#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vr6 s HIS -2 N 0.00 3.81 0.06 -1.40 5.04 -1.26 -1.58 115.29 119.96 1vr6 s HIS -2 Ca 0.00 1.71 0.09 0.00 -1.54 0.00 0.00 55.06 55.32 1vr6 s HIS -2 Cb 0.00 -2.97 -0.03 0.00 0.04 0.00 0.00 32.58 29.62 1vr6 s HIS -2 CO 0.00 0.26 -0.24 -1.01 -2.34 0.00 0.00 174.74 171.41 1vr6 s HIS -1 N -0.18 2.38 -0.26 3.88 0.09 0.11 -4.96 115.29 116.36 1vr6 s HIS -1 Ca 0.44 -0.37 -0.03 0.00 -0.00 0.00 0.00 55.06 55.09 1vr6 s HIS -1 Cb -0.23 -1.38 0.14 0.00 -0.00 0.00 0.00 32.58 31.11 1vr6 s HIS -1 CO 0.28 0.20 0.47 -1.58 -0.00 0.00 0.00 174.74 174.11 1vr6 s HIS 0 N -0.89 -1.09 0.13 1.40 5.04 -1.26 -2.71 115.29 115.91 1vr6 s HIS 0 Ca 0.13 1.29 0.04 0.00 -1.54 0.00 0.00 55.06 54.99 1vr6 s HIS 0 Cb -0.10 0.28 -0.04 0.00 0.04 0.00 0.00 32.58 32.75 1vr6 s HIS 0 CO 0.04 -0.73 -0.10 -1.64 -2.34 0.00 0.00 174.74 169.97 1vr6 s MET 1 N 2.67 0.98 -0.19 2.88 1.00 -0.47 -1.02 119.30 125.15 1vr6 s MET 1 Ca 0.12 -1.33 0.00 0.00 0.00 0.00 0.00 55.69 54.48 1vr6 s MET 1 Cb -0.15 -0.60 0.04 0.00 0.00 0.00 0.00 34.83 34.13 1vr6 s MET 1 CO -0.17 0.08 -0.08 0.42 0.00 0.00 0.00 175.02 175.27 1vr6 s ILE 2 N -2.94 1.46 -0.23 2.53 -1.09 -0.52 -0.92 121.20 119.49 1vr6 s ILE 2 Ca 0.12 -0.89 -0.08 0.00 -2.23 0.00 0.00 60.65 57.58 1vr6 s ILE 2 Cb 0.00 -1.57 -0.04 0.00 -1.58 0.00 0.00 42.46 39.27 1vr6 s ILE 2 CO 0.00 0.15 0.09 -0.69 -1.23 0.00 0.00 174.94 173.26 1vr6 s VAL 3 N 1.48 4.66 -0.22 2.92 1.01 0.13 0.32 120.40 130.70 1vr6 s VAL 3 Ca -0.01 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.85 1vr6 s VAL 3 Cb -0.16 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 1vr6 s VAL 3 CO -0.08 0.37 0.02 -0.69 0.00 0.00 0.00 175.10 174.72 1vr6 s VAL 4 N 1.14 4.06 0.33 2.92 1.01 -0.35 0.01 120.40 129.51 1vr6 s VAL 4 Ca 0.05 -0.27 -0.13 0.00 0.00 0.00 0.00 61.98 61.63 1vr6 s VAL 4 Cb -0.14 -2.86 -0.08 0.00 0.00 0.00 0.00 36.38 33.30 1vr6 s VAL 4 CO 0.04 0.40 0.71 -0.76 0.00 0.00 0.00 175.10 175.48 1vr6 s LEU 5 N 1.22 4.02 0.61 3.92 1.43 -0.15 0.07 118.68 129.80 1vr6 s LEU 5 Ca 0.04 1.16 -0.19 0.00 -1.03 0.00 0.00 54.13 54.10 1vr6 s LEU 5 Cb -0.15 -3.98 -0.03 0.00 0.03 0.00 0.00 46.19 42.07 1vr6 s LEU 5 CO 0.02 -0.23 1.31 -0.54 0.23 0.00 0.00 176.35 177.14 1vr6 s LYS 6 N -3.19 2.79 0.35 1.70 1.02 0.29 -4.52 119.74 118.18 1vr6 s LYS 6 Ca 0.52 2.11 -0.28 0.00 0.02 0.00 0.00 55.97 58.34 1vr6 s LYS 6 Cb -0.10 -2.00 -0.12 0.00 -0.52 0.00 0.00 37.83 35.09 1vr6 s LYS 6 CO 0.22 -1.43 1.37 -0.35 -0.92 0.00 0.00 175.35 174.24 1vr6 n PRO 7 N -1.57 2.34 -0.64 -1.68 -0.04 -1.26 -1.64 135.00 130.50 1vr6 n PRO 7 Ca 0.14 0.82 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 1vr6 n PRO 7 Cb 0.47 -2.46 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 1vr6 n PRO 7 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vr6 n GLY 8 N 0.68 0.80 3.76 0.55 0.00 -1.26 -5.03 105.19 104.69 1vr6 n GLY 8 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1vr6 n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vr6 s SER 9 N -2.86 5.97 0.40 1.61 0.01 -0.65 -5.01 113.70 113.17 1vr6 s SER 9 Ca 0.00 2.71 0.00 0.00 1.31 0.00 0.00 55.95 59.97 1vr6 s SER 9 Cb 0.00 -2.64 -0.00 0.00 0.21 0.00 0.00 66.02 63.59 1vr6 s SER 9 CO 0.00 -1.09 0.01 0.35 0.41 0.00 0.00 173.24 172.92 1vr6 n THR 10 N -0.26 0.00 -0.26 1.44 -2.24 -1.26 -4.99 114.28 106.71 1vr6 n THR 10 Ca 0.06 -1.92 0.14 0.00 -2.27 0.00 0.00 64.05 60.06 1vr6 n THR 10 Cb 0.44 0.41 0.42 0.00 -2.10 0.00 0.00 70.33 69.50 1vr6 n THR 10 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1vr6 h GLU 11 N 0.00 0.57 0.00 -0.78 4.22 -2.00 -0.16 114.58 116.44 1vr6 h GLU 11 Ca -0.33 -0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.05 1vr6 h GLU 11 Cb 1.02 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.13 1vr6 h GLU 11 CO 0.55 0.38 -0.10 1.05 -2.18 0.00 0.00 179.01 178.70 1vr6 h GLU 12 N 0.59 0.00 0.14 1.92 4.11 -1.99 -1.43 114.58 117.92 1vr6 h GLU 12 Ca 0.46 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.69 1vr6 h GLU 12 Cb 0.87 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.14 1vr6 h GLU 12 CO -0.20 0.10 -0.86 -0.44 0.07 0.00 0.00 179.01 177.68 1vr6 h ASP 13 N 0.00 0.52 -0.68 3.06 3.32 -1.41 -2.60 116.42 118.63 1vr6 h ASP 13 Ca -0.00 -0.93 0.12 0.00 0.02 0.00 0.00 57.03 56.24 1vr6 h ASP 13 Cb 0.38 -0.17 -0.08 0.00 0.22 0.00 0.00 39.33 39.68 1vr6 h ASP 13 CO 0.01 1.41 0.25 0.40 -1.72 0.00 0.00 179.24 179.60 1vr6 h ILE 14 N -0.28 0.70 -0.15 0.35 2.04 -1.27 -2.33 117.51 116.57 1vr6 h ILE 14 Ca -0.15 -0.14 0.04 0.00 1.00 0.00 0.00 64.86 65.61 1vr6 h ILE 14 Cb 1.66 0.25 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 1vr6 h ILE 14 CO 0.16 0.08 -0.13 -0.09 0.00 0.00 0.00 178.15 178.17 1vr6 h ARG 15 N 0.42 -0.14 -0.64 2.37 2.43 -1.23 -0.29 114.38 117.31 1vr6 h ARG 15 Ca 0.36 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.61 1vr6 h ARG 15 Cb 0.51 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.03 1vr6 h ARG 15 CO -0.36 -0.09 0.31 -0.22 -1.51 0.00 0.00 179.97 178.10 1vr6 h LYS 16 N -0.14 0.55 -0.35 0.20 3.64 -1.24 0.15 116.57 119.39 1vr6 h LYS 16 Ca 0.10 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 1vr6 h LYS 16 Cb 0.29 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1vr6 h LYS 16 CO -0.24 0.36 0.00 0.28 -2.27 0.00 0.00 179.45 177.59 1vr6 h VAL 17 N 0.57 1.26 -0.42 2.00 2.07 -0.87 -2.13 116.25 118.73 1vr6 h VAL 17 Ca 0.30 -0.97 -0.09 0.00 0.82 0.00 0.00 66.70 66.76 1vr6 h VAL 17 Cb 0.27 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1vr6 h VAL 17 CO -0.23 0.32 -0.11 0.58 0.02 0.00 0.00 177.57 178.15 1vr6 h VAL 18 N 0.42 1.27 -0.78 2.57 2.07 -0.73 -0.36 116.25 120.72 1vr6 h VAL 18 Ca 0.10 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.44 1vr6 h VAL 18 Cb 0.45 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 1vr6 h VAL 18 CO 0.02 0.41 0.50 0.50 0.02 0.00 0.00 177.57 179.01 1vr6 h LYS 19 N 0.63 0.96 -0.43 1.57 3.64 -0.69 0.23 116.57 122.47 1vr6 h LYS 19 Ca 0.10 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 1vr6 h LYS 19 Cb 0.64 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1vr6 h LYS 19 CO 0.04 0.63 -0.07 1.25 -2.27 0.00 0.00 179.45 179.03 1vr6 h LEU 20 N 0.99 0.80 -0.14 5.20 5.85 -1.05 -1.44 115.31 125.53 1vr6 h LEU 20 Ca 0.31 -0.35 0.04 0.00 0.84 0.00 0.00 57.88 58.72 1vr6 h LEU 20 Cb -0.02 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 1vr6 h LEU 20 CO -0.10 0.96 -0.17 0.00 -0.34 0.00 0.00 178.44 178.79 1vr6 h ALA 21 N 0.87 -0.10 -0.41 1.25 0.00 -0.58 -2.69 119.26 117.60 1vr6 h ALA 21 Ca 0.11 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1vr6 h ALA 21 Cb 0.59 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1vr6 h ALA 21 CO 0.04 -0.62 0.06 0.93 0.00 0.00 0.00 179.25 179.65 1vr6 h GLU 22 N -0.21 0.63 0.00 0.00 4.39 -0.47 -0.52 114.58 118.40 1vr6 h GLU 22 Ca 0.10 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1vr6 h GLU 22 Cb 0.36 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1vr6 h GLU 22 CO -0.26 0.61 0.00 0.66 -1.16 0.00 0.00 179.01 178.86 1vr6 h SER 23 N 0.61 0.00 -0.35 1.42 4.64 -0.93 -0.13 113.55 118.81 1vr6 h SER 23 Ca 0.13 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.41 1vr6 h SER 23 Cb 0.30 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.36 1vr6 h SER 23 CO 0.00 0.00 0.02 -1.22 -0.87 0.00 0.00 176.83 174.77 1vr6 n TYR 24 N -2.42 1.24 -3.80 4.77 4.01 -0.70 -4.99 117.16 115.27 1vr6 n TYR 24 Ca 0.00 -0.99 -0.28 0.00 -0.16 0.00 0.00 57.90 56.47 1vr6 n TYR 24 Cb 0.15 -0.40 0.04 0.00 -0.31 0.00 0.00 39.34 38.83 1vr6 n TYR 24 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1vr6 n ASN 25 N -0.45 -5.13 -4.65 7.72 3.02 -0.06 -4.62 115.26 111.09 1vr6 n ASN 25 Ca 0.26 -0.71 -0.32 0.00 -0.03 0.00 0.00 54.58 53.78 1vr6 n ASN 25 Cb 1.00 -4.26 -0.09 0.00 -0.61 0.00 0.00 39.78 35.81 1vr6 n ASN 25 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1vr6 s LEU 26 N -7.26 3.39 0.11 3.41 1.43 -0.29 -4.20 118.68 115.26 1vr6 s LEU 26 Ca 0.61 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 53.60 1vr6 s LEU 26 Cb -0.29 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 1vr6 s LEU 26 CO 0.80 0.25 0.27 -0.75 0.23 0.00 0.00 176.35 177.15 1vr6 s LYS 27 N -1.71 3.48 0.07 1.70 2.47 0.99 -3.70 119.74 123.04 1vr6 s LYS 27 Ca 0.20 -0.38 0.08 0.00 -1.56 0.00 0.00 55.97 54.31 1vr6 s LYS 27 Cb -0.11 -2.97 -0.03 0.00 -1.46 0.00 0.00 37.83 33.26 1vr6 s LYS 27 CO 0.11 0.55 -0.22 0.00 0.16 0.00 0.00 175.35 175.94 1vr6 s HIS 29 N -0.94 1.83 -0.23 0.00 5.65 0.12 -4.96 115.29 116.76 1vr6 s HIS 29 Ca 0.09 -0.79 -0.07 0.00 0.25 0.00 0.00 55.06 54.54 1vr6 s HIS 29 Cb -0.09 -1.32 -0.03 0.00 -1.18 0.00 0.00 32.58 29.96 1vr6 s HIS 29 CO 0.03 -0.40 0.06 0.42 -0.65 0.00 0.00 174.74 174.20 1vr6 s ILE 30 N 0.83 4.31 -0.23 0.89 1.01 -1.26 -0.08 121.20 126.67 1vr6 s ILE 30 Ca -0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.34 1vr6 s ILE 30 Cb -0.15 -3.00 0.01 0.00 0.01 0.00 0.00 42.46 39.32 1vr6 s ILE 30 CO 0.01 0.37 -0.05 -0.55 0.00 0.00 0.00 174.94 174.72 1vr6 s SER 31 N 1.38 4.26 -0.80 3.58 0.15 0.47 -5.00 113.70 117.74 1vr6 s SER 31 Ca 0.05 -0.58 -0.16 0.00 0.70 0.00 0.00 55.95 55.96 1vr6 s SER 31 Cb -0.15 -1.70 0.17 0.00 -1.71 0.00 0.00 66.02 62.63 1vr6 s SER 31 CO 0.03 -0.06 0.83 -0.54 1.20 0.00 0.00 173.24 174.70 1vr6 s LYS 32 N 1.42 3.48 0.58 5.44 1.02 -1.26 -0.75 119.74 129.66 1vr6 s LYS 32 Ca 0.04 -2.07 -0.06 0.00 0.02 0.00 0.00 55.97 53.90 1vr6 s LYS 32 Cb -0.15 -4.53 0.00 0.00 -0.52 0.00 0.00 37.83 32.64 1vr6 s LYS 32 CO -0.04 -1.46 0.88 0.20 -0.92 0.00 0.00 175.35 174.02 1vr6 s GLY 33 N 2.85 1.60 0.44 -3.33 0.00 -0.18 -4.96 107.32 103.74 1vr6 s GLY 33 Ca 0.20 -0.69 0.12 0.00 0.00 0.00 0.00 44.72 44.35 1vr6 s GLY 33 CO -0.06 -0.42 2.02 0.06 0.00 0.00 0.00 173.10 174.70 1vr6 h GLN 34 N -0.12 0.16 0.00 2.90 3.07 -2.04 -3.31 115.11 115.77 1vr6 h GLN 34 Ca -0.46 -0.02 -0.24 0.00 0.09 0.00 0.00 58.65 58.02 1vr6 h GLN 34 Cb 1.25 -0.03 -0.05 0.00 0.08 0.00 0.00 27.48 28.74 1vr6 h GLN 34 CO 0.61 0.22 -1.92 0.39 0.09 0.00 0.00 178.83 178.22 1vr6 n GLU 35 N -4.39 1.40 -3.90 0.06 1.02 -1.26 -5.01 120.64 108.56 1vr6 n GLU 35 Ca -0.01 0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 57.04 1vr6 n GLU 35 Cb 0.18 -1.34 -0.13 0.00 -0.02 0.00 0.00 31.44 30.13 1vr6 n GLU 35 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1vr6 s ARG 36 N -2.32 0.11 -0.06 3.49 1.81 -1.25 -4.69 118.95 116.04 1vr6 s ARG 36 Ca -0.12 -0.18 -0.23 0.00 -1.72 0.00 0.00 55.73 53.48 1vr6 s ARG 36 Cb 0.05 0.04 -0.04 0.00 -0.45 0.00 0.00 34.95 34.55 1vr6 s ARG 36 CO 0.49 -0.02 0.68 0.99 -0.68 0.00 0.00 175.30 176.77 1vr6 s THR 37 N -0.46 5.03 -0.05 0.02 2.01 -1.26 -1.02 115.64 119.92 1vr6 s THR 37 Ca -0.05 1.41 0.02 0.00 0.31 0.00 0.00 61.69 63.38 1vr6 s THR 37 Cb -0.03 -4.02 0.01 0.00 0.01 0.00 0.00 72.50 68.47 1vr6 s THR 37 CO -0.00 0.27 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.42 1vr6 s VAL 38 N 0.69 0.87 -0.18 3.82 1.01 0.07 -0.97 120.40 125.70 1vr6 s VAL 38 Ca 0.36 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1vr6 s VAL 38 Cb -0.18 -0.81 0.04 0.00 0.00 0.00 0.00 36.38 35.43 1vr6 s VAL 38 CO 0.18 0.29 -0.11 -0.63 0.00 0.00 0.00 175.10 174.83 1vr6 s ILE 39 N 0.57 1.57 -0.02 2.22 1.01 0.10 -0.39 121.20 126.26 1vr6 s ILE 39 Ca -0.10 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 59.45 1vr6 s ILE 39 Cb -0.13 -1.62 -0.05 0.00 0.01 0.00 0.00 42.46 40.67 1vr6 s ILE 39 CO 0.02 0.23 0.64 -0.83 0.00 0.00 0.00 174.94 174.99 1vr6 s GLY 40 N 1.44 2.63 -0.07 6.18 0.00 0.89 -0.69 107.32 117.69 1vr6 s GLY 40 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 44.72 44.83 1vr6 s GLY 40 CO -0.09 0.90 -0.18 -0.42 0.00 0.00 0.00 173.10 173.32 1vr6 s ILE 41 N 0.11 1.55 -0.15 0.90 1.01 -0.10 0.11 121.20 124.63 1vr6 s ILE 41 Ca 0.33 -0.74 -0.20 0.00 0.00 0.00 0.00 60.65 60.05 1vr6 s ILE 41 Cb -0.18 -1.36 0.05 0.00 0.01 0.00 0.00 42.46 40.98 1vr6 s ILE 41 CO 0.18 0.45 0.52 -0.51 0.00 0.00 0.00 174.94 175.57 1vr6 s ILE 42 N 0.38 0.01 -5.00 2.92 2.07 -0.30 -1.37 121.20 119.91 1vr6 s ILE 42 Ca -0.13 -0.07 0.00 0.00 -1.41 0.00 0.00 60.65 59.04 1vr6 s ILE 42 Cb -0.16 -0.76 0.00 0.00 0.13 0.00 0.00 42.46 41.68 1vr6 s ILE 42 CO 0.05 -0.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.65 1vr6 n GLY 43 N 2.31 -0.56 3.17 1.50 0.00 -1.10 -0.01 105.19 110.49 1vr6 n GLY 43 Ca -0.15 -1.38 -0.28 0.00 0.00 0.00 0.00 46.02 44.21 1vr6 n GLY 43 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vr6 s ASP 44 N -4.00 2.52 -0.07 1.61 1.01 -1.26 0.05 116.67 116.53 1vr6 s ASP 44 Ca 0.00 -0.43 -0.31 0.00 0.71 0.00 0.00 52.55 52.53 1vr6 s ASP 44 Cb 0.00 -0.85 0.08 0.00 1.01 0.00 0.00 42.92 43.17 1vr6 s ASP 44 CO 0.00 0.16 0.75 -0.62 0.21 0.00 0.00 175.17 175.67 1vr6 s ASP 45 N 0.13 -0.60 0.04 0.27 2.15 -0.61 -4.78 116.67 113.26 1vr6 s ASP 45 Ca -0.08 0.65 -0.11 0.00 0.43 0.00 0.00 52.55 53.44 1vr6 s ASP 45 Cb -0.14 0.49 -0.32 0.00 -0.30 0.00 0.00 42.92 42.65 1vr6 s ASP 45 CO 0.04 -0.56 1.01 0.03 -0.17 0.00 0.00 175.17 175.52 1vr6 h ARG 46 N 2.91 0.42 -7.34 4.34 2.47 -1.93 -3.42 114.38 111.83 1vr6 h ARG 46 Ca -0.25 -0.72 -0.51 0.00 -1.26 0.00 0.00 59.98 57.24 1vr6 h ARG 46 Cb 1.15 0.27 0.11 0.00 -1.65 0.00 0.00 29.97 29.84 1vr6 h ARG 46 CO 0.37 1.34 0.34 0.71 0.56 0.00 0.00 179.97 183.29 1vr6 s TYR 47 N -2.62 2.88 -0.16 3.04 2.02 -1.26 -5.03 117.35 116.23 1vr6 s TYR 47 Ca -0.08 1.42 -0.24 0.00 -0.37 0.00 0.00 57.07 57.80 1vr6 s TYR 47 Cb 0.05 -2.97 -0.02 0.00 -0.40 0.00 0.00 41.96 38.62 1vr6 s TYR 47 CO 0.91 -1.53 0.76 0.08 -1.57 0.00 0.00 175.55 174.20 1vr6 s VAL 48 N -3.01 4.95 -0.17 0.71 1.01 -1.26 -4.97 120.40 117.66 1vr6 s VAL 48 Ca 0.60 1.49 0.08 0.00 0.00 0.00 0.00 61.98 64.14 1vr6 s VAL 48 Cb -0.15 -4.07 -0.11 0.00 0.00 0.00 0.00 36.38 32.05 1vr6 s VAL 48 CO 0.55 0.09 0.25 1.33 0.00 0.00 0.00 175.10 177.32 1vr6 n VAL 49 N 4.54 0.00 -0.18 2.92 0.24 -1.26 -4.76 118.33 119.83 1vr6 n VAL 49 Ca 0.02 -0.24 -0.08 0.00 -2.04 0.00 0.00 64.34 62.00 1vr6 n VAL 49 Cb 0.49 0.61 0.01 0.00 -1.47 0.00 0.00 33.84 33.49 1vr6 n VAL 49 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vr6 h ALA 50 N 0.91 0.67 -0.09 2.33 0.00 -2.01 -0.43 119.26 120.64 1vr6 h ALA 50 Ca 0.00 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1vr6 h ALA 50 Cb 0.29 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1vr6 h ALA 50 CO 0.00 0.28 0.06 0.38 0.00 0.00 0.00 179.25 179.97 1vr6 h ASP 51 N 0.69 0.07 -0.31 0.00 3.04 -1.99 -2.19 116.42 115.73 1vr6 h ASP 51 Ca 0.17 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.96 1vr6 h ASP 51 Cb 0.20 -0.02 -0.01 0.00 -1.04 0.00 0.00 39.33 38.46 1vr6 h ASP 51 CO -0.01 0.05 0.19 0.11 -2.04 0.00 0.00 179.24 177.54 1vr6 h LYS 52 N 0.08 0.41 -0.51 4.15 1.79 -1.37 -2.23 116.57 118.89 1vr6 h LYS 52 Ca 0.04 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.37 1vr6 h LYS 52 Cb 0.05 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.59 1vr6 h LYS 52 CO -0.01 0.30 -0.09 0.74 -1.08 0.00 0.00 179.45 179.32 1vr6 h PHE 53 N 0.40 1.04 -0.45 -1.35 0.04 -1.28 -2.48 116.94 112.86 1vr6 h PHE 53 Ca 0.11 -0.20 0.10 0.00 2.80 0.00 0.00 57.97 60.79 1vr6 h PHE 53 Cb -0.01 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 37.85 1vr6 h PHE 53 CO -0.05 0.97 0.31 0.93 -0.60 0.00 0.00 178.31 179.87 1vr6 h GLU 54 N 0.84 0.14 0.00 1.51 5.08 -1.24 -1.62 114.58 119.29 1vr6 h GLU 54 Ca 0.14 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1vr6 h GLU 54 Cb 0.62 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 1vr6 h GLU 54 CO 0.04 0.09 -0.04 1.03 -1.00 0.00 0.00 179.01 179.14 1vr6 h SER 55 N 0.15 0.00 -2.92 1.42 0.87 -0.91 -3.45 113.55 108.71 1vr6 h SER 55 Ca 0.21 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 60.24 1vr6 h SER 55 Cb 0.64 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.62 1vr6 h SER 55 CO -0.03 0.04 0.79 -0.76 -0.53 0.00 0.00 176.83 176.35 1vr6 s LEU 56 N -6.33 4.36 0.55 2.23 1.43 -0.61 -4.90 118.68 115.41 1vr6 s LEU 56 Ca 0.00 2.37 0.25 0.00 -1.03 0.00 0.00 54.13 55.73 1vr6 s LEU 56 Cb 0.10 -3.58 1.46 0.00 0.03 0.00 0.00 46.19 44.19 1vr6 s LEU 56 CO 0.55 -0.72 2.04 0.44 0.23 0.00 0.00 176.35 178.88 1vr6 h ASP 57 N 7.07 0.00 0.38 2.29 3.32 -1.88 -1.69 116.42 125.90 1vr6 h ASP 57 Ca -0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1vr6 h ASP 57 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1vr6 h ASP 57 CO 0.89 0.00 -0.14 0.00 -1.72 0.00 0.00 179.24 178.26 1vr6 s VAL 59 N -2.53 5.07 -0.01 0.00 1.01 -0.64 0.11 120.40 123.41 1vr6 s VAL 59 Ca 0.27 0.74 -0.20 0.00 0.00 0.00 0.00 61.98 62.79 1vr6 s VAL 59 Cb 0.20 -3.84 -0.27 0.00 0.00 0.00 0.00 36.38 32.47 1vr6 s VAL 59 CO 0.49 0.04 1.02 -0.08 0.00 0.00 0.00 175.10 176.57 1vr6 h GLU 60 N 8.12 0.39 -2.72 2.72 4.81 -0.60 -3.44 114.58 123.86 1vr6 h GLU 60 Ca -0.29 -0.51 0.07 0.00 -0.13 0.00 0.00 59.36 58.50 1vr6 h GLU 60 Cb 1.14 0.17 -0.10 0.00 0.63 0.00 0.00 28.75 30.59 1vr6 h GLU 60 CO 0.72 1.19 0.33 -1.54 -0.73 0.00 0.00 179.01 178.98 1vr6 s SER 61 N -6.91 -0.37 -0.08 1.04 1.04 -1.07 -5.02 113.70 102.34 1vr6 s SER 61 Ca -0.13 -0.24 0.01 0.00 0.48 0.00 0.00 55.95 56.06 1vr6 s SER 61 Cb 0.03 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.74 1vr6 s SER 61 CO 0.84 -0.99 -0.07 -0.69 0.98 0.00 0.00 173.24 173.31 1vr6 s VAL 62 N -3.57 0.85 -0.19 5.02 1.01 -1.26 -1.21 120.40 121.05 1vr6 s VAL 62 Ca 0.07 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.69 1vr6 s VAL 62 Cb -0.02 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 1vr6 s VAL 62 CO -0.04 0.32 0.21 -0.69 0.00 0.00 0.00 175.10 174.89 1vr6 s VAL 63 N 1.28 5.36 -0.39 2.92 1.01 0.15 -4.94 120.40 125.79 1vr6 s VAL 63 Ca -0.04 0.35 -0.20 0.00 0.00 0.00 0.00 61.98 62.09 1vr6 s VAL 63 Cb -0.14 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.71 1vr6 s VAL 63 CO -0.03 0.41 0.59 -0.13 0.00 0.00 0.00 175.10 175.94 1vr6 s ARG 64 N 0.47 3.46 0.20 2.72 0.52 -1.26 -1.43 118.95 123.63 1vr6 s ARG 64 Ca 0.12 -0.23 0.08 0.00 -0.52 0.00 0.00 55.73 55.18 1vr6 s ARG 64 Cb -0.12 -3.88 0.08 0.00 0.52 0.00 0.00 34.95 31.56 1vr6 s ARG 64 CO 0.01 -0.82 1.45 0.28 0.02 0.00 0.00 175.30 176.23 1vr6 h VAL 65 N 5.74 1.56 -3.14 3.52 2.07 -1.45 -3.45 116.25 121.11 1vr6 h VAL 65 Ca -0.26 -2.72 -0.66 0.00 0.82 0.00 0.00 66.70 63.87 1vr6 h VAL 65 Cb 1.11 2.47 -0.11 0.00 -1.52 0.00 0.00 31.29 33.24 1vr6 h VAL 65 CO 0.84 0.78 -0.59 -0.76 0.02 0.00 0.00 177.57 177.86 1vr6 s LEU 66 N -7.22 3.82 0.63 2.57 1.43 -1.25 -5.07 118.68 113.59 1vr6 s LEU 66 Ca -0.01 0.16 -0.17 0.00 -1.03 0.00 0.00 54.13 53.09 1vr6 s LEU 66 Cb 0.11 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1vr6 s LEU 66 CO 0.79 0.32 1.17 -1.59 0.23 0.00 0.00 176.35 177.27 1vr6 s LYS 67 N -1.41 2.81 0.00 1.70 -2.85 -1.26 -4.93 119.74 113.80 1vr6 s LYS 67 Ca 0.19 1.65 0.27 0.00 -1.00 0.00 0.00 55.97 57.08 1vr6 s LYS 67 Cb -0.12 -1.93 1.46 0.00 -2.06 0.00 0.00 37.83 35.19 1vr6 s LYS 67 CO 0.09 -1.29 1.96 -0.35 0.10 0.00 0.00 175.35 175.86 1vr6 n PRO 68 N -2.02 1.20 -4.41 1.78 -0.04 -1.26 -4.82 135.00 125.42 1vr6 n PRO 68 Ca 0.12 -0.30 -0.24 0.00 -0.04 0.00 0.00 63.50 63.04 1vr6 n PRO 68 Cb 0.51 -1.44 -0.11 0.00 -0.04 0.00 0.00 33.50 32.41 1vr6 n PRO 68 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1vr6 s TYR 69 N -1.98 2.15 0.00 0.54 -0.85 -1.26 -5.01 117.35 110.93 1vr6 s TYR 69 Ca 0.40 -0.39 0.00 0.00 -0.52 0.00 0.00 57.07 56.56 1vr6 s TYR 69 Cb 0.19 -1.01 0.00 0.00 0.38 0.00 0.00 41.96 41.52 1vr6 s TYR 69 CO 0.32 0.53 0.00 1.63 -1.52 0.00 0.00 175.55 176.51 1vr6 n LYS 70 N -0.08 0.00 0.04 -3.49 4.76 -1.26 -4.77 118.16 113.35 1vr6 n LYS 70 Ca -0.10 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.32 1vr6 n LYS 70 Cb 0.58 -0.21 0.23 0.00 -1.84 0.00 0.00 35.03 33.79 1vr6 n LYS 70 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1vr6 h LEU 71 N 0.00 0.42 -0.68 -0.35 3.38 -1.96 -0.51 115.31 115.61 1vr6 h LEU 71 Ca 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1vr6 h LEU 71 Cb 0.19 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1vr6 h LEU 71 CO 0.00 0.67 -0.05 1.33 0.09 0.00 0.00 178.44 180.48 1vr6 n VAL 72 N -4.13 0.00 -2.96 1.22 0.24 -1.26 -4.82 118.33 106.62 1vr6 n VAL 72 Ca -0.00 -0.18 -0.34 0.00 -2.04 0.00 0.00 64.34 61.78 1vr6 n VAL 72 Cb 0.39 0.27 -0.06 0.00 -1.47 0.00 0.00 33.84 32.97 1vr6 n VAL 72 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1vr6 s SER 73 N -2.12 7.00 0.41 -1.34 0.15 -0.20 -3.53 113.70 114.08 1vr6 s SER 73 Ca 0.37 1.55 0.20 0.00 0.70 0.00 0.00 55.95 58.76 1vr6 s SER 73 Cb 0.21 -2.48 0.89 0.00 -1.71 0.00 0.00 66.02 62.94 1vr6 s SER 73 CO 0.38 -0.17 1.84 -0.09 1.20 0.00 0.00 173.24 176.40 1vr6 h ARG 74 N 2.60 0.00 -0.75 5.44 2.43 -1.12 -2.47 114.38 120.51 1vr6 h ARG 74 Ca -0.48 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 58.75 1vr6 h ARG 74 Cb 1.18 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.69 1vr6 h ARG 74 CO 0.64 0.30 0.49 1.49 -1.51 0.00 0.00 179.97 181.38 1vr6 h GLU 75 N 0.00 0.78 0.00 0.20 4.81 -1.90 -2.49 114.58 115.97 1vr6 h GLU 75 Ca -0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1vr6 h GLU 75 Cb 0.70 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1vr6 h GLU 75 CO 0.04 0.51 -1.41 0.34 -0.73 0.00 0.00 179.01 177.76 1vr6 n PHE 76 N -4.48 0.50 -3.12 0.92 -0.00 -1.03 -4.67 117.46 105.59 1vr6 n PHE 76 Ca 0.11 0.15 -0.18 0.00 -0.00 0.00 0.00 57.45 57.53 1vr6 n PHE 76 Cb 0.21 -0.72 -0.05 0.00 -0.00 0.00 0.00 39.48 38.92 1vr6 n PHE 76 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.76 178.34 1vr6 n HIS 77 N -2.43 -2.09 0.23 -5.13 -0.00 -0.96 -5.01 115.22 99.83 1vr6 n HIS 77 Ca -0.01 -2.54 0.08 0.00 -0.00 0.00 0.00 57.72 55.26 1vr6 n HIS 77 Cb 0.55 0.74 0.58 0.00 -0.00 0.00 0.00 29.99 31.85 1vr6 n HIS 77 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1vr6 h PRO 78 N 5.24 0.00 -6.86 1.57 0.11 -1.73 -3.39 132.00 126.94 1vr6 h PRO 78 Ca 0.16 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.78 1vr6 h PRO 78 Cb 0.99 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.11 1vr6 h PRO 78 CO 0.24 0.20 0.44 -1.83 -0.21 0.00 0.00 178.00 176.83 1vr6 s GLU 79 N -4.28 4.47 0.35 1.05 1.03 -1.26 -4.96 118.70 115.09 1vr6 s GLU 79 Ca -0.03 1.65 -0.29 0.00 0.03 0.00 0.00 54.97 56.34 1vr6 s GLU 79 Cb 0.14 -2.93 -0.11 0.00 -0.80 0.00 0.00 34.13 30.42 1vr6 s GLU 79 CO 0.65 0.10 1.54 -0.51 -1.33 0.00 0.00 175.26 175.70 1vr6 s ASP 80 N -1.19 6.33 -0.26 0.83 1.01 -1.26 -4.79 116.67 117.35 1vr6 s ASP 80 Ca 0.50 3.03 -0.22 0.00 0.71 0.00 0.00 52.55 56.57 1vr6 s ASP 80 Cb -0.27 -2.66 -0.01 0.00 1.01 0.00 0.00 42.92 40.99 1vr6 s ASP 80 CO 0.35 -0.90 0.69 -0.89 0.21 0.00 0.00 175.17 174.62 1vr6 s THR 81 N -0.69 4.93 -0.23 -1.27 2.01 0.10 -5.01 115.64 115.48 1vr6 s THR 81 Ca 0.57 1.22 -0.00 0.00 0.31 0.00 0.00 61.69 63.79 1vr6 s THR 81 Cb -0.47 -4.00 0.03 0.00 0.01 0.00 0.00 72.50 68.06 1vr6 s THR 81 CO 0.58 -0.03 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.68 1vr6 s VAL 82 N 2.63 2.60 -0.22 3.82 1.01 -1.26 -4.26 120.40 124.72 1vr6 s VAL 82 Ca 0.29 -1.05 -0.24 0.00 0.00 0.00 0.00 61.98 60.98 1vr6 s VAL 82 Cb -0.15 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1vr6 s VAL 82 CO 0.09 0.27 0.80 -0.63 0.00 0.00 0.00 175.10 175.64 1vr6 s ILE 83 N 1.30 4.87 -0.40 2.22 1.01 0.17 -4.85 121.20 125.51 1vr6 s ILE 83 Ca 0.01 1.54 -0.10 0.00 0.00 0.00 0.00 60.65 62.09 1vr6 s ILE 83 Cb -0.16 -4.10 0.06 0.00 0.01 0.00 0.00 42.46 38.27 1vr6 s ILE 83 CO -0.07 -0.03 0.24 -0.62 0.00 0.00 0.00 174.94 174.47 1vr6 s ASP 84 N 1.28 5.68 0.37 3.58 -1.08 -1.26 -0.61 116.67 124.63 1vr6 s ASP 84 Ca 0.35 -1.33 0.20 0.00 -0.52 0.00 0.00 52.55 51.25 1vr6 s ASP 84 Cb -0.16 -2.00 0.34 0.00 -1.46 0.00 0.00 42.92 39.64 1vr6 s ASP 84 CO 0.09 -0.49 1.58 -0.07 0.52 0.00 0.00 175.17 176.80 1vr6 h LEU 85 N 8.42 0.00 0.00 -1.34 3.38 -1.36 -3.48 115.31 120.93 1vr6 h LEU 85 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1vr6 h LEU 85 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1vr6 h LEU 85 CO 0.73 0.27 0.00 0.61 0.09 0.00 0.00 178.44 180.14 1vr6 n GLY 86 N 0.97 2.73 0.57 0.83 0.00 -1.26 -4.81 105.19 104.21 1vr6 n GLY 86 Ca 0.02 -0.40 0.07 0.00 0.00 0.00 0.00 46.02 45.72 1vr6 n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vr6 n ASP 87 N 0.00 2.18 -3.92 1.61 8.00 -1.26 -4.96 116.55 118.19 1vr6 n ASP 87 Ca 0.00 -1.59 -0.16 0.00 0.71 0.00 0.00 54.79 53.75 1vr6 n ASP 87 Cb 0.00 -0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 40.95 1vr6 n ASP 87 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1vr6 s VAL 88 N -1.18 0.32 -0.08 2.53 1.01 -1.26 -5.12 120.40 116.62 1vr6 s VAL 88 Ca 0.17 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.05 1vr6 s VAL 88 Cb 0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 1vr6 s VAL 88 CO 0.18 0.11 -0.20 -0.54 0.00 0.00 0.00 175.10 174.65 1vr6 s LYS 89 N 0.13 2.83 -0.22 2.72 1.02 -1.26 -0.80 119.74 124.16 1vr6 s LYS 89 Ca -0.01 -0.81 -0.01 0.00 0.02 0.00 0.00 55.97 55.16 1vr6 s LYS 89 Cb -0.04 -2.34 0.02 0.00 -0.52 0.00 0.00 37.83 34.94 1vr6 s LYS 89 CO -0.00 0.35 -0.10 0.42 -0.92 0.00 0.00 175.35 175.10 1vr6 s ILE 90 N -0.06 2.74 -4.04 2.17 1.01 0.22 -4.84 121.20 118.40 1vr6 s ILE 90 Ca -0.05 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.71 1vr6 s ILE 90 Cb -0.14 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.03 1vr6 s ILE 90 CO 0.04 0.35 0.00 0.61 0.00 0.00 0.00 174.94 175.94 1vr6 n GLY 91 N 4.68 0.86 3.75 6.18 0.00 -1.26 0.42 105.19 119.81 1vr6 n GLY 91 Ca -0.18 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.44 1vr6 n GLY 91 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1vr6 s ASN 92 N -4.00 6.36 0.00 1.61 3.84 -1.26 -1.50 114.94 119.99 1vr6 s ASN 92 Ca 0.00 2.96 0.00 0.00 0.21 0.00 0.00 52.86 56.03 1vr6 s ASN 92 Cb 0.00 -2.63 0.00 0.00 -0.55 0.00 0.00 41.25 38.07 1vr6 s ASN 92 CO 0.00 -0.92 0.00 0.61 -2.79 0.00 0.00 177.10 174.00 1vr6 n GLY 93 N 2.24 3.29 3.69 1.21 0.00 -1.26 -5.06 105.19 109.29 1vr6 n GLY 93 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 1vr6 n GLY 93 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vr6 s TYR 94 N -2.99 2.85 -0.22 1.61 2.02 -0.56 -0.90 117.35 119.16 1vr6 s TYR 94 Ca 0.00 -0.15 -0.02 0.00 -0.37 0.00 0.00 57.07 56.53 1vr6 s TYR 94 Cb 0.00 -1.33 0.07 0.00 -0.40 0.00 0.00 41.96 40.29 1vr6 s TYR 94 CO 0.00 0.55 0.03 0.12 -1.57 0.00 0.00 175.55 174.68 1vr6 s PHE 95 N -1.96 1.32 -0.20 2.71 5.36 -0.42 -4.60 117.98 120.18 1vr6 s PHE 95 Ca 0.29 -1.11 -0.10 0.00 -0.96 0.00 0.00 56.93 55.05 1vr6 s PHE 95 Cb -0.08 -1.20 -0.05 0.00 -0.34 0.00 0.00 43.02 41.35 1vr6 s PHE 95 CO 0.20 -0.67 0.14 0.99 -1.46 0.00 0.00 175.22 174.41 1vr6 s THR 96 N 1.76 5.40 -0.26 0.12 2.01 -0.15 -0.78 115.64 123.75 1vr6 s THR 96 Ca -0.00 0.20 -0.09 0.00 0.31 0.00 0.00 61.69 62.10 1vr6 s THR 96 Cb -0.17 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1vr6 s THR 96 CO -0.10 0.43 0.13 -0.63 -0.69 0.00 0.00 174.62 173.76 1vr6 s ILE 97 N 0.44 4.87 -0.15 1.82 1.01 -0.48 -1.50 121.20 127.20 1vr6 s ILE 97 Ca 0.08 0.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.72 1vr6 s ILE 97 Cb -0.11 -3.29 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 1vr6 s ILE 97 CO -0.01 0.30 -0.05 -0.63 0.00 0.00 0.00 174.94 174.55 1vr6 s ILE 98 N 1.58 3.76 0.04 2.92 1.01 -0.14 -4.30 121.20 126.07 1vr6 s ILE 98 Ca 0.07 -0.40 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 1vr6 s ILE 98 Cb -0.15 -2.64 0.01 0.00 0.01 0.00 0.00 42.46 39.69 1vr6 s ILE 98 CO 0.07 0.50 0.25 0.00 0.00 0.00 0.00 174.94 175.76 1vr6 s ALA 99 N 0.38 -0.52 0.00 9.38 0.00 -0.93 -0.75 121.76 129.32 1vr6 s ALA 99 Ca -0.05 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 51.77 1vr6 s ALA 99 Cb -0.14 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.28 1vr6 s ALA 99 CO 0.03 -0.39 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1vr6 n GLY 100 N 0.61 -2.21 3.84 0.00 0.00 -1.01 -1.38 105.19 105.04 1vr6 n GLY 100 Ca -0.19 -1.43 -0.32 0.00 0.00 0.00 0.00 46.02 44.09 1vr6 n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vr6 s PRO 101 N -1.84 3.41 0.14 1.61 0.04 -0.93 -1.67 135.00 135.76 1vr6 s PRO 101 Ca 0.00 0.94 -0.19 0.00 0.04 0.00 0.00 61.00 61.79 1vr6 s PRO 101 Cb 0.00 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1vr6 s PRO 101 CO 0.00 -0.72 1.71 0.00 0.04 0.00 0.00 177.00 178.03 1vr6 s SER 103 N -5.23 2.90 -0.38 0.00 0.01 -1.26 -0.43 113.70 109.32 1vr6 s SER 103 Ca -0.13 -0.56 -0.29 0.00 1.31 0.00 0.00 55.95 56.28 1vr6 s SER 103 Cb 0.11 -0.26 0.02 0.00 0.21 0.00 0.00 66.02 66.10 1vr6 s SER 103 CO 0.69 0.22 1.08 -0.69 0.41 0.00 0.00 173.24 174.95 1vr6 s VAL 104 N -0.80 4.42 -0.98 3.43 1.01 0.00 -4.72 120.40 122.77 1vr6 s VAL 104 Ca 0.10 1.50 0.21 0.00 0.00 0.00 0.00 61.98 63.79 1vr6 s VAL 104 Cb -0.10 -4.47 -0.23 0.00 0.00 0.00 0.00 36.38 31.59 1vr6 s VAL 104 CO 0.02 -0.66 0.88 -0.62 0.00 0.00 0.00 175.10 174.72 1vr6 n GLU 105 N 7.18 0.14 0.00 2.72 1.02 -1.26 -4.42 120.64 126.01 1vr6 n GLU 105 Ca 0.11 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 1vr6 n GLU 105 Cb 0.48 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 1vr6 n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vr6 n GLY 106 N 1.49 2.03 0.14 0.62 0.00 -1.26 -5.03 105.19 103.18 1vr6 n GLY 106 Ca 0.04 -0.94 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 1vr6 n GLY 106 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1vr6 h ARG 107 N 0.00 0.36 -0.61 1.61 2.43 -1.97 -3.09 114.38 113.10 1vr6 h ARG 107 Ca 0.00 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 58.92 1vr6 h ARG 107 Cb 0.00 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 1vr6 h ARG 107 CO 0.00 0.85 0.33 0.93 -1.51 0.00 0.00 179.97 180.57 1vr6 h GLU 108 N -0.07 0.86 -0.16 0.20 4.39 -1.99 -0.62 114.58 117.19 1vr6 h GLU 108 Ca 0.00 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.55 1vr6 h GLU 108 Cb 0.84 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 1vr6 h GLU 108 CO 0.05 0.66 -0.11 0.00 -1.16 0.00 0.00 179.01 178.45 1vr6 h MET 109 N 0.83 0.26 -0.08 2.33 -0.00 -1.96 -0.57 114.93 115.74 1vr6 h MET 109 Ca 0.22 -0.06 -0.22 0.00 -0.00 0.00 0.00 59.70 59.64 1vr6 h MET 109 Cb 0.05 -0.04 0.01 0.00 -0.00 0.00 0.00 31.60 31.63 1vr6 h MET 109 CO -0.03 0.37 -0.81 1.25 -0.00 0.00 0.00 176.91 177.69 1vr6 h LEU 110 N 0.25 0.85 -0.39 -0.10 5.85 -1.35 -1.71 115.31 118.69 1vr6 h LEU 110 Ca 0.05 -0.68 -0.01 0.00 0.84 0.00 0.00 57.88 58.08 1vr6 h LEU 110 Cb 0.35 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1vr6 h LEU 110 CO 0.02 1.41 0.21 0.24 -0.34 0.00 0.00 178.44 179.97 1vr6 h MET 111 N 0.36 0.55 -0.66 1.25 2.86 -0.86 0.20 114.93 118.62 1vr6 h MET 111 Ca -0.08 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 1vr6 h MET 111 Cb 1.46 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.99 1vr6 h MET 111 CO 0.16 0.46 0.36 1.05 1.06 0.00 0.00 176.91 180.00 1vr6 h GLU 112 N 0.50 0.92 -0.50 1.72 4.11 -1.14 0.02 114.58 120.21 1vr6 h GLU 112 Ca 0.14 -0.11 -0.03 0.00 0.07 0.00 0.00 59.36 59.43 1vr6 h GLU 112 Cb 0.07 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1vr6 h GLU 112 CO -0.02 0.69 0.20 1.15 0.07 0.00 0.00 179.01 181.10 1vr6 h THR 113 N 0.91 1.22 -0.32 -1.06 2.02 -0.97 -1.41 112.91 113.29 1vr6 h THR 113 Ca 0.23 -0.68 -0.12 0.00 0.77 0.00 0.00 66.41 66.62 1vr6 h THR 113 Cb 0.04 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1vr6 h THR 113 CO -0.04 0.26 -0.27 0.00 0.37 0.00 0.00 175.52 175.83 1vr6 h ALA 114 N 1.04 0.91 0.11 6.16 0.00 -0.46 0.31 119.26 127.34 1vr6 h ALA 114 Ca 0.17 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1vr6 h ALA 114 Cb 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1vr6 h ALA 114 CO -0.01 0.62 -0.05 1.25 0.00 0.00 0.00 179.25 181.05 1vr6 h HIS 115 N 0.57 -0.14 -0.25 0.00 6.17 -0.87 -0.50 115.15 120.13 1vr6 h HIS 115 Ca 0.07 -0.00 0.04 0.00 0.71 0.00 0.00 60.37 61.19 1vr6 h HIS 115 Cb 0.76 0.05 -0.04 0.00 2.52 0.00 0.00 27.41 30.70 1vr6 h HIS 115 CO 0.03 -0.00 -0.00 0.35 0.71 0.00 0.00 177.93 179.02 1vr6 h PHE 116 N -0.25 -0.02 -0.34 5.26 3.57 -1.07 -2.02 116.94 122.07 1vr6 h PHE 116 Ca -0.02 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 1vr6 h PHE 116 Cb 0.20 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1vr6 h PHE 116 CO -0.04 -0.04 0.01 -0.07 -2.23 0.00 0.00 178.31 175.94 1vr6 h LEU 117 N 0.07 0.59 -1.12 0.59 3.38 -0.84 -2.91 115.31 115.07 1vr6 h LEU 117 Ca 0.12 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1vr6 h LEU 117 Cb 0.15 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1vr6 h LEU 117 CO -0.20 0.74 0.54 0.77 0.09 0.00 0.00 178.44 180.38 1vr6 h SER 118 N 0.41 0.99 0.56 -0.43 4.64 -0.98 -0.53 113.55 118.20 1vr6 h SER 118 Ca 0.10 -0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1vr6 h SER 118 Cb 0.43 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1vr6 h SER 118 CO 0.02 0.74 -0.15 -0.33 -0.87 0.00 0.00 176.83 176.23 1vr6 h GLU 119 N 1.16 0.00 -0.00 4.77 4.39 -1.26 -1.72 114.58 121.91 1vr6 h GLU 119 Ca 0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 1vr6 h GLU 119 Cb -0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 1vr6 h GLU 119 CO -0.06 0.15 -0.03 1.28 -1.16 0.00 0.00 179.01 179.19 1vr6 n LEU 120 N -3.53 0.46 0.00 1.33 4.77 -0.30 -4.90 117.00 114.82 1vr6 n LEU 120 Ca -0.01 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1vr6 n LEU 120 Cb 0.30 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1vr6 n LEU 120 CO 0.31 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1vr6 n GLY 121 N 1.13 0.71 3.72 -0.72 0.00 -0.65 -5.05 105.19 104.33 1vr6 n GLY 121 Ca 0.20 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1vr6 n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vr6 s VAL 122 N -2.00 4.47 -0.39 1.61 1.01 -0.64 -4.90 120.40 119.56 1vr6 s VAL 122 Ca 0.00 1.93 0.04 0.00 0.00 0.00 0.00 61.98 63.95 1vr6 s VAL 122 Cb 0.00 -4.23 -0.00 0.00 0.00 0.00 0.00 36.38 32.15 1vr6 s VAL 122 CO 0.00 0.24 0.42 0.29 0.00 0.00 0.00 175.10 176.05 1vr6 n LYS 123 N 3.21 2.47 -4.10 2.72 5.02 -1.26 -3.88 118.16 122.34 1vr6 n LYS 123 Ca 0.04 -0.41 -0.33 0.00 -2.02 0.00 0.00 58.31 55.60 1vr6 n LYS 123 Cb 0.49 -0.90 -0.16 0.00 -0.02 0.00 0.00 35.03 34.44 1vr6 n LYS 123 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1vr6 s VAL 124 N -0.84 2.01 -0.21 -0.18 1.01 -1.26 0.39 120.40 121.32 1vr6 s VAL 124 Ca 0.03 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 60.99 1vr6 s VAL 124 Cb 0.03 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 1vr6 s VAL 124 CO 0.11 0.49 0.05 -0.22 0.00 0.00 0.00 175.10 175.52 1vr6 s LEU 125 N 1.30 3.55 0.17 3.92 2.96 0.51 -2.20 118.68 128.89 1vr6 s LEU 125 Ca 0.04 -0.08 0.06 0.00 -0.22 0.00 0.00 54.13 53.93 1vr6 s LEU 125 Cb -0.13 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 1vr6 s LEU 125 CO -0.12 0.09 0.09 0.00 -1.32 0.00 0.00 176.35 175.08 1vr6 s ARG 126 N 0.89 2.72 -0.29 1.98 1.70 -0.48 -1.15 118.95 124.32 1vr6 s ARG 126 Ca 0.03 -0.96 -0.25 0.00 -0.47 0.00 0.00 55.73 54.08 1vr6 s ARG 126 Cb -0.14 -2.54 0.18 0.00 -0.57 0.00 0.00 34.95 31.88 1vr6 s ARG 126 CO 0.02 0.47 1.36 0.20 -1.08 0.00 0.00 175.30 176.27 1vr6 s GLY 127 N -3.07 0.24 0.01 3.88 0.00 -1.14 -3.41 107.32 103.83 1vr6 s GLY 127 Ca 0.30 3.33 -0.24 0.00 0.00 0.00 0.00 44.72 48.11 1vr6 s GLY 127 CO 0.22 1.89 0.71 -0.32 0.00 0.00 0.00 173.10 175.60 1vr6 s GLY 128 N 0.02 2.72 -0.15 0.20 0.00 0.43 -4.57 107.32 105.96 1vr6 s GLY 128 Ca 0.07 0.20 0.11 0.00 0.00 0.00 0.00 44.72 45.09 1vr6 s GLY 128 CO -0.13 1.04 0.01 0.00 0.00 0.00 0.00 173.10 174.01 1vr6 n ALA 129 N 2.99 1.64 -3.54 3.20 0.00 -1.26 -0.82 120.51 122.72 1vr6 n ALA 129 Ca -0.03 -0.92 -0.32 0.00 0.00 0.00 0.00 53.44 52.17 1vr6 n ALA 129 Cb 0.51 -0.03 -0.17 0.00 0.00 0.00 0.00 19.45 19.76 1vr6 n ALA 129 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1vr6 s TYR 130 N -2.35 2.52 -0.03 0.00 2.02 -1.26 0.08 117.35 118.33 1vr6 s TYR 130 Ca -0.11 -1.20 0.05 0.00 -0.37 0.00 0.00 57.07 55.45 1vr6 s TYR 130 Cb 0.05 -1.72 -0.01 0.00 -0.40 0.00 0.00 41.96 39.88 1vr6 s TYR 130 CO 0.56 -0.54 -0.18 0.15 -1.57 0.00 0.00 175.55 173.97 1vr6 s LYS 131 N 0.71 1.62 0.97 -0.62 -0.14 -0.15 -4.90 119.74 117.22 1vr6 s LYS 131 Ca -0.10 -0.63 -0.15 0.00 -1.36 0.00 0.00 55.97 53.72 1vr6 s LYS 131 Cb -0.16 -1.48 0.19 0.00 -1.68 0.00 0.00 37.83 34.69 1vr6 s LYS 131 CO 0.01 0.32 1.25 -1.25 -0.76 0.00 0.00 175.35 174.92 1vr6 s PRO 132 N -0.20 0.65 0.27 -1.68 0.05 -1.26 -4.59 135.00 128.23 1vr6 s PRO 132 Ca 0.02 -0.20 -0.05 0.00 0.05 0.00 0.00 61.00 60.82 1vr6 s PRO 132 Cb -0.09 -1.83 -0.05 0.00 0.05 0.00 0.00 34.50 32.58 1vr6 s PRO 132 CO 0.01 -2.44 0.53 1.03 0.05 0.00 0.00 177.00 176.18 1vr6 s ARG 133 N -5.70 3.63 0.00 4.56 0.52 -1.26 -4.85 118.95 115.85 1vr6 s ARG 133 Ca 0.70 -0.01 0.00 0.00 -0.52 0.00 0.00 55.73 55.90 1vr6 s ARG 133 Cb -0.07 -2.67 0.00 0.00 0.52 0.00 0.00 34.95 32.73 1vr6 s ARG 133 CO 0.53 0.25 0.00 0.45 0.02 0.00 0.00 175.30 176.54 1vr6 n SER 138 N -0.82 0.00 -4.60 0.23 2.88 -1.26 -5.16 113.62 104.89 1vr6 n SER 138 Ca -0.02 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.10 1vr6 n SER 138 Cb 0.54 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.95 1vr6 n SER 138 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1vr6 s PHE 139 N -2.27 3.17 -2.56 0.66 5.36 -1.26 -4.95 117.98 116.12 1vr6 s PHE 139 Ca 0.00 0.68 0.27 0.00 -0.96 0.00 0.00 56.93 56.92 1vr6 s PHE 139 Cb 0.00 -3.27 0.91 0.00 -0.34 0.00 0.00 43.02 40.32 1vr6 s PHE 139 CO 0.00 -0.63 1.67 1.04 -1.46 0.00 0.00 175.22 175.84 1vr6 n GLN 140 N 6.26 1.77 0.00 10.12 1.13 -1.26 -4.76 117.38 130.64 1vr6 n GLN 140 Ca 0.03 -1.12 0.00 0.00 -1.94 0.00 0.00 57.00 53.97 1vr6 n GLN 140 Cb 0.48 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.36 1vr6 n GLN 140 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1vr6 n GLY 141 N 1.20 -0.51 0.24 1.08 0.00 -1.26 -0.98 105.19 104.95 1vr6 n GLY 141 Ca 0.18 -1.69 0.12 0.00 0.00 0.00 0.00 46.02 44.63 1vr6 n GLY 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1vr6 n LEU 142 N -1.31 1.09 0.00 0.99 4.77 -0.70 -4.87 117.00 116.96 1vr6 n LEU 142 Ca 0.00 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1vr6 n LEU 142 Cb 0.00 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1vr6 n LEU 142 CO 0.00 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.88 1vr6 n GLY 143 N 1.38 3.01 0.35 -0.72 0.00 0.11 -2.93 105.19 106.40 1vr6 n GLY 143 Ca 0.10 -0.36 0.14 0.00 0.00 0.00 0.00 46.02 45.90 1vr6 n GLY 143 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vr6 h GLU 144 N 0.00 0.28 -0.51 1.61 4.81 -1.97 -0.87 114.58 117.92 1vr6 h GLU 144 Ca 0.00 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 1vr6 h GLU 144 Cb 0.00 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1vr6 h GLU 144 CO 0.00 0.18 0.08 0.87 -0.73 0.00 0.00 179.01 179.41 1vr6 h LYS 145 N 0.29 0.86 -0.91 1.92 1.57 -1.93 0.15 116.57 118.51 1vr6 h LYS 145 Ca 0.26 -0.23 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 1vr6 h LYS 145 Cb 0.63 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.79 1vr6 h LYS 145 CO -0.06 0.85 0.58 0.78 -0.57 0.00 0.00 179.45 181.03 1vr6 h GLY 146 N 0.74 1.34 1.05 3.86 0.00 -1.22 -0.72 103.07 108.12 1vr6 h GLY 146 Ca 0.16 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 1vr6 h GLY 146 CO 0.01 0.35 0.33 1.41 0.00 0.00 0.00 176.54 178.65 1vr6 h LEU 147 N 1.10 1.11 -0.41 3.11 3.38 -0.86 -0.06 115.31 122.69 1vr6 h LEU 147 Ca 0.37 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 58.19 1vr6 h LEU 147 Cb 0.06 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1vr6 h LEU 147 CO -0.14 0.97 0.24 -0.33 0.09 0.00 0.00 178.44 179.28 1vr6 h GLU 148 N 1.18 0.48 -0.71 1.13 5.08 -0.30 -0.84 114.58 120.60 1vr6 h GLU 148 Ca 0.27 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1vr6 h GLU 148 Cb 0.20 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1vr6 h GLU 148 CO -0.02 0.32 0.37 1.88 -1.00 0.00 0.00 179.01 180.55 1vr6 h TYR 149 N 0.49 1.00 -0.39 4.33 0.05 -0.76 -0.57 116.97 121.13 1vr6 h TYR 149 Ca 0.16 -0.04 0.02 0.00 0.05 0.00 0.00 58.73 58.92 1vr6 h TYR 149 Cb -0.00 -0.31 -0.03 0.00 1.01 0.00 0.00 36.73 37.40 1vr6 h TYR 149 CO -0.07 0.72 0.23 -0.07 -1.05 0.00 0.00 178.16 177.92 1vr6 h LEU 150 N 0.99 0.37 -0.56 3.88 3.38 -0.81 -0.86 115.31 121.70 1vr6 h LEU 150 Ca 0.25 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.14 1vr6 h LEU 150 Cb 0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1vr6 h LEU 150 CO -0.04 0.27 0.04 -0.09 0.09 0.00 0.00 178.44 178.71 1vr6 h ARG 151 N 0.46 0.97 0.11 1.13 9.65 -0.95 -1.09 114.38 124.67 1vr6 h ARG 151 Ca 0.15 -0.29 -0.01 0.00 -1.10 0.00 0.00 59.98 58.74 1vr6 h ARG 151 Cb 0.00 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.49 1vr6 h ARG 151 CO -0.07 0.95 -0.06 0.93 2.80 0.00 0.00 179.97 184.53 1vr6 h GLU 152 N 0.85 -0.15 -0.79 0.20 5.08 -0.96 0.62 114.58 119.44 1vr6 h GLU 152 Ca 0.16 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.50 1vr6 h GLU 152 Cb 0.49 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 1vr6 h GLU 152 CO 0.02 -0.01 0.34 0.00 -1.00 0.00 0.00 179.01 178.37 1vr6 h ALA 153 N 0.61 1.02 -0.33 3.43 0.00 -1.12 -0.98 119.26 121.89 1vr6 h ALA 153 Ca -0.02 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1vr6 h ALA 153 Cb 0.21 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1vr6 h ALA 153 CO 0.03 0.62 -0.13 0.00 0.00 0.00 0.00 179.25 179.77 1vr6 h ALA 154 N 1.18 0.47 -0.19 0.00 0.00 -1.12 -1.23 119.26 118.36 1vr6 h ALA 154 Ca 0.27 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1vr6 h ALA 154 Cb 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1vr6 h ALA 154 CO -0.03 0.35 0.11 -0.44 0.00 0.00 0.00 179.25 179.24 1vr6 h ASP 155 N 0.45 0.18 -0.19 0.00 3.32 -0.71 -0.08 116.42 119.39 1vr6 h ASP 155 Ca 0.08 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1vr6 h ASP 155 Cb 0.65 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 1vr6 h ASP 155 CO 0.04 0.13 0.10 0.50 -1.72 0.00 0.00 179.24 178.30 1vr6 h LYS 156 N 0.23 0.26 -0.57 3.56 3.64 -1.13 -3.24 116.57 119.33 1vr6 h LYS 156 Ca 0.07 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1vr6 h LYS 156 Cb -0.00 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1vr6 h LYS 156 CO -0.04 0.26 0.00 0.66 -2.27 0.00 0.00 179.45 178.06 1vr6 n TYR 157 N -4.90 0.75 -2.77 1.91 4.01 -0.47 -4.97 117.16 110.72 1vr6 n TYR 157 Ca -0.04 -0.38 -0.09 0.00 -0.16 0.00 0.00 57.90 57.24 1vr6 n TYR 157 Cb 0.07 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.15 1vr6 n TYR 157 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vr6 n GLY 158 N 1.52 0.07 3.61 2.72 0.00 -0.25 -4.87 105.19 108.00 1vr6 n GLY 158 Ca 0.21 -0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1vr6 n GLY 158 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1vr6 s MET 159 N -4.85 1.93 0.05 1.61 -1.94 -0.21 -4.88 119.30 111.01 1vr6 s MET 159 Ca 0.05 -2.09 0.02 0.00 -1.71 0.00 0.00 55.69 51.97 1vr6 s MET 159 Cb -0.02 -1.62 -0.04 0.00 2.01 0.00 0.00 34.83 35.16 1vr6 s MET 159 CO 0.37 -0.03 0.07 0.71 -0.01 0.00 0.00 175.02 176.12 1vr6 s TYR 160 N -2.72 3.20 -0.17 -0.03 2.02 0.16 -4.55 117.35 115.26 1vr6 s TYR 160 Ca 0.35 0.11 -0.06 0.00 -0.37 0.00 0.00 57.07 57.09 1vr6 s TYR 160 Cb 0.09 -1.65 -0.04 0.00 -0.40 0.00 0.00 41.96 39.96 1vr6 s TYR 160 CO 0.18 0.52 0.04 0.08 -1.57 0.00 0.00 175.55 174.80 1vr6 s VAL 161 N -1.31 4.59 -0.13 0.71 1.01 -1.26 -0.36 120.40 123.64 1vr6 s VAL 161 Ca 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1vr6 s VAL 161 Cb -0.12 -3.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 1vr6 s VAL 161 CO 0.19 0.47 -0.14 0.54 0.00 0.00 0.00 175.10 176.16 1vr6 s VAL 162 N 0.32 2.95 0.01 2.92 0.11 -0.30 -0.67 120.40 125.74 1vr6 s VAL 162 Ca 0.02 -0.69 -0.13 0.00 -2.93 0.00 0.00 61.98 58.24 1vr6 s VAL 162 Cb -0.13 -2.23 0.02 0.00 -1.53 0.00 0.00 36.38 32.51 1vr6 s VAL 162 CO 0.01 0.52 0.28 0.28 -3.33 0.00 0.00 175.10 172.86 1vr6 s THR 163 N 0.40 0.07 -0.04 5.04 -1.32 -1.09 -2.91 115.64 115.80 1vr6 s THR 163 Ca -0.11 -0.61 -0.16 0.00 -1.21 0.00 0.00 61.69 59.60 1vr6 s THR 163 Cb -0.16 -0.75 -0.05 0.00 -1.51 0.00 0.00 72.50 70.03 1vr6 s THR 163 CO 0.05 -0.34 0.42 -0.70 -2.21 0.00 0.00 174.62 171.85 1vr6 s GLU 164 N -1.90 4.05 -0.17 7.08 2.12 -1.26 -1.25 118.70 127.38 1vr6 s GLU 164 Ca -0.10 0.41 -0.14 0.00 0.36 0.00 0.00 54.97 55.50 1vr6 s GLU 164 Cb -0.03 -3.29 -0.04 0.00 0.26 0.00 0.00 34.13 31.03 1vr6 s GLU 164 CO 0.01 0.54 0.32 0.00 -0.54 0.00 0.00 175.26 175.58 1vr6 s ALA 165 N -0.58 3.58 0.05 6.30 0.00 -0.36 -4.73 121.76 126.01 1vr6 s ALA 165 Ca 0.24 -0.47 0.09 0.00 0.00 0.00 0.00 51.96 51.82 1vr6 s ALA 165 Cb -0.16 -2.45 -0.19 0.00 0.00 0.00 0.00 23.12 20.31 1vr6 s ALA 165 CO 0.12 0.00 1.11 -0.07 0.00 0.00 0.00 175.76 176.93 1vr6 h LEU 166 N 6.89 0.00 -7.90 0.00 3.38 -1.90 -3.42 115.31 112.36 1vr6 h LEU 166 Ca -0.40 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.67 1vr6 h LEU 166 Cb 1.16 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 1vr6 h LEU 166 CO 0.75 0.95 0.42 -0.83 0.09 0.00 0.00 178.44 179.82 1vr6 s GLY 167 N -4.80 0.07 0.58 0.83 0.00 -1.26 -4.97 107.32 97.77 1vr6 s GLY 167 Ca -0.00 -0.34 0.28 0.00 0.00 0.00 0.00 44.72 44.65 1vr6 s GLY 167 CO 0.82 0.65 2.02 1.05 0.00 0.00 0.00 173.10 177.64 1vr6 h GLU 168 N 2.00 0.00 0.06 2.90 4.11 -1.95 -2.39 114.58 119.31 1vr6 h GLU 168 Ca -0.27 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 58.93 1vr6 h GLU 168 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1vr6 h GLU 168 CO 0.33 0.00 -1.07 0.38 0.07 0.00 0.00 179.01 178.72 1vr6 h ASP 169 N 0.00 0.30 0.06 3.06 2.03 -2.01 -3.22 116.42 116.65 1vr6 h ASP 169 Ca 0.15 -0.29 0.00 0.00 -0.73 0.00 0.00 57.03 56.16 1vr6 h ASP 169 Cb 0.78 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 39.19 1vr6 h ASP 169 CO -0.00 1.18 -0.25 -0.90 -1.03 0.00 0.00 179.24 178.23 1vr6 n ASP 170 N -3.55 1.79 -0.30 4.15 5.75 -1.02 -4.53 116.55 118.84 1vr6 n ASP 170 Ca -0.05 -1.40 -0.05 0.00 -0.01 0.00 0.00 54.79 53.28 1vr6 n ASP 170 Cb 0.93 0.22 0.07 0.00 -1.03 0.00 0.00 41.12 41.30 1vr6 n ASP 170 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1vr6 h LEU 171 N 2.41 1.06 -1.02 -2.12 5.85 -1.44 -1.78 115.31 118.26 1vr6 h LEU 171 Ca 0.00 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 1vr6 h LEU 171 Cb 0.68 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1vr6 h LEU 171 CO 0.00 0.91 0.26 -0.65 -0.34 0.00 0.00 178.44 178.61 1vr6 h PRO 172 N 1.15 0.96 -0.06 5.25 0.11 -1.80 -0.34 132.00 137.26 1vr6 h PRO 172 Ca 0.28 -0.16 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 1vr6 h PRO 172 Cb 0.13 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.08 1vr6 h PRO 172 CO -0.03 0.78 -0.04 0.87 -0.21 0.00 0.00 178.00 179.37 1vr6 h LYS 173 N 0.94 0.14 -0.64 1.05 1.79 -1.81 -1.62 116.57 116.42 1vr6 h LYS 173 Ca 0.22 -0.06 0.12 0.00 -2.18 0.00 0.00 60.65 58.74 1vr6 h LYS 173 Cb 0.18 -0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.75 1vr6 h LYS 173 CO -0.02 0.53 0.19 0.28 -1.08 0.00 0.00 179.45 179.35 1vr6 h VAL 174 N -0.26 0.67 -0.26 0.50 2.07 -1.30 -1.20 116.25 116.47 1vr6 h VAL 174 Ca 0.01 -0.11 -0.10 0.00 0.82 0.00 0.00 66.70 67.32 1vr6 h VAL 174 Cb 0.49 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1vr6 h VAL 174 CO 0.01 0.06 -0.24 0.00 0.02 0.00 0.00 177.57 177.42 1vr6 h ALA 175 N 1.49 1.09 -0.74 1.67 0.00 -1.00 0.25 119.26 122.01 1vr6 h ALA 175 Ca 0.34 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1vr6 h ALA 175 Cb 0.49 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1vr6 h ALA 175 CO -0.39 0.56 0.49 1.49 0.00 0.00 0.00 179.25 181.40 1vr6 h GLU 176 N 0.45 0.96 0.00 0.00 4.81 -0.23 -3.33 114.58 117.24 1vr6 h GLU 176 Ca 0.07 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.09 1vr6 h GLU 176 Cb 0.67 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 1vr6 h GLU 176 CO 0.05 0.63 -2.07 0.66 -0.73 0.00 0.00 179.01 177.56 1vr6 n TYR 177 N -4.58 0.10 -3.63 0.92 4.01 -0.73 -4.99 117.16 108.26 1vr6 n TYR 177 Ca 0.07 0.03 -0.30 0.00 -0.16 0.00 0.00 57.90 57.54 1vr6 n TYR 177 Cb 0.02 -0.74 -0.04 0.00 -0.31 0.00 0.00 39.34 38.27 1vr6 n TYR 177 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1vr6 s ALA 178 N -3.10 3.78 0.02 -0.72 0.00 0.84 -4.76 121.76 117.81 1vr6 s ALA 178 Ca -0.08 -0.63 0.06 0.00 0.00 0.00 0.00 51.96 51.31 1vr6 s ALA 178 Cb 0.11 -2.12 -0.24 0.00 0.00 0.00 0.00 23.12 20.87 1vr6 s ALA 178 CO 0.87 0.54 0.90 -0.44 0.00 0.00 0.00 175.76 177.63 1vr6 h ASP 179 N 2.42 0.11 -3.35 0.00 3.32 -1.21 -3.46 116.42 114.24 1vr6 h ASP 179 Ca -0.47 -0.16 -0.50 0.00 0.02 0.00 0.00 57.03 55.92 1vr6 h ASP 179 Cb 1.18 -0.03 -0.35 0.00 0.22 0.00 0.00 39.33 40.35 1vr6 h ASP 179 CO 0.70 1.14 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.92 1vr6 s ILE 180 N -2.64 1.00 -0.27 0.35 1.01 -0.30 -4.03 121.20 116.33 1vr6 s ILE 180 Ca -0.04 -0.36 -0.18 0.00 0.00 0.00 0.00 60.65 60.07 1vr6 s ILE 180 Cb 0.08 -0.96 -0.02 0.00 0.01 0.00 0.00 42.46 41.57 1vr6 s ILE 180 CO 0.83 0.34 0.51 -0.63 0.00 0.00 0.00 174.94 175.99 1vr6 s ILE 181 N 1.02 5.06 -0.01 2.92 1.01 -0.17 -2.68 121.20 128.35 1vr6 s ILE 181 Ca -0.08 0.79 -0.16 0.00 0.00 0.00 0.00 60.65 61.20 1vr6 s ILE 181 Cb -0.15 -3.84 -0.06 0.00 0.01 0.00 0.00 42.46 38.43 1vr6 s ILE 181 CO -0.00 0.04 0.43 -1.58 0.00 0.00 0.00 174.94 173.83 1vr6 s GLN 182 N 2.32 4.01 -0.19 2.79 0.74 -0.38 -0.46 119.66 128.49 1vr6 s GLN 182 Ca 0.21 0.44 -0.00 0.00 0.05 0.00 0.00 55.36 56.06 1vr6 s GLN 182 Cb -0.16 -3.25 0.01 0.00 1.10 0.00 0.00 33.01 30.72 1vr6 s GLN 182 CO 0.10 0.61 -0.16 0.42 -0.55 0.00 0.00 175.29 175.71 1vr6 s ILE 183 N -0.85 2.36 0.64 -2.34 -1.09 0.18 -1.22 121.20 118.89 1vr6 s ILE 183 Ca 0.24 -0.85 -0.07 0.00 -2.23 0.00 0.00 60.65 57.74 1vr6 s ILE 183 Cb -0.17 -2.02 0.02 0.00 -1.58 0.00 0.00 42.46 38.71 1vr6 s ILE 183 CO 0.13 0.50 0.96 -0.83 -1.23 0.00 0.00 174.94 174.48 1vr6 s GLY 184 N 1.33 1.63 0.33 6.18 0.00 -1.26 -1.92 107.32 113.61 1vr6 s GLY 184 Ca 0.05 -0.69 0.05 0.00 0.00 0.00 0.00 44.72 44.14 1vr6 s GLY 184 CO -0.11 -0.36 1.87 0.00 0.00 0.00 0.00 173.10 174.51 1vr6 h ALA 185 N -0.37 1.69 -1.05 3.20 0.00 -1.82 0.10 119.26 121.02 1vr6 h ALA 185 Ca -0.45 0.01 0.28 0.00 0.00 0.00 0.00 54.91 54.75 1vr6 h ALA 185 Cb 1.27 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 1vr6 h ALA 185 CO 0.61 0.09 0.71 0.00 0.00 0.00 0.00 179.25 180.67 1vr6 h ARG 186 N 0.83 0.23 -0.51 0.00 2.47 -1.91 -1.29 114.38 114.20 1vr6 h ARG 186 Ca 0.44 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.15 1vr6 h ARG 186 Cb 0.54 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 1vr6 h ARG 186 CO -0.20 0.15 0.00 0.09 0.56 0.00 0.00 179.97 180.57 1vr6 n ASN 187 N -4.46 3.78 -0.30 7.04 3.02 0.34 -4.71 115.26 119.98 1vr6 n ASN 187 Ca 0.24 -2.24 0.23 0.00 -0.03 0.00 0.00 54.58 52.78 1vr6 n ASN 187 Cb 0.97 -0.42 0.43 0.00 -0.61 0.00 0.00 39.78 40.15 1vr6 n ASN 187 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vr6 n ALA 188 N 0.83 0.75 -2.33 5.41 0.00 -0.49 0.06 120.51 124.74 1vr6 n ALA 188 Ca 0.20 0.95 -0.25 0.00 0.00 0.00 0.00 53.44 54.34 1vr6 n ALA 188 Cb 0.65 -0.84 0.01 0.00 0.00 0.00 0.00 19.45 19.27 1vr6 n ALA 188 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1vr6 n GLN 189 N -5.17 3.37 -3.50 0.00 6.02 -1.26 -4.79 117.38 112.06 1vr6 n GLN 189 Ca 0.29 -4.32 -0.42 0.00 -0.01 0.00 0.00 57.00 52.54 1vr6 n GLN 189 Cb 0.98 -2.21 -0.05 0.00 1.02 0.00 0.00 30.24 29.98 1vr6 n GLN 189 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1vr6 s ASN 190 N -3.55 6.09 0.26 1.08 3.84 0.11 -4.97 114.94 117.80 1vr6 s ASN 190 Ca 0.48 -2.70 0.10 0.00 0.21 0.00 0.00 52.86 50.95 1vr6 s ASN 190 Cb 0.40 -2.06 0.31 0.00 -0.55 0.00 0.00 41.25 39.36 1vr6 s ASN 190 CO -0.10 -0.50 1.59 0.15 -2.79 0.00 0.00 177.10 175.45 1vr6 h PHE 191 N 7.54 0.00 -0.08 0.43 3.04 -1.91 -1.40 116.94 124.57 1vr6 h PHE 191 Ca 0.03 0.00 -0.18 0.00 3.98 0.00 0.00 57.97 61.80 1vr6 h PHE 191 Cb 1.01 0.00 0.01 0.00 2.56 0.00 0.00 35.95 39.53 1vr6 h PHE 191 CO 0.88 0.65 -0.66 0.00 -2.02 0.00 0.00 178.31 177.15 1vr6 h ARG 192 N 0.00 0.59 -0.80 1.11 3.08 -1.99 -2.33 114.38 114.04 1vr6 h ARG 192 Ca -0.01 -0.53 0.01 0.00 0.07 0.00 0.00 59.98 59.52 1vr6 h ARG 192 Cb 1.14 0.12 -0.04 0.00 0.08 0.00 0.00 29.97 31.28 1vr6 h ARG 192 CO 0.08 1.15 0.53 1.25 -1.07 0.00 0.00 179.97 181.91 1vr6 h LEU 193 N 0.21 0.92 -0.33 3.04 5.85 -1.92 -0.12 115.31 122.96 1vr6 h LEU 193 Ca -0.06 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1vr6 h LEU 193 Cb 1.32 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 1vr6 h LEU 193 CO 0.13 0.67 0.17 -0.07 -0.34 0.00 0.00 178.44 179.01 1vr6 h LEU 194 N 1.09 0.43 -0.13 2.25 3.38 -1.26 0.19 115.31 121.26 1vr6 h LEU 194 Ca 0.29 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1vr6 h LEU 194 Cb -0.12 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1vr6 h LEU 194 CO -0.06 0.41 0.07 0.77 0.09 0.00 0.00 178.44 179.72 1vr6 h SER 195 N 0.41 0.16 -0.87 -0.43 4.64 -1.22 -2.53 113.55 113.72 1vr6 h SER 195 Ca 0.12 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 1vr6 h SER 195 Cb 0.09 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 62.10 1vr6 h SER 195 CO -0.02 0.20 0.52 0.11 -0.87 0.00 0.00 176.83 176.77 1vr6 h LYS 196 N 0.11 1.19 -0.53 4.77 6.56 -0.88 -2.81 116.57 124.97 1vr6 h LYS 196 Ca 0.04 -0.11 -0.02 0.00 -1.06 0.00 0.00 60.65 59.50 1vr6 h LYS 196 Cb 0.07 -0.25 -0.02 0.00 -0.57 0.00 0.00 32.23 31.46 1vr6 h LYS 196 CO -0.01 0.83 0.24 0.00 -2.06 0.00 0.00 179.45 178.45 1vr6 h ALA 197 N 1.37 0.69 0.00 3.86 0.00 -0.84 -2.66 119.26 121.69 1vr6 h ALA 197 Ca 0.31 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1vr6 h ALA 197 Cb -0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1vr6 h ALA 197 CO -0.06 0.27 -0.20 0.78 0.00 0.00 0.00 179.25 180.05 1vr6 h GLY 198 N 0.72 0.00 2.00 0.00 0.00 -1.25 -3.11 103.07 101.43 1vr6 h GLY 198 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 1vr6 h GLY 198 CO -0.02 0.00 -0.03 1.48 0.00 0.00 0.00 176.54 177.97 1vr6 h SER 199 N 0.00 0.00 0.54 0.19 4.64 -1.22 -1.81 113.55 115.88 1vr6 h SER 199 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vr6 h SER 199 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1vr6 h SER 199 CO 0.03 0.03 0.00 -1.22 -0.87 0.00 0.00 176.83 174.80 1vr6 n TYR 200 N -3.22 0.00 -3.20 4.77 4.01 -1.18 -4.88 117.16 113.46 1vr6 n TYR 200 Ca -0.01 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.50 1vr6 n TYR 200 Cb 0.20 -0.44 0.02 0.00 -0.31 0.00 0.00 39.34 38.81 1vr6 n TYR 200 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1vr6 n ASN 201 N -1.44 -4.88 -4.81 7.72 2.85 -0.68 -5.01 115.26 109.01 1vr6 n ASN 201 Ca 0.06 -0.34 -0.22 0.00 -0.11 0.00 0.00 54.58 53.97 1vr6 n ASN 201 Cb 0.19 -3.98 -0.05 0.00 1.24 0.00 0.00 39.78 37.19 1vr6 n ASN 201 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1vr6 s LYS 202 N -5.86 2.87 0.45 1.20 1.02 -1.26 -5.09 119.74 113.08 1vr6 s LYS 202 Ca 0.35 -1.09 -0.25 0.00 0.02 0.00 0.00 55.97 55.00 1vr6 s LYS 202 Cb -0.17 -2.53 -0.08 0.00 -0.52 0.00 0.00 37.83 34.52 1vr6 s LYS 202 CO 0.43 0.39 1.42 -2.14 -0.92 0.00 0.00 175.35 174.53 1vr6 s PRO 203 N -3.84 3.67 -0.08 -1.68 0.02 -1.26 -4.85 135.00 126.99 1vr6 s PRO 203 Ca 0.33 2.41 0.05 0.00 0.02 0.00 0.00 61.00 63.81 1vr6 s PRO 203 Cb -0.08 -2.64 -0.01 0.00 0.02 0.00 0.00 34.50 31.79 1vr6 s PRO 203 CO 0.25 -0.83 -0.22 0.08 -0.33 0.00 0.00 177.00 175.95 1vr6 s VAL 204 N -1.21 2.27 -0.27 3.83 1.01 -0.36 -1.00 120.40 124.67 1vr6 s VAL 204 Ca 0.61 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 61.54 1vr6 s VAL 204 Cb -0.44 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 1vr6 s VAL 204 CO 0.56 0.56 0.09 -0.22 0.00 0.00 0.00 175.10 176.09 1vr6 s LEU 205 N -0.01 3.69 -0.28 3.92 0.20 0.40 0.13 118.68 126.73 1vr6 s LEU 205 Ca -0.08 -0.39 -0.06 0.00 0.69 0.00 0.00 54.13 54.29 1vr6 s LEU 205 Cb -0.15 -1.93 0.01 0.00 -0.43 0.00 0.00 46.19 43.69 1vr6 s LEU 205 CO 0.05 -0.11 0.05 -0.22 -0.29 0.00 0.00 176.35 175.84 1vr6 s LEU 206 N 1.59 3.69 0.06 -0.68 2.96 0.78 -0.64 118.68 126.44 1vr6 s LEU 206 Ca 0.05 -0.69 -0.22 0.00 -0.22 0.00 0.00 54.13 53.05 1vr6 s LEU 206 Cb -0.16 -1.85 -0.06 0.00 0.50 0.00 0.00 46.19 44.62 1vr6 s LEU 206 CO 0.04 -0.17 0.65 -0.54 -1.32 0.00 0.00 176.35 175.02 1vr6 s LYS 207 N 1.48 4.37 0.25 1.98 1.02 -0.81 -1.15 119.74 126.88 1vr6 s LYS 207 Ca 0.03 0.88 -0.30 0.00 0.02 0.00 0.00 55.97 56.60 1vr6 s LYS 207 Cb -0.17 -3.30 -0.10 0.00 -0.52 0.00 0.00 37.83 33.74 1vr6 s LYS 207 CO 0.01 0.47 1.40 0.50 -0.92 0.00 0.00 175.35 176.82 1vr6 s ARG 208 N -0.62 4.29 0.43 1.68 3.52 -0.33 -4.27 118.95 123.65 1vr6 s ARG 208 Ca 0.33 2.26 -0.25 0.00 -0.13 0.00 0.00 55.73 57.93 1vr6 s ARG 208 Cb -0.20 -3.12 -0.08 0.00 -1.56 0.00 0.00 34.95 29.99 1vr6 s ARG 208 CO 0.21 -0.37 1.29 0.20 -0.81 0.00 0.00 175.30 175.82 1vr6 s GLY 209 N 0.25 2.90 0.10 8.12 0.00 -1.26 -4.63 107.32 112.79 1vr6 s GLY 209 Ca 0.58 1.20 0.16 0.00 0.00 0.00 0.00 44.72 46.66 1vr6 s GLY 209 CO 0.44 1.76 1.50 1.97 0.00 0.00 0.00 173.10 178.78 1vr6 n PHE 210 N -0.09 0.30 0.00 1.90 1.16 -1.26 -2.03 117.46 117.44 1vr6 n PHE 210 Ca 0.05 0.12 0.07 0.00 -1.87 0.00 0.00 57.45 55.82 1vr6 n PHE 210 Cb 0.44 -0.70 0.15 0.00 -1.61 0.00 0.00 39.48 37.76 1vr6 n PHE 210 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1vr6 n MET 211 N -1.78 2.30 -4.41 3.97 0.00 -1.26 -0.42 117.12 115.53 1vr6 n MET 211 Ca 0.02 -1.92 -0.35 0.00 0.00 0.00 0.00 57.70 55.45 1vr6 n MET 211 Cb 0.16 -1.31 -0.10 0.00 0.00 0.00 0.00 33.22 31.98 1vr6 n MET 211 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 1vr6 s ASN 212 N -1.03 5.14 0.82 3.17 0.01 -0.86 -5.06 114.94 117.12 1vr6 s ASN 212 Ca 0.24 0.11 -0.11 0.00 -0.71 0.00 0.00 52.86 52.39 1vr6 s ASN 212 Cb 0.14 -1.42 0.09 0.00 0.41 0.00 0.00 41.25 40.47 1vr6 s ASN 212 CO 0.18 0.37 1.09 0.42 -1.51 0.00 0.00 177.10 177.65 1vr6 s THR 213 N -0.89 3.05 0.25 1.60 -4.23 -1.26 -4.83 115.64 109.33 1vr6 s THR 213 Ca 0.14 0.34 -0.05 0.00 -1.18 0.00 0.00 61.69 60.94 1vr6 s THR 213 Cb -0.11 -2.82 0.23 0.00 1.34 0.00 0.00 72.50 71.14 1vr6 s THR 213 CO 0.03 -0.45 1.87 0.40 -0.54 0.00 0.00 174.62 175.93 1vr6 h ILE 214 N -1.30 1.09 -0.59 2.99 2.04 -1.99 -0.25 117.51 119.49 1vr6 h ILE 214 Ca -0.46 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1vr6 h ILE 214 Cb 1.25 -0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1vr6 h ILE 214 CO 0.52 0.20 0.38 -0.08 0.00 0.00 0.00 178.15 179.17 1vr6 h GLU 215 N 1.08 0.79 -0.64 2.37 4.81 -1.99 -1.03 114.58 119.97 1vr6 h GLU 215 Ca 0.39 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.53 1vr6 h GLU 215 Cb 0.12 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 1vr6 h GLU 215 CO -0.16 0.54 0.30 0.93 -0.73 0.00 0.00 179.01 179.89 1vr6 h GLU 216 N 0.80 0.93 -0.26 1.92 5.08 -1.80 -1.29 114.58 119.95 1vr6 h GLU 216 Ca 0.21 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1vr6 h GLU 216 Cb -0.06 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.01 1vr6 h GLU 216 CO -0.04 0.75 0.14 0.35 -1.00 0.00 0.00 179.01 179.21 1vr6 h PHE 217 N 0.88 0.27 -0.17 4.33 3.57 -0.75 -1.44 116.94 123.63 1vr6 h PHE 217 Ca 0.22 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.65 1vr6 h PHE 217 Cb 0.14 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1vr6 h PHE 217 CO 0.00 0.16 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.93 1vr6 h LEU 218 N 0.30 0.30 -0.57 0.59 3.38 -1.11 -1.76 115.31 116.44 1vr6 h LEU 218 Ca 0.11 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1vr6 h LEU 218 Cb 0.01 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1vr6 h LEU 218 CO -0.06 0.55 0.07 0.25 0.09 0.00 0.00 178.44 179.34 1vr6 h LEU 219 N 0.28 0.92 -0.43 1.67 5.85 -0.82 -0.32 115.31 122.46 1vr6 h LEU 219 Ca 0.05 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.54 1vr6 h LEU 219 Cb 0.58 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 1vr6 h LEU 219 CO 0.04 0.96 0.16 0.28 -0.34 0.00 0.00 178.44 179.54 1vr6 h SER 220 N 0.84 0.17 -0.71 1.25 0.02 -0.91 -2.08 113.55 112.13 1vr6 h SER 220 Ca 0.17 0.05 0.07 0.00 -0.84 0.00 0.00 61.79 61.24 1vr6 h SER 220 Cb 0.45 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.95 1vr6 h SER 220 CO 0.02 0.13 0.40 0.00 -1.14 0.00 0.00 176.83 176.23 1vr6 h ALA 221 N 1.27 0.97 -0.86 3.77 0.00 -1.04 -1.88 119.26 121.50 1vr6 h ALA 221 Ca 0.20 0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.24 1vr6 h ALA 221 Cb 0.18 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 1vr6 h ALA 221 CO -0.20 0.06 0.56 1.49 0.00 0.00 0.00 179.25 181.16 1vr6 h GLU 222 N 0.71 0.75 -0.42 0.00 4.57 -0.62 -0.71 114.58 118.86 1vr6 h GLU 222 Ca 0.33 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.39 1vr6 h GLU 222 Cb 0.24 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 1vr6 h GLU 222 CO -0.21 0.49 -0.03 1.88 -1.18 0.00 0.00 179.01 179.97 1vr6 h TYR 223 N 0.77 0.74 0.17 0.92 0.05 -0.67 0.97 116.97 119.92 1vr6 h TYR 223 Ca 0.41 -0.10 -0.01 0.00 0.05 0.00 0.00 58.73 59.08 1vr6 h TYR 223 Cb 0.53 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1vr6 h TYR 223 CO -0.00 0.71 -0.08 0.82 -1.05 0.00 0.00 178.16 178.56 1vr6 h ILE 224 N 0.65 0.85 -0.64 -2.88 2.04 -1.08 -3.18 117.51 113.28 1vr6 h ILE 224 Ca 0.13 -0.09 0.08 0.00 1.00 0.00 0.00 64.86 65.98 1vr6 h ILE 224 Cb 0.45 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.40 1vr6 h ILE 224 CO 0.02 0.02 0.42 0.00 0.00 0.00 0.00 178.15 178.61 1vr6 h ALA 225 N 0.56 1.89 -0.50 1.87 0.00 -0.77 -0.37 119.26 121.93 1vr6 h ALA 225 Ca -0.02 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.02 1vr6 h ALA 225 Cb 0.21 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1vr6 h ALA 225 CO 0.04 -0.02 0.40 -0.91 0.00 0.00 0.00 179.25 178.76 1vr6 h ASN 226 N 0.54 0.00 -0.24 0.00 2.35 -0.79 0.23 115.58 117.67 1vr6 h ASN 226 Ca 0.29 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 56.11 1vr6 h ASN 226 Cb 0.42 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1vr6 h ASN 226 CO -0.09 0.00 0.44 0.28 -1.65 0.00 0.00 177.43 176.41 1vr6 h SER 227 N 0.00 0.00 0.00 5.81 0.02 -1.15 -3.46 113.55 114.78 1vr6 h SER 227 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1vr6 h SER 227 Cb 1.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.57 1vr6 h SER 227 CO -0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1vr6 n GLY 228 N -1.38 0.74 3.39 -3.77 0.00 0.81 -4.81 105.19 100.17 1vr6 n GLY 228 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1vr6 n GLY 228 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1vr6 s ASN 229 N -3.00 5.48 -0.12 1.61 3.84 -1.24 -4.93 114.94 116.57 1vr6 s ASN 229 Ca 0.00 -0.70 0.15 0.00 0.21 0.00 0.00 52.86 52.51 1vr6 s ASN 229 Cb 0.00 -1.97 0.43 0.00 -0.55 0.00 0.00 41.25 39.16 1vr6 s ASN 229 CO 0.00 -0.24 1.34 1.07 -2.79 0.00 0.00 177.10 176.48 1vr6 n THR 230 N 4.95 1.87 -1.43 -5.21 5.66 -1.26 -3.52 114.28 115.34 1vr6 n THR 230 Ca -0.13 -1.64 -0.39 0.00 -3.05 0.00 0.00 64.05 58.83 1vr6 n THR 230 Cb 0.48 -0.03 -0.02 0.00 -1.55 0.00 0.00 70.33 69.21 1vr6 n THR 230 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1vr6 n LYS 231 N -0.31 3.26 -4.45 1.09 5.02 -1.26 -4.92 118.16 116.60 1vr6 n LYS 231 Ca 0.18 -2.30 -0.34 0.00 -2.02 0.00 0.00 58.31 53.83 1vr6 n LYS 231 Cb 0.73 -2.97 -0.12 0.00 -0.02 0.00 0.00 35.03 32.65 1vr6 n LYS 231 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1vr6 s ILE 232 N 2.68 3.82 -0.23 -0.18 1.01 -1.26 -1.22 121.20 125.82 1vr6 s ILE 232 Ca 0.60 -0.39 -0.05 0.00 0.00 0.00 0.00 60.65 60.81 1vr6 s ILE 232 Cb 0.16 -2.66 -0.01 0.00 0.01 0.00 0.00 42.46 39.96 1vr6 s ILE 232 CO -0.06 0.51 -0.01 -0.63 0.00 0.00 0.00 174.94 174.74 1vr6 s ILE 233 N 0.26 3.61 0.24 2.92 1.01 0.12 -4.08 121.20 125.27 1vr6 s ILE 233 Ca -0.03 -0.41 -0.17 0.00 0.00 0.00 0.00 60.65 60.04 1vr6 s ILE 233 Cb -0.14 -2.66 -0.08 0.00 0.01 0.00 0.00 42.46 39.59 1vr6 s ILE 233 CO 0.03 0.40 0.69 -0.76 0.00 0.00 0.00 174.94 175.30 1vr6 s LEU 234 N 1.51 4.25 -0.12 2.97 1.43 0.08 -0.15 118.68 128.65 1vr6 s LEU 234 Ca 0.06 1.29 -0.02 0.00 -1.03 0.00 0.00 54.13 54.42 1vr6 s LEU 234 Cb -0.14 -3.68 0.04 0.00 0.03 0.00 0.00 46.19 42.44 1vr6 s LEU 234 CO -0.02 -0.03 0.02 0.00 0.23 0.00 0.00 176.35 176.56 1vr6 s GLU 236 N 1.96 4.52 -0.02 0.00 2.56 0.28 -1.18 118.70 126.82 1vr6 s GLU 236 Ca 0.03 1.58 0.02 0.00 0.00 0.00 0.00 54.97 56.61 1vr6 s GLU 236 Cb -0.14 -3.40 0.04 0.00 2.00 0.00 0.00 34.13 32.63 1vr6 s GLU 236 CO -0.06 -0.11 1.00 2.89 -0.56 0.00 0.00 175.26 178.41 1vr6 n ARG 237 N 3.75 0.19 0.00 4.30 -4.01 -1.26 -0.44 116.66 119.18 1vr6 n ARG 237 Ca 0.07 -1.19 0.00 0.00 -1.04 0.00 0.00 57.85 55.69 1vr6 n ARG 237 Cb 0.49 -0.63 0.00 0.00 -3.04 0.00 0.00 32.46 29.27 1vr6 n ARG 237 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1vr6 n GLY 238 N -0.19 0.10 3.40 2.89 0.00 -1.26 -3.44 105.19 106.69 1vr6 n GLY 238 Ca 0.02 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.13 1vr6 n GLY 238 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vr6 s ILE 239 N -2.97 1.87 -0.09 -0.61 -4.36 -0.03 -4.38 121.20 110.64 1vr6 s ILE 239 Ca 0.00 -2.23 -0.27 0.00 -0.26 0.00 0.00 60.65 57.89 1vr6 s ILE 239 Cb 0.00 -2.22 -0.02 0.00 1.25 0.00 0.00 42.46 41.47 1vr6 s ILE 239 CO 0.00 -0.47 0.87 -0.60 0.24 0.00 0.00 174.94 174.98 1vr6 s ARG 240 N -3.64 4.42 0.29 0.37 3.52 0.44 -0.96 118.95 123.39 1vr6 s ARG 240 Ca 0.26 1.16 0.06 0.00 -0.13 0.00 0.00 55.73 57.08 1vr6 s ARG 240 Cb -0.00 -3.51 -0.02 0.00 -1.56 0.00 0.00 34.95 29.86 1vr6 s ARG 240 CO 0.10 -0.16 0.21 0.25 -0.81 0.00 0.00 175.30 174.89 1vr6 n THR 241 N 4.26 0.00 0.53 4.11 -2.24 -1.26 -4.97 114.28 114.71 1vr6 n THR 241 Ca 0.04 -2.00 0.07 0.00 -2.27 0.00 0.00 64.05 59.90 1vr6 n THR 241 Cb 0.50 0.95 0.32 0.00 -2.10 0.00 0.00 70.33 70.00 1vr6 n THR 241 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 1vr6 n PHE 242 N -0.57 0.00 -2.53 4.78 1.16 -1.26 -4.80 117.46 114.24 1vr6 n PHE 242 Ca 0.04 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.19 1vr6 n PHE 242 Cb 0.50 -0.47 -0.02 0.00 -1.61 0.00 0.00 39.48 37.87 1vr6 n PHE 242 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 1vr6 s GLU 243 N -2.95 3.84 0.00 3.97 2.56 -1.26 -4.94 118.70 119.93 1vr6 s GLU 243 Ca 0.08 0.92 0.26 0.00 0.00 0.00 0.00 54.97 56.23 1vr6 s GLU 243 Cb 0.10 -3.87 0.66 0.00 2.00 0.00 0.00 34.13 33.02 1vr6 s GLU 243 CO 0.26 -1.22 1.52 1.63 -0.56 0.00 0.00 175.26 176.89 1vr6 n LYS 244 N 7.49 1.49 0.21 4.30 4.76 -1.26 -4.05 118.16 131.09 1vr6 n LYS 244 Ca 0.13 -1.02 0.15 0.00 -2.87 0.00 0.00 58.31 54.71 1vr6 n LYS 244 Cb 0.48 -1.48 0.65 0.00 -1.84 0.00 0.00 35.03 32.84 1vr6 n LYS 244 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1vr6 h ALA 245 N 4.17 1.00 -2.36 7.82 0.00 -1.98 -3.44 119.26 124.47 1vr6 h ALA 245 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 1vr6 h ALA 245 Cb 0.63 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.27 1vr6 h ALA 245 CO 0.00 0.00 -0.72 0.95 0.00 0.00 0.00 179.25 179.48 1vr6 s THR 246 N -3.56 1.22 0.04 0.00 -4.23 -1.26 -5.04 115.64 102.81 1vr6 s THR 246 Ca 0.01 -1.99 -0.21 0.00 -1.18 0.00 0.00 61.69 58.32 1vr6 s THR 246 Cb 0.09 -1.77 -0.14 0.00 1.34 0.00 0.00 72.50 72.02 1vr6 s THR 246 CO 0.42 -0.67 1.39 -0.09 -0.54 0.00 0.00 174.62 175.13 1vr6 h ARG 247 N 2.93 0.28 -4.90 3.99 2.43 -1.53 -3.45 114.38 114.13 1vr6 h ARG 247 Ca -0.37 -0.12 -0.35 0.00 -0.81 0.00 0.00 59.98 58.33 1vr6 h ARG 247 Cb 1.19 -0.01 -0.14 0.00 -0.42 0.00 0.00 29.97 30.59 1vr6 h ARG 247 CO 0.61 0.62 -0.63 -0.80 -1.51 0.00 0.00 179.97 178.26 1vr6 s ASN 248 N -5.94 1.30 -0.39 -3.80 0.01 -0.07 -4.90 114.94 101.17 1vr6 s ASN 248 Ca -0.14 -1.33 -0.14 0.00 -0.71 0.00 0.00 52.86 50.53 1vr6 s ASN 248 Cb 0.05 0.13 0.01 0.00 0.41 0.00 0.00 41.25 41.85 1vr6 s ASN 248 CO 0.73 -0.68 0.27 -0.89 -1.51 0.00 0.00 177.10 175.02 1vr6 s THR 249 N -3.69 5.16 0.21 1.60 2.01 -0.14 -4.23 115.64 116.57 1vr6 s THR 249 Ca 0.35 -0.58 -0.31 0.00 0.31 0.00 0.00 61.69 61.45 1vr6 s THR 249 Cb 0.07 -3.82 -0.11 0.00 0.01 0.00 0.00 72.50 68.65 1vr6 s THR 249 CO 0.12 -0.22 1.64 -0.22 -0.69 0.00 0.00 174.62 175.24 1vr6 s LEU 250 N 1.67 4.37 -0.99 4.42 2.96 -1.26 -0.85 118.68 129.00 1vr6 s LEU 250 Ca 0.05 2.80 -0.09 0.00 -0.22 0.00 0.00 54.13 56.67 1vr6 s LEU 250 Cb -0.19 -3.61 0.25 0.00 0.50 0.00 0.00 46.19 43.15 1vr6 s LEU 250 CO 0.10 -0.90 0.95 -0.62 -1.32 0.00 0.00 176.35 174.56 1vr6 s ASP 251 N 0.98 6.91 0.38 3.68 2.15 -1.26 -4.87 116.67 124.64 1vr6 s ASP 251 Ca 0.70 -3.36 0.17 0.00 0.43 0.00 0.00 52.55 50.49 1vr6 s ASP 251 Cb -0.47 -2.15 0.77 0.00 -0.30 0.00 0.00 42.92 40.77 1vr6 s ASP 251 CO 0.36 -0.34 1.81 -0.29 -0.17 0.00 0.00 175.17 176.53 1vr6 h ILE 252 N 4.07 1.05 0.00 4.11 6.09 -2.02 -1.83 117.51 128.98 1vr6 h ILE 252 Ca 0.15 -1.35 -0.01 0.00 -1.37 0.00 0.00 64.86 62.28 1vr6 h ILE 252 Cb 0.91 1.77 -0.00 0.00 0.47 0.00 0.00 36.82 39.97 1vr6 h ILE 252 CO 0.91 0.36 -0.06 0.77 -3.07 0.00 0.00 178.15 177.06 1vr6 h SER 253 N 0.00 0.00 0.00 2.19 4.64 -2.01 -2.41 113.55 115.96 1vr6 h SER 253 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 1vr6 h SER 253 Cb 0.74 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1vr6 h SER 253 CO 0.05 0.06 -0.14 0.00 -0.87 0.00 0.00 176.83 175.93 1vr6 h ALA 254 N 1.94 1.45 0.36 5.18 0.00 -1.75 -2.58 119.26 123.86 1vr6 h ALA 254 Ca -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1vr6 h ALA 254 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1vr6 h ALA 254 CO 0.01 0.39 -0.29 0.28 0.00 0.00 0.00 179.25 179.63 1vr6 h VAL 255 N 0.26 0.00 -0.09 0.00 2.07 -1.59 0.28 116.25 117.18 1vr6 h VAL 255 Ca 0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.53 1vr6 h VAL 255 Cb 0.41 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1vr6 h VAL 255 CO 0.02 0.00 -0.15 1.55 0.02 0.00 0.00 177.57 179.01 1vr6 h PRO 256 N -0.64 0.14 0.03 1.57 0.13 -1.73 -0.37 132.00 131.14 1vr6 h PRO 256 Ca -0.05 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 65.07 1vr6 h PRO 256 Cb 0.53 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.62 1vr6 h PRO 256 CO 0.00 0.30 -0.10 0.82 -0.23 0.00 0.00 178.00 178.79 1vr6 h ILE 257 N 0.13 0.75 -0.66 -3.56 2.04 -1.32 -2.47 117.51 112.42 1vr6 h ILE 257 Ca 0.03 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 1vr6 h ILE 257 Cb 0.35 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1vr6 h ILE 257 CO 0.02 0.00 0.30 0.40 0.00 0.00 0.00 178.15 178.87 1vr6 h ILE 258 N -0.19 1.23 -0.74 -0.67 2.04 -0.66 -0.04 117.51 118.48 1vr6 h ILE 258 Ca 0.03 -0.68 0.09 0.00 1.00 0.00 0.00 64.86 65.29 1vr6 h ILE 258 Cb 0.22 0.45 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 1vr6 h ILE 258 CO -0.08 0.28 0.49 0.03 0.00 0.00 0.00 178.15 178.87 1vr6 h ARG 259 N 0.93 0.67 0.02 2.37 3.08 -0.95 0.13 114.38 120.63 1vr6 h ARG 259 Ca 0.22 -0.04 -0.14 0.00 0.07 0.00 0.00 59.98 60.10 1vr6 h ARG 259 Cb 0.16 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.07 1vr6 h ARG 259 CO -0.02 0.45 -0.55 -0.22 -1.07 0.00 0.00 179.97 178.55 1vr6 h LYS 260 N 0.69 0.33 -0.06 0.04 3.64 -1.05 -3.38 116.57 116.79 1vr6 h LYS 260 Ca 0.34 -0.39 -0.18 0.00 -1.27 0.00 0.00 60.65 59.15 1vr6 h LYS 260 Cb 0.40 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 1vr6 h LYS 260 CO -0.12 1.09 -0.73 0.93 -2.27 0.00 0.00 179.45 178.35 1vr6 h GLU 261 N -0.25 0.32 -6.44 1.90 4.39 -0.71 -3.43 114.58 110.35 1vr6 h GLU 261 Ca -0.07 -0.27 -0.63 0.00 0.34 0.00 0.00 59.36 58.72 1vr6 h GLU 261 Cb 1.29 0.06 -0.17 0.00 -0.10 0.00 0.00 28.75 29.83 1vr6 h GLU 261 CO 0.11 0.92 -0.80 0.45 -1.16 0.00 0.00 179.01 178.53 1vr6 s SER 262 N -6.95 3.44 0.00 1.42 0.15 0.42 -0.72 113.70 111.46 1vr6 s SER 262 Ca -0.05 -0.92 0.26 0.00 0.70 0.00 0.00 55.95 55.95 1vr6 s SER 262 Cb 0.11 -0.26 0.75 0.00 -1.71 0.00 0.00 66.02 64.91 1vr6 s SER 262 CO 0.83 0.08 1.57 0.00 1.20 0.00 0.00 173.24 176.92 1vr6 n HIS 263 N -0.03 0.00 -2.90 3.44 1.44 -1.23 -4.49 115.22 111.46 1vr6 n HIS 263 Ca -0.10 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.25 1vr6 n HIS 263 Cb 0.57 -0.05 -0.06 0.00 0.12 0.00 0.00 29.99 30.57 1vr6 n HIS 263 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1vr6 s LEU 264 N -2.24 4.32 0.46 2.39 1.43 -1.26 -0.72 118.68 123.05 1vr6 s LEU 264 Ca 0.30 1.68 -0.24 0.00 -1.03 0.00 0.00 54.13 54.83 1vr6 s LEU 264 Cb 0.20 -3.89 -0.07 0.00 0.03 0.00 0.00 46.19 42.45 1vr6 s LEU 264 CO 0.43 -0.05 1.33 -2.84 0.23 0.00 0.00 176.35 175.45 1vr6 s PRO 265 N -2.09 3.63 -0.17 1.29 0.02 -1.26 -4.84 135.00 131.58 1vr6 s PRO 265 Ca 0.48 2.19 -0.00 0.00 0.02 0.00 0.00 61.00 63.69 1vr6 s PRO 265 Cb -0.17 -2.54 0.04 0.00 0.02 0.00 0.00 34.50 31.85 1vr6 s PRO 265 CO 0.22 -0.78 -0.07 -1.50 -0.33 0.00 0.00 177.00 174.54 1vr6 s ILE 266 N -1.30 1.21 0.32 2.83 1.10 -1.26 -0.74 121.20 123.36 1vr6 s ILE 266 Ca 0.63 -0.67 0.06 0.00 -0.51 0.00 0.00 60.65 60.17 1vr6 s ILE 266 Cb -0.39 -1.35 -0.01 0.00 0.15 0.00 0.00 42.46 40.86 1vr6 s ILE 266 CO 0.49 0.17 0.44 -0.76 -2.11 0.00 0.00 174.94 173.16 1vr6 s LEU 267 N 1.59 4.01 -0.06 8.50 1.43 0.19 -0.33 118.68 134.02 1vr6 s LEU 267 Ca 0.01 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 52.99 1vr6 s LEU 267 Cb -0.15 -2.74 -0.02 0.00 0.03 0.00 0.00 46.19 43.31 1vr6 s LEU 267 CO -0.08 -0.36 -0.17 -0.69 0.23 0.00 0.00 176.35 175.28 1vr6 s VAL 268 N -2.15 2.83 -0.54 -1.59 1.01 -0.67 -0.55 120.40 118.74 1vr6 s VAL 268 Ca 0.43 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 61.45 1vr6 s VAL 268 Cb -0.09 -2.10 0.13 0.00 0.00 0.00 0.00 36.38 34.32 1vr6 s VAL 268 CO 0.30 0.58 0.52 -0.62 0.00 0.00 0.00 175.10 175.88 1vr6 s ASP 269 N -0.51 6.19 0.20 3.32 -1.08 0.41 -1.80 116.67 123.40 1vr6 s ASP 269 Ca 0.07 -1.74 0.26 0.00 -0.52 0.00 0.00 52.55 50.62 1vr6 s ASP 269 Cb -0.12 -2.22 0.84 0.00 -1.46 0.00 0.00 42.92 39.96 1vr6 s ASP 269 CO 0.01 -0.88 1.78 -0.81 0.52 0.00 0.00 175.17 175.79 1vr6 n PRO 270 N 5.37 0.25 -0.07 4.34 -0.04 -1.26 -3.08 135.00 140.51 1vr6 n PRO 270 Ca -0.13 0.21 -0.12 0.00 -0.04 0.00 0.00 63.50 63.42 1vr6 n PRO 270 Cb 0.40 -1.79 -0.10 0.00 -0.04 0.00 0.00 33.50 31.97 1vr6 n PRO 270 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1vr6 h SER 271 N 0.00 0.00 0.91 3.54 0.02 -1.90 -3.36 113.55 112.76 1vr6 h SER 271 Ca 0.00 -0.75 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 1vr6 h SER 271 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1vr6 h SER 271 CO 0.00 0.96 -0.52 1.41 -1.14 0.00 0.00 176.83 177.54 1vr6 n HIS 272 N -4.62 0.54 0.01 3.45 8.25 -1.25 -1.91 115.22 119.68 1vr6 n HIS 272 Ca -0.11 0.16 -0.01 0.00 -0.26 0.00 0.00 57.72 57.50 1vr6 n HIS 272 Cb 0.41 -0.65 -0.00 0.00 1.12 0.00 0.00 29.99 30.87 1vr6 n HIS 272 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1vr6 h SER 273 N 0.00 -0.03 -0.86 0.41 4.64 -1.56 -3.36 113.55 112.79 1vr6 h SER 273 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.35 1vr6 h SER 273 Cb 0.71 0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.77 1vr6 h SER 273 CO 0.00 -0.00 0.57 1.23 -0.87 0.00 0.00 176.83 177.75 1vr6 h GLY 274 N -0.08 1.21 -1.03 -0.77 0.00 -1.73 -0.14 103.07 100.53 1vr6 h GLY 274 Ca -0.00 -0.43 -0.31 0.00 0.00 0.00 0.00 47.33 46.59 1vr6 h GLY 274 CO 0.01 0.39 -0.30 0.61 0.00 0.00 0.00 176.54 177.25 1vr6 n GLY 275 N -1.40 1.14 2.80 4.60 0.00 -0.80 -2.27 105.19 109.26 1vr6 n GLY 275 Ca 0.11 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 1vr6 n GLY 275 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vr6 s ARG 276 N -3.60 -0.01 0.28 1.61 0.52 -1.26 -4.51 118.95 111.98 1vr6 s ARG 276 Ca 0.00 0.23 0.01 0.00 -0.52 0.00 0.00 55.73 55.45 1vr6 s ARG 276 Cb 0.00 -0.24 0.59 0.00 0.52 0.00 0.00 34.95 35.82 1vr6 s ARG 276 CO 0.00 -0.17 1.77 -0.09 0.02 0.00 0.00 175.30 176.83 1vr6 h ARG 277 N 7.31 0.66 0.00 3.54 2.43 -1.74 -1.53 114.38 125.04 1vr6 h ARG 277 Ca -0.45 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1vr6 h ARG 277 Cb 1.12 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1vr6 h ARG 277 CO 0.46 0.44 0.00 -0.40 -1.51 0.00 0.00 179.97 178.96 1vr6 n ASP 278 N -4.83 0.00 0.00 -3.80 5.75 -1.26 -2.59 116.55 109.82 1vr6 n ASP 278 Ca 0.19 0.41 0.10 0.00 -0.01 0.00 0.00 54.79 55.48 1vr6 n ASP 278 Cb 0.47 -0.46 -0.05 0.00 -1.03 0.00 0.00 41.12 40.04 1vr6 n ASP 278 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1vr6 n LEU 279 N -1.46 0.89 -0.04 -2.12 4.77 -0.58 -4.60 117.00 113.85 1vr6 n LEU 279 Ca 0.06 -0.39 -0.10 0.00 -0.03 0.00 0.00 56.01 55.54 1vr6 n LEU 279 Cb 0.23 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.23 1vr6 n LEU 279 CO 0.18 0.22 0.91 0.58 -1.33 0.00 0.00 177.39 177.95 1vr6 h VAL 280 N 0.00 1.10 -0.08 4.08 2.07 -1.49 -0.74 116.25 121.18 1vr6 h VAL 280 Ca 0.00 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1vr6 h VAL 280 Cb 0.51 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1vr6 h VAL 280 CO 0.00 0.09 -0.19 0.40 0.02 0.00 0.00 177.57 177.89 1vr6 h ILE 281 N 0.21 1.41 -0.58 4.57 2.04 -1.81 -0.56 117.51 122.78 1vr6 h ILE 281 Ca 0.07 -1.51 0.07 0.00 1.00 0.00 0.00 64.86 64.49 1vr6 h ILE 281 Cb 0.05 2.19 -0.06 0.00 -0.74 0.00 0.00 36.82 38.26 1vr6 h ILE 281 CO -0.01 0.43 0.27 -0.65 0.00 0.00 0.00 178.15 178.19 1vr6 h PRO 282 N -0.20 0.49 -0.32 2.37 0.11 -1.80 -1.32 132.00 131.34 1vr6 h PRO 282 Ca -0.00 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 1vr6 h PRO 282 Cb 0.78 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.77 1vr6 h PRO 282 CO 0.04 0.32 -0.06 -0.07 -0.21 0.00 0.00 178.00 178.03 1vr6 h LEU 283 N 0.51 0.48 -0.82 2.35 3.38 -1.12 -1.68 115.31 118.40 1vr6 h LEU 283 Ca 0.27 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1vr6 h LEU 283 Cb 0.24 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1vr6 h LEU 283 CO -0.22 0.59 0.24 0.28 0.09 0.00 0.00 178.44 179.42 1vr6 h SER 284 N 0.48 1.04 -0.19 -0.43 0.02 -0.58 -0.54 113.55 113.35 1vr6 h SER 284 Ca 0.10 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1vr6 h SER 284 Cb 0.40 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1vr6 h SER 284 CO 0.02 0.96 0.11 0.03 -1.14 0.00 0.00 176.83 176.81 1vr6 h ARG 285 N 1.07 0.26 -0.72 3.45 3.08 -0.87 -1.43 114.38 119.22 1vr6 h ARG 285 Ca 0.24 -0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.37 1vr6 h ARG 285 Cb 0.28 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.20 1vr6 h ARG 285 CO -0.01 0.23 0.33 0.00 -1.07 0.00 0.00 179.97 179.45 1vr6 h ALA 286 N 1.02 0.99 0.25 0.04 0.00 -1.15 -1.42 119.26 118.99 1vr6 h ALA 286 Ca 0.07 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1vr6 h ALA 286 Cb 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1vr6 h ALA 286 CO -0.01 -0.11 -0.16 0.00 0.00 0.00 0.00 179.25 178.97 1vr6 h ALA 287 N 1.46 -0.38 -0.42 0.00 0.00 -0.61 0.96 119.26 120.27 1vr6 h ALA 287 Ca 0.37 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 1vr6 h ALA 287 Cb 0.45 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1vr6 h ALA 287 CO -0.31 -0.73 -0.30 0.97 0.00 0.00 0.00 179.25 178.88 1vr6 h ILE 288 N -0.40 1.27 -0.53 0.00 2.10 -1.15 -1.15 117.51 117.65 1vr6 h ILE 288 Ca -0.02 -1.46 -0.10 0.00 1.08 0.00 0.00 64.86 64.35 1vr6 h ILE 288 Cb 0.34 1.27 -0.02 0.00 -1.09 0.00 0.00 36.82 37.31 1vr6 h ILE 288 CO 0.02 0.49 -0.08 0.00 -1.08 0.00 0.00 178.15 177.51 1vr6 h ALA 289 N 0.88 0.86 0.00 0.18 0.00 -1.04 -2.61 119.26 117.53 1vr6 h ALA 289 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1vr6 h ALA 289 Cb 0.87 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1vr6 h ALA 289 CO 0.08 0.65 0.00 -0.24 0.00 0.00 0.00 179.25 179.74 1vr6 h VAL 290 N 0.87 0.00 0.00 0.00 3.04 -0.73 -3.46 116.25 115.97 1vr6 h VAL 290 Ca 0.15 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 1vr6 h VAL 290 Cb 0.62 1.35 0.00 0.00 -2.01 0.00 0.00 31.29 31.25 1vr6 h VAL 290 CO 0.04 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.21 1vr6 n GLY 291 N -0.18 1.65 3.77 3.17 0.00 -0.98 -4.59 105.19 108.03 1vr6 n GLY 291 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1vr6 n GLY 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vr6 s ALA 292 N -2.00 2.41 -2.25 4.61 0.00 -0.45 -4.93 121.76 119.15 1vr6 s ALA 292 Ca 0.00 0.47 0.20 0.00 0.00 0.00 0.00 51.96 52.63 1vr6 s ALA 292 Cb 0.00 -3.31 0.77 0.00 0.00 0.00 0.00 23.12 20.59 1vr6 s ALA 292 CO 0.00 -1.42 1.56 0.72 0.00 0.00 0.00 175.76 176.61 1vr6 n HIS 293 N -2.74 0.19 -0.98 0.00 -0.00 0.56 -4.78 115.22 107.46 1vr6 n HIS 293 Ca 0.10 -0.10 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1vr6 n HIS 293 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.51 1vr6 n HIS 293 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1vr6 n GLY 294 N 1.10 -2.05 3.05 -1.41 0.00 -1.26 -0.98 105.19 103.65 1vr6 n GLY 294 Ca 0.16 -1.39 -0.13 0.00 0.00 0.00 0.00 46.02 44.67 1vr6 n GLY 294 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vr6 s ILE 295 N -2.15 0.50 -0.15 -0.61 -4.36 -0.56 -1.67 121.20 112.19 1vr6 s ILE 295 Ca 0.00 -1.07 0.01 0.00 -0.26 0.00 0.00 60.65 59.34 1vr6 s ILE 295 Cb 0.00 -0.58 0.02 0.00 1.25 0.00 0.00 42.46 43.15 1vr6 s ILE 295 CO 0.00 -0.40 -0.18 -0.51 0.24 0.00 0.00 174.94 174.09 1vr6 s ILE 296 N -1.40 1.85 -0.04 8.37 2.07 -0.75 -0.97 121.20 130.34 1vr6 s ILE 296 Ca -0.11 -0.83 0.03 0.00 -1.41 0.00 0.00 60.65 58.34 1vr6 s ILE 296 Cb -0.10 -1.68 0.00 0.00 0.13 0.00 0.00 42.46 40.81 1vr6 s ILE 296 CO 0.00 0.51 -0.13 -0.69 -1.91 0.00 0.00 174.94 172.72 1vr6 s VAL 297 N 1.18 1.14 -0.26 4.00 1.01 0.07 -4.03 120.40 123.52 1vr6 s VAL 297 Ca 0.00 -0.55 -0.27 0.00 0.00 0.00 0.00 61.98 61.16 1vr6 s VAL 297 Cb -0.14 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.25 1vr6 s VAL 297 CO -0.08 0.34 0.96 -0.70 0.00 0.00 0.00 175.10 175.62 1vr6 s GLU 298 N 0.16 4.16 0.00 2.72 2.12 -1.26 -2.41 118.70 124.19 1vr6 s GLU 298 Ca -0.04 1.09 0.05 0.00 0.36 0.00 0.00 54.97 56.42 1vr6 s GLU 298 Cb -0.11 -3.67 -0.01 0.00 0.26 0.00 0.00 34.13 30.60 1vr6 s GLU 298 CO 0.02 -0.66 -0.15 0.08 -0.54 0.00 0.00 175.26 174.00 1vr6 s VAL 299 N 3.17 1.20 -0.15 3.70 1.01 -0.67 -1.26 120.40 127.39 1vr6 s VAL 299 Ca 0.40 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.52 1vr6 s VAL 299 Cb -0.14 -1.02 0.05 0.00 0.00 0.00 0.00 36.38 35.26 1vr6 s VAL 299 CO 0.09 0.25 0.38 -2.28 0.00 0.00 0.00 175.10 173.54 1vr6 s HIS 300 N -0.49 -0.48 0.53 5.22 5.04 -0.59 -2.19 115.29 122.33 1vr6 s HIS 300 Ca 0.05 1.11 0.19 0.00 -1.54 0.00 0.00 55.06 54.86 1vr6 s HIS 300 Cb -0.06 0.18 1.37 0.00 0.04 0.00 0.00 32.58 34.11 1vr6 s HIS 300 CO 0.00 -0.26 2.17 -1.00 -2.34 0.00 0.00 174.74 173.31 1vr6 h PRO 301 N 6.28 0.00 -1.92 2.88 0.13 -1.89 -3.35 132.00 134.13 1vr6 h PRO 301 Ca -0.32 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.29 1vr6 h PRO 301 Cb 1.18 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.96 1vr6 h PRO 301 CO 0.29 0.00 -0.98 0.39 -0.23 0.00 0.00 178.00 177.47 1vr6 n GLU 302 N -4.41 0.51 -0.19 0.86 1.02 -1.26 -4.65 120.64 112.53 1vr6 n GLU 302 Ca -0.03 -3.02 0.21 0.00 -0.02 0.00 0.00 57.16 54.30 1vr6 n GLU 302 Cb 0.09 -1.41 0.58 0.00 -0.02 0.00 0.00 31.44 30.68 1vr6 n GLU 302 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1vr6 h PRO 303 N 4.65 0.25 0.00 3.49 0.11 -1.89 0.40 132.00 139.01 1vr6 h PRO 303 Ca 0.12 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1vr6 h PRO 303 Cb 0.92 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1vr6 h PRO 303 CO 0.39 0.17 0.00 1.05 -0.21 0.00 0.00 178.00 179.40 1vr6 h GLU 304 N 0.26 0.00 -0.29 1.05 9.09 -1.95 -2.04 114.58 120.70 1vr6 h GLU 304 Ca 0.42 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.83 1vr6 h GLU 304 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1vr6 h GLU 304 CO -0.11 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.58 1vr6 n LYS 305 N -2.72 2.80 -1.93 1.06 5.02 0.14 -5.04 118.16 117.49 1vr6 n LYS 305 Ca -0.01 -1.94 -0.39 0.00 -2.02 0.00 0.00 58.31 53.95 1vr6 n LYS 305 Cb 0.13 -1.23 0.01 0.00 -0.02 0.00 0.00 35.03 33.92 1vr6 n LYS 305 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vr6 s ALA 306 N -0.99 3.14 -2.52 7.82 0.00 -0.77 -4.91 121.76 123.53 1vr6 s ALA 306 Ca 0.20 1.31 0.27 0.00 0.00 0.00 0.00 51.96 53.74 1vr6 s ALA 306 Cb 0.10 -3.53 0.94 0.00 0.00 0.00 0.00 23.12 20.63 1vr6 s ALA 306 CO 0.13 -1.05 1.68 1.28 0.00 0.00 0.00 175.76 177.80 1vr6 n LEU 307 N -0.28 1.64 -3.61 0.00 4.77 -1.26 -4.73 117.00 113.52 1vr6 n LEU 307 Ca 0.06 -0.54 -0.03 0.00 -0.03 0.00 0.00 56.01 55.47 1vr6 n LEU 307 Cb 0.44 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1vr6 n LEU 307 CO 0.56 0.27 0.54 -0.55 -1.33 0.00 0.00 177.39 176.88 1vr6 s SER 308 N -2.03 -0.70 -1.53 -1.43 0.15 -1.26 -4.76 113.70 102.15 1vr6 s SER 308 Ca 0.36 1.08 -0.03 0.00 0.70 0.00 0.00 55.95 58.07 1vr6 s SER 308 Cb 0.21 1.42 0.00 0.00 -1.71 0.00 0.00 66.02 65.94 1vr6 s SER 308 CO 0.34 -0.17 0.34 0.47 1.20 0.00 0.00 173.24 175.42 1vr6 n ASP 309 N 4.20 -5.70 -0.30 5.45 9.92 -1.26 -4.75 116.55 124.10 1vr6 n ASP 309 Ca -0.17 -0.17 0.03 0.00 -0.53 0.00 0.00 54.79 53.95 1vr6 n ASP 309 Cb 0.57 -4.61 0.22 0.00 -0.64 0.00 0.00 41.12 36.66 1vr6 n ASP 309 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1vr6 h GLY 310 N -0.77 1.29 1.00 0.44 0.00 -1.85 -3.15 103.07 100.03 1vr6 h GLY 310 Ca -0.48 -0.43 0.06 0.00 0.00 0.00 0.00 47.33 46.48 1vr6 h GLY 310 CO 0.53 0.34 0.52 1.70 0.00 0.00 0.00 176.54 179.63 1vr6 h LYS 311 N 1.07 0.86 -0.14 4.80 3.64 -1.90 -2.12 116.57 122.78 1vr6 h LYS 311 Ca 0.37 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 1vr6 h LYS 311 Cb 0.10 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1vr6 h LYS 311 CO -0.12 0.57 0.00 0.00 -2.27 0.00 0.00 179.45 177.63 1vr6 n GLN 312 N -4.48 1.67 -2.34 1.90 0.00 -1.21 -2.92 117.38 110.00 1vr6 n GLN 312 Ca 0.11 -1.69 -0.40 0.00 0.00 0.00 0.00 57.00 55.02 1vr6 n GLN 312 Cb 0.19 -1.34 -0.03 0.00 0.00 0.00 0.00 30.24 29.06 1vr6 n GLN 312 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1vr6 s SER 313 N -1.31 7.08 0.50 2.61 0.15 -0.80 -4.44 113.70 117.50 1vr6 s SER 313 Ca 0.23 2.42 -0.15 0.00 0.70 0.00 0.00 55.95 59.14 1vr6 s SER 313 Cb 0.15 -2.63 -0.07 0.00 -1.71 0.00 0.00 66.02 61.75 1vr6 s SER 313 CO 0.22 -0.30 0.96 -0.76 1.20 0.00 0.00 173.24 174.55 1vr6 s LEU 314 N -1.47 3.64 0.00 3.45 1.43 -0.39 -4.87 118.68 120.46 1vr6 s LEU 314 Ca 0.47 1.50 0.02 0.00 -1.03 0.00 0.00 54.13 55.09 1vr6 s LEU 314 Cb -0.35 -4.43 0.07 0.00 0.03 0.00 0.00 46.19 41.51 1vr6 s LEU 314 CO 0.45 -0.57 0.54 -0.90 0.23 0.00 0.00 176.35 176.10 1vr6 n ASP 315 N -1.59 1.00 -0.08 2.29 5.75 -1.26 -1.54 116.55 121.13 1vr6 n ASP 315 Ca 0.06 -1.78 -0.06 0.00 -0.01 0.00 0.00 54.79 53.00 1vr6 n ASP 315 Cb 0.54 -0.33 0.13 0.00 -1.03 0.00 0.00 41.12 40.44 1vr6 n ASP 315 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1vr6 h PHE 316 N -0.27 0.80 -0.36 2.11 0.04 -1.83 -0.93 116.94 116.51 1vr6 h PHE 316 Ca -0.18 -0.16 -0.13 0.00 2.80 0.00 0.00 57.97 60.30 1vr6 h PHE 316 Cb 0.74 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.68 1vr6 h PHE 316 CO 0.00 0.83 -0.29 0.93 -0.60 0.00 0.00 178.31 179.18 1vr6 h GLU 317 N 0.65 0.84 -0.66 1.51 4.39 -1.96 -0.80 114.58 118.54 1vr6 h GLU 317 Ca 0.11 -0.42 -0.08 0.00 0.34 0.00 0.00 59.36 59.31 1vr6 h GLU 317 Cb 0.63 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.25 1vr6 h GLU 317 CO 0.04 1.05 0.10 -0.07 -1.16 0.00 0.00 179.01 178.97 1vr6 h LEU 318 N 0.63 1.06 -1.14 1.33 3.38 -1.94 -2.43 115.31 116.21 1vr6 h LEU 318 Ca 0.07 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 1vr6 h LEU 318 Cb 0.87 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1vr6 h LEU 318 CO 0.08 1.06 0.06 0.15 0.09 0.00 0.00 178.44 179.87 1vr6 h PHE 319 N 1.02 0.69 -0.45 1.13 3.57 -0.82 -0.70 116.94 121.38 1vr6 h PHE 319 Ca 0.20 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 1vr6 h PHE 319 Cb 0.46 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1vr6 h PHE 319 CO 0.03 0.62 0.16 -0.22 -2.23 0.00 0.00 178.31 176.67 1vr6 h LYS 320 N 0.64 0.70 -0.56 1.11 3.64 -0.98 -1.53 116.57 119.59 1vr6 h LYS 320 Ca 0.14 -0.14 0.09 0.00 -1.27 0.00 0.00 60.65 59.47 1vr6 h LYS 320 Cb 0.31 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 31.95 1vr6 h LYS 320 CO 0.00 0.66 0.15 1.49 -2.27 0.00 0.00 179.45 179.48 1vr6 h GLU 321 N 0.59 0.29 -0.32 1.90 4.57 -1.03 -1.73 114.58 118.85 1vr6 h GLU 321 Ca 0.15 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.37 1vr6 h GLU 321 Cb 0.24 -0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 28.71 1vr6 h GLU 321 CO -0.01 0.19 -0.04 1.25 -1.18 0.00 0.00 179.01 179.22 1vr6 h LEU 322 N 0.29 -0.21 -0.51 1.64 5.85 -0.74 -1.54 115.31 120.09 1vr6 h LEU 322 Ca 0.28 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 59.03 1vr6 h LEU 322 Cb 0.38 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1vr6 h LEU 322 CO -0.34 -0.07 0.08 0.58 -0.34 0.00 0.00 178.44 178.35 1vr6 h VAL 323 N 0.05 1.25 -0.61 1.05 2.07 -1.04 -1.20 116.25 117.81 1vr6 h VAL 323 Ca 0.16 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.79 1vr6 h VAL 323 Cb 0.23 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 1vr6 h VAL 323 CO -0.29 0.34 0.33 1.56 0.02 0.00 0.00 177.57 179.53 1vr6 h GLN 324 N 0.73 0.61 -0.61 1.57 4.20 -1.06 -1.52 115.11 119.02 1vr6 h GLN 324 Ca 0.15 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 1vr6 h GLN 324 Cb 0.40 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1vr6 h GLN 324 CO 0.01 0.40 0.06 0.93 -0.67 0.00 0.00 178.83 179.56 1vr6 h GLU 325 N 0.63 1.03 -0.52 1.46 5.08 -0.99 -1.84 114.58 119.44 1vr6 h GLU 325 Ca 0.27 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 1vr6 h GLU 325 Cb 0.16 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1vr6 h GLU 325 CO -0.17 0.98 0.15 0.52 -1.00 0.00 0.00 179.01 179.48 1vr6 h MET 326 N 0.96 0.81 -0.51 2.33 2.86 -0.85 -0.86 114.93 119.67 1vr6 h MET 326 Ca 0.18 -0.18 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 1vr6 h MET 326 Cb 0.47 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1vr6 h MET 326 CO 0.02 0.76 0.05 0.87 1.06 0.00 0.00 176.91 179.67 1vr6 h LYS 327 N 0.71 0.87 -0.49 1.72 1.57 -1.22 0.58 116.57 120.32 1vr6 h LYS 327 Ca 0.17 -0.25 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1vr6 h LYS 327 Cb 0.30 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1vr6 h LYS 327 CO -0.00 0.87 0.21 -0.22 -0.57 0.00 0.00 179.45 179.75 1vr6 h LYS 328 N 0.75 0.72 -0.30 3.15 3.64 -1.19 -1.13 116.57 122.20 1vr6 h LYS 328 Ca 0.15 -0.12 -0.14 0.00 -1.27 0.00 0.00 60.65 59.28 1vr6 h LYS 328 Cb 0.44 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1vr6 h LYS 328 CO 0.02 0.63 -0.37 -0.07 -2.27 0.00 0.00 179.45 177.38 1vr6 h LEU 329 N 0.65 0.73 -0.27 5.20 3.38 -0.90 -2.61 115.31 121.49 1vr6 h LEU 329 Ca 0.17 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1vr6 h LEU 329 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1vr6 h LEU 329 CO -0.02 1.03 0.12 0.00 0.09 0.00 0.00 178.44 179.66 1vr6 h ALA 330 N 1.01 0.35 -0.61 1.53 0.00 0.34 -0.24 119.26 121.64 1vr6 h ALA 330 Ca 0.05 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 54.97 1vr6 h ALA 330 Cb 0.90 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.49 1vr6 h ALA 330 CO 0.08 -0.06 0.11 0.22 0.00 0.00 0.00 179.25 179.60 1vr6 h ASP 331 N 0.30 -0.04 0.11 0.00 3.58 -1.16 0.41 116.42 119.60 1vr6 h ASP 331 Ca 0.09 0.12 -0.11 0.00 0.42 0.00 0.00 57.03 57.56 1vr6 h ASP 331 Cb 0.16 0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1vr6 h ASP 331 CO -0.01 -0.02 -0.36 0.00 -2.88 0.00 0.00 179.24 175.97 1vr6 h ALA 332 N 1.50 1.07 -0.00 -0.78 0.00 -0.95 -3.21 119.26 116.89 1vr6 h ALA 332 Ca 0.32 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1vr6 h ALA 332 Cb 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1vr6 h ALA 332 CO -0.43 0.58 -0.34 1.28 0.00 0.00 0.00 179.25 180.35 1vr6 n LEU 333 N -4.06 0.66 -0.81 0.00 4.77 -0.18 -4.98 117.00 112.40 1vr6 n LEU 333 Ca -0.01 -0.07 -0.08 0.00 -0.03 0.00 0.00 56.01 55.83 1vr6 n LEU 333 Cb 0.46 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 1vr6 n LEU 333 CO 0.42 0.14 -0.09 0.61 -1.33 0.00 0.00 177.39 177.14 1vr6 n GLY 334 N 1.42 0.27 3.71 -0.72 0.00 0.07 -5.05 105.19 104.88 1vr6 n GLY 334 Ca 0.09 -0.59 -0.23 0.00 0.00 0.00 0.00 46.02 45.28 1vr6 n GLY 334 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vr6 s VAL 335 N -2.36 3.84 -0.26 1.61 -7.23 -0.79 -4.99 120.40 110.22 1vr6 s VAL 335 Ca 0.00 -1.64 -0.06 0.00 -1.81 0.00 0.00 61.98 58.47 1vr6 s VAL 335 Cb 0.00 -3.04 -0.01 0.00 0.56 0.00 0.00 36.38 33.89 1vr6 s VAL 335 CO 0.00 -0.31 0.04 -0.75 -0.31 0.00 0.00 175.10 173.77 1vr6 s LYS 336 N -3.57 3.39 -0.03 4.82 2.47 -0.08 -4.32 119.74 122.41 1vr6 s LYS 336 Ca 0.31 -0.64 -0.30 0.00 -1.56 0.00 0.00 55.97 53.78 1vr6 s LYS 336 Cb -0.07 -3.25 -0.05 0.00 -1.46 0.00 0.00 37.83 33.00 1vr6 s LYS 336 CO 0.21 -0.27 1.35 0.08 0.16 0.00 0.00 175.35 176.88 1vr6 s VAL 337 N 1.54 3.87 0.00 4.02 1.01 -1.26 -1.30 120.40 128.28 1vr6 s VAL 337 Ca 0.05 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.25 1vr6 s VAL 337 Cb -0.16 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1vr6 s VAL 337 CO 0.01 -0.01 0.07 -0.46 0.00 0.00 0.00 175.10 174.71