#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wv4 s HIS 12 N 0.00 -1.06 -0.13 0.00 2.46 -1.26 -4.99 115.29 110.31 1wv4 s HIS 12 Ca 0.00 2.03 -0.29 0.00 0.47 0.00 0.00 55.06 57.27 1wv4 s HIS 12 Cb 0.00 0.64 -0.25 0.00 -0.13 0.00 0.00 32.58 32.83 1wv4 s HIS 12 CO 0.00 -0.53 0.79 1.37 -2.47 0.00 0.00 174.74 173.90 1wv4 h LEU 13 N 7.15 -0.00 0.00 8.88 -0.00 -2.09 -3.28 115.31 125.98 1wv4 h LEU 13 Ca -0.26 -0.96 0.00 0.00 -0.00 0.00 0.00 57.88 56.65 1wv4 h LEU 13 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.85 1wv4 h LEU 13 CO 0.15 0.97 0.00 0.54 -0.00 0.00 0.00 178.44 180.09 1wv4 n ARG 14 N -4.62 0.27 0.00 0.17 1.74 -1.26 -5.02 116.66 107.93 1wv4 n ARG 14 Ca -0.10 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1wv4 n ARG 14 Cb 0.46 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 1wv4 n ARG 14 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1wv4 n ARG 15 N -1.36 0.00 -3.81 5.56 0.63 -1.24 -5.02 116.66 111.41 1wv4 n ARG 15 Ca 0.11 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 57.00 1wv4 n ARG 15 Cb 0.27 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.18 1wv4 n ARG 15 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 1wv4 s GLU 16 N 0.00 1.37 -0.23 -0.14 2.56 -1.26 -5.05 118.70 115.95 1wv4 s GLU 16 Ca 0.00 -0.82 -0.36 0.00 0.00 0.00 0.00 54.97 53.78 1wv4 s GLU 16 Cb 0.00 0.42 0.15 0.00 2.00 0.00 0.00 34.13 36.70 1wv4 s GLU 16 CO 0.00 -0.63 1.28 1.52 -0.56 0.00 0.00 175.26 176.87 1wv4 s TYR 17 N -2.76 -0.08 0.16 5.30 -0.85 -1.26 -5.19 117.35 112.67 1wv4 s TYR 17 Ca 0.16 0.05 -0.07 0.00 -0.52 0.00 0.00 57.07 56.69 1wv4 s TYR 17 Cb -0.02 0.51 -0.02 0.00 0.38 0.00 0.00 41.96 42.81 1wv4 s TYR 17 CO 0.05 -0.13 0.24 0.99 -1.52 0.00 0.00 175.55 175.18 1wv4 s THR 18 N -2.24 0.07 0.27 -3.49 2.01 -1.26 -5.00 115.64 105.99 1wv4 s THR 18 Ca 0.10 -1.50 0.03 0.00 0.31 0.00 0.00 61.69 60.62 1wv4 s THR 18 Cb -0.01 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.58 1wv4 s THR 18 CO -0.04 -0.31 0.09 2.29 -0.69 0.00 0.00 174.62 175.97 1wv4 n LYS 19 N -0.20 0.72 -3.55 4.92 0.00 -1.26 -5.18 118.16 113.61 1wv4 n LYS 19 Ca -0.06 -2.26 -0.09 0.00 -0.00 0.00 0.00 58.31 55.89 1wv4 n LYS 19 Cb 0.63 1.21 -0.04 0.00 -0.00 0.00 0.00 35.03 36.84 1wv4 n LYS 19 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1wv4 s GLY 20 N -2.64 -0.35 0.00 2.58 0.00 -1.26 -4.91 107.32 100.74 1wv4 s GLY 20 Ca 0.13 1.60 0.00 0.00 0.00 0.00 0.00 44.72 46.45 1wv4 s GLY 20 CO 0.09 0.72 0.00 0.61 0.00 0.00 0.00 173.10 174.52 1wv4 n GLY 21 N 0.28 -0.82 3.07 0.20 0.00 -1.26 -5.01 105.19 101.65 1wv4 n GLY 21 Ca -0.09 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.83 1wv4 n GLY 21 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wv4 s LEU 22 N 0.00 5.04 0.39 0.99 2.96 -1.26 -5.06 118.68 121.74 1wv4 s LEU 22 Ca 0.00 -2.72 -0.13 0.00 -0.22 0.00 0.00 54.13 51.06 1wv4 s LEU 22 Cb 0.00 -1.80 -0.07 0.00 0.50 0.00 0.00 46.19 44.82 1wv4 s LEU 22 CO 0.00 -0.37 0.78 -0.13 -1.32 0.00 0.00 176.35 175.31 1wv4 s ARG 23 N 0.13 3.87 0.57 1.98 3.00 -1.26 -4.91 118.95 122.34 1wv4 s ARG 23 Ca 0.15 0.59 0.37 0.00 0.00 0.00 0.00 55.73 56.84 1wv4 s ARG 23 Cb -0.22 -2.37 1.70 0.00 0.00 0.00 0.00 34.95 34.06 1wv4 s ARG 23 CO -0.03 0.00 2.09 -0.09 0.00 0.00 0.00 175.30 177.27 1wv4 h ARG 24 N 1.54 0.00 -0.04 3.54 2.43 -1.99 -3.19 114.38 116.67 1wv4 h ARG 24 Ca -0.47 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.45 1wv4 h ARG 24 Cb 1.18 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.75 1wv4 h ARG 24 CO 0.64 0.00 -0.96 0.00 -1.51 0.00 0.00 179.97 178.14 1wv4 h ARG 25 N 0.00 0.68 -0.00 0.20 3.08 -2.03 -3.27 114.38 113.03 1wv4 h ARG 25 Ca 0.00 -0.68 0.00 0.00 0.07 0.00 0.00 59.98 59.37 1wv4 h ARG 25 Cb 0.33 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1wv4 h ARG 25 CO 0.00 1.27 -0.00 -0.25 -1.07 0.00 0.00 179.97 179.92 1wv4 n ASP 26 N -3.86 0.06 -4.72 7.04 8.00 -1.21 -4.90 116.55 116.97 1wv4 n ASP 26 Ca -0.09 -0.96 -0.42 0.00 0.71 0.00 0.00 54.79 54.02 1wv4 n ASP 26 Cb 0.84 -0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.89 1wv4 n ASP 26 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1wv4 s LEU 27 N -2.04 4.38 0.70 0.64 1.02 -1.24 -5.01 118.68 117.13 1wv4 s LEU 27 Ca 0.46 2.50 -0.10 0.00 0.02 0.00 0.00 54.13 57.02 1wv4 s LEU 27 Cb 0.22 -3.60 0.03 0.00 0.02 0.00 0.00 46.19 42.86 1wv4 s LEU 27 CO 0.37 -0.71 1.06 -2.84 0.02 0.00 0.00 176.35 174.26 1wv4 s PRO 28 N 0.72 2.65 0.17 1.29 0.02 -1.26 -4.98 135.00 133.60 1wv4 s PRO 28 Ca 0.65 0.23 -0.04 0.00 0.02 0.00 0.00 61.00 61.86 1wv4 s PRO 28 Cb -0.40 -2.08 0.04 0.00 0.02 0.00 0.00 34.50 32.08 1wv4 s PRO 28 CO 0.34 -1.09 1.43 0.00 -0.33 0.00 0.00 177.00 177.36 1wv4 h ALA 29 N -0.62 0.58 -2.71 -1.55 0.00 -2.01 -3.40 119.26 109.55 1wv4 h ALA 29 Ca -0.45 -0.58 -0.72 0.00 0.00 0.00 0.00 54.91 53.16 1wv4 h ALA 29 Cb 1.27 -0.06 -0.27 0.00 0.00 0.00 0.00 17.79 18.73 1wv4 h ALA 29 CO 0.63 0.72 -0.44 0.34 0.00 0.00 0.00 179.25 180.50 1wv4 s ASP 30 N -6.98 5.71 0.59 0.00 3.68 -1.26 -4.92 116.67 113.49 1wv4 s ASP 30 Ca -0.07 -1.50 0.31 0.00 2.13 0.00 0.00 52.55 53.42 1wv4 s ASP 30 Cb 0.10 -2.01 1.27 0.00 -1.45 0.00 0.00 42.92 40.83 1wv4 s ASP 30 CO 0.85 -0.56 1.59 1.55 0.13 0.00 0.00 175.17 178.73 1wv4 h PRO 31 N 8.46 0.00 0.00 4.34 0.13 -2.01 0.72 132.00 143.63 1wv4 h PRO 31 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1wv4 h PRO 31 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1wv4 h PRO 31 CO 0.78 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.83 1wv4 n LEU 32 N -3.57 0.00 -0.01 1.56 4.77 -1.26 -1.22 117.00 117.27 1wv4 n LEU 32 Ca 0.21 0.10 -0.17 0.00 -0.03 0.00 0.00 56.01 56.12 1wv4 n LEU 32 Cb 1.26 -0.10 -0.14 0.00 -2.33 0.00 0.00 43.42 42.10 1wv4 n LEU 32 CO 0.29 -0.03 -0.73 0.41 -1.33 0.00 0.00 177.39 176.00 1wv4 n THR 33 N -1.10 1.71 -0.03 -5.08 -1.04 0.25 -2.13 114.28 106.86 1wv4 n THR 33 Ca 0.14 -0.71 -0.15 0.00 -2.04 0.00 0.00 64.05 61.30 1wv4 n THR 33 Cb 0.11 -1.47 -0.10 0.00 -1.82 0.00 0.00 70.33 67.05 1wv4 n THR 33 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1wv4 h LEU 34 N 0.05 0.29 -0.95 -4.42 5.85 -1.60 -2.20 115.31 112.32 1wv4 h LEU 34 Ca -0.38 -0.65 0.11 0.00 0.84 0.00 0.00 57.88 57.79 1wv4 h LEU 34 Cb 2.03 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 42.89 1wv4 h LEU 34 CO 0.08 0.89 0.59 0.15 -0.34 0.00 0.00 178.44 179.81 1wv4 h PHE 35 N -0.30 1.07 -0.08 1.25 3.04 -1.29 0.90 116.94 121.53 1wv4 h PHE 35 Ca -0.01 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.90 1wv4 h PHE 35 Cb 0.89 -0.34 -0.01 0.00 2.56 0.00 0.00 35.95 39.05 1wv4 h PHE 35 CO 0.14 0.44 -0.25 1.49 -2.02 0.00 0.00 178.31 178.11 1wv4 h GLU 36 N 0.95 0.14 -0.13 1.11 4.81 -1.34 -1.57 114.58 118.57 1wv4 h GLU 36 Ca 0.46 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.54 1wv4 h GLU 36 Cb 0.42 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1wv4 h GLU 36 CO -0.25 0.39 -0.34 -0.09 -0.73 0.00 0.00 179.01 177.99 1wv4 h ARG 37 N 0.13 0.45 -0.09 1.92 2.43 -0.26 -2.37 114.38 116.59 1wv4 h ARG 37 Ca 0.02 -0.32 -0.06 0.00 -0.81 0.00 0.00 59.98 58.82 1wv4 h ARG 37 Cb 0.52 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1wv4 h ARG 37 CO 0.04 0.93 -0.19 -1.49 -1.51 0.00 0.00 179.97 177.74 1wv4 h TRP 38 N 0.04 0.16 -0.08 2.20 4.06 -0.84 -1.55 115.95 119.94 1wv4 h TRP 38 Ca -0.01 -0.02 -0.21 0.00 2.06 0.00 0.00 58.89 60.71 1wv4 h TRP 38 Cb 0.95 -0.05 0.00 0.00 -1.00 0.00 0.00 29.16 29.07 1wv4 h TRP 38 CO 0.11 0.35 -0.80 1.25 -3.56 0.00 0.00 178.44 175.79 1wv4 h LEU 39 N 0.15 0.65 -0.43 -4.49 5.85 -1.28 0.34 115.31 116.09 1wv4 h LEU 39 Ca 0.03 -0.44 -0.09 0.00 0.84 0.00 0.00 57.88 58.21 1wv4 h LEU 39 Cb 0.43 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1wv4 h LEU 39 CO 0.03 1.21 -0.07 0.28 -0.34 0.00 0.00 178.44 179.55 1wv4 h SER 40 N 0.35 0.82 0.89 1.25 0.02 -1.32 -0.73 113.55 114.82 1wv4 h SER 40 Ca -0.05 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1wv4 h SER 40 Cb 1.40 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1wv4 h SER 40 CO 0.15 0.97 0.00 1.56 -1.14 0.00 0.00 176.83 178.37 1wv4 h GLN 41 N 0.65 0.00 0.18 3.45 4.20 -1.19 0.79 115.11 123.19 1wv4 h GLN 41 Ca 0.11 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.48 1wv4 h GLN 41 Cb 0.60 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.39 1wv4 h GLN 41 CO 0.04 0.00 -1.72 0.00 -0.67 0.00 0.00 178.83 176.48 1wv4 h ALA 42 N 2.04 0.17 -0.27 3.87 0.00 -0.34 -3.19 119.26 121.54 1wv4 h ALA 42 Ca 0.00 -1.14 -0.12 0.00 0.00 0.00 0.00 54.91 53.65 1wv4 h ALA 42 Cb 0.44 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1wv4 h ALA 42 CO 0.00 1.04 -0.33 0.00 0.00 0.00 0.00 179.25 179.97 1wv4 h GLU 44 N 0.50 0.16 -1.10 0.00 4.11 -0.97 -2.41 114.58 114.86 1wv4 h GLU 44 Ca 0.06 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.45 1wv4 h GLU 44 Cb 0.81 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1wv4 h GLU 44 CO 0.07 0.33 0.00 0.00 0.07 0.00 0.00 179.01 179.47 1wv4 n ALA 45 N -2.24 2.18 -4.01 1.06 0.00 -1.20 -4.83 120.51 111.47 1wv4 n ALA 45 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.07 1wv4 n ALA 45 Cb 0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 1wv4 n ALA 45 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1wv4 n LYS 46 N 0.48 -0.71 -2.26 0.00 4.01 -0.91 -4.92 118.16 113.86 1wv4 n LYS 46 Ca 0.00 0.02 -0.30 0.00 -0.51 0.00 0.00 58.31 57.52 1wv4 n LYS 46 Cb 0.30 -2.50 -0.00 0.00 -0.51 0.00 0.00 35.03 32.32 1wv4 n LYS 46 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1wv4 s LEU 47 N -6.80 3.46 0.11 -0.35 1.02 -1.13 -5.03 118.68 109.96 1wv4 s LEU 47 Ca 0.16 1.26 -0.30 0.00 0.02 0.00 0.00 54.13 55.27 1wv4 s LEU 47 Cb -0.09 -4.25 -0.06 0.00 0.02 0.00 0.00 46.19 41.80 1wv4 s LEU 47 CO 0.82 -0.70 1.09 0.00 0.02 0.00 0.00 176.35 177.58 1wv4 s ALA 48 N -2.90 3.33 -1.06 4.21 0.00 -1.26 -4.20 121.76 119.88 1wv4 s ALA 48 Ca 0.53 0.75 -0.27 0.00 0.00 0.00 0.00 51.96 52.98 1wv4 s ALA 48 Cb -0.11 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.69 1wv4 s ALA 48 CO 0.46 -0.25 0.62 -0.25 0.00 0.00 0.00 175.76 176.34 1wv4 n ASP 49 N 3.05 -3.92 -0.17 0.00 8.00 -1.26 -4.82 116.55 117.43 1wv4 n ASP 49 Ca 0.05 -1.16 0.24 0.00 0.71 0.00 0.00 54.79 54.62 1wv4 n ASP 49 Cb 0.47 -1.47 0.65 0.00 -0.02 0.00 0.00 41.12 40.75 1wv4 n ASP 49 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1wv4 h PRO 50 N -1.86 0.13 -0.21 -0.24 0.11 -1.91 0.54 132.00 128.57 1wv4 h PRO 50 Ca -0.65 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.45 1wv4 h PRO 50 Cb 1.31 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1wv4 h PRO 50 CO 0.45 0.09 0.00 0.25 -0.21 0.00 0.00 178.00 178.58 1wv4 n THR 51 N -4.37 0.27 -2.58 -1.15 -2.24 -1.26 -4.87 114.28 98.08 1wv4 n THR 51 Ca 0.17 -0.29 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 1wv4 n THR 51 Cb 0.81 0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 69.16 1wv4 n THR 51 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wv4 s ALA 52 N -1.73 3.31 0.08 6.98 0.00 0.19 -0.69 121.76 129.91 1wv4 s ALA 52 Ca 0.17 0.62 0.03 0.00 0.00 0.00 0.00 51.96 52.79 1wv4 s ALA 52 Cb 0.09 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 1wv4 s ALA 52 CO 0.12 -0.42 -0.10 0.00 0.00 0.00 0.00 175.76 175.36 1wv4 s MET 53 N 1.35 0.79 -0.35 0.00 0.23 0.75 -4.45 119.30 117.61 1wv4 s MET 53 Ca 0.54 -1.08 -0.16 0.00 -1.03 0.00 0.00 55.69 53.96 1wv4 s MET 53 Cb -0.24 -0.49 -0.01 0.00 -1.53 0.00 0.00 34.83 32.57 1wv4 s MET 53 CO 0.26 0.08 0.40 0.08 -2.03 0.00 0.00 175.02 173.81 1wv4 s VAL 54 N -2.24 5.13 -0.16 5.16 1.01 -0.44 -0.42 120.40 128.44 1wv4 s VAL 54 Ca 0.02 0.11 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 1wv4 s VAL 54 Cb -0.04 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1wv4 s VAL 54 CO -0.00 -0.13 0.14 0.54 0.00 0.00 0.00 175.10 175.64 1wv4 s VAL 55 N 2.11 5.46 -0.15 2.92 0.11 -0.78 -1.39 120.40 128.69 1wv4 s VAL 55 Ca 0.13 0.20 0.01 0.00 -2.93 0.00 0.00 61.98 59.40 1wv4 s VAL 55 Cb -0.16 -3.43 0.00 0.00 -1.53 0.00 0.00 36.38 31.26 1wv4 s VAL 55 CO 0.12 0.54 -0.18 0.00 -3.33 0.00 0.00 175.10 172.25 1wv4 s ALA 56 N -0.41 2.40 0.53 1.54 0.00 -0.50 -2.18 121.76 123.14 1wv4 s ALA 56 Ca 0.12 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.02 1wv4 s ALA 56 Cb -0.12 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1wv4 s ALA 56 CO 0.01 -0.04 0.07 0.95 0.00 0.00 0.00 175.76 176.75 1wv4 s THR 57 N 0.83 1.15 -0.01 0.00 -4.23 -0.80 -2.41 115.64 110.17 1wv4 s THR 57 Ca -0.06 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 58.54 1wv4 s THR 57 Cb -0.15 -2.07 0.01 0.00 1.34 0.00 0.00 72.50 71.63 1wv4 s THR 57 CO -0.01 0.00 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.37 1wv4 s VAL 58 N -2.88 0.16 0.77 2.29 1.01 -1.26 -2.33 120.40 118.16 1wv4 s VAL 58 Ca 0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 61.98 61.97 1wv4 s VAL 58 Cb 0.00 -0.19 0.11 0.00 0.00 0.00 0.00 36.38 36.30 1wv4 s VAL 58 CO 0.04 0.09 1.09 1.51 0.00 0.00 0.00 175.10 177.83 1wv4 s ASP 59 N 0.41 4.31 0.51 3.32 1.47 0.12 -4.74 116.67 122.06 1wv4 s ASP 59 Ca -0.04 0.27 0.24 0.00 1.18 0.00 0.00 52.55 54.20 1wv4 s ASP 59 Cb -0.06 -0.72 1.34 0.00 -0.34 0.00 0.00 42.92 43.14 1wv4 s ASP 59 CO -0.01 -1.93 1.96 1.05 0.68 0.00 0.00 175.17 176.92 1wv4 h GLU 60 N -0.85 0.08 0.00 2.11 4.11 -1.93 0.12 114.58 118.22 1wv4 h GLU 60 Ca -0.43 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1wv4 h GLU 60 Cb 1.29 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1wv4 h GLU 60 CO 0.51 0.06 -0.03 0.72 0.07 0.00 0.00 179.01 180.34 1wv4 n HIS 61 N -4.38 0.07 -0.38 2.06 8.25 -1.26 -4.89 115.22 114.69 1wv4 n HIS 61 Ca 0.12 0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1wv4 n HIS 61 Cb 0.66 -0.52 0.00 0.00 1.12 0.00 0.00 29.99 31.25 1wv4 n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wv4 n GLY 62 N 1.49 0.90 3.68 -1.41 0.00 0.41 -5.06 105.19 105.20 1wv4 n GLY 62 Ca 0.07 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 1wv4 n GLY 62 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wv4 s GLN 63 N -0.86 4.17 0.31 1.61 2.00 -1.25 -4.84 119.66 120.80 1wv4 s GLN 63 Ca 0.00 0.08 -0.18 0.00 -2.00 0.00 0.00 55.36 53.26 1wv4 s GLN 63 Cb 0.00 -3.51 -0.09 0.00 0.80 0.00 0.00 33.01 30.21 1wv4 s GLN 63 CO 0.00 0.04 0.78 -1.25 -0.50 0.00 0.00 175.29 174.36 1wv4 s PRO 64 N 1.08 4.15 0.18 1.67 0.04 -1.26 -0.71 135.00 140.15 1wv4 s PRO 64 Ca 0.16 0.85 0.07 0.00 0.04 0.00 0.00 61.00 62.12 1wv4 s PRO 64 Cb -0.14 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 1wv4 s PRO 64 CO 0.06 0.21 -0.15 0.71 0.04 0.00 0.00 177.00 177.87 1wv4 s TYR 65 N -1.85 1.66 -0.04 0.56 1.51 -0.98 -4.97 117.35 113.25 1wv4 s TYR 65 Ca 0.52 -0.55 -0.05 0.00 -1.01 0.00 0.00 57.07 55.97 1wv4 s TYR 65 Cb -0.13 -0.80 0.01 0.00 -0.11 0.00 0.00 41.96 40.93 1wv4 s TYR 65 CO 0.18 0.30 0.13 -0.65 -1.11 0.00 0.00 175.55 174.41 1wv4 s GLN 66 N -3.28 0.25 -0.08 -0.62 -0.21 -1.26 -1.91 119.66 112.55 1wv4 s GLN 66 Ca 0.18 0.01 -0.30 0.00 0.02 0.00 0.00 55.36 55.27 1wv4 s GLN 66 Cb -0.03 0.11 0.07 0.00 1.00 0.00 0.00 33.01 34.17 1wv4 s GLN 66 CO 0.06 -0.04 0.69 -0.98 -2.12 0.00 0.00 175.29 172.89 1wv4 s ARG 67 N -0.35 1.03 0.33 2.91 3.03 -0.93 -4.99 118.95 119.98 1wv4 s ARG 67 Ca -0.04 0.34 -0.27 0.00 2.03 0.00 0.00 55.73 57.79 1wv4 s ARG 67 Cb -0.03 0.49 -0.09 0.00 -1.03 0.00 0.00 34.95 34.28 1wv4 s ARG 67 CO 0.00 -0.30 1.02 0.42 -1.13 0.00 0.00 175.30 175.31 1wv4 s ILE 68 N -1.02 3.83 0.10 4.99 1.01 -1.26 -1.86 121.20 126.99 1wv4 s ILE 68 Ca -0.10 1.60 -0.07 0.00 0.00 0.00 0.00 60.65 62.09 1wv4 s ILE 68 Cb -0.01 -3.93 -0.01 0.00 0.01 0.00 0.00 42.46 38.52 1wv4 s ILE 68 CO 0.09 0.21 0.16 -0.69 0.00 0.00 0.00 174.94 174.70 1wv4 s VAL 69 N -1.45 0.13 -0.09 2.92 1.01 0.44 -4.93 120.40 118.44 1wv4 s VAL 69 Ca 0.50 -1.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 1wv4 s VAL 69 Cb -0.24 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1wv4 s VAL 69 CO 0.31 -0.61 -0.03 -0.76 0.00 0.00 0.00 175.10 174.00 1wv4 s LEU 70 N -2.92 3.36 -0.27 3.92 1.43 -1.26 -0.18 118.68 122.76 1wv4 s LEU 70 Ca 0.10 0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 1wv4 s LEU 70 Cb 0.05 -1.76 -0.00 0.00 0.03 0.00 0.00 46.19 44.52 1wv4 s LEU 70 CO -0.07 0.35 1.27 -0.22 0.23 0.00 0.00 176.35 177.91 1wv4 s LEU 71 N -0.72 3.95 0.00 1.79 2.96 0.13 -4.38 118.68 122.41 1wv4 s LEU 71 Ca 0.11 1.29 0.22 0.00 -0.22 0.00 0.00 54.13 55.53 1wv4 s LEU 71 Cb -0.11 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 42.90 1wv4 s LEU 71 CO 0.02 -0.99 0.93 0.29 -1.32 0.00 0.00 176.35 175.28 1wv4 n LYS 72 N 7.12 0.08 0.00 1.98 4.76 -0.36 -4.94 118.16 126.80 1wv4 n LYS 72 Ca 0.14 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1wv4 n LYS 72 Cb 0.46 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 1wv4 n LYS 72 CO 0.00 0.00 0.00 1.58 -1.37 0.00 0.00 177.40 177.61 1wv4 n HIS 73 N -1.61 0.00 -3.81 2.13 -0.00 -1.25 -4.92 115.22 105.76 1wv4 n HIS 73 Ca 0.03 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.63 1wv4 n HIS 73 Cb 0.36 0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.26 1wv4 n HIS 73 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 1wv4 s TYR 74 N -1.65 -0.09 0.23 1.57 -0.85 -1.26 -1.14 117.35 114.16 1wv4 s TYR 74 Ca 0.00 0.10 -0.16 0.00 -0.52 0.00 0.00 57.07 56.48 1wv4 s TYR 74 Cb 0.00 0.04 0.06 0.00 0.38 0.00 0.00 41.96 42.44 1wv4 s TYR 74 CO 0.00 -0.35 0.81 -0.40 -1.52 0.00 0.00 175.55 174.09 1wv4 n ASP 75 N 1.33 -1.69 0.31 -0.18 3.85 -1.07 -5.00 116.55 114.09 1wv4 n ASP 75 Ca -0.22 -2.02 0.15 0.00 -0.71 0.00 0.00 54.79 51.99 1wv4 n ASP 75 Cb 0.56 2.79 0.81 0.00 -1.35 0.00 0.00 41.12 43.93 1wv4 n ASP 75 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 1wv4 h GLU 76 N 0.00 0.00 0.00 0.11 9.09 -2.01 -1.42 114.58 120.34 1wv4 h GLU 76 Ca -0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.15 1wv4 h GLU 76 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 1wv4 h GLU 76 CO 0.34 0.00 -0.15 0.87 0.05 0.00 0.00 179.01 180.12 1wv4 h LYS 77 N 0.00 0.00 0.00 1.06 1.57 -1.95 -3.44 116.57 113.81 1wv4 h LYS 77 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wv4 h LYS 77 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1wv4 h LYS 77 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 1wv4 n GLY 78 N 1.18 1.00 3.64 3.86 0.00 -0.54 -4.36 105.19 109.97 1wv4 n GLY 78 Ca 0.04 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.78 1wv4 n GLY 78 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wv4 s MET 79 N -1.25 3.39 0.00 1.61 -1.94 -0.27 -2.61 119.30 118.23 1wv4 s MET 79 Ca 0.00 -0.41 0.01 0.00 -1.71 0.00 0.00 55.69 53.58 1wv4 s MET 79 Cb 0.00 -2.93 -0.04 0.00 2.01 0.00 0.00 34.83 33.87 1wv4 s MET 79 CO 0.00 0.50 0.04 0.08 -0.01 0.00 0.00 175.02 175.64 1wv4 s VAL 80 N -0.32 4.45 0.11 -6.03 1.01 -0.29 0.50 120.40 119.83 1wv4 s VAL 80 Ca 0.07 -0.52 -0.11 0.00 0.00 0.00 0.00 61.98 61.42 1wv4 s VAL 80 Cb -0.12 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.25 1wv4 s VAL 80 CO 0.02 0.35 0.28 0.72 0.00 0.00 0.00 175.10 176.47 1wv4 s PHE 81 N -1.16 0.07 0.10 5.22 -0.71 -0.97 -1.23 117.98 119.31 1wv4 s PHE 81 Ca 0.22 -0.45 0.07 0.00 -1.04 0.00 0.00 56.93 55.73 1wv4 s PHE 81 Cb -0.12 0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.71 1wv4 s PHE 81 CO 0.13 -0.63 -0.11 0.71 -1.34 0.00 0.00 175.22 173.97 1wv4 s TYR 82 N -3.86 2.71 0.29 3.49 4.12 -1.26 -2.18 117.35 120.66 1wv4 s TYR 82 Ca 0.06 -0.17 -0.08 0.00 0.02 0.00 0.00 57.07 56.90 1wv4 s TYR 82 Cb 0.03 -1.42 -0.00 0.00 -1.52 0.00 0.00 41.96 39.05 1wv4 s TYR 82 CO -0.09 0.42 0.47 -0.08 0.02 0.00 0.00 175.55 176.28 1wv4 s THR 83 N -1.20 0.00 0.12 -0.71 -1.32 0.45 -4.86 115.64 108.12 1wv4 s THR 83 Ca 0.21 -1.51 -0.19 0.00 -1.21 0.00 0.00 61.69 58.99 1wv4 s THR 83 Cb -0.11 -2.44 -0.07 0.00 -1.51 0.00 0.00 72.50 68.37 1wv4 s THR 83 CO 0.13 0.00 0.61 0.21 -2.21 0.00 0.00 174.62 173.36 1wv4 s ASN 84 N -3.12 7.04 0.00 8.08 3.04 -1.26 0.15 114.94 128.87 1wv4 s ASN 84 Ca 0.26 1.28 0.23 0.00 0.04 0.00 0.00 52.86 54.67 1wv4 s ASN 84 Cb -0.00 -2.37 1.08 0.00 -1.54 0.00 0.00 41.25 38.42 1wv4 s ASN 84 CO 0.14 0.19 1.74 0.18 -3.04 0.00 0.00 177.10 176.31 1wv4 n LEU 85 N 1.35 0.00 -2.54 3.21 4.77 0.58 -3.14 117.00 121.23 1wv4 n LEU 85 Ca -0.08 0.36 -0.25 0.00 -0.03 0.00 0.00 56.01 56.02 1wv4 n LEU 85 Cb 0.51 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1wv4 n LEU 85 CO 0.42 -0.09 0.14 0.61 -1.33 0.00 0.00 177.39 177.15 1wv4 n GLY 86 N 0.71 5.38 3.36 -0.72 0.00 -1.26 -4.75 105.19 107.90 1wv4 n GLY 86 Ca 0.09 -2.57 -0.28 0.00 0.00 0.00 0.00 46.02 43.26 1wv4 n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wv4 s SER 87 N -3.47 3.11 0.31 1.61 1.04 -1.19 -5.04 113.70 110.08 1wv4 s SER 87 Ca 0.45 -0.72 0.06 0.00 0.48 0.00 0.00 55.95 56.22 1wv4 s SER 87 Cb 0.40 -0.21 0.86 0.00 0.10 0.00 0.00 66.02 67.17 1wv4 s SER 87 CO -0.16 0.16 1.60 -0.09 0.98 0.00 0.00 173.24 175.74 1wv4 h ARG 88 N 4.03 0.09 -0.06 4.02 2.43 -1.95 0.38 114.38 123.32 1wv4 h ARG 88 Ca -0.49 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 58.59 1wv4 h ARG 88 Cb 1.17 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1wv4 h ARG 88 CO 0.40 0.06 -0.32 1.57 -1.51 0.00 0.00 179.97 180.16 1wv4 h LYS 89 N 0.09 0.11 -0.32 0.20 2.10 -1.97 -1.25 116.57 115.53 1wv4 h LYS 89 Ca 0.63 -0.04 -0.08 0.00 -2.00 0.00 0.00 60.65 59.16 1wv4 h LYS 89 Cb 1.39 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 32.70 1wv4 h LYS 89 CO -0.79 0.42 -0.11 0.00 -2.00 0.00 0.00 179.45 176.98 1wv4 h ALA 90 N 1.58 0.45 -0.51 0.07 0.00 -0.54 -1.88 119.26 118.43 1wv4 h ALA 90 Ca 0.01 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1wv4 h ALA 90 Cb 0.62 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1wv4 h ALA 90 CO 0.05 0.31 0.06 0.45 0.00 0.00 0.00 179.25 180.12 1wv4 h HIS 91 N 0.42 0.85 -0.45 0.00 3.86 -1.01 -2.39 115.15 116.42 1wv4 h HIS 91 Ca 0.08 -0.10 -0.10 0.00 -1.16 0.00 0.00 60.37 59.09 1wv4 h HIS 91 Cb 0.62 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 1wv4 h HIS 91 CO 0.05 0.75 -0.12 1.96 0.86 0.00 0.00 177.93 181.44 1wv4 h GLN 92 N 0.77 0.82 -0.36 2.45 4.20 -0.99 -2.36 115.11 119.64 1wv4 h GLN 92 Ca 0.16 -0.28 -0.10 0.00 0.06 0.00 0.00 58.65 58.48 1wv4 h GLN 92 Cb 0.38 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1wv4 h GLN 92 CO 0.01 0.90 -0.16 0.82 -0.67 0.00 0.00 178.83 179.73 1wv4 h ILE 93 N 0.74 1.28 -0.69 2.54 2.04 -1.18 0.37 117.51 122.61 1wv4 h ILE 93 Ca 0.12 -1.28 0.05 0.00 1.00 0.00 0.00 64.86 64.75 1wv4 h ILE 93 Cb 0.62 1.35 -0.04 0.00 -0.74 0.00 0.00 36.82 38.01 1wv4 h ILE 93 CO 0.04 0.42 0.46 -0.33 0.00 0.00 0.00 178.15 178.74 1wv4 h GLU 94 N 0.53 0.73 0.00 2.37 5.08 -1.34 -0.47 114.58 121.48 1wv4 h GLU 94 Ca 0.08 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 1wv4 h GLU 94 Cb 0.70 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1wv4 h GLU 94 CO 0.05 0.49 -0.66 -0.97 -1.00 0.00 0.00 179.01 176.92 1wv4 h ASN 95 N 0.76 0.00 -1.27 1.42 -0.73 -0.97 -3.44 115.58 111.35 1wv4 h ASN 95 Ca 0.29 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.47 1wv4 h ASN 95 Cb 0.20 0.00 -0.24 0.00 0.27 0.00 0.00 38.32 38.55 1wv4 h ASN 95 CO -0.09 0.38 -0.36 0.21 -0.37 0.00 0.00 177.43 177.21 1wv4 s ASN 96 N -6.17 -0.90 0.00 1.15 3.04 0.12 -5.02 114.94 107.16 1wv4 s ASN 96 Ca 0.03 0.53 0.24 0.00 0.04 0.00 0.00 52.86 53.69 1wv4 s ASN 96 Cb 0.08 1.82 1.26 0.00 -1.54 0.00 0.00 41.25 42.86 1wv4 s ASN 96 CO 0.75 -0.28 1.78 -0.81 -3.04 0.00 0.00 177.10 175.50 1wv4 n PRO 97 N 5.41 0.47 -2.17 0.43 -0.04 -0.88 -3.79 135.00 134.42 1wv4 n PRO 97 Ca -0.01 0.05 -0.42 0.00 -0.04 0.00 0.00 63.50 63.08 1wv4 n PRO 97 Cb 0.51 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.44 1wv4 n PRO 97 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1wv4 s ARG 98 N -2.39 4.28 0.08 0.54 0.52 -1.26 -1.54 118.95 119.17 1wv4 s ARG 98 Ca 0.27 2.04 -0.08 0.00 -0.52 0.00 0.00 55.73 57.43 1wv4 s ARG 98 Cb 0.16 -3.49 -0.00 0.00 0.52 0.00 0.00 34.95 32.13 1wv4 s ARG 98 CO 0.33 -0.56 0.17 0.14 0.02 0.00 0.00 175.30 175.40 1wv4 s VAL 99 N 2.10 0.14 0.12 3.52 -7.23 -0.87 -4.49 120.40 113.70 1wv4 s VAL 99 Ca 0.65 -1.19 0.10 0.00 -1.81 0.00 0.00 61.98 59.73 1wv4 s VAL 99 Cb -0.34 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 1wv4 s VAL 99 CO 0.28 -0.65 -0.24 -0.55 -0.31 0.00 0.00 175.10 173.63 1wv4 s SER 100 N -2.71 2.97 -0.01 4.85 0.15 -1.01 -2.36 113.70 115.57 1wv4 s SER 100 Ca 0.03 -0.73 0.04 0.00 0.70 0.00 0.00 55.95 55.98 1wv4 s SER 100 Cb 0.04 -0.19 -0.01 0.00 -1.71 0.00 0.00 66.02 64.16 1wv4 s SER 100 CO -0.10 0.12 -0.12 -0.76 1.20 0.00 0.00 173.24 173.58 1wv4 s LEU 101 N -2.05 1.99 -0.04 3.45 1.43 -0.58 -1.41 118.68 121.47 1wv4 s LEU 101 Ca 0.11 -0.23 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 1wv4 s LEU 101 Cb -0.10 -0.66 0.03 0.00 0.03 0.00 0.00 46.19 45.49 1wv4 s LEU 101 CO 0.05 0.14 0.02 -0.22 0.23 0.00 0.00 176.35 176.58 1wv4 s LEU 102 N -0.22 0.78 -0.32 1.79 0.20 -0.48 -1.01 118.68 119.42 1wv4 s LEU 102 Ca 0.03 -0.00 -0.17 0.00 0.69 0.00 0.00 54.13 54.68 1wv4 s LEU 102 Cb -0.06 -0.23 -0.01 0.00 -0.43 0.00 0.00 46.19 45.46 1wv4 s LEU 102 CO -0.00 -0.16 0.49 -0.36 -0.29 0.00 0.00 176.35 176.03 1wv4 s PHE 103 N 1.51 3.21 -1.35 5.38 0.40 -0.54 -1.32 117.98 125.26 1wv4 s PHE 103 Ca -0.03 0.30 -0.13 0.00 -0.60 0.00 0.00 56.93 56.48 1wv4 s PHE 103 Cb -0.13 -2.82 0.10 0.00 0.51 0.00 0.00 43.02 40.68 1wv4 s PHE 103 CO -0.03 -0.44 1.97 -0.35 0.70 0.00 0.00 175.22 177.07 1wv4 n PRO 104 N 5.63 3.24 -0.83 0.24 -0.04 -1.26 -3.28 135.00 138.70 1wv4 n PRO 104 Ca -0.05 -3.15 -0.16 0.00 -0.04 0.00 0.00 63.50 60.10 1wv4 n PRO 104 Cb 0.49 -3.15 0.07 0.00 -0.04 0.00 0.00 33.50 30.87 1wv4 n PRO 104 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1wv4 n TRP 105 N 5.42 1.70 -0.29 0.54 8.01 -0.64 -4.56 117.44 127.62 1wv4 n TRP 105 Ca 0.46 -1.74 0.15 0.00 -1.31 0.00 0.00 57.50 55.05 1wv4 n TRP 105 Cb 0.39 -0.86 0.40 0.00 -2.01 0.00 0.00 31.31 29.23 1wv4 n TRP 105 CO 0.00 0.00 0.00 1.12 -1.01 0.00 0.00 177.69 177.80 1wv4 h HIS 106 N 1.13 0.82 -1.20 -5.99 2.07 -1.79 0.36 115.15 110.54 1wv4 h HIS 106 Ca 0.33 0.03 0.38 0.00 -2.85 0.00 0.00 60.37 58.26 1wv4 h HIS 106 Cb 1.35 -0.25 -0.13 0.00 2.57 0.00 0.00 27.41 30.96 1wv4 h HIS 106 CO 0.87 0.23 0.76 1.15 -3.07 0.00 0.00 177.93 177.88 1wv4 h THR 107 N 0.63 0.22 -0.38 6.12 2.02 -1.88 0.83 112.91 120.47 1wv4 h THR 107 Ca 0.50 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.62 1wv4 h THR 107 Cb 0.93 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1wv4 h THR 107 CO -0.25 0.03 0.00 0.18 0.37 0.00 0.00 175.52 175.85 1wv4 n LEU 108 N -4.75 3.60 -1.79 2.58 4.77 0.11 -4.95 117.00 116.56 1wv4 n LEU 108 Ca 0.34 -2.42 -0.16 0.00 -0.03 0.00 0.00 56.01 53.74 1wv4 n LEU 108 Cb 1.25 -0.40 -0.01 0.00 -2.33 0.00 0.00 43.42 41.93 1wv4 n LEU 108 CO 0.19 0.73 -0.20 -0.62 -1.33 0.00 0.00 177.39 176.16 1wv4 n GLU 109 N 0.30 -1.27 -4.30 3.23 -0.58 0.29 -4.81 120.64 113.49 1wv4 n GLU 109 Ca 0.18 0.80 -0.19 0.00 -0.42 0.00 0.00 57.16 57.53 1wv4 n GLU 109 Cb 0.67 -5.18 -0.11 0.00 -0.57 0.00 0.00 31.44 26.25 1wv4 n GLU 109 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1wv4 s ARG 110 N -4.69 1.20 0.01 3.49 0.52 -0.34 -3.41 118.95 115.74 1wv4 s ARG 110 Ca 0.00 -1.41 -0.07 0.00 -0.52 0.00 0.00 55.73 53.74 1wv4 s ARG 110 Cb 0.00 -1.10 -0.00 0.00 0.52 0.00 0.00 34.95 34.36 1wv4 s ARG 110 CO 0.00 0.21 0.13 -0.65 0.02 0.00 0.00 175.30 175.00 1wv4 s GLN 111 N -3.03 0.51 -0.01 3.54 -0.21 -1.10 -1.62 119.66 117.74 1wv4 s GLN 111 Ca 0.15 -0.49 0.01 0.00 0.02 0.00 0.00 55.36 55.06 1wv4 s GLN 111 Cb -0.04 0.21 0.00 0.00 1.00 0.00 0.00 33.01 34.19 1wv4 s GLN 111 CO 0.05 -0.12 -0.04 0.08 -2.12 0.00 0.00 175.29 173.13 1wv4 s VAL 112 N -1.70 0.39 -0.05 1.09 1.01 -1.21 -2.29 120.40 117.65 1wv4 s VAL 112 Ca -0.12 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 61.73 1wv4 s VAL 112 Cb -0.06 -0.36 -0.00 0.00 0.00 0.00 0.00 36.38 35.96 1wv4 s VAL 112 CO 0.00 0.13 -0.17 -0.32 0.00 0.00 0.00 175.10 174.74 1wv4 s MET 113 N 0.12 1.82 -0.07 2.72 0.00 -0.94 -1.47 119.30 121.49 1wv4 s MET 113 Ca -0.01 -0.61 0.05 0.00 0.00 0.00 0.00 55.69 55.12 1wv4 s MET 113 Cb -0.05 -1.57 -0.00 0.00 0.00 0.00 0.00 34.83 33.21 1wv4 s MET 113 CO -0.00 0.23 -0.21 0.08 0.00 0.00 0.00 175.02 175.11 1wv4 s VAL 114 N 0.08 1.80 -0.10 10.11 1.01 -0.18 0.18 120.40 133.30 1wv4 s VAL 114 Ca -0.05 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.06 1wv4 s VAL 114 Cb -0.12 -1.55 0.00 0.00 0.00 0.00 0.00 36.38 34.72 1wv4 s VAL 114 CO 0.02 0.50 -0.23 -0.63 0.00 0.00 0.00 175.10 174.77 1wv4 s ILE 115 N 0.11 2.00 0.02 2.22 -1.09 0.06 -1.53 121.20 122.98 1wv4 s ILE 115 Ca -0.09 -0.98 -0.06 0.00 -2.23 0.00 0.00 60.65 57.29 1wv4 s ILE 115 Cb -0.14 -1.73 0.02 0.00 -1.58 0.00 0.00 42.46 39.02 1wv4 s ILE 115 CO 0.05 0.55 0.26 0.61 -1.23 0.00 0.00 174.94 175.18 1wv4 n GLY 116 N 3.58 0.82 3.61 6.18 0.00 -1.00 -0.95 105.19 117.44 1wv4 n GLY 116 Ca -0.19 -0.92 -0.34 0.00 0.00 0.00 0.00 46.02 44.56 1wv4 n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wv4 s LYS 117 N -2.01 3.16 -0.26 1.61 1.02 -1.26 -2.04 119.74 119.96 1wv4 s LYS 117 Ca 0.06 -0.46 -0.17 0.00 0.02 0.00 0.00 55.97 55.41 1wv4 s LYS 117 Cb -0.00 -2.80 -0.03 0.00 -0.52 0.00 0.00 37.83 34.48 1wv4 s LYS 117 CO 0.00 0.56 0.49 0.00 -0.92 0.00 0.00 175.35 175.48 1wv4 s ALA 118 N -0.49 3.59 -0.06 5.17 0.00 -0.59 -0.88 121.76 128.51 1wv4 s ALA 118 Ca 0.08 -0.64 0.04 0.00 0.00 0.00 0.00 51.96 51.44 1wv4 s ALA 118 Cb -0.12 -2.86 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 1wv4 s ALA 118 CO 0.02 -0.73 -0.16 -1.21 0.00 0.00 0.00 175.76 173.68 1wv4 s GLU 119 N 2.28 2.56 0.28 0.00 2.02 -0.39 -4.78 118.70 120.67 1wv4 s GLU 119 Ca 0.20 -0.72 -0.30 0.00 0.02 0.00 0.00 54.97 54.17 1wv4 s GLU 119 Cb -0.16 -2.37 -0.10 0.00 0.10 0.00 0.00 34.13 31.60 1wv4 s GLU 119 CO 0.09 0.57 1.44 0.50 0.02 0.00 0.00 175.26 177.88 1wv4 s ARG 120 N -0.59 4.24 0.46 1.61 3.00 -1.26 -0.95 118.95 125.46 1wv4 s ARG 120 Ca 0.08 2.36 -0.13 0.00 -1.00 0.00 0.00 55.73 57.04 1wv4 s ARG 120 Cb -0.11 -3.07 -0.07 0.00 0.00 0.00 0.00 34.95 31.69 1wv4 s ARG 120 CO 0.01 -0.42 0.87 -0.51 0.00 0.00 0.00 175.30 175.25 1wv4 s LEU 121 N -0.84 3.72 0.47 -0.88 1.43 0.06 -4.88 118.68 117.77 1wv4 s LEU 121 Ca 0.57 1.34 -0.20 0.00 -1.03 0.00 0.00 54.13 54.81 1wv4 s LEU 121 Cb -0.43 -4.25 -0.09 0.00 0.03 0.00 0.00 46.19 41.45 1wv4 s LEU 121 CO 0.48 -0.50 0.99 -0.94 0.23 0.00 0.00 176.35 176.62 1wv4 s SER 122 N -3.14 6.60 0.50 2.29 1.04 -1.26 -4.81 113.70 114.91 1wv4 s SER 122 Ca 0.55 1.77 0.26 0.00 0.48 0.00 0.00 55.95 59.00 1wv4 s SER 122 Cb -0.10 -2.54 1.33 0.00 0.10 0.00 0.00 66.02 64.81 1wv4 s SER 122 CO 0.32 -0.60 1.89 0.00 0.98 0.00 0.00 173.24 175.83 1wv4 h THR 123 N 1.54 0.62 -0.58 2.02 1.03 -1.99 0.58 112.91 116.14 1wv4 h THR 123 Ca -0.49 -0.05 0.05 0.00 -0.01 0.00 0.00 66.41 65.91 1wv4 h THR 123 Cb 1.20 0.47 -0.05 0.00 -1.07 0.00 0.00 68.15 68.70 1wv4 h THR 123 CO 0.60 0.03 0.31 -0.07 -0.01 0.00 0.00 175.52 176.38 1wv4 h LEU 124 N 0.14 0.46 0.94 0.00 4.07 -1.93 -3.09 115.31 115.91 1wv4 h LEU 124 Ca 0.42 0.03 -0.05 0.00 0.08 0.00 0.00 57.88 58.36 1wv4 h LEU 124 Cb 1.42 -0.06 0.01 0.00 1.08 0.00 0.00 40.66 43.11 1wv4 h LEU 124 CO -0.07 0.31 -0.45 -0.33 -1.08 0.00 0.00 178.44 176.82 1wv4 h GLU 125 N 0.59 -1.22 -0.90 1.13 4.39 -0.18 -2.51 114.58 115.88 1wv4 h GLU 125 Ca 0.26 0.08 0.26 0.00 0.34 0.00 0.00 59.36 60.30 1wv4 h GLU 125 Cb 0.15 0.28 -0.04 0.00 -0.10 0.00 0.00 28.75 29.04 1wv4 h GLU 125 CO -0.16 -0.81 1.15 0.28 -1.16 0.00 0.00 179.01 178.30 1wv4 n VAL 126 N -5.62 0.00 -3.04 3.13 0.31 -0.97 -3.24 118.33 108.90 1wv4 n VAL 126 Ca -0.16 1.17 -0.44 0.00 -0.01 0.00 0.00 64.34 64.90 1wv4 n VAL 126 Cb 0.50 -2.12 -0.04 0.00 -0.91 0.00 0.00 33.84 31.26 1wv4 n VAL 126 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1wv4 s MET 127 N -4.28 3.07 0.00 5.55 -1.94 -0.95 -3.93 119.30 116.83 1wv4 s MET 127 Ca -0.02 -1.16 0.00 0.00 -1.71 0.00 0.00 55.69 52.80 1wv4 s MET 127 Cb 0.12 -4.25 0.00 0.00 2.01 0.00 0.00 34.83 32.71 1wv4 s MET 127 CO 0.41 -1.61 0.00 1.17 -0.01 0.00 0.00 175.02 174.97 1wv4 n LYS 128 N 6.74 0.00 0.00 2.03 3.00 -1.20 -4.96 118.16 123.77 1wv4 n LYS 128 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.23 1wv4 n LYS 128 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.46 1wv4 n LYS 128 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1wv4 n TYR 129 N 0.00 0.00 0.00 5.64 4.02 -1.25 -5.22 117.16 120.35 1wv4 n TYR 129 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1wv4 n TYR 129 Cb 0.00 -0.50 0.00 0.00 -0.02 0.00 0.00 39.34 38.82 1wv4 n TYR 129 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1wv4 n SER 176 N -1.32 0.00 -4.47 7.72 3.41 -1.26 -4.83 113.62 112.87 1wv4 n SER 176 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 1wv4 n SER 176 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1wv4 n SER 176 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1wv4 n PHE 177 N 0.00 3.10 -2.71 7.33 -1.74 -1.26 -4.96 117.46 117.23 1wv4 n PHE 177 Ca 0.00 -1.84 -0.43 0.00 -0.56 0.00 0.00 57.45 54.62 1wv4 n PHE 177 Cb 0.00 -2.54 -0.03 0.00 1.52 0.00 0.00 39.48 38.43 1wv4 n PHE 177 CO 0.00 0.00 0.00 -1.58 -0.56 0.00 0.00 176.76 174.62 1wv4 s TRP 178 N 8.77 2.89 0.14 2.97 0.52 -1.26 -0.31 118.94 132.67 1wv4 s TRP 178 Ca 0.64 0.61 0.01 0.00 0.02 0.00 0.00 56.10 57.37 1wv4 s TRP 178 Cb 0.02 -4.15 0.01 0.00 -1.15 0.00 0.00 33.47 28.19 1wv4 s TRP 178 CO 0.12 -1.15 0.05 0.41 0.02 0.00 0.00 176.95 176.40 1wv4 n GLY 179 N 4.80 3.59 2.96 0.98 0.00 0.38 -4.92 105.19 112.98 1wv4 n GLY 179 Ca 0.09 -2.23 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 1wv4 n GLY 179 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wv4 s GLY 180 N -1.95 0.19 0.23 -0.02 0.00 -1.26 -0.41 107.32 104.09 1wv4 s GLY 180 Ca 0.03 -0.45 0.11 0.00 0.00 0.00 0.00 44.72 44.41 1wv4 s GLY 180 CO 0.02 -0.51 -0.21 -1.36 0.00 0.00 0.00 173.10 171.05 1wv4 s PHE 181 N -1.11 2.20 -0.12 1.90 0.40 -0.93 -0.76 117.98 119.56 1wv4 s PHE 181 Ca -0.12 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 55.85 1wv4 s PHE 181 Cb -0.08 -1.02 0.02 0.00 0.51 0.00 0.00 43.02 42.45 1wv4 s PHE 181 CO -0.01 0.57 -0.13 0.50 0.70 0.00 0.00 175.22 176.86 1wv4 s ARG 182 N -3.14 2.05 -0.13 0.44 3.52 -0.12 -2.30 118.95 119.26 1wv4 s ARG 182 Ca 0.25 -0.48 -0.19 0.00 -0.13 0.00 0.00 55.73 55.18 1wv4 s ARG 182 Cb -0.06 -1.84 -0.04 0.00 -1.56 0.00 0.00 34.95 31.45 1wv4 s ARG 182 CO 0.12 -0.15 0.51 0.08 -0.81 0.00 0.00 175.30 175.05 1wv4 s VAL 183 N 1.25 5.16 0.80 7.11 1.01 0.18 -1.26 120.40 134.65 1wv4 s VAL 183 Ca -0.02 1.00 -0.11 0.00 0.00 0.00 0.00 61.98 62.84 1wv4 s VAL 183 Cb -0.14 -3.84 0.07 0.00 0.00 0.00 0.00 36.38 32.47 1wv4 s VAL 183 CO -0.05 0.28 1.10 -0.94 0.00 0.00 0.00 175.10 175.49 1wv4 s SER 184 N 0.77 4.43 -1.11 3.32 1.04 -0.05 -1.11 113.70 120.98 1wv4 s SER 184 Ca 0.26 1.32 -0.05 0.00 0.48 0.00 0.00 55.95 57.96 1wv4 s SER 184 Cb -0.15 -2.05 0.29 0.00 0.10 0.00 0.00 66.02 64.20 1wv4 s SER 184 CO 0.11 -2.01 1.49 0.18 0.98 0.00 0.00 173.24 173.98 1wv4 n LEU 185 N -3.46 6.33 0.07 2.42 4.77 -1.26 -3.65 117.00 122.22 1wv4 n LEU 185 Ca 0.07 -5.11 -0.10 0.00 -0.03 0.00 0.00 56.01 50.83 1wv4 n LEU 185 Cb 0.56 -1.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 1wv4 n LEU 185 CO 0.56 1.60 0.28 -0.33 -1.33 0.00 0.00 177.39 178.17 1wv4 h GLU 186 N 5.65 0.35 -3.18 3.23 5.08 -1.42 -3.43 114.58 120.86 1wv4 h GLU 186 Ca 0.22 -0.33 -0.14 0.00 -1.00 0.00 0.00 59.36 58.11 1wv4 h GLU 186 Cb 0.65 0.08 -0.22 0.00 0.50 0.00 0.00 28.75 29.77 1wv4 h GLU 186 CO 1.33 1.00 -0.37 -0.65 -1.00 0.00 0.00 179.01 179.32 1wv4 s GLN 187 N -3.42 0.52 -0.03 2.33 -0.21 -0.75 -0.96 119.66 117.14 1wv4 s GLN 187 Ca -0.05 -0.10 -0.00 0.00 0.02 0.00 0.00 55.36 55.23 1wv4 s GLN 187 Cb 0.10 0.23 0.03 0.00 1.00 0.00 0.00 33.01 34.37 1wv4 s GLN 187 CO 0.84 -0.12 0.02 0.42 -2.12 0.00 0.00 175.29 174.33 1wv4 s ILE 188 N -0.95 0.08 0.09 1.08 1.01 -0.54 -0.76 121.20 121.22 1wv4 s ILE 188 Ca -0.10 0.17 0.08 0.00 0.00 0.00 0.00 60.65 60.80 1wv4 s ILE 188 Cb -0.05 -0.21 -0.04 0.00 0.01 0.00 0.00 42.46 42.17 1wv4 s ILE 188 CO 0.02 0.14 -0.16 -0.70 0.00 0.00 0.00 174.94 174.25 1wv4 s GLU 189 N 1.23 1.96 -0.03 2.79 2.12 0.13 -0.82 118.70 126.08 1wv4 s GLU 189 Ca -0.07 -1.08 0.07 0.00 0.36 0.00 0.00 54.97 54.25 1wv4 s GLU 189 Cb -0.13 -2.19 -0.02 0.00 0.26 0.00 0.00 34.13 32.05 1wv4 s GLU 189 CO -0.02 0.51 -0.25 -0.06 -0.54 0.00 0.00 175.26 174.90 1wv4 s PHE 190 N -1.10 2.25 -0.08 5.30 0.40 0.18 -2.21 117.98 122.71 1wv4 s PHE 190 Ca 0.18 -0.49 -0.00 0.00 -0.60 0.00 0.00 56.93 56.02 1wv4 s PHE 190 Cb -0.11 -1.45 0.02 0.00 0.51 0.00 0.00 43.02 41.99 1wv4 s PHE 190 CO 0.10 -0.08 -0.05 -0.46 0.70 0.00 0.00 175.22 175.42 1wv4 s TRP 191 N -0.47 1.12 0.49 0.36 -0.00 -0.97 -1.13 118.94 118.33 1wv4 s TRP 191 Ca 0.06 -0.46 0.02 0.00 -0.00 0.00 0.00 56.10 55.72 1wv4 s TRP 191 Cb -0.10 -0.99 -0.01 0.00 -0.00 0.00 0.00 33.47 32.36 1wv4 s TRP 191 CO 0.00 -0.38 0.06 -1.14 -0.00 0.00 0.00 176.95 175.49 1wv4 s GLN 192 N 1.52 2.13 -0.65 5.86 2.00 -0.36 -2.72 119.66 127.45 1wv4 s GLN 192 Ca -0.00 -2.36 -0.08 0.00 -2.00 0.00 0.00 55.36 50.92 1wv4 s GLN 192 Cb -0.13 -1.14 0.17 0.00 0.80 0.00 0.00 33.01 32.71 1wv4 s GLN 192 CO -0.04 -0.45 0.51 0.20 -0.50 0.00 0.00 175.29 175.01 1wv4 s GLY 193 N -3.79 2.44 0.52 2.59 0.00 -1.22 -3.44 107.32 104.41 1wv4 s GLY 193 Ca 0.10 -3.10 -0.13 0.00 0.00 0.00 0.00 44.72 41.58 1wv4 s GLY 193 CO 0.06 1.15 0.94 -0.32 0.00 0.00 0.00 173.10 174.94 1wv4 s GLY 194 N 1.61 1.89 0.00 0.20 0.00 -1.25 -4.24 107.32 105.53 1wv4 s GLY 194 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.85 1wv4 s GLY 194 CO -0.04 0.24 0.00 1.18 0.00 0.00 0.00 173.10 174.47 1wv4 n GLU 195 N -1.89 0.00 -0.17 2.90 4.71 -1.26 -3.97 120.64 120.96 1wv4 n GLU 195 Ca 0.05 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 57.08 1wv4 n GLU 195 Cb 0.54 0.00 -0.03 0.00 -1.01 0.00 0.00 31.44 30.94 1wv4 n GLU 195 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 1wv4 n HIS 196 N 0.00 0.00 -0.23 -0.32 8.25 -1.26 -4.14 115.22 117.52 1wv4 n HIS 196 Ca 0.00 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 56.99 1wv4 n HIS 196 Cb 0.00 -0.62 0.00 0.00 1.12 0.00 0.00 29.99 30.49 1wv4 n HIS 196 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1wv4 n ARG 197 N 5.70 0.00 -2.59 -0.41 3.00 -1.25 -4.82 116.66 116.28 1wv4 n ARG 197 Ca 0.13 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.57 1wv4 n ARG 197 Cb 0.12 -3.65 -0.03 0.00 0.00 0.00 0.00 32.46 28.89 1wv4 n ARG 197 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1wv4 s LEU 198 N 0.00 3.44 0.35 6.15 1.43 -1.26 -4.98 118.68 123.80 1wv4 s LEU 198 Ca 0.00 -0.90 -0.08 0.00 -1.03 0.00 0.00 54.13 52.12 1wv4 s LEU 198 Cb 0.00 -2.55 -0.06 0.00 0.03 0.00 0.00 46.19 43.61 1wv4 s LEU 198 CO 0.00 -1.67 0.67 -1.00 0.23 0.00 0.00 176.35 174.58 1wv4 s HIS 199 N 5.24 3.47 -0.29 0.29 3.76 -1.26 -3.82 115.29 122.67 1wv4 s HIS 199 Ca 0.38 0.86 -0.11 0.00 -0.15 0.00 0.00 55.06 56.04 1wv4 s HIS 199 Cb -0.06 -2.29 -0.04 0.00 1.11 0.00 0.00 32.58 31.30 1wv4 s HIS 199 CO 0.05 0.03 0.20 -0.51 -0.85 0.00 0.00 174.74 173.66 1wv4 s ASP 200 N -3.12 6.03 -0.09 1.40 1.01 -1.22 -4.28 116.67 116.39 1wv4 s ASP 200 Ca 0.48 -0.09 0.01 0.00 0.71 0.00 0.00 52.55 53.66 1wv4 s ASP 200 Cb -0.10 -2.13 0.02 0.00 1.01 0.00 0.00 42.92 41.72 1wv4 s ASP 200 CO 0.30 -0.09 -0.11 -0.13 0.21 0.00 0.00 175.17 175.35 1wv4 s ARG 201 N 1.76 1.76 -0.04 8.23 0.52 -1.26 -1.22 118.95 128.69 1wv4 s ARG 201 Ca 0.07 -0.39 0.05 0.00 -0.52 0.00 0.00 55.73 54.94 1wv4 s ARG 201 Cb -0.16 -1.58 -0.01 0.00 0.52 0.00 0.00 34.95 33.72 1wv4 s ARG 201 CO 0.11 -0.10 -0.19 -0.06 0.02 0.00 0.00 175.30 175.08 1wv4 s PHE 202 N 1.10 1.84 -0.18 -0.53 0.40 -0.28 -0.81 117.98 119.52 1wv4 s PHE 202 Ca -0.06 -0.50 -0.02 0.00 -0.60 0.00 0.00 56.93 55.75 1wv4 s PHE 202 Cb -0.14 -1.22 -0.01 0.00 0.51 0.00 0.00 43.02 42.15 1wv4 s PHE 202 CO -0.02 -0.15 -0.09 -1.17 0.70 0.00 0.00 175.22 174.50 1wv4 s LEU 203 N -0.09 2.80 -0.39 -0.37 2.96 -0.84 0.49 118.68 123.24 1wv4 s LEU 203 Ca -0.02 -0.37 -0.15 0.00 -0.22 0.00 0.00 54.13 53.38 1wv4 s LEU 203 Cb -0.11 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.91 1wv4 s LEU 203 CO 0.02 0.07 0.31 -0.31 -1.32 0.00 0.00 176.35 175.11 1wv4 s TYR 204 N 0.95 3.23 -0.12 5.38 1.51 0.00 -2.41 117.35 125.89 1wv4 s TYR 204 Ca -0.01 -0.43 -0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1wv4 s TYR 204 Cb -0.15 -2.61 -0.03 0.00 -0.11 0.00 0.00 41.96 39.06 1wv4 s TYR 204 CO -0.00 -0.54 0.00 -0.65 -1.11 0.00 0.00 175.55 173.25 1wv4 s GLN 205 N 1.77 3.30 -0.10 -0.62 -0.21 -0.03 -1.47 119.66 122.30 1wv4 s GLN 205 Ca 0.07 -0.42 -0.23 0.00 0.02 0.00 0.00 55.36 54.79 1wv4 s GLN 205 Cb -0.18 -2.89 -0.03 0.00 1.00 0.00 0.00 33.01 30.91 1wv4 s GLN 205 CO 0.11 0.53 0.71 0.50 -2.12 0.00 0.00 175.29 175.02 1wv4 s ARG 206 N -0.39 4.38 -0.15 2.91 6.06 -0.14 -0.88 118.95 130.75 1wv4 s ARG 206 Ca 0.07 0.87 -0.09 0.00 -2.50 0.00 0.00 55.73 54.08 1wv4 s ARG 206 Cb -0.12 -3.49 0.05 0.00 0.06 0.00 0.00 34.95 31.45 1wv4 s ARG 206 CO 0.02 -0.05 0.36 -1.83 -2.50 0.00 0.00 175.30 171.30 1wv4 s GLU 207 N 1.19 0.35 -0.58 5.12 4.04 -0.77 -4.94 118.70 123.11 1wv4 s GLU 207 Ca 0.36 0.65 -0.01 0.00 0.04 0.00 0.00 54.97 56.02 1wv4 s GLU 207 Cb -0.17 0.01 0.00 0.00 0.02 0.00 0.00 34.13 33.99 1wv4 s GLU 207 CO 0.16 -0.13 0.43 0.09 -1.84 0.00 0.00 175.26 173.97 1wv4 n ASN 208 N 3.91 -3.43 -3.96 0.83 3.02 -1.26 -1.48 115.26 112.89 1wv4 n ASN 208 Ca -0.21 -0.69 -0.37 0.00 -0.03 0.00 0.00 54.58 53.27 1wv4 n ASN 208 Cb 0.55 -1.14 0.01 0.00 -0.61 0.00 0.00 39.78 38.60 1wv4 n ASN 208 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1wv4 n ASP 209 N -1.69 -3.75 -3.88 6.41 9.92 -1.26 -4.91 116.55 117.39 1wv4 n ASP 209 Ca -0.23 -1.09 0.04 0.00 -0.53 0.00 0.00 54.79 52.98 1wv4 n ASP 209 Cb 0.50 -1.39 0.01 0.00 -0.64 0.00 0.00 41.12 39.60 1wv4 n ASP 209 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1wv4 s ALA 210 N -3.50 -2.62 -0.19 2.24 0.00 -0.55 -5.15 121.76 111.97 1wv4 s ALA 210 Ca 0.33 0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.54 1wv4 s ALA 210 Cb -0.19 0.83 0.04 0.00 0.00 0.00 0.00 23.12 23.80 1wv4 s ALA 210 CO 0.85 -1.15 -0.13 -1.58 0.00 0.00 0.00 175.76 173.75 1wv4 s TRP 211 N -2.03 2.55 0.04 0.00 0.52 -1.26 -1.84 118.94 116.91 1wv4 s TRP 211 Ca 0.28 -1.63 -0.27 0.00 0.02 0.00 0.00 56.10 54.51 1wv4 s TRP 211 Cb 0.01 -1.72 -0.05 0.00 -1.15 0.00 0.00 33.47 30.56 1wv4 s TRP 211 CO -0.03 -0.76 0.83 0.21 0.02 0.00 0.00 176.95 177.23 1wv4 s LYS 212 N 1.36 4.55 -0.06 4.98 2.20 -0.06 -4.87 119.74 127.83 1wv4 s LYS 212 Ca 0.00 1.18 0.06 0.00 -0.36 0.00 0.00 55.97 56.85 1wv4 s LYS 212 Cb -0.15 -3.39 -0.01 0.00 -1.51 0.00 0.00 37.83 32.77 1wv4 s LYS 212 CO -0.09 0.20 -0.24 0.42 -0.36 0.00 0.00 175.35 175.28 1wv4 s ILE 213 N 0.19 1.95 -0.08 5.43 1.01 -1.26 -0.85 121.20 127.59 1wv4 s ILE 213 Ca 0.42 -1.00 -0.07 0.00 0.00 0.00 0.00 60.65 60.01 1wv4 s ILE 213 Cb -0.21 -1.65 0.02 0.00 0.01 0.00 0.00 42.46 40.63 1wv4 s ILE 213 CO 0.25 0.54 0.20 -1.81 0.00 0.00 0.00 174.94 174.12 1wv4 s ASP 214 N -0.06 -0.21 0.57 3.58 1.01 -1.01 -4.99 116.67 115.56 1wv4 s ASP 214 Ca -0.06 0.41 -0.15 0.00 0.71 0.00 0.00 52.55 53.46 1wv4 s ASP 214 Cb -0.14 0.40 -0.05 0.00 1.01 0.00 0.00 42.92 44.14 1wv4 s ASP 214 CO 0.04 -0.08 1.03 -0.60 0.21 0.00 0.00 175.17 175.77 1wv4 s ARG 215 N 0.27 3.55 0.24 8.23 3.52 -1.26 -1.98 118.95 131.51 1wv4 s ARG 215 Ca -0.01 1.06 0.08 0.00 -0.13 0.00 0.00 55.73 56.73 1wv4 s ARG 215 Cb -0.03 -2.07 -0.05 0.00 -1.56 0.00 0.00 34.95 31.24 1wv4 s ARG 215 CO -0.01 -0.61 -0.14 -0.51 -0.81 0.00 0.00 175.30 173.22 1wv4 s LEU 216 N -4.47 2.55 0.53 -0.88 1.43 0.01 -4.90 118.68 112.95 1wv4 s LEU 216 Ca 0.61 -1.06 -0.16 0.00 -1.03 0.00 0.00 54.13 52.48 1wv4 s LEU 216 Cb -0.13 -0.76 -0.07 0.00 0.03 0.00 0.00 46.19 45.25 1wv4 s LEU 216 CO 0.37 -0.17 1.00 0.00 0.23 0.00 0.00 176.35 177.78 1wv4 s ALA 217 N -2.88 3.01 -1.67 4.21 0.00 -1.26 -4.27 121.76 118.91 1wv4 s ALA 217 Ca 0.26 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1wv4 s ALA 217 Cb -0.01 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.98 1wv4 s ALA 217 CO 0.10 -0.32 0.42 -0.35 0.00 0.00 0.00 175.76 175.60