o h SER 31 N 0.33 -0.75 -0.90 -0.43 0.02 0.64 0.63 113.55 113.09 1i5o h SER 31 Ca 0.31 0.03 0.05 0.00 -0.84 0.00 0.00 61.79 61.34 1i5o h SER 31 Cb 0.43 0.19 -0.06 0.00 0.14 0.00 0.00 62.40 63.10 1i5o h SER 31 CO -0.35 -0.50 0.57 -0.07 -1.14 0.00 0.00 176.83 175.34 1i5o h LEU 32 N -0.96 0.93 -1.88 5.07 3.38 -0.13 -2.63 115.31 119.09 1i5o h LEU 32 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1i5o h LEU 32 Cb 0.68 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1i5o h LEU 32 CO 0.15 0.61 0.00 0.49 0.09 0.00 0.00 178.44 179.78 1i5o n PHE 33 N -4.56 0.23 -3.98 1.13 3.72 0.84 -4.91 117.46 109.93 1i5o n PHE 33 Ca 0.12 -0.11 -0.26 0.00 -0.05 0.00 0.00 57.45 57.15 1i5o n PHE 33 Cb 0.14 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 1i5o n PHE 33 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1i5o n LYS 34 N 1.15 -3.23 0.00 -1.08 4.76 0.16 -4.85 118.16 115.07 1i5o n LYS 34 Ca 0.17 0.39 0.06 0.00 -2.87 0.00 0.00 58.31 56.07 1i5o n LYS 34 Cb 0.54 -4.53 0.38 0.00 -1.84 0.00 0.00 35.03 29.58 1i5o n LYS 34 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1i5o n LEU 35 N -4.41 0.00 -0.00 -0.35 4.77 -0.86 -2.61 117.00 113.55 1i5o n LEU 35 Ca -0.29 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 55.79 1i5o n LEU 35 Cb 0.68 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.64 1i5o n LEU 35 CO 0.76 0.00 -0.27 0.35 -1.33 0.00 0.00 177.39 176.89 1i5o n THR 36 N -0.71 0.00 -2.08 -5.08 -2.24 -1.26 -4.60 114.28 98.31 1i5o n THR 36 Ca 0.09 -0.17 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 1i5o n THR 36 Cb 0.04 0.68 -0.00 0.00 -2.10 0.00 0.00 70.33 68.95 1i5o n THR 36 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1i5o n GLU 37 N -1.73 3.99 -3.67 -0.78 1.02 -1.07 -4.88 120.64 113.52 1i5o n GLU 37 Ca 0.01 -3.35 -0.15 0.00 -0.02 0.00 0.00 57.16 53.66 1i5o n GLU 37 Cb 0.39 -2.81 -0.08 0.00 -0.02 0.00 0.00 31.44 28.92 1i5o n GLU 37 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1i5o s THR 38 N 0.04 0.03 0.40 2.62 -1.32 -1.26 -5.02 115.64 111.12 1i5o s THR 38 Ca 0.48 -0.23 0.07 0.00 -1.21 0.00 0.00 61.69 60.80 1i5o s THR 38 Cb 0.14 -0.75 0.27 0.00 -1.51 0.00 0.00 72.50 70.65 1i5o s THR 38 CO -0.05 -0.12 2.04 0.44 -2.21 0.00 0.00 174.62 174.72 1i5o h ASP 39 N 3.90 0.51 -2.78 8.08 3.32 -1.98 -3.46 116.42 124.02 1i5o h ASP 39 Ca -0.28 -0.01 -0.54 0.00 0.02 0.00 0.00 57.03 56.21 1i5o h ASP 39 Cb 1.16 -0.13 0.22 0.00 0.22 0.00 0.00 39.33 40.81 1i5o h ASP 39 CO 0.35 0.37 -1.11 0.00 -1.72 0.00 0.00 179.24 177.13 1i5o n GLN 40 N -4.47 -0.12 -2.91 3.56 1.13 -1.26 -4.89 117.38 108.42 1i5o n GLN 40 Ca 0.04 -0.01 -0.44 0.00 -1.94 0.00 0.00 57.00 54.65 1i5o n GLN 40 Cb 0.08 -1.48 -0.02 0.00 0.11 0.00 0.00 30.24 28.93 1i5o n GLN 40 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1i5o s ARG 41 N -2.83 3.74 0.48 -1.09 3.52 -1.26 -4.98 118.95 116.53 1i5o s ARG 41 Ca 0.50 -1.96 -0.16 0.00 -0.13 0.00 0.00 55.73 53.99 1i5o s ARG 41 Cb -0.22 -4.98 -0.08 0.00 -1.56 0.00 0.00 34.95 28.11 1i5o s ARG 41 CO 0.73 -1.80 0.94 0.42 -0.81 0.00 0.00 175.30 174.78 1i5o s ILE 42 N 2.51 4.56 -0.23 4.11 1.09 -1.26 -2.86 121.20 129.12 1i5o s ILE 42 Ca 0.36 1.14 -0.03 0.00 -1.10 0.00 0.00 60.65 61.02 1i5o s ILE 42 Cb -0.04 -3.71 0.12 0.00 -1.06 0.00 0.00 42.46 37.77 1i5o s ILE 42 CO -0.07 -0.61 0.30 0.28 -0.10 0.00 0.00 174.94 174.74 1i5o s THR 43 N -2.52 -0.46 -0.09 2.92 -1.32 0.80 -4.98 115.64 109.99 1i5o s THR 43 Ca 0.58 -0.12 -0.10 0.00 -1.21 0.00 0.00 61.69 60.84 1i5o s THR 43 Cb -0.10 -0.76 -0.05 0.00 -1.51 0.00 0.00 72.50 70.08 1i5o s THR 43 CO 0.29 -0.19 0.23 -0.63 -2.21 0.00 0.00 174.62 172.11 1i5o s ILE 44 N 2.43 5.35 -0.16 5.08 1.09 -1.26 -1.78 121.20 131.96 1i5o s ILE 44 Ca 0.10 0.41 -0.00 0.00 -1.10 0.00 0.00 60.65 60.06 1i5o s ILE 44 Cb -0.15 -3.51 -0.00 0.00 -1.06 0.00 0.00 42.46 37.74 1i5o s ILE 44 CO -0.15 0.59 -0.14 -0.83 -0.10 0.00 0.00 174.94 174.31 1i5o s GLY 45 N -0.93 1.49 -0.09 6.18 0.00 0.89 -4.99 107.32 109.87 1i5o s GLY 45 Ca 0.17 -1.05 0.04 0.00 0.00 0.00 0.00 44.72 43.88 1i5o s GLY 45 CO 0.07 0.06 -0.20 1.08 0.00 0.00 0.00 173.10 174.10 1i5o s LEU 46 N 0.86 2.32 -1.54 0.66 1.43 -1.26 -1.57 118.68 119.58 1i5o s LEU 46 Ca -0.04 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 1i5o s LEU 46 Cb -0.15 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.60 1i5o s LEU 46 CO -0.01 0.22 0.00 0.59 0.23 0.00 0.00 176.35 177.38 1i5o n ASN 47 N 3.16 -4.82 -4.66 2.29 3.02 -1.11 -4.91 115.26 108.23 1i5o n ASN 47 Ca -0.18 0.23 -0.45 0.00 -0.03 0.00 0.00 54.58 54.15 1i5o n ASN 47 Cb 0.52 -3.80 -0.04 0.00 -0.61 0.00 0.00 39.78 35.85 1i5o n ASN 47 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1i5o n LEU 48 N -1.98 3.73 -4.70 3.41 4.77 0.78 -4.56 117.00 118.45 1i5o n LEU 48 Ca -0.17 0.87 -0.43 0.00 -0.03 0.00 0.00 56.01 56.24 1i5o n LEU 48 Cb 0.57 -1.45 -0.03 0.00 -2.33 0.00 0.00 43.42 40.17 1i5o n LEU 48 CO 0.23 -0.00 1.30 -0.81 -1.33 0.00 0.00 177.39 176.78 1i5o n PRO 49 N 7.27 2.56 -3.30 3.23 -0.04 -1.26 0.13 135.00 143.59 1i5o n PRO 49 Ca 0.23 0.92 -0.09 0.00 -0.04 0.00 0.00 63.50 64.52 1i5o n PRO 49 Cb 0.36 -2.74 -0.06 0.00 -0.04 0.00 0.00 33.50 31.02 1i5o n PRO 49 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1i5o s SER 50 N 1.01 0.27 0.34 3.54 0.15 -0.75 -4.83 113.70 113.44 1i5o s SER 50 Ca 0.75 -0.59 0.12 0.00 0.70 0.00 0.00 55.95 56.93 1i5o s SER 50 Cb -0.56 1.13 0.66 0.00 -1.71 0.00 0.00 66.02 65.54 1i5o s SER 50 CO 0.36 -0.32 1.26 1.23 1.20 0.00 0.00 173.24 176.96 1i5o h GLY 51 N 7.88 0.00 1.03 9.45 0.00 -1.95 1.28 103.07 120.77 1i5o h GLY 51 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1i5o h GLY 51 CO 0.24 0.00 -0.15 -2.21 0.00 0.00 0.00 176.54 174.41 1i5o n GLU 52 N -2.06 0.50 0.00 4.80 2.13 -1.26 -3.84 120.64 120.91 1i5o n GLU 52 Ca -0.01 -0.18 0.00 0.00 0.66 0.00 0.00 57.16 57.63 1i5o n GLU 52 Cb 0.38 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.59 1i5o n GLU 52 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1i5o n MET 53 N -1.09 0.00 0.00 5.31 2.81 0.10 -5.06 117.12 119.20 1i5o n MET 53 Ca 0.12 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 1i5o n MET 53 Cb 0.30 -0.23 0.00 0.00 -0.71 0.00 0.00 33.22 32.58 1i5o n MET 53 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1i5o n GLY 54 N 0.00 2.12 3.02 3.03 0.00 0.40 -4.73 105.19 109.03 1i5o n GLY 54 Ca 0.00 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 1i5o n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i5o s ARG 55 N 0.00 0.17 0.28 1.61 0.52 -1.25 -1.80 118.95 118.48 1i5o s ARG 55 Ca 0.00 0.52 0.01 0.00 -0.52 0.00 0.00 55.73 55.74 1i5o s ARG 55 Cb 0.00 -0.13 -0.00 0.00 0.52 0.00 0.00 34.95 35.34 1i5o s ARG 55 CO 0.00 -0.18 0.04 0.36 0.02 0.00 0.00 175.30 175.54 1i5o n LYS 56 N 4.35 1.00 -4.18 3.54 2.85 0.12 -3.51 118.16 122.34 1i5o n LYS 56 Ca -0.23 -2.19 -0.17 0.00 -1.05 0.00 0.00 58.31 54.67 1i5o n LYS 56 Cb 0.52 0.86 -0.11 0.00 -0.65 0.00 0.00 35.03 35.65 1i5o n LYS 56 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1i5o s ASP 57 N -2.62 1.60 -0.02 -5.58 -0.00 0.25 -0.15 116.67 110.14 1i5o s ASP 57 Ca 0.06 -0.71 0.00 0.00 -0.00 0.00 0.00 52.55 51.90 1i5o s ASP 57 Cb 0.00 -0.03 0.02 0.00 -0.00 0.00 0.00 42.92 42.92 1i5o s ASP 57 CO 0.04 -0.16 0.01 -0.22 -0.00 0.00 0.00 175.17 174.85 1i5o s LEU 58 N -2.08 1.24 -0.21 1.23 0.20 -0.61 -2.13 118.68 116.32 1i5o s LEU 58 Ca 0.02 0.00 0.01 0.00 0.69 0.00 0.00 54.13 54.85 1i5o s LEU 58 Cb -0.07 -0.13 0.03 0.00 -0.43 0.00 0.00 46.19 45.59 1i5o s LEU 58 CO 0.02 -0.10 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.18 1i5o s ILE 59 N 0.90 2.14 -0.21 6.68 1.01 -0.93 -0.07 121.20 130.71 1i5o s ILE 59 Ca -0.08 -1.16 -0.06 0.00 0.00 0.00 0.00 60.65 59.35 1i5o s ILE 59 Cb -0.12 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.30 1i5o s ILE 59 CO -0.02 0.35 0.04 -0.54 0.00 0.00 0.00 174.94 174.76 1i5o s LYS 60 N 1.23 3.70 -0.68 2.79 1.02 -0.73 -0.43 119.74 126.64 1i5o s LYS 60 Ca 0.00 -0.47 0.05 0.00 0.02 0.00 0.00 55.97 55.58 1i5o s LYS 60 Cb -0.15 -3.19 0.21 0.00 -0.52 0.00 0.00 37.83 34.18 1i5o s LYS 60 CO -0.10 -0.01 0.63 -0.89 -0.92 0.00 0.00 175.35 174.06 1i5o n ILE 61 N 4.36 2.05 -1.17 2.17 5.41 0.64 -0.14 119.36 132.67 1i5o n ILE 61 Ca -0.17 -5.07 -0.45 0.00 1.00 0.00 0.00 62.75 58.07 1i5o n ILE 61 Cb 0.52 -2.14 -0.05 0.00 -0.71 0.00 0.00 39.64 37.25 1i5o n ILE 61 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1i5o n GLU 62 N 1.37 0.00 -2.15 0.38 2.13 -1.13 -2.28 120.64 118.96 1i5o n GLU 62 Ca 0.25 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.91 1i5o n GLU 62 Cb 0.38 -1.09 -0.03 0.00 0.27 0.00 0.00 31.44 30.98 1i5o n GLU 62 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1i5o n ASN 63 N 1.30 -4.69 -4.05 4.31 3.02 -0.41 -4.47 115.26 110.28 1i5o n ASN 63 Ca 0.16 0.19 -0.22 0.00 -0.03 0.00 0.00 54.58 54.67 1i5o n ASN 63 Cb 0.10 -4.02 -0.15 0.00 -0.61 0.00 0.00 39.78 35.09 1i5o n ASN 63 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1i5o s THR 64 N -2.69 0.97 -0.09 3.41 2.01 -0.97 -4.72 115.64 113.56 1i5o s THR 64 Ca 0.00 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.55 1i5o s THR 64 Cb 0.00 -0.84 0.01 0.00 0.01 0.00 0.00 72.50 71.67 1i5o s THR 64 CO 0.00 0.29 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.68 1i5o s PHE 65 N 0.06 2.07 0.19 4.92 0.40 -1.26 -0.54 117.98 123.81 1i5o s PHE 65 Ca -0.02 -0.87 -0.20 0.00 -0.60 0.00 0.00 56.93 55.24 1i5o s PHE 65 Cb -0.08 -1.44 -0.08 0.00 0.51 0.00 0.00 43.02 41.93 1i5o s PHE 65 CO 0.01 -0.40 0.69 -0.51 0.70 0.00 0.00 175.22 175.71 1i5o s LEU 66 N 0.63 4.40 0.78 -0.37 1.43 -1.26 -5.07 118.68 119.22 1i5o s LEU 66 Ca -0.14 1.40 -0.12 0.00 -1.03 0.00 0.00 54.13 54.24 1i5o s LEU 66 Cb -0.16 -3.43 0.06 0.00 0.03 0.00 0.00 46.19 42.69 1i5o s LEU 66 CO 0.04 0.09 1.11 -0.94 0.23 0.00 0.00 176.35 176.88 1i5o s SER 67 N -1.52 4.69 0.45 2.29 1.04 -1.26 -4.82 113.70 114.57 1i5o s SER 67 Ca 0.40 1.18 0.22 0.00 0.48 0.00 0.00 55.95 58.23 1i5o s SER 67 Cb -0.18 -1.90 1.21 0.00 0.10 0.00 0.00 66.02 65.25 1i5o s SER 67 CO 0.21 -1.83 1.83 -0.08 0.98 0.00 0.00 173.24 174.36 1i5o h GLU 68 N -0.99 0.28 0.45 4.02 4.22 -1.99 -1.41 114.58 119.16 1i5o h GLU 68 Ca -0.47 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 58.94 1i5o h GLU 68 Cb 1.27 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1i5o h GLU 68 CO 0.61 0.19 -0.22 -0.44 -2.18 0.00 0.00 179.01 176.97 1i5o h ASP 69 N 0.29 -0.51 -0.59 1.04 3.32 -1.99 -0.86 116.42 117.12 1i5o h ASP 69 Ca 0.51 -0.03 0.17 0.00 0.02 0.00 0.00 57.03 57.70 1i5o h ASP 69 Cb 1.46 0.13 -0.02 0.00 0.22 0.00 0.00 39.33 41.12 1i5o h ASP 69 CO -0.16 -0.09 0.53 1.56 -1.72 0.00 0.00 179.24 179.36 1i5o h GLN 70 N -1.12 0.00 0.06 3.56 4.20 -1.74 0.29 115.11 120.36 1i5o h GLN 70 Ca -0.06 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 1i5o h GLN 70 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1i5o h GLN 70 CO 0.10 0.00 -0.03 0.28 -0.67 0.00 0.00 178.83 178.51 1i5o h VAL 71 N 0.00 1.23 -0.87 -0.54 2.07 -1.24 -3.35 116.25 113.54 1i5o h VAL 71 Ca 0.28 -1.57 0.23 0.00 0.82 0.00 0.00 66.70 66.46 1i5o h VAL 71 Cb 1.34 2.16 -0.14 0.00 -1.52 0.00 0.00 31.29 33.13 1i5o h VAL 71 CO -0.00 0.36 0.21 0.44 0.02 0.00 0.00 177.57 178.59 1i5o h ASP 72 N -0.85 -0.06 0.00 0.57 5.19 0.11 -0.15 116.42 121.23 1i5o h ASP 72 Ca -0.01 0.20 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 1i5o h ASP 72 Cb 0.64 0.29 0.00 0.00 0.18 0.00 0.00 39.33 40.44 1i5o h ASP 72 CO 0.01 -0.17 0.03 1.56 -3.12 0.00 0.00 179.24 177.55 1i5o h GLN 73 N 0.18 0.00 0.00 3.56 1.08 -1.59 -1.34 115.11 117.00 1i5o h GLN 73 Ca 0.54 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.74 1i5o h GLN 73 Cb 1.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 1i5o h GLN 73 CO -0.67 0.00 0.00 1.28 -0.95 0.00 0.00 178.83 178.49 1i5o n LEU 74 N -2.35 0.43 -0.34 1.46 7.99 -0.07 -3.72 117.00 120.41 1i5o n LEU 74 Ca -0.02 0.55 0.26 0.00 -0.01 0.00 0.00 56.01 56.80 1i5o n LEU 74 Cb 0.07 -0.43 0.55 0.00 -0.11 0.00 0.00 43.42 43.50 1i5o n LEU 74 CO 0.11 -0.17 1.23 0.00 -1.51 0.00 0.00 177.39 177.05 1i5o h ALA 75 N 2.66 2.38 0.00 -1.18 0.00 -1.41 0.18 119.26 121.89 1i5o h ALA 75 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 1i5o h ALA 75 Cb 0.57 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1i5o h ALA 75 CO 0.00 -0.82 -0.70 -0.07 0.00 0.00 0.00 179.25 177.66 1i5o h LEU 76 N 0.31 0.00 0.00 0.00 4.07 -1.83 -3.19 115.31 114.67 1i5o h LEU 76 Ca 0.63 0.00 -0.46 0.00 0.08 0.00 0.00 57.88 58.13 1i5o h LEU 76 Cb 1.75 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 43.42 1i5o h LEU 76 CO -0.30 0.67 -2.53 -1.22 -1.08 0.00 0.00 178.44 173.98 1i5o n TYR 77 N -3.26 0.02 -3.14 1.13 4.01 -0.00 -4.72 117.16 111.20 1i5o n TYR 77 Ca 0.01 0.01 -0.25 0.00 -0.16 0.00 0.00 57.90 57.51 1i5o n TYR 77 Cb 0.81 -1.00 -0.05 0.00 -0.31 0.00 0.00 39.34 38.78 1i5o n TYR 77 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1i5o n ALA 78 N -4.16 3.69 -0.43 -0.72 0.00 0.43 -4.90 120.51 114.42 1i5o n ALA 78 Ca -0.54 -4.29 0.36 0.00 0.00 0.00 0.00 53.44 48.97 1i5o n ALA 78 Cb 0.89 -0.82 0.64 0.00 0.00 0.00 0.00 19.45 20.16 1i5o n ALA 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1i5o h PRO 79 N 3.41 0.09 -0.52 0.00 0.13 -1.60 -0.62 132.00 132.89 1i5o h PRO 79 Ca 0.13 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 65.22 1i5o h PRO 79 Cb 0.69 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 1i5o h PRO 79 CO 0.71 0.06 0.04 0.00 -0.23 0.00 0.00 178.00 178.58 1i5o n GLN 80 N -4.74 4.13 -2.57 0.86 0.00 -1.26 -4.08 117.38 109.72 1i5o n GLN 80 Ca 0.37 -3.08 -0.42 0.00 0.00 0.00 0.00 57.00 53.87 1i5o n GLN 80 Cb 1.41 -2.14 -0.03 0.00 0.00 0.00 0.00 30.24 29.48 1i5o n GLN 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1i5o s ALA 81 N -2.84 3.36 -0.75 2.61 0.00 -0.24 -4.86 121.76 119.04 1i5o s ALA 81 Ca 0.51 0.59 -0.20 0.00 0.00 0.00 0.00 51.96 52.86 1i5o s ALA 81 Cb 0.40 -3.44 0.11 0.00 0.00 0.00 0.00 23.12 20.19 1i5o s ALA 81 CO 0.13 -0.51 0.96 0.95 0.00 0.00 0.00 175.76 177.29 1i5o s THR 82 N 1.61 4.64 0.47 0.00 -4.23 0.15 -3.97 115.64 114.29 1i5o s THR 82 Ca 0.54 -1.05 -0.24 0.00 -1.18 0.00 0.00 61.69 59.76 1i5o s THR 82 Cb -0.23 -4.67 -0.07 0.00 1.34 0.00 0.00 72.50 68.87 1i5o s THR 82 CO 0.24 -1.39 1.29 -0.69 -0.54 0.00 0.00 174.62 173.53 1i5o s VAL 83 N 3.08 2.55 -0.03 2.29 1.01 -0.64 -2.84 120.40 125.82 1i5o s VAL 83 Ca 0.24 0.44 0.04 0.00 0.00 0.00 0.00 61.98 62.70 1i5o s VAL 83 Cb -0.14 -3.24 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 1i5o s VAL 83 CO 0.01 0.02 -0.14 0.20 0.00 0.00 0.00 175.10 175.19 1i5o s ASN 84 N -0.97 1.77 -0.24 3.32 0.01 -1.12 0.94 114.94 118.65 1i5o s ASN 84 Ca 0.64 -0.28 -0.13 0.00 -0.71 0.00 0.00 52.86 52.37 1i5o s ASN 84 Cb -0.36 -0.42 -0.04 0.00 0.41 0.00 0.00 41.25 40.83 1i5o s ASN 84 CO 0.45 0.13 0.29 -0.60 -1.51 0.00 0.00 177.10 175.86 1i5o s ARG 85 N 0.00 4.07 -0.09 -0.60 3.52 0.12 -2.33 118.95 123.63 1i5o s ARG 85 Ca -0.01 -0.06 -0.02 0.00 -0.13 0.00 0.00 55.73 55.51 1i5o s ARG 85 Cb -0.09 -3.59 0.03 0.00 -1.56 0.00 0.00 34.95 29.74 1i5o s ARG 85 CO 0.01 -0.10 0.00 0.42 -0.81 0.00 0.00 175.30 174.83 1i5o s ILE 86 N 1.51 0.43 0.00 4.11 1.01 -0.46 -0.49 121.20 127.31 1i5o s ILE 86 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.77 1i5o s ILE 86 Cb -0.15 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.68 1i5o s ILE 86 CO 0.08 0.19 0.32 -0.90 0.00 0.00 0.00 174.94 174.62 1i5o n ASP 87 N 5.12 0.33 -2.71 3.58 5.68 -1.18 0.21 116.55 127.58 1i5o n ASP 87 Ca -0.08 -1.09 -0.07 0.00 -0.50 0.00 0.00 54.79 53.05 1i5o n ASP 87 Cb 0.50 0.00 0.09 0.00 -1.14 0.00 0.00 41.12 40.57 1i5o n ASP 87 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1i5o n ASN 88 N -0.05 -2.08 0.00 -1.12 2.85 -0.91 -4.48 115.26 109.47 1i5o n ASN 88 Ca 0.00 -3.12 0.00 0.00 -0.11 0.00 0.00 54.58 51.35 1i5o n ASN 88 Cb 0.29 1.68 0.00 0.00 1.24 0.00 0.00 39.78 42.99 1i5o n ASN 88 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 1i5o n TYR 89 N 0.58 0.00 -4.24 1.20 4.01 -1.08 -4.91 117.16 112.73 1i5o n TYR 89 Ca 0.03 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.64 1i5o n TYR 89 Cb 0.71 -0.47 -0.10 0.00 -0.31 0.00 0.00 39.34 39.16 1i5o n TYR 89 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1i5o s GLU 90 N 0.00 1.27 0.14 -0.72 2.56 -1.26 -4.96 118.70 115.73 1i5o s GLU 90 Ca 0.00 -1.67 -0.31 0.00 0.00 0.00 0.00 54.97 52.98 1i5o s GLU 90 Cb 0.00 0.10 -0.10 0.00 2.00 0.00 0.00 34.13 36.14 1i5o s GLU 90 CO 0.00 -0.36 1.61 0.08 -0.56 0.00 0.00 175.26 176.03 1i5o s VAL 91 N -4.03 2.69 -0.87 3.70 1.01 -1.26 -4.16 120.40 117.47 1i5o s VAL 91 Ca 0.39 0.41 0.08 0.00 0.00 0.00 0.00 61.98 62.86 1i5o s VAL 91 Cb 0.07 -3.26 0.14 0.00 0.00 0.00 0.00 36.38 33.33 1i5o s VAL 91 CO 0.13 0.02 0.96 1.33 0.00 0.00 0.00 175.10 177.54 1i5o n VAL 92 N 4.21 0.46 0.00 2.92 0.24 0.36 -5.01 118.33 121.51 1i5o n VAL 92 Ca 0.15 -0.73 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 1i5o n VAL 92 Cb 0.39 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.62 1i5o n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1i5o n GLY 93 N 0.37 3.25 3.99 7.63 0.00 -1.23 -4.91 105.19 114.29 1i5o n GLY 93 Ca 0.07 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1i5o n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i5o s LYS 94 N -0.74 2.01 -0.19 1.61 1.02 -1.26 0.14 119.74 122.33 1i5o s LYS 94 Ca 0.00 -1.11 -0.14 0.00 0.02 0.00 0.00 55.97 54.74 1i5o s LYS 94 Cb 0.00 -2.42 0.06 0.00 -0.52 0.00 0.00 37.83 34.94 1i5o s LYS 94 CO 0.00 -1.16 0.49 -1.12 -0.92 0.00 0.00 175.35 172.64 1i5o s SER 95 N -4.64 -0.58 -0.15 2.83 0.01 0.27 -4.88 113.70 106.56 1i5o s SER 95 Ca 0.63 1.03 -0.05 0.00 1.31 0.00 0.00 55.95 58.87 1i5o s SER 95 Cb -0.07 0.97 -0.03 0.00 0.21 0.00 0.00 66.02 67.10 1i5o s SER 95 CO 0.42 -0.19 0.02 -0.60 0.41 0.00 0.00 173.24 173.30 1i5o s ARG 96 N 0.87 3.62 0.09 12.44 3.52 -1.26 -1.62 118.95 136.62 1i5o s ARG 96 Ca -0.05 -0.41 -0.31 0.00 -0.13 0.00 0.00 55.73 54.84 1i5o s ARG 96 Cb -0.05 -3.02 -0.09 0.00 -1.56 0.00 0.00 34.95 30.23 1i5o s ARG 96 CO -0.07 0.39 1.65 -2.14 -0.81 0.00 0.00 175.30 174.31 1i5o s PRO 97 N 0.01 4.20 -0.07 5.12 0.02 -1.26 -4.97 135.00 138.05 1i5o s PRO 97 Ca 0.04 2.36 0.03 0.00 0.02 0.00 0.00 61.00 63.45 1i5o s PRO 97 Cb -0.13 -3.50 -0.02 0.00 0.02 0.00 0.00 34.50 30.87 1i5o s PRO 97 CO 0.02 -0.72 -0.16 -1.12 -0.33 0.00 0.00 177.00 174.69 1i5o s SER 98 N 2.16 3.88 0.26 2.53 0.01 -1.26 -4.88 113.70 116.40 1i5o s SER 98 Ca 0.74 -0.27 -0.30 0.00 1.31 0.00 0.00 55.95 57.42 1i5o s SER 98 Cb -0.41 -0.99 -0.14 0.00 0.21 0.00 0.00 66.02 64.70 1i5o s SER 98 CO 0.32 0.30 1.28 -0.11 0.41 0.00 0.00 173.24 175.44 1i5o n LEU 99 N 2.64 2.72 -4.70 2.44 7.94 -1.26 -4.60 117.00 122.18 1i5o n LEU 99 Ca -0.17 1.16 -0.31 0.00 -1.11 0.00 0.00 56.01 55.58 1i5o n LEU 99 Cb 0.52 -1.38 -0.08 0.00 0.53 0.00 0.00 43.42 43.01 1i5o n LEU 99 CO 0.26 -0.77 -0.33 -2.16 -1.11 0.00 0.00 177.39 173.28 1i5o s PRO 100 N -0.89 2.62 0.37 1.96 0.04 -1.26 -5.02 135.00 132.81 1i5o s PRO 100 Ca 0.65 -0.79 0.14 0.00 0.04 0.00 0.00 61.00 61.04 1i5o s PRO 100 Cb -0.67 -2.58 0.98 0.00 0.04 0.00 0.00 34.50 32.26 1i5o s PRO 100 CO 0.54 0.56 1.79 1.05 0.04 0.00 0.00 177.00 180.98 1i5o h GLU 101 N 3.56 0.51 -4.49 4.56 4.11 -1.94 -3.40 114.58 117.49 1i5o h GLU 101 Ca -0.48 -0.03 -0.20 0.00 0.07 0.00 0.00 59.36 58.72 1i5o h GLU 101 Cb 1.17 -0.11 -0.16 0.00 0.50 0.00 0.00 28.75 30.14 1i5o h GLU 101 CO 0.60 0.33 -0.70 1.03 0.07 0.00 0.00 179.01 180.34 1i5o s ARG 102 N -5.60 0.69 -0.31 1.06 0.52 -1.26 -0.10 118.95 113.95 1i5o s ARG 102 Ca -0.09 -1.15 -0.03 0.00 -0.52 0.00 0.00 55.73 53.94 1i5o s ARG 102 Cb 0.25 -0.10 0.11 0.00 0.52 0.00 0.00 34.95 35.72 1i5o s ARG 102 CO 0.80 -0.03 0.14 0.42 0.02 0.00 0.00 175.30 176.64 1i5o s ILE 103 N -3.14 0.20 0.45 1.52 1.01 0.01 -4.92 121.20 116.33 1i5o s ILE 103 Ca 0.05 -1.06 0.02 0.00 0.00 0.00 0.00 60.65 59.66 1i5o s ILE 103 Cb 0.02 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.32 1i5o s ILE 103 CO -0.05 -0.75 0.65 -1.81 0.00 0.00 0.00 174.94 172.98 1i5o s ASP 104 N 1.83 5.75 0.00 3.58 1.01 -1.26 -1.56 116.67 126.01 1i5o s ASP 104 Ca 0.10 0.13 0.00 0.00 0.71 0.00 0.00 52.55 53.50 1i5o s ASP 104 Cb -0.17 -1.34 0.00 0.00 1.01 0.00 0.00 42.92 42.42 1i5o s ASP 104 CO -0.29 -0.74 0.00 0.59 0.21 0.00 0.00 175.17 174.94 1i5o n ASN 105 N -2.05 0.00 -0.06 0.27 4.13 0.16 -4.35 115.26 113.37 1i5o n ASN 105 Ca 0.02 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.28 1i5o n ASN 105 Cb 0.58 0.00 0.28 0.00 -1.54 0.00 0.00 39.78 39.10 1i5o n ASN 105 CO 0.00 0.00 0.00 -0.37 0.28 0.00 0.00 177.26 177.17 1i5o h VAL 106 N 0.00 1.19 -2.97 2.41 -1.51 -1.86 -3.41 116.25 110.10 1i5o h VAL 106 Ca 0.00 -0.66 -0.46 0.00 -1.23 0.00 0.00 66.70 64.36 1i5o h VAL 106 Cb 0.00 0.71 0.11 0.00 -2.13 0.00 0.00 31.29 29.98 1i5o h VAL 106 CO 0.00 0.24 0.22 -0.76 -1.23 0.00 0.00 177.57 176.05 1i5o s LEU 107 N -9.29 2.88 0.16 4.19 1.43 -1.26 -5.10 118.68 111.69 1i5o s LEU 107 Ca -0.09 -0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.02 1i5o s LEU 107 Cb 0.16 -2.25 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1i5o s LEU 107 CO 0.77 -2.09 -0.10 -0.69 0.23 0.00 0.00 176.35 174.47 1i5o s VAL 108 N -3.39 1.22 -0.29 -1.59 1.01 -1.26 -4.73 120.40 111.36 1i5o s VAL 108 Ca 0.68 -2.08 -0.13 0.00 0.00 0.00 0.00 61.98 60.46 1i5o s VAL 108 Cb -0.06 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1i5o s VAL 108 CO 0.47 -0.70 0.25 0.00 0.00 0.00 0.00 175.10 175.12 1i5o h PRO 110 N 8.36 0.27 -6.53 0.00 0.11 -1.90 -3.38 132.00 128.94 1i5o h PRO 110 Ca -0.33 -0.02 -0.56 0.00 0.11 0.00 0.00 66.00 65.20 1i5o h PRO 110 Cb 1.17 -0.06 -0.08 0.00 0.11 0.00 0.00 31.00 32.14 1i5o h PRO 110 CO 0.60 0.18 0.91 1.21 -0.21 0.00 0.00 178.00 180.69 1i5o s ASN 111 N -5.50 6.48 0.34 -2.05 2.47 -1.26 -4.94 114.94 110.48 1i5o s ASN 111 Ca -0.07 0.15 0.02 0.00 0.42 0.00 0.00 52.86 53.37 1i5o s ASN 111 Cb 0.23 -2.54 0.60 0.00 -1.45 0.00 0.00 41.25 38.10 1i5o s ASN 111 CO 0.79 -1.39 1.99 0.77 -3.72 0.00 0.00 177.10 175.54 1i5o h SER 112 N 9.43 0.78 0.00 -4.21 4.64 -1.99 -2.22 113.55 119.98 1i5o h SER 112 Ca -0.25 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1i5o h SER 112 Cb 1.06 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 1i5o h SER 112 CO 1.16 0.55 0.00 -3.20 -0.87 0.00 0.00 176.83 174.47 1i5o n ASN 113 N -4.44 0.00 -4.65 4.97 5.15 -1.26 -4.73 115.26 110.30 1i5o n ASN 113 Ca 0.08 -0.66 -0.43 0.00 -0.60 0.00 0.00 54.58 52.98 1i5o n ASN 113 Cb 0.07 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.30 1i5o n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1i5o h ILE 115 N 5.74 0.30 -0.94 0.00 6.09 -1.91 -0.40 117.51 126.40 1i5o h ILE 115 Ca -0.36 0.00 0.23 0.00 -1.37 0.00 0.00 64.86 63.36 1i5o h ILE 115 Cb 1.16 0.52 -0.07 0.00 0.47 0.00 0.00 36.82 38.91 1i5o h ILE 115 CO 0.97 0.00 0.63 0.77 -3.07 0.00 0.00 178.15 177.45 1i5o h SER 116 N 0.00 0.34 0.16 2.19 4.64 -1.93 -2.61 113.55 116.34 1i5o h SER 116 Ca 0.26 0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.60 1i5o h SER 116 Cb 1.45 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.52 1i5o h SER 116 CO -0.00 0.12 -0.11 0.45 -0.87 0.00 0.00 176.83 176.41 1i5o h HIS 117 N 0.32 0.00 0.00 4.77 3.86 -1.38 -3.33 115.15 119.39 1i5o h HIS 117 Ca 0.49 0.00 -0.31 0.00 -1.16 0.00 0.00 60.37 59.40 1i5o h HIS 117 Cb 1.37 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.78 1i5o h HIS 117 CO -0.00 0.11 -2.16 0.00 0.86 0.00 0.00 177.93 176.74 1i5o n ALA 118 N -2.44 1.57 -2.14 2.45 0.00 -0.99 -5.05 120.51 113.92 1i5o n ALA 118 Ca -0.03 -1.02 -0.27 0.00 0.00 0.00 0.00 53.44 52.13 1i5o n ALA 118 Cb 0.19 -0.06 0.02 0.00 0.00 0.00 0.00 19.45 19.60 1i5o n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1i5o s GLU 119 N -2.41 3.17 -0.89 0.00 0.41 -1.20 -4.93 118.70 112.86 1i5o s GLU 119 Ca -0.16 0.10 -0.21 0.00 -0.41 0.00 0.00 54.97 54.29 1i5o s GLU 119 Cb 0.06 -2.30 -0.12 0.00 -1.78 0.00 0.00 34.13 29.98 1i5o s GLU 119 CO 0.60 -0.51 1.98 -0.35 -0.49 0.00 0.00 175.26 176.49 1i5o n PRO 120 N -2.47 1.74 -3.99 0.39 -0.04 -1.26 -4.81 135.00 124.56 1i5o n PRO 120 Ca 0.03 -1.97 -0.29 0.00 -0.04 0.00 0.00 63.50 61.22 1i5o n PRO 120 Cb 0.57 -2.98 -0.17 0.00 -0.04 0.00 0.00 33.50 30.88 1i5o n PRO 120 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1i5o s VAL 121 N 4.68 1.45 0.05 0.52 -7.23 -1.26 -5.10 120.40 113.51 1i5o s VAL 121 Ca 0.56 -0.56 -0.31 0.00 -1.81 0.00 0.00 61.98 59.86 1i5o s VAL 121 Cb 0.14 -1.38 -0.06 0.00 0.56 0.00 0.00 36.38 35.64 1i5o s VAL 121 CO 0.08 0.43 1.29 -0.44 -0.31 0.00 0.00 175.10 176.15 1i5o s SER 122 N 1.54 6.97 0.78 4.85 0.01 -1.26 -4.95 113.70 121.64 1i5o s SER 122 Ca 0.05 2.09 -0.14 0.00 1.31 0.00 0.00 55.95 59.26 1i5o s SER 122 Cb -0.13 -2.57 0.07 0.00 0.21 0.00 0.00 66.02 63.59 1i5o s SER 122 CO -0.10 -0.58 1.20 -1.54 0.41 0.00 0.00 173.24 172.63 1i5o n SER 123 N 4.38 1.12 -3.66 2.44 3.41 -1.26 -4.68 113.62 115.37 1i5o n SER 123 Ca 0.11 0.62 -0.09 0.00 -0.26 0.00 0.00 58.87 59.25 1i5o n SER 123 Cb 0.45 -1.51 -0.08 0.00 -0.26 0.00 0.00 64.21 62.80 1i5o n SER 123 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1i5o s SER 124 N -2.00 -0.77 -0.02 4.04 0.15 -1.26 0.41 113.70 114.25 1i5o s SER 124 Ca 0.75 1.27 0.00 0.00 0.70 0.00 0.00 55.95 58.67 1i5o s SER 124 Cb -0.31 1.16 0.02 0.00 -1.71 0.00 0.00 66.02 65.19 1i5o s SER 124 CO 0.49 -0.22 0.00 -0.36 1.20 0.00 0.00 173.24 174.35 1i5o s PHE 125 N 1.43 0.26 0.22 3.44 0.40 -0.60 -1.46 117.98 121.66 1i5o s PHE 125 Ca -0.09 0.01 -0.30 0.00 -0.60 0.00 0.00 56.93 55.96 1i5o s PHE 125 Cb -0.06 -0.34 -0.08 0.00 0.51 0.00 0.00 43.02 43.05 1i5o s PHE 125 CO -0.15 -0.10 0.93 0.00 0.70 0.00 0.00 175.22 176.59 1i5o s ALA 126 N 0.83 3.34 -0.13 5.36 0.00 -0.83 -0.81 121.76 129.52 1i5o s ALA 126 Ca -0.08 0.59 -0.08 0.00 0.00 0.00 0.00 51.96 52.39 1i5o s ALA 126 Cb -0.11 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1i5o s ALA 126 CO -0.02 0.19 0.16 0.08 0.00 0.00 0.00 175.76 176.17 1i5o s VAL 127 N -1.03 5.46 -0.14 0.00 1.01 0.85 -2.14 120.40 124.41 1i5o s VAL 127 Ca 0.41 0.25 -0.04 0.00 0.00 0.00 0.00 61.98 62.60 1i5o s VAL 127 Cb -0.25 -3.44 0.07 0.00 0.00 0.00 0.00 36.38 32.76 1i5o s VAL 127 CO 0.31 0.58 0.19 -0.60 0.00 0.00 0.00 175.10 175.59 1i5o s ARG 128 N -0.75 0.11 -0.66 2.72 3.52 -0.39 -4.81 118.95 118.69 1i5o s ARG 128 Ca 0.14 0.40 -0.24 0.00 -0.13 0.00 0.00 55.73 55.91 1i5o s ARG 128 Cb -0.12 -0.71 0.06 0.00 -1.56 0.00 0.00 34.95 32.61 1i5o s ARG 128 CO 0.03 -0.47 1.04 0.21 -0.81 0.00 0.00 175.30 175.31 1i5o s LYS 129 N 2.31 3.17 -0.18 5.12 2.20 -1.26 -0.01 119.74 131.10 1i5o s LYS 129 Ca 0.04 -0.59 0.00 0.00 -0.36 0.00 0.00 55.97 55.06 1i5o s LYS 129 Cb -0.14 -4.19 0.01 0.00 -1.51 0.00 0.00 37.83 32.00 1i5o s LYS 129 CO -0.09 -1.84 -0.16 -0.98 -0.36 0.00 0.00 175.35 171.93 1i5o s ARG 130 N 4.45 3.14 0.00 4.03 1.70 -1.07 -4.98 118.95 126.22 1i5o s ARG 130 Ca 0.27 -0.77 0.00 0.00 -0.47 0.00 0.00 55.73 54.76 1i5o s ARG 130 Cb -0.14 -2.66 0.00 0.00 -0.57 0.00 0.00 34.95 31.58 1i5o s ARG 130 CO 0.13 -0.11 0.00 0.00 -1.08 0.00 0.00 175.30 174.24 1i5o n ALA 131 N 4.41 -0.06 -0.90 7.88 0.00 -1.26 -2.67 120.51 127.91 1i5o n ALA 131 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1i5o n ALA 131 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1i5o n ALA 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1i5o n ASN 132 N 0.00 -2.52 0.00 0.00 4.13 -1.26 -4.89 115.26 110.71 1i5o n ASN 132 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1i5o n ASN 132 Cb 0.00 -1.56 0.00 0.00 -1.54 0.00 0.00 39.78 36.68 1i5o n ASN 132 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 1i5o n ASP 133 N -0.26 0.00 -3.85 6.41 5.75 -1.09 -5.14 116.55 118.37 1i5o n ASP 133 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 54.79 54.57 1i5o n ASP 133 Cb 0.13 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.05 1i5o n ASP 133 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1i5o s ILE 134 N -2.69 0.49 0.09 2.12 1.01 -1.26 -2.59 121.20 118.38 1i5o s ILE 134 Ca 0.00 -0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.37 1i5o s ILE 134 Cb 0.00 -0.56 -0.07 0.00 0.01 0.00 0.00 42.46 41.84 1i5o s ILE 134 CO 0.00 0.24 0.72 0.00 0.00 0.00 0.00 174.94 175.90 1i5o s ALA 135 N 1.29 3.45 -0.06 9.38 0.00 0.98 0.18 121.76 136.99 1i5o s ALA 135 Ca -0.05 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.18 1i5o s ALA 135 Cb -0.14 -2.90 0.01 0.00 0.00 0.00 0.00 23.12 20.10 1i5o s ALA 135 CO -0.02 0.22 -0.13 -0.51 0.00 0.00 0.00 175.76 175.31 1i5o s LEU 136 N -0.67 1.72 -0.16 0.00 1.43 0.89 -1.26 118.68 120.64 1i5o s LEU 136 Ca 0.35 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1i5o s LEU 136 Cb -0.21 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.18 1i5o s LEU 136 CO 0.23 0.06 -0.12 -0.75 0.23 0.00 0.00 176.35 176.00 1i5o s LYS 137 N 0.50 2.13 0.39 1.70 2.20 -0.91 0.84 119.74 126.59 1i5o s LYS 137 Ca -0.12 -0.58 -0.26 0.00 -0.36 0.00 0.00 55.97 54.65 1i5o s LYS 137 Cb -0.15 -2.11 -0.11 0.00 -1.51 0.00 0.00 37.83 33.95 1i5o s LYS 137 CO 0.03 -0.29 1.12 0.00 -0.36 0.00 0.00 175.35 175.86 1i5o h LYS 139 N 1.88 0.00 0.00 0.00 3.64 -1.64 -3.03 116.57 117.43 1i5o h LYS 139 Ca -0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1i5o h LYS 139 Cb 1.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1i5o h LYS 139 CO 0.59 0.03 0.00 0.66 -2.27 0.00 0.00 179.45 178.46 1i5o n TYR 140 N -3.15 0.00 0.28 1.91 4.01 -1.26 -4.61 117.16 114.34 1i5o n TYR 140 Ca 0.00 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.89 1i5o n TYR 140 Cb 0.29 -0.00 0.71 0.00 -0.31 0.00 0.00 39.34 40.03 1i5o n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1i5o n GLU 142 N -2.54 -1.36 -3.32 0.00 1.02 -1.14 -4.99 120.64 108.30 1i5o n GLU 142 Ca -0.01 1.10 -0.38 0.00 -0.02 0.00 0.00 57.16 57.85 1i5o n GLU 142 Cb 0.13 -5.46 -0.06 0.00 -0.02 0.00 0.00 31.44 26.02 1i5o n GLU 142 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1i5o s LYS 143 N -3.95 4.26 -0.09 3.49 3.01 -1.26 -4.79 119.74 120.40 1i5o s LYS 143 Ca 0.00 0.37 -0.18 0.00 -1.01 0.00 0.00 55.97 55.16 1i5o s LYS 143 Cb 0.00 -3.49 -0.05 0.00 -1.01 0.00 0.00 37.83 33.29 1i5o s LYS 143 CO 0.00 0.04 0.47 -2.00 0.51 0.00 0.00 175.35 174.37 1i5o s GLU 144 N 1.02 4.27 0.17 1.68 2.12 -1.26 -2.86 118.70 123.84 1i5o s GLU 144 Ca 0.24 0.45 0.04 0.00 0.36 0.00 0.00 54.97 56.06 1i5o s GLU 144 Cb -0.15 -3.40 -0.05 0.00 0.26 0.00 0.00 34.13 30.80 1i5o s GLU 144 CO 0.09 0.26 -0.07 -0.06 -0.54 0.00 0.00 175.26 174.94 1i5o s PHE 145 N 0.29 1.34 0.09 5.30 0.40 0.25 -4.94 117.98 120.70 1i5o s PHE 145 Ca 0.26 -0.81 -0.30 0.00 -0.60 0.00 0.00 56.93 55.48 1i5o s PHE 145 Cb -0.15 -0.71 -0.05 0.00 0.51 0.00 0.00 43.02 42.61 1i5o s PHE 145 CO 0.11 0.04 1.06 0.45 0.70 0.00 0.00 175.22 177.58 1i5o s SER 146 N -3.20 7.30 0.56 1.36 0.15 -1.26 -0.08 113.70 118.54 1i5o s SER 146 Ca 0.20 1.89 0.30 0.00 0.70 0.00 0.00 55.95 59.03 1i5o s SER 146 Cb 0.03 -2.59 1.46 0.00 -1.71 0.00 0.00 66.02 63.22 1i5o s SER 146 CO 0.03 -0.25 1.87 1.12 1.20 0.00 0.00 173.24 177.21 1i5o h HIS 147 N 6.08 0.00 -0.85 3.44 2.07 -0.61 1.55 115.15 126.83 1i5o h HIS 147 Ca -0.42 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.07 1i5o h HIS 147 Cb 1.21 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.15 1i5o h HIS 147 CO 0.66 0.00 0.44 -0.91 -3.07 0.00 0.00 177.93 175.04 1i5o h ASN 148 N 0.00 1.08 -0.07 3.10 2.35 -1.90 0.15 115.58 120.29 1i5o h ASN 148 Ca 0.32 -0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.83 1i5o h ASN 148 Cb 1.49 -0.28 0.01 0.00 0.05 0.00 0.00 38.32 39.59 1i5o h ASN 148 CO -0.00 0.89 -0.46 0.58 -1.65 0.00 0.00 177.43 176.79 1i5o h VAL 149 N 1.19 1.40 -0.25 2.81 2.07 0.18 -1.22 116.25 122.43 1i5o h VAL 149 Ca 0.29 -1.84 -0.02 0.00 0.82 0.00 0.00 66.70 65.95 1i5o h VAL 149 Cb 0.07 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1i5o h VAL 149 CO -0.04 0.54 0.07 0.58 0.02 0.00 0.00 177.57 178.73 1i5o h VAL 150 N -0.03 1.12 0.13 2.57 2.07 -0.70 -2.55 116.25 118.85 1i5o h VAL 150 Ca -0.04 -0.42 -0.18 0.00 0.82 0.00 0.00 66.70 66.89 1i5o h VAL 150 Cb 1.12 0.86 0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1i5o h VAL 150 CO 0.09 0.15 -0.76 -0.07 0.02 0.00 0.00 177.57 177.00 1i5o h LEU 151 N 0.35 0.45 0.00 2.57 3.38 -0.71 -3.38 115.31 117.98 1i5o h LEU 151 Ca 0.09 -0.94 0.00 0.00 0.09 0.00 0.00 57.88 57.11 1i5o h LEU 151 Cb 0.13 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1i5o h LEU 151 CO -0.00 1.36 0.00 0.00 0.09 0.00 0.00 178.44 179.89 1i5o n ALA 152 N -2.66 -0.23 0.00 1.53 0.00 -0.46 -5.09 120.51 113.60 1i5o n ALA 152 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1i5o n ALA 152 Cb 0.80 0.16 0.00 0.00 0.00 0.00 0.00 19.45 20.40 1i5o n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79