#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vw4 n ASP 4 N 0.00 0.63 0.05 0.00 8.00 -1.26 -2.59 116.55 121.38 2vw4 n ASP 4 Ca 0.00 0.65 0.11 0.00 0.71 0.00 0.00 54.79 56.26 2vw4 n ASP 4 Cb 0.00 -0.78 0.01 0.00 -0.02 0.00 0.00 41.12 40.33 2vw4 n ASP 4 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2vw4 n LYS 5 N -2.19 0.42 -2.80 -1.24 5.02 -1.26 -4.97 118.16 111.14 2vw4 n LYS 5 Ca 0.02 0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 56.01 2vw4 n LYS 5 Cb 0.24 -1.67 -0.06 0.00 -0.02 0.00 0.00 35.03 33.52 2vw4 n LYS 5 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2vw4 s LEU 6 N -4.45 3.90 0.64 -0.35 1.43 -1.07 -5.05 118.68 113.73 2vw4 s LEU 6 Ca 0.01 1.56 -0.16 0.00 -1.03 0.00 0.00 54.13 54.51 2vw4 s LEU 6 Cb 0.13 -4.42 -0.01 0.00 0.03 0.00 0.00 46.19 41.92 2vw4 s LEU 6 CO 0.80 -0.38 1.15 -2.16 0.23 0.00 0.00 176.35 175.99 2vw4 s PRO 7 N -3.35 2.81 0.04 1.29 0.04 -1.26 -4.72 135.00 129.85 2vw4 s PRO 7 Ca 0.59 1.57 0.02 0.00 0.04 0.00 0.00 61.00 63.22 2vw4 s PRO 7 Cb -0.09 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 2vw4 s PRO 7 CO 0.18 -1.27 0.04 -1.01 0.04 0.00 0.00 177.00 174.99 2vw4 s HIS 8 N -2.05 3.14 0.09 0.56 3.76 -1.26 -1.49 115.29 118.04 2vw4 s HIS 8 Ca 0.71 0.08 0.05 0.00 -0.15 0.00 0.00 55.06 55.76 2vw4 s HIS 8 Cb -0.24 -1.64 -0.03 0.00 1.11 0.00 0.00 32.58 31.77 2vw4 s HIS 8 CO 0.38 0.50 -0.14 0.95 -0.85 0.00 0.00 174.74 175.59 2vw4 s THR 9 N -1.26 1.18 -0.12 1.30 -4.23 -0.16 -4.94 115.64 107.41 2vw4 s THR 9 Ca 0.25 -1.49 -0.00 0.00 -1.18 0.00 0.00 61.69 59.27 2vw4 s THR 9 Cb -0.12 -1.27 -0.02 0.00 1.34 0.00 0.00 72.50 72.44 2vw4 s THR 9 CO 0.17 -0.32 -0.11 -0.54 -0.54 0.00 0.00 174.62 173.27 2vw4 s LYS 10 N -2.18 3.29 -0.10 3.99 3.01 -1.26 -0.03 119.74 126.46 2vw4 s LYS 10 Ca 0.03 -0.65 -0.01 0.00 -1.01 0.00 0.00 55.97 54.32 2vw4 s LYS 10 Cb -0.07 -2.64 -0.03 0.00 -1.01 0.00 0.00 37.83 34.08 2vw4 s LYS 10 CO 0.02 0.29 -0.06 0.08 0.51 0.00 0.00 175.35 176.19 2vw4 s VAL 11 N 0.16 3.71 -0.28 3.17 1.01 -0.28 -4.94 120.40 122.95 2vw4 s VAL 11 Ca -0.06 -0.45 -0.16 0.00 0.00 0.00 0.00 61.98 61.30 2vw4 s VAL 11 Cb -0.15 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.64 2vw4 s VAL 11 CO 0.04 0.56 0.44 -0.89 0.00 0.00 0.00 175.10 175.25 2vw4 s THR 12 N -0.29 5.12 0.51 3.92 2.01 -1.26 -4.66 115.64 120.98 2vw4 s THR 12 Ca 0.04 0.62 -0.18 0.00 0.31 0.00 0.00 61.69 62.48 2vw4 s THR 12 Cb -0.13 -3.79 -0.08 0.00 0.01 0.00 0.00 72.50 68.52 2vw4 s THR 12 CO 0.02 0.07 1.00 -0.76 -0.69 0.00 0.00 174.62 174.27 2vw4 s LEU 13 N 2.20 3.71 0.15 4.42 1.43 -1.26 -4.84 118.68 124.49 2vw4 s LEU 13 Ca 0.17 1.72 0.10 0.00 -1.03 0.00 0.00 54.13 55.10 2vw4 s LEU 13 Cb -0.16 -4.53 -0.04 0.00 0.03 0.00 0.00 46.19 41.49 2vw4 s LEU 13 CO 0.10 -0.70 -0.24 0.68 0.23 0.00 0.00 176.35 176.43 2vw4 s VAL 14 N -2.36 2.15 0.32 -1.59 -7.23 -1.26 -5.02 120.40 105.41 2vw4 s VAL 14 Ca 0.62 -1.85 -0.29 0.00 -1.81 0.00 0.00 61.98 58.66 2vw4 s VAL 14 Cb -0.12 -1.96 -0.10 0.00 0.56 0.00 0.00 36.38 34.76 2vw4 s VAL 14 CO 0.26 -0.06 1.23 0.00 -0.31 0.00 0.00 175.10 176.22 2vw4 s ALA 15 N -1.43 3.44 0.73 1.32 0.00 -1.26 -4.56 121.76 120.00 2vw4 s ALA 15 Ca 0.16 1.13 -0.16 0.00 0.00 0.00 0.00 51.96 53.08 2vw4 s ALA 15 Cb -0.09 -3.42 -0.00 0.00 0.00 0.00 0.00 23.12 19.61 2vw4 s ALA 15 CO 0.07 -0.48 0.86 -2.30 0.00 0.00 0.00 175.76 173.91 2vw4 n PRO 16 N 0.87 0.42 -0.02 0.00 -0.02 -1.26 -2.12 135.00 132.87 2vw4 n PRO 16 Ca -0.00 0.20 0.11 0.00 -2.02 0.00 0.00 63.50 61.78 2vw4 n PRO 16 Cb 0.43 -2.13 0.54 0.00 -0.02 0.00 0.00 33.50 32.33 2vw4 n PRO 16 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2vw4 n PRO 17 N -1.66 1.24 -1.71 0.52 -0.04 -1.26 -5.06 135.00 127.03 2vw4 n PRO 17 Ca 0.12 -0.36 -0.30 0.00 -0.04 0.00 0.00 63.50 62.91 2vw4 n PRO 17 Cb 0.50 -1.35 0.05 0.00 -0.04 0.00 0.00 33.50 32.65 2vw4 n PRO 17 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2vw4 s GLN 18 N -1.94 2.82 -0.02 0.54 -1.52 -0.90 -1.00 119.66 117.64 2vw4 s GLN 18 Ca 0.32 0.70 0.04 0.00 -1.95 0.00 0.00 55.36 54.46 2vw4 s GLN 18 Cb 0.16 -2.00 -0.01 0.00 -0.22 0.00 0.00 33.01 30.94 2vw4 s GLN 18 CO 0.25 -1.11 -0.14 0.08 -0.25 0.00 0.00 175.29 174.12 2vw4 s VAL 19 N -3.19 1.09 0.65 1.09 1.01 -1.26 -4.66 120.40 115.13 2vw4 s VAL 19 Ca 0.58 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.81 2vw4 s VAL 19 Cb -0.13 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 2vw4 s VAL 19 CO 0.54 0.31 1.20 0.00 0.00 0.00 0.00 175.10 177.15 2vw4 n HIS 20 N 2.88 1.59 -1.72 5.22 1.44 -1.26 -4.89 115.22 118.48 2vw4 n HIS 20 Ca -0.15 0.42 -0.42 0.00 -2.01 0.00 0.00 57.72 55.56 2vw4 n HIS 20 Cb 0.55 -2.22 -0.00 0.00 0.12 0.00 0.00 29.99 28.43 2vw4 n HIS 20 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23 2vw4 n PRO 21 N -1.75 2.29 -3.52 -1.40 -0.02 -1.26 -4.98 135.00 124.36 2vw4 n PRO 21 Ca 0.15 0.80 -0.11 0.00 -2.02 0.00 0.00 63.50 62.33 2vw4 n PRO 21 Cb 0.48 -2.44 -0.02 0.00 -0.02 0.00 0.00 33.50 31.50 2vw4 n PRO 21 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2vw4 s HIS 22 N -1.11 -0.45 0.24 6.00 -3.43 -1.26 -5.07 115.29 110.21 2vw4 s HIS 22 Ca 0.55 0.19 -0.10 0.00 -0.80 0.00 0.00 55.06 54.90 2vw4 s HIS 22 Cb -0.54 0.59 -0.07 0.00 -1.43 0.00 0.00 32.58 31.13 2vw4 s HIS 22 CO 0.63 -0.94 0.56 -1.21 -2.00 0.00 0.00 174.74 171.78 2vw4 s GLU 23 N -3.79 3.80 0.00 -0.38 2.02 -1.26 -5.09 118.70 114.00 2vw4 s GLU 23 Ca 0.03 0.28 0.00 0.00 0.02 0.00 0.00 54.97 55.31 2vw4 s GLU 23 Cb -0.02 -2.63 0.00 0.00 0.10 0.00 0.00 34.13 31.58 2vw4 s GLU 23 CO -0.08 0.29 0.00 1.04 0.02 0.00 0.00 175.26 176.53 2vw4 n GLN 24 N -0.22 0.00 -1.68 1.61 6.02 -1.26 -4.88 117.38 116.97 2vw4 n GLN 24 Ca 0.01 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.54 2vw4 n GLN 24 Cb 0.53 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.75 2vw4 n GLN 24 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2vw4 n ALA 25 N -3.00 1.58 -2.66 -1.58 0.00 -1.26 -4.41 120.51 109.18 2vw4 n ALA 25 Ca 0.00 0.43 -0.20 0.00 0.00 0.00 0.00 53.44 53.68 2vw4 n ALA 25 Cb 0.00 -2.39 -0.13 0.00 0.00 0.00 0.00 19.45 16.94 2vw4 n ALA 25 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2vw4 s THR 26 N 1.08 1.18 -0.67 0.00 -1.32 -0.09 -4.89 115.64 110.92 2vw4 s THR 26 Ca 0.79 -1.21 0.25 0.00 -1.21 0.00 0.00 61.69 60.31 2vw4 s THR 26 Cb -0.65 -1.10 0.09 0.00 -1.51 0.00 0.00 72.50 69.33 2vw4 s THR 26 CO 0.37 -0.11 1.41 0.29 -2.21 0.00 0.00 174.62 174.37 2vw4 n LYS 27 N 1.52 0.28 -2.06 7.08 4.01 -1.26 -4.75 118.16 122.98 2vw4 n LYS 27 Ca -0.20 0.11 -0.36 0.00 -0.51 0.00 0.00 58.31 57.35 2vw4 n LYS 27 Cb 0.54 -1.70 0.03 0.00 -0.51 0.00 0.00 35.03 33.39 2vw4 n LYS 27 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 2vw4 s SER 28 N -4.23 5.34 0.81 4.39 1.04 -1.26 -5.05 113.70 114.73 2vw4 s SER 28 Ca 0.07 2.37 -0.05 0.00 0.48 0.00 0.00 55.95 58.82 2vw4 s SER 28 Cb 0.13 -2.60 0.16 0.00 0.10 0.00 0.00 66.02 63.82 2vw4 s SER 28 CO 0.70 -1.49 1.11 -0.83 0.98 0.00 0.00 173.24 173.71 2vw4 s GLY 29 N -1.57 1.77 0.40 7.32 0.00 -1.26 -5.04 107.32 108.93 2vw4 s GLY 29 Ca 0.76 -1.64 -0.27 0.00 0.00 0.00 0.00 44.72 43.57 2vw4 s GLY 29 CO 0.33 -0.98 1.36 -1.05 0.00 0.00 0.00 173.10 172.75 2vw4 n PRO 30 N -3.15 2.21 -4.17 2.90 -0.02 -1.26 -5.01 135.00 126.50 2vw4 n PRO 30 Ca 0.16 0.78 -0.11 0.00 -2.02 0.00 0.00 63.50 62.31 2vw4 n PRO 30 Cb 0.60 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.50 2vw4 n PRO 30 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2vw4 s LYS 31 N -2.15 0.84 -0.35 -0.52 1.02 -1.26 -4.54 119.74 112.77 2vw4 s LYS 31 Ca 0.58 -1.31 -0.25 0.00 0.02 0.00 0.00 55.97 55.01 2vw4 s LYS 31 Cb -0.50 -0.26 0.01 0.00 -0.52 0.00 0.00 37.83 36.56 2vw4 s LYS 31 CO 0.60 -0.00 0.86 0.08 -0.92 0.00 0.00 175.35 175.97 2vw4 s VAL 32 N -3.44 4.67 -0.31 3.17 1.01 -0.56 -1.00 120.40 123.94 2vw4 s VAL 32 Ca 0.11 1.12 -0.11 0.00 0.00 0.00 0.00 61.98 63.09 2vw4 s VAL 32 Cb 0.04 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 2vw4 s VAL 32 CO -0.04 -0.44 0.20 -0.69 0.00 0.00 0.00 175.10 174.13 2vw4 s VAL 33 N 3.26 5.17 -0.19 2.92 1.01 0.14 -0.99 120.40 131.71 2vw4 s VAL 33 Ca 0.35 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 62.11 2vw4 s VAL 33 Cb -0.13 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2vw4 s VAL 33 CO 0.17 0.12 0.30 -1.61 0.00 0.00 0.00 175.10 174.07 2vw4 s GLU 34 N 1.72 4.20 0.12 2.72 2.02 0.95 -0.70 118.70 129.72 2vw4 s GLU 34 Ca 0.06 0.05 0.07 0.00 0.02 0.00 0.00 54.97 55.17 2vw4 s GLU 34 Cb -0.17 -3.48 -0.04 0.00 0.10 0.00 0.00 34.13 30.55 2vw4 s GLU 34 CO 0.10 0.12 -0.16 -0.06 0.02 0.00 0.00 175.26 175.28 2vw4 s PHE 35 N 0.84 1.50 -0.01 1.61 0.40 0.10 -1.13 117.98 121.28 2vw4 s PHE 35 Ca 0.15 -0.50 0.03 0.00 -0.60 0.00 0.00 56.93 56.02 2vw4 s PHE 35 Cb -0.13 -0.79 -0.01 0.00 0.51 0.00 0.00 43.02 42.60 2vw4 s PHE 35 CO 0.05 0.17 -0.11 -0.08 0.70 0.00 0.00 175.22 175.94 2vw4 s THR 36 N -1.79 0.90 0.03 0.64 -1.32 -1.26 -0.85 115.64 111.98 2vw4 s THR 36 Ca 0.07 -0.48 0.03 0.00 -1.21 0.00 0.00 61.69 60.11 2vw4 s THR 36 Cb -0.07 -0.76 -0.02 0.00 -1.51 0.00 0.00 72.50 70.15 2vw4 s THR 36 CO 0.04 0.26 -0.09 -0.04 -2.21 0.00 0.00 174.62 172.57 2vw4 s MET 37 N -0.19 0.62 -0.14 7.08 -1.94 -0.65 -4.90 119.30 119.17 2vw4 s MET 37 Ca 0.03 -0.61 0.02 0.00 -1.71 0.00 0.00 55.69 53.42 2vw4 s MET 37 Cb -0.05 -0.51 0.01 0.00 2.01 0.00 0.00 34.83 36.29 2vw4 s MET 37 CO -0.00 0.12 -0.21 0.99 -0.01 0.00 0.00 175.02 175.91 2vw4 s THR 38 N -0.90 1.99 0.13 2.05 2.01 -1.26 -1.52 115.64 118.15 2vw4 s THR 38 Ca -0.03 -0.94 -0.31 0.00 0.31 0.00 0.00 61.69 60.72 2vw4 s THR 38 Cb -0.07 -1.77 -0.07 0.00 0.01 0.00 0.00 72.50 70.60 2vw4 s THR 38 CO 0.01 0.54 1.27 -0.63 -0.69 0.00 0.00 174.62 175.11 2vw4 s ILE 39 N 0.86 3.58 -0.18 1.82 1.01 -0.06 -0.10 121.20 128.11 2vw4 s ILE 39 Ca -0.06 1.20 -0.01 0.00 0.00 0.00 0.00 60.65 61.77 2vw4 s ILE 39 Cb -0.15 -3.77 0.05 0.00 0.01 0.00 0.00 42.46 38.60 2vw4 s ILE 39 CO -0.02 0.13 -0.02 -0.70 0.00 0.00 0.00 174.94 174.33 2vw4 s GLU 40 N 0.57 1.12 -0.01 2.79 2.12 -0.04 -4.41 118.70 120.84 2vw4 s GLU 40 Ca 0.59 -0.52 -0.26 0.00 0.36 0.00 0.00 54.97 55.13 2vw4 s GLU 40 Cb -0.33 -2.07 -0.04 0.00 0.26 0.00 0.00 34.13 31.95 2vw4 s GLU 40 CO 0.33 -0.53 0.83 -1.21 -0.54 0.00 0.00 175.26 174.14 2vw4 s GLU 41 N 1.70 4.51 -0.05 4.30 2.02 -1.26 -1.56 118.70 128.36 2vw4 s GLU 41 Ca -0.01 1.14 -0.29 0.00 0.02 0.00 0.00 54.97 55.84 2vw4 s GLU 41 Cb -0.16 -3.44 0.06 0.00 0.10 0.00 0.00 34.13 30.69 2vw4 s GLU 41 CO -0.07 0.06 0.63 -1.59 0.02 0.00 0.00 175.26 174.31 2vw4 s LYS 42 N 0.71 1.00 -0.00 1.61 -2.85 -0.73 -5.00 119.74 114.48 2vw4 s LYS 42 Ca 0.44 0.20 -0.30 0.00 -1.00 0.00 0.00 55.97 55.30 2vw4 s LYS 42 Cb -0.20 0.47 -0.04 0.00 -2.06 0.00 0.00 37.83 36.00 2vw4 s LYS 42 CO 0.23 -0.31 1.14 0.21 0.10 0.00 0.00 175.35 176.72 2vw4 s LYS 43 N -1.20 4.43 0.03 1.78 2.20 -1.26 -0.92 119.74 124.80 2vw4 s LYS 43 Ca -0.11 1.63 0.06 0.00 -0.36 0.00 0.00 55.97 57.20 2vw4 s LYS 43 Cb -0.01 -3.45 -0.02 0.00 -1.51 0.00 0.00 37.83 32.84 2vw4 s LYS 43 CO 0.09 -0.27 -0.19 -1.64 -0.36 0.00 0.00 175.35 172.98 2vw4 s MET 44 N 1.47 1.31 -0.16 4.03 -1.94 0.26 -4.93 119.30 119.35 2vw4 s MET 44 Ca 0.56 -0.84 -0.24 0.00 -1.71 0.00 0.00 55.69 53.46 2vw4 s MET 44 Cb -0.25 -1.36 -0.02 0.00 2.01 0.00 0.00 34.83 35.20 2vw4 s MET 44 CO 0.26 0.35 0.75 0.08 -0.01 0.00 0.00 175.02 176.45 2vw4 s VAL 45 N -0.73 4.96 -0.61 -6.03 1.01 -1.26 -0.34 120.40 117.39 2vw4 s VAL 45 Ca 0.06 1.46 0.06 0.00 0.00 0.00 0.00 61.98 63.56 2vw4 s VAL 45 Cb -0.08 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 32.25 2vw4 s VAL 45 CO 0.01 0.10 0.55 2.30 0.00 0.00 0.00 175.10 178.06 2vw4 n ILE 46 N 4.52 0.00 -3.96 2.22 -6.64 -0.25 -4.83 119.36 110.42 2vw4 n ILE 46 Ca 0.02 -0.46 -0.12 0.00 -1.77 0.00 0.00 62.75 60.41 2vw4 n ILE 46 Cb 0.50 1.09 -0.02 0.00 -1.44 0.00 0.00 39.64 39.76 2vw4 n ILE 46 CO 0.00 0.00 0.00 -0.90 -1.77 0.00 0.00 176.55 173.88 2vw4 n ASP 47 N -0.10 -1.25 -0.25 7.28 5.68 -1.26 -1.08 116.55 125.58 2vw4 n ASP 47 Ca 0.03 -2.60 0.15 0.00 -0.50 0.00 0.00 54.79 51.86 2vw4 n ASP 47 Cb 0.13 2.29 0.71 0.00 -1.14 0.00 0.00 41.12 43.12 2vw4 n ASP 47 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2vw4 n ASP 48 N -1.67 0.77 -0.76 -1.12 5.75 -1.26 -3.44 116.55 114.82 2vw4 n ASP 48 Ca -0.00 -1.28 0.07 0.00 -0.01 0.00 0.00 54.79 53.57 2vw4 n ASP 48 Cb 0.50 -0.00 0.21 0.00 -1.03 0.00 0.00 41.12 40.81 2vw4 n ASP 48 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 2vw4 n LYS 49 N -0.39 2.85 -1.01 0.11 2.85 -1.26 -4.98 118.16 116.34 2vw4 n LYS 49 Ca 0.21 -2.55 -0.00 0.00 -1.05 0.00 0.00 58.31 54.92 2vw4 n LYS 49 Cb 0.23 -1.63 -0.00 0.00 -0.65 0.00 0.00 35.03 32.98 2vw4 n LYS 49 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2vw4 n GLY 50 N -0.23 0.47 3.76 2.58 0.00 -1.22 -5.02 105.19 105.53 2vw4 n GLY 50 Ca 0.17 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 2vw4 n GLY 50 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vw4 s THR 51 N -1.98 2.37 0.19 2.61 2.01 -1.26 -4.88 115.64 114.70 2vw4 s THR 51 Ca 0.00 0.35 0.08 0.00 0.31 0.00 0.00 61.69 62.43 2vw4 s THR 51 Cb 0.00 -3.22 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 2vw4 s THR 51 CO 0.00 0.07 -0.05 0.42 -0.69 0.00 0.00 174.62 174.37 2vw4 s THR 52 N -0.63 3.41 -0.09 -0.82 -4.23 -1.26 -1.09 115.64 110.93 2vw4 s THR 52 Ca 0.55 -1.61 0.04 0.00 -1.18 0.00 0.00 61.69 59.50 2vw4 s THR 52 Cb -0.44 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 70.69 2vw4 s THR 52 CO 0.53 -0.14 -0.21 -0.22 -0.54 0.00 0.00 174.62 174.03 2vw4 s LEU 53 N -2.98 1.99 -0.89 4.79 2.96 0.54 -4.92 118.68 120.17 2vw4 s LEU 53 Ca 0.27 -0.49 -0.25 0.00 -0.22 0.00 0.00 54.13 53.44 2vw4 s LEU 53 Cb -0.09 -1.26 0.02 0.00 0.50 0.00 0.00 46.19 45.36 2vw4 s LEU 53 CO 0.17 0.14 1.56 -1.10 -1.32 0.00 0.00 176.35 175.80 2vw4 s GLN 54 N 0.35 3.18 0.37 1.98 -1.52 -1.26 -0.57 119.66 122.18 2vw4 s GLN 54 Ca -0.16 -0.56 0.02 0.00 -1.95 0.00 0.00 55.36 52.71 2vw4 s GLN 54 Cb -0.17 -4.92 -0.02 0.00 -0.22 0.00 0.00 33.01 27.68 2vw4 s GLN 54 CO 0.07 -2.50 0.55 0.00 -0.25 0.00 0.00 175.29 173.16 2vw4 s ALA 55 N 6.65 3.87 -0.03 6.09 0.00 -0.10 -4.92 121.76 133.33 2vw4 s ALA 55 Ca 0.51 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 51.34 2vw4 s ALA 55 Cb -0.05 -1.97 0.03 0.00 0.00 0.00 0.00 23.12 21.13 2vw4 s ALA 55 CO 0.01 -0.12 -0.01 -1.64 0.00 0.00 0.00 175.76 174.00 2vw4 s MET 56 N -4.33 0.40 0.04 0.00 -1.94 -0.53 -1.77 119.30 111.18 2vw4 s MET 56 Ca 0.43 0.05 0.02 0.00 -1.71 0.00 0.00 55.69 54.48 2vw4 s MET 56 Cb -0.10 -0.57 -0.02 0.00 2.01 0.00 0.00 34.83 36.15 2vw4 s MET 56 CO 0.35 -0.14 -0.07 0.95 -0.01 0.00 0.00 175.02 176.10 2vw4 s THR 57 N 1.07 0.48 -0.18 2.05 -4.23 -0.60 -2.64 115.64 111.58 2vw4 s THR 57 Ca -0.09 -1.11 -0.25 0.00 -1.18 0.00 0.00 61.69 59.06 2vw4 s THR 57 Cb -0.14 -0.63 -0.01 0.00 1.34 0.00 0.00 72.50 73.06 2vw4 s THR 57 CO -0.02 -0.44 0.82 -0.36 -0.54 0.00 0.00 174.62 174.08 2vw4 s PHE 58 N -1.56 3.40 -1.79 3.99 0.08 -1.26 -0.86 117.98 119.98 2vw4 s PHE 58 Ca -0.09 1.21 0.00 0.00 0.12 0.00 0.00 56.93 58.17 2vw4 s PHE 58 Cb -0.09 -3.01 0.00 0.00 -0.57 0.00 0.00 43.02 39.36 2vw4 s PHE 58 CO -0.00 -0.26 0.00 0.09 -0.10 0.00 0.00 175.22 174.94 2vw4 n ASN 59 N 5.36 -5.12 0.00 1.36 4.13 0.85 -3.01 115.26 118.83 2vw4 n ASN 59 Ca 0.04 0.34 0.00 0.00 1.68 0.00 0.00 54.58 56.65 2vw4 n ASN 59 Cb 0.49 -4.17 0.00 0.00 -1.54 0.00 0.00 39.78 34.55 2vw4 n ASN 59 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2vw4 n GLY 60 N -0.86 0.85 3.30 7.41 0.00 -1.26 -5.00 105.19 109.63 2vw4 n GLY 60 Ca -0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 2vw4 n GLY 60 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vw4 s SER 61 N -2.75 2.51 -0.21 1.61 1.04 -1.16 -5.01 113.70 109.72 2vw4 s SER 61 Ca 0.00 -0.81 -0.02 0.00 0.48 0.00 0.00 55.95 55.59 2vw4 s SER 61 Cb 0.00 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 65.99 2vw4 s SER 61 CO 0.00 -0.04 -0.09 -0.04 0.98 0.00 0.00 173.24 174.05 2vw4 s MET 62 N -2.58 3.23 1.13 4.02 -1.94 -1.26 -3.20 119.30 118.70 2vw4 s MET 62 Ca 0.12 -0.71 -0.17 0.00 -1.71 0.00 0.00 55.69 53.22 2vw4 s MET 62 Cb -0.06 -2.88 0.25 0.00 2.01 0.00 0.00 34.83 34.15 2vw4 s MET 62 CO 0.05 -0.21 1.13 -1.25 -0.01 0.00 0.00 175.02 174.73 2vw4 s PRO 63 N 1.42 -0.65 1.09 2.03 0.04 -1.26 -3.39 135.00 134.27 2vw4 s PRO 63 Ca 0.05 0.01 -0.13 0.00 0.04 0.00 0.00 61.00 60.98 2vw4 s PRO 63 Cb -0.14 -1.66 0.24 0.00 0.04 0.00 0.00 34.50 32.98 2vw4 s PRO 63 CO -0.06 -3.35 1.06 0.20 0.04 0.00 0.00 177.00 174.89 2vw4 s GLY 64 N -3.93 1.55 0.66 0.56 0.00 0.20 -4.74 107.32 101.63 2vw4 s GLY 64 Ca 0.70 -0.29 -0.16 0.00 0.00 0.00 0.00 44.72 44.97 2vw4 s GLY 64 CO 0.56 0.38 1.15 2.56 0.00 0.00 0.00 173.10 177.75 2vw4 s PRO 65 N -4.74 2.70 -0.06 2.90 0.04 -1.26 -4.55 135.00 130.03 2vw4 s PRO 65 Ca 0.67 1.57 -0.29 0.00 0.04 0.00 0.00 61.00 62.99 2vw4 s PRO 65 Cb -0.21 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 2vw4 s PRO 65 CO 0.61 -1.36 0.94 0.99 0.04 0.00 0.00 177.00 178.21 2vw4 s THR 66 N -2.09 4.87 -0.21 1.26 2.01 -1.26 -4.30 115.64 115.92 2vw4 s THR 66 Ca 0.71 1.93 -0.11 0.00 0.31 0.00 0.00 61.69 64.53 2vw4 s THR 66 Cb -0.24 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 67.96 2vw4 s THR 66 CO 0.40 0.11 0.19 -0.76 -0.69 0.00 0.00 174.62 173.87 2vw4 s LEU 67 N 1.42 4.17 -0.16 4.42 1.02 -0.70 -4.50 118.68 124.36 2vw4 s LEU 67 Ca 0.48 0.26 0.01 0.00 0.02 0.00 0.00 54.13 54.89 2vw4 s LEU 67 Cb -0.19 -2.18 0.00 0.00 0.02 0.00 0.00 46.19 43.84 2vw4 s LEU 67 CO 0.22 0.10 -0.17 -0.69 0.02 0.00 0.00 176.35 175.83 2vw4 s VAL 68 N 0.75 2.47 0.40 -1.59 1.01 -1.26 -0.30 120.40 121.89 2vw4 s VAL 68 Ca 0.10 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2vw4 s VAL 68 Cb -0.13 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 2vw4 s VAL 68 CO 0.02 0.52 0.18 0.68 0.00 0.00 0.00 175.10 176.51 2vw4 s VAL 69 N 0.92 0.38 0.12 2.92 -7.23 -0.17 -5.00 120.40 112.33 2vw4 s VAL 69 Ca -0.04 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.19 2vw4 s VAL 69 Cb -0.15 -2.33 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 2vw4 s VAL 69 CO -0.02 0.00 -0.00 -1.00 -0.31 0.00 0.00 175.10 173.77 2vw4 s HIS 70 N -3.23 2.94 0.08 2.82 3.76 -1.26 -0.91 115.29 119.49 2vw4 s HIS 70 Ca 0.27 -0.07 -0.35 0.00 -0.15 0.00 0.00 55.06 54.75 2vw4 s HIS 70 Cb 0.02 -1.48 -0.15 0.00 1.11 0.00 0.00 32.58 32.08 2vw4 s HIS 70 CO 0.18 0.49 1.55 -1.91 -0.85 0.00 0.00 174.74 174.20 2vw4 n GLU 71 N 0.34 1.76 0.00 1.40 2.13 0.20 -1.17 120.64 125.30 2vw4 n GLU 71 Ca -0.11 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.35 2vw4 n GLU 71 Cb 0.53 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.87 2vw4 n GLU 71 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2vw4 n GLY 72 N 3.29 3.38 3.64 8.31 0.00 -0.17 -4.65 105.19 118.99 2vw4 n GLY 72 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2vw4 n GLY 72 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vw4 s ASP 73 N -0.85 2.65 -0.11 1.61 1.01 -0.31 -4.66 116.67 116.00 2vw4 s ASP 73 Ca 0.00 1.82 0.01 0.00 0.71 0.00 0.00 52.55 55.09 2vw4 s ASP 73 Cb 0.00 -2.41 -0.02 0.00 1.01 0.00 0.00 42.92 41.51 2vw4 s ASP 73 CO 0.00 -3.21 -0.15 -0.31 0.21 0.00 0.00 175.17 171.71 2vw4 s TYR 74 N -2.68 2.76 -0.16 4.23 1.51 -0.17 -1.29 117.35 121.55 2vw4 s TYR 74 Ca 0.66 -0.59 -0.20 0.00 -1.01 0.00 0.00 57.07 55.92 2vw4 s TYR 74 Cb -0.22 -1.79 -0.03 0.00 -0.11 0.00 0.00 41.96 39.81 2vw4 s TYR 74 CO 0.59 -0.16 0.59 0.08 -1.11 0.00 0.00 175.55 175.55 2vw4 s VAL 75 N 0.15 5.07 -0.31 0.71 1.01 -0.31 0.23 120.40 126.94 2vw4 s VAL 75 Ca -0.08 1.15 0.03 0.00 0.00 0.00 0.00 61.98 63.08 2vw4 s VAL 75 Cb -0.15 -3.92 0.09 0.00 0.00 0.00 0.00 36.38 32.40 2vw4 s VAL 75 CO 0.05 0.19 0.01 -1.58 0.00 0.00 0.00 175.10 173.77 2vw4 s GLN 76 N 1.43 1.60 -0.18 2.72 0.74 0.12 -1.30 119.66 124.78 2vw4 s GLN 76 Ca 0.29 -1.64 -0.06 0.00 0.05 0.00 0.00 55.36 54.00 2vw4 s GLN 76 Cb -0.16 -3.00 -0.03 0.00 1.10 0.00 0.00 33.01 30.92 2vw4 s GLN 76 CO 0.11 -0.84 0.02 -1.17 -0.55 0.00 0.00 175.29 172.86 2vw4 s LEU 77 N 1.03 3.47 -0.29 3.68 2.96 0.19 -0.73 118.68 128.99 2vw4 s LEU 77 Ca 0.05 -0.08 -0.17 0.00 -0.22 0.00 0.00 54.13 53.72 2vw4 s LEU 77 Cb -0.19 -1.87 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 2vw4 s LEU 77 CO -0.09 0.13 0.45 -0.89 -1.32 0.00 0.00 176.35 174.63 2vw4 s THR 78 N 0.63 5.11 -0.22 3.68 2.01 -0.03 -0.91 115.64 125.91 2vw4 s THR 78 Ca 0.01 0.60 -0.06 0.00 0.31 0.00 0.00 61.69 62.54 2vw4 s THR 78 Cb -0.14 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 2vw4 s THR 78 CO 0.02 0.05 0.03 -0.22 -0.69 0.00 0.00 174.62 173.80 2vw4 s LEU 79 N 2.21 3.32 -0.18 4.42 2.96 0.46 -1.64 118.68 130.23 2vw4 s LEU 79 Ca 0.18 -0.21 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 2vw4 s LEU 79 Cb -0.16 -1.86 -0.00 0.00 0.50 0.00 0.00 46.19 44.67 2vw4 s LEU 79 CO 0.10 0.02 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.35 2vw4 s VAL 80 N 1.25 2.92 -0.59 1.68 1.01 -0.57 -1.40 120.40 124.70 2vw4 s VAL 80 Ca 0.04 -0.67 -0.03 0.00 0.00 0.00 0.00 61.98 61.32 2vw4 s VAL 80 Cb -0.15 -2.27 0.15 0.00 0.00 0.00 0.00 36.38 34.12 2vw4 s VAL 80 CO 0.02 0.49 0.40 0.21 0.00 0.00 0.00 175.10 176.22 2vw4 s ASN 81 N 1.02 5.22 0.71 3.32 2.47 -0.19 -0.88 114.94 126.61 2vw4 s ASN 81 Ca -0.01 -2.73 -0.16 0.00 0.42 0.00 0.00 52.86 50.38 2vw4 s ASN 81 Cb -0.15 -1.85 0.01 0.00 -1.45 0.00 0.00 41.25 37.82 2vw4 s ASN 81 CO -0.02 -0.39 1.07 -2.65 -3.72 0.00 0.00 177.10 171.38 2vw4 n PRO 82 N 3.65 0.61 0.29 0.43 -0.02 -1.26 0.23 135.00 138.93 2vw4 n PRO 82 Ca 0.06 0.27 0.19 0.00 -2.02 0.00 0.00 63.50 62.00 2vw4 n PRO 82 Cb 0.38 -2.31 1.01 0.00 -0.02 0.00 0.00 33.50 32.56 2vw4 n PRO 82 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vw4 h ALA 83 N -0.13 1.02 0.00 3.55 0.00 -1.89 -1.11 119.26 120.70 2vw4 h ALA 83 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2vw4 h ALA 83 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2vw4 h ALA 83 CO 0.48 -0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.96 2vw4 n THR 84 N -2.82 0.61 -2.75 0.00 -2.24 -1.26 -4.74 114.28 101.08 2vw4 n THR 84 Ca -0.02 0.10 -0.28 0.00 -2.27 0.00 0.00 64.05 61.58 2vw4 n THR 84 Cb 0.08 -0.82 -0.01 0.00 -2.10 0.00 0.00 70.33 67.48 2vw4 n THR 84 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2vw4 s ASN 85 N -3.37 6.34 -0.12 3.42 0.01 -0.42 -4.98 114.94 115.81 2vw4 s ASN 85 Ca 0.09 0.96 0.19 0.00 -0.71 0.00 0.00 52.86 53.39 2vw4 s ASN 85 Cb 0.13 -2.26 -0.27 0.00 0.41 0.00 0.00 41.25 39.26 2vw4 s ASN 85 CO 0.41 -0.50 0.23 0.00 -1.51 0.00 0.00 177.10 175.72 2vw4 n ALA 86 N -1.93 2.04 -2.67 0.60 0.00 -1.26 -4.73 120.51 112.56 2vw4 n ALA 86 Ca 0.01 -0.95 -0.27 0.00 0.00 0.00 0.00 53.44 52.22 2vw4 n ALA 86 Cb 0.55 -0.39 -0.08 0.00 0.00 0.00 0.00 19.45 19.53 2vw4 n ALA 86 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2vw4 s MET 87 N -2.88 2.45 0.51 0.00 -1.94 -1.26 -4.89 119.30 111.29 2vw4 s MET 87 Ca -0.09 -1.04 -0.18 0.00 -1.71 0.00 0.00 55.69 52.68 2vw4 s MET 87 Cb 0.09 -2.41 -0.08 0.00 2.01 0.00 0.00 34.83 34.45 2vw4 s MET 87 CO 0.82 0.48 1.00 -1.25 -0.01 0.00 0.00 175.02 176.06 2vw4 s PRO 88 N -2.79 3.83 0.29 2.03 0.04 -1.26 -4.20 135.00 132.93 2vw4 s PRO 88 Ca 0.27 1.12 -0.01 0.00 0.04 0.00 0.00 61.00 62.42 2vw4 s PRO 88 Cb -0.10 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 2vw4 s PRO 88 CO 0.19 -0.38 0.33 -1.01 0.04 0.00 0.00 177.00 176.17 2vw4 s HIS 89 N -2.37 1.15 0.00 0.56 3.76 -0.80 -4.90 115.29 112.69 2vw4 s HIS 89 Ca 0.62 -1.32 0.00 0.00 -0.15 0.00 0.00 55.06 54.21 2vw4 s HIS 89 Cb -0.12 -0.32 0.00 0.00 1.11 0.00 0.00 32.58 33.24 2vw4 s HIS 89 CO 0.27 -0.92 0.00 0.27 -0.85 0.00 0.00 174.74 173.51 2vw4 n ASN 90 N -0.97 0.00 -3.77 1.40 0.23 -1.26 -0.69 115.26 110.19 2vw4 n ASN 90 Ca 0.02 -0.74 -0.13 0.00 -0.53 0.00 0.00 54.58 53.20 2vw4 n ASN 90 Cb 0.63 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.19 2vw4 n ASN 90 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2vw4 s VAL 91 N -2.95 -0.03 -0.29 3.53 0.11 -1.26 -4.19 120.40 115.33 2vw4 s VAL 91 Ca 0.00 0.11 -0.01 0.00 -2.93 0.00 0.00 61.98 59.15 2vw4 s VAL 91 Cb 0.00 -0.26 0.05 0.00 -1.53 0.00 0.00 36.38 34.64 2vw4 s VAL 91 CO 0.00 0.04 -0.02 -0.62 -3.33 0.00 0.00 175.10 171.17 2vw4 s ASP 92 N 0.78 4.74 -0.38 3.54 -1.08 0.62 -1.31 116.67 123.58 2vw4 s ASP 92 Ca -0.06 -1.21 -0.20 0.00 -0.52 0.00 0.00 52.55 50.57 2vw4 s ASP 92 Cb -0.07 -1.69 0.01 0.00 -1.46 0.00 0.00 42.92 39.71 2vw4 s ASP 92 CO -0.04 -0.23 0.60 -0.36 0.52 0.00 0.00 175.17 175.66 2vw4 s PHE 93 N 1.25 3.13 0.64 -5.34 0.08 0.15 -0.91 117.98 116.99 2vw4 s PHE 93 Ca -0.05 0.17 0.44 0.00 0.12 0.00 0.00 56.93 57.62 2vw4 s PHE 93 Cb -0.19 -3.14 2.40 0.00 -0.57 0.00 0.00 43.02 41.51 2vw4 s PHE 93 CO -0.02 -0.68 2.36 0.45 -0.10 0.00 0.00 175.22 177.23 2vw4 h HIS 94 N 8.59 0.00 -0.00 0.36 3.86 -1.55 -1.50 115.15 124.90 2vw4 h HIS 94 Ca -0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.95 2vw4 h HIS 94 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 2vw4 h HIS 94 CO 0.73 0.00 -0.05 0.41 0.86 0.00 0.00 177.93 179.88 2vw4 n GLY 95 N -1.05 -1.27 3.88 2.45 0.00 -1.26 -4.90 105.19 103.04 2vw4 n GLY 95 Ca -0.03 -0.17 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2vw4 n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vw4 s ALA 96 N -2.68 3.77 -0.23 4.61 0.00 -0.57 -4.63 121.76 122.03 2vw4 s ALA 96 Ca 0.24 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 50.98 2vw4 s ALA 96 Cb 0.20 -1.56 0.02 0.00 0.00 0.00 0.00 23.12 21.78 2vw4 s ALA 96 CO 0.49 0.41 -0.08 0.99 0.00 0.00 0.00 175.76 177.58 2vw4 s THR 97 N -1.87 2.84 0.00 0.00 2.01 -1.26 -4.70 115.64 112.66 2vw4 s THR 97 Ca 0.33 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.42 2vw4 s THR 97 Cb -0.10 -2.38 0.00 0.00 0.01 0.00 0.00 72.50 70.03 2vw4 s THR 97 CO 0.26 0.29 0.00 0.61 -0.69 0.00 0.00 174.62 175.10 2vw4 n GLY 98 N 4.68 2.22 4.03 4.40 0.00 -1.26 -4.95 105.19 114.31 2vw4 n GLY 98 Ca -0.17 -1.99 -0.31 0.00 0.00 0.00 0.00 46.02 43.55 2vw4 n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vw4 n ALA 99 N 0.88 -1.49 -3.90 4.61 0.00 -1.26 -0.59 120.51 118.76 2vw4 n ALA 99 Ca 0.00 -0.01 -0.27 0.00 0.00 0.00 0.00 53.44 53.15 2vw4 n ALA 99 Cb 0.00 -3.26 0.01 0.00 0.00 0.00 0.00 19.45 16.20 2vw4 n ALA 99 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2vw4 n LEU 100 N -4.48 -2.53 0.00 0.00 4.77 -1.26 -1.35 117.00 112.15 2vw4 n LEU 100 Ca -0.05 -0.87 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 2vw4 n LEU 100 Cb 0.56 -2.46 0.00 0.00 -2.33 0.00 0.00 43.42 39.19 2vw4 n LEU 100 CO 0.79 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.88 2vw4 n GLY 101 N -1.68 0.40 0.00 -0.72 0.00 0.24 -2.89 105.19 100.53 2vw4 n GLY 101 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2vw4 n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vw4 n GLY 102 N -1.85 1.08 0.36 -0.02 0.00 -0.45 -0.67 105.19 103.64 2vw4 n GLY 102 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2vw4 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vw4 h ALA 103 N 0.00 1.54 0.00 4.61 0.00 -0.88 -1.36 119.26 123.17 2vw4 h ALA 103 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2vw4 h ALA 103 Cb 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2vw4 h ALA 103 CO 0.00 0.31 -0.03 -0.22 0.00 0.00 0.00 179.25 179.31 2vw4 h LYS 104 N 1.00 0.00 -0.02 0.00 3.64 -1.75 -3.10 116.57 116.34 2vw4 h LYS 104 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2vw4 h LYS 104 Cb 0.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2vw4 h LYS 104 CO -0.16 0.03 -0.01 1.28 -2.27 0.00 0.00 179.45 178.32 2vw4 n LEU 105 N -3.20 2.19 -0.47 5.20 4.77 -0.54 -4.53 117.00 120.43 2vw4 n LEU 105 Ca -0.01 -0.99 0.06 0.00 -0.03 0.00 0.00 56.01 55.04 2vw4 n LEU 105 Cb 0.22 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.41 2vw4 n LEU 105 CO 0.26 0.40 0.38 0.35 -1.33 0.00 0.00 177.39 177.44 2vw4 n THR 106 N 0.78 1.23 -1.98 -5.08 -2.24 -1.03 -4.83 114.28 101.13 2vw4 n THR 106 Ca 0.08 -1.73 -0.41 0.00 -2.27 0.00 0.00 64.05 59.73 2vw4 n THR 106 Cb 0.37 0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.67 2vw4 n THR 106 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2vw4 s ASN 107 N -2.36 5.56 -0.21 3.42 0.01 -1.24 -4.11 114.94 116.00 2vw4 s ASN 107 Ca 0.25 0.95 0.01 0.00 -0.71 0.00 0.00 52.86 53.36 2vw4 s ASN 107 Cb 0.24 -2.53 0.03 0.00 0.41 0.00 0.00 41.25 39.41 2vw4 s ASN 107 CO -0.02 -2.04 -0.15 0.68 -1.51 0.00 0.00 177.10 174.06 2vw4 s VAL 108 N 8.09 2.25 0.71 1.60 -7.23 0.13 -4.98 120.40 120.96 2vw4 s VAL 108 Ca 0.77 -1.14 -0.11 0.00 -1.81 0.00 0.00 61.98 59.69 2vw4 s VAL 108 Cb -0.19 -2.09 0.02 0.00 0.56 0.00 0.00 36.38 34.68 2vw4 s VAL 108 CO 0.28 0.33 1.06 0.20 -0.31 0.00 0.00 175.10 176.66 2vw4 s ASN 109 N 1.25 5.26 0.25 4.85 0.01 -1.26 -1.91 114.94 123.38 2vw4 s ASN 109 Ca 0.00 1.60 -0.31 0.00 -0.71 0.00 0.00 52.86 53.45 2vw4 s ASN 109 Cb -0.16 -2.46 -0.13 0.00 0.41 0.00 0.00 41.25 38.91 2vw4 s ASN 109 CO -0.09 -1.52 1.39 -2.65 -1.51 0.00 0.00 177.10 172.72 2vw4 n PRO 110 N -3.18 2.03 -0.54 -0.60 -0.02 -1.26 -1.20 135.00 130.24 2vw4 n PRO 110 Ca 0.08 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2vw4 n PRO 110 Cb 0.54 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2vw4 n PRO 110 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vw4 n GLY 111 N 2.02 0.76 3.48 -1.23 0.00 0.14 -4.68 105.19 105.69 2vw4 n GLY 111 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 2vw4 n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vw4 s GLU 112 N -0.46 1.69 0.11 1.61 2.02 -0.34 -4.87 118.70 118.46 2vw4 s GLU 112 Ca 0.00 -1.82 -0.05 0.00 0.02 0.00 0.00 54.97 53.12 2vw4 s GLU 112 Cb 0.00 -1.62 -0.02 0.00 0.10 0.00 0.00 34.13 32.58 2vw4 s GLU 112 CO 0.00 0.21 0.13 1.14 0.02 0.00 0.00 175.26 176.76 2vw4 s GLN 113 N -3.58 0.89 0.07 1.61 -2.07 -1.26 -1.02 119.66 114.31 2vw4 s GLN 113 Ca 0.30 -1.20 -0.10 0.00 -1.82 0.00 0.00 55.36 52.54 2vw4 s GLN 113 Cb -0.01 0.30 0.01 0.00 -1.09 0.00 0.00 33.01 32.21 2vw4 s GLN 113 CO 0.15 -0.27 0.23 0.00 -1.32 0.00 0.00 175.29 174.07 2vw4 s ALA 114 N -3.95 -0.40 -0.12 2.60 0.00 -0.49 -5.00 121.76 114.41 2vw4 s ALA 114 Ca 0.14 -0.39 0.02 0.00 0.00 0.00 0.00 51.96 51.73 2vw4 s ALA 114 Cb 0.06 0.43 0.01 0.00 0.00 0.00 0.00 23.12 23.63 2vw4 s ALA 114 CO -0.05 -0.47 -0.16 0.99 0.00 0.00 0.00 175.76 176.07 2vw4 s THR 115 N -3.36 1.58 -0.04 0.00 2.01 -1.26 -0.41 115.64 114.16 2vw4 s THR 115 Ca 0.01 -0.68 0.05 0.00 0.31 0.00 0.00 61.69 61.38 2vw4 s THR 115 Cb 0.02 -1.44 -0.02 0.00 0.01 0.00 0.00 72.50 71.07 2vw4 s THR 115 CO -0.08 0.46 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.89 2vw4 s LEU 116 N 1.02 2.46 -0.03 4.42 2.96 -0.08 -4.98 118.68 124.46 2vw4 s LEU 116 Ca -0.05 -0.31 0.07 0.00 -0.22 0.00 0.00 54.13 53.62 2vw4 s LEU 116 Cb -0.15 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.05 2vw4 s LEU 116 CO -0.03 0.32 -0.25 -0.60 -1.32 0.00 0.00 176.35 174.48 2vw4 s ARG 117 N -0.60 2.12 0.04 1.98 3.52 -1.26 -0.64 118.95 124.11 2vw4 s ARG 117 Ca 0.09 -0.89 -0.10 0.00 -0.13 0.00 0.00 55.73 54.69 2vw4 s ARG 117 Cb -0.11 -1.99 0.01 0.00 -1.56 0.00 0.00 34.95 31.30 2vw4 s ARG 117 CO 0.00 0.51 0.22 -0.59 -0.81 0.00 0.00 175.30 174.63 2vw4 s PHE 118 N -0.50 0.03 -0.19 5.12 -0.12 -0.42 -5.00 117.98 116.89 2vw4 s PHE 118 Ca 0.07 -0.25 -0.26 0.00 -0.05 0.00 0.00 56.93 56.44 2vw4 s PHE 118 Cb -0.10 -0.01 -0.01 0.00 -0.63 0.00 0.00 43.02 42.27 2vw4 s PHE 118 CO -0.00 -0.45 0.89 0.21 -0.05 0.00 0.00 175.22 175.82 2vw4 s LYS 119 N -2.65 4.27 -1.33 1.99 2.20 -1.26 -1.17 119.74 121.79 2vw4 s LYS 119 Ca -0.04 1.11 -0.13 0.00 -0.36 0.00 0.00 55.97 56.55 2vw4 s LYS 119 Cb -0.01 -3.60 0.11 0.00 -1.51 0.00 0.00 37.83 32.82 2vw4 s LYS 119 CO -0.04 -0.44 1.91 0.00 -0.36 0.00 0.00 175.35 176.41 2vw4 n ALA 120 N 5.64 4.93 1.08 3.13 0.00 -0.41 -4.71 120.51 130.17 2vw4 n ALA 120 Ca 0.07 -4.09 0.11 0.00 0.00 0.00 0.00 53.44 49.53 2vw4 n ALA 120 Cb 0.48 -3.27 0.35 0.00 0.00 0.00 0.00 19.45 17.01 2vw4 n ALA 120 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2vw4 n ASP 121 N 5.55 2.04 -3.93 0.00 5.75 -1.26 -1.00 116.55 123.70 2vw4 n ASP 121 Ca 0.45 -1.75 -0.22 0.00 -0.01 0.00 0.00 54.79 53.25 2vw4 n ASP 121 Cb 0.40 -0.11 -0.16 0.00 -1.03 0.00 0.00 41.12 40.21 2vw4 n ASP 121 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2vw4 s ARG 122 N -1.77 1.14 0.41 0.11 0.52 -1.26 -4.80 118.95 113.30 2vw4 s ARG 122 Ca 0.34 -0.20 -0.22 0.00 -0.52 0.00 0.00 55.73 55.12 2vw4 s ARG 122 Cb 0.19 -1.08 -0.10 0.00 0.52 0.00 0.00 34.95 34.48 2vw4 s ARG 122 CO 0.28 -0.07 0.98 -1.54 0.02 0.00 0.00 175.30 174.97 2vw4 s SER 123 N 0.93 6.89 0.00 0.23 1.04 -1.26 -4.77 113.70 116.75 2vw4 s SER 123 Ca -0.10 1.81 0.00 0.00 0.48 0.00 0.00 55.95 58.14 2vw4 s SER 123 Cb -0.15 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.42 2vw4 s SER 123 CO 0.00 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.44 2vw4 n GLY 124 N -0.19 1.00 3.73 7.32 0.00 0.50 -3.13 105.19 114.42 2vw4 n GLY 124 Ca 0.06 -1.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.01 2vw4 n GLY 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vw4 s THR 125 N -1.48 5.25 -0.03 2.61 -4.23 0.37 0.13 115.64 118.25 2vw4 s THR 125 Ca 0.00 0.75 0.03 0.00 -1.18 0.00 0.00 61.69 61.28 2vw4 s THR 125 Cb 0.00 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 70.12 2vw4 s THR 125 CO 0.00 0.36 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.97 2vw4 s PHE 126 N 0.52 1.13 0.33 3.99 0.40 0.84 -4.37 117.98 120.82 2vw4 s PHE 126 Ca 0.21 -0.30 -0.29 0.00 -0.60 0.00 0.00 56.93 55.96 2vw4 s PHE 126 Cb -0.14 -0.79 -0.10 0.00 0.51 0.00 0.00 43.02 42.49 2vw4 s PHE 126 CO 0.07 -0.12 1.36 0.08 0.70 0.00 0.00 175.22 177.32 2vw4 s VAL 127 N 0.17 2.57 0.07 -0.44 1.01 -1.26 -0.14 120.40 122.38 2vw4 s VAL 127 Ca -0.03 0.56 0.07 0.00 0.00 0.00 0.00 61.98 62.57 2vw4 s VAL 127 Cb -0.09 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 2vw4 s VAL 127 CO 0.01 0.13 -0.15 -0.72 0.00 0.00 0.00 175.10 174.36 2vw4 s TYR 128 N -0.96 2.63 0.11 5.22 -0.85 0.42 -1.45 117.35 122.47 2vw4 s TYR 128 Ca 0.51 -0.21 -0.17 0.00 -0.52 0.00 0.00 57.07 56.68 2vw4 s TYR 128 Cb -0.41 -1.44 0.04 0.00 0.38 0.00 0.00 41.96 40.52 2vw4 s TYR 128 CO 0.54 0.34 0.42 -3.38 -1.52 0.00 0.00 175.55 171.94 2vw4 s HIS 129 N -1.05 -0.25 0.42 -3.49 -3.43 -0.09 -1.32 115.29 106.09 2vw4 s HIS 129 Ca 0.17 -0.01 -0.24 0.00 -0.80 0.00 0.00 55.06 54.18 2vw4 s HIS 129 Cb -0.11 0.28 -0.08 0.00 -1.43 0.00 0.00 32.58 31.24 2vw4 s HIS 129 CO 0.08 -0.69 1.15 0.00 -2.00 0.00 0.00 174.74 173.28 2vw4 n ALA 131 N -0.11 0.75 -2.19 0.00 0.00 -1.26 -4.50 120.51 113.20 2vw4 n ALA 131 Ca 0.05 -2.53 -0.41 0.00 0.00 0.00 0.00 53.44 50.55 2vw4 n ALA 131 Cb 0.47 -1.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 2vw4 n ALA 131 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2vw4 s PRO 132 N -0.43 4.59 0.17 0.00 0.02 -1.26 -4.87 135.00 133.22 2vw4 s PRO 132 Ca 0.34 1.65 -0.33 0.00 0.02 0.00 0.00 61.00 62.67 2vw4 s PRO 132 Cb 0.21 -3.32 -0.15 0.00 0.02 0.00 0.00 34.50 31.26 2vw4 s PRO 132 CO -0.16 0.06 1.34 -1.91 -0.33 0.00 0.00 177.00 175.99 2vw4 n GLU 133 N 2.75 1.55 -0.15 5.54 2.13 -1.26 -1.28 120.64 129.92 2vw4 n GLU 133 Ca 0.04 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.41 2vw4 n GLU 133 Cb 0.47 -2.17 0.00 0.00 0.27 0.00 0.00 31.44 30.01 2vw4 n GLU 133 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2vw4 n GLY 134 N 2.41 2.61 2.00 8.31 0.00 -1.26 -4.80 105.19 114.45 2vw4 n GLY 134 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.19 2vw4 n GLY 134 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2vw4 n MET 135 N -2.00 0.79 0.33 1.61 0.00 -0.40 -4.97 117.12 112.49 2vw4 n MET 135 Ca 0.00 -2.67 -0.17 0.00 0.00 0.00 0.00 57.70 54.86 2vw4 n MET 135 Cb 0.00 -0.72 -0.09 0.00 0.00 0.00 0.00 33.22 32.42 2vw4 n MET 135 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2vw4 h VAL 136 N 6.17 0.37 -0.73 3.17 2.07 -1.83 -2.59 116.25 122.88 2vw4 h VAL 136 Ca -0.18 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 2vw4 h VAL 136 Cb 1.62 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2vw4 h VAL 136 CO 0.14 0.00 0.38 1.55 0.02 0.00 0.00 177.57 179.66 2vw4 h PRO 137 N -0.83 1.03 -0.50 1.57 0.13 -1.93 -2.27 132.00 129.20 2vw4 h PRO 137 Ca -0.08 -0.12 0.02 0.00 -0.87 0.00 0.00 66.00 64.95 2vw4 h PRO 137 Cb 0.65 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 31.55 2vw4 h PRO 137 CO 0.11 0.77 0.31 2.35 -0.23 0.00 0.00 178.00 181.31 2vw4 h TRP 138 N 1.03 0.57 -0.56 1.56 7.01 -1.93 -0.02 115.95 123.61 2vw4 h TRP 138 Ca 0.26 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.18 2vw4 h TRP 138 Cb 0.06 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 26.91 2vw4 h TRP 138 CO 0.01 0.33 -0.02 0.45 -2.79 0.00 0.00 178.44 176.43 2vw4 h HIS 139 N 0.61 1.07 0.32 2.65 3.86 -1.08 -1.79 115.15 120.79 2vw4 h HIS 139 Ca 0.20 -0.18 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 2vw4 h HIS 139 Cb 0.01 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.20 2vw4 h HIS 139 CO -0.06 0.96 -0.15 0.28 0.86 0.00 0.00 177.93 179.82 2vw4 h VAL 140 N 0.90 0.68 0.00 2.45 2.07 -1.03 -2.55 116.25 118.77 2vw4 h VAL 140 Ca 0.16 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 2vw4 h VAL 140 Cb 0.55 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2vw4 h VAL 140 CO 0.03 0.10 -0.07 -0.37 0.02 0.00 0.00 177.57 177.28 2vw4 h VAL 141 N -0.74 0.27 0.00 2.57 -1.51 -1.01 -1.85 116.25 113.98 2vw4 h VAL 141 Ca -0.04 -0.49 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 2vw4 h VAL 141 Cb 0.50 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 2vw4 h VAL 141 CO 0.07 0.07 0.00 -1.20 -1.23 0.00 0.00 177.57 175.28 2vw4 n SER 142 N -3.32 0.00 0.00 4.19 7.64 -0.68 -4.74 113.62 116.72 2vw4 n SER 142 Ca -0.01 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.74 2vw4 n SER 142 Cb 0.25 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 2vw4 n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vw4 n GLY 143 N 1.13 0.11 2.89 0.23 0.00 -0.70 -1.45 105.19 107.41 2vw4 n GLY 143 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2vw4 n GLY 143 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vw4 n MET 144 N 0.00 3.50 -3.63 1.61 2.81 -0.97 -4.56 117.12 115.89 2vw4 n MET 144 Ca 0.00 -3.42 -0.10 0.00 -1.81 0.00 0.00 57.70 52.36 2vw4 n MET 144 Cb 0.00 -2.99 -0.04 0.00 -0.71 0.00 0.00 33.22 29.48 2vw4 n MET 144 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2vw4 s SER 145 N 1.33 -0.27 0.00 7.83 1.04 -1.26 -1.79 113.70 120.58 2vw4 s SER 145 Ca 0.41 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.53 2vw4 s SER 145 Cb 0.09 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2vw4 s SER 145 CO -0.01 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 173.94 2vw4 n GLY 146 N -0.25 1.50 3.20 7.32 0.00 -0.43 -0.62 105.19 115.91 2vw4 n GLY 146 Ca -0.15 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.72 2vw4 n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vw4 s THR 147 N -2.58 1.71 -0.29 2.61 2.01 -1.26 -0.44 115.64 117.41 2vw4 s THR 147 Ca 0.00 -0.88 -0.11 0.00 0.31 0.00 0.00 61.69 61.01 2vw4 s THR 147 Cb 0.00 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 2vw4 s THR 147 CO 0.00 0.48 0.19 -0.22 -0.69 0.00 0.00 174.62 174.38 2vw4 s LEU 148 N -0.11 4.05 -0.25 4.42 2.96 0.80 -1.72 118.68 128.83 2vw4 s LEU 148 Ca -0.02 -0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 53.69 2vw4 s LEU 148 Cb -0.12 -2.10 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 2vw4 s LEU 148 CO 0.02 -0.08 0.14 -0.32 -1.32 0.00 0.00 176.35 174.80 2vw4 s MET 149 N 1.74 3.92 -0.40 1.98 -2.45 0.59 -0.11 119.30 124.57 2vw4 s MET 149 Ca 0.07 -0.34 -0.05 0.00 -1.25 0.00 0.00 55.69 54.12 2vw4 s MET 149 Cb -0.16 -3.51 0.09 0.00 1.25 0.00 0.00 34.83 32.51 2vw4 s MET 149 CO 0.10 -0.07 0.20 0.08 1.05 0.00 0.00 175.02 176.38 2vw4 s VAL 150 N 1.39 3.53 0.24 10.11 1.01 0.12 -1.00 120.40 135.80 2vw4 s VAL 150 Ca 0.07 -1.79 -0.24 0.00 0.00 0.00 0.00 61.98 60.02 2vw4 s VAL 150 Cb -0.15 -3.29 -0.09 0.00 0.00 0.00 0.00 36.38 32.85 2vw4 s VAL 150 CO 0.06 -0.57 0.83 -0.76 0.00 0.00 0.00 175.10 174.66 2vw4 s LEU 151 N 1.24 4.44 0.61 3.92 1.43 -0.08 -0.37 118.68 129.87 2vw4 s LEU 151 Ca 0.05 1.66 -0.18 0.00 -1.03 0.00 0.00 54.13 54.63 2vw4 s LEU 151 Cb -0.23 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.33 2vw4 s LEU 151 CO -0.02 0.07 1.22 -2.84 0.23 0.00 0.00 176.35 175.01 2vw4 s PRO 152 N -1.68 2.86 0.46 1.29 0.02 -1.26 -0.63 135.00 136.06 2vw4 s PRO 152 Ca 0.43 1.85 0.11 0.00 0.02 0.00 0.00 61.00 63.42 2vw4 s PRO 152 Cb -0.20 -1.91 1.04 0.00 0.02 0.00 0.00 34.50 33.45 2vw4 s PRO 152 CO 0.24 -1.30 2.09 -0.09 -0.33 0.00 0.00 177.00 177.61 2vw4 h ARG 153 N 0.76 0.31 -0.63 5.54 2.43 -1.89 -0.35 114.38 120.54 2vw4 h ARG 153 Ca -0.50 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 2vw4 h ARG 153 Cb 1.30 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2vw4 h ARG 153 CO 0.54 0.20 0.00 -3.47 -1.51 0.00 0.00 179.97 175.74 2vw4 n ASP 154 N -4.50 5.16 -0.22 -3.80 2.03 -1.26 -0.92 116.55 113.04 2vw4 n ASP 154 Ca 0.01 -2.81 0.02 0.00 0.52 0.00 0.00 54.79 52.53 2vw4 n ASP 154 Cb 0.11 -0.66 -0.01 0.00 -0.72 0.00 0.00 41.12 39.84 2vw4 n ASP 154 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2vw4 n GLY 155 N 0.55 -2.07 3.81 0.27 0.00 -0.14 -4.54 105.19 103.06 2vw4 n GLY 155 Ca 0.24 -1.42 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 2vw4 n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vw4 s LEU 156 N 0.00 3.89 0.02 0.99 1.43 -1.25 -4.54 118.68 119.23 2vw4 s LEU 156 Ca 0.00 1.81 0.03 0.00 -1.03 0.00 0.00 54.13 54.94 2vw4 s LEU 156 Cb 0.00 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.65 2vw4 s LEU 156 CO 0.00 -0.57 -0.10 -0.54 0.23 0.00 0.00 176.35 175.37 2vw4 s LYS 157 N -3.21 0.73 0.94 1.70 -0.14 -1.26 -0.82 119.74 117.67 2vw4 s LYS 157 Ca 0.65 -0.57 -0.15 0.00 -1.36 0.00 0.00 55.97 54.53 2vw4 s LYS 157 Cb -0.13 -0.67 0.19 0.00 -1.68 0.00 0.00 37.83 35.54 2vw4 s LYS 157 CO 0.16 0.17 1.30 0.16 -0.76 0.00 0.00 175.35 176.38 2vw4 s ASP 158 N -0.86 3.26 0.62 2.83 -4.77 0.96 -4.65 116.67 114.06 2vw4 s ASP 158 Ca -0.00 0.28 0.35 0.00 -3.30 0.00 0.00 52.55 49.88 2vw4 s ASP 158 Cb -0.06 -0.37 2.04 0.00 -1.09 0.00 0.00 42.92 43.44 2vw4 s ASP 158 CO 0.00 -2.64 2.30 -0.65 0.70 0.00 0.00 175.17 174.88 2vw4 h PRO 159 N -1.56 0.00 -0.38 2.11 0.11 -1.89 -0.24 132.00 130.15 2vw4 h PRO 159 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2vw4 h PRO 159 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2vw4 h PRO 159 CO 0.40 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.23 2vw4 n GLN 160 N -3.56 2.15 -0.99 1.05 3.00 -1.26 -4.92 117.38 112.85 2vw4 n GLN 160 Ca -0.03 -1.76 0.00 0.00 -0.01 0.00 0.00 57.00 55.21 2vw4 n GLN 160 Cb 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 30.24 28.89 2vw4 n GLN 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2vw4 n GLY 161 N 1.32 0.46 3.84 1.08 0.00 -0.10 -5.05 105.19 106.74 2vw4 n GLY 161 Ca 0.18 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 2vw4 n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vw4 s LYS 162 N -0.68 4.05 0.38 1.61 1.02 -1.26 -4.73 119.74 120.13 2vw4 s LYS 162 Ca 0.00 0.92 -0.26 0.00 0.02 0.00 0.00 55.97 56.65 2vw4 s LYS 162 Cb 0.00 -2.23 -0.09 0.00 -0.52 0.00 0.00 37.83 34.99 2vw4 s LYS 162 CO 0.00 -0.08 1.21 -1.25 -0.92 0.00 0.00 175.35 174.31 2vw4 s PRO 163 N -3.51 4.16 0.15 -1.68 0.04 -1.26 -0.02 135.00 132.87 2vw4 s PRO 163 Ca 0.59 1.95 0.07 0.00 0.04 0.00 0.00 61.00 63.64 2vw4 s PRO 163 Cb -0.10 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.59 2vw4 s PRO 163 CO 0.22 -0.26 -0.16 -0.51 0.04 0.00 0.00 177.00 176.32 2vw4 s LEU 164 N -2.25 2.43 0.20 -3.56 1.43 -0.00 -4.72 118.68 112.21 2vw4 s LEU 164 Ca 0.54 -0.85 -0.15 0.00 -1.03 0.00 0.00 54.13 52.64 2vw4 s LEU 164 Cb -0.33 -0.68 0.01 0.00 0.03 0.00 0.00 46.19 45.22 2vw4 s LEU 164 CO 0.43 -0.10 0.48 -1.38 0.23 0.00 0.00 176.35 176.00 2vw4 s HIS 165 N -2.17 0.07 0.09 0.29 -3.43 -1.26 -3.76 115.29 105.12 2vw4 s HIS 165 Ca 0.13 -0.43 0.08 0.00 -0.80 0.00 0.00 55.06 54.04 2vw4 s HIS 165 Cb -0.05 0.28 -0.03 0.00 -1.43 0.00 0.00 32.58 31.35 2vw4 s HIS 165 CO 0.05 -0.91 -0.21 1.52 -2.00 0.00 0.00 174.74 173.19 2vw4 s TYR 166 N -3.92 1.77 -0.17 0.38 1.13 -1.26 -4.90 117.35 110.38 2vw4 s TYR 166 Ca 0.13 -0.41 0.22 0.00 -1.41 0.00 0.00 57.07 55.60 2vw4 s TYR 166 Cb -0.00 -0.98 -0.11 0.00 -1.10 0.00 0.00 41.96 39.76 2vw4 s TYR 166 CO 0.00 0.18 0.85 -0.25 -2.51 0.00 0.00 175.55 173.83 2vw4 n ASP 167 N 1.22 0.59 -3.77 -0.18 8.00 0.15 -4.94 116.55 117.62 2vw4 n ASP 167 Ca -0.19 0.23 -0.13 0.00 0.71 0.00 0.00 54.79 55.41 2vw4 n ASP 167 Cb 0.54 0.88 -0.11 0.00 -0.02 0.00 0.00 41.12 42.41 2vw4 n ASP 167 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2vw4 s ARG 168 N -3.37 0.36 -0.05 -1.24 6.06 -0.99 -5.01 118.95 114.71 2vw4 s ARG 168 Ca -0.03 0.36 0.05 0.00 -2.50 0.00 0.00 55.73 53.61 2vw4 s ARG 168 Cb 0.11 0.17 -0.01 0.00 0.06 0.00 0.00 34.95 35.28 2vw4 s ARG 168 CO 0.83 -0.05 -0.20 0.00 -2.50 0.00 0.00 175.30 173.37 2vw4 s ALA 169 N 0.05 1.79 0.09 6.12 0.00 -1.26 -0.34 121.76 128.22 2vw4 s ALA 169 Ca -0.01 -0.83 0.08 0.00 0.00 0.00 0.00 51.96 51.20 2vw4 s ALA 169 Cb -0.02 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 2vw4 s ALA 169 CO 0.01 0.33 -0.22 0.71 0.00 0.00 0.00 175.76 176.59 2vw4 s TYR 170 N -0.02 1.86 -0.13 0.00 2.02 -0.12 -4.20 117.35 116.76 2vw4 s TYR 170 Ca -0.04 -0.41 0.02 0.00 -0.37 0.00 0.00 57.07 56.27 2vw4 s TYR 170 Cb -0.13 -1.03 0.01 0.00 -0.40 0.00 0.00 41.96 40.41 2vw4 s TYR 170 CO 0.03 0.20 -0.19 -0.08 -1.57 0.00 0.00 175.55 173.94 2vw4 s THR 171 N -1.07 1.83 -0.15 -0.71 -1.32 -0.17 -1.31 115.64 112.73 2vw4 s THR 171 Ca 0.07 -0.83 0.02 0.00 -1.21 0.00 0.00 61.69 59.74 2vw4 s THR 171 Cb -0.10 -1.64 0.01 0.00 -1.51 0.00 0.00 72.50 69.27 2vw4 s THR 171 CO 0.04 0.50 -0.21 -0.63 -2.21 0.00 0.00 174.62 172.12 2vw4 s ILE 172 N 0.95 2.02 -0.16 5.08 1.09 0.68 -4.41 121.20 126.46 2vw4 s ILE 172 Ca -0.05 -0.94 -0.05 0.00 -1.10 0.00 0.00 60.65 58.51 2vw4 s ILE 172 Cb -0.15 -1.81 -0.03 0.00 -1.06 0.00 0.00 42.46 39.41 2vw4 s ILE 172 CO -0.03 0.54 -0.00 -0.83 -0.10 0.00 0.00 174.94 174.51 2vw4 s GLY 173 N 1.03 1.78 -0.16 6.18 0.00 -1.26 -0.98 107.32 113.91 2vw4 s GLY 173 Ca -0.02 -0.79 -0.04 0.00 0.00 0.00 0.00 44.72 43.87 2vw4 s GLY 173 CO -0.07 -0.03 -0.03 1.85 0.00 0.00 0.00 173.10 174.82 2vw4 s GLU 174 N 0.36 3.68 -0.24 2.90 2.12 -0.15 -0.82 118.70 126.56 2vw4 s GLU 174 Ca -0.02 -0.51 0.01 0.00 0.36 0.00 0.00 54.97 54.81 2vw4 s GLU 174 Cb -0.14 -2.93 0.06 0.00 0.26 0.00 0.00 34.13 31.39 2vw4 s GLU 174 CO 0.02 0.24 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.85 2vw4 s PHE 175 N 0.36 2.63 -0.30 5.30 0.08 0.46 -4.53 117.98 121.98 2vw4 s PHE 175 Ca -0.04 -1.88 -0.29 0.00 0.12 0.00 0.00 56.93 54.84 2vw4 s PHE 175 Cb -0.14 -1.68 0.01 0.00 -0.57 0.00 0.00 43.02 40.64 2vw4 s PHE 175 CO 0.03 -0.80 1.16 0.16 -0.10 0.00 0.00 175.22 175.67 2vw4 s ASP 176 N 1.32 6.86 0.08 1.36 -4.77 -1.26 -1.55 116.67 118.72 2vw4 s ASP 176 Ca -0.06 1.17 0.04 0.00 -3.30 0.00 0.00 52.55 50.40 2vw4 s ASP 176 Cb -0.19 -2.54 -0.04 0.00 -1.09 0.00 0.00 42.92 39.06 2vw4 s ASP 176 CO -0.06 -0.92 0.03 -0.76 0.70 0.00 0.00 175.17 174.16 2vw4 s LEU 177 N 3.83 3.58 -0.50 2.11 1.43 0.17 -4.85 118.68 124.45 2vw4 s LEU 177 Ca 0.49 -0.12 0.07 0.00 -1.03 0.00 0.00 54.13 53.55 2vw4 s LEU 177 Cb -0.15 -2.29 0.26 0.00 0.03 0.00 0.00 46.19 44.05 2vw4 s LEU 177 CO 0.17 0.18 0.64 -1.22 0.23 0.00 0.00 176.35 176.35 2vw4 n TYR 178 N 0.55 1.52 -2.90 0.29 4.01 -1.26 -0.57 117.16 118.80 2vw4 n TYR 178 Ca -0.10 -3.84 -0.41 0.00 -0.16 0.00 0.00 57.90 53.38 2vw4 n TYR 178 Cb 0.52 -0.45 -0.04 0.00 -0.31 0.00 0.00 39.34 39.06 2vw4 n TYR 178 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2vw4 s ILE 179 N -1.93 4.87 0.72 -0.72 -1.09 -1.26 -4.71 121.20 117.08 2vw4 s ILE 179 Ca 0.38 1.59 -0.14 0.00 -2.23 0.00 0.00 60.65 60.24 2vw4 s ILE 179 Cb 0.18 -4.12 0.03 0.00 -1.58 0.00 0.00 42.46 36.97 2vw4 s ILE 179 CO -0.07 -0.01 1.15 -2.84 -1.23 0.00 0.00 174.94 171.94 2vw4 s PRO 180 N 2.43 2.32 0.11 2.79 0.02 -1.26 -4.84 135.00 136.57 2vw4 s PRO 180 Ca 0.36 1.54 0.10 0.00 0.02 0.00 0.00 61.00 63.02 2vw4 s PRO 180 Cb -0.16 -1.88 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 2vw4 s PRO 180 CO 0.10 -1.65 -0.23 0.15 -0.33 0.00 0.00 177.00 175.04 2vw4 s LYS 181 N -4.13 1.64 0.80 5.54 1.02 -1.26 -1.15 119.74 122.19 2vw4 s LYS 181 Ca 0.70 -1.23 -0.05 0.00 0.02 0.00 0.00 55.97 55.40 2vw4 s LYS 181 Cb -0.24 -2.01 0.17 0.00 -0.52 0.00 0.00 37.83 35.23 2vw4 s LYS 181 CO 0.46 0.48 1.09 0.41 -0.92 0.00 0.00 175.35 176.86 2vw4 n GLY 182 N 1.04 -0.03 0.36 -3.33 0.00 -0.46 -4.86 105.19 97.91 2vw4 n GLY 182 Ca -0.17 -1.93 0.15 0.00 0.00 0.00 0.00 46.02 44.07 2vw4 n GLY 182 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2vw4 h PRO 183 N 0.00 0.25 0.00 1.61 0.11 -2.02 -0.60 132.00 131.36 2vw4 h PRO 183 Ca -0.36 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2vw4 h PRO 183 Cb 1.19 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2vw4 h PRO 183 CO 0.33 0.17 0.00 -0.40 -0.21 0.00 0.00 178.00 177.89 2vw4 n ASP 184 N -4.45 0.00 0.00 -2.05 5.75 -1.26 -4.89 116.55 109.65 2vw4 n ASP 184 Ca 0.10 -0.51 0.00 0.00 -0.01 0.00 0.00 54.79 54.37 2vw4 n ASP 184 Cb 0.47 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 2vw4 n ASP 184 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vw4 n GLY 185 N 0.47 0.82 3.86 6.12 0.00 -0.23 -5.03 105.19 111.21 2vw4 n GLY 185 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 2vw4 n GLY 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vw4 s LYS 186 N -0.09 3.86 0.39 1.61 1.02 -1.26 -4.81 119.74 120.45 2vw4 s LYS 186 Ca 0.00 0.36 -0.27 0.00 0.02 0.00 0.00 55.97 56.07 2vw4 s LYS 186 Cb 0.00 -2.72 -0.10 0.00 -0.52 0.00 0.00 37.83 34.49 2vw4 s LYS 186 CO 0.00 0.36 1.36 0.71 -0.92 0.00 0.00 175.35 176.85 2vw4 s TYR 187 N -1.72 2.78 0.30 3.18 2.02 -1.26 -1.36 117.35 121.29 2vw4 s TYR 187 Ca 0.45 1.34 -0.27 0.00 -0.37 0.00 0.00 57.07 58.22 2vw4 s TYR 187 Cb -0.12 -3.78 -0.10 0.00 -0.40 0.00 0.00 41.96 37.56 2vw4 s TYR 187 CO 0.20 -2.32 0.94 0.15 -1.57 0.00 0.00 175.55 172.95 2vw4 s LYS 188 N -2.12 4.64 -0.16 -0.62 1.02 -0.30 -4.82 119.74 117.38 2vw4 s LYS 188 Ca 0.54 1.36 -0.02 0.00 0.02 0.00 0.00 55.97 57.87 2vw4 s LYS 188 Cb -0.41 -2.92 -0.01 0.00 -0.52 0.00 0.00 37.83 33.96 2vw4 s LYS 188 CO 0.54 0.34 -0.10 0.34 -0.92 0.00 0.00 175.35 175.56 2vw4 s ASP 189 N -1.51 4.17 -0.09 2.83 2.15 -1.26 -4.76 116.67 118.20 2vw4 s ASP 189 Ca 0.48 -0.33 -0.01 0.00 0.43 0.00 0.00 52.55 53.12 2vw4 s ASP 189 Cb -0.20 -1.66 -0.03 0.00 -0.30 0.00 0.00 42.92 40.72 2vw4 s ASP 189 CO 0.26 0.11 -0.04 -0.31 -0.17 0.00 0.00 175.17 175.02 2vw4 s TYR 190 N 0.68 3.04 0.31 -5.34 2.02 -1.26 -5.01 117.35 111.80 2vw4 s TYR 190 Ca -0.05 0.02 0.05 0.00 -0.37 0.00 0.00 57.07 56.72 2vw4 s TYR 190 Cb -0.15 -1.80 0.53 0.00 -0.40 0.00 0.00 41.96 40.14 2vw4 s TYR 190 CO 0.02 0.30 1.78 0.00 -1.57 0.00 0.00 175.55 176.08 2vw4 h ALA 191 N 5.55 1.23 -2.27 3.71 0.00 -1.99 -3.45 119.26 122.03 2vw4 h ALA 191 Ca -0.45 -0.31 -0.28 0.00 0.00 0.00 0.00 54.91 53.86 2vw4 h ALA 191 Cb 1.18 -0.11 -0.15 0.00 0.00 0.00 0.00 17.79 18.72 2vw4 h ALA 191 CO 0.56 0.50 -0.67 0.95 0.00 0.00 0.00 179.25 180.59 2vw4 s THR 192 N -4.52 0.74 0.13 0.00 -4.23 -1.26 -5.06 115.64 101.44 2vw4 s THR 192 Ca -0.06 -1.98 -0.17 0.00 -1.18 0.00 0.00 61.69 58.29 2vw4 s THR 192 Cb 0.14 -2.03 -0.03 0.00 1.34 0.00 0.00 72.50 71.92 2vw4 s THR 192 CO 0.77 -0.56 1.72 0.25 -0.54 0.00 0.00 174.62 176.26 2vw4 h LEU 193 N 2.74 0.42 -1.31 4.79 5.85 -1.94 -3.10 115.31 122.76 2vw4 h LEU 193 Ca -0.36 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.28 2vw4 h LEU 193 Cb 1.20 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 2vw4 h LEU 193 CO 0.63 0.40 0.48 0.00 -0.34 0.00 0.00 178.44 179.61 2vw4 h ALA 194 N 1.04 1.54 0.00 1.25 0.00 -1.99 -2.18 119.26 118.92 2vw4 h ALA 194 Ca 0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2vw4 h ALA 194 Cb 0.08 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 2vw4 h ALA 194 CO -0.02 0.40 -0.08 0.93 0.00 0.00 0.00 179.25 180.49 2vw4 h GLU 195 N 0.93 0.00 0.00 0.00 5.08 -1.96 -2.66 114.58 115.96 2vw4 h GLU 195 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2vw4 h GLU 195 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2vw4 h GLU 195 CO -0.07 0.08 0.00 0.66 -1.00 0.00 0.00 179.01 178.67 2vw4 h SER 196 N 0.00 0.00 0.74 1.42 4.64 -1.38 -3.41 113.55 115.55 2vw4 h SER 196 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2vw4 h SER 196 Cb 0.47 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2vw4 h SER 196 CO 0.01 0.00 -0.36 0.22 -0.87 0.00 0.00 176.83 175.83 2vw4 h TYR 197 N 0.00 -0.94 -0.28 4.77 3.20 -1.54 -2.05 116.97 120.13 2vw4 h TYR 197 Ca 0.00 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 2vw4 h TYR 197 Cb 0.75 0.32 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 2vw4 h TYR 197 CO 0.00 -0.58 0.17 0.78 -1.64 0.00 0.00 178.16 176.88 2vw4 h GLY 198 N -1.00 0.42 1.01 1.82 0.00 -1.81 -0.72 103.07 102.79 2vw4 h GLY 198 Ca -0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 2vw4 h GLY 198 CO 0.16 0.17 0.37 -0.55 0.00 0.00 0.00 176.54 176.69 2vw4 h ASP 199 N 0.35 0.92 -0.55 0.19 3.32 -1.85 -2.72 116.42 116.09 2vw4 h ASP 199 Ca 0.10 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 2vw4 h ASP 199 Cb 0.03 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 2vw4 h ASP 199 CO -0.02 0.78 0.19 0.74 -1.72 0.00 0.00 179.24 179.21 2vw4 h THR 200 N 1.00 1.23 -0.84 0.35 2.02 -0.94 -2.56 112.91 113.17 2vw4 h THR 200 Ca 0.25 -0.75 0.04 0.00 0.77 0.00 0.00 66.41 66.72 2vw4 h THR 200 Cb 0.08 0.69 -0.05 0.00 -1.74 0.00 0.00 68.15 67.14 2vw4 h THR 200 CO -0.04 0.28 0.55 0.58 0.37 0.00 0.00 175.52 177.27 2vw4 h VAL 201 N 0.75 1.12 -0.48 3.16 2.07 -0.95 0.29 116.25 122.22 2vw4 h VAL 201 Ca 0.18 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2vw4 h VAL 201 Cb 0.25 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 2vw4 h VAL 201 CO -0.01 0.19 0.24 -0.61 0.02 0.00 0.00 177.57 177.40 2vw4 h GLN 202 N 1.02 0.68 -0.23 1.57 4.15 -1.17 -1.34 115.11 119.79 2vw4 h GLN 202 Ca 0.34 -0.09 -0.02 0.00 0.77 0.00 0.00 58.65 59.65 2vw4 h GLN 202 Cb 0.07 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 2vw4 h GLN 202 CO -0.11 0.55 0.07 0.28 -1.93 0.00 0.00 178.83 177.69 2vw4 h VAL 203 N 0.63 1.20 -0.63 2.39 2.07 -1.02 -3.05 116.25 117.84 2vw4 h VAL 203 Ca 0.17 -0.63 0.13 0.00 0.82 0.00 0.00 66.70 67.19 2vw4 h VAL 203 Cb 0.09 1.19 -0.10 0.00 -1.52 0.00 0.00 31.29 30.94 2vw4 h VAL 203 CO -0.02 0.20 0.03 0.24 0.02 0.00 0.00 177.57 178.04 2vw4 h MET 204 N 0.19 0.14 0.00 1.57 2.86 -0.68 -1.17 114.93 117.83 2vw4 h MET 204 Ca 0.07 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2vw4 h MET 204 Cb 0.25 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.88 2vw4 h MET 204 CO -0.00 0.09 0.00 0.00 1.06 0.00 0.00 176.91 178.06 2vw4 h ARG 205 N 0.14 0.00 0.00 1.72 3.08 -1.14 0.73 114.38 118.92 2vw4 h ARG 205 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.38 2vw4 h ARG 205 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2vw4 h ARG 205 CO -0.52 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 178.63 2vw4 n THR 206 N -2.76 0.50 -1.31 2.04 -2.24 -0.44 -4.92 114.28 105.15 2vw4 n THR 206 Ca -0.01 -0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 2vw4 n THR 206 Cb 0.11 -0.68 -0.05 0.00 -2.10 0.00 0.00 70.33 67.61 2vw4 n THR 206 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2vw4 n LEU 207 N -1.99 -0.41 -4.17 3.22 4.77 0.25 -4.97 117.00 113.70 2vw4 n LEU 207 Ca 0.05 0.27 -0.35 0.00 -0.03 0.00 0.00 56.01 55.94 2vw4 n LEU 207 Cb 0.36 -2.46 -0.13 0.00 -2.33 0.00 0.00 43.42 38.86 2vw4 n LEU 207 CO 0.27 -0.93 -0.30 -0.89 -1.33 0.00 0.00 177.39 174.20 2vw4 s THR 208 N -2.03 3.14 0.39 -5.08 2.01 -1.26 -5.10 115.64 107.72 2vw4 s THR 208 Ca 0.00 -1.52 -0.27 0.00 0.31 0.00 0.00 61.69 60.21 2vw4 s THR 208 Cb 0.00 -2.89 -0.09 0.00 0.01 0.00 0.00 72.50 69.52 2vw4 s THR 208 CO 0.00 -0.26 1.35 -2.84 -0.69 0.00 0.00 174.62 172.18 2vw4 s PRO 209 N 1.24 4.03 0.16 4.92 0.02 -1.26 -4.89 135.00 139.22 2vw4 s PRO 209 Ca -0.01 2.28 0.01 0.00 0.02 0.00 0.00 61.00 63.29 2vw4 s PRO 209 Cb -0.20 -2.85 -0.02 0.00 0.02 0.00 0.00 34.50 31.45 2vw4 s PRO 209 CO -0.01 -0.48 1.36 0.66 -0.33 0.00 0.00 177.00 178.20 2vw4 h SER 210 N 2.83 0.31 -5.01 2.53 4.64 -1.16 -3.47 113.55 114.23 2vw4 h SER 210 Ca -0.50 -0.25 -0.14 0.00 -0.47 0.00 0.00 61.79 60.43 2vw4 h SER 210 Cb 1.24 -0.10 -0.20 0.00 -0.31 0.00 0.00 62.40 63.04 2vw4 h SER 210 CO 0.63 1.05 -0.53 -1.00 -0.87 0.00 0.00 176.83 176.11 2vw4 s HIS 211 N -3.22 0.12 -0.15 4.77 3.76 -1.19 -4.92 115.29 114.46 2vw4 s HIS 211 Ca -0.03 -0.30 -0.02 0.00 -0.15 0.00 0.00 55.06 54.56 2vw4 s HIS 211 Cb 0.10 -0.10 0.05 0.00 1.11 0.00 0.00 32.58 33.74 2vw4 s HIS 211 CO 0.84 -0.30 0.00 0.42 -0.85 0.00 0.00 174.74 174.85 2vw4 s ILE 212 N -1.75 0.64 0.06 0.60 1.01 -0.10 -0.66 121.20 121.00 2vw4 s ILE 212 Ca -0.12 -0.39 0.08 0.00 0.00 0.00 0.00 60.65 60.22 2vw4 s ILE 212 Cb -0.06 -0.96 -0.03 0.00 0.01 0.00 0.00 42.46 41.42 2vw4 s ILE 212 CO -0.01 0.01 -0.22 0.68 0.00 0.00 0.00 174.94 175.41 2vw4 s VAL 213 N 1.83 1.75 -0.09 2.92 -7.23 -0.59 0.09 120.40 119.08 2vw4 s VAL 213 Ca 0.01 -1.30 -0.23 0.00 -1.81 0.00 0.00 61.98 58.66 2vw4 s VAL 213 Cb -0.15 -1.53 -0.03 0.00 0.56 0.00 0.00 36.38 35.22 2vw4 s VAL 213 CO -0.07 0.18 0.67 -0.36 -0.31 0.00 0.00 175.10 175.21 2vw4 s PHE 214 N -0.87 3.54 -1.46 2.82 0.08 -1.26 -0.40 117.98 120.43 2vw4 s PHE 214 Ca 0.08 1.18 -0.10 0.00 0.12 0.00 0.00 56.93 58.21 2vw4 s PHE 214 Cb -0.09 -2.79 0.05 0.00 -0.57 0.00 0.00 43.02 39.62 2vw4 s PHE 214 CO 0.02 0.05 0.84 0.09 -0.10 0.00 0.00 175.22 176.13 2vw4 n ASN 215 N 3.97 -5.34 0.00 1.36 4.13 0.00 -3.30 115.26 116.08 2vw4 n ASN 215 Ca -0.02 -0.52 0.00 0.00 1.68 0.00 0.00 54.58 55.72 2vw4 n ASN 215 Cb 0.51 -4.28 0.00 0.00 -1.54 0.00 0.00 39.78 34.47 2vw4 n ASN 215 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2vw4 n GLY 216 N -1.63 0.95 3.56 7.41 0.00 -1.22 -4.70 105.19 109.56 2vw4 n GLY 216 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 2vw4 n GLY 216 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vw4 s LYS 217 N -0.93 0.85 0.06 1.61 2.20 -1.21 -4.61 119.74 117.71 2vw4 s LYS 217 Ca 0.00 0.36 -0.34 0.00 -0.36 0.00 0.00 55.97 55.63 2vw4 s LYS 217 Cb 0.00 0.40 -0.13 0.00 -1.51 0.00 0.00 37.83 36.59 2vw4 s LYS 217 CO 0.00 -0.23 1.67 0.28 -0.36 0.00 0.00 175.35 176.71 2vw4 n VAL 218 N 1.23 0.21 -1.01 4.02 0.31 -0.24 -1.82 118.33 121.03 2vw4 n VAL 218 Ca -0.15 -0.04 -0.00 0.00 -0.01 0.00 0.00 64.34 64.14 2vw4 n VAL 218 Cb 0.57 -1.59 -0.00 0.00 -0.91 0.00 0.00 33.84 31.91 2vw4 n VAL 218 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2vw4 n GLY 219 N 3.72 0.45 0.37 2.92 0.00 -1.26 -4.83 105.19 106.55 2vw4 n GLY 219 Ca 0.19 -0.08 0.15 0.00 0.00 0.00 0.00 46.02 46.28 2vw4 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vw4 h ALA 220 N 0.00 1.85 -1.16 4.61 0.00 -1.58 -2.59 119.26 120.39 2vw4 h ALA 220 Ca -0.00 0.06 -0.69 0.00 0.00 0.00 0.00 54.91 54.27 2vw4 h ALA 220 Cb 0.14 -0.07 -0.33 0.00 0.00 0.00 0.00 17.79 17.53 2vw4 h ALA 220 CO 0.01 -0.19 0.35 1.28 0.00 0.00 0.00 179.25 180.69 2vw4 n LEU 221 N -4.68 6.46 -4.19 0.00 4.77 -1.26 -4.72 117.00 113.38 2vw4 n LEU 221 Ca 0.22 -4.91 -0.11 0.00 -0.03 0.00 0.00 56.01 51.18 2vw4 n LEU 221 Cb 0.62 -0.82 -0.10 0.00 -2.33 0.00 0.00 43.42 40.79 2vw4 n LEU 221 CO 0.24 1.91 -0.28 0.42 -1.33 0.00 0.00 177.39 178.36 2vw4 s THR 222 N -5.18 0.18 0.00 -5.08 -4.23 -0.98 -0.32 115.64 100.03 2vw4 s THR 222 Ca 0.52 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 2vw4 s THR 222 Cb 0.43 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 72.02 2vw4 s THR 222 CO -0.28 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.13 2vw4 n GLY 223 N -0.20 3.50 0.31 3.99 0.00 -1.26 -0.98 105.19 110.55 2vw4 n GLY 223 Ca -0.03 -0.12 0.18 0.00 0.00 0.00 0.00 46.02 46.06 2vw4 n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vw4 h ALA 224 N -0.94 1.14 -0.44 4.61 0.00 -1.97 -1.54 119.26 120.12 2vw4 h ALA 224 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2vw4 h ALA 224 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2vw4 h ALA 224 CO 0.00 -0.14 0.00 0.09 0.00 0.00 0.00 179.25 179.20 2vw4 n ASN 225 N -2.87 3.20 -4.68 0.00 3.02 -0.15 -4.98 115.26 108.79 2vw4 n ASN 225 Ca -0.02 -1.97 -0.39 0.00 -0.03 0.00 0.00 54.58 52.17 2vw4 n ASN 225 Cb 0.20 -0.29 0.04 0.00 -0.61 0.00 0.00 39.78 39.12 2vw4 n ASN 225 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vw4 n ALA 226 N 0.91 0.86 -1.19 5.41 0.00 -0.58 -3.75 120.51 122.17 2vw4 n ALA 226 Ca 0.15 0.09 -0.31 0.00 0.00 0.00 0.00 53.44 53.37 2vw4 n ALA 226 Cb 0.49 -2.23 0.10 0.00 0.00 0.00 0.00 19.45 17.81 2vw4 n ALA 226 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2vw4 s LEU 227 N -2.58 3.04 0.03 0.00 1.43 -0.24 -4.85 118.68 115.51 2vw4 s LEU 227 Ca 0.73 1.92 0.03 0.00 -1.03 0.00 0.00 54.13 55.77 2vw4 s LEU 227 Cb -0.43 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 41.23 2vw4 s LEU 227 CO 0.49 -2.20 -0.08 0.42 0.23 0.00 0.00 176.35 175.21 2vw4 s THR 228 N -2.77 0.61 0.37 5.49 -4.23 -1.26 -0.69 115.64 113.16 2vw4 s THR 228 Ca 0.63 -0.85 -0.08 0.00 -1.18 0.00 0.00 61.69 60.21 2vw4 s THR 228 Cb -0.19 -0.61 0.03 0.00 1.34 0.00 0.00 72.50 73.07 2vw4 s THR 228 CO 0.55 -0.19 0.63 0.00 -0.54 0.00 0.00 174.62 175.07 2vw4 n ALA 229 N 1.91 -1.05 -2.66 3.99 0.00 -0.87 -4.94 120.51 116.90 2vw4 n ALA 229 Ca -0.19 -1.43 -0.20 0.00 0.00 0.00 0.00 53.44 51.62 2vw4 n ALA 229 Cb 0.56 1.14 -0.13 0.00 0.00 0.00 0.00 19.45 21.02 2vw4 n ALA 229 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2vw4 s LYS 230 N -2.44 0.90 0.15 0.00 3.01 -1.26 -1.55 119.74 118.55 2vw4 s LYS 230 Ca 0.22 -0.71 -0.34 0.00 -1.01 0.00 0.00 55.97 54.14 2vw4 s LYS 230 Cb -0.03 -0.89 -0.16 0.00 -1.01 0.00 0.00 37.83 35.74 2vw4 s LYS 230 CO 0.16 0.22 1.22 0.28 0.51 0.00 0.00 175.35 177.74 2vw4 n VAL 231 N 1.99 0.68 0.00 3.17 0.31 0.27 -1.41 118.33 123.34 2vw4 n VAL 231 Ca -0.18 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2vw4 n VAL 231 Cb 0.55 -0.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.62 2vw4 n VAL 231 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2vw4 n GLY 232 N 2.15 1.63 3.77 2.92 0.00 0.83 -4.98 105.19 111.50 2vw4 n GLY 232 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2vw4 n GLY 232 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vw4 s GLU 233 N -0.70 4.27 -0.21 1.61 2.12 -0.50 -4.86 118.70 120.43 2vw4 s GLU 233 Ca 0.00 0.67 -0.16 0.00 0.36 0.00 0.00 54.97 55.84 2vw4 s GLU 233 Cb 0.00 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 31.02 2vw4 s GLU 233 CO 0.00 0.39 0.39 0.99 -0.54 0.00 0.00 175.26 176.49 2vw4 s THR 234 N -0.23 5.20 -0.10 -1.70 2.01 -1.26 -1.96 115.64 117.59 2vw4 s THR 234 Ca 0.29 0.67 -0.02 0.00 0.31 0.00 0.00 61.69 62.95 2vw4 s THR 234 Cb -0.18 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.58 2vw4 s THR 234 CO 0.16 0.24 -0.03 0.68 -0.69 0.00 0.00 174.62 174.98 2vw4 s VAL 235 N 1.42 4.00 -0.20 3.82 -7.23 0.61 0.32 120.40 123.15 2vw4 s VAL 235 Ca 0.18 -0.35 -0.13 0.00 -1.81 0.00 0.00 61.98 59.87 2vw4 s VAL 235 Cb -0.15 -2.69 -0.05 0.00 0.56 0.00 0.00 36.38 34.05 2vw4 s VAL 235 CO 0.08 0.57 0.26 -0.22 -0.31 0.00 0.00 175.10 175.48 2vw4 s LEU 236 N -0.47 4.19 -0.34 1.32 2.96 0.54 -1.59 118.68 125.28 2vw4 s LEU 236 Ca 0.08 0.37 -0.03 0.00 -0.22 0.00 0.00 54.13 54.32 2vw4 s LEU 236 Cb -0.12 -2.30 0.07 0.00 0.50 0.00 0.00 46.19 44.33 2vw4 s LEU 236 CO 0.02 0.06 0.09 -0.76 -1.32 0.00 0.00 176.35 174.44 2vw4 s LEU 237 N 0.80 4.43 -0.10 -0.68 1.43 -0.04 -0.94 118.68 123.58 2vw4 s LEU 237 Ca 0.14 -1.46 -0.23 0.00 -1.03 0.00 0.00 54.13 51.54 2vw4 s LEU 237 Cb -0.13 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.26 2vw4 s LEU 237 CO 0.04 -0.37 0.71 -0.63 0.23 0.00 0.00 176.35 176.33 2vw4 s ILE 238 N 1.26 5.02 -0.14 -0.59 1.01 -0.43 -1.85 121.20 125.48 2vw4 s ILE 238 Ca -0.00 1.43 -0.00 0.00 0.00 0.00 0.00 60.65 62.07 2vw4 s ILE 238 Cb -0.21 -4.04 0.03 0.00 0.01 0.00 0.00 42.46 38.26 2vw4 s ILE 238 CO -0.01 0.20 -0.09 -2.28 0.00 0.00 0.00 174.94 172.76 2vw4 s HIS 239 N 1.15 1.82 -0.06 3.97 2.46 -0.67 -0.23 115.29 123.74 2vw4 s HIS 239 Ca 0.36 -1.04 0.02 0.00 0.47 0.00 0.00 55.06 54.87 2vw4 s HIS 239 Cb -0.17 -1.39 -0.03 0.00 -0.13 0.00 0.00 32.58 30.86 2vw4 s HIS 239 CO 0.16 -0.61 -0.10 -1.54 -2.47 0.00 0.00 174.74 170.18 2vw4 s SER 240 N 1.60 4.35 -0.26 9.88 1.04 -0.15 -1.09 113.70 129.07 2vw4 s SER 240 Ca 0.03 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.32 2vw4 s SER 240 Cb -0.14 -1.01 0.10 0.00 0.10 0.00 0.00 66.02 65.07 2vw4 s SER 240 CO -0.09 0.35 0.15 -1.58 0.98 0.00 0.00 173.24 173.06 2vw4 s GLN 241 N -0.81 0.18 0.08 4.02 -0.44 -0.62 -0.98 119.66 121.09 2vw4 s GLN 241 Ca 0.12 -0.32 0.25 0.00 -2.50 0.00 0.00 55.36 52.91 2vw4 s GLN 241 Cb -0.11 -1.23 0.99 0.00 -1.64 0.00 0.00 33.01 31.02 2vw4 s GLN 241 CO 0.01 -0.92 1.78 0.00 0.50 0.00 0.00 175.29 176.66 2vw4 n ALA 242 N 5.27 2.11 0.00 1.58 0.00 -1.26 0.09 120.51 128.30 2vw4 n ALA 242 Ca -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2vw4 n ALA 242 Cb 0.45 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2vw4 n ALA 242 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2vw4 n ASN 243 N -1.76 1.97 -3.85 0.00 5.15 -1.26 -2.94 115.26 112.58 2vw4 n ASN 243 Ca 0.05 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.92 2vw4 n ASN 243 Cb 0.31 0.31 -0.11 0.00 -0.53 0.00 0.00 39.78 39.77 2vw4 n ASN 243 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2vw4 s ARG 244 N -1.05 0.38 0.55 1.20 3.52 -1.26 -4.68 118.95 117.61 2vw4 s ARG 244 Ca 0.00 -0.14 -0.21 0.00 -0.13 0.00 0.00 55.73 55.25 2vw4 s ARG 244 Cb 0.00 0.16 -0.05 0.00 -1.56 0.00 0.00 34.95 33.51 2vw4 s ARG 244 CO 0.00 -0.08 1.29 -0.51 -0.81 0.00 0.00 175.30 175.19 2vw4 s ASP 245 N -0.80 5.33 0.16 -2.12 1.01 -1.26 -3.63 116.67 115.36 2vw4 s ASP 245 Ca -0.09 2.59 -0.02 0.00 0.71 0.00 0.00 52.55 55.74 2vw4 s ASP 245 Cb -0.05 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 2vw4 s ASP 245 CO 0.01 -1.51 0.11 0.28 0.21 0.00 0.00 175.17 174.26 2vw4 s THR 246 N -1.41 0.06 -0.46 -1.27 -1.32 -0.43 -4.87 115.64 105.93 2vw4 s THR 246 Ca 0.73 -1.91 0.03 0.00 -1.21 0.00 0.00 61.69 59.34 2vw4 s THR 246 Cb -0.36 -2.22 0.16 0.00 -1.51 0.00 0.00 72.50 68.58 2vw4 s THR 246 CO 0.41 -0.26 0.34 0.00 -2.21 0.00 0.00 174.62 172.90 2vw4 s ARG 247 N -4.09 1.16 0.51 7.08 1.70 -1.26 -0.84 118.95 123.22 2vw4 s ARG 247 Ca 0.30 -2.22 -0.23 0.00 -0.47 0.00 0.00 55.73 53.11 2vw4 s ARG 247 Cb 0.07 -1.83 -0.06 0.00 -0.57 0.00 0.00 34.95 32.56 2vw4 s ARG 247 CO 0.06 -1.33 1.35 -2.14 -1.08 0.00 0.00 175.30 172.16 2vw4 s PRO 248 N -0.05 3.33 -0.15 3.89 0.02 -1.14 -0.76 135.00 140.15 2vw4 s PRO 248 Ca 0.28 2.23 -0.13 0.00 0.02 0.00 0.00 61.00 63.40 2vw4 s PRO 248 Cb -0.03 -2.37 0.04 0.00 0.02 0.00 0.00 34.50 32.16 2vw4 s PRO 248 CO -0.15 -1.04 0.40 -1.58 -0.33 0.00 0.00 177.00 174.31 2vw4 s HIS 249 N -1.30 -0.48 -0.36 6.54 2.46 0.23 -1.50 115.29 120.89 2vw4 s HIS 249 Ca 0.68 1.12 -0.09 0.00 0.47 0.00 0.00 55.06 57.25 2vw4 s HIS 249 Cb -0.40 0.18 0.03 0.00 -0.13 0.00 0.00 32.58 32.26 2vw4 s HIS 249 CO 0.48 -0.24 0.16 -1.17 -2.47 0.00 0.00 174.74 171.50 2vw4 s LEU 250 N 0.50 4.51 -0.10 8.88 2.96 -1.26 -1.18 118.68 132.99 2vw4 s LEU 250 Ca -0.02 -1.05 -0.30 0.00 -0.22 0.00 0.00 54.13 52.54 2vw4 s LEU 250 Cb -0.04 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 2vw4 s LEU 250 CO -0.03 -0.35 1.41 -0.63 -1.32 0.00 0.00 176.35 175.43 2vw4 s ILE 251 N 1.48 3.97 0.00 6.68 1.01 0.62 -1.11 121.20 133.85 2vw4 s ILE 251 Ca 0.00 1.21 0.00 0.00 0.00 0.00 0.00 60.65 61.86 2vw4 s ILE 251 Cb -0.19 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.50 2vw4 s ILE 251 CO 0.05 -0.09 0.00 0.61 0.00 0.00 0.00 174.94 175.51 2vw4 n GLY 252 N 3.78 0.84 0.00 6.18 0.00 -1.26 -4.05 105.19 110.68 2vw4 n GLY 252 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2vw4 n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vw4 n GLY 253 N -2.00 5.62 3.46 -0.02 0.00 -0.27 -5.01 105.19 106.97 2vw4 n GLY 253 Ca 0.00 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 44.11 2vw4 n GLY 253 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vw4 s HIS 254 N -0.57 0.87 -0.58 1.61 0.09 -1.26 -4.72 115.29 110.74 2vw4 s HIS 254 Ca 0.00 -1.13 -0.18 0.00 -0.00 0.00 0.00 55.06 53.74 2vw4 s HIS 254 Cb 0.00 -0.11 0.11 0.00 -0.00 0.00 0.00 32.58 32.58 2vw4 s HIS 254 CO 0.00 -0.98 0.65 0.20 -0.00 0.00 0.00 174.74 174.61 2vw4 s GLY 255 N -3.15 1.85 0.11 -2.22 0.00 -0.14 -4.70 107.32 99.07 2vw4 s GLY 255 Ca 0.30 -2.29 -0.21 0.00 0.00 0.00 0.00 44.72 42.52 2vw4 s GLY 255 CO 0.15 1.48 1.76 -0.55 0.00 0.00 0.00 173.10 175.93 2vw4 h ASP 256 N 9.10 0.11 -3.35 1.64 3.32 -0.96 -1.04 116.42 125.24 2vw4 h ASP 256 Ca -0.30 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.36 2vw4 h ASP 256 Cb 1.09 -0.02 -0.37 0.00 0.22 0.00 0.00 39.33 40.26 2vw4 h ASP 256 CO 1.08 0.08 -0.76 0.26 -1.72 0.00 0.00 179.24 178.18 2vw4 s TRP 257 N -6.18 0.51 -0.06 4.55 0.52 -1.05 -2.93 118.94 114.29 2vw4 s TRP 257 Ca -0.13 -0.07 0.01 0.00 0.02 0.00 0.00 56.10 55.93 2vw4 s TRP 257 Cb 0.08 -0.64 0.02 0.00 -1.15 0.00 0.00 33.47 31.77 2vw4 s TRP 257 CO 0.68 -0.24 -0.08 0.08 0.02 0.00 0.00 176.95 177.41 2vw4 s VAL 258 N 1.64 0.83 -0.75 4.03 1.01 0.15 0.35 120.40 127.66 2vw4 s VAL 258 Ca -0.01 -0.28 -0.09 0.00 0.00 0.00 0.00 61.98 61.60 2vw4 s VAL 258 Cb -0.13 -0.80 0.20 0.00 0.00 0.00 0.00 36.38 35.65 2vw4 s VAL 258 CO -0.03 0.29 0.64 0.26 0.00 0.00 0.00 175.10 176.26 2vw4 s TRP 259 N 0.88 3.62 0.27 5.22 0.51 0.23 -1.29 118.94 128.38 2vw4 s TRP 259 Ca -0.11 -2.33 0.11 0.00 -2.12 0.00 0.00 56.10 51.64 2vw4 s TRP 259 Cb -0.15 -3.55 0.36 0.00 -0.81 0.00 0.00 33.47 29.32 2vw4 s TRP 259 CO 0.01 -0.92 1.61 1.05 -0.51 0.00 0.00 176.95 178.19 2vw4 h GLU 260 N 7.40 0.00 -0.00 4.98 4.11 -1.86 -0.91 114.58 128.29 2vw4 h GLU 260 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.49 2vw4 h GLU 260 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 2vw4 h GLU 260 CO 0.74 0.62 -0.12 0.25 0.07 0.00 0.00 179.01 180.57 2vw4 n THR 261 N -3.80 0.00 -1.46 -1.06 -2.24 -1.26 -4.28 114.28 100.18 2vw4 n THR 261 Ca -0.01 -0.04 -0.03 0.00 -2.27 0.00 0.00 64.05 61.71 2vw4 n THR 261 Cb 0.62 -0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 68.66 2vw4 n THR 261 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vw4 n GLY 262 N 1.34 0.46 3.00 3.38 0.00 -0.42 -4.79 105.19 108.16 2vw4 n GLY 262 Ca 0.12 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 2vw4 n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vw4 s LYS 263 N -2.98 1.86 0.35 1.61 -0.14 -1.26 -0.48 119.74 118.70 2vw4 s LYS 263 Ca 0.00 -1.23 0.27 0.00 -1.36 0.00 0.00 55.97 53.65 2vw4 s LYS 263 Cb 0.00 -2.76 1.16 0.00 -1.68 0.00 0.00 37.83 34.55 2vw4 s LYS 263 CO 0.00 -0.62 1.80 0.74 -0.76 0.00 0.00 175.35 176.51 2vw4 h PHE 264 N 7.85 0.00 0.00 3.18 0.04 -1.90 -1.94 116.94 124.17 2vw4 h PHE 264 Ca -0.17 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.60 2vw4 h PHE 264 Cb 1.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.20 2vw4 h PHE 264 CO 0.56 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 178.27 2vw4 n ALA 265 N -1.87 1.89 -2.36 2.45 0.00 -1.26 -4.72 120.51 114.64 2vw4 n ALA 265 Ca 0.01 -0.01 -0.35 0.00 0.00 0.00 0.00 53.44 53.10 2vw4 n ALA 265 Cb 0.22 -1.37 -0.06 0.00 0.00 0.00 0.00 19.45 18.25 2vw4 n ALA 265 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2vw4 s ASN 266 N -3.73 6.81 0.37 0.00 0.01 -0.73 -5.06 114.94 112.61 2vw4 s ASN 266 Ca 0.08 1.06 -0.27 0.00 -0.71 0.00 0.00 52.86 53.02 2vw4 s ASN 266 Cb 0.11 -2.28 -0.10 0.00 0.41 0.00 0.00 41.25 39.40 2vw4 s ASN 266 CO 0.42 0.09 1.34 -2.16 -1.51 0.00 0.00 177.10 175.28 2vw4 s PRO 267 N -2.04 4.14 0.62 -0.60 0.04 -1.26 -4.97 135.00 130.93 2vw4 s PRO 267 Ca 0.39 2.27 -0.13 0.00 0.04 0.00 0.00 61.00 63.56 2vw4 s PRO 267 Cb -0.15 -2.92 -0.03 0.00 0.04 0.00 0.00 34.50 31.45 2vw4 s PRO 267 CO 0.19 -0.39 1.04 -1.25 0.04 0.00 0.00 177.00 176.63 2vw4 s PRO 268 N -2.04 3.37 0.20 0.56 0.04 -1.26 -4.94 135.00 130.92 2vw4 s PRO 268 Ca 0.53 0.97 -0.07 0.00 0.04 0.00 0.00 61.00 62.47 2vw4 s PRO 268 Cb -0.41 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.02 2vw4 s PRO 268 CO 0.53 -0.75 0.48 -0.65 0.04 0.00 0.00 177.00 176.65 2vw4 s GLN 269 N -4.66 3.71 0.26 4.56 -0.21 -0.41 -4.68 119.66 118.23 2vw4 s GLN 269 Ca 0.59 0.10 0.09 0.00 0.02 0.00 0.00 55.36 56.16 2vw4 s GLN 269 Cb -0.13 -2.72 -0.04 0.00 1.00 0.00 0.00 33.01 31.12 2vw4 s GLN 269 CO 0.46 0.36 0.03 -0.98 -2.12 0.00 0.00 175.29 173.04 2vw4 s ARG 270 N -2.85 2.42 -1.49 2.91 1.70 -1.26 -0.67 118.95 119.70 2vw4 s ARG 270 Ca 0.45 -1.34 0.00 0.00 -0.47 0.00 0.00 55.73 54.37 2vw4 s ARG 270 Cb -0.11 -2.24 0.00 0.00 -0.57 0.00 0.00 34.95 32.02 2vw4 s ARG 270 CO 0.24 0.38 0.00 -0.25 -1.08 0.00 0.00 175.30 174.58 2vw4 n ASP 271 N -0.92 -4.74 -4.77 -2.89 8.00 -0.88 -4.96 116.55 105.39 2vw4 n ASP 271 Ca -0.07 0.22 -0.40 0.00 0.71 0.00 0.00 54.79 55.24 2vw4 n ASP 271 Cb 0.59 -3.71 -0.01 0.00 -0.02 0.00 0.00 41.12 37.96 2vw4 n ASP 271 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2vw4 s LEU 272 N -3.86 4.35 -0.11 0.64 1.43 -0.45 -4.76 118.68 115.93 2vw4 s LEU 272 Ca 0.00 2.72 -0.19 0.00 -1.03 0.00 0.00 54.13 55.62 2vw4 s LEU 272 Cb 0.00 -3.73 -0.27 0.00 0.03 0.00 0.00 46.19 42.22 2vw4 s LEU 272 CO 0.00 -0.67 0.59 1.05 0.23 0.00 0.00 176.35 177.55 2vw4 h GLU 273 N 3.12 0.19 -3.44 1.70 4.11 -1.91 -0.34 114.58 118.00 2vw4 h GLU 273 Ca -0.49 -0.32 -0.23 0.00 0.07 0.00 0.00 59.36 58.38 2vw4 h GLU 273 Cb 1.23 0.12 -0.30 0.00 0.50 0.00 0.00 28.75 30.31 2vw4 h GLU 273 CO 0.64 1.15 -0.63 0.99 0.07 0.00 0.00 179.01 181.24 2vw4 s THR 274 N -2.42 -0.03 0.47 -1.06 2.01 -1.26 -4.23 115.64 109.13 2vw4 s THR 274 Ca -0.20 0.09 0.02 0.00 0.31 0.00 0.00 61.69 61.92 2vw4 s THR 274 Cb 0.03 -0.16 0.02 0.00 0.01 0.00 0.00 72.50 72.40 2vw4 s THR 274 CO 0.74 0.04 0.17 -2.67 -0.69 0.00 0.00 174.62 172.21 2vw4 n TRP 275 N 3.60 0.25 -3.89 4.92 2.14 -0.56 -4.99 117.44 118.91 2vw4 n TRP 275 Ca -0.19 -2.16 -0.25 0.00 2.07 0.00 0.00 57.50 56.96 2vw4 n TRP 275 Cb 0.55 -0.35 -0.17 0.00 -0.81 0.00 0.00 31.31 30.54 2vw4 n TRP 275 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 2vw4 s PHE 276 N -2.54 1.18 -0.33 -2.67 5.36 -1.26 -2.87 117.98 114.85 2vw4 s PHE 276 Ca 0.13 -0.52 -0.10 0.00 -0.96 0.00 0.00 56.93 55.48 2vw4 s PHE 276 Cb -0.01 -1.06 0.01 0.00 -0.34 0.00 0.00 43.02 41.61 2vw4 s PHE 276 CO 0.08 -0.43 0.17 0.42 -1.46 0.00 0.00 175.22 173.99 2vw4 s ILE 277 N 1.75 4.54 0.25 3.12 -1.09 -0.02 -4.53 121.20 125.22 2vw4 s ILE 277 Ca 0.04 -0.61 -0.30 0.00 -2.23 0.00 0.00 60.65 57.55 2vw4 s ILE 277 Cb -0.13 -3.40 -0.10 0.00 -1.58 0.00 0.00 42.46 37.25 2vw4 s ILE 277 CO -0.07 -0.05 1.45 -0.13 -1.23 0.00 0.00 174.94 174.91 2vw4 s ARG 278 N 1.58 4.26 0.06 2.79 0.52 -1.26 -1.32 118.95 125.58 2vw4 s ARG 278 Ca 0.03 2.32 -0.35 0.00 -0.52 0.00 0.00 55.73 57.21 2vw4 s ARG 278 Cb -0.18 -3.10 -0.15 0.00 0.52 0.00 0.00 34.95 32.04 2vw4 s ARG 278 CO 0.06 -0.43 1.56 0.41 0.02 0.00 0.00 175.30 176.93 2vw4 n GLY 279 N 2.16 0.95 0.78 -3.53 0.00 -1.24 -1.72 105.19 102.59 2vw4 n GLY 279 Ca 0.07 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.81 2vw4 n GLY 279 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vw4 n GLY 280 N 3.35 1.10 3.47 -0.02 0.00 0.11 -4.75 105.19 108.46 2vw4 n GLY 280 Ca 0.19 -0.38 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 2vw4 n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vw4 s SER 281 N -2.39 -0.08 -0.04 1.61 1.04 -0.70 -4.81 113.70 108.33 2vw4 s SER 281 Ca 0.00 -0.81 0.05 0.00 0.48 0.00 0.00 55.95 55.67 2vw4 s SER 281 Cb 0.00 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 2vw4 s SER 281 CO 0.00 -1.02 -0.20 0.00 0.98 0.00 0.00 173.24 172.99 2vw4 s ALA 282 N -3.97 1.77 0.48 5.32 0.00 -1.26 -1.59 121.76 122.51 2vw4 s ALA 282 Ca 0.18 -0.84 0.04 0.00 0.00 0.00 0.00 51.96 51.33 2vw4 s ALA 282 Cb 0.01 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.55 2vw4 s ALA 282 CO 0.03 0.35 0.07 0.20 0.00 0.00 0.00 175.76 176.41 2vw4 s GLY 283 N -0.12 2.73 -0.07 0.00 0.00 -0.25 -3.76 107.32 105.86 2vw4 s GLY 283 Ca -0.02 -1.20 -0.04 0.00 0.00 0.00 0.00 44.72 43.47 2vw4 s GLY 283 CO 0.02 -2.11 0.16 0.00 0.00 0.00 0.00 173.10 171.17 2vw4 s ALA 284 N -2.79 -0.33 -0.01 3.20 0.00 -0.78 -1.66 121.76 119.38 2vw4 s ALA 284 Ca 0.21 0.67 0.05 0.00 0.00 0.00 0.00 51.96 52.90 2vw4 s ALA 284 Cb 0.04 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 2vw4 s ALA 284 CO 0.11 -0.14 -0.17 0.00 0.00 0.00 0.00 175.76 175.56 2vw4 s ALA 285 N 0.95 1.43 -0.13 0.00 0.00 -0.77 -0.60 121.76 122.65 2vw4 s ALA 285 Ca -0.07 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.09 2vw4 s ALA 285 Cb -0.09 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 2vw4 s ALA 285 CO -0.05 0.35 0.07 -0.51 0.00 0.00 0.00 175.76 175.62 2vw4 s LEU 286 N -0.41 3.94 -0.01 0.00 1.43 0.16 -0.86 118.68 122.91 2vw4 s LEU 286 Ca 0.07 0.24 -0.00 0.00 -1.03 0.00 0.00 54.13 53.41 2vw4 s LEU 286 Cb -0.07 -1.95 0.02 0.00 0.03 0.00 0.00 46.19 44.22 2vw4 s LEU 286 CO -0.01 0.33 0.02 -0.47 0.23 0.00 0.00 176.35 176.45 2vw4 s TYR 287 N -0.57 0.01 -0.31 0.29 5.04 -0.62 -0.30 117.35 120.89 2vw4 s TYR 287 Ca 0.11 0.08 -0.09 0.00 -2.44 0.00 0.00 57.07 54.72 2vw4 s TYR 287 Cb -0.12 -0.12 -0.01 0.00 0.35 0.00 0.00 41.96 42.06 2vw4 s TYR 287 CO 0.02 -0.05 0.15 0.99 -1.34 0.00 0.00 175.55 175.32 2vw4 s THR 288 N 0.57 4.59 0.26 4.34 2.01 -1.26 -0.28 115.64 125.87 2vw4 s THR 288 Ca -0.05 -0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.26 2vw4 s THR 288 Cb -0.07 -3.33 -0.10 0.00 0.01 0.00 0.00 72.50 69.02 2vw4 s THR 288 CO -0.02 0.09 1.36 -0.36 -0.69 0.00 0.00 174.62 175.00 2vw4 s PHE 289 N 1.61 3.09 0.00 4.92 0.08 -0.83 -4.89 117.98 121.97 2vw4 s PHE 289 Ca 0.05 1.20 0.00 0.00 0.12 0.00 0.00 56.93 58.30 2vw4 s PHE 289 Cb -0.17 -3.72 0.00 0.00 -0.57 0.00 0.00 43.02 38.56 2vw4 s PHE 289 CO 0.06 -2.20 0.00 1.63 -0.10 0.00 0.00 175.22 174.61 2vw4 n LYS 290 N 1.92 3.01 -4.68 0.44 5.02 -1.26 -0.12 118.16 122.49 2vw4 n LYS 290 Ca 0.04 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.11 2vw4 n LYS 290 Cb 0.41 -0.66 -0.15 0.00 -0.02 0.00 0.00 35.03 34.62 2vw4 n LYS 290 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2vw4 s GLN 291 N -1.13 1.18 0.79 1.97 -1.52 -1.26 -4.62 119.66 115.07 2vw4 s GLN 291 Ca 0.00 -0.53 -0.11 0.00 -1.95 0.00 0.00 55.36 52.77 2vw4 s GLN 291 Cb 0.00 -1.14 0.07 0.00 -0.22 0.00 0.00 33.01 31.72 2vw4 s GLN 291 CO 0.00 0.31 1.16 -1.25 -0.25 0.00 0.00 175.29 175.26 2vw4 s PRO 292 N -0.35 2.04 0.00 2.91 0.04 -1.26 -4.81 135.00 133.57 2vw4 s PRO 292 Ca 0.06 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.19 2vw4 s PRO 292 Cb -0.06 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2vw4 s PRO 292 CO -0.01 -1.53 0.00 0.41 0.04 0.00 0.00 177.00 175.92 2vw4 n GLY 293 N -3.26 0.68 3.64 0.56 0.00 0.10 -4.94 105.19 101.98 2vw4 n GLY 293 Ca 0.08 -2.30 -0.38 0.00 0.00 0.00 0.00 46.02 43.42 2vw4 n GLY 293 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vw4 s VAL 294 N -0.72 5.24 0.19 1.61 1.01 -1.26 -0.59 120.40 125.89 2vw4 s VAL 294 Ca 0.00 0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.49 2vw4 s VAL 294 Cb 0.00 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 2vw4 s VAL 294 CO 0.00 0.25 0.29 -0.31 0.00 0.00 0.00 175.10 175.32 2vw4 s TYR 295 N 1.53 3.40 -0.08 5.22 1.51 0.12 -4.94 117.35 124.12 2vw4 s TYR 295 Ca 0.14 0.04 -0.01 0.00 -1.01 0.00 0.00 57.07 56.22 2vw4 s TYR 295 Cb -0.15 -1.59 -0.03 0.00 -0.11 0.00 0.00 41.96 40.08 2vw4 s TYR 295 CO 0.08 0.49 -0.02 0.00 -1.11 0.00 0.00 175.55 174.99 2vw4 s ALA 296 N -1.86 3.21 -0.20 3.71 0.00 -1.26 -0.92 121.76 124.44 2vw4 s ALA 296 Ca 0.34 -0.84 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 2vw4 s ALA 296 Cb -0.10 -1.41 0.01 0.00 0.00 0.00 0.00 23.12 21.62 2vw4 s ALA 296 CO 0.28 0.59 -0.13 -0.47 0.00 0.00 0.00 175.76 176.03 2vw4 s TYR 297 N -0.88 2.89 0.16 0.00 5.04 -0.19 -0.27 117.35 124.09 2vw4 s TYR 297 Ca 0.13 -1.41 -0.11 0.00 -2.44 0.00 0.00 57.07 53.24 2vw4 s TYR 297 Cb -0.11 -2.00 0.00 0.00 0.35 0.00 0.00 41.96 40.20 2vw4 s TYR 297 CO 0.03 -0.71 0.33 -0.48 -1.34 0.00 0.00 175.55 173.38 2vw4 s LEU 298 N 1.35 0.78 -0.18 6.97 0.05 -0.33 0.16 118.68 127.48 2vw4 s LEU 298 Ca 0.04 -0.71 -0.29 0.00 0.05 0.00 0.00 54.13 53.23 2vw4 s LEU 298 Cb -0.14 1.44 -0.01 0.00 -2.05 0.00 0.00 46.19 45.43 2vw4 s LEU 298 CO -0.09 -0.90 1.17 0.21 -0.55 0.00 0.00 176.35 176.19 2vw4 s ASN 299 N -2.92 7.02 -0.09 1.48 3.84 -0.73 -0.60 114.94 122.94 2vw4 s ASN 299 Ca 0.12 1.57 0.05 0.00 0.21 0.00 0.00 52.86 54.81 2vw4 s ASN 299 Cb 0.02 -2.54 0.29 0.00 -0.55 0.00 0.00 41.25 38.47 2vw4 s ASN 299 CO -0.03 -0.71 1.00 1.57 -2.79 0.00 0.00 177.10 176.14 2vw4 n HIS 300 N 6.37 0.79 -2.66 0.43 -0.00 0.07 -3.97 115.22 116.25 2vw4 n HIS 300 Ca 0.13 -0.35 -0.42 0.00 -0.00 0.00 0.00 57.72 57.08 2vw4 n HIS 300 Cb 0.45 -0.28 -0.03 0.00 -0.00 0.00 0.00 29.99 30.13 2vw4 n HIS 300 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2vw4 s ASN 301 N -0.22 6.32 0.52 0.26 3.84 -1.26 -4.92 114.94 119.48 2vw4 s ASN 301 Ca 0.20 -0.25 0.30 0.00 0.21 0.00 0.00 52.86 53.32 2vw4 s ASN 301 Cb 0.15 -2.52 1.35 0.00 -0.55 0.00 0.00 41.25 39.69 2vw4 s ASN 301 CO 0.05 -1.52 2.00 -0.07 -2.79 0.00 0.00 177.10 174.77 2vw4 h LEU 302 N 11.96 0.00 -0.01 3.21 3.38 -2.00 0.00 115.31 131.86 2vw4 h LEU 302 Ca -0.26 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 2vw4 h LEU 302 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2vw4 h LEU 302 CO 1.19 0.10 0.00 0.40 0.09 0.00 0.00 178.44 180.22 2vw4 h ILE 303 N 0.00 1.24 -1.01 1.22 2.04 -1.91 0.54 117.51 119.63 2vw4 h ILE 303 Ca -0.00 -0.70 0.07 0.00 1.00 0.00 0.00 64.86 65.23 2vw4 h ILE 303 Cb 0.49 1.70 -0.07 0.00 -0.74 0.00 0.00 36.82 38.21 2vw4 h ILE 303 CO 0.01 0.18 0.65 -0.33 0.00 0.00 0.00 178.15 178.67 2vw4 h GLU 304 N -0.28 1.13 0.43 2.37 5.08 -1.52 -0.00 114.58 121.79 2vw4 h GLU 304 Ca 0.00 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 2vw4 h GLU 304 Cb 0.30 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2vw4 h GLU 304 CO 0.00 0.75 -0.21 0.00 -1.00 0.00 0.00 179.01 178.55 2vw4 h ALA 305 N 1.46 -0.74 0.13 3.43 0.00 -1.00 -1.74 119.26 120.80 2vw4 h ALA 305 Ca 0.44 -0.13 -0.32 0.00 0.00 0.00 0.00 54.91 54.91 2vw4 h ALA 305 Cb 0.19 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2vw4 h ALA 305 CO -0.18 -0.69 -1.58 0.74 0.00 0.00 0.00 179.25 177.53 2vw4 h PHE 306 N -0.88 0.50 0.17 0.00 0.04 -0.85 -2.29 116.94 113.63 2vw4 h PHE 306 Ca -0.06 -0.37 -0.32 0.00 2.80 0.00 0.00 57.97 60.03 2vw4 h PHE 306 Cb 0.44 -0.02 0.01 0.00 2.20 0.00 0.00 35.95 38.58 2vw4 h PHE 306 CO 0.04 1.44 -1.55 0.93 -0.60 0.00 0.00 178.31 178.56 2vw4 h GLU 307 N 0.08 0.37 0.00 1.51 4.39 -1.15 -3.41 114.58 116.36 2vw4 h GLU 307 Ca -0.27 -0.63 0.00 0.00 0.34 0.00 0.00 59.36 58.81 2vw4 h GLU 307 Cb 2.03 0.23 0.00 0.00 -0.10 0.00 0.00 28.75 30.92 2vw4 h GLU 307 CO 0.16 1.30 -1.76 1.28 -1.16 0.00 0.00 179.01 178.84 2vw4 n LEU 308 N -3.75 0.23 0.00 1.33 4.77 -0.78 -5.01 117.00 113.80 2vw4 n LEU 308 Ca -0.23 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 2vw4 n LEU 308 Cb 1.01 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.10 2vw4 n LEU 308 CO 0.49 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 2vw4 n GLY 309 N 1.32 0.81 2.57 -0.72 0.00 -0.80 -0.92 105.19 107.46 2vw4 n GLY 309 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2vw4 n GLY 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vw4 n ALA 310 N 0.00 6.44 -3.36 4.61 0.00 0.11 -4.00 120.51 124.31 2vw4 n ALA 310 Ca 0.00 -3.94 -0.13 0.00 0.00 0.00 0.00 53.44 49.37 2vw4 n ALA 310 Cb 0.00 -3.15 -0.09 0.00 0.00 0.00 0.00 19.45 16.20 2vw4 n ALA 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vw4 s ALA 311 N 1.06 -1.15 0.41 0.00 0.00 -1.26 -1.77 121.76 119.04 2vw4 s ALA 311 Ca 0.54 1.24 0.05 0.00 0.00 0.00 0.00 51.96 53.78 2vw4 s ALA 311 Cb 0.15 -0.67 -0.02 0.00 0.00 0.00 0.00 23.12 22.59 2vw4 s ALA 311 CO -0.06 -0.23 0.17 0.41 0.00 0.00 0.00 175.76 176.05 2vw4 n GLY 312 N 2.62 3.15 3.26 0.00 0.00 0.12 -4.53 105.19 109.82 2vw4 n GLY 312 Ca -0.14 -2.08 -0.24 0.00 0.00 0.00 0.00 46.02 43.56 2vw4 n GLY 312 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vw4 s HIS 313 N -3.17 1.72 -0.14 1.61 3.76 0.56 -1.02 115.29 118.60 2vw4 s HIS 313 Ca 0.25 -0.40 -0.00 0.00 -0.15 0.00 0.00 55.06 54.75 2vw4 s HIS 313 Cb 0.01 -0.97 0.03 0.00 1.11 0.00 0.00 32.58 32.76 2vw4 s HIS 313 CO 0.17 0.15 -0.09 0.42 -0.85 0.00 0.00 174.74 174.54 2vw4 s ILE 314 N -1.03 1.25 -0.27 0.60 1.01 -0.10 -1.08 121.20 121.58 2vw4 s ILE 314 Ca 0.06 -0.52 -0.15 0.00 0.00 0.00 0.00 60.65 60.04 2vw4 s ILE 314 Cb -0.09 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 2vw4 s ILE 314 CO 0.03 0.32 0.37 -0.75 0.00 0.00 0.00 174.94 174.92 2vw4 s LYS 315 N 1.60 4.01 -0.14 2.79 2.20 0.14 0.14 119.74 130.48 2vw4 s LYS 315 Ca 0.04 0.03 0.02 0.00 -0.36 0.00 0.00 55.97 55.70 2vw4 s LYS 315 Cb -0.14 -3.66 0.01 0.00 -1.51 0.00 0.00 37.83 32.53 2vw4 s LYS 315 CO -0.09 -0.28 -0.21 0.08 -0.36 0.00 0.00 175.35 174.49 2vw4 s VAL 316 N 2.07 2.19 0.26 4.02 1.01 0.24 -2.04 120.40 128.16 2vw4 s VAL 316 Ca 0.15 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 61.14 2vw4 s VAL 316 Cb -0.16 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 2vw4 s VAL 316 CO 0.10 0.54 0.52 -1.61 0.00 0.00 0.00 175.10 174.65 2vw4 s GLU 317 N 0.72 3.62 0.00 2.72 0.41 -0.60 0.03 118.70 125.61 2vw4 s GLU 317 Ca -0.09 -0.04 0.00 0.00 -0.41 0.00 0.00 54.97 54.43 2vw4 s GLU 317 Cb -0.16 -2.69 0.00 0.00 -1.78 0.00 0.00 34.13 29.50 2vw4 s GLU 317 CO 0.01 0.27 0.00 0.41 -0.49 0.00 0.00 175.26 175.45 2vw4 n GLY 318 N -0.77 0.97 3.68 -1.39 0.00 -1.26 -0.56 105.19 105.86 2vw4 n GLY 318 Ca -0.02 -1.90 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 2vw4 n GLY 318 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vw4 s LYS 319 N -1.95 3.64 0.37 1.61 3.01 -1.26 -4.67 119.74 120.49 2vw4 s LYS 319 Ca 0.00 -0.33 -0.28 0.00 -1.01 0.00 0.00 55.97 54.36 2vw4 s LYS 319 Cb 0.00 -3.10 -0.10 0.00 -1.01 0.00 0.00 37.83 33.62 2vw4 s LYS 319 CO 0.00 0.46 1.38 -0.46 0.51 0.00 0.00 175.35 177.24 2vw4 s TRP 320 N -0.18 2.78 -0.34 3.18 -0.11 -1.26 -4.47 118.94 118.54 2vw4 s TRP 320 Ca 0.07 1.31 -0.00 0.00 1.22 0.00 0.00 56.10 58.70 2vw4 s TRP 320 Cb -0.12 -3.82 0.08 0.00 -1.50 0.00 0.00 33.47 28.11 2vw4 s TRP 320 CO 0.01 -2.41 0.07 1.21 -4.62 0.00 0.00 176.95 171.22 2vw4 s ASN 321 N -0.43 4.94 0.38 5.86 3.84 -1.26 -4.97 114.94 123.30 2vw4 s ASN 321 Ca 0.53 -1.76 0.28 0.00 0.21 0.00 0.00 52.86 52.12 2vw4 s ASN 321 Cb -0.42 -1.72 1.12 0.00 -0.55 0.00 0.00 41.25 39.68 2vw4 s ASN 321 CO 0.56 -0.38 1.82 0.44 -2.79 0.00 0.00 177.10 176.75 2vw4 h ASP 322 N 7.90 0.00 -0.22 -4.21 3.32 -1.95 -2.78 116.42 118.48 2vw4 h ASP 322 Ca -0.14 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.71 2vw4 h ASP 322 Cb 1.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2vw4 h ASP 322 CO 0.58 0.00 -0.63 0.44 -1.72 0.00 0.00 179.24 177.91 2vw4 h ASP 323 N 0.00 0.95 -0.14 6.45 3.32 -2.02 -3.29 116.42 121.68 2vw4 h ASP 323 Ca 0.00 -0.55 -0.20 0.00 0.02 0.00 0.00 57.03 56.30 2vw4 h ASP 323 Cb 0.45 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.74 2vw4 h ASP 323 CO 0.00 1.35 -0.68 -0.07 -1.72 0.00 0.00 179.24 178.12 2vw4 h LEU 324 N 0.62 0.85 -7.20 1.55 3.38 -1.94 -3.46 115.31 109.11 2vw4 h LEU 324 Ca -0.01 -0.63 -0.09 0.00 0.09 0.00 0.00 57.88 57.24 2vw4 h LEU 324 Cb 1.25 -0.25 -0.24 0.00 0.09 0.00 0.00 40.66 41.51 2vw4 h LEU 324 CO 0.14 1.34 -0.16 -0.32 0.09 0.00 0.00 178.44 179.53 2vw4 s MET 325 N -3.75 0.55 -0.08 1.13 0.00 -1.07 -5.15 119.30 110.93 2vw4 s MET 325 Ca -0.11 0.76 -0.04 0.00 0.00 0.00 0.00 55.69 56.30 2vw4 s MET 325 Cb 0.08 0.20 0.04 0.00 0.00 0.00 0.00 34.83 35.14 2vw4 s MET 325 CO 0.88 -0.10 0.19 0.21 0.00 0.00 0.00 175.02 176.20 2vw4 s LYS 326 N 0.65 0.15 -0.59 4.11 2.20 -1.25 -4.05 119.74 120.96 2vw4 s LYS 326 Ca -0.03 0.42 -0.28 0.00 -0.36 0.00 0.00 55.97 55.72 2vw4 s LYS 326 Cb -0.05 -0.12 0.01 0.00 -1.51 0.00 0.00 37.83 36.16 2vw4 s LYS 326 CO -0.04 -0.15 1.41 -1.14 -0.36 0.00 0.00 175.35 175.07 2vw4 s GLN 327 N 1.08 3.25 -0.05 4.03 0.74 -1.26 -4.88 119.66 122.58 2vw4 s GLN 327 Ca -0.08 0.35 -0.26 0.00 0.05 0.00 0.00 55.36 55.42 2vw4 s GLN 327 Cb -0.10 -4.14 -0.22 0.00 1.10 0.00 0.00 33.01 29.65 2vw4 s GLN 327 CO -0.06 -2.01 1.11 0.82 -0.55 0.00 0.00 175.29 174.60 2vw4 h ILE 328 N 6.35 1.51 -3.30 -2.34 1.08 -2.02 -3.43 117.51 115.37 2vw4 h ILE 328 Ca -0.27 -1.62 -0.53 0.00 -0.39 0.00 0.00 64.86 62.05 2vw4 h ILE 328 Cb 1.09 2.56 -0.38 0.00 -3.07 0.00 0.00 36.82 37.02 2vw4 h ILE 328 CO 1.20 0.43 -0.79 -0.54 -0.69 0.00 0.00 178.15 177.76 2vw4 s LYS 329 N -3.54 1.26 0.84 2.37 -0.14 -1.26 -5.14 119.74 114.14 2vw4 s LYS 329 Ca -0.16 -0.41 -0.12 0.00 -1.36 0.00 0.00 55.97 53.92 2vw4 s LYS 329 Cb 0.01 -1.86 0.10 0.00 -1.68 0.00 0.00 37.83 34.41 2vw4 s LYS 329 CO 0.70 -0.42 1.19 0.00 -0.76 0.00 0.00 175.35 176.05 2vw4 s ALA 330 N 1.70 1.71 0.03 5.17 0.00 -1.26 -4.89 121.76 124.22 2vw4 s ALA 330 Ca 0.01 0.76 -0.35 0.00 0.00 0.00 0.00 51.96 52.38 2vw4 s ALA 330 Cb -0.15 -3.48 -0.14 0.00 0.00 0.00 0.00 23.12 19.35 2vw4 s ALA 330 CO -0.07 -2.46 1.64 -2.30 0.00 0.00 0.00 175.76 172.57 2vw4 n PRO 331 N -3.62 1.86 -3.68 0.00 -0.02 -1.26 -4.96 135.00 123.32 2vw4 n PRO 331 Ca 0.13 0.68 -0.10 0.00 -2.02 0.00 0.00 63.50 62.18 2vw4 n PRO 331 Cb 0.51 -2.43 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 2vw4 n PRO 331 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vw4 s ALA 332 N 2.03 -0.80 0.28 3.55 0.00 -1.26 -5.14 121.76 120.43 2vw4 s ALA 332 Ca 0.86 -0.12 -0.28 0.00 0.00 0.00 0.00 51.96 52.42 2vw4 s ALA 332 Cb -0.78 0.61 -0.14 0.00 0.00 0.00 0.00 23.12 22.81 2vw4 s ALA 332 CO 0.47 -0.59 0.93 -2.30 0.00 0.00 0.00 175.76 174.26 2vw4 n PRO 333 N -0.10 1.14 -1.86 0.00 -0.02 -1.26 -4.88 135.00 128.02 2vw4 n PRO 333 Ca -0.16 0.40 -0.42 0.00 -2.02 0.00 0.00 63.50 61.30 2vw4 n PRO 333 Cb 0.63 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.36 2vw4 n PRO 333 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2vw4 s ILE 334 N -1.07 3.14 -1.31 4.25 1.01 -1.26 -5.24 121.20 120.73 2vw4 s ILE 334 Ca 0.60 0.38 0.00 0.00 0.00 0.00 0.00 60.65 61.63 2vw4 s ILE 334 Cb -0.73 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 38.50 2vw4 s ILE 334 CO 0.59 -0.02 0.33 -2.65 0.00 0.00 0.00 174.94 173.19