#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vh9 s LEU 1 N 0.00 4.39 -0.04 1.04 2.96 -1.26 -4.16 118.68 121.61 1vh9 s LEU 1 Ca 0.00 2.08 0.08 0.00 -0.22 0.00 0.00 54.13 56.07 1vh9 s LEU 1 Cb 0.00 -3.58 -0.12 0.00 0.50 0.00 0.00 46.19 42.99 1vh9 s LEU 1 CO 0.00 -0.46 0.11 2.30 -1.32 0.00 0.00 176.35 176.98 1vh9 n ILE 2 N 3.64 0.27 -1.70 6.68 -5.35 -0.42 -5.02 119.36 117.46 1vh9 n ILE 2 Ca 0.08 -0.27 -0.43 0.00 -0.27 0.00 0.00 62.75 61.86 1vh9 n ILE 2 Cb 0.46 -0.22 -0.02 0.00 -1.74 0.00 0.00 39.64 38.11 1vh9 n ILE 2 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 1vh9 n TRP 3 N -2.04 2.37 -0.06 4.28 5.03 -1.26 -4.93 117.44 120.84 1vh9 n TRP 3 Ca -0.07 0.41 -0.16 0.00 3.03 0.00 0.00 57.50 60.71 1vh9 n TRP 3 Cb 0.48 -2.49 -0.14 0.00 -1.03 0.00 0.00 31.31 28.14 1vh9 n TRP 3 CO 0.00 0.00 0.00 1.63 -0.03 0.00 0.00 177.69 179.29 1vh9 n LYS 4 N 1.73 0.69 -3.69 -0.99 4.76 0.08 -4.82 118.16 115.92 1vh9 n LYS 4 Ca 0.09 0.19 -0.36 0.00 -2.87 0.00 0.00 58.31 55.37 1vh9 n LYS 4 Cb 0.34 -1.64 -0.09 0.00 -1.84 0.00 0.00 35.03 31.80 1vh9 n LYS 4 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1vh9 s ARG 5 N -2.54 4.12 -0.46 1.97 0.52 -0.40 -5.01 118.95 117.15 1vh9 s ARG 5 Ca -0.21 -0.25 -0.11 0.00 -0.52 0.00 0.00 55.73 54.64 1vh9 s ARG 5 Cb 0.07 -3.49 0.10 0.00 0.52 0.00 0.00 34.95 32.16 1vh9 s ARG 5 CO 0.74 0.17 0.34 -1.01 0.02 0.00 0.00 175.30 175.55 1vh9 s HIS 6 N 0.75 3.34 0.39 -0.53 3.76 -1.26 -4.91 115.29 116.83 1vh9 s HIS 6 Ca 0.08 -1.50 0.08 0.00 -0.15 0.00 0.00 55.06 53.56 1vh9 s HIS 6 Cb -0.12 -3.26 -0.07 0.00 1.11 0.00 0.00 32.58 30.24 1vh9 s HIS 6 CO 0.02 -0.90 -0.01 -0.51 -0.85 0.00 0.00 174.74 172.49 1vh9 s LEU 7 N 1.46 2.86 0.31 0.89 1.43 -1.26 -5.16 118.68 119.21 1vh9 s LEU 7 Ca 0.04 -1.31 0.07 0.00 -1.03 0.00 0.00 54.13 51.91 1vh9 s LEU 7 Cb -0.25 -0.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.98 1vh9 s LEU 7 CO 0.02 -0.39 0.24 0.42 0.23 0.00 0.00 176.35 176.87 1vh9 s THR 8 N -2.68 3.77 0.24 5.49 -4.23 -1.26 -4.98 115.64 112.00 1vh9 s THR 8 Ca 0.35 -1.43 -0.06 0.00 -1.18 0.00 0.00 61.69 59.37 1vh9 s THR 8 Cb 0.08 -3.22 0.24 0.00 1.34 0.00 0.00 72.50 70.93 1vh9 s THR 8 CO 0.18 -0.24 1.89 -0.07 -0.54 0.00 0.00 174.62 175.85 1vh9 h LEU 9 N 1.37 1.02 -0.86 4.79 3.38 -1.98 0.60 115.31 123.63 1vh9 h LEU 9 Ca -0.46 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.52 1vh9 h LEU 9 Cb 1.25 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 1vh9 h LEU 9 CO 0.60 0.70 0.56 0.44 0.09 0.00 0.00 178.44 180.83 1vh9 h ASP 10 N 1.19 0.96 -0.31 -0.43 5.19 -1.95 0.46 116.42 121.52 1vh9 h ASP 10 Ca 0.37 -0.02 -0.17 0.00 -0.62 0.00 0.00 57.03 56.59 1vh9 h ASP 10 Cb -0.01 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.26 1vh9 h ASP 10 CO -0.12 0.69 -0.46 -0.33 -3.12 0.00 0.00 179.24 175.90 1vh9 h GLU 11 N 1.13 0.89 -0.13 3.56 5.08 -1.76 -2.35 114.58 121.00 1vh9 h GLU 11 Ca 0.32 -0.51 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1vh9 h GLU 11 Cb -0.09 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1vh9 h GLU 11 CO -0.08 1.15 0.07 -0.07 -1.00 0.00 0.00 179.01 179.08 1vh9 h LEU 12 N 0.71 0.12 -1.73 1.33 3.38 -0.24 -2.36 115.31 116.51 1vh9 h LEU 12 Ca 0.04 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1vh9 h LEU 12 Cb 1.05 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1vh9 h LEU 12 CO 0.11 0.09 -0.17 0.78 0.09 0.00 0.00 178.44 179.33 1vh9 h ASN 13 N 0.15 0.00 0.59 -0.43 2.35 -0.90 -2.41 115.58 114.93 1vh9 h ASN 13 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1vh9 h ASN 13 Cb -0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1vh9 h ASN 13 CO -0.03 0.17 0.00 0.00 -1.65 0.00 0.00 177.43 175.93 1vh9 h ALA 14 N 1.83 1.00 0.00 -0.83 0.00 -0.86 -2.34 119.26 118.05 1vh9 h ALA 14 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1vh9 h ALA 14 Cb 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1vh9 h ALA 14 CO 0.02 0.00 -0.20 1.79 0.00 0.00 0.00 179.25 180.87 1vh9 h THR 15 N 0.00 0.26 0.00 0.00 1.35 -1.42 -3.27 112.91 109.83 1vh9 h THR 15 Ca 0.00 -1.37 -0.04 0.00 -0.55 0.00 0.00 66.41 64.45 1vh9 h THR 15 Cb 0.30 2.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 1vh9 h THR 15 CO 0.00 0.15 -0.20 0.28 -0.25 0.00 0.00 175.52 175.49 1vh9 h SER 16 N 0.00 0.00 -1.60 5.36 0.02 -1.56 -3.46 113.55 112.31 1vh9 h SER 16 Ca -0.00 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.24 1vh9 h SER 16 Cb 1.12 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.69 1vh9 h SER 16 CO 0.02 0.20 0.67 0.47 -1.14 0.00 0.00 176.83 177.05 1vh9 n ASP 17 N -3.39 1.99 -1.97 3.07 9.92 -1.24 -1.57 116.55 123.38 1vh9 n ASP 17 Ca 0.00 1.10 -0.16 0.00 -0.53 0.00 0.00 54.79 55.20 1vh9 n ASP 17 Cb 0.41 -1.16 0.00 0.00 -0.64 0.00 0.00 41.12 39.73 1vh9 n ASP 17 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1vh9 n ASN 18 N 3.93 -4.81 -3.44 -2.24 3.02 -1.26 -5.01 115.26 105.44 1vh9 n ASN 18 Ca 0.22 -0.08 -0.21 0.00 -0.03 0.00 0.00 54.58 54.49 1vh9 n ASN 18 Cb 0.16 -3.84 -0.06 0.00 -0.61 0.00 0.00 39.78 35.43 1vh9 n ASN 18 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1vh9 n THR 19 N -4.08 0.00 0.18 3.41 -2.24 -0.61 -5.03 114.28 105.91 1vh9 n THR 19 Ca -0.15 -1.90 0.02 0.00 -2.27 0.00 0.00 64.05 59.74 1vh9 n THR 19 Cb 0.63 0.66 0.32 0.00 -2.10 0.00 0.00 70.33 69.84 1vh9 n THR 19 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1vh9 h MET 20 N 0.00 0.00 -0.34 -0.78 4.05 -1.95 -2.58 114.93 113.32 1vh9 h MET 20 Ca -0.26 0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.20 1vh9 h MET 20 Cb 0.98 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.74 1vh9 h MET 20 CO 0.41 0.43 0.13 0.28 0.23 0.00 0.00 176.91 178.38 1vh9 h VAL 21 N 0.00 0.91 -0.12 -5.77 2.07 -1.95 -1.82 116.25 109.57 1vh9 h VAL 21 Ca -0.00 -0.09 -0.16 0.00 0.82 0.00 0.00 66.70 67.26 1vh9 h VAL 21 Cb 0.76 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1vh9 h VAL 21 CO 0.06 0.05 -0.62 0.00 0.02 0.00 0.00 177.57 177.08 1vh9 h ALA 22 N 1.22 0.71 0.00 1.67 0.00 -1.57 -1.81 119.26 119.48 1vh9 h ALA 22 Ca 0.15 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1vh9 h ALA 22 Cb 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1vh9 h ALA 22 CO -0.15 0.72 -0.01 1.25 0.00 0.00 0.00 179.25 181.05 1vh9 h HIS 23 N 0.31 0.00 -0.03 0.00 2.76 -1.00 -1.56 115.15 115.63 1vh9 h HIS 23 Ca -0.01 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1vh9 h HIS 23 Cb 1.16 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.12 1vh9 h HIS 23 CO 0.04 0.01 0.00 1.28 -1.30 0.00 0.00 177.93 177.96 1vh9 n LEU 24 N -3.92 2.75 -0.31 0.26 4.77 -0.74 -4.98 117.00 114.83 1vh9 n LEU 24 Ca -0.03 -1.00 -0.04 0.00 -0.03 0.00 0.00 56.01 54.91 1vh9 n LEU 24 Cb 0.10 -0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1vh9 n LEU 24 CO 0.29 0.47 -0.04 0.61 -1.33 0.00 0.00 177.39 177.39 1vh9 n GLY 25 N 1.18 0.52 3.70 -0.72 0.00 -0.59 -4.44 105.19 104.85 1vh9 n GLY 25 Ca 0.12 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 1vh9 n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vh9 s ILE 26 N -2.15 4.31 -0.11 -0.61 1.01 -0.69 -4.40 121.20 118.56 1vh9 s ILE 26 Ca 0.00 1.64 0.01 0.00 0.00 0.00 0.00 60.65 62.30 1vh9 s ILE 26 Cb 0.00 -4.06 0.02 0.00 0.01 0.00 0.00 42.46 38.44 1vh9 s ILE 26 CO 0.00 0.06 -0.12 -0.69 0.00 0.00 0.00 174.94 174.19 1vh9 s VAL 27 N 1.65 1.29 0.15 2.92 1.01 -0.61 -4.68 120.40 122.13 1vh9 s VAL 27 Ca 0.56 -0.48 -0.31 0.00 0.00 0.00 0.00 61.98 61.74 1vh9 s VAL 27 Cb -0.25 -1.23 -0.10 0.00 0.00 0.00 0.00 36.38 34.80 1vh9 s VAL 27 CO 0.25 0.41 1.57 -0.31 0.00 0.00 0.00 175.10 177.02 1vh9 s TYR 28 N 1.34 3.00 0.00 5.22 2.02 -1.26 -1.38 117.35 126.29 1vh9 s TYR 28 Ca -0.00 0.60 0.00 0.00 -0.37 0.00 0.00 57.07 57.29 1vh9 s TYR 28 Cb -0.14 -3.93 0.00 0.00 -0.40 0.00 0.00 41.96 37.50 1vh9 s TYR 28 CO -0.06 -3.45 0.00 0.25 -1.57 0.00 0.00 175.55 170.72 1vh9 n THR 29 N 4.05 0.00 -3.64 -0.71 -2.24 0.16 -4.92 114.28 106.99 1vh9 n THR 29 Ca 0.14 -0.40 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 1vh9 n THR 29 Cb 0.39 1.00 -0.07 0.00 -2.10 0.00 0.00 70.33 69.55 1vh9 n THR 29 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1vh9 s ARG 30 N -0.79 0.77 -0.27 -0.78 3.52 -1.05 -4.97 118.95 115.39 1vh9 s ARG 30 Ca 0.00 1.04 -0.02 0.00 -0.13 0.00 0.00 55.73 56.61 1vh9 s ARG 30 Cb 0.00 0.31 0.09 0.00 -1.56 0.00 0.00 34.95 33.79 1vh9 s ARG 30 CO 0.00 -0.11 0.09 -1.17 -0.81 0.00 0.00 175.30 173.30 1vh9 s LEU 31 N 0.75 1.39 0.00 -0.88 2.96 -1.26 -0.75 118.68 120.89 1vh9 s LEU 31 Ca -0.03 -1.28 0.00 0.00 -0.22 0.00 0.00 54.13 52.60 1vh9 s LEU 31 Cb -0.05 -0.62 0.00 0.00 0.50 0.00 0.00 46.19 46.02 1vh9 s LEU 31 CO -0.05 -0.39 0.00 0.61 -1.32 0.00 0.00 176.35 175.19 1vh9 n GLY 32 N 5.04 1.26 0.16 7.98 0.00 -0.17 -5.00 105.19 114.46 1vh9 n GLY 32 Ca -0.05 -1.98 0.03 0.00 0.00 0.00 0.00 46.02 44.02 1vh9 n GLY 32 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1vh9 h ASP 33 N 0.00 0.00 0.00 1.61 5.19 -2.00 -3.37 116.42 117.86 1vh9 h ASP 33 Ca 0.00 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.26 1vh9 h ASP 33 Cb 0.00 0.00 -0.28 0.00 0.18 0.00 0.00 39.33 39.23 1vh9 h ASP 33 CO 0.00 0.48 -0.75 -0.90 -3.12 0.00 0.00 179.24 174.95 1vh9 n ASP 34 N -3.42 0.28 -3.70 6.45 3.85 -1.26 -1.30 116.55 117.45 1vh9 n ASP 34 Ca 0.00 -1.98 -0.14 0.00 -0.71 0.00 0.00 54.79 51.96 1vh9 n ASP 34 Cb 0.63 -0.09 -0.08 0.00 -1.35 0.00 0.00 41.12 40.22 1vh9 n ASP 34 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1vh9 s VAL 35 N 0.00 0.03 -0.06 2.12 0.11 -1.26 -4.50 120.40 116.84 1vh9 s VAL 35 Ca 0.21 -0.27 0.00 0.00 -2.93 0.00 0.00 61.98 58.99 1vh9 s VAL 35 Cb 0.24 -0.70 0.02 0.00 -1.53 0.00 0.00 36.38 34.41 1vh9 s VAL 35 CO -0.10 -0.15 -0.04 -0.22 -3.33 0.00 0.00 175.10 171.26 1vh9 s LEU 36 N -0.99 1.13 0.11 2.54 2.96 -0.84 -1.00 118.68 122.58 1vh9 s LEU 36 Ca -0.10 -0.14 0.10 0.00 -0.22 0.00 0.00 54.13 53.77 1vh9 s LEU 36 Cb -0.04 -0.50 -0.04 0.00 0.50 0.00 0.00 46.19 46.12 1vh9 s LEU 36 CO 0.05 -0.09 -0.27 -1.61 -1.32 0.00 0.00 176.35 173.11 1vh9 s GLU 37 N 1.26 1.50 -0.06 1.98 2.02 0.07 -1.13 118.70 124.34 1vh9 s GLU 37 Ca -0.05 -1.28 -0.14 0.00 0.02 0.00 0.00 54.97 53.52 1vh9 s GLU 37 Cb -0.14 -1.90 0.03 0.00 0.10 0.00 0.00 34.13 32.22 1vh9 s GLU 37 CO -0.02 0.46 0.32 0.00 0.02 0.00 0.00 175.26 176.05 1vh9 s ALA 38 N -0.99 -0.81 0.13 5.21 0.00 -0.94 -0.67 121.76 123.69 1vh9 s ALA 38 Ca 0.13 0.61 0.08 0.00 0.00 0.00 0.00 51.96 52.78 1vh9 s ALA 38 Cb -0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1vh9 s ALA 38 CO 0.05 -0.22 -0.11 -1.21 0.00 0.00 0.00 175.76 174.27 1vh9 s GLU 39 N -0.66 2.07 -0.00 0.00 2.02 -0.48 -0.50 118.70 121.14 1vh9 s GLU 39 Ca -0.08 -1.10 0.01 0.00 0.02 0.00 0.00 54.97 53.82 1vh9 s GLU 39 Cb -0.04 -2.25 -0.00 0.00 0.10 0.00 0.00 34.13 31.94 1vh9 s GLU 39 CO 0.03 0.49 -0.03 1.41 0.02 0.00 0.00 175.26 177.18 1vh9 s MET 40 N -2.36 0.21 0.45 1.61 -2.45 -0.62 -1.58 119.30 114.56 1vh9 s MET 40 Ca 0.22 -0.09 -0.20 0.00 -1.25 0.00 0.00 55.69 54.37 1vh9 s MET 40 Cb -0.10 -0.21 -0.10 0.00 1.25 0.00 0.00 34.83 35.67 1vh9 s MET 40 CO 0.14 0.05 0.97 -1.25 1.05 0.00 0.00 175.02 175.98 1vh9 s PRO 41 N -0.04 4.12 -0.74 4.11 0.04 -1.26 -1.13 135.00 140.10 1vh9 s PRO 41 Ca 0.01 1.12 -0.05 0.00 0.04 0.00 0.00 61.00 62.11 1vh9 s PRO 41 Cb -0.01 -2.16 0.19 0.00 0.04 0.00 0.00 34.50 32.56 1vh9 s PRO 41 CO -0.00 -0.12 0.60 0.08 0.04 0.00 0.00 177.00 177.59 1vh9 s VAL 42 N -2.24 4.34 0.00 -0.36 1.01 -0.44 -4.68 120.40 118.03 1vh9 s VAL 42 Ca 0.62 -3.04 0.00 0.00 0.00 0.00 0.00 61.98 59.57 1vh9 s VAL 42 Cb -0.10 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.53 1vh9 s VAL 42 CO 0.17 -0.96 0.00 -0.90 0.00 0.00 0.00 175.10 173.41 1vh9 n ASP 43 N 3.35 0.00 -0.38 3.32 3.85 -1.26 -4.48 116.55 120.96 1vh9 n ASP 43 Ca 0.12 -0.90 0.35 0.00 -0.71 0.00 0.00 54.79 53.65 1vh9 n ASP 43 Cb 0.40 0.00 0.61 0.00 -1.35 0.00 0.00 41.12 40.78 1vh9 n ASP 43 CO 0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.20 177.26 1vh9 n THR 44 N 0.00 -0.33 0.20 2.12 5.66 -1.26 -0.32 114.28 120.35 1vh9 n THR 44 Ca 0.00 1.87 0.07 0.00 -3.05 0.00 0.00 64.05 62.94 1vh9 n THR 44 Cb 0.00 -3.06 0.40 0.00 -1.55 0.00 0.00 70.33 66.12 1vh9 n THR 44 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 1vh9 h ARG 45 N 0.00 0.00 0.00 1.09 3.08 -1.95 -3.28 114.38 113.32 1vh9 h ARG 45 Ca 0.84 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.89 1vh9 h ARG 45 Cb 2.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.51 1vh9 h ARG 45 CO -0.61 0.32 -0.00 0.25 -1.07 0.00 0.00 179.97 178.86 1vh9 n THR 46 N -3.56 1.02 -2.26 2.04 -2.24 0.56 -4.98 114.28 104.86 1vh9 n THR 46 Ca -0.00 -1.06 -0.30 0.00 -2.27 0.00 0.00 64.05 60.41 1vh9 n THR 46 Cb 0.46 0.45 -0.00 0.00 -2.10 0.00 0.00 70.33 69.14 1vh9 n THR 46 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1vh9 s HIS 47 N -1.13 3.57 0.24 4.78 3.76 -0.36 -0.84 115.29 125.32 1vh9 s HIS 47 Ca 0.03 1.17 0.11 0.00 -0.15 0.00 0.00 55.06 56.22 1vh9 s HIS 47 Cb 0.03 -2.59 -0.05 0.00 1.11 0.00 0.00 32.58 31.08 1vh9 s HIS 47 CO 0.00 -0.47 -0.13 1.14 -0.85 0.00 0.00 174.74 174.44 1vh9 s GLN 48 N -4.74 1.92 0.00 1.40 -2.07 -0.33 -4.56 119.66 111.28 1vh9 s GLN 48 Ca 0.53 -1.53 -0.00 0.00 -1.82 0.00 0.00 55.36 52.54 1vh9 s GLN 48 Cb -0.11 -1.97 -0.00 0.00 -1.09 0.00 0.00 33.01 29.84 1vh9 s GLN 48 CO 0.45 0.37 0.03 -2.30 -1.32 0.00 0.00 175.29 172.52 1vh9 n PRO 49 N -0.46 -0.00 0.32 9.60 -0.02 -1.26 0.03 135.00 143.21 1vh9 n PRO 49 Ca -0.08 0.03 0.20 0.00 -2.02 0.00 0.00 63.50 61.64 1vh9 n PRO 49 Cb 0.58 -0.04 1.05 0.00 -0.02 0.00 0.00 33.50 35.07 1vh9 n PRO 49 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 1vh9 h PHE 50 N 0.00 0.00 0.00 6.00 -1.00 -2.03 -3.45 116.94 116.46 1vh9 h PHE 50 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1vh9 h PHE 50 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1vh9 h PHE 50 CO -0.02 0.01 0.00 0.41 -1.61 0.00 0.00 178.31 177.10 1vh9 n GLY 51 N -0.84 0.93 3.92 -1.45 0.00 0.10 -5.12 105.19 102.74 1vh9 n GLY 51 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 1vh9 n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vh9 s LEU 52 N 0.00 2.76 -0.01 0.99 1.43 -1.24 -4.73 118.68 117.88 1vh9 s LEU 52 Ca 0.00 0.56 -0.30 0.00 -1.03 0.00 0.00 54.13 53.36 1vh9 s LEU 52 Cb 0.00 -3.19 -0.05 0.00 0.03 0.00 0.00 46.19 42.98 1vh9 s LEU 52 CO 0.00 -1.64 1.34 -0.22 0.23 0.00 0.00 176.35 176.06 1vh9 s LEU 53 N -5.32 4.31 0.22 1.79 2.96 0.14 -1.18 118.68 121.60 1vh9 s LEU 53 Ca 0.60 2.04 -0.31 0.00 -0.22 0.00 0.00 54.13 56.25 1vh9 s LEU 53 Cb -0.11 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 42.92 1vh9 s LEU 53 CO 0.46 -0.68 1.50 -2.28 -1.32 0.00 0.00 176.35 174.03 1vh9 s HIS 54 N 2.28 3.02 0.64 5.38 5.65 -0.02 -4.78 115.29 127.45 1vh9 s HIS 54 Ca 0.62 0.86 0.35 0.00 0.25 0.00 0.00 55.06 57.14 1vh9 s HIS 54 Cb -0.30 -3.88 1.98 0.00 -1.18 0.00 0.00 32.58 29.21 1vh9 s HIS 54 CO 0.25 -3.00 2.20 0.78 -0.65 0.00 0.00 174.74 174.32 1vh9 h GLY 55 N 5.69 0.00 2.00 1.59 0.00 -1.93 -0.69 103.07 109.72 1vh9 h GLY 55 Ca -0.45 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.73 1vh9 h GLY 55 CO 0.83 0.00 -0.70 -1.33 0.00 0.00 0.00 176.54 175.33 1vh9 h GLY 56 N 0.00 0.00 0.91 4.60 0.00 -1.94 -2.88 103.07 103.76 1vh9 h GLY 56 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.26 1vh9 h GLY 56 CO -0.00 0.00 -0.21 0.00 0.00 0.00 0.00 176.54 176.33 1vh9 h ALA 57 N 1.30 0.39 -0.53 3.60 0.00 -1.43 -0.79 119.26 121.80 1vh9 h ALA 57 Ca -0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1vh9 h ALA 57 Cb 1.29 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1vh9 h ALA 57 CO 0.09 0.34 0.31 0.77 0.00 0.00 0.00 179.25 180.76 1vh9 h SER 58 N 0.35 0.64 -0.75 0.00 0.02 -1.58 0.23 113.55 112.45 1vh9 h SER 58 Ca 0.05 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1vh9 h SER 58 Cb 0.76 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.10 1vh9 h SER 58 CO 0.06 0.53 0.50 0.00 -1.14 0.00 0.00 176.83 176.77 1vh9 h ALA 59 N 1.14 0.95 -0.56 3.77 0.00 -1.38 -1.34 119.26 121.85 1vh9 h ALA 59 Ca 0.19 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1vh9 h ALA 59 Cb 0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1vh9 h ALA 59 CO -0.03 0.36 0.07 0.00 0.00 0.00 0.00 179.25 179.64 1vh9 h ALA 60 N 1.28 1.07 -0.50 0.00 0.00 -0.60 -0.89 119.26 119.62 1vh9 h ALA 60 Ca 0.28 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1vh9 h ALA 60 Cb -0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1vh9 h ALA 60 CO -0.06 0.60 0.16 1.25 0.00 0.00 0.00 179.25 181.19 1vh9 h LEU 61 N 0.85 0.72 -0.31 0.00 5.85 -0.35 -0.77 115.31 121.31 1vh9 h LEU 61 Ca 0.17 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1vh9 h LEU 61 Cb 0.41 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1vh9 h LEU 61 CO 0.01 0.73 0.15 0.00 -0.34 0.00 0.00 178.44 178.99 1vh9 h ALA 62 N 1.01 0.40 -0.55 1.25 0.00 -0.95 -1.68 119.26 118.75 1vh9 h ALA 62 Ca 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1vh9 h ALA 62 Cb 0.27 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1vh9 h ALA 62 CO -0.01 -0.03 0.26 1.49 0.00 0.00 0.00 179.25 180.96 1vh9 h GLU 63 N 0.36 0.77 -0.11 0.00 4.57 -1.00 -1.61 114.58 117.57 1vh9 h GLU 63 Ca 0.11 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 1vh9 h GLU 63 Cb 0.13 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 1vh9 h GLU 63 CO -0.01 0.60 0.01 1.15 -1.18 0.00 0.00 179.01 179.58 1vh9 h THR 64 N 0.77 1.23 -0.21 0.32 2.02 -0.73 -2.71 112.91 113.60 1vh9 h THR 64 Ca 0.19 -0.74 -0.03 0.00 0.77 0.00 0.00 66.41 66.61 1vh9 h THR 64 Cb 0.08 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1vh9 h THR 64 CO -0.03 0.21 0.02 -0.07 0.37 0.00 0.00 175.52 176.03 1vh9 h LEU 65 N -0.06 0.34 -0.99 2.58 3.38 -1.08 -2.77 115.31 116.71 1vh9 h LEU 65 Ca 0.03 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 1vh9 h LEU 65 Cb 0.32 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1vh9 h LEU 65 CO 0.00 0.53 0.59 1.23 0.09 0.00 0.00 178.44 180.88 1vh9 h GLY 66 N 0.13 1.37 0.92 0.83 0.00 -1.36 -1.52 103.07 103.44 1vh9 h GLY 66 Ca 0.06 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 46.80 1vh9 h GLY 66 CO 0.01 0.54 0.07 1.76 0.00 0.00 0.00 176.54 178.91 1vh9 h SER 67 N 1.30 0.59 -0.40 0.19 0.02 -1.47 -1.54 113.55 112.25 1vh9 h SER 67 Ca 0.34 -0.26 -0.10 0.00 -0.84 0.00 0.00 61.79 60.94 1vh9 h SER 67 Cb -0.08 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 1vh9 h SER 67 CO -0.07 0.69 -0.14 -0.03 -1.14 0.00 0.00 176.83 176.14 1vh9 h MET 68 N 0.46 0.80 -0.57 3.45 -1.53 -1.29 -0.66 114.93 115.58 1vh9 h MET 68 Ca 0.11 -0.33 -0.05 0.00 -3.44 0.00 0.00 59.70 55.99 1vh9 h MET 68 Cb 0.35 -0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 31.35 1vh9 h MET 68 CO 0.01 0.95 0.15 0.00 0.14 0.00 0.00 176.91 178.16 1vh9 h ALA 69 N 0.83 0.75 -0.64 0.39 0.00 -1.30 -1.19 119.26 118.09 1vh9 h ALA 69 Ca 0.09 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1vh9 h ALA 69 Cb 0.68 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1vh9 h ALA 69 CO 0.05 0.44 0.42 0.78 0.00 0.00 0.00 179.25 180.94 1vh9 h GLY 70 N 0.81 0.91 0.95 0.00 0.00 -1.12 -2.41 103.07 102.21 1vh9 h GLY 70 Ca 0.18 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.19 1vh9 h GLY 70 CO -0.00 0.32 0.41 -2.75 0.00 0.00 0.00 176.54 174.52 1vh9 h PHE 71 N 0.87 0.77 0.00 5.60 3.57 -0.66 -1.68 116.94 125.41 1vh9 h PHE 71 Ca 0.24 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.76 1vh9 h PHE 71 Cb -0.09 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.39 1vh9 h PHE 71 CO -0.03 0.47 0.00 -1.33 -2.23 0.00 0.00 178.31 175.19 1vh9 n MET 72 N -4.67 0.02 0.00 1.11 2.81 -0.49 -1.23 117.12 114.66 1vh9 n MET 72 Ca 0.05 0.36 0.12 0.00 -1.81 0.00 0.00 57.70 56.43 1vh9 n MET 72 Cb 0.04 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.25 1vh9 n MET 72 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 1vh9 n MET 73 N -1.46 1.69 -3.42 0.03 2.81 -0.63 -0.74 117.12 115.39 1vh9 n MET 73 Ca 0.02 -1.29 -0.20 0.00 -1.81 0.00 0.00 57.70 54.42 1vh9 n MET 73 Cb 0.07 -1.47 -0.00 0.00 -0.71 0.00 0.00 33.22 31.11 1vh9 n MET 73 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1vh9 s THR 74 N -2.20 4.17 0.28 2.03 -4.23 -0.37 -4.71 115.64 110.62 1vh9 s THR 74 Ca 0.27 -0.90 0.10 0.00 -1.18 0.00 0.00 61.69 59.97 1vh9 s THR 74 Cb 0.20 -3.46 -0.04 0.00 1.34 0.00 0.00 72.50 70.53 1vh9 s THR 74 CO 0.41 -0.21 0.00 0.00 -0.54 0.00 0.00 174.62 174.29 1vh9 s ARG 75 N -4.23 2.24 -0.08 3.99 1.70 -1.26 -4.30 118.95 117.01 1vh9 s ARG 75 Ca 0.45 -1.49 -0.30 0.00 -0.47 0.00 0.00 55.73 53.92 1vh9 s ARG 75 Cb -0.10 -2.11 -0.15 0.00 -0.57 0.00 0.00 34.95 32.02 1vh9 s ARG 75 CO 0.32 0.31 0.87 -0.25 -1.08 0.00 0.00 175.30 175.48 1vh9 n ASP 76 N -0.91 0.19 0.00 -2.89 8.00 -1.26 -0.45 116.55 119.23 1vh9 n ASP 76 Ca -0.06 0.86 0.00 0.00 0.71 0.00 0.00 54.79 56.30 1vh9 n ASP 76 Cb 0.60 -0.67 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 1vh9 n ASP 76 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vh9 n GLY 77 N 1.51 1.57 3.95 0.44 0.00 -1.26 -5.05 105.19 106.35 1vh9 n GLY 77 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1vh9 n GLY 77 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vh9 s GLN 78 N -0.63 3.47 0.05 1.61 -0.21 0.40 -4.73 119.66 119.62 1vh9 s GLN 78 Ca 0.00 -0.52 -0.02 0.00 0.02 0.00 0.00 55.36 54.84 1vh9 s GLN 78 Cb 0.00 -2.83 -0.04 0.00 1.00 0.00 0.00 33.01 31.15 1vh9 s GLN 78 CO 0.00 0.36 -0.01 0.00 -2.12 0.00 0.00 175.29 173.52 1vh9 s VAL 80 N -3.83 0.93 -0.08 0.00 1.01 -1.26 0.26 120.40 117.43 1vh9 s VAL 80 Ca 0.06 -1.44 -0.06 0.00 0.00 0.00 0.00 61.98 60.54 1vh9 s VAL 80 Cb 0.07 -1.14 0.03 0.00 0.00 0.00 0.00 36.38 35.34 1vh9 s VAL 80 CO -0.10 -0.42 0.20 0.54 0.00 0.00 0.00 175.10 175.33 1vh9 s VAL 81 N -1.88 -0.01 0.03 2.92 0.11 -0.35 -4.93 120.40 116.29 1vh9 s VAL 81 Ca 0.00 0.04 -0.30 0.00 -2.93 0.00 0.00 61.98 58.79 1vh9 s VAL 81 Cb -0.06 -0.30 -0.06 0.00 -1.53 0.00 0.00 36.38 34.43 1vh9 s VAL 81 CO 0.01 0.02 1.28 -0.83 -3.33 0.00 0.00 175.10 172.24 1vh9 s GLY 82 N 0.42 2.15 -0.12 6.54 0.00 -1.26 -0.99 107.32 114.05 1vh9 s GLY 82 Ca -0.03 0.86 0.01 0.00 0.00 0.00 0.00 44.72 45.56 1vh9 s GLY 82 CO -0.02 2.23 -0.11 -0.37 0.00 0.00 0.00 173.10 174.83 1vh9 n THR 83 N 4.24 0.71 -3.97 0.90 5.66 0.20 -4.94 114.28 117.07 1vh9 n THR 83 Ca 0.11 -0.27 -0.17 0.00 -3.05 0.00 0.00 64.05 60.66 1vh9 n THR 83 Cb 0.45 -0.95 -0.16 0.00 -1.55 0.00 0.00 70.33 68.12 1vh9 n THR 83 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1vh9 s GLU 84 N -2.25 0.40 -0.01 1.09 2.56 -1.15 -4.98 118.70 114.36 1vh9 s GLU 84 Ca -0.17 0.04 0.04 0.00 0.00 0.00 0.00 54.97 54.88 1vh9 s GLU 84 Cb 0.04 -0.55 -0.01 0.00 2.00 0.00 0.00 34.13 35.62 1vh9 s GLU 84 CO 0.28 -0.12 -0.12 -1.17 -0.56 0.00 0.00 175.26 173.57 1vh9 s LEU 85 N 0.99 1.98 0.03 2.70 2.96 -1.26 -0.47 118.68 125.61 1vh9 s LEU 85 Ca -0.10 -0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 53.56 1vh9 s LEU 85 Cb -0.14 -0.66 -0.02 0.00 0.50 0.00 0.00 46.19 45.88 1vh9 s LEU 85 CO -0.01 0.14 0.01 0.54 -1.32 0.00 0.00 176.35 175.71 1vh9 s ASN 86 N -0.21 0.25 -0.22 3.68 2.20 -1.10 -5.03 114.94 114.51 1vh9 s ASN 86 Ca 0.03 -0.57 -0.22 0.00 -0.94 0.00 0.00 52.86 51.17 1vh9 s ASN 86 Cb -0.06 0.16 0.06 0.00 -2.00 0.00 0.00 41.25 39.41 1vh9 s ASN 86 CO -0.00 -0.41 0.61 0.00 -2.94 0.00 0.00 177.10 174.36 1vh9 s ALA 87 N -2.15 -1.52 -0.18 3.54 0.00 -1.26 -2.42 121.76 117.77 1vh9 s ALA 87 Ca -0.09 1.69 -0.01 0.00 0.00 0.00 0.00 51.96 53.55 1vh9 s ALA 87 Cb -0.05 -0.94 0.00 0.00 0.00 0.00 0.00 23.12 22.14 1vh9 s ALA 87 CO -0.03 -0.29 -0.13 0.99 0.00 0.00 0.00 175.76 176.30 1vh9 s THR 88 N 0.22 2.76 -0.54 0.00 2.01 -0.45 -5.00 115.64 114.64 1vh9 s THR 88 Ca -0.01 -0.72 -0.22 0.00 0.31 0.00 0.00 61.69 61.05 1vh9 s THR 88 Cb -0.04 -2.20 0.05 0.00 0.01 0.00 0.00 72.50 70.32 1vh9 s THR 88 CO 0.01 0.49 0.84 -1.00 -0.69 0.00 0.00 174.62 174.28 1vh9 s HIS 89 N 1.12 2.87 -0.15 4.92 3.76 -1.26 -2.32 115.29 124.22 1vh9 s HIS 89 Ca 0.01 -0.21 -0.26 0.00 -0.15 0.00 0.00 55.06 54.44 1vh9 s HIS 89 Cb -0.14 -3.92 -0.24 0.00 1.11 0.00 0.00 32.58 29.38 1vh9 s HIS 89 CO -0.04 -1.27 0.62 0.45 -0.85 0.00 0.00 174.74 173.65 1vh9 h HIS 90 N 9.23 0.04 -3.90 1.40 3.86 -1.60 -3.49 115.15 120.69 1vh9 h HIS 90 Ca -0.27 -0.03 -0.25 0.00 -1.16 0.00 0.00 60.37 58.67 1vh9 h HIS 90 Cb 1.08 -0.00 -0.18 0.00 1.06 0.00 0.00 27.41 29.37 1vh9 h HIS 90 CO 0.86 1.16 -0.72 1.03 0.86 0.00 0.00 177.93 181.13 1vh9 s ARG 91 N -2.27 0.67 0.47 2.45 0.52 -1.04 -5.05 118.95 114.70 1vh9 s ARG 91 Ca -0.21 -1.03 -0.09 0.00 -0.52 0.00 0.00 55.73 53.87 1vh9 s ARG 91 Cb -0.00 -0.25 -0.05 0.00 0.52 0.00 0.00 34.95 35.16 1vh9 s ARG 91 CO 0.67 0.02 0.82 -1.25 0.02 0.00 0.00 175.30 175.59 1vh9 s PRO 92 N -2.64 3.69 0.01 3.54 0.04 -1.26 -4.79 135.00 133.58 1vh9 s PRO 92 Ca 0.00 0.46 0.02 0.00 0.04 0.00 0.00 61.00 61.52 1vh9 s PRO 92 Cb -0.03 -2.33 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 1vh9 s PRO 92 CO -0.02 -0.18 -0.07 0.08 0.04 0.00 0.00 177.00 176.85 1vh9 s VAL 93 N -2.61 0.56 0.00 -0.36 1.01 -1.26 -5.03 120.40 112.71 1vh9 s VAL 93 Ca 0.51 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1vh9 s VAL 93 Cb -0.10 -0.50 0.00 0.00 0.00 0.00 0.00 36.38 35.78 1vh9 s VAL 93 CO 0.39 0.04 0.00 -1.54 0.00 0.00 0.00 175.10 173.99 1vh9 n SER 94 N 2.60 0.07 -3.81 3.32 3.41 -1.26 0.26 113.62 118.22 1vh9 n SER 94 Ca -0.15 -0.17 -0.10 0.00 -0.26 0.00 0.00 58.87 58.20 1vh9 n SER 94 Cb 0.57 0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 64.81 1vh9 n SER 94 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1vh9 s GLU 95 N -0.37 1.07 3.62 4.33 -1.05 -1.26 -4.81 118.70 120.23 1vh9 s GLU 95 Ca 0.00 -0.94 0.00 0.00 -0.15 0.00 0.00 54.97 53.88 1vh9 s GLU 95 Cb 0.00 0.41 0.00 0.00 -0.44 0.00 0.00 34.13 34.10 1vh9 s GLU 95 CO 0.00 -0.40 0.00 0.41 0.95 0.00 0.00 175.26 176.22 1vh9 n GLY 96 N -0.19 0.21 3.30 -3.83 0.00 -1.26 -4.86 105.19 98.57 1vh9 n GLY 96 Ca -0.12 -0.95 -0.16 0.00 0.00 0.00 0.00 46.02 44.78 1vh9 n GLY 96 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vh9 s LYS 97 N 0.00 1.21 0.21 1.61 -2.85 -1.26 -1.33 119.74 117.33 1vh9 s LYS 97 Ca 0.00 -1.54 0.09 0.00 -1.00 0.00 0.00 55.97 53.52 1vh9 s LYS 97 Cb 0.00 -0.85 -0.04 0.00 -2.06 0.00 0.00 37.83 34.88 1vh9 s LYS 97 CO 0.00 0.10 -0.07 0.14 0.10 0.00 0.00 175.35 175.62 1vh9 s VAL 98 N -3.18 3.26 -0.10 1.79 -7.23 -0.29 -3.40 120.40 111.25 1vh9 s VAL 98 Ca 0.21 -1.75 0.02 0.00 -1.81 0.00 0.00 61.98 58.65 1vh9 s VAL 98 Cb 0.02 -2.65 0.01 0.00 0.56 0.00 0.00 36.38 34.31 1vh9 s VAL 98 CO 0.04 -0.19 -0.17 -0.60 -0.31 0.00 0.00 175.10 173.87 1vh9 s ARG 99 N -3.09 2.32 -0.17 4.82 3.52 -0.18 -1.58 118.95 124.59 1vh9 s ARG 99 Ca 0.27 -0.61 -0.09 0.00 -0.13 0.00 0.00 55.73 55.17 1vh9 s ARG 99 Cb -0.08 -1.91 -0.05 0.00 -1.56 0.00 0.00 34.95 31.35 1vh9 s ARG 99 CO 0.17 -0.01 0.12 0.20 -0.81 0.00 0.00 175.30 174.97 1vh9 s GLY 100 N 0.82 2.06 -0.20 8.12 0.00 0.35 -1.32 107.32 117.14 1vh9 s GLY 100 Ca -0.10 -0.68 0.01 0.00 0.00 0.00 0.00 44.72 43.94 1vh9 s GLY 100 CO 0.01 -0.03 -0.17 0.14 0.00 0.00 0.00 173.10 173.05 1vh9 s VAL 101 N -0.07 2.25 -0.19 1.40 1.01 -0.43 -2.21 120.40 122.17 1vh9 s VAL 101 Ca 0.10 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 1vh9 s VAL 101 Cb -0.11 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 1vh9 s VAL 101 CO 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 175.10 175.53 1vh9 s GLN 103 N 0.79 0.33 0.37 0.00 -0.21 -0.61 -1.98 119.66 118.35 1vh9 s GLN 103 Ca -0.00 -0.52 -0.25 0.00 0.02 0.00 0.00 55.36 54.61 1vh9 s GLN 103 Cb -0.14 -0.07 -0.09 0.00 1.00 0.00 0.00 33.01 33.71 1vh9 s GLN 103 CO 0.02 0.00 1.05 -1.25 -2.12 0.00 0.00 175.29 172.99 1vh9 s PRO 104 N -1.15 4.30 -0.09 2.91 0.04 -1.26 -0.66 135.00 139.09 1vh9 s PRO 104 Ca -0.10 1.55 0.05 0.00 0.04 0.00 0.00 61.00 62.53 1vh9 s PRO 104 Cb -0.08 -2.69 -0.09 0.00 0.04 0.00 0.00 34.50 31.69 1vh9 s PRO 104 CO -0.00 -0.03 -0.02 1.28 0.04 0.00 0.00 177.00 178.26 1vh9 n LEU 105 N 0.23 1.23 -3.70 -3.56 4.77 -0.13 -4.85 117.00 110.98 1vh9 n LEU 105 Ca 0.04 -0.02 -0.11 0.00 -0.03 0.00 0.00 56.01 55.88 1vh9 n LEU 105 Cb 0.49 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 1vh9 n LEU 105 CO 0.47 0.39 0.10 -2.28 -1.33 0.00 0.00 177.39 174.74 1vh9 s HIS 106 N -2.20 -0.58 -0.31 -1.77 5.04 -1.08 -4.99 115.29 109.40 1vh9 s HIS 106 Ca -0.08 1.29 0.02 0.00 -1.54 0.00 0.00 55.06 54.75 1vh9 s HIS 106 Cb 0.03 0.24 0.09 0.00 0.04 0.00 0.00 32.58 32.98 1vh9 s HIS 106 CO 0.29 -0.30 0.05 -0.51 -2.34 0.00 0.00 174.74 171.93 1vh9 s LEU 107 N 0.90 3.58 0.34 8.88 1.43 -1.26 -1.82 118.68 130.72 1vh9 s LEU 107 Ca -0.05 -1.83 0.08 0.00 -1.03 0.00 0.00 54.13 51.29 1vh9 s LEU 107 Cb -0.06 -1.31 -0.03 0.00 0.03 0.00 0.00 46.19 44.82 1vh9 s LEU 107 CO -0.07 -0.37 0.26 -0.83 0.23 0.00 0.00 176.35 175.57 1vh9 s GLY 108 N 1.22 1.82 0.19 -3.19 0.00 0.01 -5.02 107.32 102.35 1vh9 s GLY 108 Ca 0.08 -1.70 0.26 0.00 0.00 0.00 0.00 44.72 43.37 1vh9 s GLY 108 CO -0.14 -1.62 1.79 -0.96 0.00 0.00 0.00 173.10 172.18 1vh9 n ARG 109 N -1.32 0.23 -0.05 2.90 1.85 -1.26 -3.69 116.66 115.32 1vh9 n ARG 109 Ca -0.02 0.19 -0.03 0.00 -1.00 0.00 0.00 57.85 56.99 1vh9 n ARG 109 Cb 0.60 -1.77 -0.11 0.00 -1.05 0.00 0.00 32.46 30.14 1vh9 n ARG 109 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 1vh9 n GLN 110 N -2.17 1.45 -3.88 2.89 -0.06 -1.26 -4.83 117.38 109.51 1vh9 n GLN 110 Ca 0.06 -0.04 -0.07 0.00 -2.00 0.00 0.00 57.00 54.94 1vh9 n GLN 110 Cb 0.42 -1.34 -0.02 0.00 -4.06 0.00 0.00 30.24 25.24 1vh9 n GLN 110 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1vh9 s ASN 111 N -4.34 -0.23 0.17 1.69 2.20 -1.24 -1.92 114.94 111.27 1vh9 s ASN 111 Ca -0.06 -0.66 -0.07 0.00 -0.94 0.00 0.00 52.86 51.13 1vh9 s ASN 111 Cb 0.05 0.71 -0.02 0.00 -2.00 0.00 0.00 41.25 39.99 1vh9 s ASN 111 CO 0.55 -1.32 0.24 -1.10 -2.94 0.00 0.00 177.10 172.53 1vh9 s GLN 112 N -3.92 1.15 -0.05 3.55 -0.21 -0.84 -0.80 119.66 118.53 1vh9 s GLN 112 Ca 0.13 -1.29 -0.01 0.00 0.02 0.00 0.00 55.36 54.21 1vh9 s GLN 112 Cb -0.05 0.34 0.03 0.00 1.00 0.00 0.00 33.01 34.33 1vh9 s GLN 112 CO 0.07 -0.41 0.01 0.45 -2.12 0.00 0.00 175.29 173.30 1vh9 s SER 113 N -3.01 1.06 0.01 5.90 0.15 -0.76 -1.50 113.70 115.55 1vh9 s SER 113 Ca 0.22 -0.03 0.07 0.00 0.70 0.00 0.00 55.95 56.92 1vh9 s SER 113 Cb 0.04 -0.29 -0.03 0.00 -1.71 0.00 0.00 66.02 64.03 1vh9 s SER 113 CO 0.03 -0.17 -0.22 0.26 1.20 0.00 0.00 173.24 174.33 1vh9 s TRP 114 N 1.65 2.44 -0.11 3.44 0.52 -0.35 -0.96 118.94 125.58 1vh9 s TRP 114 Ca -0.01 -0.34 -0.06 0.00 0.02 0.00 0.00 56.10 55.71 1vh9 s TRP 114 Cb -0.13 -1.48 -0.04 0.00 -1.15 0.00 0.00 33.47 30.67 1vh9 s TRP 114 CO -0.03 0.12 0.12 -1.21 0.02 0.00 0.00 176.95 175.97 1vh9 s GLU 115 N -1.01 3.37 -0.17 4.98 0.41 0.17 -0.83 118.70 125.61 1vh9 s GLU 115 Ca 0.12 -0.18 -0.04 0.00 -0.41 0.00 0.00 54.97 54.46 1vh9 s GLU 115 Cb -0.10 -3.13 0.06 0.00 -1.78 0.00 0.00 34.13 29.18 1vh9 s GLU 115 CO 0.02 0.76 0.06 0.42 -0.49 0.00 0.00 175.26 176.03 1vh9 s ILE 116 N -1.02 0.21 -0.14 -1.63 1.09 -0.67 -1.57 121.20 117.47 1vh9 s ILE 116 Ca 0.15 -0.32 -0.06 0.00 -1.10 0.00 0.00 60.65 59.32 1vh9 s ILE 116 Cb -0.12 -0.77 -0.04 0.00 -1.06 0.00 0.00 42.46 40.47 1vh9 s ILE 116 CO 0.04 -0.22 0.08 -0.69 -0.10 0.00 0.00 174.94 174.06 1vh9 s VAL 117 N 2.00 5.02 -0.21 2.92 1.01 -0.76 -1.20 120.40 129.18 1vh9 s VAL 117 Ca 0.01 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 1vh9 s VAL 117 Cb -0.16 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.00 1vh9 s VAL 117 CO -0.08 0.54 -0.04 -0.69 0.00 0.00 0.00 175.10 174.83 1vh9 s VAL 118 N -0.38 3.44 0.11 2.92 1.01 0.25 -1.32 120.40 126.42 1vh9 s VAL 118 Ca 0.10 -0.48 0.07 0.00 0.00 0.00 0.00 61.98 61.67 1vh9 s VAL 118 Cb -0.12 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 1vh9 s VAL 118 CO 0.02 0.43 -0.07 -0.36 0.00 0.00 0.00 175.10 175.11 1vh9 s PHE 119 N 1.32 2.79 0.69 5.22 0.40 -0.44 -0.44 117.98 127.52 1vh9 s PHE 119 Ca 0.04 -0.13 -0.04 0.00 -0.60 0.00 0.00 56.93 56.20 1vh9 s PHE 119 Cb -0.14 -1.44 0.08 0.00 0.51 0.00 0.00 43.02 42.03 1vh9 s PHE 119 CO -0.02 0.45 0.97 0.16 0.70 0.00 0.00 175.22 177.48 1vh9 s ASP 120 N -2.31 4.68 0.00 1.36 3.84 -0.60 -1.01 116.67 122.63 1vh9 s ASP 120 Ca 0.23 0.09 0.02 0.00 -0.00 0.00 0.00 52.55 52.89 1vh9 s ASP 120 Cb -0.11 -0.68 0.10 0.00 -1.38 0.00 0.00 42.92 40.85 1vh9 s ASP 120 CO 0.15 -1.63 1.03 -0.62 -0.00 0.00 0.00 175.17 174.09 1vh9 n GLU 121 N -2.80 0.01 0.00 2.11 1.02 -1.22 -0.59 120.64 119.16 1vh9 n GLU 121 Ca 0.10 0.41 0.13 0.00 -0.02 0.00 0.00 57.16 57.79 1vh9 n GLU 121 Cb 0.60 -1.50 0.38 0.00 -0.02 0.00 0.00 31.44 30.90 1vh9 n GLU 121 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1vh9 n GLN 122 N -1.45 1.83 -0.71 3.49 3.00 -1.26 -4.93 117.38 117.35 1vh9 n GLN 122 Ca 0.01 -1.24 0.00 0.00 -0.01 0.00 0.00 57.00 55.76 1vh9 n GLN 122 Cb 0.02 -1.47 0.00 0.00 0.00 0.00 0.00 30.24 28.79 1vh9 n GLN 122 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1vh9 n GLY 123 N 1.24 0.74 3.78 1.08 0.00 0.24 -5.04 105.19 107.22 1vh9 n GLY 123 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1vh9 n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vh9 s ARG 124 N -0.29 4.41 -0.07 1.61 0.52 -1.26 -4.82 118.95 119.06 1vh9 s ARG 124 Ca 0.00 0.95 -0.30 0.00 -0.52 0.00 0.00 55.73 55.87 1vh9 s ARG 124 Cb 0.00 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 32.14 1vh9 s ARG 124 CO 0.00 0.50 1.47 0.50 0.02 0.00 0.00 175.30 177.79 1vh9 s ARG 125 N -0.76 4.22 -0.01 3.54 3.52 -1.26 -1.56 118.95 126.65 1vh9 s ARG 125 Ca 0.34 1.97 0.09 0.00 -0.13 0.00 0.00 55.73 58.00 1vh9 s ARG 125 Cb -0.21 -3.80 -0.12 0.00 -1.56 0.00 0.00 34.95 29.26 1vh9 s ARG 125 CO 0.22 -0.73 0.28 0.00 -0.81 0.00 0.00 175.30 174.26 1vh9 s THR 128 N 0.65 1.87 0.23 0.00 2.01 -0.98 -0.59 115.64 118.83 1vh9 s THR 128 Ca -0.03 -0.86 0.05 0.00 0.31 0.00 0.00 61.69 61.17 1vh9 s THR 128 Cb -0.05 -1.67 -0.05 0.00 0.01 0.00 0.00 72.50 70.74 1vh9 s THR 128 CO -0.04 0.51 -0.06 0.00 -0.69 0.00 0.00 174.62 174.34 1vh9 s ARG 130 N -3.76 0.11 -0.09 0.00 3.52 -1.01 -1.67 118.95 116.04 1vh9 s ARG 130 Ca 0.26 0.32 0.02 0.00 -0.13 0.00 0.00 55.73 56.20 1vh9 s ARG 130 Cb 0.03 -0.11 0.01 0.00 -1.56 0.00 0.00 34.95 33.33 1vh9 s ARG 130 CO 0.08 -0.12 -0.15 -1.17 -0.81 0.00 0.00 175.30 173.12 1vh9 s LEU 131 N 0.87 1.72 -0.06 -0.88 2.96 -0.01 -2.70 118.68 120.59 1vh9 s LEU 131 Ca -0.07 -0.39 -0.11 0.00 -0.22 0.00 0.00 54.13 53.35 1vh9 s LEU 131 Cb -0.09 -1.02 -0.05 0.00 0.50 0.00 0.00 46.19 45.53 1vh9 s LEU 131 CO -0.04 0.04 0.27 -0.83 -1.32 0.00 0.00 176.35 174.47 1vh9 s GLY 132 N 0.80 2.32 0.19 7.98 0.00 0.37 -1.21 107.32 117.76 1vh9 s GLY 132 Ca -0.11 -0.44 0.06 0.00 0.00 0.00 0.00 44.72 44.23 1vh9 s GLY 132 CO 0.02 -0.13 -0.11 -0.51 0.00 0.00 0.00 173.10 172.37 1vh9 s THR 133 N -1.06 1.43 -0.07 0.90 -4.23 -0.56 -0.63 115.64 111.42 1vh9 s THR 133 Ca 0.20 -2.13 0.04 0.00 -1.18 0.00 0.00 61.69 58.62 1vh9 s THR 133 Cb -0.14 -2.02 -0.00 0.00 1.34 0.00 0.00 72.50 71.67 1vh9 s THR 133 CO 0.09 -0.61 -0.20 0.00 -0.54 0.00 0.00 174.62 173.36 1vh9 s ALA 134 N -3.16 1.81 -0.17 3.99 0.00 -0.16 -1.99 121.76 122.08 1vh9 s ALA 134 Ca 0.21 -0.81 -0.19 0.00 0.00 0.00 0.00 51.96 51.18 1vh9 s ALA 134 Cb 0.02 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 1vh9 s ALA 134 CO 0.05 0.29 0.51 0.08 0.00 0.00 0.00 175.76 176.69 1vh9 s VAL 135 N 0.18 5.13 -0.69 0.00 1.01 -0.81 -1.21 120.40 124.01 1vh9 s VAL 135 Ca -0.10 0.97 -0.01 0.00 0.00 0.00 0.00 61.98 62.85 1vh9 s VAL 135 Cb -0.15 -3.84 0.41 0.00 0.00 0.00 0.00 36.38 32.81 1vh9 s VAL 135 CO 0.05 0.23 1.91 0.18 0.00 0.00 0.00 175.10 177.47 1vh9 n LEU 136 N 4.38 7.24 0.00 3.92 4.77 0.74 -4.90 117.00 133.15 1vh9 n LEU 136 Ca -0.05 -4.59 0.00 0.00 -0.03 0.00 0.00 56.01 51.34 1vh9 n LEU 136 Cb 0.51 -0.93 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1vh9 n LEU 136 CO 0.42 1.68 0.25 0.61 -1.33 0.00 0.00 177.39 179.02