#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vh5 s LEU 1 N 0.00 3.87 0.10 2.46 2.96 -1.26 -3.79 118.68 123.02 1vh5 s LEU 1 Ca 0.00 0.47 0.22 0.00 -0.22 0.00 0.00 54.13 54.60 1vh5 s LEU 1 Cb 0.00 -3.38 -0.13 0.00 0.50 0.00 0.00 46.19 43.18 1vh5 s LEU 1 CO 0.00 -1.05 0.81 2.30 -1.32 0.00 0.00 176.35 177.09 1vh5 n ILE 2 N 6.38 0.49 -2.42 6.68 -5.35 -0.48 -4.97 119.36 119.70 1vh5 n ILE 2 Ca 0.09 -0.55 -0.36 0.00 -0.27 0.00 0.00 62.75 61.66 1vh5 n ILE 2 Cb 0.48 -0.27 -0.02 0.00 -1.74 0.00 0.00 39.64 38.09 1vh5 n ILE 2 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 1vh5 s TRP 3 N -3.35 3.02 -0.43 4.28 0.52 -1.26 -4.71 118.94 117.01 1vh5 s TRP 3 Ca -0.03 1.58 0.04 0.00 0.02 0.00 0.00 56.10 57.71 1vh5 s TRP 3 Cb 0.11 -3.22 0.02 0.00 -1.15 0.00 0.00 33.47 29.24 1vh5 s TRP 3 CO 0.83 -1.06 0.58 1.63 0.02 0.00 0.00 176.95 178.95 1vh5 n LYS 4 N -0.52 -0.02 -4.23 4.98 5.02 0.54 -4.97 118.16 118.96 1vh5 n LYS 4 Ca 0.07 -0.66 -0.20 0.00 -2.02 0.00 0.00 58.31 55.50 1vh5 n LYS 4 Cb 0.50 -1.04 -0.12 0.00 -0.02 0.00 0.00 35.03 34.35 1vh5 n LYS 4 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1vh5 s ARG 5 N -0.38 0.98 -0.09 1.97 0.52 -1.03 -4.84 118.95 116.09 1vh5 s ARG 5 Ca 0.04 -1.12 -0.12 0.00 -0.52 0.00 0.00 55.73 54.01 1vh5 s ARG 5 Cb 0.03 -1.02 -0.05 0.00 0.52 0.00 0.00 34.95 34.43 1vh5 s ARG 5 CO 0.05 0.22 0.30 0.15 0.02 0.00 0.00 175.30 176.04 1vh5 s LYS 6 N -2.11 3.91 -0.15 3.54 1.02 -1.26 -4.98 119.74 119.70 1vh5 s LYS 6 Ca 0.04 0.16 -0.19 0.00 0.02 0.00 0.00 55.97 56.00 1vh5 s LYS 6 Cb -0.08 -3.28 0.05 0.00 -0.52 0.00 0.00 37.83 33.99 1vh5 s LYS 6 CO 0.03 0.56 0.51 -1.50 -0.92 0.00 0.00 175.35 174.03 1vh5 s ILE 7 N -0.53 0.01 0.48 2.17 1.10 -1.26 -5.15 121.20 118.02 1vh5 s ILE 7 Ca 0.19 -0.07 -0.04 0.00 -0.51 0.00 0.00 60.65 60.22 1vh5 s ILE 7 Cb -0.14 -0.75 -0.02 0.00 0.15 0.00 0.00 42.46 41.70 1vh5 s ILE 7 CO 0.08 -0.04 0.76 0.42 -2.11 0.00 0.00 174.94 174.04 1vh5 s THR 8 N -0.16 4.59 0.33 4.00 -4.23 -1.26 -4.96 115.64 113.95 1vh5 s THR 8 Ca -0.03 -0.03 0.03 0.00 -1.18 0.00 0.00 61.69 60.48 1vh5 s THR 8 Cb -0.03 -3.74 0.29 0.00 1.34 0.00 0.00 72.50 70.36 1vh5 s THR 8 CO 0.02 -0.67 1.92 -0.07 -0.54 0.00 0.00 174.62 175.29 1vh5 h LEU 9 N 0.25 0.79 -0.57 4.79 3.38 -1.99 -0.96 115.31 121.00 1vh5 h LEU 9 Ca -0.47 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.46 1vh5 h LEU 9 Cb 1.22 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1vh5 h LEU 9 CO 0.61 0.50 0.18 -0.08 0.09 0.00 0.00 178.44 179.73 1vh5 h GLU 10 N 0.89 0.88 -0.58 1.13 4.81 -1.94 0.02 114.58 119.79 1vh5 h GLU 10 Ca 0.37 -0.19 -0.11 0.00 -0.13 0.00 0.00 59.36 59.30 1vh5 h GLU 10 Cb 0.28 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1vh5 h GLU 10 CO -0.14 0.80 -0.06 0.00 -0.73 0.00 0.00 179.01 178.89 1vh5 h ALA 11 N 1.04 0.78 -0.25 2.92 0.00 -1.85 -1.10 119.26 120.80 1vh5 h ALA 11 Ca 0.18 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.78 1vh5 h ALA 11 Cb 0.29 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1vh5 h ALA 11 CO -0.01 0.67 0.11 -0.07 0.00 0.00 0.00 179.25 179.95 1vh5 h LEU 12 N 0.95 0.16 -1.66 0.00 3.38 -0.92 -2.77 115.31 114.44 1vh5 h LEU 12 Ca 0.16 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 1vh5 h LEU 12 Cb 0.62 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1vh5 h LEU 12 CO 0.04 0.12 -0.19 0.78 0.09 0.00 0.00 178.44 179.28 1vh5 h ASN 13 N 0.24 0.00 0.53 -0.43 2.35 -0.78 -2.47 115.58 115.03 1vh5 h ASN 13 Ca 0.10 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.79 1vh5 h ASN 13 Cb 0.04 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1vh5 h ASN 13 CO -0.08 0.19 -0.29 0.00 -1.65 0.00 0.00 177.43 175.60 1vh5 h ALA 14 N 1.81 1.23 -0.53 -0.83 0.00 -0.91 -3.06 119.26 116.97 1vh5 h ALA 14 Ca -0.00 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.67 1vh5 h ALA 14 Cb 0.43 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1vh5 h ALA 14 CO 0.02 0.37 0.35 0.52 0.00 0.00 0.00 179.25 180.51 1vh5 h MET 15 N 0.00 0.58 -0.00 0.00 2.86 -1.36 -2.75 114.93 114.26 1vh5 h MET 15 Ca -0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1vh5 h MET 15 Cb 0.64 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.17 1vh5 h MET 15 CO 0.04 0.38 -0.10 0.41 1.06 0.00 0.00 176.91 178.70 1vh5 n GLY 16 N -1.47 -1.06 3.68 8.32 0.00 -1.15 -4.86 105.19 108.64 1vh5 n GLY 16 Ca 0.06 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1vh5 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vh5 s GLU 17 N -2.56 4.20 0.00 1.61 2.02 -1.04 -1.13 118.70 121.80 1vh5 s GLU 17 Ca 0.27 2.30 0.00 0.00 0.02 0.00 0.00 54.97 57.56 1vh5 s GLU 17 Cb 0.20 -3.70 0.00 0.00 0.10 0.00 0.00 34.13 30.73 1vh5 s GLU 17 CO 0.49 -0.76 0.00 0.41 0.02 0.00 0.00 175.26 175.42 1vh5 n GLY 18 N 4.03 0.54 1.32 -1.39 0.00 -1.26 -4.96 105.19 103.47 1vh5 n GLY 18 Ca 0.16 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 1vh5 n GLY 18 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1vh5 n ASN 19 N 0.06 0.37 -0.35 1.61 0.23 -0.86 -5.00 115.26 111.33 1vh5 n ASN 19 Ca 0.00 -1.88 0.01 0.00 -0.53 0.00 0.00 54.58 52.18 1vh5 n ASN 19 Cb 0.00 0.55 0.15 0.00 -2.08 0.00 0.00 39.78 38.40 1vh5 n ASN 19 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 1vh5 h MET 20 N 0.00 1.09 -0.28 -3.83 1.85 -1.96 -1.01 114.93 110.80 1vh5 h MET 20 Ca -0.11 -0.07 0.04 0.00 -0.61 0.00 0.00 59.70 58.95 1vh5 h MET 20 Cb 0.49 -0.25 -0.04 0.00 0.43 0.00 0.00 31.60 32.23 1vh5 h MET 20 CO 0.17 0.72 0.05 0.28 -0.40 0.00 0.00 176.91 177.73 1vh5 h VAL 21 N 1.12 0.86 -0.62 -5.77 2.07 -1.95 -0.80 116.25 111.17 1vh5 h VAL 21 Ca 0.40 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.81 1vh5 h VAL 21 Cb 0.12 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1vh5 h VAL 21 CO -0.16 0.03 0.15 1.23 0.02 0.00 0.00 177.57 178.83 1vh5 h GLY 22 N 0.14 1.06 2.00 2.17 0.00 -0.54 -1.27 103.07 106.64 1vh5 h GLY 22 Ca 0.13 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.74 1vh5 h GLY 22 CO -0.18 0.62 -0.25 0.74 0.00 0.00 0.00 176.54 177.48 1vh5 h PHE 23 N 0.90 0.00 -0.38 5.60 -1.00 -0.89 -1.18 116.94 119.99 1vh5 h PHE 23 Ca 0.19 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.97 1vh5 h PHE 23 Cb 0.36 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.92 1vh5 h PHE 23 CO 0.03 0.25 0.00 1.28 -1.61 0.00 0.00 178.31 178.25 1vh5 n LEU 24 N -3.96 2.45 -3.54 1.54 4.77 -0.33 -4.94 117.00 112.98 1vh5 n LEU 24 Ca -0.02 -1.15 -0.26 0.00 -0.03 0.00 0.00 56.01 54.55 1vh5 n LEU 24 Cb 0.32 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1vh5 n LEU 24 CO 0.35 0.58 0.03 -0.67 -1.33 0.00 0.00 177.39 176.35 1vh5 n ASP 25 N 0.83 -4.58 -4.70 -1.43 4.64 -0.45 -4.32 116.55 106.55 1vh5 n ASP 25 Ca 0.16 -0.54 -0.42 0.00 -1.38 0.00 0.00 54.79 52.61 1vh5 n ASP 25 Cb 0.41 -3.71 -0.03 0.00 -1.04 0.00 0.00 41.12 36.75 1vh5 n ASP 25 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1vh5 s ILE 26 N -3.13 3.98 -0.11 5.18 1.01 -0.50 -4.45 121.20 123.19 1vh5 s ILE 26 Ca 0.50 1.37 -0.01 0.00 0.00 0.00 0.00 60.65 62.51 1vh5 s ILE 26 Cb -0.25 -3.88 0.03 0.00 0.01 0.00 0.00 42.46 38.36 1vh5 s ILE 26 CO 0.61 0.03 -0.06 -0.60 0.00 0.00 0.00 174.94 174.93 1vh5 s ARG 27 N 1.90 1.36 0.11 2.79 3.52 -0.29 -4.69 118.95 123.64 1vh5 s ARG 27 Ca 0.59 -0.21 -0.31 0.00 -0.13 0.00 0.00 55.73 55.68 1vh5 s ARG 27 Cb -0.29 -1.52 -0.07 0.00 -1.56 0.00 0.00 34.95 31.52 1vh5 s ARG 27 CO 0.26 -0.29 1.24 -0.06 -0.81 0.00 0.00 175.30 175.64 1vh5 s PHE 28 N 1.75 3.39 0.00 5.12 0.40 -1.26 -0.43 117.98 126.95 1vh5 s PHE 28 Ca 0.05 1.26 0.00 0.00 -0.60 0.00 0.00 56.93 57.64 1vh5 s PHE 28 Cb -0.13 -3.48 0.00 0.00 0.51 0.00 0.00 43.02 39.92 1vh5 s PHE 28 CO -0.08 -1.51 0.00 0.39 0.70 0.00 0.00 175.22 174.73 1vh5 n GLU 29 N 3.52 1.98 -3.68 0.44 1.02 0.14 -4.93 120.64 119.13 1vh5 n GLU 29 Ca 0.08 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.12 1vh5 n GLU 29 Cb 0.45 -0.94 -0.10 0.00 -0.02 0.00 0.00 31.44 30.84 1vh5 n GLU 29 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1vh5 s HIS 30 N -1.80 -0.71 -0.36 -0.32 5.04 -1.12 -5.01 115.29 111.01 1vh5 s HIS 30 Ca 0.00 1.52 -0.01 0.00 -1.54 0.00 0.00 55.06 55.02 1vh5 s HIS 30 Cb 0.00 0.34 0.09 0.00 0.04 0.00 0.00 32.58 33.05 1vh5 s HIS 30 CO 0.00 -0.37 0.11 0.42 -2.34 0.00 0.00 174.74 172.55 1vh5 s ILE 31 N 1.23 3.01 0.85 0.89 1.01 -1.26 -1.21 121.20 125.72 1vh5 s ILE 31 Ca -0.08 -1.87 -0.07 0.00 0.00 0.00 0.00 60.65 58.63 1vh5 s ILE 31 Cb -0.07 -2.97 0.18 0.00 0.01 0.00 0.00 42.46 39.61 1vh5 s ILE 31 CO -0.12 -0.47 1.17 -0.83 0.00 0.00 0.00 174.94 174.69 1vh5 s GLY 32 N 1.48 1.78 0.42 6.18 0.00 0.08 -4.99 107.32 112.27 1vh5 s GLY 32 Ca 0.04 -1.66 0.17 0.00 0.00 0.00 0.00 44.72 43.27 1vh5 s GLY 32 CO -0.04 -0.94 1.91 1.29 0.00 0.00 0.00 173.10 175.32 1vh5 h ASP 33 N -1.10 0.00 0.00 1.64 -0.00 -2.00 -3.34 116.42 111.63 1vh5 h ASP 33 Ca -0.38 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 56.64 1vh5 h ASP 33 Cb 1.24 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.55 1vh5 h ASP 33 CO 0.34 0.27 -0.46 -0.90 -0.00 0.00 0.00 179.24 178.50 1vh5 n ASP 34 N -4.01 0.36 -3.83 4.15 3.85 -1.25 -1.38 116.55 114.43 1vh5 n ASP 34 Ca -0.02 -2.15 -0.12 0.00 -0.71 0.00 0.00 54.79 51.79 1vh5 n ASP 34 Cb 0.34 -0.24 -0.11 0.00 -1.35 0.00 0.00 41.12 39.77 1vh5 n ASP 34 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1vh5 s THR 35 N -0.39 0.05 -0.03 2.12 2.01 -1.25 -4.31 115.64 113.83 1vh5 s THR 35 Ca 0.06 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.67 1vh5 s THR 35 Cb 0.06 -0.40 0.01 0.00 0.01 0.00 0.00 72.50 72.18 1vh5 s THR 35 CO -0.00 -0.23 -0.08 -0.22 -0.69 0.00 0.00 174.62 173.40 1vh5 s LEU 36 N -0.83 1.72 -0.03 4.42 2.96 -0.59 -0.74 118.68 125.59 1vh5 s LEU 36 Ca -0.09 -0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 1vh5 s LEU 36 Cb -0.05 -0.51 -0.00 0.00 0.50 0.00 0.00 46.19 46.12 1vh5 s LEU 36 CO 0.01 0.04 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.34 1vh5 s GLU 37 N 0.32 1.35 0.04 1.98 2.02 -0.35 -0.76 118.70 123.30 1vh5 s GLU 37 Ca -0.05 -0.48 -0.00 0.00 0.02 0.00 0.00 54.97 54.46 1vh5 s GLU 37 Cb -0.09 -1.22 -0.03 0.00 0.10 0.00 0.00 34.13 32.88 1vh5 s GLU 37 CO 0.00 0.21 -0.04 0.00 0.02 0.00 0.00 175.26 175.46 1vh5 s ALA 38 N 0.02 0.40 0.34 5.21 0.00 -0.71 -0.69 121.76 126.35 1vh5 s ALA 38 Ca -0.02 -0.94 0.09 0.00 0.00 0.00 0.00 51.96 51.09 1vh5 s ALA 38 Cb -0.09 0.20 -0.06 0.00 0.00 0.00 0.00 23.12 23.17 1vh5 s ALA 38 CO 0.01 -0.25 -0.02 0.95 0.00 0.00 0.00 175.76 176.45 1vh5 s THR 39 N -2.73 2.48 -0.17 0.00 -4.23 0.43 -0.10 115.64 111.31 1vh5 s THR 39 Ca -0.03 -2.04 -0.17 0.00 -1.18 0.00 0.00 61.69 58.27 1vh5 s THR 39 Cb -0.01 -2.76 0.05 0.00 1.34 0.00 0.00 72.50 71.12 1vh5 s THR 39 CO -0.05 -0.19 0.48 -0.32 -0.54 0.00 0.00 174.62 174.00 1vh5 s MET 40 N -3.69 0.58 0.49 3.99 0.00 -0.46 -1.13 119.30 119.08 1vh5 s MET 40 Ca 0.34 0.64 -0.19 0.00 0.00 0.00 0.00 55.69 56.48 1vh5 s MET 40 Cb 0.01 0.28 -0.08 0.00 0.00 0.00 0.00 34.83 35.04 1vh5 s MET 40 CO 0.18 -0.08 1.00 -1.25 0.00 0.00 0.00 175.02 174.88 1vh5 s PRO 41 N 0.17 3.91 -0.57 4.11 0.04 -1.26 -0.67 135.00 140.72 1vh5 s PRO 41 Ca -0.01 1.17 -0.16 0.00 0.04 0.00 0.00 61.00 62.04 1vh5 s PRO 41 Cb -0.03 -2.12 0.13 0.00 0.04 0.00 0.00 34.50 32.51 1vh5 s PRO 41 CO 0.01 -0.32 0.56 0.08 0.04 0.00 0.00 177.00 177.37 1vh5 s VAL 42 N -2.26 5.16 0.00 -0.36 1.01 0.60 -4.73 120.40 119.82 1vh5 s VAL 42 Ca 0.63 -1.47 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1vh5 s VAL 42 Cb -0.12 -4.38 0.00 0.00 0.00 0.00 0.00 36.38 31.88 1vh5 s VAL 42 CO 0.23 -0.93 0.00 -0.90 0.00 0.00 0.00 175.10 173.49 1vh5 n ASP 43 N 5.38 0.00 0.28 3.32 3.85 -1.26 -4.23 116.55 123.89 1vh5 n ASP 43 Ca -0.11 -0.75 0.18 0.00 -0.71 0.00 0.00 54.79 53.40 1vh5 n ASP 43 Cb 0.41 0.00 0.97 0.00 -1.35 0.00 0.00 41.12 41.15 1vh5 n ASP 43 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 1vh5 h SER 44 N 0.00 0.00 1.44 -1.12 4.64 -1.95 -0.28 113.55 116.28 1vh5 h SER 44 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vh5 h SER 44 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1vh5 h SER 44 CO 0.00 0.00 -0.42 0.03 -0.87 0.00 0.00 176.83 175.57 1vh5 h ARG 45 N 0.00 0.00 0.00 4.77 3.08 -1.96 -3.38 114.38 116.89 1vh5 h ARG 45 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1vh5 h ARG 45 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1vh5 h ARG 45 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.15 1vh5 n THR 46 N -2.71 0.37 -3.58 2.04 -2.24 -0.26 -5.03 114.28 102.86 1vh5 n THR 46 Ca 0.03 -0.43 -0.30 0.00 -2.27 0.00 0.00 64.05 61.08 1vh5 n THR 46 Cb 0.51 0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 69.65 1vh5 n THR 46 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1vh5 s LYS 47 N -0.37 3.61 0.76 -0.78 1.02 -0.34 -0.52 119.74 123.12 1vh5 s LYS 47 Ca 0.00 -0.11 -0.05 0.00 0.02 0.00 0.00 55.97 55.83 1vh5 s LYS 47 Cb 0.00 -2.78 0.12 0.00 -0.52 0.00 0.00 37.83 34.65 1vh5 s LYS 47 CO 0.00 0.38 1.05 1.14 -0.92 0.00 0.00 175.35 177.00 1vh5 s GLN 48 N -3.05 1.63 0.00 1.68 1.03 0.27 -4.62 119.66 116.59 1vh5 s GLN 48 Ca 0.41 -0.75 0.06 0.00 0.04 0.00 0.00 55.36 55.13 1vh5 s GLN 48 Cb -0.11 -2.20 0.32 0.00 0.03 0.00 0.00 33.01 31.04 1vh5 s GLN 48 CO 0.27 -1.56 1.06 -2.30 -2.54 0.00 0.00 175.29 170.22 1vh5 n PRO 49 N -3.02 0.09 -0.44 9.60 -0.02 -1.26 -2.33 135.00 137.62 1vh5 n PRO 49 Ca 0.13 0.23 0.08 0.00 -2.02 0.00 0.00 63.50 61.92 1vh5 n PRO 49 Cb 0.60 -1.50 0.26 0.00 -0.02 0.00 0.00 33.50 32.84 1vh5 n PRO 49 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1vh5 n PHE 50 N -1.29 0.99 -0.34 6.00 3.01 -1.26 -4.96 117.46 119.61 1vh5 n PHE 50 Ca 0.03 -0.71 0.00 0.00 1.01 0.00 0.00 57.45 57.78 1vh5 n PHE 50 Cb 0.05 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 1vh5 n PHE 50 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1vh5 n GLY 51 N 0.15 0.72 3.83 1.37 0.00 -0.98 -5.05 105.19 105.23 1vh5 n GLY 51 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1vh5 n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vh5 s LEU 52 N 0.00 3.95 -0.01 0.99 1.43 -1.26 -4.70 118.68 119.08 1vh5 s LEU 52 Ca 0.00 -0.04 -0.37 0.00 -1.03 0.00 0.00 54.13 52.69 1vh5 s LEU 52 Cb 0.00 -2.55 -0.15 0.00 0.03 0.00 0.00 46.19 43.52 1vh5 s LEU 52 CO 0.00 0.08 1.56 -0.11 0.23 0.00 0.00 176.35 178.10 1vh5 n LEU 53 N -0.32 2.35 -4.72 1.79 7.94 0.39 -0.57 117.00 123.86 1vh5 n LEU 53 Ca -0.08 1.08 -0.42 0.00 -1.11 0.00 0.00 56.01 55.49 1vh5 n LEU 53 Cb 0.54 -1.25 -0.03 0.00 0.53 0.00 0.00 43.42 43.22 1vh5 n LEU 53 CO 0.45 -0.62 1.12 -2.28 -1.11 0.00 0.00 177.39 174.95 1vh5 s HIS 54 N 1.78 3.14 0.46 1.96 5.65 0.32 -4.63 115.29 123.97 1vh5 s HIS 54 Ca 0.88 0.88 0.12 0.00 0.25 0.00 0.00 55.06 57.19 1vh5 s HIS 54 Cb -0.89 -3.79 1.04 0.00 -1.18 0.00 0.00 32.58 27.76 1vh5 s HIS 54 CO 0.50 -2.75 2.08 0.78 -0.65 0.00 0.00 174.74 174.70 1vh5 h GLY 55 N 6.29 0.25 1.40 1.59 0.00 -1.91 -0.72 103.07 109.97 1vh5 h GLY 55 Ca -0.43 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 46.74 1vh5 h GLY 55 CO 0.85 0.10 0.10 -1.33 0.00 0.00 0.00 176.54 176.27 1vh5 h GLY 56 N 0.32 0.81 1.08 4.60 0.00 -1.95 -2.37 103.07 105.56 1vh5 h GLY 56 Ca 0.06 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1vh5 h GLY 56 CO -0.01 0.44 0.50 0.00 0.00 0.00 0.00 176.54 177.46 1vh5 h ALA 57 N 1.39 1.22 -0.84 3.60 0.00 -1.43 0.76 119.26 123.96 1vh5 h ALA 57 Ca 0.16 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1vh5 h ALA 57 Cb 0.29 -0.35 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1vh5 h ALA 57 CO 0.00 0.64 0.53 0.77 0.00 0.00 0.00 179.25 181.19 1vh5 h SER 58 N 1.22 0.84 -0.14 0.00 0.02 -1.22 -1.15 113.55 113.12 1vh5 h SER 58 Ca 0.31 0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 61.12 1vh5 h SER 58 Cb 0.00 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1vh5 h SER 58 CO -0.05 0.55 -0.43 0.58 -1.14 0.00 0.00 176.83 176.33 1vh5 h VAL 59 N 0.98 1.29 -0.45 2.27 2.07 -0.80 -0.48 116.25 121.13 1vh5 h VAL 59 Ca 0.36 -1.62 0.03 0.00 0.82 0.00 0.00 66.70 66.29 1vh5 h VAL 59 Cb 0.12 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1vh5 h VAL 59 CO -0.16 0.52 0.24 0.58 0.02 0.00 0.00 177.57 178.77 1vh5 h VAL 60 N 0.56 0.99 -0.11 2.57 2.07 -0.41 0.13 116.25 122.05 1vh5 h VAL 60 Ca 0.04 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 1vh5 h VAL 60 Cb 0.97 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1vh5 h VAL 60 CO 0.09 0.09 0.06 0.25 0.02 0.00 0.00 177.57 178.08 1vh5 h LEU 61 N 0.47 0.13 -0.15 2.57 5.85 -0.86 0.12 115.31 123.44 1vh5 h LEU 61 Ca 0.19 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1vh5 h LEU 61 Cb 0.08 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1vh5 h LEU 61 CO -0.12 0.15 0.09 0.00 -0.34 0.00 0.00 178.44 178.21 1vh5 h ALA 62 N 0.99 0.18 -0.42 1.25 0.00 -0.79 -1.48 119.26 118.98 1vh5 h ALA 62 Ca 0.04 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1vh5 h ALA 62 Cb 0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1vh5 h ALA 62 CO -0.01 -0.35 -0.13 1.49 0.00 0.00 0.00 179.25 180.26 1vh5 h GLU 63 N 0.18 0.77 -0.57 0.00 4.81 -0.61 0.19 114.58 119.35 1vh5 h GLU 63 Ca 0.06 -0.27 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 1vh5 h GLU 63 Cb -0.01 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1vh5 h GLU 63 CO -0.02 0.87 0.27 0.77 -0.73 0.00 0.00 179.01 180.17 1vh5 h SER 64 N 0.70 0.75 -0.02 1.04 0.02 -0.48 -0.36 113.55 115.20 1vh5 h SER 64 Ca 0.11 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1vh5 h SER 64 Cb 0.61 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 1vh5 h SER 64 CO 0.04 0.68 -0.03 0.40 -1.14 0.00 0.00 176.83 176.78 1vh5 h ILE 65 N 0.78 1.43 -0.31 3.27 2.04 -1.12 -3.07 117.51 120.54 1vh5 h ILE 65 Ca 0.20 -1.32 -0.04 0.00 1.00 0.00 0.00 64.86 64.70 1vh5 h ILE 65 Cb 0.12 2.29 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 1vh5 h ILE 65 CO -0.02 0.35 0.03 1.23 0.00 0.00 0.00 178.15 179.74 1vh5 h GLY 66 N -0.49 0.50 0.92 5.37 0.00 -0.90 -0.08 103.07 108.38 1vh5 h GLY 66 Ca 0.00 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 1vh5 h GLY 66 CO 0.01 0.25 -0.12 1.48 0.00 0.00 0.00 176.54 178.16 1vh5 h SER 67 N 0.45 0.65 -0.31 0.19 4.64 -1.11 -0.60 113.55 117.46 1vh5 h SER 67 Ca 0.10 -0.39 -0.05 0.00 -0.47 0.00 0.00 61.79 60.98 1vh5 h SER 67 Cb 0.25 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1vh5 h SER 67 CO 0.00 0.89 -0.00 -0.37 -0.87 0.00 0.00 176.83 176.48 1vh5 h VAL 68 N 0.40 1.26 -0.64 0.95 -1.51 -1.38 -2.02 116.25 113.30 1vh5 h VAL 68 Ca 0.07 -0.95 0.12 0.00 -1.23 0.00 0.00 66.70 64.71 1vh5 h VAL 68 Cb 0.63 1.26 -0.09 0.00 -2.13 0.00 0.00 31.29 30.97 1vh5 h VAL 68 CO 0.04 0.31 0.17 0.00 -1.23 0.00 0.00 177.57 176.85 1vh5 h ALA 69 N 0.84 0.80 -0.24 5.19 0.00 -0.94 -0.70 119.26 124.20 1vh5 h ALA 69 Ca 0.09 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1vh5 h ALA 69 Cb 0.44 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1vh5 h ALA 69 CO 0.02 -0.29 0.13 0.78 0.00 0.00 0.00 179.25 179.89 1vh5 h GLY 70 N 0.30 0.33 0.71 0.00 0.00 -1.02 -2.24 103.07 101.14 1vh5 h GLY 70 Ca 0.34 -0.09 0.06 0.00 0.00 0.00 0.00 47.33 47.64 1vh5 h GLY 70 CO -0.41 0.08 0.45 -1.82 0.00 0.00 0.00 176.54 174.84 1vh5 h TYR 71 N 0.27 0.83 0.00 5.60 3.20 -0.84 -2.04 116.97 123.98 1vh5 h TYR 71 Ca 0.10 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1vh5 h TYR 71 Cb 0.02 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.03 1vh5 h TYR 71 CO -0.09 0.41 0.00 1.28 -1.64 0.00 0.00 178.16 178.12 1vh5 n LEU 72 N -4.70 0.42 -1.20 2.82 4.77 -0.32 -1.50 117.00 117.28 1vh5 n LEU 72 Ca 0.10 0.62 0.11 0.00 -0.03 0.00 0.00 56.01 56.80 1vh5 n LEU 72 Cb 0.17 -0.57 0.28 0.00 -2.33 0.00 0.00 43.42 40.97 1vh5 n LEU 72 CO 0.30 -0.50 0.74 0.00 -1.33 0.00 0.00 177.39 176.60 1vh5 s THR 74 N -1.04 1.58 0.05 0.00 -4.23 -0.56 -4.71 115.64 106.73 1vh5 s THR 74 Ca 0.43 -1.48 -0.02 0.00 -1.18 0.00 0.00 61.69 59.44 1vh5 s THR 74 Cb 0.23 -2.07 -0.03 0.00 1.34 0.00 0.00 72.50 71.97 1vh5 s THR 74 CO 0.30 0.00 -0.00 -1.83 -0.54 0.00 0.00 174.62 172.55 1vh5 s GLU 75 N -4.31 0.59 7.07 3.99 -1.05 -1.26 -4.33 118.70 119.40 1vh5 s GLU 75 Ca 0.33 -1.08 0.00 0.00 -0.15 0.00 0.00 54.97 54.07 1vh5 s GLU 75 Cb -0.02 0.21 0.00 0.00 -0.44 0.00 0.00 34.13 33.88 1vh5 s GLU 75 CO 0.21 -0.12 0.00 0.41 0.95 0.00 0.00 175.26 176.71 1vh5 n GLY 76 N 0.34 3.34 0.54 -3.83 0.00 -1.26 -1.90 105.19 102.42 1vh5 n GLY 76 Ca -0.16 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 45.73 1vh5 n GLY 76 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vh5 n GLU 77 N 14.00 1.70 -1.65 1.61 -0.58 -1.26 -4.91 120.64 129.54 1vh5 n GLU 77 Ca 0.00 -1.06 -0.35 0.00 -0.42 0.00 0.00 57.16 55.33 1vh5 n GLU 77 Cb 0.00 -1.34 0.07 0.00 -0.57 0.00 0.00 31.44 29.60 1vh5 n GLU 77 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1vh5 s GLN 78 N -1.73 2.46 0.24 3.49 -0.21 -0.80 -4.87 119.66 118.24 1vh5 s GLN 78 Ca 0.29 1.81 -0.01 0.00 0.02 0.00 0.00 55.36 57.46 1vh5 s GLN 78 Cb 0.15 -1.87 -0.03 0.00 1.00 0.00 0.00 33.01 32.26 1vh5 s GLN 78 CO 0.22 -1.60 0.21 0.15 -2.12 0.00 0.00 175.29 172.15 1vh5 s LYS 79 N -3.68 1.38 0.13 2.91 1.02 -0.64 -4.73 119.74 116.12 1vh5 s LYS 79 Ca 0.76 -1.67 0.10 0.00 0.02 0.00 0.00 55.97 55.18 1vh5 s LYS 79 Cb -0.30 0.31 -0.04 0.00 -0.52 0.00 0.00 37.83 37.28 1vh5 s LYS 79 CO 0.41 -0.49 -0.22 0.14 -0.92 0.00 0.00 175.35 174.27 1vh5 s VAL 80 N -3.95 2.57 -0.03 3.17 -7.23 -1.26 -0.42 120.40 113.24 1vh5 s VAL 80 Ca 0.37 -1.66 0.04 0.00 -1.81 0.00 0.00 61.98 58.91 1vh5 s VAL 80 Cb 0.05 -2.17 -0.00 0.00 0.56 0.00 0.00 36.38 34.82 1vh5 s VAL 80 CO 0.15 0.07 -0.14 0.68 -0.31 0.00 0.00 175.10 175.55 1vh5 s VAL 81 N -1.18 1.14 0.09 1.32 -7.23 -0.16 -4.95 120.40 109.42 1vh5 s VAL 81 Ca 0.17 -0.56 -0.30 0.00 -1.81 0.00 0.00 61.98 59.47 1vh5 s VAL 81 Cb -0.10 -0.99 -0.06 0.00 0.56 0.00 0.00 36.38 35.79 1vh5 s VAL 81 CO 0.09 0.34 1.18 -0.83 -0.31 0.00 0.00 175.10 175.57 1vh5 s GLY 82 N 0.08 2.49 -0.23 2.32 0.00 -1.26 -0.58 107.32 110.14 1vh5 s GLY 82 Ca -0.03 0.85 -0.14 0.00 0.00 0.00 0.00 44.72 45.40 1vh5 s GLY 82 CO 0.01 1.97 -0.33 1.04 0.00 0.00 0.00 173.10 175.80 1vh5 n LEU 83 N 3.60 1.82 -3.90 0.66 4.77 0.30 -4.91 117.00 119.35 1vh5 n LEU 83 Ca 0.08 0.31 -0.11 0.00 -0.03 0.00 0.00 56.01 56.26 1vh5 n LEU 83 Cb 0.46 -0.74 -0.13 0.00 -2.33 0.00 0.00 43.42 40.68 1vh5 n LEU 83 CO 0.55 0.29 -0.36 -0.70 -1.33 0.00 0.00 177.39 175.84 1vh5 s GLU 84 N -2.57 0.08 0.01 3.23 2.56 -1.10 -5.01 118.70 115.90 1vh5 s GLU 84 Ca -0.33 -0.15 0.01 0.00 0.00 0.00 0.00 54.97 54.50 1vh5 s GLU 84 Cb 0.11 0.03 -0.01 0.00 2.00 0.00 0.00 34.13 36.26 1vh5 s GLU 84 CO 0.43 -0.01 -0.03 -1.50 -0.56 0.00 0.00 175.26 173.59 1vh5 s ILE 85 N -0.36 0.22 0.05 -3.70 2.07 -1.26 -0.90 121.20 117.33 1vh5 s ILE 85 Ca -0.04 -0.47 0.00 0.00 -1.41 0.00 0.00 60.65 58.73 1vh5 s ILE 85 Cb -0.02 -0.26 -0.03 0.00 0.13 0.00 0.00 42.46 42.27 1vh5 s ILE 85 CO -0.00 -0.16 -0.04 0.54 -1.91 0.00 0.00 174.94 173.36 1vh5 s ASN 86 N -0.67 0.59 -0.17 4.50 2.20 -0.42 -4.99 114.94 115.98 1vh5 s ASN 86 Ca -0.05 -0.79 -0.13 0.00 -0.94 0.00 0.00 52.86 50.95 1vh5 s ASN 86 Cb -0.05 0.13 0.05 0.00 -2.00 0.00 0.00 41.25 39.38 1vh5 s ASN 86 CO -0.00 -0.43 0.44 0.00 -2.94 0.00 0.00 177.10 174.18 1vh5 s ALA 87 N -2.75 -1.12 -0.25 3.54 0.00 -1.26 -1.24 121.76 118.67 1vh5 s ALA 87 Ca -0.01 1.40 -0.09 0.00 0.00 0.00 0.00 51.96 53.26 1vh5 s ALA 87 Cb -0.01 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 1vh5 s ALA 87 CO -0.05 -0.24 0.13 -0.80 0.00 0.00 0.00 175.76 174.80 1vh5 s ASN 88 N 0.71 5.66 -0.40 0.00 -0.87 0.51 -4.97 114.94 115.58 1vh5 s ASN 88 Ca -0.04 -0.06 -0.20 0.00 -1.57 0.00 0.00 52.86 50.99 1vh5 s ASN 88 Cb -0.05 -2.03 0.01 0.00 -0.02 0.00 0.00 41.25 39.16 1vh5 s ASN 88 CO -0.05 -0.00 0.61 -1.00 -2.57 0.00 0.00 177.10 174.09 1vh5 s HIS 89 N 1.45 3.11 -0.08 2.20 3.76 -1.26 -1.53 115.29 122.95 1vh5 s HIS 89 Ca 0.06 0.11 0.04 0.00 -0.15 0.00 0.00 55.06 55.12 1vh5 s HIS 89 Cb -0.15 -3.20 -0.05 0.00 1.11 0.00 0.00 32.58 30.29 1vh5 s HIS 89 CO 0.06 -0.73 0.12 1.33 -0.85 0.00 0.00 174.74 174.67 1vh5 n VAL 90 N 5.68 0.00 -3.70 -0.90 0.24 0.15 -5.00 118.33 114.81 1vh5 n VAL 90 Ca -0.02 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.34 61.93 1vh5 n VAL 90 Cb 0.48 0.64 -0.09 0.00 -1.47 0.00 0.00 33.84 33.40 1vh5 n VAL 90 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1vh5 s ARG 91 N -1.93 0.61 0.66 7.34 3.52 -1.07 -4.97 118.95 123.12 1vh5 s ARG 91 Ca -0.00 0.70 -0.11 0.00 -0.13 0.00 0.00 55.73 56.19 1vh5 s ARG 91 Cb 0.03 0.30 -0.01 0.00 -1.56 0.00 0.00 34.95 33.70 1vh5 s ARG 91 CO 0.17 -0.08 1.05 -1.54 -0.81 0.00 0.00 175.30 174.09 1vh5 s SER 92 N 0.23 5.75 0.06 -2.12 1.04 -1.26 -4.55 113.70 112.85 1vh5 s SER 92 Ca -0.00 1.53 0.04 0.00 0.48 0.00 0.00 55.95 58.00 1vh5 s SER 92 Cb -0.04 -2.48 -0.03 0.00 0.10 0.00 0.00 66.02 63.57 1vh5 s SER 92 CO 0.01 -1.20 -0.12 0.00 0.98 0.00 0.00 173.24 172.91 1vh5 s ALA 93 N -3.10 1.01 0.00 5.32 0.00 -1.26 -5.00 121.76 118.72 1vh5 s ALA 93 Ca 0.57 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.59 1vh5 s ALA 93 Cb -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 22.94 1vh5 s ALA 93 CO 0.54 0.11 0.00 2.89 0.00 0.00 0.00 175.76 179.30 1vh5 n ARG 94 N 1.31 3.12 -3.85 0.00 1.85 -1.26 -0.46 116.66 117.36 1vh5 n ARG 94 Ca -0.21 0.00 -0.08 0.00 -1.00 0.00 0.00 57.85 56.56 1vh5 n ARG 94 Cb 0.54 -0.65 -0.01 0.00 -1.05 0.00 0.00 32.46 31.29 1vh5 n ARG 94 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 177.63 175.79 1vh5 s GLU 95 N -0.90 1.94 3.13 2.89 -1.05 -1.26 -4.86 118.70 118.59 1vh5 s GLU 95 Ca 0.00 -1.17 0.00 0.00 -0.15 0.00 0.00 54.97 53.65 1vh5 s GLU 95 Cb 0.00 0.61 0.00 0.00 -0.44 0.00 0.00 34.13 34.30 1vh5 s GLU 95 CO 0.00 -0.89 0.00 0.41 0.95 0.00 0.00 175.26 175.73 1vh5 n GLY 96 N -0.48 -0.03 3.40 -3.83 0.00 -1.26 -4.67 105.19 98.32 1vh5 n GLY 96 Ca -0.05 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 1vh5 n GLY 96 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vh5 s ARG 97 N 0.00 1.71 0.21 1.61 0.52 -1.26 -0.30 118.95 121.45 1vh5 s ARG 97 Ca 0.00 -1.18 0.05 0.00 -0.52 0.00 0.00 55.73 54.08 1vh5 s ARG 97 Cb 0.00 -2.01 -0.04 0.00 0.52 0.00 0.00 34.95 33.42 1vh5 s ARG 97 CO 0.00 0.49 0.23 0.14 0.02 0.00 0.00 175.30 176.18 1vh5 s VAL 98 N -0.97 4.77 -0.12 3.52 -7.23 0.15 -3.25 120.40 117.28 1vh5 s VAL 98 Ca 0.14 -1.11 0.01 0.00 -1.81 0.00 0.00 61.98 59.20 1vh5 s VAL 98 Cb -0.10 -3.52 0.02 0.00 0.56 0.00 0.00 36.38 33.33 1vh5 s VAL 98 CO 0.05 -0.24 -0.13 -0.60 -0.31 0.00 0.00 175.10 173.88 1vh5 s ARG 99 N -3.57 2.03 -0.13 4.82 3.52 0.06 -1.36 118.95 124.33 1vh5 s ARG 99 Ca 0.33 -0.47 -0.09 0.00 -0.13 0.00 0.00 55.73 55.36 1vh5 s ARG 99 Cb -0.09 -1.85 -0.04 0.00 -1.56 0.00 0.00 34.95 31.41 1vh5 s ARG 99 CO 0.26 -0.17 0.19 0.20 -0.81 0.00 0.00 175.30 174.97 1vh5 s GLY 100 N 1.31 2.18 -0.18 8.12 0.00 0.85 -0.74 107.32 118.86 1vh5 s GLY 100 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.13 1vh5 s GLY 100 CO -0.06 -0.12 -0.07 0.14 0.00 0.00 0.00 173.10 172.98 1vh5 s VAL 101 N -0.58 1.32 -0.17 1.40 1.01 0.12 -1.73 120.40 121.76 1vh5 s VAL 101 Ca 0.15 -0.76 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 1vh5 s VAL 101 Cb -0.12 -1.44 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 1vh5 s VAL 101 CO 0.04 0.16 -0.06 0.00 0.00 0.00 0.00 175.10 175.24 1vh5 s LYS 103 N 0.79 0.62 0.22 0.00 1.02 -0.28 -1.54 119.74 120.57 1vh5 s LYS 103 Ca -0.02 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 54.90 1vh5 s LYS 103 Cb -0.15 -0.48 -0.09 0.00 -0.52 0.00 0.00 37.83 36.60 1vh5 s LYS 103 CO 0.02 0.10 1.19 -1.25 -0.92 0.00 0.00 175.35 174.48 1vh5 s PRO 104 N -1.50 4.52 -0.11 -1.68 0.04 -1.26 -0.90 135.00 134.10 1vh5 s PRO 104 Ca -0.06 1.89 0.10 0.00 0.04 0.00 0.00 61.00 62.97 1vh5 s PRO 104 Cb -0.09 -3.21 -0.24 0.00 0.04 0.00 0.00 34.50 31.00 1vh5 s PRO 104 CO 0.01 -0.02 0.40 1.28 0.04 0.00 0.00 177.00 178.71 1vh5 n LEU 105 N 2.00 1.14 -3.65 -3.56 4.77 0.70 -4.83 117.00 113.57 1vh5 n LEU 105 Ca 0.03 0.24 -0.07 0.00 -0.03 0.00 0.00 56.01 56.17 1vh5 n LEU 105 Cb 0.44 -0.06 -0.08 0.00 -2.33 0.00 0.00 43.42 41.40 1vh5 n LEU 105 CO 0.56 0.54 0.26 -2.28 -1.33 0.00 0.00 177.39 175.14 1vh5 s HIS 106 N -2.56 -0.99 -0.32 -1.77 5.04 -0.78 -4.96 115.29 108.94 1vh5 s HIS 106 Ca -0.11 1.96 -0.01 0.00 -1.54 0.00 0.00 55.06 55.36 1vh5 s HIS 106 Cb 0.07 0.57 0.07 0.00 0.04 0.00 0.00 32.58 33.33 1vh5 s HIS 106 CO 0.80 -0.50 0.03 -0.51 -2.34 0.00 0.00 174.74 172.22 1vh5 s LEU 107 N 1.78 4.20 0.53 8.88 1.43 -1.26 -0.76 118.68 133.47 1vh5 s LEU 107 Ca -0.09 -1.54 0.07 0.00 -1.03 0.00 0.00 54.13 51.54 1vh5 s LEU 107 Cb -0.07 -1.70 0.04 0.00 0.03 0.00 0.00 46.19 44.48 1vh5 s LEU 107 CO -0.18 -0.32 0.47 -0.83 0.23 0.00 0.00 176.35 175.72 1vh5 s GLY 108 N 1.30 2.20 0.43 -3.19 0.00 -0.19 -5.02 107.32 102.86 1vh5 s GLY 108 Ca -0.01 -1.56 0.28 0.00 0.00 0.00 0.00 44.72 43.42 1vh5 s GLY 108 CO -0.03 -1.85 1.80 1.76 0.00 0.00 0.00 173.10 174.79 1vh5 h SER 109 N 0.69 0.00 0.00 1.64 0.02 -2.00 -3.37 113.55 110.53 1vh5 h SER 109 Ca -0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1vh5 h SER 109 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1vh5 h SER 109 CO 0.54 0.00 -0.60 -1.14 -1.14 0.00 0.00 176.83 174.49 1vh5 n ARG 110 N -2.88 2.38 -3.87 3.45 0.00 -1.26 -4.85 116.66 109.63 1vh5 n ARG 110 Ca 0.03 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.79 1vh5 n ARG 110 Cb 0.38 -0.80 -0.07 0.00 0.00 0.00 0.00 32.46 31.97 1vh5 n ARG 110 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1vh5 s HIS 111 N -1.26 0.17 0.09 -0.14 -3.43 -1.26 -1.03 115.29 108.43 1vh5 s HIS 111 Ca 0.00 -0.61 0.02 0.00 -0.80 0.00 0.00 55.06 53.68 1vh5 s HIS 111 Cb 0.00 -0.08 -0.04 0.00 -1.43 0.00 0.00 32.58 31.04 1vh5 s HIS 111 CO 0.00 -0.53 -0.08 -0.65 -2.00 0.00 0.00 174.74 171.48 1vh5 s GLN 112 N -3.85 0.81 -0.09 -0.38 -0.21 -0.56 -1.03 119.66 114.35 1vh5 s GLN 112 Ca 0.05 -1.21 0.00 0.00 0.02 0.00 0.00 55.36 54.22 1vh5 s GLN 112 Cb 0.05 -0.33 0.02 0.00 1.00 0.00 0.00 33.01 33.75 1vh5 s GLN 112 CO -0.11 0.02 -0.09 0.08 -2.12 0.00 0.00 175.29 173.08 1vh5 s VAL 113 N -2.98 1.03 0.01 1.09 1.01 0.06 -0.85 120.40 119.77 1vh5 s VAL 113 Ca 0.07 -0.34 0.06 0.00 0.00 0.00 0.00 61.98 61.77 1vh5 s VAL 113 Cb 0.01 -1.01 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 1vh5 s VAL 113 CO -0.02 0.36 -0.16 0.26 0.00 0.00 0.00 175.10 175.53 1vh5 s TRP 114 N 1.34 2.63 -0.12 5.22 0.52 0.11 -0.21 118.94 128.42 1vh5 s TRP 114 Ca -0.02 -0.21 -0.01 0.00 0.02 0.00 0.00 56.10 55.88 1vh5 s TRP 114 Cb -0.14 -1.53 -0.02 0.00 -1.15 0.00 0.00 33.47 30.64 1vh5 s TRP 114 CO -0.04 0.24 -0.11 -1.14 0.02 0.00 0.00 176.95 175.92 1vh5 s GLN 115 N -1.23 3.33 -0.16 4.98 0.74 -0.08 -1.13 119.66 126.12 1vh5 s GLN 115 Ca 0.14 -0.64 0.00 0.00 0.05 0.00 0.00 55.36 54.92 1vh5 s GLN 115 Cb -0.11 -2.67 0.02 0.00 1.10 0.00 0.00 33.01 31.36 1vh5 s GLN 115 CO 0.04 0.29 -0.14 0.42 -0.55 0.00 0.00 175.29 175.35 1vh5 s ILE 116 N 0.17 1.64 -0.14 -2.34 1.09 0.10 -1.13 121.20 120.59 1vh5 s ILE 116 Ca -0.06 -0.71 -0.06 0.00 -1.10 0.00 0.00 60.65 58.72 1vh5 s ILE 116 Cb -0.15 -1.55 -0.04 0.00 -1.06 0.00 0.00 42.46 39.67 1vh5 s ILE 116 CO 0.04 0.43 0.06 -1.61 -0.10 0.00 0.00 174.94 173.77 1vh5 s GLU 117 N 1.45 3.53 -0.14 2.79 2.02 -0.21 -0.92 118.70 127.22 1vh5 s GLU 117 Ca 0.04 -0.31 0.01 0.00 0.02 0.00 0.00 54.97 54.74 1vh5 s GLU 117 Cb -0.13 -3.08 -0.00 0.00 0.10 0.00 0.00 34.13 31.02 1vh5 s GLU 117 CO -0.11 0.54 -0.18 0.42 0.02 0.00 0.00 175.26 175.96 1vh5 s ILE 118 N -0.40 2.51 0.06 -1.63 1.01 0.50 -0.71 121.20 122.56 1vh5 s ILE 118 Ca 0.09 -0.84 0.07 0.00 0.00 0.00 0.00 60.65 59.98 1vh5 s ILE 118 Cb -0.12 -2.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.28 1vh5 s ILE 118 CO 0.02 0.53 -0.15 -0.36 0.00 0.00 0.00 174.94 174.98 1vh5 s PHE 119 N 0.65 2.63 1.08 3.97 0.40 0.08 -0.20 117.98 126.58 1vh5 s PHE 119 Ca -0.09 -0.21 -0.18 0.00 -0.60 0.00 0.00 56.93 55.84 1vh5 s PHE 119 Cb -0.16 -1.45 0.26 0.00 0.51 0.00 0.00 43.02 42.18 1vh5 s PHE 119 CO 0.02 0.33 1.22 -0.40 0.70 0.00 0.00 175.22 177.09 1vh5 n ASP 120 N 1.23 -0.85 0.27 1.36 3.85 -0.16 -0.76 116.55 121.49 1vh5 n ASP 120 Ca -0.15 -1.34 0.18 0.00 -0.71 0.00 0.00 54.79 52.77 1vh5 n ASP 120 Cb 0.52 -1.00 0.86 0.00 -1.35 0.00 0.00 41.12 40.15 1vh5 n ASP 120 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 1vh5 h GLU 121 N 0.00 0.00 -0.33 0.11 4.11 -1.85 0.51 114.58 117.13 1vh5 h GLU 121 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.01 1vh5 h GLU 121 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1vh5 h GLU 121 CO 0.29 0.00 0.00 1.63 0.07 0.00 0.00 179.01 181.00 1vh5 n LYS 122 N -2.92 2.14 -0.83 1.06 5.02 -1.26 -4.94 118.16 116.43 1vh5 n LYS 122 Ca -0.01 -1.74 0.00 0.00 -2.02 0.00 0.00 58.31 54.55 1vh5 n LYS 122 Cb 0.19 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 1vh5 n LYS 122 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vh5 n GLY 123 N 1.32 0.55 3.80 0.72 0.00 0.17 -5.03 105.19 106.73 1vh5 n GLY 123 Ca 0.18 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 1vh5 n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vh5 s ARG 124 N -0.61 4.11 0.13 1.61 0.52 -1.26 -4.79 118.95 118.67 1vh5 s ARG 124 Ca 0.00 0.55 -0.31 0.00 -0.52 0.00 0.00 55.73 55.45 1vh5 s ARG 124 Cb 0.00 -3.27 -0.10 0.00 0.52 0.00 0.00 34.95 32.10 1vh5 s ARG 124 CO 0.00 0.57 1.77 -1.17 0.02 0.00 0.00 175.30 176.49 1vh5 s LEU 125 N -0.75 4.39 -0.06 2.53 2.96 -1.26 -0.99 118.68 125.49 1vh5 s LEU 125 Ca 0.26 2.73 0.04 0.00 -0.22 0.00 0.00 54.13 56.95 1vh5 s LEU 125 Cb -0.18 -3.57 -0.07 0.00 0.50 0.00 0.00 46.19 42.88 1vh5 s LEU 125 CO 0.15 -0.97 0.00 0.00 -1.32 0.00 0.00 176.35 174.21 1vh5 s SER 128 N 0.69 2.85 0.08 0.00 0.15 -0.58 -0.37 113.70 116.52 1vh5 s SER 128 Ca -0.04 -0.54 0.04 0.00 0.70 0.00 0.00 55.95 56.11 1vh5 s SER 128 Cb -0.05 -1.30 -0.03 0.00 -1.71 0.00 0.00 66.02 62.93 1vh5 s SER 128 CO -0.05 0.00 -0.12 -0.94 1.20 0.00 0.00 173.24 173.34 1vh5 s SER 129 N 1.18 1.50 -0.03 5.45 1.04 -0.10 -0.37 113.70 122.37 1vh5 s SER 129 Ca -0.00 -0.69 0.07 0.00 0.48 0.00 0.00 55.95 55.80 1vh5 s SER 129 Cb -0.14 -0.02 -0.01 0.00 0.10 0.00 0.00 66.02 65.95 1vh5 s SER 129 CO -0.07 -0.17 -0.24 -0.13 0.98 0.00 0.00 173.24 173.61 1vh5 s ARG 130 N -2.17 2.11 -0.12 4.02 3.00 -0.38 -0.72 118.95 124.70 1vh5 s ARG 130 Ca 0.00 -0.85 0.03 0.00 0.00 0.00 0.00 55.73 54.91 1vh5 s ARG 130 Cb -0.07 -1.94 0.01 0.00 0.00 0.00 0.00 34.95 32.95 1vh5 s ARG 130 CO 0.01 0.45 -0.21 -1.17 0.00 0.00 0.00 175.30 174.39 1vh5 s LEU 131 N -0.39 2.00 -0.21 2.53 2.96 -0.28 -1.30 118.68 123.99 1vh5 s LEU 131 Ca 0.04 -0.54 -0.07 0.00 -0.22 0.00 0.00 54.13 53.34 1vh5 s LEU 131 Cb -0.11 -1.33 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 1vh5 s LEU 131 CO 0.01 0.08 0.06 -0.89 -1.32 0.00 0.00 176.35 174.29 1vh5 s THR 132 N 0.74 4.53 0.25 3.68 2.01 -0.08 -0.71 115.64 126.06 1vh5 s THR 132 Ca -0.10 -0.11 0.11 0.00 0.31 0.00 0.00 61.69 61.90 1vh5 s THR 132 Cb -0.16 -3.08 -0.05 0.00 0.01 0.00 0.00 72.50 69.23 1vh5 s THR 132 CO 0.01 0.40 -0.17 0.42 -0.69 0.00 0.00 174.62 174.59 1vh5 s THR 133 N 0.95 2.65 -0.06 -0.82 -4.23 -0.03 -0.54 115.64 113.56 1vh5 s THR 133 Ca 0.04 -2.20 -0.02 0.00 -1.18 0.00 0.00 61.69 58.33 1vh5 s THR 133 Cb -0.14 -2.37 -0.04 0.00 1.34 0.00 0.00 72.50 71.30 1vh5 s THR 133 CO 0.03 -0.32 0.04 0.00 -0.54 0.00 0.00 174.62 173.83 1vh5 s ALA 134 N -2.25 3.44 -0.22 3.99 0.00 0.25 -1.49 121.76 125.48 1vh5 s ALA 134 Ca 0.28 -0.82 -0.15 0.00 0.00 0.00 0.00 51.96 51.27 1vh5 s ALA 134 Cb -0.06 -1.55 -0.04 0.00 0.00 0.00 0.00 23.12 21.47 1vh5 s ALA 134 CO 0.15 0.63 0.37 0.42 0.00 0.00 0.00 175.76 177.32 1vh5 s ILE 135 N -1.01 5.21 -0.14 0.00 1.01 -0.20 -0.99 121.20 125.07 1vh5 s ILE 135 Ca 0.17 0.63 -0.03 0.00 0.00 0.00 0.00 60.65 61.41 1vh5 s ILE 135 Cb -0.12 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 1vh5 s ILE 135 CO 0.07 0.24 -0.03 -0.76 0.00 0.00 0.00 174.94 174.46 1vh5 s LEU 136 N 1.44 3.32 0.00 2.97 1.43 0.44 -4.87 118.68 123.40 1vh5 s LEU 136 Ca 0.17 -0.07 0.13 0.00 -1.03 0.00 0.00 54.13 53.33 1vh5 s LEU 136 Cb -0.15 -1.79 0.80 0.00 0.03 0.00 0.00 46.19 45.08 1vh5 s LEU 136 CO 0.08 0.21 1.22 -0.62 0.23 0.00 0.00 176.35 177.47