#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vvh h ALA 3 N 0.00 1.49 -3.16 -1.46 0.00 -1.92 -3.43 119.26 110.78 2vvh h ALA 3 Ca 0.00 -0.21 -0.60 0.00 0.00 0.00 0.00 54.91 54.11 2vvh h ALA 3 Cb 0.00 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 17.59 2vvh h ALA 3 CO 0.00 0.36 -0.40 0.42 0.00 0.00 0.00 179.25 179.63 2vvh s ILE 4 N -4.75 5.35 0.31 0.00 1.01 -1.26 -4.97 121.20 116.88 2vvh s ILE 4 Ca -0.06 0.39 -0.04 0.00 0.00 0.00 0.00 60.65 60.94 2vvh s ILE 4 Cb 0.15 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 2vvh s ILE 4 CO 0.74 0.40 0.57 -0.54 0.00 0.00 0.00 174.94 176.10 2vvh s LYS 5 N 0.53 3.60 0.52 2.79 -0.14 -1.26 -5.00 119.74 120.77 2vvh s LYS 5 Ca 0.13 -0.05 0.19 0.00 -1.36 0.00 0.00 55.97 54.87 2vvh s LYS 5 Cb -0.12 -2.63 1.30 0.00 -1.68 0.00 0.00 37.83 34.69 2vvh s LYS 5 CO 0.02 0.18 2.10 -1.35 -0.76 0.00 0.00 175.35 175.53 2vvh h PRO 6 N 1.41 0.01 -4.94 -1.68 0.11 -1.98 -3.39 132.00 121.54 2vvh h PRO 6 Ca -0.48 -0.00 -0.63 0.00 0.11 0.00 0.00 66.00 64.99 2vvh h PRO 6 Cb 1.20 -0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.96 2vvh h PRO 6 CO 0.65 0.01 -0.85 -0.51 -0.21 0.00 0.00 178.00 177.09 2vvh s ASP 7 N -6.80 2.84 0.16 -2.05 1.01 -1.26 -4.06 116.67 106.51 2vvh s ASP 7 Ca -0.05 -0.54 0.08 0.00 0.71 0.00 0.00 52.55 52.75 2vvh s ASP 7 Cb 0.18 -1.30 -0.04 0.00 1.01 0.00 0.00 42.92 42.77 2vvh s ASP 7 CO 0.69 0.02 -0.17 -0.04 0.21 0.00 0.00 175.17 175.88 2vvh s MET 8 N 1.08 1.22 0.19 8.23 -1.94 -0.22 -5.01 119.30 122.85 2vvh s MET 8 Ca -0.02 -1.38 0.05 0.00 -1.71 0.00 0.00 55.69 52.62 2vvh s MET 8 Cb -0.14 -1.22 -0.04 0.00 2.01 0.00 0.00 34.83 35.44 2vvh s MET 8 CO -0.06 0.24 0.21 0.15 -0.01 0.00 0.00 175.02 175.56 2vvh s LYS 9 N -2.82 3.10 -0.07 2.03 1.02 0.79 -1.18 119.74 122.61 2vvh s LYS 9 Ca 0.15 -0.82 -0.01 0.00 0.02 0.00 0.00 55.97 55.31 2vvh s LYS 9 Cb -0.05 -2.74 0.03 0.00 -0.52 0.00 0.00 37.83 34.55 2vvh s LYS 9 CO 0.06 0.47 -0.03 0.42 -0.92 0.00 0.00 175.35 175.35 2vvh s ILE 10 N -1.85 0.56 -0.09 2.17 1.01 0.49 -0.68 121.20 122.82 2vvh s ILE 10 Ca 0.33 -0.03 0.02 0.00 0.00 0.00 0.00 60.65 60.97 2vvh s ILE 10 Cb -0.10 -0.65 -0.02 0.00 0.01 0.00 0.00 42.46 41.70 2vvh s ILE 10 CO 0.26 0.28 -0.13 0.21 0.00 0.00 0.00 174.94 175.55 2vvh s ASN 11 N 1.66 4.09 -0.06 3.58 3.84 0.40 -0.87 114.94 127.58 2vvh s ASN 11 Ca 0.01 -0.23 -0.05 0.00 0.21 0.00 0.00 52.86 52.80 2vvh s ASN 11 Cb -0.13 -1.20 0.02 0.00 -0.55 0.00 0.00 41.25 39.39 2vvh s ASN 11 CO -0.05 0.27 0.16 -0.22 -2.79 0.00 0.00 177.10 174.47 2vvh s LEU 12 N -0.27 1.26 -0.17 3.21 0.20 -0.02 -1.17 118.68 121.72 2vvh s LEU 12 Ca 0.02 0.32 -0.00 0.00 0.69 0.00 0.00 54.13 55.16 2vvh s LEU 12 Cb -0.13 0.52 0.04 0.00 -0.43 0.00 0.00 46.19 46.19 2vvh s LEU 12 CO 0.03 -0.07 -0.08 -0.60 -0.29 0.00 0.00 176.35 175.34 2vvh s ARG 13 N 0.29 1.67 -0.10 1.98 6.06 -0.72 -0.15 118.95 127.98 2vvh s ARG 13 Ca -0.02 -0.57 -0.02 0.00 -2.50 0.00 0.00 55.73 52.62 2vvh s ARG 13 Cb -0.03 -2.07 -0.03 0.00 0.06 0.00 0.00 34.95 32.88 2vvh s ARG 13 CO -0.01 -0.39 0.00 1.41 -2.50 0.00 0.00 175.30 173.81 2vvh s MET 14 N 1.57 3.11 0.01 5.12 -2.45 0.72 -1.40 119.30 125.98 2vvh s MET 14 Ca 0.01 -0.41 0.04 0.00 -1.25 0.00 0.00 55.69 54.08 2vvh s MET 14 Cb -0.15 -2.83 -0.01 0.00 1.25 0.00 0.00 34.83 33.09 2vvh s MET 14 CO -0.08 0.63 -0.12 -2.00 1.05 0.00 0.00 175.02 174.50 2vvh s GLU 15 N -0.69 0.93 0.11 4.11 2.12 -0.59 -0.50 118.70 124.19 2vvh s GLU 15 Ca 0.11 -0.52 -0.15 0.00 0.36 0.00 0.00 54.97 54.77 2vvh s GLU 15 Cb -0.12 -0.90 0.05 0.00 0.26 0.00 0.00 34.13 33.42 2vvh s GLU 15 CO 0.02 0.24 0.72 0.41 -0.54 0.00 0.00 175.26 176.12 2vvh n GLY 16 N 2.52 0.77 3.18 -1.50 0.00 -0.54 -2.12 105.19 107.50 2vvh n GLY 16 Ca -0.15 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 2vvh n GLY 16 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vvh s ASN 17 N -2.70 -0.10 -0.11 1.61 3.84 -0.28 -1.14 114.94 116.07 2vvh s ASN 17 Ca 0.16 0.84 0.02 0.00 0.21 0.00 0.00 52.86 54.09 2vvh s ASN 17 Cb -0.02 1.23 0.01 0.00 -0.55 0.00 0.00 41.25 41.92 2vvh s ASN 17 CO 0.03 -0.24 -0.17 -0.69 -2.79 0.00 0.00 177.10 173.24 2vvh s VAL 18 N 2.58 1.64 -1.91 -5.21 1.01 -0.86 -0.97 120.40 116.68 2vvh s VAL 18 Ca 0.01 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.24 2vvh s VAL 18 Cb -0.12 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.78 2vvh s VAL 18 CO -0.13 0.47 0.00 -3.20 0.00 0.00 0.00 175.10 172.24 2vvh n ASN 19 N 4.02 -5.25 0.00 3.32 5.15 -0.75 -1.07 115.26 120.69 2vvh n ASN 19 Ca -0.20 0.39 0.00 0.00 -0.60 0.00 0.00 54.58 54.17 2vvh n ASN 19 Cb 0.52 -4.36 0.00 0.00 -0.53 0.00 0.00 39.78 35.40 2vvh n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2vvh n GLY 20 N -0.75 0.75 3.46 8.20 0.00 -1.26 -5.04 105.19 110.55 2vvh n GLY 20 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2vvh n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2vvh s HIS 21 N -2.77 3.24 0.42 1.61 5.04 -0.23 -5.07 115.29 117.52 2vvh s HIS 21 Ca 0.00 -0.56 -0.23 0.00 -1.54 0.00 0.00 55.06 52.72 2vvh s HIS 21 Cb 0.00 -2.55 -0.09 0.00 0.04 0.00 0.00 32.58 29.98 2vvh s HIS 21 CO 0.00 -0.56 1.05 -1.58 -2.34 0.00 0.00 174.74 171.31 2vvh s HIS 22 N 1.67 3.22 0.08 3.88 2.46 -1.26 -2.02 115.29 123.32 2vvh s HIS 22 Ca 0.05 1.63 -0.17 0.00 0.47 0.00 0.00 55.06 57.03 2vvh s HIS 22 Cb -0.19 -3.11 0.04 0.00 -0.13 0.00 0.00 32.58 29.19 2vvh s HIS 22 CO 0.10 -0.66 0.42 -0.59 -2.47 0.00 0.00 174.74 171.53 2vvh s PHE 23 N -1.72 -0.25 -0.04 3.88 -0.12 -0.29 -4.24 117.98 115.19 2vvh s PHE 23 Ca 0.60 0.09 0.02 0.00 -0.05 0.00 0.00 56.93 57.58 2vvh s PHE 23 Cb -0.21 0.25 0.01 0.00 -0.63 0.00 0.00 43.02 42.44 2vvh s PHE 23 CO 0.26 -0.64 -0.09 0.08 -0.05 0.00 0.00 175.22 174.78 2vvh s VAL 24 N -3.11 0.84 -0.08 -2.49 1.01 -0.71 -1.47 120.40 114.40 2vvh s VAL 24 Ca -0.01 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.64 2vvh s VAL 24 Cb 0.00 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.62 2vvh s VAL 24 CO -0.07 0.28 -0.09 -0.63 0.00 0.00 0.00 175.10 174.59 2vvh s ILE 25 N 0.57 0.95 0.08 2.22 1.01 0.34 -0.29 121.20 126.08 2vvh s ILE 25 Ca -0.10 -0.32 -0.04 0.00 0.00 0.00 0.00 60.65 60.20 2vvh s ILE 25 Cb -0.13 -0.93 -0.05 0.00 0.01 0.00 0.00 42.46 41.36 2vvh s ILE 25 CO 0.02 0.33 0.29 -1.81 0.00 0.00 0.00 174.94 173.77 2vvh s ASP 26 N 1.13 6.45 -0.01 3.58 1.01 -0.09 -0.20 116.67 128.55 2vvh s ASP 26 Ca -0.06 0.49 0.00 0.00 0.71 0.00 0.00 52.55 53.69 2vvh s ASP 26 Cb -0.14 -2.05 0.01 0.00 1.01 0.00 0.00 42.92 41.75 2vvh s ASP 26 CO -0.01 0.15 -0.00 -0.83 0.21 0.00 0.00 175.17 174.68 2vvh s GLY 27 N -2.24 0.09 -0.06 0.21 0.00 0.79 -0.65 107.32 105.46 2vvh s GLY 27 Ca 0.35 0.06 0.00 0.00 0.00 0.00 0.00 44.72 45.13 2vvh s GLY 27 CO 0.23 0.21 -0.03 -0.35 0.00 0.00 0.00 173.10 173.16 2vvh s ASP 28 N 0.36 1.32 0.07 1.64 -1.08 -0.56 -0.84 116.67 117.60 2vvh s ASP 28 Ca -0.03 -0.14 -0.01 0.00 -0.52 0.00 0.00 52.55 51.85 2vvh s ASP 28 Cb -0.05 -0.50 0.01 0.00 -1.46 0.00 0.00 42.92 40.92 2vvh s ASP 28 CO -0.01 -0.11 0.12 0.61 0.52 0.00 0.00 175.17 176.30 2vvh n GLY 29 N 4.52 2.51 3.10 2.66 0.00 -0.05 -0.73 105.19 117.19 2vvh n GLY 29 Ca -0.17 -1.29 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 2vvh n GLY 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vvh s THR 30 N -2.63 0.14 0.23 2.61 -4.23 -0.39 -0.38 115.64 111.00 2vvh s THR 30 Ca 0.05 -1.19 -0.19 0.00 -1.18 0.00 0.00 61.69 59.18 2vvh s THR 30 Cb -0.00 -0.93 0.03 0.00 1.34 0.00 0.00 72.50 72.93 2vvh s THR 30 CO 0.03 -0.66 0.61 -0.83 -0.54 0.00 0.00 174.62 173.24 2vvh s GLY 31 N -2.19 -0.07 -0.45 3.99 0.00 -0.33 -0.52 107.32 107.75 2vvh s GLY 31 Ca -0.04 -0.26 0.01 0.00 0.00 0.00 0.00 44.72 44.44 2vvh s GLY 31 CO -0.05 -0.18 0.21 0.54 0.00 0.00 0.00 173.10 173.61 2vvh s LYS 32 N -3.90 1.92 0.23 2.90 1.02 0.78 -1.06 119.74 121.63 2vvh s LYS 32 Ca 0.11 -2.18 -0.07 0.00 0.02 0.00 0.00 55.97 53.85 2vvh s LYS 32 Cb -0.03 -3.41 0.39 0.00 -0.52 0.00 0.00 37.83 34.25 2vvh s LYS 32 CO 0.02 -1.06 1.71 -1.35 -0.92 0.00 0.00 175.35 173.75 2vvh h PRO 33 N 7.31 0.32 0.00 -1.68 0.11 -1.78 -1.36 132.00 134.92 2vvh h PRO 33 Ca -0.07 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.02 2vvh h PRO 33 Cb 0.98 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2vvh h PRO 33 CO 0.64 0.21 0.00 0.74 -0.21 0.00 0.00 178.00 179.38 2vvh h PHE 34 N 0.32 0.00 -0.01 0.65 -1.00 -1.84 -2.31 116.94 112.76 2vvh h PHE 34 Ca 0.37 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.15 2vvh h PHE 34 Cb 0.57 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.13 2vvh h PHE 34 CO -0.22 0.00 -0.65 0.39 -1.61 0.00 0.00 178.31 176.21 2vvh n GLU 35 N -2.59 0.47 -2.59 1.51 1.02 -0.80 -4.53 120.64 113.14 2vvh n GLU 35 Ca 0.03 -0.36 -0.16 0.00 -0.02 0.00 0.00 57.16 56.65 2vvh n GLU 35 Cb 0.36 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.30 2vvh n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vvh n GLY 36 N 1.45 -0.23 3.23 0.62 0.00 -0.58 -4.47 105.19 105.21 2vvh n GLY 36 Ca 0.07 -0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 2vvh n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vvh s LYS 37 N -5.12 1.51 -0.07 1.61 1.02 -1.02 -0.87 119.74 116.80 2vvh s LYS 37 Ca 0.13 -0.84 -0.23 0.00 0.02 0.00 0.00 55.97 55.04 2vvh s LYS 37 Cb -0.06 -1.55 0.05 0.00 -0.52 0.00 0.00 37.83 35.76 2vvh s LYS 37 CO 0.15 0.41 0.53 1.14 -0.92 0.00 0.00 175.35 176.67 2vvh s GLN 38 N -0.86 0.84 0.09 1.68 -2.07 -0.81 -0.15 119.66 118.38 2vvh s GLN 38 Ca 0.08 0.23 0.05 0.00 -1.82 0.00 0.00 55.36 53.90 2vvh s GLN 38 Cb -0.08 0.39 -0.03 0.00 -1.09 0.00 0.00 33.01 32.20 2vvh s GLN 38 CO 0.01 -0.22 -0.13 0.45 -1.32 0.00 0.00 175.29 174.07 2vvh s SER 39 N -0.90 1.69 -0.17 12.60 0.15 0.32 -1.58 113.70 125.83 2vvh s SER 39 Ca -0.09 -0.69 -0.14 0.00 0.70 0.00 0.00 55.95 55.72 2vvh s SER 39 Cb -0.03 -0.04 0.05 0.00 -1.71 0.00 0.00 66.02 64.29 2vvh s SER 39 CO 0.06 -0.13 0.44 -0.32 1.20 0.00 0.00 173.24 174.50 2vvh s MET 40 N -2.12 0.50 -0.25 5.44 0.00 0.16 -1.26 119.30 121.77 2vvh s MET 40 Ca 0.01 0.66 -0.12 0.00 0.00 0.00 0.00 55.69 56.25 2vvh s MET 40 Cb -0.08 0.20 -0.05 0.00 0.00 0.00 0.00 34.83 34.91 2vvh s MET 40 CO 0.02 -0.08 0.22 -0.51 0.00 0.00 0.00 175.02 174.67 2vvh s ASP 41 N 0.47 6.14 0.02 1.11 1.01 0.09 -0.17 116.67 125.34 2vvh s ASP 41 Ca -0.02 0.15 0.04 0.00 0.71 0.00 0.00 52.55 53.42 2vvh s ASP 41 Cb -0.04 -2.13 -0.03 0.00 1.01 0.00 0.00 42.92 41.72 2vvh s ASP 41 CO -0.02 -0.00 -0.06 -0.76 0.21 0.00 0.00 175.17 174.53 2vvh s LEU 42 N 1.36 3.19 -0.04 1.23 1.43 0.13 -1.49 118.68 124.49 2vvh s LEU 42 Ca 0.09 -0.16 -0.01 0.00 -1.03 0.00 0.00 54.13 53.02 2vvh s LEU 42 Cb -0.14 -1.85 0.03 0.00 0.03 0.00 0.00 46.19 44.25 2vvh s LEU 42 CO 0.07 0.27 0.04 -0.70 0.23 0.00 0.00 176.35 176.26 2vvh s GLU 43 N -1.55 0.05 -0.33 1.70 2.12 0.18 -1.86 118.70 119.01 2vvh s GLU 43 Ca 0.18 0.30 -0.29 0.00 0.36 0.00 0.00 54.97 55.52 2vvh s GLU 43 Cb -0.11 -0.54 -0.00 0.00 0.26 0.00 0.00 34.13 33.73 2vvh s GLU 43 CO 0.09 -0.29 1.44 0.08 -0.54 0.00 0.00 175.26 176.04 2vvh s VAL 44 N 1.93 3.91 -0.08 3.70 1.01 -0.08 -0.92 120.40 129.86 2vvh s VAL 44 Ca 0.02 0.98 0.01 0.00 0.00 0.00 0.00 61.98 63.00 2vvh s VAL 44 Cb -0.12 -4.05 -0.25 0.00 0.00 0.00 0.00 36.38 31.96 2vvh s VAL 44 CO -0.03 -0.55 0.51 0.29 0.00 0.00 0.00 175.10 175.32 2vvh n LYS 45 N 7.77 0.71 -4.16 2.72 4.76 0.61 -4.80 118.16 125.77 2vvh n LYS 45 Ca 0.17 0.28 -0.15 0.00 -2.87 0.00 0.00 58.31 55.74 2vvh n LYS 45 Cb 0.47 -1.75 -0.13 0.00 -1.84 0.00 0.00 35.03 31.78 2vvh n LYS 45 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2vvh s GLU 46 N -2.58 0.53 0.00 1.97 2.02 -1.03 -4.86 118.70 114.75 2vvh s GLU 46 Ca -0.15 -0.45 0.00 0.00 0.02 0.00 0.00 54.97 54.40 2vvh s GLU 46 Cb 0.07 -0.44 0.00 0.00 0.10 0.00 0.00 34.13 33.86 2vvh s GLU 46 CO 0.80 0.11 0.00 0.41 0.02 0.00 0.00 175.26 176.59 2vvh n GLY 47 N 2.33 0.75 3.77 -1.39 0.00 -1.26 -1.73 105.19 107.66 2vvh n GLY 47 Ca -0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.47 2vvh n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vvh s GLY 48 N -1.55 2.89 0.24 -0.02 0.00 -1.26 -3.52 107.32 104.10 2vvh s GLY 48 Ca 0.00 0.83 -0.30 0.00 0.00 0.00 0.00 44.72 45.25 2vvh s GLY 48 CO 0.00 1.34 0.96 2.56 0.00 0.00 0.00 173.10 177.95 2vvh s PRO 49 N -2.06 4.84 0.26 2.90 0.04 -1.26 -5.11 135.00 134.60 2vvh s PRO 49 Ca 0.53 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.78 2vvh s PRO 49 Cb -0.27 -3.27 -0.11 0.00 0.04 0.00 0.00 34.50 30.89 2vvh s PRO 49 CO 0.35 0.49 1.52 -0.51 0.04 0.00 0.00 177.00 178.89 2vvh s LEU 50 N -1.20 4.37 0.00 -3.56 1.43 -1.23 -4.91 118.68 113.58 2vvh s LEU 50 Ca 0.41 2.79 0.12 0.00 -1.03 0.00 0.00 54.13 56.42 2vvh s LEU 50 Cb -0.27 -3.63 0.44 0.00 0.03 0.00 0.00 46.19 42.77 2vvh s LEU 50 CO 0.33 -0.80 1.33 -0.81 0.23 0.00 0.00 176.35 176.62 2vvh n PRO 51 N 2.42 1.58 -4.33 1.29 -0.04 -1.26 -4.90 135.00 129.76 2vvh n PRO 51 Ca 0.08 -0.89 -0.17 0.00 -0.04 0.00 0.00 63.50 62.47 2vvh n PRO 51 Cb 0.39 -1.26 -0.10 0.00 -0.04 0.00 0.00 33.50 32.49 2vvh n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2vvh s PHE 52 N -1.72 1.57 0.04 0.54 -0.12 -1.26 -4.66 117.98 112.37 2vvh s PHE 52 Ca 0.22 -0.93 -0.30 0.00 -0.05 0.00 0.00 56.93 55.87 2vvh s PHE 52 Cb 0.12 -0.91 -0.09 0.00 -0.63 0.00 0.00 43.02 41.51 2vvh s PHE 52 CO 0.16 -0.05 1.91 0.00 -0.05 0.00 0.00 175.22 177.20 2vvh s ALA 53 N -3.43 3.61 0.42 1.99 0.00 0.53 -4.89 121.76 120.00 2vvh s ALA 53 Ca 0.29 1.31 0.10 0.00 0.00 0.00 0.00 51.96 53.66 2vvh s ALA 53 Cb 0.06 -3.82 0.94 0.00 0.00 0.00 0.00 23.12 20.29 2vvh s ALA 53 CO 0.09 -1.50 2.01 0.35 0.00 0.00 0.00 175.76 176.72 2vvh h PHE 54 N 10.17 0.49 -1.04 0.00 3.57 -1.95 -2.81 116.94 125.36 2vvh h PHE 54 Ca -0.48 0.01 0.28 0.00 3.53 0.00 0.00 57.97 61.31 2vvh h PHE 54 Cb 1.23 -0.16 -0.07 0.00 2.79 0.00 0.00 35.95 39.74 2vvh h PHE 54 CO 0.92 0.27 0.70 -0.44 -2.23 0.00 0.00 178.31 177.53 2vvh h ASP 55 N 0.49 0.27 0.38 0.41 3.32 -1.95 -0.40 116.42 118.94 2vvh h ASP 55 Ca 0.22 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 2vvh h ASP 55 Cb 0.26 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 2vvh h ASP 55 CO -0.06 0.06 -0.04 0.16 -1.72 0.00 0.00 179.24 177.64 2vvh h ILE 56 N 0.24 0.24 0.00 0.35 3.07 -1.90 -2.86 117.51 116.65 2vvh h ILE 56 Ca 0.55 -0.32 -0.03 0.00 1.55 0.00 0.00 64.86 66.60 2vvh h ILE 56 Cb 1.68 1.25 -0.01 0.00 -0.27 0.00 0.00 36.82 39.48 2vvh h ILE 56 CO -0.17 0.04 -0.76 -0.07 -1.05 0.00 0.00 178.15 176.14 2vvh h LEU 57 N 0.00 0.00 -1.20 0.16 3.38 -1.28 -3.42 115.31 112.95 2vvh h LEU 57 Ca -0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2vvh h LEU 57 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2vvh h LEU 57 CO 0.01 0.13 -0.22 0.71 0.09 0.00 0.00 178.44 179.15 2vvh h THR 58 N 0.00 1.23 0.00 0.22 1.35 -1.57 -0.13 112.91 114.01 2vvh h THR 58 Ca -0.02 -1.06 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 2vvh h THR 58 Cb 1.12 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 2vvh h THR 58 CO 0.01 0.33 0.00 0.35 -0.25 0.00 0.00 175.52 175.96 2vvh n THR 59 N -4.18 0.67 0.10 6.82 -2.24 -1.26 -2.80 114.28 111.38 2vvh n THR 59 Ca -0.01 0.10 0.02 0.00 -2.27 0.00 0.00 64.05 61.89 2vvh n THR 59 Cb 0.35 -0.87 -0.02 0.00 -2.10 0.00 0.00 70.33 67.69 2vvh n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vvh h ALA 60 N 2.54 0.66 0.00 6.98 0.00 -1.32 -3.45 119.26 124.67 2vvh h ALA 60 Ca 0.00 -0.59 -0.14 0.00 0.00 0.00 0.00 54.91 54.18 2vvh h ALA 60 Cb 0.42 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2vvh h ALA 60 CO 0.00 0.71 -0.24 1.19 0.00 0.00 0.00 179.25 180.91 2vvh n PHE 61 N -3.07 0.00 0.00 0.00 3.01 -1.12 -4.99 117.46 111.28 2vvh n PHE 61 Ca -0.03 -1.25 0.00 0.00 1.01 0.00 0.00 57.45 57.18 2vvh n PHE 61 Cb 0.77 -1.32 0.00 0.00 -0.01 0.00 0.00 39.48 38.92 2vvh n PHE 61 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2vvh n ASN 65 N 2.44 0.00 0.00 4.37 5.15 -1.26 -5.12 115.26 120.84 2vvh n ASN 65 Ca 0.33 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.38 2vvh n ASN 65 Cb 0.75 0.00 0.45 0.00 -0.53 0.00 0.00 39.78 40.45 2vvh n ASN 65 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2vvh n ARG 66 N 0.00 0.67 -0.18 1.20 3.00 -1.26 -1.49 116.66 118.59 2vvh n ARG 66 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.87 2vvh n ARG 66 Cb 0.00 -1.35 0.29 0.00 0.00 0.00 0.00 32.46 31.40 2vvh n ARG 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2vvh h VAL 67 N 0.00 1.14 -0.57 5.15 2.07 -1.95 -3.24 116.25 118.85 2vvh h VAL 67 Ca 0.00 -0.31 -0.72 0.00 0.82 0.00 0.00 66.70 66.49 2vvh h VAL 67 Cb 0.00 0.16 -0.08 0.00 -1.52 0.00 0.00 31.29 29.85 2vvh h VAL 67 CO 0.00 0.16 2.80 0.49 0.02 0.00 0.00 177.57 181.05 2vvh n PHE 68 N -4.44 3.08 -3.75 1.57 3.01 -0.56 -4.69 117.46 111.68 2vvh n PHE 68 Ca 0.08 -2.92 -0.12 0.00 1.01 0.00 0.00 57.45 55.50 2vvh n PHE 68 Cb 0.08 -2.28 -0.12 0.00 -0.01 0.00 0.00 39.48 37.16 2vvh n PHE 68 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2vvh s ALA 69 N 1.69 -0.72 -0.49 4.37 0.00 -1.23 -4.34 121.76 121.04 2vvh s ALA 69 Ca 0.48 0.97 -0.29 0.00 0.00 0.00 0.00 51.96 53.13 2vvh s ALA 69 Cb 0.14 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.69 2vvh s ALA 69 CO -0.05 -0.17 1.28 -2.00 0.00 0.00 0.00 175.76 174.81 2vvh s GLU 70 N 0.62 3.57 -0.22 0.00 2.12 -0.23 -4.44 118.70 120.12 2vvh s GLU 70 Ca -0.04 0.61 -0.12 0.00 0.36 0.00 0.00 54.97 55.78 2vvh s GLU 70 Cb -0.05 -4.00 -0.05 0.00 0.26 0.00 0.00 34.13 30.29 2vvh s GLU 70 CO -0.04 -1.58 0.23 0.71 -0.54 0.00 0.00 175.26 174.04 2vvh s TYR 71 N 5.12 3.35 0.70 5.30 1.51 -1.26 -0.57 117.35 131.50 2vvh s TYR 71 Ca 0.52 0.38 -0.11 0.00 -1.01 0.00 0.00 57.07 56.85 2vvh s TYR 71 Cb -0.10 -2.33 0.01 0.00 -0.11 0.00 0.00 41.96 39.43 2vvh s TYR 71 CO 0.30 0.08 1.06 -1.25 -1.11 0.00 0.00 175.55 174.64 2vvh s PRO 72 N 1.00 2.90 0.57 -1.71 0.04 -1.26 -4.96 135.00 131.59 2vvh s PRO 72 Ca 0.11 0.86 0.28 0.00 0.04 0.00 0.00 61.00 62.29 2vvh s PRO 72 Cb -0.14 -1.99 1.72 0.00 0.04 0.00 0.00 34.50 34.13 2vvh s PRO 72 CO 0.05 -1.10 2.22 -0.44 0.04 0.00 0.00 177.00 177.77 2vvh h ASP 73 N -0.71 0.00 0.29 6.66 3.32 -1.99 -2.33 116.42 121.66 2vvh h ASP 73 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2vvh h ASP 73 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2vvh h ASP 73 CO 0.58 0.02 -0.11 0.00 -1.72 0.00 0.00 179.24 178.01 2vvh n HIS 74 N -3.91 0.00 -5.05 4.55 1.44 -1.26 -4.78 115.22 106.21 2vvh n HIS 74 Ca -0.03 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.36 2vvh n HIS 74 Cb 0.10 -0.15 -0.16 0.00 0.12 0.00 0.00 29.99 29.91 2vvh n HIS 74 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2vvh s ILE 75 N -2.40 2.45 0.14 0.61 1.01 -0.88 -5.08 121.20 117.06 2vvh s ILE 75 Ca 0.30 -0.88 -0.31 0.00 0.00 0.00 0.00 60.65 59.76 2vvh s ILE 75 Cb 0.20 -1.98 -0.10 0.00 0.01 0.00 0.00 42.46 40.60 2vvh s ILE 75 CO 0.46 0.55 1.70 -1.58 0.00 0.00 0.00 174.94 176.06 2vvh s GLN 76 N 0.29 4.17 -0.84 2.79 2.00 -1.26 -4.69 119.66 122.13 2vvh s GLN 76 Ca -0.15 2.47 -0.14 0.00 -2.00 0.00 0.00 55.36 55.55 2vvh s GLN 76 Cb -0.17 -3.37 0.22 0.00 0.80 0.00 0.00 33.01 30.49 2vvh s GLN 76 CO 0.07 -0.74 0.78 0.34 -0.50 0.00 0.00 175.29 175.25 2vvh s ASP 77 N 1.90 6.78 0.47 6.67 -1.08 -1.26 -4.70 116.67 125.44 2vvh s ASP 77 Ca 0.75 -2.71 0.12 0.00 -0.52 0.00 0.00 52.55 50.19 2vvh s ASP 77 Cb -0.45 -2.21 1.07 0.00 -1.46 0.00 0.00 42.92 39.87 2vvh s ASP 77 CO 0.33 -0.57 2.11 0.22 0.52 0.00 0.00 175.17 177.78 2vvh h TYR 78 N 7.76 0.25 0.07 -5.34 3.20 -1.93 -2.63 116.97 118.37 2vvh h TYR 78 Ca 0.11 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.88 2vvh h TYR 78 Cb 1.04 -0.09 0.01 0.00 1.54 0.00 0.00 36.73 39.23 2vvh h TYR 78 CO 1.04 0.16 -0.51 0.74 -1.64 0.00 0.00 178.16 177.94 2vvh h PHE 79 N 0.27 0.29 0.00 -3.82 -1.00 -1.90 -2.74 116.94 108.04 2vvh h PHE 79 Ca 0.07 -0.21 -0.07 0.00 2.81 0.00 0.00 57.97 60.57 2vvh h PHE 79 Cb -0.03 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.51 2vvh h PHE 79 CO 0.00 1.20 -0.35 0.87 -1.61 0.00 0.00 178.31 178.41 2vvh h LYS 80 N -0.66 0.00 0.00 1.51 1.57 -1.88 -2.48 116.57 114.63 2vvh h LYS 80 Ca -0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2vvh h LYS 80 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.67 2vvh h LYS 80 CO 0.07 0.35 0.00 1.04 -0.57 0.00 0.00 179.45 180.34 2vvh n GLN 81 N -4.05 0.01 0.00 3.15 1.13 -0.99 -3.16 117.38 113.47 2vvh n GLN 81 Ca -0.02 0.13 0.13 0.00 -1.94 0.00 0.00 57.00 55.31 2vvh n GLN 81 Cb 0.40 -1.50 0.47 0.00 0.11 0.00 0.00 30.24 29.72 2vvh n GLN 81 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2vvh n SER 82 N -1.49 0.92 -4.83 1.08 3.41 -0.93 -4.89 113.62 106.88 2vvh n SER 82 Ca 0.05 -0.89 -0.25 0.00 -0.26 0.00 0.00 58.87 57.52 2vvh n SER 82 Cb 0.25 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.21 2vvh n SER 82 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2vvh s PHE 83 N -2.42 3.21 0.18 7.33 0.40 -1.19 0.53 117.98 126.01 2vvh s PHE 83 Ca 0.28 -0.01 0.27 0.00 -0.60 0.00 0.00 56.93 56.87 2vvh s PHE 83 Cb 0.20 -1.52 1.13 0.00 0.51 0.00 0.00 43.02 43.34 2vvh s PHE 83 CO 0.48 0.52 1.91 -1.00 0.70 0.00 0.00 175.22 177.83 2vvh h PRO 84 N 2.19 0.00 -0.78 0.24 0.13 -1.90 -3.46 132.00 128.42 2vvh h PRO 84 Ca -0.48 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 2vvh h PRO 84 Cb 1.21 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 2vvh h PRO 84 CO 0.64 0.15 0.51 0.87 -0.23 0.00 0.00 178.00 179.94 2vvh h LYS 85 N 0.00 1.00 0.00 0.86 1.57 -1.92 -3.37 116.57 114.71 2vvh h LYS 85 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2vvh h LYS 85 Cb 0.62 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2vvh h LYS 85 CO 0.02 0.66 0.00 0.41 -0.57 0.00 0.00 179.45 179.97 2vvh n GLY 86 N -1.42 -1.50 3.79 3.86 0.00 0.19 -4.77 105.19 105.34 2vvh n GLY 86 Ca 0.09 -2.08 -0.08 0.00 0.00 0.00 0.00 46.02 43.95 2vvh n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2vvh s TYR 87 N 0.00 -0.07 0.12 1.61 1.13 -0.93 -1.63 117.35 117.59 2vvh s TYR 87 Ca 0.00 -0.36 0.05 0.00 -1.41 0.00 0.00 57.07 55.34 2vvh s TYR 87 Cb 0.00 0.59 -0.04 0.00 -1.10 0.00 0.00 41.96 41.41 2vvh s TYR 87 CO 0.00 -1.18 -0.11 -1.54 -2.51 0.00 0.00 175.55 170.21 2vvh s SER 88 N -2.94 1.75 0.05 -0.18 1.04 -0.26 -0.64 113.70 112.52 2vvh s SER 88 Ca 0.13 -0.89 0.02 0.00 0.48 0.00 0.00 55.95 55.69 2vvh s SER 88 Cb -0.05 -0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.02 2vvh s SER 88 CO 0.07 -0.26 -0.07 -1.66 0.98 0.00 0.00 173.24 172.31 2vvh s TRP 89 N -2.71 0.66 0.07 5.02 1.48 -0.50 -0.83 118.94 122.13 2vvh s TRP 89 Ca 0.11 -0.61 0.09 0.00 -1.06 0.00 0.00 56.10 54.62 2vvh s TRP 89 Cb -0.01 -0.40 -0.03 0.00 -1.16 0.00 0.00 33.47 31.87 2vvh s TRP 89 CO 0.01 -0.12 -0.23 -1.21 -4.06 0.00 0.00 176.95 171.34 2vvh s GLU 90 N -2.13 1.39 -0.06 3.25 2.02 -0.68 -1.71 118.70 120.78 2vvh s GLU 90 Ca -0.06 -1.10 -0.06 0.00 0.02 0.00 0.00 54.97 53.77 2vvh s GLU 90 Cb -0.06 -1.62 0.02 0.00 0.10 0.00 0.00 34.13 32.56 2vvh s GLU 90 CO -0.01 0.40 0.17 0.50 0.02 0.00 0.00 175.26 176.34 2vvh s ARG 91 N -1.54 0.22 -0.06 1.61 3.52 0.40 -0.74 118.95 122.35 2vvh s ARG 91 Ca 0.09 0.19 0.02 0.00 -0.13 0.00 0.00 55.73 55.90 2vvh s ARG 91 Cb -0.10 0.10 -0.03 0.00 -1.56 0.00 0.00 34.95 33.37 2vvh s ARG 91 CO 0.03 -0.03 -0.11 -1.54 -0.81 0.00 0.00 175.30 172.84 2vvh s SER 92 N -0.02 4.31 -0.22 -2.12 1.04 -0.41 -1.09 113.70 115.18 2vvh s SER 92 Ca -0.01 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.31 2vvh s SER 92 Cb -0.02 -1.00 0.03 0.00 0.10 0.00 0.00 66.02 65.14 2vvh s SER 92 CO 0.00 0.35 -0.14 -0.76 0.98 0.00 0.00 173.24 173.68 2vvh s LEU 93 N -0.75 2.80 -0.38 2.42 1.43 0.12 -1.99 118.68 122.32 2vvh s LEU 93 Ca 0.12 -0.93 -0.05 0.00 -1.03 0.00 0.00 54.13 52.23 2vvh s LEU 93 Cb -0.11 -1.55 0.08 0.00 0.03 0.00 0.00 46.19 44.65 2vvh s LEU 93 CO 0.01 -0.09 0.17 -0.89 0.23 0.00 0.00 176.35 175.78 2vvh s THR 94 N 1.24 3.56 0.37 5.49 2.01 0.12 -0.79 115.64 127.64 2vvh s THR 94 Ca -0.01 -1.62 -0.12 0.00 0.31 0.00 0.00 61.69 60.25 2vvh s THR 94 Cb -0.16 -3.23 -0.07 0.00 0.01 0.00 0.00 72.50 69.04 2vvh s THR 94 CO -0.08 -0.46 0.76 -0.36 -0.69 0.00 0.00 174.62 173.79 2vvh s PHE 95 N 1.28 3.43 -0.02 4.92 0.40 -0.17 -0.86 117.98 126.96 2vvh s PHE 95 Ca 0.03 1.12 0.31 0.00 -0.60 0.00 0.00 56.93 57.79 2vvh s PHE 95 Cb -0.22 -2.49 1.36 0.00 0.51 0.00 0.00 43.02 42.19 2vvh s PHE 95 CO -0.01 -0.03 1.93 1.05 0.70 0.00 0.00 175.22 178.86 2vvh h GLU 96 N 1.66 0.00 -0.68 0.44 4.11 -1.55 -2.61 114.58 115.96 2vvh h GLU 96 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 2vvh h GLU 96 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2vvh h GLU 96 CO 0.64 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.32 2vvh n ASP 97 N -2.80 4.69 0.00 3.06 5.75 -1.26 -4.93 116.55 121.06 2vvh n ASP 97 Ca 0.01 -2.37 0.00 0.00 -0.01 0.00 0.00 54.79 52.42 2vvh n ASP 97 Cb 0.24 -0.57 0.00 0.00 -1.03 0.00 0.00 41.12 39.76 2vvh n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vvh n GLY 98 N 1.27 1.56 3.72 6.12 0.00 -0.98 -4.72 105.19 112.17 2vvh n GLY 98 Ca 0.26 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 2vvh n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvh n GLY 99 N -1.90 1.31 2.85 -0.02 0.00 -1.19 -4.72 105.19 101.50 2vvh n GLY 99 Ca 0.00 0.54 -0.21 0.00 0.00 0.00 0.00 46.02 46.36 2vvh n GLY 99 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vvh s ILE 100 N 0.50 0.46 0.04 -0.61 -1.09 -0.59 -0.99 121.20 118.92 2vvh s ILE 100 Ca 0.70 -0.03 0.08 0.00 -2.23 0.00 0.00 60.65 59.17 2vvh s ILE 100 Cb -0.54 -0.54 -0.03 0.00 -1.58 0.00 0.00 42.46 39.77 2vvh s ILE 100 CO 0.42 0.23 -0.21 0.00 -1.23 0.00 0.00 174.94 174.15 2vvh s ILE 102 N -0.87 2.53 0.00 0.00 -5.25 0.42 0.13 121.20 118.16 2vvh s ILE 102 Ca 0.13 -1.87 -0.18 0.00 -0.99 0.00 0.00 60.65 57.75 2vvh s ILE 102 Cb -0.10 -2.20 0.03 0.00 2.95 0.00 0.00 42.46 43.14 2vvh s ILE 102 CO 0.04 -0.06 0.39 0.00 -1.79 0.00 0.00 174.94 173.52 2vvh s ALA 103 N -1.52 -0.98 0.03 2.27 0.00 -0.25 -0.95 121.76 120.36 2vvh s ALA 103 Ca 0.20 0.44 0.01 0.00 0.00 0.00 0.00 51.96 52.61 2vvh s ALA 103 Cb -0.09 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 2vvh s ALA 103 CO 0.10 -0.34 -0.05 1.03 0.00 0.00 0.00 175.76 176.50 2vvh s ARG 104 N -1.72 0.41 -0.08 0.00 0.52 -0.34 -0.46 118.95 117.27 2vvh s ARG 104 Ca -0.10 -0.70 -0.03 0.00 -0.52 0.00 0.00 55.73 54.37 2vvh s ARG 104 Cb -0.03 -0.04 0.04 0.00 0.52 0.00 0.00 34.95 35.44 2vvh s ARG 104 CO 0.03 -0.01 0.17 1.21 0.02 0.00 0.00 175.30 176.72 2vvh s ASN 105 N -1.58 0.23 -0.33 0.23 2.47 -0.69 -1.23 114.94 114.02 2vvh s ASN 105 Ca -0.12 0.36 -0.13 0.00 0.42 0.00 0.00 52.86 53.39 2vvh s ASN 105 Cb -0.09 0.29 -0.02 0.00 -1.45 0.00 0.00 41.25 39.98 2vvh s ASN 105 CO -0.01 -0.19 0.27 -1.81 -3.72 0.00 0.00 177.10 171.64 2vvh s ASP 106 N 1.70 6.09 -0.22 -4.21 1.01 -0.68 -1.41 116.67 118.95 2vvh s ASP 106 Ca -0.04 -0.31 -0.06 0.00 0.71 0.00 0.00 52.55 52.85 2vvh s ASP 106 Cb -0.12 -2.15 -0.03 0.00 1.01 0.00 0.00 42.92 41.63 2vvh s ASP 106 CO -0.06 -0.24 0.04 -0.63 0.21 0.00 0.00 175.17 174.48 2vvh s ILE 107 N 1.81 4.19 0.37 0.77 1.01 0.18 -1.90 121.20 127.63 2vvh s ILE 107 Ca 0.08 -0.23 0.04 0.00 0.00 0.00 0.00 60.65 60.55 2vvh s ILE 107 Cb -0.17 -2.92 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 2vvh s ILE 107 CO 0.11 0.39 0.05 0.42 0.00 0.00 0.00 174.94 175.91 2vvh s THR 108 N 1.21 1.31 -0.06 2.92 -4.23 -0.48 -2.18 115.64 114.14 2vvh s THR 108 Ca 0.04 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.52 2vvh s THR 108 Cb -0.14 -2.73 0.03 0.00 1.34 0.00 0.00 72.50 71.00 2vvh s THR 108 CO 0.02 0.00 0.13 -0.32 -0.54 0.00 0.00 174.62 173.92 2vvh s MET 109 N -3.82 0.10 -0.04 3.99 1.75 -1.26 -0.59 119.30 119.42 2vvh s MET 109 Ca 0.32 0.31 -0.00 0.00 -1.25 0.00 0.00 55.69 55.06 2vvh s MET 109 Cb 0.08 -0.12 0.03 0.00 2.84 0.00 0.00 34.83 37.65 2vvh s MET 109 CO 0.15 -0.13 0.00 -1.83 -0.65 0.00 0.00 175.02 172.56 2vvh s GLU 110 N 0.88 0.42 7.73 4.11 -1.05 -0.97 -4.95 118.70 124.86 2vvh s GLU 110 Ca -0.07 0.10 0.00 0.00 -0.15 0.00 0.00 54.97 54.85 2vvh s GLU 110 Cb -0.09 -0.68 0.00 0.00 -0.44 0.00 0.00 34.13 32.92 2vvh s GLU 110 CO -0.04 -0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.38 2vvh n GLY 111 N 4.57 3.26 1.55 -3.83 0.00 -1.26 -2.55 105.19 106.93 2vvh n GLY 111 Ca -0.18 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.77 2vvh n GLY 111 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vvh n ASP 112 N 6.25 5.10 -4.22 1.61 5.75 -1.26 -4.94 116.55 124.85 2vvh n ASP 112 Ca 0.00 -2.96 -0.32 0.00 -0.01 0.00 0.00 54.79 51.50 2vvh n ASP 112 Cb 0.00 -0.64 -0.17 0.00 -1.03 0.00 0.00 41.12 39.28 2vvh n ASP 112 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2vvh s THR 113 N -2.78 2.07 0.09 2.12 2.01 -1.06 -0.15 115.64 117.95 2vvh s THR 113 Ca 0.50 -1.02 -0.22 0.00 0.31 0.00 0.00 61.69 61.27 2vvh s THR 113 Cb 0.39 -1.79 -0.07 0.00 0.01 0.00 0.00 72.50 71.05 2vvh s THR 113 CO 0.14 0.56 0.67 -0.36 -0.69 0.00 0.00 174.62 174.93 2vvh s PHE 114 N 0.33 3.82 -0.09 4.92 0.08 0.15 -2.30 117.98 124.90 2vvh s PHE 114 Ca -0.19 1.41 0.02 0.00 0.12 0.00 0.00 56.93 58.30 2vvh s PHE 114 Cb -0.18 -2.64 -0.02 0.00 -0.57 0.00 0.00 43.02 39.61 2vvh s PHE 114 CO 0.09 0.50 -0.15 0.71 -0.10 0.00 0.00 175.22 176.27 2vvh s TYR 115 N -0.89 2.72 -0.20 0.36 1.51 0.24 -0.45 117.35 120.65 2vvh s TYR 115 Ca 0.33 -0.43 0.00 0.00 -1.01 0.00 0.00 57.07 55.96 2vvh s TYR 115 Cb -0.21 -1.72 0.05 0.00 -0.11 0.00 0.00 41.96 39.97 2vvh s TYR 115 CO 0.22 -0.03 -0.07 -0.80 -1.11 0.00 0.00 175.55 173.76 2vvh s ASN 116 N -0.21 3.32 -0.53 2.29 0.01 -0.32 -1.38 114.94 118.13 2vvh s ASN 116 Ca 0.00 -0.89 -0.18 0.00 -0.71 0.00 0.00 52.86 51.09 2vvh s ASN 116 Cb -0.13 -1.11 0.09 0.00 0.41 0.00 0.00 41.25 40.51 2vvh s ASN 116 CO 0.03 -0.18 0.57 -0.75 -1.51 0.00 0.00 177.10 175.26 2vvh s LYS 117 N 1.48 3.04 -0.11 -0.60 2.20 -0.80 -1.76 119.74 123.19 2vvh s LYS 117 Ca -0.02 -1.29 -0.01 0.00 -0.36 0.00 0.00 55.97 54.29 2vvh s LYS 117 Cb -0.17 -4.20 -0.03 0.00 -1.51 0.00 0.00 37.83 31.93 2vvh s LYS 117 CO -0.08 -1.29 -0.07 0.08 -0.36 0.00 0.00 175.35 173.63 2vvh s VAL 118 N 2.21 3.65 0.04 4.02 1.01 -0.49 -1.69 120.40 129.15 2vvh s VAL 118 Ca 0.09 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.68 2vvh s VAL 118 Cb -0.24 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 2vvh s VAL 118 CO 0.07 0.54 -0.23 -0.13 0.00 0.00 0.00 175.10 175.35 2vvh s ARG 119 N -0.12 1.56 -0.13 2.72 1.81 -0.37 -1.54 118.95 122.88 2vvh s ARG 119 Ca 0.01 -1.00 -0.05 0.00 -1.72 0.00 0.00 55.73 52.97 2vvh s ARG 119 Cb -0.13 -1.69 0.06 0.00 -0.45 0.00 0.00 34.95 32.74 2vvh s ARG 119 CO 0.03 0.44 0.28 0.12 -0.68 0.00 0.00 175.30 175.49 2vvh s PHE 120 N -0.79 -0.45 -0.05 -0.53 2.19 -0.90 -1.20 117.98 116.24 2vvh s PHE 120 Ca 0.09 1.01 0.02 0.00 0.33 0.00 0.00 56.93 58.38 2vvh s PHE 120 Cb -0.09 0.04 0.01 0.00 -1.31 0.00 0.00 43.02 41.67 2vvh s PHE 120 CO 0.02 -0.34 -0.09 -1.01 1.83 0.00 0.00 175.22 175.63 2vvh s HIS 121 N 2.09 1.13 -0.03 10.12 3.76 -0.12 -1.12 115.29 131.12 2vvh s HIS 121 Ca -0.02 -0.36 0.04 0.00 -0.15 0.00 0.00 55.06 54.56 2vvh s HIS 121 Cb -0.11 -0.86 -0.00 0.00 1.11 0.00 0.00 32.58 32.72 2vvh s HIS 121 CO -0.09 -0.20 -0.14 0.20 -0.85 0.00 0.00 174.74 173.65 2vvh s GLY 122 N 0.60 0.77 0.16 -2.22 0.00 -0.15 -0.44 107.32 106.04 2vvh s GLY 122 Ca -0.11 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.06 2vvh s GLY 122 CO 0.02 -0.34 -0.06 -1.34 0.00 0.00 0.00 173.10 171.38 2vvh s VAL 123 N -0.03 0.99 -1.57 1.40 -7.23 -0.03 -1.81 120.40 112.12 2vvh s VAL 123 Ca -0.01 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 2vvh s VAL 123 Cb -0.09 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.88 2vvh s VAL 123 CO 0.01 -0.64 0.00 0.59 -0.31 0.00 0.00 175.10 174.75 2vvh n ASN 124 N -0.22 -5.04 -4.68 4.85 3.02 -1.26 -1.54 115.26 110.38 2vvh n ASN 124 Ca -0.09 0.11 -0.43 0.00 -0.03 0.00 0.00 54.58 54.15 2vvh n ASN 124 Cb 0.62 -4.11 -0.02 0.00 -0.61 0.00 0.00 39.78 35.65 2vvh n ASN 124 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2vvh s PHE 125 N -2.79 3.37 0.34 3.10 0.08 -1.26 -3.20 117.98 117.62 2vvh s PHE 125 Ca 0.00 1.44 -0.29 0.00 0.12 0.00 0.00 56.93 58.21 2vvh s PHE 125 Cb 0.00 -3.28 -0.10 0.00 -0.57 0.00 0.00 43.02 39.07 2vvh s PHE 125 CO 0.00 -0.63 1.37 -2.14 -0.10 0.00 0.00 175.22 173.72 2vvh s PRO 126 N 2.27 4.27 0.31 0.24 0.02 -1.26 -4.91 135.00 135.94 2vvh s PRO 126 Ca 0.50 2.33 0.07 0.00 0.02 0.00 0.00 61.00 63.93 2vvh s PRO 126 Cb -0.20 -3.04 0.79 0.00 0.02 0.00 0.00 34.50 32.07 2vvh s PRO 126 CO 0.18 -0.31 1.77 0.00 -0.33 0.00 0.00 177.00 178.31 2vvh h ALA 127 N 3.37 1.72 -0.52 -1.55 0.00 -1.99 -1.37 119.26 118.93 2vvh h ALA 127 Ca -0.49 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2vvh h ALA 127 Cb 1.23 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2vvh h ALA 127 CO 0.66 -0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.88 2vvh n ASN 128 N -4.78 4.74 -4.89 0.00 3.02 -1.26 -4.36 115.26 107.72 2vvh n ASN 128 Ca 0.24 -2.68 -0.30 0.00 -0.03 0.00 0.00 54.58 51.82 2vvh n ASN 128 Cb 0.62 -0.58 0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2vvh n ASN 128 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2vvh s GLY 129 N -1.10 1.61 0.61 7.41 0.00 -0.52 -4.87 107.32 110.47 2vvh s GLY 129 Ca 0.48 -0.46 0.36 0.00 0.00 0.00 0.00 44.72 45.10 2vvh s GLY 129 CO 0.18 -0.04 2.27 -0.56 0.00 0.00 0.00 173.10 174.95 2vvh h PRO 130 N -0.81 0.00 0.10 2.90 0.13 -1.94 -1.91 132.00 130.47 2vvh h PRO 130 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2vvh h PRO 130 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2vvh h PRO 130 CO 0.65 0.02 -0.05 0.28 -0.23 0.00 0.00 178.00 178.67 2vvh h VAL 131 N 0.00 0.90 0.00 1.56 2.07 -1.93 0.15 116.25 119.00 2vvh h VAL 131 Ca -0.00 -1.38 -0.04 0.00 0.82 0.00 0.00 66.70 66.11 2vvh h VAL 131 Cb 0.07 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2vvh h VAL 131 CO 0.00 0.27 -0.18 0.24 0.02 0.00 0.00 177.57 177.92 2vvh h MET 132 N -0.92 0.00 -0.01 1.57 2.86 -1.78 0.16 114.93 116.81 2vvh h MET 132 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2vvh h MET 132 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 2vvh h MET 132 CO 0.02 0.18 -0.15 1.04 1.06 0.00 0.00 176.91 179.06 2vvh n GLN 133 N -3.34 1.42 -3.61 1.72 1.13 -0.73 -4.70 117.38 109.27 2vvh n GLN 133 Ca 0.00 -0.95 -0.26 0.00 -1.94 0.00 0.00 57.00 53.86 2vvh n GLN 133 Cb 0.41 -1.48 0.04 0.00 0.11 0.00 0.00 30.24 29.32 2vvh n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2vvh n LYS 134 N 0.04 -2.22 -0.21 -1.09 5.02 -0.81 -4.93 118.16 113.96 2vvh n LYS 134 Ca 0.15 0.57 0.07 0.00 -2.02 0.00 0.00 58.31 57.07 2vvh n LYS 134 Cb 0.40 -4.68 0.18 0.00 -0.02 0.00 0.00 35.03 30.91 2vvh n LYS 134 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2vvh n LYS 135 N -4.02 2.82 -3.14 1.97 4.76 0.46 -5.01 118.16 116.00 2vvh n LYS 135 Ca -0.14 -2.14 -0.33 0.00 -2.87 0.00 0.00 58.31 52.83 2vvh n LYS 135 Cb 0.62 -1.32 -0.06 0.00 -1.84 0.00 0.00 35.03 32.43 2vvh n LYS 135 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2vvh s THR 136 N -1.00 4.68 -0.12 -0.18 -4.23 -1.25 -1.08 115.64 112.45 2vvh s THR 136 Ca 0.27 0.96 -0.03 0.00 -1.18 0.00 0.00 61.69 61.71 2vvh s THR 136 Cb 0.14 -3.62 -0.06 0.00 1.34 0.00 0.00 72.50 70.31 2vvh s THR 136 CO 0.19 -0.17 -0.13 0.18 -0.54 0.00 0.00 174.62 174.14 2vvh n LEU 137 N -0.33 1.64 -3.55 4.79 4.77 0.15 -4.82 117.00 119.66 2vvh n LEU 137 Ca 0.03 0.07 -0.07 0.00 -0.03 0.00 0.00 56.01 56.01 2vvh n LEU 137 Cb 0.53 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 41.23 2vvh n LEU 137 CO 0.41 0.41 0.82 -1.59 -1.33 0.00 0.00 177.39 176.11 2vvh s LYS 138 N -2.22 0.60 0.16 3.23 -2.85 -1.20 -4.98 119.74 112.48 2vvh s LYS 138 Ca -0.16 -0.19 -0.30 0.00 -1.00 0.00 0.00 55.97 54.32 2vvh s LYS 138 Cb 0.05 0.28 -0.07 0.00 -2.06 0.00 0.00 37.83 36.03 2vvh s LYS 138 CO 0.23 -0.26 1.07 -1.58 0.10 0.00 0.00 175.35 174.91 2vvh s TRP 139 N -2.65 3.65 0.60 1.78 0.52 -1.26 -0.34 118.94 121.24 2vvh s TRP 139 Ca 0.06 1.64 -0.15 0.00 0.02 0.00 0.00 56.10 57.67 2vvh s TRP 139 Cb -0.01 -3.22 -0.03 0.00 -1.15 0.00 0.00 33.47 29.06 2vvh s TRP 139 CO -0.06 -0.42 1.06 -1.21 0.02 0.00 0.00 176.95 176.34 2vvh s GLU 140 N -0.27 3.27 0.37 4.98 0.41 -0.22 -4.71 118.70 122.53 2vvh s GLU 140 Ca 0.49 1.19 -0.28 0.00 -0.41 0.00 0.00 54.97 55.97 2vvh s GLU 140 Cb -0.28 -2.03 -0.11 0.00 -1.78 0.00 0.00 34.13 29.93 2vvh s GLU 140 CO 0.33 -0.85 1.39 -0.35 -0.49 0.00 0.00 175.26 175.30 2vvh n PRO 141 N -2.11 2.40 -4.43 0.39 -0.04 -1.26 -4.73 135.00 125.20 2vvh n PRO 141 Ca 0.09 0.84 -0.21 0.00 -0.04 0.00 0.00 63.50 64.18 2vvh n PRO 141 Cb 0.53 -2.51 -0.11 0.00 -0.04 0.00 0.00 33.50 31.37 2vvh n PRO 141 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2vvh s SER 142 N -0.23 2.23 -0.13 3.54 1.04 -0.78 -4.97 113.70 114.40 2vvh s SER 142 Ca 0.55 -1.37 -0.01 0.00 0.48 0.00 0.00 55.95 55.60 2vvh s SER 142 Cb -0.52 -0.06 0.03 0.00 0.10 0.00 0.00 66.02 65.58 2vvh s SER 142 CO 0.63 -0.62 -0.05 -0.89 0.98 0.00 0.00 173.24 173.29 2vvh s THR 143 N -3.35 0.94 -0.09 2.02 2.01 -1.26 -0.74 115.64 115.17 2vvh s THR 143 Ca 0.37 -0.36 -0.24 0.00 0.31 0.00 0.00 61.69 61.77 2vvh s THR 143 Cb 0.09 -1.05 -0.03 0.00 0.01 0.00 0.00 72.50 71.51 2vvh s THR 143 CO 0.15 0.25 0.76 -0.70 -0.69 0.00 0.00 174.62 174.39 2vvh s GLU 144 N 1.73 4.40 -0.37 4.92 2.12 0.68 -4.60 118.70 127.58 2vvh s GLU 144 Ca 0.03 0.95 -0.18 0.00 0.36 0.00 0.00 54.97 56.14 2vvh s GLU 144 Cb -0.14 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2vvh s GLU 144 CO -0.08 -0.07 0.51 0.15 -0.54 0.00 0.00 175.26 175.24 2vvh s LYS 145 N 1.25 3.51 -0.23 4.30 3.01 0.13 -0.61 119.74 131.11 2vvh s LYS 145 Ca 0.39 -0.28 -0.09 0.00 -1.01 0.00 0.00 55.97 54.98 2vvh s LYS 145 Cb -0.18 -3.85 -0.05 0.00 -1.01 0.00 0.00 37.83 32.75 2vvh s LYS 145 CO 0.17 -0.71 0.13 -1.64 0.51 0.00 0.00 175.35 173.81 2vvh s MET 146 N 2.40 4.00 0.14 1.68 -1.94 0.39 -1.19 119.30 124.77 2vvh s MET 146 Ca 0.18 -0.31 -0.16 0.00 -1.71 0.00 0.00 55.69 53.69 2vvh s MET 146 Cb -0.16 -3.44 0.03 0.00 2.01 0.00 0.00 34.83 33.27 2vvh s MET 146 CO 0.14 0.08 0.41 1.52 -0.01 0.00 0.00 175.02 177.16 2vvh s TYR 147 N 0.97 -0.14 -0.11 -0.03 -0.85 -0.02 -1.81 117.35 115.36 2vvh s TYR 147 Ca 0.06 -0.19 -0.18 0.00 -0.52 0.00 0.00 57.07 56.24 2vvh s TYR 147 Cb -0.13 0.25 -0.04 0.00 0.38 0.00 0.00 41.96 42.42 2vvh s TYR 147 CO 0.03 -0.74 0.49 0.08 -1.52 0.00 0.00 175.55 173.89 2vvh s VAL 148 N -3.83 5.17 -0.05 -3.49 1.01 -1.26 -0.01 120.40 117.93 2vvh s VAL 148 Ca 0.05 0.98 -0.00 0.00 0.00 0.00 0.00 61.98 63.00 2vvh s VAL 148 Cb 0.01 -3.82 0.03 0.00 0.00 0.00 0.00 36.38 32.60 2vvh s VAL 148 CO -0.10 0.33 -0.01 -0.60 0.00 0.00 0.00 175.10 174.73 2vvh s ARG 149 N 0.55 0.53 -1.44 2.72 6.06 -0.24 -4.86 118.95 122.27 2vvh s ARG 149 Ca 0.26 0.07 -0.00 0.00 -2.50 0.00 0.00 55.73 53.56 2vvh s ARG 149 Cb -0.15 -0.79 0.00 0.00 0.06 0.00 0.00 34.95 34.07 2vvh s ARG 149 CO 0.11 -0.21 0.31 -3.47 -2.50 0.00 0.00 175.30 169.54 2vvh n ASP 150 N 4.65 0.02 0.00 -2.12 2.03 -1.26 -1.65 116.55 118.22 2vvh n ASP 150 Ca -0.16 -1.07 0.00 0.00 0.52 0.00 0.00 54.79 54.08 2vvh n ASP 150 Cb 0.50 -2.69 0.00 0.00 -0.72 0.00 0.00 41.12 38.21 2vvh n ASP 150 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2vvh n GLY 151 N -2.14 0.58 3.09 0.27 0.00 -1.26 -5.01 105.19 100.72 2vvh n GLY 151 Ca -0.32 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.44 2vvh n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vvh s VAL 152 N -2.48 1.39 0.06 1.61 1.01 -0.66 -5.08 120.40 116.25 2vvh s VAL 152 Ca 0.00 -0.64 -0.31 0.00 0.00 0.00 0.00 61.98 61.04 2vvh s VAL 152 Cb 0.00 -1.23 -0.08 0.00 0.00 0.00 0.00 36.38 35.07 2vvh s VAL 152 CO 0.00 0.41 1.61 -0.22 0.00 0.00 0.00 175.10 176.90 2vvh s LEU 153 N 0.49 4.36 -0.04 3.92 2.96 -1.24 -1.08 118.68 128.05 2vvh s LEU 153 Ca -0.14 2.42 0.04 0.00 -0.22 0.00 0.00 54.13 56.23 2vvh s LEU 153 Cb -0.16 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 42.97 2vvh s LEU 153 CO 0.05 -0.86 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.18 2vvh s THR 154 N 2.58 1.25 -0.18 3.68 2.01 0.98 -0.39 115.64 125.57 2vvh s THR 154 Ca 0.72 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 62.11 2vvh s THR 154 Cb -0.38 -1.08 0.02 0.00 0.01 0.00 0.00 72.50 71.07 2vvh s THR 154 CO 0.31 0.36 -0.20 -0.83 -0.69 0.00 0.00 174.62 173.58 2vvh s GLY 155 N 0.05 1.37 -0.09 4.40 0.00 0.25 -0.84 107.32 112.46 2vvh s GLY 155 Ca -0.03 -1.19 -0.02 0.00 0.00 0.00 0.00 44.72 43.48 2vvh s GLY 155 CO 0.01 0.27 -0.02 0.99 0.00 0.00 0.00 173.10 174.36 2vvh s ASP 156 N 1.26 5.08 -0.02 1.64 1.01 -0.33 -0.94 116.67 124.37 2vvh s ASP 156 Ca 0.04 0.08 0.00 0.00 0.71 0.00 0.00 52.55 53.38 2vvh s ASP 156 Cb -0.13 -1.47 0.03 0.00 1.01 0.00 0.00 42.92 42.36 2vvh s ASP 156 CO -0.12 0.34 0.02 -0.63 0.21 0.00 0.00 175.17 174.99 2vvh s ILE 157 N -0.67 0.03 -0.52 0.77 1.01 -0.26 -0.69 121.20 120.86 2vvh s ILE 157 Ca 0.11 0.14 -0.22 0.00 0.00 0.00 0.00 60.65 60.68 2vvh s ILE 157 Cb -0.12 -0.14 0.05 0.00 0.01 0.00 0.00 42.46 42.26 2vvh s ILE 157 CO 0.02 0.10 0.78 0.42 0.00 0.00 0.00 174.94 176.26 2vvh s THR 158 N 0.91 4.64 0.29 2.92 -4.23 -1.26 -1.27 115.64 117.65 2vvh s THR 158 Ca -0.08 -0.09 0.08 0.00 -1.18 0.00 0.00 61.69 60.41 2vvh s THR 158 Cb -0.12 -4.41 -0.03 0.00 1.34 0.00 0.00 72.50 69.28 2vvh s THR 158 CO -0.02 -0.94 0.21 -0.04 -0.54 0.00 0.00 174.62 173.28 2vvh s MET 159 N 3.27 2.76 -0.14 3.99 1.00 0.62 -4.77 119.30 126.02 2vvh s MET 159 Ca 0.23 -1.21 -0.07 0.00 0.00 0.00 0.00 55.69 54.64 2vvh s MET 159 Cb -0.16 -2.47 0.05 0.00 0.00 0.00 0.00 34.83 32.26 2vvh s MET 159 CO 0.16 0.27 0.32 0.00 0.00 0.00 0.00 175.02 175.76 2vvh s ALA 160 N -2.23 -0.78 -0.15 3.03 0.00 -1.26 -1.70 121.76 118.66 2vvh s ALA 160 Ca 0.36 1.23 -0.19 0.00 0.00 0.00 0.00 51.96 53.36 2vvh s ALA 160 Cb -0.07 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 2vvh s ALA 160 CO 0.25 -0.28 0.52 -0.51 0.00 0.00 0.00 175.76 175.74 2vvh s LEU 161 N 1.46 4.21 0.19 0.00 1.43 0.25 -1.05 118.68 125.17 2vvh s LEU 161 Ca -0.08 0.79 -0.30 0.00 -1.03 0.00 0.00 54.13 53.50 2vvh s LEU 161 Cb -0.10 -2.75 -0.08 0.00 0.03 0.00 0.00 46.19 43.30 2vvh s LEU 161 CO -0.10 -0.11 1.19 -0.22 0.23 0.00 0.00 176.35 177.34 2vvh s LEU 162 N 1.16 4.45 0.30 1.79 2.96 0.54 -0.47 118.68 129.42 2vvh s LEU 162 Ca 0.26 2.23 0.09 0.00 -0.22 0.00 0.00 54.13 56.49 2vvh s LEU 162 Cb -0.15 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 2vvh s LEU 162 CO 0.11 -0.36 0.10 -0.76 -1.32 0.00 0.00 176.35 174.11 2vvh s LEU 163 N -0.29 3.30 0.29 -0.68 1.43 -0.18 0.34 118.68 122.89 2vvh s LEU 163 Ca 0.52 -0.67 -0.30 0.00 -1.03 0.00 0.00 54.13 52.65 2vvh s LEU 163 Cb -0.33 -1.80 -0.12 0.00 0.03 0.00 0.00 46.19 43.98 2vvh s LEU 163 CO 0.37 -0.17 1.57 -0.62 0.23 0.00 0.00 176.35 177.73 2vvh n GLU 164 N -1.06 2.61 -0.42 1.70 1.02 -0.24 -1.37 120.64 122.87 2vvh n GLU 164 Ca -0.05 0.93 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 2vvh n GLU 164 Cb 0.60 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.33 2vvh n GLU 164 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vvh n GLY 165 N 2.12 0.71 2.46 0.62 0.00 -1.26 -4.47 105.19 105.37 2vvh n GLY 165 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 2vvh n GLY 165 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vvh n ASN 166 N 0.00 -4.41 -4.77 1.61 3.02 -0.47 -5.03 115.26 105.21 2vvh n ASN 166 Ca 0.00 0.02 -0.30 0.00 -0.03 0.00 0.00 54.58 54.27 2vvh n ASN 166 Cb 0.00 -1.98 0.11 0.00 -0.61 0.00 0.00 39.78 37.30 2vvh n ASN 166 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vvh s ALA 167 N -1.59 1.99 0.22 5.41 0.00 -1.25 -4.81 121.76 121.72 2vvh s ALA 167 Ca 0.00 -0.18 0.10 0.00 0.00 0.00 0.00 51.96 51.88 2vvh s ALA 167 Cb 0.00 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 2vvh s ALA 167 CO 0.00 -1.97 -0.10 -1.01 0.00 0.00 0.00 175.76 172.68 2vvh s HIS 168 N -3.09 2.56 -0.18 0.00 3.76 -1.26 -1.01 115.29 116.06 2vvh s HIS 168 Ca 0.62 -0.25 -0.01 0.00 -0.15 0.00 0.00 55.06 55.27 2vvh s HIS 168 Cb -0.16 -1.20 0.05 0.00 1.11 0.00 0.00 32.58 32.38 2vvh s HIS 168 CO 0.55 0.57 -0.03 -0.47 -0.85 0.00 0.00 174.74 174.51 2vvh s TYR 169 N -1.99 1.62 0.17 1.40 5.04 0.38 -4.94 117.35 119.03 2vvh s TYR 169 Ca 0.27 -1.10 -0.22 0.00 -2.44 0.00 0.00 57.07 53.58 2vvh s TYR 169 Cb -0.07 -1.27 -0.08 0.00 0.35 0.00 0.00 41.96 40.89 2vvh s TYR 169 CO 0.16 -0.63 0.71 1.03 -1.34 0.00 0.00 175.55 175.48 2vvh s ARG 170 N 1.66 4.36 -0.03 4.97 1.81 -1.26 -0.58 118.95 129.87 2vvh s ARG 170 Ca -0.01 0.95 -0.01 0.00 -1.72 0.00 0.00 55.73 54.94 2vvh s ARG 170 Cb -0.16 -3.10 0.03 0.00 -0.45 0.00 0.00 34.95 31.27 2vvh s ARG 170 CO -0.07 0.52 0.07 0.00 -0.68 0.00 0.00 175.30 175.13 2vvh s ASP 172 N 0.90 5.73 -0.12 0.00 1.01 -0.04 -0.28 116.67 123.88 2vvh s ASP 172 Ca -0.07 0.11 -0.00 0.00 0.71 0.00 0.00 52.55 53.30 2vvh s ASP 172 Cb -0.10 -1.98 -0.02 0.00 1.01 0.00 0.00 42.92 41.83 2vvh s ASP 172 CO -0.03 0.18 -0.12 -0.55 0.21 0.00 0.00 175.17 174.86 2vvh s SER 173 N 0.32 4.16 -0.12 0.27 0.15 -0.39 -0.70 113.70 117.39 2vvh s SER 173 Ca 0.04 -0.27 0.01 0.00 0.70 0.00 0.00 55.95 56.44 2vvh s SER 173 Cb -0.12 -1.51 0.02 0.00 -1.71 0.00 0.00 66.02 62.69 2vvh s SER 173 CO -0.00 0.20 -0.16 -0.60 1.20 0.00 0.00 173.24 173.88 2vvh s ARG 174 N 0.15 2.34 -0.06 5.44 3.52 -0.84 -1.10 118.95 128.39 2vvh s ARG 174 Ca -0.06 -0.60 0.04 0.00 -0.13 0.00 0.00 55.73 54.99 2vvh s ARG 174 Cb -0.15 -2.01 -0.02 0.00 -1.56 0.00 0.00 34.95 31.22 2vvh s ARG 174 CO 0.04 -0.10 -0.19 0.99 -0.81 0.00 0.00 175.30 175.24 2vvh s THR 175 N 1.08 2.65 -0.16 4.11 2.01 -0.11 -1.29 115.64 123.92 2vvh s THR 175 Ca -0.04 -0.86 -0.03 0.00 0.31 0.00 0.00 61.69 61.07 2vvh s THR 175 Cb -0.14 -2.02 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 2vvh s THR 175 CO -0.04 0.57 -0.04 0.42 -0.69 0.00 0.00 174.62 174.84 2vvh s THR 176 N -0.37 3.81 -0.15 -0.82 -4.23 0.08 -0.58 115.64 113.38 2vvh s THR 176 Ca 0.03 -0.39 -0.01 0.00 -1.18 0.00 0.00 61.69 60.14 2vvh s THR 176 Cb -0.12 -2.67 -0.02 0.00 1.34 0.00 0.00 72.50 71.03 2vvh s THR 176 CO 0.02 0.49 -0.10 -0.31 -0.54 0.00 0.00 174.62 174.18 2vvh s TYR 177 N 0.45 2.87 -0.14 3.99 2.02 0.48 -1.68 117.35 125.34 2vvh s TYR 177 Ca -0.04 -0.64 -0.01 0.00 -0.37 0.00 0.00 57.07 56.00 2vvh s TYR 177 Cb -0.14 -1.90 0.04 0.00 -0.40 0.00 0.00 41.96 39.55 2vvh s TYR 177 CO 0.03 -0.24 -0.02 0.15 -1.57 0.00 0.00 175.55 173.90 2vvh s LYS 178 N 0.53 1.04 0.45 -0.62 1.02 -0.01 -3.63 119.74 118.51 2vvh s LYS 178 Ca -0.07 -0.29 -0.24 0.00 0.02 0.00 0.00 55.97 55.38 2vvh s LYS 178 Cb -0.15 -1.70 -0.08 0.00 -0.52 0.00 0.00 37.83 35.38 2vvh s LYS 178 CO 0.04 -0.43 1.26 0.00 -0.92 0.00 0.00 175.35 175.30 2vvh s ALA 179 N 1.79 3.08 0.09 5.17 0.00 -1.26 -1.10 121.76 129.53 2vvh s ALA 179 Ca 0.02 1.13 -0.15 0.00 0.00 0.00 0.00 51.96 52.96 2vvh s ALA 179 Cb -0.15 -3.46 -0.12 0.00 0.00 0.00 0.00 23.12 19.40 2vvh s ALA 179 CO -0.07 -0.84 1.36 -0.22 0.00 0.00 0.00 175.76 175.99 2vvh h LYS 180 N 2.27 0.69 -6.57 0.00 3.11 -1.60 -3.44 116.57 111.03 2vvh h LYS 180 Ca -0.50 -0.44 -0.52 0.00 -2.81 0.00 0.00 60.65 56.39 2vvh h LYS 180 Cb 1.25 0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 32.51 2vvh h LYS 180 CO 0.61 1.06 0.30 -2.00 -2.81 0.00 0.00 179.45 176.61 2vvh s GLU 181 N -4.09 4.69 0.53 1.90 2.12 -1.26 -5.04 118.70 117.55 2vvh s GLU 181 Ca -0.12 1.36 -0.20 0.00 0.36 0.00 0.00 54.97 56.38 2vvh s GLU 181 Cb 0.08 -3.33 -0.07 0.00 0.26 0.00 0.00 34.13 31.07 2vvh s GLU 181 CO 0.84 0.35 1.09 0.15 -0.54 0.00 0.00 175.26 177.16 2vvh s LYS 182 N -0.47 3.51 0.00 4.30 1.02 -1.26 -4.00 119.74 122.84 2vvh s LYS 182 Ca 0.43 1.51 0.00 0.00 0.02 0.00 0.00 55.97 57.92 2vvh s LYS 182 Cb -0.24 -2.04 0.00 0.00 -0.52 0.00 0.00 37.83 35.04 2vvh s LYS 182 CO 0.29 -0.70 0.00 0.41 -0.92 0.00 0.00 175.35 174.42 2vvh n GLY 183 N -0.03 0.64 3.67 -3.33 0.00 -1.26 -5.02 105.19 99.85 2vvh n GLY 183 Ca 0.11 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2vvh n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vvh s VAL 184 N -2.00 4.17 0.15 1.61 1.01 -1.26 -4.95 120.40 119.13 2vvh s VAL 184 Ca 0.00 1.44 -0.31 0.00 0.00 0.00 0.00 61.98 63.10 2vvh s VAL 184 Cb 0.00 -3.93 -0.10 0.00 0.00 0.00 0.00 36.38 32.35 2vvh s VAL 184 CO 0.00 -0.10 1.69 -0.75 0.00 0.00 0.00 175.10 175.93 2vvh s LYS 185 N 3.31 4.17 0.25 2.72 2.20 -1.26 -4.98 119.74 126.15 2vvh s LYS 185 Ca 0.57 2.48 -0.30 0.00 -0.36 0.00 0.00 55.97 58.37 2vvh s LYS 185 Cb -0.24 -3.31 -0.09 0.00 -1.51 0.00 0.00 37.83 32.68 2vvh s LYS 185 CO 0.18 -0.72 0.96 -0.51 -0.36 0.00 0.00 175.35 174.89 2vvh s LEU 186 N 1.77 4.61 0.76 5.43 1.43 -1.26 -4.73 118.68 126.68 2vvh s LEU 186 Ca 0.74 1.98 -0.12 0.00 -1.03 0.00 0.00 54.13 55.71 2vvh s LEU 186 Cb -0.45 -3.65 0.05 0.00 0.03 0.00 0.00 46.19 42.16 2vvh s LEU 186 CO 0.33 0.10 1.12 -2.16 0.23 0.00 0.00 176.35 175.97 2vvh s PRO 187 N -1.29 2.43 0.91 1.29 0.04 -1.26 -5.02 135.00 132.09 2vvh s PRO 187 Ca 0.42 0.40 -0.15 0.00 0.04 0.00 0.00 61.00 61.72 2vvh s PRO 187 Cb -0.26 -1.98 0.16 0.00 0.04 0.00 0.00 34.50 32.46 2vvh s PRO 187 CO 0.32 -1.33 1.27 0.20 0.04 0.00 0.00 177.00 177.51 2vvh s GLY 188 N -4.32 1.71 0.21 0.56 0.00 -1.26 -4.74 107.32 99.48 2vvh s GLY 188 Ca 0.60 -1.00 -0.32 0.00 0.00 0.00 0.00 44.72 44.00 2vvh s GLY 188 CO 0.52 -0.33 1.38 2.98 0.00 0.00 0.00 173.10 177.64 2vvh n TYR 189 N -3.61 1.98 -3.90 1.90 9.36 -1.26 -4.82 117.16 116.80 2vvh n TYR 189 Ca 0.13 0.47 -0.10 0.00 3.32 0.00 0.00 57.90 61.72 2vvh n TYR 189 Cb 0.60 -2.43 -0.01 0.00 -0.63 0.00 0.00 39.34 36.87 2vvh n TYR 189 CO 0.00 0.00 0.00 -3.38 0.22 0.00 0.00 176.86 173.70 2vvh s HIS 190 N 0.07 0.30 0.08 2.98 -3.43 -0.75 -4.99 115.29 109.54 2vvh s HIS 190 Ca 0.71 -0.80 0.10 0.00 -0.80 0.00 0.00 55.06 54.27 2vvh s HIS 190 Cb -0.71 0.54 -0.03 0.00 -1.43 0.00 0.00 32.58 30.95 2vvh s HIS 190 CO 0.48 -1.35 -0.26 -0.51 -2.00 0.00 0.00 174.74 171.11 2vvh s LEU 191 N -3.07 2.24 -0.20 5.38 1.02 -0.40 -0.46 118.68 123.18 2vvh s LEU 191 Ca 0.19 -0.66 -0.01 0.00 0.02 0.00 0.00 54.13 53.68 2vvh s LEU 191 Cb -0.04 -1.21 0.05 0.00 0.02 0.00 0.00 46.19 45.01 2vvh s LEU 191 CO 0.12 0.21 -0.03 -0.69 0.02 0.00 0.00 176.35 175.98 2vvh s VAL 192 N -0.93 1.11 0.27 -1.59 1.01 0.22 -0.68 120.40 119.81 2vvh s VAL 192 Ca 0.12 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 2vvh s VAL 192 Cb -0.10 -1.40 -0.09 0.00 0.00 0.00 0.00 36.38 34.78 2vvh s VAL 192 CO 0.04 -0.05 1.16 -1.81 0.00 0.00 0.00 175.10 174.44 2vvh s ASP 193 N 1.61 7.14 0.06 3.32 1.01 -0.01 -0.23 116.67 129.57 2vvh s ASP 193 Ca -0.02 2.34 0.06 0.00 0.71 0.00 0.00 52.55 55.64 2vvh s ASP 193 Cb -0.17 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.10 2vvh s ASP 193 CO -0.07 -0.26 -0.15 -1.00 0.21 0.00 0.00 175.17 173.90 2vvh s HIS 194 N -0.96 1.32 -0.03 4.23 3.76 0.09 -1.44 115.29 122.26 2vvh s HIS 194 Ca 0.47 -0.41 0.01 0.00 -0.15 0.00 0.00 55.06 54.97 2vvh s HIS 194 Cb -0.34 -0.76 0.02 0.00 1.11 0.00 0.00 32.58 32.62 2vvh s HIS 194 CO 0.42 0.07 -0.01 0.00 -0.85 0.00 0.00 174.74 174.38 2vvh s ILE 196 N 0.84 1.10 -0.14 0.00 2.07 -1.26 -1.51 121.20 122.30 2vvh s ILE 196 Ca -0.09 -0.65 -0.08 0.00 -1.41 0.00 0.00 60.65 58.43 2vvh s ILE 196 Cb -0.12 -0.93 0.05 0.00 0.13 0.00 0.00 42.46 41.59 2vvh s ILE 196 CO -0.01 0.27 0.34 -0.70 -1.91 0.00 0.00 174.94 172.93 2vvh s GLU 197 N -0.43 0.32 -0.53 3.50 2.12 -0.14 -4.57 118.70 118.98 2vvh s GLU 197 Ca 0.05 0.66 -0.28 0.00 0.36 0.00 0.00 54.97 55.75 2vvh s GLU 197 Cb -0.06 -0.04 0.03 0.00 0.26 0.00 0.00 34.13 34.33 2vvh s GLU 197 CO -0.00 -0.15 1.15 0.42 -0.54 0.00 0.00 175.26 176.14 2vvh s ILE 198 N 1.21 4.13 0.13 -3.70 1.01 -1.26 -0.87 121.20 121.85 2vvh s ILE 198 Ca -0.08 1.04 -0.10 0.00 0.00 0.00 0.00 60.65 61.51 2vvh s ILE 198 Cb -0.08 -4.66 -0.11 0.00 0.01 0.00 0.00 42.46 37.61 2vvh s ILE 198 CO -0.10 -1.16 1.38 -0.07 0.00 0.00 0.00 174.94 174.99 2vvh h LEU 199 N 11.52 0.89 -7.25 2.97 3.38 -1.08 -3.47 115.31 122.28 2vvh h LEU 199 Ca -0.24 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.17 2vvh h LEU 199 Cb 1.06 -0.26 -0.12 0.00 0.09 0.00 0.00 40.66 41.43 2vvh h LEU 199 CO 1.15 1.32 0.07 -0.94 0.09 0.00 0.00 178.44 180.13 2vvh s SER 200 N -7.02 -0.39 0.01 -0.43 1.04 -1.20 -5.00 113.70 100.71 2vvh s SER 200 Ca -0.10 -0.19 -0.28 0.00 0.48 0.00 0.00 55.95 55.86 2vvh s SER 200 Cb 0.10 0.54 0.09 0.00 0.10 0.00 0.00 66.02 66.85 2vvh s SER 200 CO 0.89 -0.93 0.75 -1.38 0.98 0.00 0.00 173.24 173.55 2vvh s HIS 201 N -3.79 -0.50 0.85 5.02 -3.43 -1.26 -0.77 115.29 111.40 2vvh s HIS 201 Ca 0.03 0.58 -0.12 0.00 -0.80 0.00 0.00 55.06 54.74 2vvh s HIS 201 Cb 0.00 0.50 0.12 0.00 -1.43 0.00 0.00 32.58 31.77 2vvh s HIS 201 CO -0.11 -0.63 1.20 0.16 -2.00 0.00 0.00 174.74 173.36 2vvh s ASP 202 N -1.99 4.04 0.26 7.38 1.47 -0.81 -4.95 116.67 122.07 2vvh s ASP 202 Ca -0.02 0.51 -0.01 0.00 1.18 0.00 0.00 52.55 54.22 2vvh s ASP 202 Cb -0.01 -0.86 0.55 0.00 -0.34 0.00 0.00 42.92 42.27 2vvh s ASP 202 CO -0.03 -2.17 1.75 0.50 0.68 0.00 0.00 175.17 175.90 2vvh h LYS 203 N -1.19 0.57 -0.43 2.11 3.64 -2.02 -1.89 116.57 117.35 2vvh h LYS 203 Ca -0.45 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2vvh h LYS 203 Cb 1.29 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2vvh h LYS 203 CO 0.54 0.37 0.00 -0.25 -2.27 0.00 0.00 179.45 177.85 2vvh n ASP 204 N -4.90 3.06 -2.38 4.20 8.00 -1.26 -4.94 116.55 118.33 2vvh n ASP 204 Ca 0.17 -1.95 -0.19 0.00 0.71 0.00 0.00 54.79 53.54 2vvh n ASP 204 Cb 0.46 -0.28 -0.01 0.00 -0.02 0.00 0.00 41.12 41.27 2vvh n ASP 204 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2vvh n TYR 205 N 1.21 -1.06 0.15 1.24 4.02 -0.71 -4.32 117.16 117.69 2vvh n TYR 205 Ca 0.19 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 58.10 2vvh n TYR 205 Cb 0.52 -3.73 0.20 0.00 -0.02 0.00 0.00 39.34 36.32 2vvh n TYR 205 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2vvh h ASN 206 N 0.00 0.00 -3.38 7.72 2.35 -1.92 -3.43 115.58 116.92 2vvh h ASN 206 Ca -0.46 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 54.77 2vvh h ASN 206 Cb 1.34 0.00 -0.34 0.00 0.05 0.00 0.00 38.32 39.37 2vvh h ASN 206 CO 0.54 0.54 -0.82 -0.54 -1.65 0.00 0.00 177.43 175.50 2vvh s LYS 207 N -3.46 1.78 -0.01 0.81 1.02 -1.26 -0.91 119.74 117.71 2vvh s LYS 207 Ca -0.00 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.57 2vvh s LYS 207 Cb 0.11 -1.50 0.01 0.00 -0.52 0.00 0.00 37.83 35.93 2vvh s LYS 207 CO 0.73 -0.01 -0.00 0.08 -0.92 0.00 0.00 175.35 175.23 2vvh s VAL 208 N 0.79 0.08 -0.27 3.17 1.01 -0.78 -1.92 120.40 122.47 2vvh s VAL 208 Ca -0.12 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.80 2vvh s VAL 208 Cb -0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2vvh s VAL 208 CO 0.02 0.05 0.10 -0.75 0.00 0.00 0.00 175.10 174.52 2vvh s LYS 209 N 0.32 3.54 0.04 2.72 2.20 0.05 0.23 119.74 128.83 2vvh s LYS 209 Ca -0.03 -0.57 0.05 0.00 -0.36 0.00 0.00 55.97 55.07 2vvh s LYS 209 Cb -0.05 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.83 2vvh s LYS 209 CO -0.01 -0.27 -0.10 -1.17 -0.36 0.00 0.00 175.35 173.44 2vvh s LEU 210 N 1.61 3.00 -0.00 5.43 2.96 0.76 -0.39 118.68 132.06 2vvh s LEU 210 Ca 0.06 -0.28 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 2vvh s LEU 210 Cb -0.16 -1.76 0.00 0.00 0.50 0.00 0.00 46.19 44.77 2vvh s LEU 210 CO 0.05 0.25 -0.00 -0.47 -1.32 0.00 0.00 176.35 174.85 2vvh s TYR 211 N -1.05 0.02 0.03 5.38 5.04 -0.05 -0.66 117.35 126.06 2vvh s TYR 211 Ca 0.18 0.00 0.03 0.00 -2.44 0.00 0.00 57.07 54.84 2vvh s TYR 211 Cb -0.11 -0.03 -0.02 0.00 0.35 0.00 0.00 41.96 42.16 2vvh s TYR 211 CO 0.09 -0.01 -0.09 -2.00 -1.34 0.00 0.00 175.55 172.20 2vvh s GLU 212 N 0.06 0.63 -0.05 4.97 2.12 -0.61 -0.97 118.70 124.84 2vvh s GLU 212 Ca -0.00 -0.59 0.02 0.00 0.36 0.00 0.00 54.97 54.76 2vvh s GLU 212 Cb -0.01 -0.54 0.02 0.00 0.26 0.00 0.00 34.13 33.85 2vvh s GLU 212 CO -0.00 0.13 -0.09 -1.58 -0.54 0.00 0.00 175.26 173.17 2vvh s HIS 213 N -0.83 1.16 -0.03 5.30 5.65 -0.57 -1.92 115.29 124.06 2vvh s HIS 213 Ca -0.03 -0.39 -0.02 0.00 0.25 0.00 0.00 55.06 54.87 2vvh s HIS 213 Cb -0.07 -0.89 0.01 0.00 -1.18 0.00 0.00 32.58 30.45 2vvh s HIS 213 CO 0.00 -0.23 0.07 0.00 -0.65 0.00 0.00 174.74 173.93 2vvh s ALA 214 N 0.70 -0.13 -0.05 1.58 0.00 -0.05 -0.81 121.76 122.99 2vvh s ALA 214 Ca -0.13 0.24 -0.01 0.00 0.00 0.00 0.00 51.96 52.07 2vvh s ALA 214 Cb -0.15 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 22.84 2vvh s ALA 214 CO 0.02 -0.05 0.01 0.08 0.00 0.00 0.00 175.76 175.82 2vvh s VAL 215 N 0.28 0.21 0.28 0.00 1.01 -0.52 -1.07 120.40 120.60 2vvh s VAL 215 Ca -0.02 0.18 -0.22 0.00 0.00 0.00 0.00 61.98 61.92 2vvh s VAL 215 Cb -0.03 -0.37 -0.09 0.00 0.00 0.00 0.00 36.38 35.88 2vvh s VAL 215 CO -0.01 0.21 0.83 0.00 0.00 0.00 0.00 175.10 176.13 2vvh s ALA 216 N 1.75 3.31 0.31 5.51 0.00 0.27 -0.83 121.76 132.06 2vvh s ALA 216 Ca 0.01 0.33 -0.19 0.00 0.00 0.00 0.00 51.96 52.11 2vvh s ALA 216 Cb -0.13 -2.99 0.03 0.00 0.00 0.00 0.00 23.12 20.03 2vvh s ALA 216 CO -0.04 0.25 0.72 -3.38 0.00 0.00 0.00 175.76 173.32 2vvh s HIS 217 N -1.60 -0.06 -2.70 0.00 -3.43 0.14 -4.36 115.29 103.28 2vvh s HIS 217 Ca 0.47 -0.46 0.26 0.00 -0.80 0.00 0.00 55.06 54.53 2vvh s HIS 217 Cb -0.17 0.71 0.64 0.00 -1.43 0.00 0.00 32.58 32.32 2vvh s HIS 217 CO 0.22 -1.32 1.51 0.43 -2.00 0.00 0.00 174.74 173.58 2vvh n SER 218 N -0.74 2.25 -0.32 7.38 7.64 -1.26 -1.28 113.62 127.29 2vvh n SER 218 Ca -0.05 -1.75 0.04 0.00 1.01 0.00 0.00 58.87 58.12 2vvh n SER 218 Cb 0.59 -0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.77 2vvh n SER 218 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vvh n GLY 219 N 1.26 -2.14 3.77 0.23 0.00 -1.26 -4.78 105.19 102.27 2vvh n GLY 219 Ca 0.17 -1.44 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 2vvh n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vvh s LEU 220 N 0.00 4.24 -0.03 0.99 1.43 -1.26 -0.53 118.68 123.52 2vvh s LEU 220 Ca 0.00 2.97 0.14 0.00 -1.03 0.00 0.00 54.13 56.21 2vvh s LEU 220 Cb 0.00 -3.77 0.46 0.00 0.03 0.00 0.00 46.19 42.91 2vvh s LEU 220 CO 0.00 -0.97 1.36 -0.81 0.23 0.00 0.00 176.35 176.17 2vvh n PRO 221 N 0.22 2.42 -1.06 1.29 -0.04 -1.26 -4.92 135.00 131.64 2vvh n PRO 221 Ca 0.03 -1.86 -0.08 0.00 -0.04 0.00 0.00 63.50 61.54 2vvh n PRO 221 Cb 0.40 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.66 2vvh n PRO 221 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2vvh n ASP 222 N 0.87 4.75 -0.23 3.54 8.00 0.31 -5.16 116.55 128.63 2vvh n ASP 222 Ca 0.17 -3.27 0.03 0.00 0.71 0.00 0.00 54.79 52.43 2vvh n ASP 222 Cb 0.50 -0.76 0.02 0.00 -0.02 0.00 0.00 41.12 40.86 2vvh n ASP 222 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35