#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh3 n ASN 3 N 0.00 0.00 -1.72 1.61 6.94 -1.26 -5.13 115.26 115.70 2wh3 n ASN 3 Ca 0.00 -0.29 -0.01 0.00 -0.02 0.00 0.00 54.58 54.26 2wh3 n ASN 3 Cb 0.00 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.41 2wh3 n ASN 3 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2wh3 n LYS 4 N 0.00 -1.71 -0.65 -3.83 5.02 -1.26 -5.02 118.16 110.71 2wh3 n LYS 4 Ca 0.00 1.59 -0.28 0.00 -2.02 0.00 0.00 58.31 57.60 2wh3 n LYS 4 Cb 0.00 -2.26 0.25 0.00 -0.02 0.00 0.00 35.03 33.00 2wh3 n LYS 4 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2wh3 s ILE 5 N -0.22 1.97 -0.46 -0.18 -5.25 -1.26 -4.91 121.20 110.89 2wh3 s ILE 5 Ca -0.06 0.00 -0.29 0.00 -0.99 0.00 0.00 60.65 59.31 2wh3 s ILE 5 Cb 0.00 -2.14 0.02 0.00 2.95 0.00 0.00 42.46 43.30 2wh3 s ILE 5 CO 0.17 0.00 1.25 -2.28 -1.79 0.00 0.00 174.94 172.29 2wh3 s HIS 6 N -2.54 2.63 0.48 1.37 5.65 -1.26 -4.87 115.29 116.75 2wh3 s HIS 6 Ca 0.68 0.68 0.36 0.00 0.25 0.00 0.00 55.06 57.03 2wh3 s HIS 6 Cb -0.24 -4.40 1.51 0.00 -1.18 0.00 0.00 32.58 28.27 2wh3 s HIS 6 CO 0.63 -1.58 1.64 -1.00 -0.65 0.00 0.00 174.74 173.79 2wh3 h PRO 7 N 9.86 0.07 0.12 2.88 0.13 -1.94 0.29 132.00 143.42 2wh3 h PRO 7 Ca -0.25 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 2wh3 h PRO 7 Cb 1.08 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2wh3 h PRO 7 CO 1.12 0.04 -0.06 0.82 -0.23 0.00 0.00 178.00 179.69 2wh3 h ILE 8 N 0.07 0.00 0.00 -3.56 1.08 -1.89 -2.34 117.51 110.87 2wh3 h ILE 8 Ca 0.81 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 65.22 2wh3 h ILE 8 Cb 2.79 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 36.54 2wh3 h ILE 8 CO -0.25 0.00 0.18 1.23 -0.69 0.00 0.00 178.15 178.62 2wh3 h GLY 9 N -0.23 0.00 1.36 5.37 0.00 -1.47 0.13 103.07 108.23 2wh3 h GLY 9 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.04 2wh3 h GLY 9 CO 0.03 0.00 -1.15 -2.75 0.00 0.00 0.00 176.54 172.67 2wh3 h PHE 10 N 0.00 0.86 -0.12 5.60 3.57 -0.40 -3.23 116.94 123.22 2wh3 h PHE 10 Ca 0.00 -0.53 0.00 0.00 3.53 0.00 0.00 57.97 60.97 2wh3 h PHE 10 Cb 0.36 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.02 2wh3 h PHE 10 CO 0.00 1.37 0.00 0.54 -2.23 0.00 0.00 178.31 177.99 2wh3 n ARG 11 N -3.76 1.94 0.24 1.11 5.12 0.36 -4.59 116.66 117.07 2wh3 n ARG 11 Ca -0.11 -1.38 0.05 0.00 -1.93 0.00 0.00 57.85 54.48 2wh3 n ARG 11 Cb 0.94 -1.46 0.10 0.00 -1.16 0.00 0.00 32.46 30.89 2wh3 n ARG 11 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2wh3 h LEU 12 N 3.08 0.00 0.00 0.55 7.12 -1.28 0.62 115.31 125.40 2wh3 h LEU 12 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 2wh3 h LEU 12 Cb 0.66 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.79 2wh3 h LEU 12 CO 0.00 0.00 -1.33 0.61 -0.13 0.00 0.00 178.44 177.59 2wh3 n GLY 13 N -1.53 -0.71 3.61 3.75 0.00 -1.26 -4.51 105.19 104.53 2wh3 n GLY 13 Ca 0.04 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 2wh3 n GLY 13 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wh3 s ILE 14 N -2.93 0.00 0.00 -0.61 2.07 0.22 -4.96 121.20 114.99 2wh3 s ILE 14 Ca -0.00 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 2wh3 s ILE 14 Cb 0.12 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.71 2wh3 s ILE 14 CO 0.72 0.00 0.00 0.41 -1.91 0.00 0.00 174.94 174.16 2wh3 n THR 15 N 1.62 0.00 0.00 4.00 -1.04 -1.26 -4.55 114.28 113.05 2wh3 n THR 15 Ca -0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2wh3 n THR 15 Cb 0.57 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.86 2wh3 n THR 15 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2wh3 n ARG 16 N -2.89 0.00 -4.49 -2.82 3.00 -1.26 -4.28 116.66 103.93 2wh3 n ARG 16 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.61 2wh3 n ARG 16 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.36 2wh3 n ARG 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2wh3 s ASP 17 N 0.00 3.48 0.04 6.15 -0.00 -1.26 -4.24 116.67 120.84 2wh3 s ASP 17 Ca 0.00 -1.12 -0.37 0.00 -0.00 0.00 0.00 52.55 51.05 2wh3 s ASP 17 Cb 0.00 -0.29 -0.19 0.00 -0.00 0.00 0.00 42.92 42.43 2wh3 s ASP 17 CO 0.00 -0.13 0.97 0.79 -0.00 0.00 0.00 175.17 176.80 2wh3 n TRP 18 N -0.67 0.45 0.13 4.23 8.01 -1.26 -4.80 117.44 123.53 2wh3 n TRP 18 Ca -0.05 1.02 -0.03 0.00 -1.31 0.00 0.00 57.50 57.13 2wh3 n TRP 18 Cb 0.62 -2.07 0.13 0.00 -2.01 0.00 0.00 31.31 27.98 2wh3 n TRP 18 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.69 174.77 2wh3 n GLU 19 N 1.43 2.18 0.00 -0.99 2.13 -1.26 -4.41 120.64 119.71 2wh3 n GLU 19 Ca 0.19 -1.32 0.00 0.00 0.66 0.00 0.00 57.16 56.70 2wh3 n GLU 19 Cb 0.12 -1.69 0.00 0.00 0.27 0.00 0.00 31.44 30.14 2wh3 n GLU 19 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2wh3 n SER 20 N 0.06 0.00 -4.35 4.31 2.88 -1.26 -3.88 113.62 111.38 2wh3 n SER 20 Ca 0.18 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.38 2wh3 n SER 20 Cb 0.81 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 64.13 2wh3 n SER 20 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wh3 s ARG 21 N 0.00 3.41 0.01 -1.46 1.70 -0.90 -4.94 118.95 116.76 2wh3 s ARG 21 Ca 0.00 -0.64 -0.29 0.00 -0.47 0.00 0.00 55.73 54.33 2wh3 s ARG 21 Cb 0.00 -2.83 0.11 0.00 -0.57 0.00 0.00 34.95 31.66 2wh3 s ARG 21 CO 0.00 0.02 1.25 1.67 -1.08 0.00 0.00 175.30 177.17 2wh3 s TRP 22 N 0.88 -0.03 0.25 5.89 1.48 -1.26 -3.87 118.94 122.28 2wh3 s TRP 22 Ca -0.02 -0.10 0.07 0.00 -1.06 0.00 0.00 56.10 54.99 2wh3 s TRP 22 Cb -0.15 0.56 -0.04 0.00 -1.16 0.00 0.00 33.47 32.69 2wh3 s TRP 22 CO 0.01 -0.34 0.19 -0.47 -4.06 0.00 0.00 176.95 172.27 2wh3 s TYR 23 N -2.39 3.10 -0.28 1.66 5.04 -1.26 -5.03 117.35 118.18 2wh3 s TYR 23 Ca 0.17 -0.11 -0.18 0.00 -2.44 0.00 0.00 57.07 54.51 2wh3 s TYR 23 Cb 0.03 -1.39 0.10 0.00 0.35 0.00 0.00 41.96 41.05 2wh3 s TYR 23 CO -0.02 0.52 0.82 0.00 -1.34 0.00 0.00 175.55 175.53 2wh3 s ALA 24 N -2.14 -2.01 0.95 3.97 0.00 -1.26 -4.96 121.76 116.31 2wh3 s ALA 24 Ca 0.33 2.26 -0.15 0.00 0.00 0.00 0.00 51.96 54.40 2wh3 s ALA 24 Cb -0.08 -1.50 0.17 0.00 0.00 0.00 0.00 23.12 21.72 2wh3 s ALA 24 CO 0.25 -0.35 1.22 0.20 0.00 0.00 0.00 175.76 177.08 2wh3 s GLY 25 N 1.27 1.67 0.00 0.00 0.00 -1.26 -4.64 107.32 104.35 2wh3 s GLY 25 Ca -0.07 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.75 2wh3 s GLY 25 CO -0.15 -0.22 0.49 0.58 0.00 0.00 0.00 173.10 173.80 2wh3 n LYS 26 N -3.79 0.78 0.00 2.90 2.85 -1.26 -1.68 118.16 117.96 2wh3 n LYS 26 Ca 0.11 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.37 2wh3 n LYS 26 Cb 0.60 -1.32 0.00 0.00 -0.65 0.00 0.00 35.03 33.66 2wh3 n LYS 26 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2wh3 n LYS 27 N 0.24 4.24 0.00 -1.58 5.02 -1.26 -4.87 118.16 119.95 2wh3 n LYS 27 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2wh3 n LYS 27 Cb 0.24 -0.64 0.00 0.00 -0.02 0.00 0.00 35.03 34.61 2wh3 n LYS 27 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2wh3 n GLN 28 N -1.08 4.17 -0.31 1.97 6.02 -1.03 -4.86 117.38 122.25 2wh3 n GLN 28 Ca 0.00 0.00 0.28 0.00 -0.01 0.00 0.00 57.00 57.27 2wh3 n GLN 28 Cb 0.00 -0.40 0.47 0.00 1.02 0.00 0.00 30.24 31.33 2wh3 n GLN 28 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 2wh3 n TYR 29 N -0.07 0.61 0.38 1.08 9.36 -0.67 -0.09 117.16 127.75 2wh3 n TYR 29 Ca 0.00 0.61 -0.15 0.00 3.32 0.00 0.00 57.90 61.68 2wh3 n TYR 29 Cb 0.00 -1.02 -0.07 0.00 -0.63 0.00 0.00 39.34 37.62 2wh3 n TYR 29 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 2wh3 h ARG 30 N 0.00 -0.93 -0.80 2.98 2.43 -1.89 -0.07 114.38 116.10 2wh3 h ARG 30 Ca 0.63 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.96 2wh3 h ARG 30 Cb 1.94 0.21 -0.07 0.00 -0.42 0.00 0.00 29.97 31.63 2wh3 h ARG 30 CO -0.40 -0.62 0.45 0.45 -1.51 0.00 0.00 179.97 178.34 2wh3 h HIS 31 N -1.05 0.82 -0.46 2.20 -0.00 -0.86 -1.30 115.15 114.49 2wh3 h HIS 31 Ca -0.10 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.20 2wh3 h HIS 31 Cb 0.74 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.89 2wh3 h HIS 31 CO 0.04 0.34 -0.10 -0.07 -0.00 0.00 0.00 177.93 178.14 2wh3 h LEU 32 N 0.77 0.89 -0.89 2.43 3.38 -1.44 -0.53 115.31 119.91 2wh3 h LEU 32 Ca 0.39 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2wh3 h LEU 32 Cb 0.35 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2wh3 h LEU 32 CO -0.24 1.04 0.58 0.25 0.09 0.00 0.00 178.44 180.15 2wh3 h LEU 33 N 0.73 0.97 0.27 1.67 5.85 -0.23 0.17 115.31 124.74 2wh3 h LEU 33 Ca 0.12 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2wh3 h LEU 33 Cb 0.64 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.45 2wh3 h LEU 33 CO 0.04 0.67 -0.13 0.25 -0.34 0.00 0.00 178.44 178.94 2wh3 h LEU 34 N 1.13 -0.31 -0.32 2.25 6.46 -1.06 -2.56 115.31 120.90 2wh3 h LEU 34 Ca 0.35 -0.11 0.03 0.00 -0.12 0.00 0.00 57.88 58.04 2wh3 h LEU 34 Cb -0.02 0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 39.93 2wh3 h LEU 34 CO -0.11 -0.08 -0.33 -0.08 -0.62 0.00 0.00 178.44 177.23 2wh3 h GLU 35 N -0.54 -0.17 -1.00 1.25 4.81 -0.31 0.30 114.58 118.93 2wh3 h GLU 35 Ca -0.04 0.01 0.35 0.00 -0.13 0.00 0.00 59.36 59.56 2wh3 h GLU 35 Cb 0.40 0.04 -0.16 0.00 0.63 0.00 0.00 28.75 29.66 2wh3 h GLU 35 CO 0.06 -0.11 0.56 -0.44 -0.73 0.00 0.00 179.01 178.36 2wh3 h ASP 36 N -0.17 0.46 0.12 1.04 3.45 -0.99 -1.08 116.42 119.25 2wh3 h ASP 36 Ca 0.05 0.21 -0.01 0.00 0.43 0.00 0.00 57.03 57.72 2wh3 h ASP 36 Cb 0.32 0.17 0.00 0.00 -0.56 0.00 0.00 39.33 39.26 2wh3 h ASP 36 CO -0.39 -0.22 -0.06 1.56 -1.57 0.00 0.00 179.24 178.56 2wh3 h GLN 37 N 0.23 -0.15 -1.07 3.56 1.08 -0.02 -2.21 115.11 116.53 2wh3 h GLN 37 Ca 0.77 0.01 0.29 0.00 -1.45 0.00 0.00 58.65 58.27 2wh3 h GLN 37 Cb 1.85 0.03 -0.07 0.00 -0.05 0.00 0.00 27.48 29.24 2wh3 h GLN 37 CO -0.65 -0.10 0.73 0.07 -0.95 0.00 0.00 178.83 177.93 2wh3 h ARG 38 N -0.17 0.20 0.59 1.46 0.11 -0.51 0.15 114.38 116.20 2wh3 h ARG 38 Ca -0.02 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 60.03 2wh3 h ARG 38 Cb 0.12 -0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.16 2wh3 h ARG 38 CO 0.03 0.13 -0.35 0.82 0.10 0.00 0.00 179.97 180.69 2wh3 h ILE 39 N 0.20 0.00 -1.03 0.08 2.04 -1.14 -1.47 117.51 116.19 2wh3 h ILE 39 Ca 0.56 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.69 2wh3 h ILE 39 Cb 1.80 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.80 2wh3 h ILE 39 CO -0.15 0.00 0.69 0.03 0.00 0.00 0.00 178.15 178.71 2wh3 h ARG 40 N -0.88 0.28 0.00 2.37 3.08 -0.15 -1.52 114.38 117.56 2wh3 h ARG 40 Ca -0.08 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2wh3 h ARG 40 Cb 0.70 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2wh3 h ARG 40 CO 0.08 0.18 0.00 0.41 -1.07 0.00 0.00 179.97 179.58 2wh3 n GLY 41 N -1.56 -2.79 0.41 0.04 0.00 -0.10 -0.11 105.19 101.09 2wh3 n GLY 41 Ca 0.24 0.09 0.24 0.00 0.00 0.00 0.00 46.02 46.59 2wh3 n GLY 41 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2wh3 h LEU 42 N 0.00 0.42 -0.26 0.99 5.85 -1.02 0.72 115.31 122.01 2wh3 h LEU 42 Ca 0.00 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 2wh3 h LEU 42 Cb 0.00 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2wh3 h LEU 42 CO 0.00 0.07 0.03 -0.07 -0.34 0.00 0.00 178.44 178.13 2wh3 h LEU 43 N 0.37 0.43 0.00 2.25 3.38 -1.16 -0.92 115.31 119.66 2wh3 h LEU 43 Ca 0.60 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2wh3 h LEU 43 Cb 1.57 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.21 2wh3 h LEU 43 CO -0.30 0.60 0.00 -0.62 0.09 0.00 0.00 178.44 178.21 2wh3 n GLU 44 N -4.65 0.03 0.00 1.13 1.02 0.85 -3.11 120.64 115.91 2wh3 n GLU 44 Ca -0.03 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 2wh3 n GLU 44 Cb 0.22 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 2wh3 n GLU 44 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2wh3 n LYS 45 N -1.46 0.00 -0.74 3.49 5.02 -0.47 -4.47 118.16 119.54 2wh3 n LYS 45 Ca 0.03 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.12 2wh3 n LYS 45 Cb 0.12 -0.19 -0.03 0.00 -0.02 0.00 0.00 35.03 34.91 2wh3 n LYS 45 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2wh3 n GLU 46 N -0.40 2.03 -0.22 1.97 1.02 -0.53 -3.20 120.64 121.31 2wh3 n GLU 46 Ca 0.00 -1.37 -0.00 0.00 -0.02 0.00 0.00 57.16 55.77 2wh3 n GLU 46 Cb 0.00 -2.37 -0.00 0.00 -0.02 0.00 0.00 31.44 29.04 2wh3 n GLU 46 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2wh3 n LEU 47 N 3.97 -0.04 0.08 -4.62 7.94 -1.18 -4.92 117.00 118.22 2wh3 n LEU 47 Ca 0.43 -0.33 -0.01 0.00 -1.11 0.00 0.00 56.01 55.00 2wh3 n LEU 47 Cb 0.19 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.09 2wh3 n LEU 47 CO 0.64 0.67 0.06 0.22 -1.11 0.00 0.00 177.39 177.87 2wh3 h TYR 48 N 0.00 0.00 -0.69 1.96 3.20 -1.77 -3.00 116.97 116.68 2wh3 h TYR 48 Ca -0.02 0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.03 2wh3 h TYR 48 Cb 0.36 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 2wh3 h TYR 48 CO -0.08 0.63 0.48 0.77 -1.64 0.00 0.00 178.16 178.33 2wh3 h SER 49 N 0.00 0.12 -0.00 -2.11 0.02 -1.94 0.57 113.55 110.21 2wh3 h SER 49 Ca -0.09 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2wh3 h SER 49 Cb 1.56 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.08 2wh3 h SER 49 CO 0.07 0.06 -0.93 0.00 -1.14 0.00 0.00 176.83 174.89 2wh3 n ALA 50 N -2.62 4.57 -3.02 3.77 0.00 -1.24 -5.06 120.51 116.91 2wh3 n ALA 50 Ca 0.13 -0.57 -0.01 0.00 0.00 0.00 0.00 53.44 53.00 2wh3 n ALA 50 Cb 0.68 -0.72 -0.01 0.00 0.00 0.00 0.00 19.45 19.40 2wh3 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wh3 n GLY 51 N 1.47 -0.85 0.00 0.00 0.00 0.20 -4.02 105.19 101.98 2wh3 n GLY 51 Ca 0.04 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.33 2wh3 n GLY 51 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2wh3 n LEU 52 N 2.25 0.00 0.00 0.99 -0.00 -1.26 -4.13 117.00 114.86 2wh3 n LEU 52 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.95 2wh3 n LEU 52 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.57 2wh3 n LEU 52 CO 0.07 -0.26 0.00 0.00 -0.00 0.00 0.00 177.39 177.20 2wh3 n ALA 53 N -3.00 0.00 -3.58 1.47 0.00 -1.21 -4.68 120.51 109.51 2wh3 n ALA 53 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2wh3 n ALA 53 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2wh3 n ALA 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2wh3 s ARG 54 N 0.00 0.41 -0.45 0.00 3.52 -1.25 -4.85 118.95 116.33 2wh3 s ARG 54 Ca 0.00 -0.14 0.06 0.00 -0.13 0.00 0.00 55.73 55.52 2wh3 s ARG 54 Cb 0.00 0.19 0.19 0.00 -1.56 0.00 0.00 34.95 33.77 2wh3 s ARG 54 CO 0.00 -0.18 0.52 0.28 -0.81 0.00 0.00 175.30 175.12 2wh3 n VAL 55 N -0.08 -0.69 -1.67 7.11 0.31 -1.26 -2.78 118.33 119.28 2wh3 n VAL 55 Ca -0.02 -2.57 -0.33 0.00 -0.01 0.00 0.00 64.34 61.42 2wh3 n VAL 55 Cb 0.59 -0.60 0.06 0.00 -0.91 0.00 0.00 33.84 32.97 2wh3 n VAL 55 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wh3 s ASP 56 N 0.06 4.95 -0.18 4.52 2.15 -1.22 -4.80 116.67 122.15 2wh3 s ASP 56 Ca 0.32 2.01 -0.07 0.00 0.43 0.00 0.00 52.55 55.25 2wh3 s ASP 56 Cb 0.05 -2.55 0.08 0.00 -0.30 0.00 0.00 42.92 40.20 2wh3 s ASP 56 CO -0.15 -1.74 0.37 -0.63 -0.17 0.00 0.00 175.17 172.86 2wh3 s ILE 57 N -2.37 -0.51 0.37 4.11 1.01 -1.25 -1.88 121.20 120.68 2wh3 s ILE 57 Ca 0.67 0.19 0.08 0.00 0.00 0.00 0.00 60.65 61.59 2wh3 s ILE 57 Cb -0.21 -0.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 2wh3 s ILE 57 CO 0.43 0.08 0.18 -1.61 0.00 0.00 0.00 174.94 174.02 2wh3 s GLU 58 N 2.40 2.33 0.24 2.79 2.02 -1.26 -2.13 118.70 125.09 2wh3 s GLU 58 Ca -0.02 -1.65 -0.22 0.00 0.02 0.00 0.00 54.97 53.10 2wh3 s GLU 58 Cb -0.12 -2.13 0.03 0.00 0.10 0.00 0.00 34.13 32.02 2wh3 s GLU 58 CO -0.12 0.00 0.80 1.03 0.02 0.00 0.00 175.26 177.00 2wh3 s ARG 59 N -3.89 1.59 0.00 1.61 0.52 -1.25 -2.30 118.95 115.23 2wh3 s ARG 59 Ca 0.40 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.72 2wh3 s ARG 59 Cb -0.00 0.54 0.00 0.00 0.52 0.00 0.00 34.95 36.01 2wh3 s ARG 59 CO 0.23 -0.73 0.00 0.00 0.02 0.00 0.00 175.30 174.82 2wh3 n ALA 60 N -0.47 0.00 0.00 2.13 0.00 -1.26 -4.69 120.51 116.22 2wh3 n ALA 60 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2wh3 n ALA 60 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2wh3 n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wh3 n ALA 61 N 0.00 0.00 -3.99 0.00 0.00 -1.26 -5.00 120.51 110.26 2wh3 n ALA 61 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2wh3 n ALA 61 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2wh3 n ALA 61 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wh3 n ASP 62 N 0.00 -1.59 -4.22 0.00 9.92 -1.26 -4.98 116.55 114.42 2wh3 n ASP 62 Ca 0.00 -0.97 -0.23 0.00 -0.53 0.00 0.00 54.79 53.07 2wh3 n ASP 62 Cb 0.00 -3.16 -0.09 0.00 -0.64 0.00 0.00 41.12 37.22 2wh3 n ASP 62 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2wh3 s ASN 63 N -4.00 2.35 -0.20 -2.24 4.22 -1.26 -3.31 114.94 110.50 2wh3 s ASN 63 Ca 0.25 -1.54 -0.08 0.00 -2.14 0.00 0.00 52.86 49.34 2wh3 s ASN 63 Cb -0.13 0.29 0.08 0.00 1.28 0.00 0.00 41.25 42.76 2wh3 s ASN 63 CO 0.88 -0.81 0.44 -0.69 -2.04 0.00 0.00 177.10 174.88 2wh3 s VAL 64 N -3.34 -0.43 -0.02 3.54 1.01 -0.95 -4.60 120.40 115.62 2wh3 s VAL 64 Ca 0.30 0.13 -0.17 0.00 0.00 0.00 0.00 61.98 62.24 2wh3 s VAL 64 Cb 0.05 -0.67 -0.09 0.00 0.00 0.00 0.00 36.38 35.66 2wh3 s VAL 64 CO 0.15 0.05 0.77 0.00 0.00 0.00 0.00 175.10 176.07 2wh3 h ALA 65 N 7.77 -0.68 -4.05 5.51 0.00 -1.77 -3.15 119.26 122.89 2wh3 h ALA 65 Ca -0.23 -0.14 -0.36 0.00 0.00 0.00 0.00 54.91 54.18 2wh3 h ALA 65 Cb 1.14 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2wh3 h ALA 65 CO 0.18 -0.63 -0.49 0.28 0.00 0.00 0.00 179.25 178.58 2wh3 n VAL 66 N -4.87 -1.14 -1.32 0.00 0.31 -1.16 -3.29 118.33 106.85 2wh3 n VAL 66 Ca -0.08 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.89 2wh3 n VAL 66 Cb 0.24 -2.56 -0.08 0.00 -0.91 0.00 0.00 33.84 30.54 2wh3 n VAL 66 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2wh3 n THR 67 N -3.95 1.32 -1.82 2.52 -1.04 -0.79 -3.29 114.28 107.23 2wh3 n THR 67 Ca -0.14 -1.24 -0.27 0.00 -2.04 0.00 0.00 64.05 60.35 2wh3 n THR 67 Cb 0.62 -2.19 -0.05 0.00 -1.82 0.00 0.00 70.33 66.90 2wh3 n THR 67 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2wh3 s VAL 68 N 8.31 3.22 0.22 12.58 1.01 -1.24 -3.40 120.40 141.12 2wh3 s VAL 68 Ca 0.65 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 62.25 2wh3 s VAL 68 Cb 0.08 -3.53 -0.09 0.00 0.00 0.00 0.00 36.38 32.84 2wh3 s VAL 68 CO 0.18 -0.51 1.37 -1.00 0.00 0.00 0.00 175.10 175.14 2wh3 s HIS 69 N 11.59 3.14 0.30 5.22 3.76 -1.12 -3.39 115.29 134.78 2wh3 s HIS 69 Ca 0.81 1.13 0.04 0.00 -0.15 0.00 0.00 55.06 56.88 2wh3 s HIS 69 Cb -0.12 -3.71 -0.03 0.00 1.11 0.00 0.00 32.58 29.83 2wh3 s HIS 69 CO 0.11 -2.26 0.19 0.08 -0.85 0.00 0.00 174.74 172.01 2wh3 s VAL 70 N 0.04 0.16 -0.01 -0.90 1.01 -1.17 -3.35 120.40 116.17 2wh3 s VAL 70 Ca 0.58 -2.00 0.02 0.00 0.00 0.00 0.00 61.98 60.58 2wh3 s VAL 70 Cb -0.39 -2.50 0.03 0.00 0.00 0.00 0.00 36.38 33.52 2wh3 s VAL 70 CO 0.41 0.00 0.90 0.00 0.00 0.00 0.00 175.10 176.41 2wh3 n ALA 71 N -0.55 1.79 -2.71 5.51 0.00 -1.26 -1.75 120.51 121.54 2wh3 n ALA 71 Ca 0.03 -1.03 -0.07 0.00 0.00 0.00 0.00 53.44 52.37 2wh3 n ALA 71 Cb 0.64 -0.05 0.10 0.00 0.00 0.00 0.00 19.45 20.14 2wh3 n ALA 71 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wh3 n LYS 72 N -0.45 0.83 0.25 0.00 4.81 -1.26 -4.82 118.16 117.52 2wh3 n LYS 72 Ca 0.01 -1.64 0.14 0.00 -0.87 0.00 0.00 58.31 55.96 2wh3 n LYS 72 Cb 0.36 -0.74 0.80 0.00 0.02 0.00 0.00 35.03 35.47 2wh3 n LYS 72 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 2wh3 h PRO 73 N 2.70 0.00 0.00 1.64 0.13 -1.86 -2.40 132.00 132.21 2wh3 h PRO 73 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 2wh3 h PRO 73 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2wh3 h PRO 73 CO 0.08 0.00 0.07 0.41 -0.23 0.00 0.00 178.00 178.33 2wh3 n GLY 74 N -1.42 -0.55 0.12 1.56 0.00 -1.26 -1.81 105.19 101.83 2wh3 n GLY 74 Ca -0.01 0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 2wh3 n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wh3 n VAL 75 N -1.68 1.34 0.24 1.61 0.31 -0.90 -3.04 118.33 116.21 2wh3 n VAL 75 Ca -0.00 -0.51 0.15 0.00 -0.01 0.00 0.00 64.34 63.97 2wh3 n VAL 75 Cb 0.08 -1.34 0.81 0.00 -0.91 0.00 0.00 33.84 32.47 2wh3 n VAL 75 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 2wh3 h VAL 76 N -0.03 0.00 0.00 2.52 -1.51 -1.46 -2.78 116.25 112.99 2wh3 h VAL 76 Ca -0.53 -0.02 -0.37 0.00 -1.23 0.00 0.00 66.70 64.55 2wh3 h VAL 76 Cb 1.80 0.71 -0.06 0.00 -2.13 0.00 0.00 31.29 31.61 2wh3 h VAL 76 CO -0.09 0.00 -2.35 -0.38 -1.23 0.00 0.00 177.57 173.52 2wh3 n ILE 77 N -2.56 1.34 0.00 7.19 5.41 -1.04 -2.19 119.36 127.51 2wh3 n ILE 77 Ca -0.02 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.29 2wh3 n ILE 77 Cb 0.06 -1.52 0.00 0.00 -0.71 0.00 0.00 39.64 37.47 2wh3 n ILE 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wh3 n GLY 78 N 2.03 0.92 2.59 7.39 0.00 -1.05 -0.67 105.19 116.40 2wh3 n GLY 78 Ca -0.44 -1.04 -0.23 0.00 0.00 0.00 0.00 46.02 44.32 2wh3 n GLY 78 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2wh3 n ARG 79 N 0.00 2.18 0.00 1.61 1.85 -1.26 -4.74 116.66 116.30 2wh3 n ARG 79 Ca 0.00 -4.17 0.00 0.00 -1.00 0.00 0.00 57.85 52.68 2wh3 n ARG 79 Cb 0.00 -1.99 0.00 0.00 -1.05 0.00 0.00 32.46 29.42 2wh3 n ARG 79 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wh3 n GLY 80 N -0.01 2.84 0.00 2.89 0.00 -1.26 -4.83 105.19 104.81 2wh3 n GLY 80 Ca 0.28 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2wh3 n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wh3 n GLY 81 N 0.00 0.00 0.20 -0.02 0.00 -1.26 -5.07 105.19 99.04 2wh3 n GLY 81 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2wh3 n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wh3 n GLU 82 N 0.00 0.55 0.21 1.61 4.71 -1.16 -3.75 120.64 122.82 2wh3 n GLU 82 Ca 0.00 0.23 -0.15 0.00 -0.01 0.00 0.00 57.16 57.24 2wh3 n GLU 82 Cb 0.00 -1.42 -0.08 0.00 -1.01 0.00 0.00 31.44 28.93 2wh3 n GLU 82 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 2wh3 h ARG 83 N -0.86 -0.50 -0.26 3.49 9.65 -1.15 0.78 114.38 125.53 2wh3 h ARG 83 Ca -0.65 0.03 0.07 0.00 -1.10 0.00 0.00 59.98 58.34 2wh3 h ARG 83 Cb 1.59 0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 30.28 2wh3 h ARG 83 CO -0.38 -0.33 0.22 0.97 2.80 0.00 0.00 179.97 183.25 2wh3 h ILE 84 N -0.52 0.64 0.11 1.20 2.10 -1.42 -0.36 117.51 119.26 2wh3 h ILE 84 Ca -0.04 0.00 -0.30 0.00 1.08 0.00 0.00 64.86 65.60 2wh3 h ILE 84 Cb 0.43 0.83 -0.01 0.00 -1.09 0.00 0.00 36.82 36.98 2wh3 h ILE 84 CO 0.04 0.00 -1.50 -0.09 -1.08 0.00 0.00 178.15 175.52 2wh3 h ARG 85 N 0.00 0.23 0.00 2.19 9.65 -1.32 -3.08 114.38 122.05 2wh3 h ARG 85 Ca 0.12 -0.40 -0.11 0.00 -1.10 0.00 0.00 59.98 58.49 2wh3 h ARG 85 Cb 0.57 0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 29.28 2wh3 h ARG 85 CO -0.00 1.10 -0.51 -0.39 2.80 0.00 0.00 179.97 182.96 2wh3 h VAL 86 N 0.06 1.16 0.00 0.20 -1.51 0.18 -3.16 116.25 113.18 2wh3 h VAL 86 Ca -0.23 -1.90 -0.02 0.00 -1.23 0.00 0.00 66.70 63.32 2wh3 h VAL 86 Cb 2.00 2.09 0.00 0.00 -2.13 0.00 0.00 31.29 33.25 2wh3 h VAL 86 CO 0.16 0.50 -0.10 -0.07 -1.23 0.00 0.00 177.57 176.84 2wh3 h LEU 87 N 0.00 0.08 -1.99 4.19 3.38 -1.21 -2.76 115.31 117.00 2wh3 h LEU 87 Ca -0.01 -0.79 0.33 0.00 0.09 0.00 0.00 57.88 57.50 2wh3 h LEU 87 Cb 1.05 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 2wh3 h LEU 87 CO 0.07 0.87 0.82 0.03 0.09 0.00 0.00 178.44 180.32 2wh3 h ARG 88 N -0.69 0.01 0.35 1.13 3.08 -1.59 0.85 114.38 117.52 2wh3 h ARG 88 Ca -0.01 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 2wh3 h ARG 88 Cb 0.88 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.93 2wh3 h ARG 88 CO 0.02 0.00 -0.17 1.49 -1.07 0.00 0.00 179.97 180.24 2wh3 h GLU 89 N 0.01 -0.45 0.19 0.04 4.57 -1.48 -2.94 114.58 114.51 2wh3 h GLU 89 Ca 0.55 0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.76 2wh3 h GLU 89 Cb 2.18 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 30.87 2wh3 h GLU 89 CO -0.01 -0.20 -0.15 0.93 -1.18 0.00 0.00 179.01 178.40 2wh3 h GLU 90 N -0.65 -0.33 -0.49 1.92 4.39 0.95 -2.88 114.58 117.49 2wh3 h GLU 90 Ca -0.05 0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.77 2wh3 h GLU 90 Cb 0.47 0.07 -0.10 0.00 -0.10 0.00 0.00 28.75 29.09 2wh3 h GLU 90 CO 0.08 -0.22 -0.16 -0.07 -1.16 0.00 0.00 179.01 177.48 2wh3 h LEU 91 N -0.34 -0.57 -1.07 1.33 3.38 -1.25 0.25 115.31 117.03 2wh3 h LEU 91 Ca -0.01 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2wh3 h LEU 91 Cb 0.31 0.35 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2wh3 h LEU 91 CO -0.01 -0.20 0.00 0.00 0.09 0.00 0.00 178.44 178.32 2wh3 h ALA 92 N 1.40 1.00 0.00 1.53 0.00 -1.44 -2.86 119.26 118.88 2wh3 h ALA 92 Ca 0.24 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2wh3 h ALA 92 Cb 0.41 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2wh3 h ALA 92 CO -0.53 0.00 -0.02 0.87 0.00 0.00 0.00 179.25 179.57 2wh3 h LYS 93 N 0.00 0.00 -0.01 0.00 1.57 -0.28 -2.53 116.57 115.32 2wh3 h LYS 93 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wh3 h LYS 93 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2wh3 h LYS 93 CO 0.00 0.02 -0.15 1.47 -0.57 0.00 0.00 179.45 180.23 2wh3 n LEU 94 N -3.23 1.32 -3.59 2.94 -0.00 -1.08 -4.94 117.00 108.42 2wh3 n LEU 94 Ca -0.02 -0.82 -0.15 0.00 -0.00 0.00 0.00 56.01 55.02 2wh3 n LEU 94 Cb 0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.46 2wh3 n LEU 94 CO 0.24 0.26 -0.15 -0.89 -0.00 0.00 0.00 177.39 176.85 2wh3 s THR 95 N -1.18 -0.39 0.00 1.47 2.01 -0.95 -5.01 115.64 111.58 2wh3 s THR 95 Ca 0.09 0.15 -0.02 0.00 0.31 0.00 0.00 61.69 62.22 2wh3 s THR 95 Cb 0.08 -0.52 -0.08 0.00 0.01 0.00 0.00 72.50 71.98 2wh3 s THR 95 CO 0.21 0.01 1.99 0.61 -0.69 0.00 0.00 174.62 176.75 2wh3 n GLY 96 N 5.34 2.13 3.22 4.40 0.00 -1.26 -4.49 105.19 114.53 2wh3 n GLY 96 Ca -0.06 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.36 2wh3 n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wh3 n LYS 97 N 2.09 0.81 -2.44 1.61 5.02 -1.26 -5.03 118.16 118.96 2wh3 n LYS 97 Ca 0.14 -2.92 -0.38 0.00 -2.02 0.00 0.00 58.31 53.13 2wh3 n LYS 97 Cb 0.48 0.33 -0.03 0.00 -0.02 0.00 0.00 35.03 35.79 2wh3 n LYS 97 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2wh3 s ASN 98 N -3.72 6.26 -1.31 4.39 3.84 -1.21 -4.88 114.94 118.30 2wh3 s ASN 98 Ca 0.26 -1.67 -0.13 0.00 0.21 0.00 0.00 52.86 51.52 2wh3 s ASN 98 Cb -0.02 -2.57 -0.04 0.00 -0.55 0.00 0.00 41.25 38.06 2wh3 s ASN 98 CO 0.16 -1.74 2.36 1.33 -2.79 0.00 0.00 177.10 176.42 2wh3 n VAL 99 N 6.97 3.26 -0.38 -5.21 0.24 -1.26 -2.24 118.33 119.72 2wh3 n VAL 99 Ca 0.40 -2.45 -0.11 0.00 -2.04 0.00 0.00 64.34 60.15 2wh3 n VAL 99 Cb 0.48 -2.50 0.09 0.00 -1.47 0.00 0.00 33.84 30.45 2wh3 n VAL 99 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wh3 n ALA 100 N 5.45 -1.51 0.00 2.33 0.00 -1.19 -4.88 120.51 120.70 2wh3 n ALA 100 Ca 0.58 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2wh3 n ALA 100 Cb 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.72 2wh3 n ALA 100 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2wh3 n LEU 101 N 0.00 0.00 0.00 0.00 0.00 -1.21 -4.69 117.00 111.11 2wh3 n LEU 101 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 56.01 55.80 2wh3 n LEU 101 Cb 0.21 0.00 0.17 0.00 0.00 0.00 0.00 43.42 43.79 2wh3 n LEU 101 CO 0.14 0.00 0.74 0.59 0.00 0.00 0.00 177.39 178.86 2wh3 n ASN 102 N 0.00 0.66 -2.78 1.96 3.02 -1.21 -4.97 115.26 111.95 2wh3 n ASN 102 Ca 0.00 -1.78 -0.10 0.00 -0.03 0.00 0.00 54.58 52.68 2wh3 n ASN 102 Cb 0.00 -0.85 0.06 0.00 -0.61 0.00 0.00 39.78 38.38 2wh3 n ASN 102 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2wh3 n VAL 103 N -3.40 -0.03 -0.00 2.41 0.31 -1.26 -3.60 118.33 112.76 2wh3 n VAL 103 Ca 0.17 -1.73 -0.00 0.00 -0.01 0.00 0.00 64.34 62.76 2wh3 n VAL 103 Cb 0.58 1.29 0.00 0.00 -0.91 0.00 0.00 33.84 34.80 2wh3 n VAL 103 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wh3 n GLN 104 N 0.95 -1.90 -1.46 5.55 1.13 -1.22 -4.82 117.38 115.62 2wh3 n GLN 104 Ca 0.09 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 2wh3 n GLN 104 Cb 0.66 -0.02 0.00 0.00 0.11 0.00 0.00 30.24 30.99 2wh3 n GLN 104 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2wh3 n GLU 105 N -1.97 0.00 -3.77 -1.09 2.13 -1.24 -3.07 120.64 111.63 2wh3 n GLU 105 Ca 0.00 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.61 2wh3 n GLU 105 Cb 0.01 0.00 -0.17 0.00 0.27 0.00 0.00 31.44 31.54 2wh3 n GLU 105 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2wh3 s VAL 106 N -2.54 0.24 -0.64 6.31 1.01 -0.72 -4.59 120.40 119.47 2wh3 s VAL 106 Ca 0.00 0.19 0.20 0.00 0.00 0.00 0.00 61.98 62.37 2wh3 s VAL 106 Cb 0.00 -0.41 0.20 0.00 0.00 0.00 0.00 36.38 36.17 2wh3 s VAL 106 CO 0.00 0.23 1.62 0.00 0.00 0.00 0.00 175.10 176.95 2wh3 n GLN 107 N 5.06 0.13 -3.14 2.72 3.00 -1.26 -4.36 117.38 119.53 2wh3 n GLN 107 Ca -0.08 0.38 0.04 0.00 -0.01 0.00 0.00 57.00 57.32 2wh3 n GLN 107 Cb 0.50 -1.75 -0.00 0.00 0.00 0.00 0.00 30.24 28.99 2wh3 n GLN 107 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 2wh3 s ASN 108 N -3.83 -1.27 0.40 1.08 3.84 -1.26 -5.02 114.94 108.87 2wh3 s ASN 108 Ca 0.05 0.02 0.28 0.00 0.21 0.00 0.00 52.86 53.42 2wh3 s ASN 108 Cb 0.09 1.77 1.31 0.00 -0.55 0.00 0.00 41.25 43.87 2wh3 s ASN 108 CO 0.34 -0.22 1.85 -0.65 -2.79 0.00 0.00 177.10 175.63 2wh3 h PRO 109 N 7.58 0.00 -1.24 0.43 0.11 -1.95 -2.74 132.00 134.19 2wh3 h PRO 109 Ca -0.02 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.82 2wh3 h PRO 109 Cb 1.19 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.16 2wh3 h PRO 109 CO 0.07 0.00 0.34 0.09 -0.21 0.00 0.00 178.00 178.29 2wh3 n ASN 110 N -2.55 4.67 -0.63 -2.05 3.02 -1.26 -2.47 115.26 113.99 2wh3 n ASN 110 Ca 0.00 -2.85 -0.00 0.00 -0.03 0.00 0.00 54.58 51.70 2wh3 n ASN 110 Cb 0.18 -0.83 -0.00 0.00 -0.61 0.00 0.00 39.78 38.52 2wh3 n ASN 110 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wh3 n LEU 111 N 0.05 0.01 -3.45 3.41 4.77 -1.03 -4.35 117.00 116.40 2wh3 n LEU 111 Ca 0.27 -1.17 -0.29 0.00 -0.03 0.00 0.00 56.01 54.80 2wh3 n LEU 111 Cb 0.83 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.80 2wh3 n LEU 111 CO 0.31 0.67 -0.32 -0.55 -1.33 0.00 0.00 177.39 176.17 2wh3 s SER 112 N -0.69 2.84 0.15 -1.43 0.15 -1.03 -5.02 113.70 108.67 2wh3 s SER 112 Ca 0.03 -2.23 -0.26 0.00 0.70 0.00 0.00 55.95 54.19 2wh3 s SER 112 Cb 0.03 -0.38 -0.02 0.00 -1.71 0.00 0.00 66.02 63.94 2wh3 s SER 112 CO -0.02 -0.30 1.38 0.00 1.20 0.00 0.00 173.24 175.50 2wh3 n ALA 113 N 3.98 -0.50 -0.37 5.45 0.00 -1.26 -0.56 120.51 127.24 2wh3 n ALA 113 Ca 0.13 0.78 0.33 0.00 0.00 0.00 0.00 53.44 54.68 2wh3 n ALA 113 Cb 0.38 -0.17 0.51 0.00 0.00 0.00 0.00 19.45 20.17 2wh3 n ALA 113 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2wh3 n PRO 114 N -5.15 0.01 -0.08 0.00 -0.02 -1.26 0.41 135.00 128.90 2wh3 n PRO 114 Ca 0.03 0.88 -0.12 0.00 -2.02 0.00 0.00 63.50 62.27 2wh3 n PRO 114 Cb 0.25 -2.10 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 2wh3 n PRO 114 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wh3 n LEU 115 N -3.23 1.83 -0.35 2.45 4.77 0.28 -3.60 117.00 119.14 2wh3 n LEU 115 Ca 0.28 0.55 0.25 0.00 -0.03 0.00 0.00 56.01 57.06 2wh3 n LEU 115 Cb 1.47 -0.91 0.50 0.00 -2.33 0.00 0.00 43.42 42.15 2wh3 n LEU 115 CO 0.28 -0.17 1.18 0.58 -1.33 0.00 0.00 177.39 177.93 2wh3 h VAL 116 N -1.00 0.38 0.37 4.08 2.07 0.20 0.25 116.25 122.60 2wh3 h VAL 116 Ca -0.15 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 2wh3 h VAL 116 Cb 0.84 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2wh3 h VAL 116 CO -0.09 0.06 -0.20 0.00 0.02 0.00 0.00 177.57 177.37 2wh3 h ALA 117 N 1.72 -1.11 -0.96 1.67 0.00 -0.57 -2.67 119.26 117.34 2wh3 h ALA 117 Ca 0.69 -0.11 0.28 0.00 0.00 0.00 0.00 54.91 55.77 2wh3 h ALA 117 Cb 1.70 0.26 -0.14 0.00 0.00 0.00 0.00 17.79 19.60 2wh3 h ALA 117 CO -0.46 -1.08 0.45 1.96 0.00 0.00 0.00 179.25 180.13 2wh3 h GLN 118 N -0.53 0.31 0.13 0.00 4.20 -1.07 0.10 115.11 118.25 2wh3 h GLN 118 Ca -0.05 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.65 2wh3 h GLN 118 Cb 0.41 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.09 2wh3 h GLN 118 CO 0.07 0.20 -0.36 -0.09 -0.67 0.00 0.00 178.83 177.99 2wh3 h ARG 119 N 0.32 -0.52 -0.99 1.46 2.43 -0.99 0.74 114.38 116.83 2wh3 h ARG 119 Ca 0.65 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.91 2wh3 h ARG 119 Cb 1.40 0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 31.01 2wh3 h ARG 119 CO -0.60 -0.35 0.64 0.28 -1.51 0.00 0.00 179.97 178.43 2wh3 h VAL 120 N -0.54 1.13 -0.50 0.20 2.07 -0.96 -1.04 116.25 116.61 2wh3 h VAL 120 Ca -0.01 -0.41 0.10 0.00 0.82 0.00 0.00 66.70 67.19 2wh3 h VAL 120 Cb 0.53 -0.18 -0.10 0.00 -1.52 0.00 0.00 31.29 30.02 2wh3 h VAL 120 CO -0.17 0.22 -0.26 0.00 0.02 0.00 0.00 177.57 177.37 2wh3 h ALA 121 N 1.44 0.05 0.17 1.67 0.00 0.05 0.06 119.26 122.70 2wh3 h ALA 121 Ca 0.41 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.47 2wh3 h ALA 121 Cb 0.09 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2wh3 h ALA 121 CO -0.15 -0.61 -0.15 0.93 0.00 0.00 0.00 179.25 179.28 2wh3 h GLU 122 N -0.15 -0.29 -0.77 0.00 5.08 0.35 -2.67 114.58 116.12 2wh3 h GLU 122 Ca 0.22 0.02 0.28 0.00 -1.00 0.00 0.00 59.36 58.88 2wh3 h GLU 122 Cb 0.51 0.07 -0.14 0.00 0.50 0.00 0.00 28.75 29.68 2wh3 h GLU 122 CO -0.59 -0.20 0.27 1.04 -1.00 0.00 0.00 179.01 178.53 2wh3 n GLN 123 N -3.18 -0.05 0.22 2.33 6.02 -0.65 0.12 117.38 122.19 2wh3 n GLN 123 Ca -0.04 1.09 -0.15 0.00 -0.01 0.00 0.00 57.00 57.90 2wh3 n GLN 123 Cb 0.14 -1.88 -0.08 0.00 1.02 0.00 0.00 30.24 29.44 2wh3 n GLN 123 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2wh3 h ILE 124 N 0.00 0.64 0.00 5.09 2.04 -0.76 -0.76 117.51 123.76 2wh3 h ILE 124 Ca 0.58 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 66.36 2wh3 h ILE 124 Cb 1.44 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 2wh3 h ILE 124 CO -0.64 0.02 0.00 -0.62 0.00 0.00 0.00 178.15 176.91 2wh3 n GLU 125 N -5.28 0.06 0.00 2.37 1.02 0.32 -0.50 120.64 118.64 2wh3 n GLU 125 Ca -0.11 0.40 0.13 0.00 -0.02 0.00 0.00 57.16 57.57 2wh3 n GLU 125 Cb 0.23 -1.64 0.38 0.00 -0.02 0.00 0.00 31.44 30.38 2wh3 n GLU 125 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2wh3 n ARG 126 N -1.76 0.98 -2.87 3.49 1.74 0.52 -4.95 116.66 113.79 2wh3 n ARG 126 Ca 0.02 -0.59 -0.10 0.00 -0.77 0.00 0.00 57.85 56.40 2wh3 n ARG 126 Cb 0.12 -1.49 0.05 0.00 -1.02 0.00 0.00 32.46 30.12 2wh3 n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2wh3 n ARG 127 N -0.49 -3.88 -3.20 5.56 3.00 0.35 -5.03 116.66 112.97 2wh3 n ARG 127 Ca 0.13 0.47 -0.21 0.00 -0.01 0.00 0.00 57.85 58.23 2wh3 n ARG 127 Cb 0.36 -4.38 0.00 0.00 0.00 0.00 0.00 32.46 28.44 2wh3 n ARG 127 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2wh3 s PHE 128 N -3.19 3.19 -0.69 -1.55 0.40 -0.71 -4.98 117.98 110.44 2wh3 s PHE 128 Ca 0.08 0.05 -0.26 0.00 -0.60 0.00 0.00 56.93 56.20 2wh3 s PHE 128 Cb -0.04 -2.17 -0.08 0.00 0.51 0.00 0.00 43.02 41.25 2wh3 s PHE 128 CO 0.41 -0.20 2.20 0.00 0.70 0.00 0.00 175.22 178.33 2wh3 s ALA 129 N -2.39 1.45 0.58 5.36 0.00 -1.26 -4.77 121.76 120.73 2wh3 s ALA 129 Ca 0.47 -0.69 0.32 0.00 0.00 0.00 0.00 51.96 52.06 2wh3 s ALA 129 Cb -0.10 -4.46 1.34 0.00 0.00 0.00 0.00 23.12 19.91 2wh3 s ALA 129 CO 0.35 -4.89 1.65 0.28 0.00 0.00 0.00 175.76 173.16 2wh3 h VAL 130 N 7.44 0.21 0.05 0.00 2.07 -1.94 0.41 116.25 124.50 2wh3 h VAL 130 Ca -0.10 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 2wh3 h VAL 130 Cb 1.11 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2wh3 h VAL 130 CO 1.13 0.00 -0.02 -0.09 0.02 0.00 0.00 177.57 178.61 2wh3 h ARG 131 N 0.00 -0.06 -0.45 1.57 9.65 -1.98 -3.26 114.38 119.85 2wh3 h ARG 131 Ca 0.45 0.00 0.12 0.00 -1.10 0.00 0.00 59.98 59.46 2wh3 h ARG 131 Cb 2.24 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 30.81 2wh3 h ARG 131 CO -0.00 -0.04 0.32 0.07 2.80 0.00 0.00 179.97 183.11 2wh3 h ARG 132 N -0.21 0.04 0.00 0.20 0.11 -1.83 0.65 114.38 113.35 2wh3 h ARG 132 Ca -0.01 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2wh3 h ARG 132 Cb 0.05 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.12 2wh3 h ARG 132 CO 0.01 0.03 0.05 0.00 0.10 0.00 0.00 179.97 180.16 2wh3 h ALA 133 N 1.78 1.03 0.00 0.08 0.00 -0.29 0.64 119.26 122.50 2wh3 h ALA 133 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.71 2wh3 h ALA 133 Cb 0.79 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 2wh3 h ALA 133 CO -0.01 -0.03 -2.39 -0.89 0.00 0.00 0.00 179.25 175.93 2wh3 n ILE 134 N -2.31 1.36 -0.32 0.00 2.08 0.22 -3.18 119.36 117.21 2wh3 n ILE 134 Ca -0.02 -0.36 0.18 0.00 0.56 0.00 0.00 62.75 63.11 2wh3 n ILE 134 Cb 0.08 -1.80 0.38 0.00 -0.75 0.00 0.00 39.64 37.55 2wh3 n ILE 134 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2wh3 h LYS 135 N -0.83 0.36 0.12 0.38 1.79 0.08 -1.32 116.57 117.14 2wh3 h LYS 135 Ca -0.63 -0.02 -0.20 0.00 -2.18 0.00 0.00 60.65 57.62 2wh3 h LYS 135 Cb 1.57 -0.08 0.01 0.00 -1.58 0.00 0.00 32.23 32.15 2wh3 h LYS 135 CO -0.36 0.24 -0.96 1.96 -1.08 0.00 0.00 179.45 179.24 2wh3 h GLN 136 N 0.37 0.26 0.00 3.15 4.20 0.01 -0.98 115.11 122.12 2wh3 h GLN 136 Ca 0.64 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2wh3 h GLN 136 Cb 1.32 0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.27 2wh3 h GLN 136 CO -0.57 1.21 0.13 0.00 -0.67 0.00 0.00 178.83 178.93 2wh3 n ALA 137 N -2.78 0.84 -0.10 3.87 0.00 -0.68 -1.00 120.51 120.66 2wh3 n ALA 137 Ca -0.17 0.12 -0.20 0.00 0.00 0.00 0.00 53.44 53.19 2wh3 n ALA 137 Cb 0.82 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.19 2wh3 n ALA 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wh3 n VAL 138 N -1.98 1.10 0.00 0.00 0.31 -0.59 -4.07 118.33 113.11 2wh3 n VAL 138 Ca -0.01 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 2wh3 n VAL 138 Cb 0.15 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 2wh3 n VAL 138 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2wh3 n GLN 139 N -3.69 0.00 0.00 5.55 -0.06 -0.37 -0.67 117.38 118.14 2wh3 n GLN 139 Ca -0.38 0.46 0.00 0.00 -2.00 0.00 0.00 57.00 55.08 2wh3 n GLN 139 Cb 0.80 -1.53 0.00 0.00 -4.06 0.00 0.00 30.24 25.45 2wh3 n GLN 139 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2wh3 n ARG 140 N -1.46 0.00 -0.33 3.69 0.63 -0.17 -2.55 116.66 116.47 2wh3 n ARG 140 Ca 0.00 0.27 0.30 0.00 -0.92 0.00 0.00 57.85 57.50 2wh3 n ARG 140 Cb 0.03 -0.74 0.64 0.00 0.45 0.00 0.00 32.46 32.84 2wh3 n ARG 140 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2wh3 h VAL 141 N 0.00 0.44 0.12 5.15 2.07 -1.59 0.21 116.25 122.65 2wh3 h VAL 141 Ca 0.00 -0.06 -0.27 0.00 0.82 0.00 0.00 66.70 67.19 2wh3 h VAL 141 Cb 0.00 0.25 0.03 0.00 -1.52 0.00 0.00 31.29 30.05 2wh3 h VAL 141 CO 0.00 0.03 -1.12 0.24 0.02 0.00 0.00 177.57 176.75 2wh3 h MET 142 N 0.18 0.54 -0.33 1.57 2.86 -1.08 -3.22 114.93 115.45 2wh3 h MET 142 Ca 0.59 -0.75 -0.03 0.00 -2.06 0.00 0.00 59.70 57.46 2wh3 h MET 142 Cb 1.94 0.25 -0.02 0.00 0.06 0.00 0.00 31.60 33.83 2wh3 h MET 142 CO -0.16 1.33 0.09 1.49 1.06 0.00 0.00 176.91 180.73 2wh3 h GLU 143 N 0.11 0.48 -1.56 1.72 4.81 -0.44 -2.01 114.58 117.69 2wh3 h GLU 143 Ca -0.17 -0.07 -0.58 0.00 -0.13 0.00 0.00 59.36 58.41 2wh3 h GLU 143 Cb 1.82 -0.09 -0.23 0.00 0.63 0.00 0.00 28.75 30.89 2wh3 h GLU 143 CO 0.21 0.43 0.72 -1.13 -0.73 0.00 0.00 179.01 178.52 2wh3 n SER 144 N -4.37 7.14 -1.93 1.04 3.41 0.35 -4.98 113.62 114.28 2wh3 n SER 144 Ca 0.02 -3.51 0.00 0.00 -0.26 0.00 0.00 58.87 55.11 2wh3 n SER 144 Cb 0.17 -1.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 2wh3 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wh3 n GLY 145 N -0.17 -4.15 0.00 5.00 0.00 -0.76 -4.94 105.19 100.17 2wh3 n GLY 145 Ca 0.50 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2wh3 n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wh3 n ALA 146 N 1.29 0.00 1.05 4.61 0.00 -1.25 -4.77 120.51 121.44 2wh3 n ALA 146 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wh3 n ALA 146 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 2wh3 n ALA 146 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wh3 n LYS 147 N 0.00 0.52 0.00 0.00 4.76 -1.05 -4.75 118.16 117.64 2wh3 n LYS 147 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2wh3 n LYS 147 Cb 0.00 -1.03 0.00 0.00 -1.84 0.00 0.00 35.03 32.16 2wh3 n LYS 147 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wh3 n GLY 148 N 0.03 2.29 3.33 0.72 0.00 -1.23 -0.66 105.19 109.67 2wh3 n GLY 148 Ca 0.01 0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 2wh3 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wh3 s ALA 149 N -0.44 1.82 0.00 4.61 0.00 0.01 -0.17 121.76 127.59 2wh3 s ALA 149 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.17 2wh3 s ALA 149 Cb 0.00 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.70 2wh3 s ALA 149 CO 0.00 -0.29 0.00 1.17 0.00 0.00 0.00 175.76 176.64 2wh3 n LYS 150 N -0.44 0.00 -4.73 0.00 4.81 -0.87 -2.78 118.16 114.15 2wh3 n LYS 150 Ca -0.04 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.14 2wh3 n LYS 150 Cb 0.64 0.00 -0.17 0.00 0.02 0.00 0.00 35.03 35.53 2wh3 n LYS 150 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2wh3 s VAL 151 N 0.00 1.34 -0.11 3.15 1.01 -0.79 0.30 120.40 125.31 2wh3 s VAL 151 Ca 0.00 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.40 2wh3 s VAL 151 Cb 0.00 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.19 2wh3 s VAL 151 CO 0.00 0.40 -0.19 -0.63 0.00 0.00 0.00 175.10 174.68 2wh3 s ILE 152 N 0.57 1.77 0.09 2.22 1.01 0.40 -3.41 121.20 123.85 2wh3 s ILE 152 Ca -0.15 -0.82 0.05 0.00 0.00 0.00 0.00 60.65 59.73 2wh3 s ILE 152 Cb -0.16 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 2wh3 s ILE 152 CO 0.05 0.49 -0.01 -0.69 0.00 0.00 0.00 174.94 174.79 2wh3 s VAL 153 N 0.73 3.98 0.00 2.92 1.01 0.17 -1.54 120.40 127.66 2wh3 s VAL 153 Ca -0.11 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.87 2wh3 s VAL 153 Cb -0.16 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.33 2wh3 s VAL 153 CO 0.02 0.13 0.00 -1.54 0.00 0.00 0.00 175.10 173.70 2wh3 n SER 154 N 0.60 0.00 -4.71 3.32 3.41 -0.99 -1.61 113.62 113.64 2wh3 n SER 154 Ca -0.11 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.21 2wh3 n SER 154 Cb 0.52 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.63 2wh3 n SER 154 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2wh3 s GLY 155 N -0.38 1.57 0.00 5.00 0.00 -0.99 -4.17 107.32 108.35 2wh3 s GLY 155 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.25 2wh3 s GLY 155 CO 0.00 0.12 0.00 0.54 0.00 0.00 0.00 173.10 173.76 2wh3 n ARG 156 N -4.01 0.00 -0.95 2.90 5.12 -1.26 -4.61 116.66 113.86 2wh3 n ARG 156 Ca 0.06 0.00 -0.26 0.00 -1.93 0.00 0.00 57.85 55.72 2wh3 n ARG 156 Cb 0.58 -2.37 -0.10 0.00 -1.16 0.00 0.00 32.46 29.42 2wh3 n ARG 156 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2wh3 n ILE 157 N -2.25 0.00 0.00 0.55 5.41 -1.26 0.27 119.36 122.08 2wh3 n ILE 157 Ca 0.00 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2wh3 n ILE 157 Cb 0.00 -0.32 0.00 0.00 -0.71 0.00 0.00 39.64 38.61 2wh3 n ILE 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wh3 n GLY 158 N 4.13 3.21 0.00 7.39 0.00 -1.26 -3.93 105.19 114.72 2wh3 n GLY 158 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2wh3 n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wh3 n GLY 159 N -1.89 0.88 3.76 -0.02 0.00 0.75 -5.08 105.19 103.59 2wh3 n GLY 159 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2wh3 n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wh3 s ALA 160 N -2.00 3.65 0.13 4.61 0.00 -1.25 -4.91 121.76 121.99 2wh3 s ALA 160 Ca 0.00 1.50 -0.28 0.00 0.00 0.00 0.00 51.96 53.18 2wh3 s ALA 160 Cb 0.00 -3.61 -0.08 0.00 0.00 0.00 0.00 23.12 19.43 2wh3 s ALA 160 CO 0.00 -0.93 1.48 1.49 0.00 0.00 0.00 175.76 177.80 2wh3 h GLU 161 N 4.17 -0.18 -6.31 0.00 4.81 -1.96 -3.38 114.58 111.73 2wh3 h GLU 161 Ca -0.48 0.01 -0.55 0.00 -0.13 0.00 0.00 59.36 58.21 2wh3 h GLU 161 Cb 1.23 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.63 2wh3 h GLU 161 CO 0.73 -0.12 0.71 -1.14 -0.73 0.00 0.00 179.01 178.46 2wh3 s GLN 162 N -5.28 4.35 0.18 1.92 2.00 -1.26 -4.90 119.66 116.67 2wh3 s GLN 162 Ca -0.12 1.68 -0.30 0.00 -2.00 0.00 0.00 55.36 54.62 2wh3 s GLN 162 Cb 0.08 -3.56 -0.08 0.00 0.80 0.00 0.00 33.01 30.25 2wh3 s GLN 162 CO 0.55 -0.46 1.23 0.00 -0.50 0.00 0.00 175.29 176.10 2wh3 s ALA 163 N 2.26 3.46 0.19 1.58 0.00 -1.26 -4.65 121.76 123.34 2wh3 s ALA 163 Ca 0.56 0.99 0.07 0.00 0.00 0.00 0.00 51.96 53.58 2wh3 s ALA 163 Cb -0.25 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 2wh3 s ALA 163 CO 0.22 -0.42 -0.13 1.03 0.00 0.00 0.00 175.76 176.46 2wh3 s ARG 164 N -0.17 1.26 -0.30 0.00 0.52 -1.26 -4.77 118.95 114.23 2wh3 s ARG 164 Ca 0.54 -1.55 -0.06 0.00 -0.52 0.00 0.00 55.73 54.13 2wh3 s ARG 164 Cb -0.34 -0.98 0.02 0.00 0.52 0.00 0.00 34.95 34.17 2wh3 s ARG 164 CO 0.37 0.15 0.07 0.99 0.02 0.00 0.00 175.30 176.90 2wh3 s THR 165 N -3.07 3.81 -0.32 0.02 2.01 -1.26 -2.35 115.64 114.47 2wh3 s THR 165 Ca 0.21 -0.83 -0.19 0.00 0.31 0.00 0.00 61.69 61.20 2wh3 s THR 165 Cb 0.00 -3.00 -0.01 0.00 0.01 0.00 0.00 72.50 69.50 2wh3 s THR 165 CO 0.05 0.03 0.55 -0.70 -0.69 0.00 0.00 174.62 173.87 2wh3 s GLU 166 N 1.46 3.80 0.00 4.92 2.56 -0.63 -4.92 118.70 125.89 2wh3 s GLU 166 Ca 0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.97 55.06 2wh3 s GLU 166 Cb -0.18 -3.75 0.00 0.00 2.00 0.00 0.00 34.13 32.20 2wh3 s GLU 166 CO 0.02 -0.57 0.00 1.87 -0.56 0.00 0.00 175.26 176.02 2wh3 n TRP 167 N 5.76 -1.79 0.00 5.30 -0.00 -1.26 0.45 117.44 125.90 2wh3 n TRP 167 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.47 2wh3 n TRP 167 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.80 2wh3 n TRP 167 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2wh3 n ALA 168 N -3.00 0.00 -3.79 5.87 0.00 -1.22 -4.89 120.51 113.48 2wh3 n ALA 168 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 2wh3 n ALA 168 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2wh3 n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wh3 s ALA 169 N 0.00 -1.04 0.18 0.00 0.00 -1.26 -1.88 121.76 117.76 2wh3 s ALA 169 Ca 0.00 -0.45 -0.16 0.00 0.00 0.00 0.00 51.96 51.35 2wh3 s ALA 169 Cb 0.00 0.83 0.02 0.00 0.00 0.00 0.00 23.12 23.97 2wh3 s ALA 169 CO 0.00 -1.01 0.46 -1.14 0.00 0.00 0.00 175.76 174.07 2wh3 s GLN 170 N -3.60 1.31 4.02 0.00 0.74 -1.12 -4.97 119.66 116.05 2wh3 s GLN 170 Ca 0.13 -0.92 0.00 0.00 0.05 0.00 0.00 55.36 54.62 2wh3 s GLN 170 Cb -0.05 0.49 0.00 0.00 1.10 0.00 0.00 33.01 34.54 2wh3 s GLN 170 CO 0.08 -0.54 0.00 0.41 -0.55 0.00 0.00 175.29 174.69 2wh3 n GLY 171 N -0.30 0.43 2.86 2.59 0.00 -1.26 -0.81 105.19 108.69 2wh3 n GLY 171 Ca -0.10 -0.96 -0.18 0.00 0.00 0.00 0.00 46.02 44.78 2wh3 n GLY 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wh3 s ARG 172 N 0.00 0.55 -0.37 1.61 0.52 0.16 -4.91 118.95 116.52 2wh3 s ARG 172 Ca 0.00 -0.03 0.01 0.00 -0.52 0.00 0.00 55.73 55.19 2wh3 s ARG 172 Cb 0.00 -0.64 0.14 0.00 0.52 0.00 0.00 34.95 34.97 2wh3 s ARG 172 CO 0.00 -0.09 0.23 0.08 0.02 0.00 0.00 175.30 175.53 2wh3 s VAL 173 N 0.89 0.29 -1.04 3.52 1.01 -1.26 -3.83 120.40 119.99 2wh3 s VAL 173 Ca -0.10 -1.89 -0.13 0.00 0.00 0.00 0.00 61.98 59.86 2wh3 s VAL 173 Cb -0.13 -1.22 0.21 0.00 0.00 0.00 0.00 36.38 35.24 2wh3 s VAL 173 CO -0.01 -1.00 1.11 -2.16 0.00 0.00 0.00 175.10 173.04 2wh3 s PRO 174 N 0.90 3.93 0.00 2.72 0.04 -1.26 -4.88 135.00 136.45 2wh3 s PRO 174 Ca 0.19 -2.65 0.13 0.00 0.04 0.00 0.00 61.00 58.72 2wh3 s PRO 174 Cb -0.20 -4.71 0.76 0.00 0.04 0.00 0.00 34.50 30.39 2wh3 s PRO 174 CO -0.01 -1.47 1.19 1.28 0.04 0.00 0.00 177.00 178.04 2wh3 n LEU 175 N 4.34 0.00 -0.86 -3.56 4.32 -1.26 -1.94 117.00 118.04 2wh3 n LEU 175 Ca 0.24 0.00 0.11 0.00 -0.02 0.00 0.00 56.01 56.34 2wh3 n LEU 175 Cb 0.44 -0.00 0.09 0.00 -1.62 0.00 0.00 43.42 42.33 2wh3 n LEU 175 CO 0.48 -0.00 0.59 1.41 -1.22 0.00 0.00 177.39 178.64 2wh3 n HIS 176 N -1.00 0.02 -3.76 -1.77 8.25 -1.26 -4.85 115.22 110.85 2wh3 n HIS 176 Ca 0.10 -0.01 -0.37 0.00 -0.26 0.00 0.00 57.72 57.17 2wh3 n HIS 176 Cb 0.04 -0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.03 2wh3 n HIS 176 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2wh3 s THR 177 N -1.76 3.99 0.00 1.59 2.01 -0.82 -5.02 115.64 115.62 2wh3 s THR 177 Ca 0.25 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.57 2wh3 s THR 177 Cb 0.18 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.63 2wh3 s THR 177 CO 0.27 0.08 0.91 0.18 -0.69 0.00 0.00 174.62 175.37 2wh3 n LEU 178 N 4.87 0.00 -3.47 4.42 7.99 -1.26 -3.51 117.00 126.04 2wh3 n LEU 178 Ca -0.14 0.91 -0.27 0.00 -0.01 0.00 0.00 56.01 56.50 2wh3 n LEU 178 Cb 0.48 -0.41 -0.07 0.00 -0.11 0.00 0.00 43.42 43.30 2wh3 n LEU 178 CO 0.32 -0.41 1.17 -2.11 -1.51 0.00 0.00 177.39 174.84 2wh3 n ARG 179 N -2.05 0.00 0.00 3.23 1.85 -1.26 -3.66 116.66 114.77 2wh3 n ARG 179 Ca 0.00 -0.71 0.00 0.00 -1.00 0.00 0.00 57.85 56.14 2wh3 n ARG 179 Cb 0.00 -2.11 0.00 0.00 -1.05 0.00 0.00 32.46 29.30 2wh3 n ARG 179 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wh3 n ALA 180 N 7.07 0.00 -1.66 2.89 0.00 -1.23 -4.10 120.51 123.49 2wh3 n ALA 180 Ca 0.28 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.66 2wh3 n ALA 180 Cb 0.29 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.74 2wh3 n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wh3 n ASN 181 N 0.00 -2.22 -4.66 0.00 5.15 -1.24 -3.90 115.26 108.39 2wh3 n ASN 181 Ca 0.00 0.06 -0.34 0.00 -0.60 0.00 0.00 54.58 53.70 2wh3 n ASN 181 Cb 0.12 -0.57 -0.10 0.00 -0.53 0.00 0.00 39.78 38.70 2wh3 n ASN 181 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2wh3 s ILE 182 N -0.43 4.11 -0.30 -1.44 1.01 -1.26 -2.13 121.20 120.77 2wh3 s ILE 182 Ca 0.06 -0.39 -0.14 0.00 0.00 0.00 0.00 60.65 60.18 2wh3 s ILE 182 Cb -0.01 -2.74 -0.03 0.00 0.01 0.00 0.00 42.46 39.69 2wh3 s ILE 182 CO 0.13 0.55 0.32 -0.62 0.00 0.00 0.00 174.94 175.32 2wh3 s ASP 183 N -1.02 6.17 -0.25 3.58 3.68 0.30 -4.87 116.67 124.25 2wh3 s ASP 183 Ca 0.14 0.01 -0.11 0.00 2.13 0.00 0.00 52.55 54.72 2wh3 s ASP 183 Cb -0.11 -2.18 -0.05 0.00 -1.45 0.00 0.00 42.92 39.13 2wh3 s ASP 183 CO 0.04 -0.21 0.19 -0.47 0.13 0.00 0.00 175.17 174.85 2wh3 s TYR 184 N 1.97 3.29 -0.12 -5.34 5.04 -1.26 -0.82 117.35 120.11 2wh3 s TYR 184 Ca 0.12 0.23 0.01 0.00 -2.44 0.00 0.00 57.07 54.99 2wh3 s TYR 184 Cb -0.16 -2.33 0.02 0.00 0.35 0.00 0.00 41.96 39.83 2wh3 s TYR 184 CO 0.11 -0.02 -0.16 0.20 -1.34 0.00 0.00 175.55 174.35 2wh3 s GLY 185 N 1.28 1.09 -0.01 8.97 0.00 0.15 -4.38 107.32 114.41 2wh3 s GLY 185 Ca 0.08 -0.80 0.04 0.00 0.00 0.00 0.00 44.72 44.04 2wh3 s GLY 185 CO 0.07 0.27 -0.13 -0.12 0.00 0.00 0.00 173.10 173.18 2wh3 s PHE 186 N 1.07 1.19 -0.23 1.90 5.36 -1.25 -0.21 117.98 125.82 2wh3 s PHE 186 Ca -0.04 -0.23 -0.26 0.00 -0.96 0.00 0.00 56.93 55.43 2wh3 s PHE 186 Cb -0.15 -0.77 0.07 0.00 -0.34 0.00 0.00 43.02 41.83 2wh3 s PHE 186 CO -0.03 -0.03 0.73 0.00 -1.46 0.00 0.00 175.22 174.42 2wh3 s ALA 187 N -0.27 -1.79 0.72 11.12 0.00 -0.96 -4.91 121.76 125.67 2wh3 s ALA 187 Ca 0.04 1.88 -0.11 0.00 0.00 0.00 0.00 51.96 53.77 2wh3 s ALA 187 Cb -0.06 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.12 2wh3 s ALA 187 CO -0.00 -0.34 1.08 -0.51 0.00 0.00 0.00 175.76 175.98 2wh3 s LEU 188 N 0.06 2.92 -0.46 0.00 2.01 -1.26 -2.64 118.68 119.31 2wh3 s LEU 188 Ca -0.02 1.35 0.06 0.00 0.01 0.00 0.00 54.13 55.52 2wh3 s LEU 188 Cb -0.04 -4.15 0.19 0.00 0.01 0.00 0.00 46.19 42.20 2wh3 s LEU 188 CO 0.02 -1.47 0.55 0.00 1.01 0.00 0.00 176.35 176.46 2wh3 n ALA 189 N -3.12 0.63 -1.97 4.21 0.00 -1.25 -4.84 120.51 114.17 2wh3 n ALA 189 Ca 0.07 -2.17 -0.41 0.00 0.00 0.00 0.00 53.44 50.93 2wh3 n ALA 189 Cb 0.55 -1.10 -0.04 0.00 0.00 0.00 0.00 19.45 18.87 2wh3 n ALA 189 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2wh3 s ARG 190 N 0.34 4.54 0.25 0.00 1.70 -1.26 -2.93 118.95 121.58 2wh3 s ARG 190 Ca 0.32 1.84 0.01 0.00 -0.47 0.00 0.00 55.73 57.43 2wh3 s ARG 190 Cb 0.05 -3.23 -0.00 0.00 -0.57 0.00 0.00 34.95 31.19 2wh3 s ARG 190 CO -0.14 0.01 0.03 0.25 -1.08 0.00 0.00 175.30 174.38 2wh3 n THR 191 N 2.09 0.00 0.10 4.99 -2.24 0.17 -4.87 114.28 114.53 2wh3 n THR 191 Ca 0.02 -1.26 -0.00 0.00 -2.27 0.00 0.00 64.05 60.54 2wh3 n THR 191 Cb 0.45 0.34 0.30 0.00 -2.10 0.00 0.00 70.33 69.32 2wh3 n THR 191 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2wh3 h THR 192 N 1.24 1.25 0.00 4.28 2.02 -1.98 -3.13 112.91 116.59 2wh3 h THR 192 Ca -0.20 -1.19 0.00 0.00 0.77 0.00 0.00 66.41 65.79 2wh3 h THR 192 Cb 0.66 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 2wh3 h THR 192 CO 0.32 0.36 -1.61 0.00 0.37 0.00 0.00 175.52 174.96 2wh3 n TYR 193 N -4.14 0.31 -3.63 3.16 0.18 -1.26 -5.08 117.16 106.70 2wh3 n TYR 193 Ca -0.01 0.09 0.00 0.00 1.88 0.00 0.00 57.90 59.86 2wh3 n TYR 193 Cb 0.38 -0.62 0.00 0.00 -0.38 0.00 0.00 39.34 38.72 2wh3 n TYR 193 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2wh3 n GLY 194 N 1.25 -0.80 3.87 -7.48 0.00 -1.19 -5.15 105.19 95.70 2wh3 n GLY 194 Ca -0.02 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.73 2wh3 n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wh3 s VAL 195 N -3.00 5.04 0.38 1.61 1.01 -1.26 0.46 120.40 124.64 2wh3 s VAL 195 Ca 0.00 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.41 2wh3 s VAL 195 Cb 0.00 -3.48 -0.06 0.00 0.00 0.00 0.00 36.38 32.84 2wh3 s VAL 195 CO 0.00 0.08 0.04 -0.76 0.00 0.00 0.00 175.10 174.46 2wh3 s LEU 196 N -2.64 2.40 -0.04 3.92 2.01 -1.15 -4.75 118.68 118.44 2wh3 s LEU 196 Ca 0.33 -1.43 0.03 0.00 0.01 0.00 0.00 54.13 53.06 2wh3 s LEU 196 Cb -0.12 -0.56 0.00 0.00 0.01 0.00 0.00 46.19 45.52 2wh3 s LEU 196 CO 0.26 -0.61 -0.12 -0.83 1.01 0.00 0.00 176.35 176.06 2wh3 s GLY 197 N -3.61 0.68 -0.27 -3.19 0.00 -1.26 -3.75 107.32 95.92 2wh3 s GLY 197 Ca 0.32 -0.45 0.02 0.00 0.00 0.00 0.00 44.72 44.61 2wh3 s GLY 197 CO 0.15 -0.14 -0.07 0.14 0.00 0.00 0.00 173.10 173.18 2wh3 s VAL 198 N 0.20 1.98 -0.14 1.40 1.01 -1.08 -2.35 120.40 121.42 2wh3 s VAL 198 Ca -0.05 -1.63 0.02 0.00 0.00 0.00 0.00 61.98 60.33 2wh3 s VAL 198 Cb -0.10 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2wh3 s VAL 198 CO 0.01 -0.15 -0.20 -0.54 0.00 0.00 0.00 175.10 174.22 2wh3 s LYS 199 N 1.16 3.08 -0.03 2.72 1.02 -0.59 -2.27 119.74 124.84 2wh3 s LYS 199 Ca -0.05 -0.83 0.05 0.00 0.02 0.00 0.00 55.97 55.17 2wh3 s LYS 199 Cb -0.19 -2.48 -0.01 0.00 -0.52 0.00 0.00 37.83 34.63 2wh3 s LYS 199 CO -0.06 0.02 -0.20 0.00 -0.92 0.00 0.00 175.35 174.19 2wh3 s ALA 200 N 0.75 1.70 -0.16 5.17 0.00 0.71 -0.45 121.76 129.48 2wh3 s ALA 200 Ca -0.08 -0.83 0.02 0.00 0.00 0.00 0.00 51.96 51.07 2wh3 s ALA 200 Cb -0.16 -0.49 0.02 0.00 0.00 0.00 0.00 23.12 22.48 2wh3 s ALA 200 CO -0.00 0.36 -0.20 0.71 0.00 0.00 0.00 175.76 176.63 2wh3 s TYR 201 N -0.23 2.66 -0.18 0.00 1.51 0.15 -0.68 117.35 120.58 2wh3 s TYR 201 Ca 0.02 -1.46 0.01 0.00 -1.01 0.00 0.00 57.07 54.63 2wh3 s TYR 201 Cb -0.10 -1.83 0.02 0.00 -0.11 0.00 0.00 41.96 39.93 2wh3 s TYR 201 CO 0.01 -0.70 -0.20 0.42 -1.11 0.00 0.00 175.55 173.97 2wh3 s ILE 202 N 1.07 2.04 -0.26 2.71 -1.09 0.00 -2.06 121.20 123.61 2wh3 s ILE 202 Ca -0.01 -0.93 -0.15 0.00 -2.23 0.00 0.00 60.65 57.33 2wh3 s ILE 202 Cb -0.14 -1.84 -0.04 0.00 -1.58 0.00 0.00 42.46 38.86 2wh3 s ILE 202 CO -0.07 0.54 0.39 0.12 -1.23 0.00 0.00 174.94 174.68 2wh3 s PHE 203 N 1.28 3.27 0.00 3.97 5.36 0.76 0.11 117.98 132.74 2wh3 s PHE 203 Ca 0.05 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.49 2wh3 s PHE 203 Cb -0.13 -2.58 0.00 0.00 -0.34 0.00 0.00 43.02 39.97 2wh3 s PHE 203 CO -0.13 -0.19 0.00 1.28 -1.46 0.00 0.00 175.22 174.72 2wh3 n LEU 204 N 5.19 0.00 0.00 6.12 4.77 -0.90 -2.54 117.00 129.63 2wh3 n LEU 204 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2wh3 n LEU 204 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2wh3 n LEU 204 CO 0.38 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2wh3 n GLY 205 N 4.76 -2.28 0.00 -0.72 0.00 -1.24 -4.76 105.19 100.94 2wh3 n GLY 205 Ca 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2wh3 n GLY 205 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wh3 n GLU 206 N -0.55 0.00 -0.66 1.61 2.13 -1.26 -4.49 120.64 117.42 2wh3 n GLU 206 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2wh3 n GLU 206 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2wh3 n GLU 206 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2wh3 n VAL 207 N 0.00 0.00 0.00 6.31 0.31 -1.26 -4.81 118.33 118.88 2wh3 n VAL 207 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2wh3 n VAL 207 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2wh3 n VAL 207 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81