#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh1 n ASN 3 N 0.00 0.00 -1.70 1.61 6.94 -1.26 -5.13 115.26 115.72 2wh1 n ASN 3 Ca 0.00 -0.28 -0.01 0.00 -0.02 0.00 0.00 54.58 54.27 2wh1 n ASN 3 Cb 0.00 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.41 2wh1 n ASN 3 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2wh1 n LYS 4 N 0.00 -1.55 -0.65 -3.83 5.02 -1.26 -5.02 118.16 110.87 2wh1 n LYS 4 Ca 0.00 1.49 -0.28 0.00 -2.02 0.00 0.00 58.31 57.50 2wh1 n LYS 4 Cb 0.00 -2.14 0.25 0.00 -0.02 0.00 0.00 35.03 33.11 2wh1 n LYS 4 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2wh1 s ILE 5 N -0.20 1.97 -0.45 -0.18 -5.25 -1.26 -4.90 121.20 110.92 2wh1 s ILE 5 Ca -0.06 0.00 -0.29 0.00 -0.99 0.00 0.00 60.65 59.31 2wh1 s ILE 5 Cb 0.00 -2.14 0.02 0.00 2.95 0.00 0.00 42.46 43.30 2wh1 s ILE 5 CO 0.16 0.00 1.24 -2.28 -1.79 0.00 0.00 174.94 172.27 2wh1 s HIS 6 N -2.54 2.66 0.49 1.37 5.65 -1.26 -4.87 115.29 116.79 2wh1 s HIS 6 Ca 0.68 0.70 0.37 0.00 0.25 0.00 0.00 55.06 57.06 2wh1 s HIS 6 Cb -0.23 -4.39 1.52 0.00 -1.18 0.00 0.00 32.58 28.29 2wh1 s HIS 6 CO 0.63 -1.53 1.65 -1.00 -0.65 0.00 0.00 174.74 173.84 2wh1 h PRO 7 N 9.76 0.06 0.10 2.88 0.13 -1.94 0.30 132.00 143.29 2wh1 h PRO 7 Ca -0.25 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2wh1 h PRO 7 Cb 1.08 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2wh1 h PRO 7 CO 1.11 0.04 -0.05 0.82 -0.23 0.00 0.00 178.00 179.70 2wh1 h ILE 8 N 0.06 0.00 0.00 -3.56 1.08 -1.89 -2.32 117.51 110.89 2wh1 h ILE 8 Ca 0.80 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 65.22 2wh1 h ILE 8 Cb 2.82 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 36.57 2wh1 h ILE 8 CO -0.22 0.00 0.18 1.23 -0.69 0.00 0.00 178.15 178.65 2wh1 h GLY 9 N -0.18 0.00 1.44 5.37 0.00 -1.51 0.17 103.07 108.36 2wh1 h GLY 9 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.04 2wh1 h GLY 9 CO 0.02 0.00 -1.17 -2.75 0.00 0.00 0.00 176.54 172.64 2wh1 h PHE 10 N 0.00 0.75 -0.12 5.60 3.57 -0.38 -3.24 116.94 123.12 2wh1 h PHE 10 Ca 0.00 -0.48 0.00 0.00 3.53 0.00 0.00 57.97 61.02 2wh1 h PHE 10 Cb 0.35 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.03 2wh1 h PHE 10 CO 0.00 1.33 0.00 0.54 -2.23 0.00 0.00 178.31 177.95 2wh1 n ARG 11 N -3.70 2.02 0.26 1.11 5.12 0.49 -4.60 116.66 117.36 2wh1 n ARG 11 Ca -0.10 -1.51 0.04 0.00 -1.93 0.00 0.00 57.85 54.35 2wh1 n ARG 11 Cb 0.96 -1.46 0.08 0.00 -1.16 0.00 0.00 32.46 30.87 2wh1 n ARG 11 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2wh1 h LEU 12 N 3.37 0.00 0.00 0.55 7.12 -1.28 0.65 115.31 125.72 2wh1 h LEU 12 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 2wh1 h LEU 12 Cb 0.73 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.86 2wh1 h LEU 12 CO 0.00 0.00 -1.36 0.61 -0.13 0.00 0.00 178.44 177.56 2wh1 n GLY 13 N -1.52 -0.72 3.61 3.75 0.00 -1.26 -4.52 105.19 104.52 2wh1 n GLY 13 Ca 0.03 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 2wh1 n GLY 13 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wh1 s ILE 14 N -2.95 0.00 0.00 -0.61 2.07 0.23 -4.96 121.20 114.98 2wh1 s ILE 14 Ca -0.01 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.23 2wh1 s ILE 14 Cb 0.12 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.71 2wh1 s ILE 14 CO 0.72 0.00 0.00 0.41 -1.91 0.00 0.00 174.94 174.16 2wh1 n THR 15 N 1.54 0.00 0.00 4.00 -1.04 -1.26 -4.55 114.28 112.97 2wh1 n THR 15 Ca -0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2wh1 n THR 15 Cb 0.57 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.86 2wh1 n THR 15 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2wh1 n ARG 16 N -2.89 0.00 -4.49 -2.82 3.00 -1.26 -4.29 116.66 103.91 2wh1 n ARG 16 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.61 2wh1 n ARG 16 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.36 2wh1 n ARG 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2wh1 s ASP 17 N 0.00 3.42 0.03 6.15 -0.00 -1.26 -4.26 116.67 120.74 2wh1 s ASP 17 Ca 0.00 -1.15 -0.38 0.00 -0.00 0.00 0.00 52.55 51.02 2wh1 s ASP 17 Cb 0.00 -0.29 -0.19 0.00 -0.00 0.00 0.00 42.92 42.44 2wh1 s ASP 17 CO 0.00 -0.18 1.03 0.79 -0.00 0.00 0.00 175.17 176.81 2wh1 n TRP 18 N -0.68 0.57 0.22 4.23 8.01 -1.26 -4.80 117.44 123.73 2wh1 n TRP 18 Ca -0.05 1.03 -0.02 0.00 -1.31 0.00 0.00 57.50 57.14 2wh1 n TRP 18 Cb 0.62 -2.09 0.12 0.00 -2.01 0.00 0.00 31.31 27.95 2wh1 n TRP 18 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.69 174.77 2wh1 n GLU 19 N 1.50 2.08 0.00 -0.99 2.13 -1.26 -4.39 120.64 119.70 2wh1 n GLU 19 Ca 0.20 -1.18 0.00 0.00 0.66 0.00 0.00 57.16 56.84 2wh1 n GLU 19 Cb 0.11 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.16 2wh1 n GLU 19 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2wh1 n SER 20 N 0.09 0.00 -4.34 4.31 2.88 -1.26 -3.89 113.62 111.41 2wh1 n SER 20 Ca 0.16 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.35 2wh1 n SER 20 Cb 0.75 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 64.07 2wh1 n SER 20 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wh1 s ARG 21 N 0.00 3.40 0.02 -1.46 1.70 -0.94 -4.94 118.95 116.74 2wh1 s ARG 21 Ca 0.00 -0.64 -0.29 0.00 -0.47 0.00 0.00 55.73 54.34 2wh1 s ARG 21 Cb 0.00 -2.88 0.11 0.00 -0.57 0.00 0.00 34.95 31.60 2wh1 s ARG 21 CO 0.00 -0.04 1.22 1.67 -1.08 0.00 0.00 175.30 177.07 2wh1 s TRP 22 N 1.05 -0.04 0.24 5.89 1.48 -1.26 -3.90 118.94 122.40 2wh1 s TRP 22 Ca 0.00 -0.11 0.07 0.00 -1.06 0.00 0.00 56.10 55.00 2wh1 s TRP 22 Cb -0.15 0.57 -0.04 0.00 -1.16 0.00 0.00 33.47 32.70 2wh1 s TRP 22 CO -0.01 -0.40 0.18 -0.47 -4.06 0.00 0.00 176.95 172.20 2wh1 s TYR 23 N -2.48 3.10 -0.28 1.66 5.04 -1.26 -5.03 117.35 118.09 2wh1 s TYR 23 Ca 0.16 -0.10 -0.17 0.00 -2.44 0.00 0.00 57.07 54.52 2wh1 s TYR 23 Cb 0.03 -1.41 0.10 0.00 0.35 0.00 0.00 41.96 41.03 2wh1 s TYR 23 CO -0.02 0.52 0.80 0.00 -1.34 0.00 0.00 175.55 175.52 2wh1 s ALA 24 N -2.08 -2.00 0.95 3.97 0.00 -1.26 -4.96 121.76 116.38 2wh1 s ALA 24 Ca 0.32 2.29 -0.14 0.00 0.00 0.00 0.00 51.96 54.43 2wh1 s ALA 24 Cb -0.08 -1.49 0.17 0.00 0.00 0.00 0.00 23.12 21.71 2wh1 s ALA 24 CO 0.24 -0.36 1.19 0.20 0.00 0.00 0.00 175.76 177.04 2wh1 s GLY 25 N 1.34 1.64 0.00 0.00 0.00 -1.26 -4.64 107.32 104.40 2wh1 s GLY 25 Ca -0.08 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 43.84 2wh1 s GLY 25 CO -0.16 -0.15 0.49 0.58 0.00 0.00 0.00 173.10 173.87 2wh1 n LYS 26 N -3.82 0.77 0.00 2.90 2.85 -1.26 -1.69 118.16 117.90 2wh1 n LYS 26 Ca 0.10 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.36 2wh1 n LYS 26 Cb 0.60 -1.31 0.00 0.00 -0.65 0.00 0.00 35.03 33.67 2wh1 n LYS 26 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2wh1 n LYS 27 N 0.26 4.30 0.00 -1.58 5.02 -1.26 -4.87 118.16 120.04 2wh1 n LYS 27 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2wh1 n LYS 27 Cb 0.25 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 34.59 2wh1 n LYS 27 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2wh1 n GLN 28 N -1.14 4.00 -0.31 1.97 6.02 -1.04 -4.86 117.38 122.02 2wh1 n GLN 28 Ca 0.00 0.00 0.27 0.00 -0.01 0.00 0.00 57.00 57.26 2wh1 n GLN 28 Cb 0.00 -0.40 0.46 0.00 1.02 0.00 0.00 30.24 31.33 2wh1 n GLN 28 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 2wh1 n TYR 29 N -0.08 0.55 0.37 1.08 9.36 -0.68 -0.02 117.16 127.74 2wh1 n TYR 29 Ca 0.00 0.56 -0.14 0.00 3.32 0.00 0.00 57.90 61.63 2wh1 n TYR 29 Cb 0.00 -0.96 -0.07 0.00 -0.63 0.00 0.00 39.34 37.68 2wh1 n TYR 29 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 2wh1 h ARG 30 N 0.00 -0.91 -0.83 2.98 2.43 -1.89 0.07 114.38 116.23 2wh1 h ARG 30 Ca 0.61 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.94 2wh1 h ARG 30 Cb 1.90 0.21 -0.07 0.00 -0.42 0.00 0.00 29.97 31.59 2wh1 h ARG 30 CO -0.36 -0.61 0.48 0.45 -1.51 0.00 0.00 179.97 178.42 2wh1 h HIS 31 N -1.04 0.87 -0.42 2.20 -0.00 -0.80 -1.28 115.15 114.68 2wh1 h HIS 31 Ca -0.10 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.21 2wh1 h HIS 31 Cb 0.72 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.86 2wh1 h HIS 31 CO 0.04 0.36 -0.12 -0.07 -0.00 0.00 0.00 177.93 178.14 2wh1 h LEU 32 N 0.80 0.83 -0.85 2.43 3.38 -1.46 -0.45 115.31 119.99 2wh1 h LEU 32 Ca 0.40 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2wh1 h LEU 32 Cb 0.36 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 2wh1 h LEU 32 CO -0.24 1.01 0.55 0.25 0.09 0.00 0.00 178.44 180.09 2wh1 h LEU 33 N 0.64 0.91 0.24 1.67 5.85 -0.24 0.19 115.31 124.57 2wh1 h LEU 33 Ca 0.10 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2wh1 h LEU 33 Cb 0.66 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2wh1 h LEU 33 CO 0.05 0.62 -0.11 0.25 -0.34 0.00 0.00 178.44 178.90 2wh1 h LEU 34 N 1.06 -0.27 -0.31 2.25 6.46 -1.07 -2.57 115.31 120.87 2wh1 h LEU 34 Ca 0.34 -0.10 0.03 0.00 -0.12 0.00 0.00 57.88 58.03 2wh1 h LEU 34 Cb 0.02 0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 39.97 2wh1 h LEU 34 CO -0.12 -0.06 -0.33 -0.08 -0.62 0.00 0.00 178.44 177.23 2wh1 h GLU 35 N -0.48 -0.18 -1.02 1.25 4.81 -0.24 0.24 114.58 118.96 2wh1 h GLU 35 Ca -0.03 0.01 0.35 0.00 -0.13 0.00 0.00 59.36 59.56 2wh1 h GLU 35 Cb 0.36 0.04 -0.15 0.00 0.63 0.00 0.00 28.75 29.63 2wh1 h GLU 35 CO 0.05 -0.12 0.58 -0.44 -0.73 0.00 0.00 179.01 178.35 2wh1 h ASP 36 N -0.19 0.46 0.12 1.04 3.45 -0.99 -1.23 116.42 119.08 2wh1 h ASP 36 Ca 0.05 0.20 -0.01 0.00 0.43 0.00 0.00 57.03 57.71 2wh1 h ASP 36 Cb 0.33 0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.26 2wh1 h ASP 36 CO -0.39 -0.20 -0.06 1.56 -1.57 0.00 0.00 179.24 178.58 2wh1 h GLN 37 N 0.24 -0.16 -1.06 3.56 1.08 -0.14 -2.24 115.11 116.40 2wh1 h GLN 37 Ca 0.76 0.01 0.29 0.00 -1.45 0.00 0.00 58.65 58.26 2wh1 h GLN 37 Cb 1.85 0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 29.25 2wh1 h GLN 37 CO -0.62 -0.11 0.73 0.07 -0.95 0.00 0.00 178.83 177.95 2wh1 h ARG 38 N -0.18 0.15 0.73 1.46 0.11 -0.61 0.16 114.38 116.20 2wh1 h ARG 38 Ca -0.02 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 60.02 2wh1 h ARG 38 Cb 0.13 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.18 2wh1 h ARG 38 CO 0.03 0.10 -0.38 0.82 0.10 0.00 0.00 179.97 180.63 2wh1 h ILE 39 N 0.15 0.00 -1.00 0.08 2.04 -1.17 -1.53 117.51 116.08 2wh1 h ILE 39 Ca 0.54 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.65 2wh1 h ILE 39 Cb 1.83 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.83 2wh1 h ILE 39 CO -0.11 0.00 0.66 0.03 0.00 0.00 0.00 178.15 178.73 2wh1 h ARG 40 N -1.02 0.34 0.00 2.37 3.08 -0.15 -1.45 114.38 117.55 2wh1 h ARG 40 Ca -0.10 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2wh1 h ARG 40 Cb 0.79 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.77 2wh1 h ARG 40 CO 0.14 0.23 0.00 0.41 -1.07 0.00 0.00 179.97 179.68 2wh1 n GLY 41 N -1.52 -2.78 0.41 0.04 0.00 0.01 -0.21 105.19 101.14 2wh1 n GLY 41 Ca 0.23 0.10 0.23 0.00 0.00 0.00 0.00 46.02 46.58 2wh1 n GLY 41 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2wh1 h LEU 42 N 0.00 0.43 -0.22 0.99 5.85 -1.04 -0.03 115.31 121.29 2wh1 h LEU 42 Ca 0.00 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 2wh1 h LEU 42 Cb 0.00 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2wh1 h LEU 42 CO 0.00 0.09 0.04 -0.07 -0.34 0.00 0.00 178.44 178.16 2wh1 h LEU 43 N 0.38 0.35 0.00 2.25 3.38 -1.15 -1.07 115.31 119.44 2wh1 h LEU 43 Ca 0.58 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2wh1 h LEU 43 Cb 1.51 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2wh1 h LEU 43 CO -0.28 0.51 0.00 -0.62 0.09 0.00 0.00 178.44 178.15 2wh1 n GLU 44 N -4.72 0.04 0.00 1.13 1.02 0.70 -3.11 120.64 115.71 2wh1 n GLU 44 Ca -0.04 0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2wh1 n GLU 44 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 2wh1 n GLU 44 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2wh1 n LYS 45 N -1.44 0.00 -0.75 3.49 5.02 -0.55 -4.48 118.16 119.45 2wh1 n LYS 45 Ca 0.03 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.11 2wh1 n LYS 45 Cb 0.11 -0.19 -0.03 0.00 -0.02 0.00 0.00 35.03 34.90 2wh1 n LYS 45 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2wh1 n GLU 46 N -0.43 2.06 -0.23 1.97 1.02 -0.52 -3.24 120.64 121.26 2wh1 n GLU 46 Ca 0.00 -1.38 -0.00 0.00 -0.02 0.00 0.00 57.16 55.76 2wh1 n GLU 46 Cb 0.00 -2.38 -0.00 0.00 -0.02 0.00 0.00 31.44 29.04 2wh1 n GLU 46 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2wh1 n LEU 47 N 3.94 -0.05 0.08 -4.62 7.94 -1.18 -4.92 117.00 118.18 2wh1 n LEU 47 Ca 0.44 -0.33 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 2wh1 n LEU 47 Cb 0.20 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.11 2wh1 n LEU 47 CO 0.63 0.67 0.06 0.22 -1.11 0.00 0.00 177.39 177.86 2wh1 h TYR 48 N 0.00 0.00 -0.59 1.96 3.20 -1.77 -2.99 116.97 116.78 2wh1 h TYR 48 Ca -0.03 0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.00 2wh1 h TYR 48 Cb 0.37 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 2wh1 h TYR 48 CO -0.08 0.58 0.42 0.77 -1.64 0.00 0.00 178.16 178.21 2wh1 h SER 49 N 0.00 0.08 0.00 -2.11 0.02 -1.93 0.47 113.55 110.07 2wh1 h SER 49 Ca -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2wh1 h SER 49 Cb 1.52 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.05 2wh1 h SER 49 CO 0.06 0.04 -1.00 0.00 -1.14 0.00 0.00 176.83 174.79 2wh1 n ALA 50 N -2.62 4.53 -3.01 3.77 0.00 -1.24 -5.06 120.51 116.87 2wh1 n ALA 50 Ca 0.11 -0.57 -0.01 0.00 0.00 0.00 0.00 53.44 52.98 2wh1 n ALA 50 Cb 0.61 -0.73 -0.01 0.00 0.00 0.00 0.00 19.45 19.32 2wh1 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wh1 n GLY 51 N 1.47 -0.96 0.00 0.00 0.00 0.16 -4.03 105.19 101.83 2wh1 n GLY 51 Ca 0.03 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2wh1 n GLY 51 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2wh1 n LEU 52 N 2.12 0.00 0.00 0.99 -0.00 -1.25 -4.14 117.00 114.71 2wh1 n LEU 52 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.95 2wh1 n LEU 52 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.61 2wh1 n LEU 52 CO 0.08 -0.25 0.00 0.00 -0.00 0.00 0.00 177.39 177.22 2wh1 n ALA 53 N -3.00 0.00 -3.57 1.47 0.00 -1.21 -4.68 120.51 109.51 2wh1 n ALA 53 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2wh1 n ALA 53 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2wh1 n ALA 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2wh1 s ARG 54 N 0.00 0.43 -0.45 0.00 3.52 -1.25 -4.85 118.95 116.35 2wh1 s ARG 54 Ca 0.00 -0.16 0.06 0.00 -0.13 0.00 0.00 55.73 55.50 2wh1 s ARG 54 Cb 0.00 0.20 0.19 0.00 -1.56 0.00 0.00 34.95 33.78 2wh1 s ARG 54 CO 0.00 -0.19 0.53 0.28 -0.81 0.00 0.00 175.30 175.11 2wh1 n VAL 55 N -0.12 -0.67 -1.63 7.11 0.31 -1.26 -2.86 118.33 119.21 2wh1 n VAL 55 Ca -0.02 -2.54 -0.33 0.00 -0.01 0.00 0.00 64.34 61.45 2wh1 n VAL 55 Cb 0.59 -0.56 0.06 0.00 -0.91 0.00 0.00 33.84 33.02 2wh1 n VAL 55 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wh1 s ASP 56 N 0.05 4.90 -0.18 4.52 2.15 -1.22 -4.80 116.67 122.10 2wh1 s ASP 56 Ca 0.32 2.00 -0.07 0.00 0.43 0.00 0.00 52.55 55.23 2wh1 s ASP 56 Cb 0.06 -2.55 0.08 0.00 -0.30 0.00 0.00 42.92 40.21 2wh1 s ASP 56 CO -0.14 -1.77 0.39 -0.63 -0.17 0.00 0.00 175.17 172.84 2wh1 s ILE 57 N -2.42 -0.51 0.36 4.11 1.01 -1.25 -1.88 121.20 120.62 2wh1 s ILE 57 Ca 0.66 0.18 0.08 0.00 0.00 0.00 0.00 60.65 61.57 2wh1 s ILE 57 Cb -0.20 -0.61 -0.05 0.00 0.01 0.00 0.00 42.46 41.61 2wh1 s ILE 57 CO 0.45 0.07 0.14 -1.61 0.00 0.00 0.00 174.94 173.99 2wh1 s GLU 58 N 2.39 2.29 0.24 2.79 2.02 -1.26 -2.20 118.70 124.96 2wh1 s GLU 58 Ca -0.02 -1.66 -0.22 0.00 0.02 0.00 0.00 54.97 53.08 2wh1 s GLU 58 Cb -0.11 -2.09 0.03 0.00 0.10 0.00 0.00 34.13 32.06 2wh1 s GLU 58 CO -0.12 0.04 0.80 1.03 0.02 0.00 0.00 175.26 177.03 2wh1 s ARG 59 N -3.85 1.59 0.00 1.61 0.52 -1.25 -2.29 118.95 115.28 2wh1 s ARG 59 Ca 0.39 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.72 2wh1 s ARG 59 Cb -0.00 0.54 0.00 0.00 0.52 0.00 0.00 34.95 36.01 2wh1 s ARG 59 CO 0.22 -0.73 0.00 0.00 0.02 0.00 0.00 175.30 174.81 2wh1 n ALA 60 N -0.46 0.00 0.00 2.13 0.00 -1.26 -4.69 120.51 116.22 2wh1 n ALA 60 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2wh1 n ALA 60 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2wh1 n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wh1 n ALA 61 N 0.00 0.00 -3.99 0.00 0.00 -1.26 -5.00 120.51 110.26 2wh1 n ALA 61 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2wh1 n ALA 61 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2wh1 n ALA 61 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wh1 n ASP 62 N 0.00 -1.91 -4.26 0.00 9.92 -1.26 -4.98 116.55 114.06 2wh1 n ASP 62 Ca 0.00 -0.95 -0.22 0.00 -0.53 0.00 0.00 54.79 53.09 2wh1 n ASP 62 Cb 0.00 -3.23 -0.09 0.00 -0.64 0.00 0.00 41.12 37.16 2wh1 n ASP 62 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2wh1 s ASN 63 N -3.92 2.34 -0.18 -2.24 4.22 -1.26 -3.26 114.94 110.63 2wh1 s ASN 63 Ca 0.30 -1.52 -0.08 0.00 -2.14 0.00 0.00 52.86 49.43 2wh1 s ASN 63 Cb -0.16 0.23 0.08 0.00 1.28 0.00 0.00 41.25 42.68 2wh1 s ASN 63 CO 0.88 -0.78 0.41 -0.69 -2.04 0.00 0.00 177.10 174.88 2wh1 s VAL 64 N -3.34 -0.37 -0.02 3.54 1.01 -0.92 -4.59 120.40 115.71 2wh1 s VAL 64 Ca 0.31 0.14 -0.16 0.00 0.00 0.00 0.00 61.98 62.28 2wh1 s VAL 64 Cb 0.06 -0.63 -0.09 0.00 0.00 0.00 0.00 36.38 35.72 2wh1 s VAL 64 CO 0.15 0.06 0.71 0.00 0.00 0.00 0.00 175.10 176.02 2wh1 h ALA 65 N 7.73 -0.63 -3.89 5.51 0.00 -1.76 -3.14 119.26 123.07 2wh1 h ALA 65 Ca -0.25 -0.12 -0.35 0.00 0.00 0.00 0.00 54.91 54.19 2wh1 h ALA 65 Cb 1.14 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2wh1 h ALA 65 CO 0.19 -0.59 -0.48 0.28 0.00 0.00 0.00 179.25 178.66 2wh1 n VAL 66 N -4.79 -1.06 -1.26 0.00 0.31 -1.16 -3.28 118.33 107.09 2wh1 n VAL 66 Ca -0.07 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.89 2wh1 n VAL 66 Cb 0.22 -2.52 -0.08 0.00 -0.91 0.00 0.00 33.84 30.55 2wh1 n VAL 66 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2wh1 n THR 67 N -3.89 1.19 -1.81 2.52 -1.04 -0.79 -3.34 114.28 107.11 2wh1 n THR 67 Ca -0.16 -1.11 -0.24 0.00 -2.04 0.00 0.00 64.05 60.50 2wh1 n THR 67 Cb 0.63 -2.17 -0.05 0.00 -1.82 0.00 0.00 70.33 66.92 2wh1 n THR 67 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2wh1 s VAL 68 N 8.43 3.22 0.25 12.58 1.01 -1.24 -3.37 120.40 141.28 2wh1 s VAL 68 Ca 0.66 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.22 2wh1 s VAL 68 Cb 0.09 -3.51 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 2wh1 s VAL 68 CO 0.19 -0.49 1.40 -1.00 0.00 0.00 0.00 175.10 175.20 2wh1 s HIS 69 N 11.96 3.07 0.30 5.22 3.76 -1.13 -3.42 115.29 135.04 2wh1 s HIS 69 Ca 0.81 1.10 0.04 0.00 -0.15 0.00 0.00 55.06 56.87 2wh1 s HIS 69 Cb -0.11 -3.76 -0.03 0.00 1.11 0.00 0.00 32.58 29.79 2wh1 s HIS 69 CO 0.08 -2.42 0.20 0.08 -0.85 0.00 0.00 174.74 171.83 2wh1 s VAL 70 N -0.09 0.13 -0.01 -0.90 1.01 -1.17 -3.35 120.40 116.03 2wh1 s VAL 70 Ca 0.58 -2.00 0.01 0.00 0.00 0.00 0.00 61.98 60.57 2wh1 s VAL 70 Cb -0.40 -2.49 0.02 0.00 0.00 0.00 0.00 36.38 33.50 2wh1 s VAL 70 CO 0.43 0.00 0.89 0.00 0.00 0.00 0.00 175.10 176.42 2wh1 n ALA 71 N -0.55 1.77 -2.71 5.51 0.00 -1.26 -1.74 120.51 121.53 2wh1 n ALA 71 Ca 0.04 -0.96 -0.07 0.00 0.00 0.00 0.00 53.44 52.44 2wh1 n ALA 71 Cb 0.64 -0.03 0.10 0.00 0.00 0.00 0.00 19.45 20.16 2wh1 n ALA 71 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wh1 n LYS 72 N -0.42 0.82 0.26 0.00 4.81 -1.26 -4.82 118.16 117.55 2wh1 n LYS 72 Ca 0.01 -1.62 0.14 0.00 -0.87 0.00 0.00 58.31 55.97 2wh1 n LYS 72 Cb 0.34 -0.72 0.83 0.00 0.02 0.00 0.00 35.03 35.49 2wh1 n LYS 72 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 2wh1 h PRO 73 N 2.68 0.00 0.00 1.64 0.13 -1.87 -2.38 132.00 132.20 2wh1 h PRO 73 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 2wh1 h PRO 73 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2wh1 h PRO 73 CO 0.07 0.00 0.07 0.41 -0.23 0.00 0.00 178.00 178.33 2wh1 n GLY 74 N -1.40 -0.56 0.12 1.56 0.00 -1.26 -1.88 105.19 101.77 2wh1 n GLY 74 Ca -0.02 0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 2wh1 n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wh1 n VAL 75 N -1.71 1.38 0.25 1.61 0.31 -0.90 -3.07 118.33 116.20 2wh1 n VAL 75 Ca -0.00 -0.52 0.16 0.00 -0.01 0.00 0.00 64.34 63.96 2wh1 n VAL 75 Cb 0.08 -1.36 0.85 0.00 -0.91 0.00 0.00 33.84 32.51 2wh1 n VAL 75 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 2wh1 h VAL 76 N -0.01 0.00 0.00 2.52 -1.51 -1.48 -2.81 116.25 112.96 2wh1 h VAL 76 Ca -0.54 -0.04 -0.37 0.00 -1.23 0.00 0.00 66.70 64.52 2wh1 h VAL 76 Cb 1.83 0.77 -0.06 0.00 -2.13 0.00 0.00 31.29 31.69 2wh1 h VAL 76 CO -0.09 0.00 -2.35 -0.38 -1.23 0.00 0.00 177.57 173.52 2wh1 n ILE 77 N -2.63 1.34 0.00 7.19 5.41 -1.05 -2.14 119.36 127.48 2wh1 n ILE 77 Ca -0.02 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.28 2wh1 n ILE 77 Cb 0.07 -1.51 0.00 0.00 -0.71 0.00 0.00 39.64 37.49 2wh1 n ILE 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wh1 n GLY 78 N 2.04 0.93 2.58 7.39 0.00 -1.06 -0.66 105.19 116.41 2wh1 n GLY 78 Ca -0.44 -1.03 -0.22 0.00 0.00 0.00 0.00 46.02 44.32 2wh1 n GLY 78 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2wh1 n ARG 79 N 0.00 2.16 0.00 1.61 1.85 -1.26 -4.75 116.66 116.27 2wh1 n ARG 79 Ca 0.00 -4.14 0.00 0.00 -1.00 0.00 0.00 57.85 52.71 2wh1 n ARG 79 Cb 0.00 -1.97 0.00 0.00 -1.05 0.00 0.00 32.46 29.44 2wh1 n ARG 79 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wh1 n GLY 80 N -0.01 2.89 0.00 2.89 0.00 -1.26 -4.84 105.19 104.86 2wh1 n GLY 80 Ca 0.28 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2wh1 n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wh1 n GLY 81 N 0.00 0.00 0.20 -0.02 0.00 -1.26 -5.07 105.19 99.04 2wh1 n GLY 81 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2wh1 n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wh1 n GLU 82 N 0.00 0.55 0.24 1.61 4.71 -1.15 -3.75 120.64 122.85 2wh1 n GLU 82 Ca 0.00 0.23 -0.15 0.00 -0.01 0.00 0.00 57.16 57.22 2wh1 n GLU 82 Cb 0.00 -1.42 -0.08 0.00 -1.01 0.00 0.00 31.44 28.93 2wh1 n GLU 82 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 2wh1 h ARG 83 N -0.79 -0.56 -0.31 3.49 9.65 -1.14 0.77 114.38 125.49 2wh1 h ARG 83 Ca -0.64 0.04 0.09 0.00 -1.10 0.00 0.00 59.98 58.37 2wh1 h ARG 83 Cb 1.60 0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 30.30 2wh1 h ARG 83 CO -0.35 -0.37 0.26 0.97 2.80 0.00 0.00 179.97 183.27 2wh1 h ILE 84 N -0.58 0.65 0.11 1.20 2.10 -1.41 -0.49 117.51 119.10 2wh1 h ILE 84 Ca -0.05 0.00 -0.30 0.00 1.08 0.00 0.00 64.86 65.59 2wh1 h ILE 84 Cb 0.46 0.81 -0.01 0.00 -1.09 0.00 0.00 36.82 36.99 2wh1 h ILE 84 CO 0.07 0.00 -1.49 -0.09 -1.08 0.00 0.00 178.15 175.56 2wh1 h ARG 85 N 0.00 0.24 0.00 2.19 9.65 -1.33 -3.08 114.38 122.04 2wh1 h ARG 85 Ca 0.15 -0.41 -0.11 0.00 -1.10 0.00 0.00 59.98 58.51 2wh1 h ARG 85 Cb 0.66 0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 29.38 2wh1 h ARG 85 CO -0.00 1.10 -0.51 -0.39 2.80 0.00 0.00 179.97 182.98 2wh1 h VAL 86 N 0.06 1.11 0.00 0.20 -1.51 0.17 -3.19 116.25 113.10 2wh1 h VAL 86 Ca -0.23 -1.91 -0.03 0.00 -1.23 0.00 0.00 66.70 63.31 2wh1 h VAL 86 Cb 2.00 2.11 0.00 0.00 -2.13 0.00 0.00 31.29 33.28 2wh1 h VAL 86 CO 0.16 0.50 -0.11 -0.07 -1.23 0.00 0.00 177.57 176.82 2wh1 h LEU 87 N 0.00 0.09 -1.99 4.19 3.38 -1.24 -2.79 115.31 116.95 2wh1 h LEU 87 Ca -0.01 -0.81 0.34 0.00 0.09 0.00 0.00 57.88 57.49 2wh1 h LEU 87 Cb 1.07 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.74 2wh1 h LEU 87 CO 0.07 0.89 0.84 0.03 0.09 0.00 0.00 178.44 180.35 2wh1 h ARG 88 N -0.69 0.00 0.32 1.13 3.08 -1.60 0.84 114.38 117.45 2wh1 h ARG 88 Ca -0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 2wh1 h ARG 88 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.96 2wh1 h ARG 88 CO 0.02 0.00 -0.15 1.49 -1.07 0.00 0.00 179.97 180.26 2wh1 h GLU 89 N 0.00 -0.41 0.21 0.04 4.57 -1.50 -2.92 114.58 114.57 2wh1 h GLU 89 Ca 0.55 0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.75 2wh1 h GLU 89 Cb 2.23 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 30.91 2wh1 h GLU 89 CO -0.01 -0.15 -0.14 0.93 -1.18 0.00 0.00 179.01 178.46 2wh1 h GLU 90 N -0.63 -0.34 -0.50 1.92 4.39 0.89 -2.87 114.58 117.45 2wh1 h GLU 90 Ca -0.04 0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.78 2wh1 h GLU 90 Cb 0.45 0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 29.08 2wh1 h GLU 90 CO 0.07 -0.23 -0.19 -0.07 -1.16 0.00 0.00 179.01 177.43 2wh1 h LEU 91 N -0.35 -0.67 -1.31 1.33 3.38 -1.23 0.25 115.31 116.71 2wh1 h LEU 91 Ca -0.02 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2wh1 h LEU 91 Cb 0.30 0.39 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2wh1 h LEU 91 CO 0.01 -0.22 0.00 0.00 0.09 0.00 0.00 178.44 178.32 2wh1 h ALA 92 N 1.31 1.00 0.00 1.53 0.00 -1.45 -2.89 119.26 118.76 2wh1 h ALA 92 Ca 0.24 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2wh1 h ALA 92 Cb 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2wh1 h ALA 92 CO -0.55 0.00 -0.03 0.87 0.00 0.00 0.00 179.25 179.54 2wh1 h LYS 93 N 0.00 0.00 -0.01 0.00 1.57 -0.26 -2.47 116.57 115.40 2wh1 h LYS 93 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wh1 h LYS 93 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2wh1 h LYS 93 CO 0.00 0.03 -0.15 1.47 -0.57 0.00 0.00 179.45 180.22 2wh1 n LEU 94 N -3.31 1.32 -3.59 2.94 -0.00 -1.09 -4.94 117.00 108.33 2wh1 n LEU 94 Ca -0.02 -0.82 -0.15 0.00 -0.00 0.00 0.00 56.01 55.02 2wh1 n LEU 94 Cb 0.15 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.44 2wh1 n LEU 94 CO 0.25 0.26 -0.16 -0.89 -0.00 0.00 0.00 177.39 176.85 2wh1 s THR 95 N -1.20 -0.39 0.00 1.47 2.01 -0.93 -5.01 115.64 111.59 2wh1 s THR 95 Ca 0.09 0.15 -0.02 0.00 0.31 0.00 0.00 61.69 62.22 2wh1 s THR 95 Cb 0.08 -0.52 -0.08 0.00 0.01 0.00 0.00 72.50 71.98 2wh1 s THR 95 CO 0.21 0.01 1.96 0.61 -0.69 0.00 0.00 174.62 176.73 2wh1 n GLY 96 N 5.34 2.12 3.14 4.40 0.00 -1.26 -4.48 105.19 114.44 2wh1 n GLY 96 Ca -0.06 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.37 2wh1 n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wh1 n LYS 97 N 2.09 0.83 -2.45 1.61 5.02 -1.26 -5.03 118.16 118.97 2wh1 n LYS 97 Ca 0.13 -2.85 -0.38 0.00 -2.02 0.00 0.00 58.31 53.19 2wh1 n LYS 97 Cb 0.48 0.33 -0.03 0.00 -0.02 0.00 0.00 35.03 35.79 2wh1 n LYS 97 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2wh1 s ASN 98 N -3.65 6.27 -1.31 4.39 3.84 -1.20 -4.89 114.94 118.39 2wh1 s ASN 98 Ca 0.24 -1.70 -0.12 0.00 0.21 0.00 0.00 52.86 51.49 2wh1 s ASN 98 Cb -0.02 -2.57 -0.05 0.00 -0.55 0.00 0.00 41.25 38.05 2wh1 s ASN 98 CO 0.15 -1.73 2.43 1.33 -2.79 0.00 0.00 177.10 176.49 2wh1 n VAL 99 N 6.96 3.33 -0.26 -5.21 0.24 -1.26 -2.16 118.33 119.96 2wh1 n VAL 99 Ca 0.41 -2.34 -0.11 0.00 -2.04 0.00 0.00 64.34 60.25 2wh1 n VAL 99 Cb 0.48 -2.48 0.11 0.00 -1.47 0.00 0.00 33.84 30.48 2wh1 n VAL 99 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wh1 n ALA 100 N 5.02 -1.77 0.00 2.33 0.00 -1.19 -4.88 120.51 120.03 2wh1 n ALA 100 Ca 0.60 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2wh1 n ALA 100 Cb 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.68 2wh1 n ALA 100 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2wh1 n LEU 101 N 0.00 0.00 -4.97 0.00 0.00 -1.20 -4.69 117.00 106.13 2wh1 n LEU 101 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 56.01 55.79 2wh1 n LEU 101 Cb 0.22 0.00 0.17 0.00 0.00 0.00 0.00 43.42 43.82 2wh1 n LEU 101 CO 0.15 0.00 0.76 0.20 0.00 0.00 0.00 177.39 178.50 2wh1 s ASN 102 N 0.00 3.37 -0.46 1.96 0.01 -1.21 -4.97 114.94 113.63 2wh1 s ASN 102 Ca 0.00 -0.13 0.06 0.00 -0.71 0.00 0.00 52.86 52.09 2wh1 s ASN 102 Cb 0.00 0.05 0.29 0.00 0.41 0.00 0.00 41.25 42.00 2wh1 s ASN 102 CO 0.00 -2.54 1.00 0.52 -1.51 0.00 0.00 177.10 174.57 2wh1 n VAL 103 N -3.47 -0.03 0.00 1.60 0.31 -1.26 -3.61 118.33 111.88 2wh1 n VAL 103 Ca 0.17 -1.73 0.00 0.00 -0.01 0.00 0.00 64.34 62.77 2wh1 n VAL 103 Cb 0.60 1.30 0.00 0.00 -0.91 0.00 0.00 33.84 34.83 2wh1 n VAL 103 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wh1 n GLN 104 N 0.86 -1.84 -1.39 5.55 1.13 -1.22 -4.82 117.38 115.66 2wh1 n GLN 104 Ca 0.08 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 2wh1 n GLN 104 Cb 0.67 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.02 2wh1 n GLN 104 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2wh1 n GLU 105 N -1.92 0.00 -3.76 -1.09 2.13 -1.24 -3.05 120.64 111.71 2wh1 n GLU 105 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 2wh1 n GLU 105 Cb 0.00 0.00 -0.18 0.00 0.27 0.00 0.00 31.44 31.53 2wh1 n GLU 105 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2wh1 s VAL 106 N -2.53 0.19 -0.66 6.31 1.01 -0.71 -4.58 120.40 119.42 2wh1 s VAL 106 Ca 0.00 0.22 0.20 0.00 0.00 0.00 0.00 61.98 62.40 2wh1 s VAL 106 Cb 0.00 -0.37 0.20 0.00 0.00 0.00 0.00 36.38 36.20 2wh1 s VAL 106 CO 0.00 0.22 1.61 0.00 0.00 0.00 0.00 175.10 176.93 2wh1 n GLN 107 N 5.07 0.12 -3.14 2.72 3.00 -1.26 -4.37 117.38 119.52 2wh1 n GLN 107 Ca -0.08 0.37 0.04 0.00 -0.01 0.00 0.00 57.00 57.32 2wh1 n GLN 107 Cb 0.50 -1.74 -0.00 0.00 0.00 0.00 0.00 30.24 29.00 2wh1 n GLN 107 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 2wh1 s ASN 108 N -3.78 -1.26 0.42 1.08 3.84 -1.26 -5.02 114.94 108.95 2wh1 s ASN 108 Ca 0.05 0.05 0.30 0.00 0.21 0.00 0.00 52.86 53.47 2wh1 s ASN 108 Cb 0.09 1.77 1.37 0.00 -0.55 0.00 0.00 41.25 43.93 2wh1 s ASN 108 CO 0.34 -0.22 1.89 -0.65 -2.79 0.00 0.00 177.10 175.67 2wh1 h PRO 109 N 7.63 0.00 -1.24 0.43 0.11 -1.95 -2.81 132.00 134.18 2wh1 h PRO 109 Ca -0.03 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.82 2wh1 h PRO 109 Cb 1.19 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.16 2wh1 h PRO 109 CO 0.07 0.00 0.34 0.09 -0.21 0.00 0.00 178.00 178.29 2wh1 n ASN 110 N -2.63 4.64 -0.58 -2.05 3.02 -1.26 -2.41 115.26 113.99 2wh1 n ASN 110 Ca 0.00 -2.85 -0.00 0.00 -0.03 0.00 0.00 54.58 51.70 2wh1 n ASN 110 Cb 0.19 -0.83 -0.00 0.00 -0.61 0.00 0.00 39.78 38.53 2wh1 n ASN 110 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wh1 n LEU 111 N 0.04 0.01 -3.47 3.41 4.77 -1.06 -4.33 117.00 116.37 2wh1 n LEU 111 Ca 0.27 -1.11 -0.29 0.00 -0.03 0.00 0.00 56.01 54.85 2wh1 n LEU 111 Cb 0.83 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.80 2wh1 n LEU 111 CO 0.31 0.65 -0.32 -0.55 -1.33 0.00 0.00 177.39 176.15 2wh1 s SER 112 N -0.63 2.95 0.15 -1.43 0.15 -1.01 -5.02 113.70 108.86 2wh1 s SER 112 Ca 0.02 -2.22 -0.27 0.00 0.70 0.00 0.00 55.95 54.17 2wh1 s SER 112 Cb 0.02 -0.42 -0.04 0.00 -1.71 0.00 0.00 66.02 63.87 2wh1 s SER 112 CO -0.01 -0.30 1.41 0.00 1.20 0.00 0.00 173.24 175.54 2wh1 n ALA 113 N 4.00 -0.54 -0.39 5.45 0.00 -1.26 -0.62 120.51 127.15 2wh1 n ALA 113 Ca 0.12 0.79 0.34 0.00 0.00 0.00 0.00 53.44 54.69 2wh1 n ALA 113 Cb 0.37 -0.15 0.52 0.00 0.00 0.00 0.00 19.45 20.18 2wh1 n ALA 113 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2wh1 n PRO 114 N -5.16 0.01 -0.09 0.00 -0.02 -1.26 0.52 135.00 128.99 2wh1 n PRO 114 Ca 0.03 0.85 -0.12 0.00 -2.02 0.00 0.00 63.50 62.24 2wh1 n PRO 114 Cb 0.25 -2.05 -0.06 0.00 -0.02 0.00 0.00 33.50 31.63 2wh1 n PRO 114 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wh1 n LEU 115 N -3.23 1.84 -0.35 2.45 4.77 0.21 -3.63 117.00 119.06 2wh1 n LEU 115 Ca 0.28 0.54 0.25 0.00 -0.03 0.00 0.00 56.01 57.04 2wh1 n LEU 115 Cb 1.45 -0.91 0.50 0.00 -2.33 0.00 0.00 43.42 42.14 2wh1 n LEU 115 CO 0.28 -0.14 1.18 0.58 -1.33 0.00 0.00 177.39 177.97 2wh1 h VAL 116 N -1.00 0.39 0.31 4.08 2.07 0.31 0.34 116.25 122.76 2wh1 h VAL 116 Ca -0.16 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2wh1 h VAL 116 Cb 0.88 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2wh1 h VAL 116 CO -0.10 0.06 -0.17 0.00 0.02 0.00 0.00 177.57 177.38 2wh1 h ALA 117 N 1.70 -1.07 -1.00 1.67 0.00 -0.56 -2.71 119.26 117.29 2wh1 h ALA 117 Ca 0.68 -0.10 0.30 0.00 0.00 0.00 0.00 54.91 55.80 2wh1 h ALA 117 Cb 1.70 0.25 -0.14 0.00 0.00 0.00 0.00 17.79 19.60 2wh1 h ALA 117 CO -0.44 -1.04 0.57 1.96 0.00 0.00 0.00 179.25 180.30 2wh1 h GLN 118 N -0.45 0.39 0.25 0.00 4.20 -1.06 0.66 115.11 119.11 2wh1 h GLN 118 Ca -0.04 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 2wh1 h GLN 118 Cb 0.35 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 2wh1 h GLN 118 CO 0.05 0.26 -0.38 -0.09 -0.67 0.00 0.00 178.83 178.00 2wh1 h ARG 119 N 0.40 -0.64 -1.00 1.46 2.43 -1.00 0.01 114.38 116.04 2wh1 h ARG 119 Ca 0.70 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.96 2wh1 h ARG 119 Cb 1.53 0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 31.16 2wh1 h ARG 119 CO -0.57 -0.43 0.65 0.28 -1.51 0.00 0.00 179.97 178.39 2wh1 h VAL 120 N -0.67 1.15 -0.55 0.20 2.07 -0.96 -1.19 116.25 116.31 2wh1 h VAL 120 Ca -0.03 -0.42 0.10 0.00 0.82 0.00 0.00 66.70 67.17 2wh1 h VAL 120 Cb 0.61 -0.20 -0.11 0.00 -1.52 0.00 0.00 31.29 30.08 2wh1 h VAL 120 CO -0.12 0.23 -0.28 0.00 0.02 0.00 0.00 177.57 177.42 2wh1 h ALA 121 N 1.42 0.05 0.19 1.67 0.00 -0.30 0.37 119.26 122.66 2wh1 h ALA 121 Ca 0.41 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.48 2wh1 h ALA 121 Cb 0.05 0.67 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2wh1 h ALA 121 CO -0.14 -0.62 -0.14 0.93 0.00 0.00 0.00 179.25 179.28 2wh1 h GLU 122 N -0.14 -0.31 -0.78 0.00 5.08 0.13 -2.68 114.58 115.88 2wh1 h GLU 122 Ca 0.24 0.02 0.29 0.00 -1.00 0.00 0.00 59.36 58.91 2wh1 h GLU 122 Cb 0.52 0.07 -0.14 0.00 0.50 0.00 0.00 28.75 29.70 2wh1 h GLU 122 CO -0.63 -0.20 0.29 1.04 -1.00 0.00 0.00 179.01 178.50 2wh1 n GLN 123 N -3.14 -0.05 0.17 2.33 6.02 -0.62 0.13 117.38 122.21 2wh1 n GLN 123 Ca -0.04 1.10 -0.14 0.00 -0.01 0.00 0.00 57.00 57.91 2wh1 n GLN 123 Cb 0.14 -1.90 -0.08 0.00 1.02 0.00 0.00 30.24 29.42 2wh1 n GLN 123 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2wh1 h ILE 124 N 0.00 0.76 0.00 5.09 2.04 -0.70 -0.70 117.51 123.99 2wh1 h ILE 124 Ca 0.60 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 66.33 2wh1 h ILE 124 Cb 1.49 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 2wh1 h ILE 124 CO -0.64 0.03 0.00 -0.62 0.00 0.00 0.00 178.15 176.92 2wh1 n GLU 125 N -5.22 0.09 0.00 2.37 1.02 0.34 -0.58 120.64 118.66 2wh1 n GLU 125 Ca -0.10 0.42 0.13 0.00 -0.02 0.00 0.00 57.16 57.60 2wh1 n GLU 125 Cb 0.18 -1.71 0.42 0.00 -0.02 0.00 0.00 31.44 30.31 2wh1 n GLU 125 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2wh1 n ARG 126 N -1.89 0.96 -2.86 3.49 1.74 0.59 -4.95 116.66 113.74 2wh1 n ARG 126 Ca 0.02 -0.55 -0.10 0.00 -0.77 0.00 0.00 57.85 56.44 2wh1 n ARG 126 Cb 0.14 -1.49 0.05 0.00 -1.02 0.00 0.00 32.46 30.14 2wh1 n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2wh1 n ARG 127 N -0.53 -3.83 -3.31 5.56 3.00 0.25 -5.03 116.66 112.77 2wh1 n ARG 127 Ca 0.13 0.46 -0.21 0.00 -0.01 0.00 0.00 57.85 58.22 2wh1 n ARG 127 Cb 0.34 -4.35 -0.00 0.00 0.00 0.00 0.00 32.46 28.45 2wh1 n ARG 127 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2wh1 s PHE 128 N -3.19 3.25 -0.70 -1.55 0.40 -0.72 -4.98 117.98 110.49 2wh1 s PHE 128 Ca 0.08 0.07 -0.26 0.00 -0.60 0.00 0.00 56.93 56.22 2wh1 s PHE 128 Cb -0.03 -2.07 -0.08 0.00 0.51 0.00 0.00 43.02 41.34 2wh1 s PHE 128 CO 0.40 -0.09 2.25 0.00 0.70 0.00 0.00 175.22 178.48 2wh1 s ALA 129 N -2.33 1.35 0.59 5.36 0.00 -1.26 -4.77 121.76 120.70 2wh1 s ALA 129 Ca 0.44 -0.66 0.30 0.00 0.00 0.00 0.00 51.96 52.05 2wh1 s ALA 129 Cb -0.10 -4.47 1.28 0.00 0.00 0.00 0.00 23.12 19.83 2wh1 s ALA 129 CO 0.34 -5.01 1.62 0.28 0.00 0.00 0.00 175.76 172.99 2wh1 h VAL 130 N 7.50 0.18 0.04 0.00 2.07 -1.94 0.44 116.25 124.55 2wh1 h VAL 130 Ca -0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2wh1 h VAL 130 Cb 1.10 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2wh1 h VAL 130 CO 1.12 0.00 -0.02 -0.09 0.02 0.00 0.00 177.57 178.60 2wh1 h ARG 131 N 0.00 -0.05 -0.46 1.57 9.65 -1.98 -3.27 114.38 119.84 2wh1 h ARG 131 Ca 0.42 0.00 0.12 0.00 -1.10 0.00 0.00 59.98 59.43 2wh1 h ARG 131 Cb 2.22 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 30.79 2wh1 h ARG 131 CO -0.00 -0.03 0.33 0.07 2.80 0.00 0.00 179.97 183.13 2wh1 h ARG 132 N -0.21 0.05 0.00 0.20 0.11 -1.84 0.61 114.38 113.30 2wh1 h ARG 132 Ca -0.00 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2wh1 h ARG 132 Cb 0.04 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.11 2wh1 h ARG 132 CO 0.01 0.03 0.03 0.00 0.10 0.00 0.00 179.97 180.14 2wh1 n ALA 133 N -2.61 1.00 -0.12 0.08 0.00 0.15 0.53 120.51 119.54 2wh1 n ALA 133 Ca 0.08 0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 2wh1 n ALA 133 Cb 0.50 -1.24 -0.09 0.00 0.00 0.00 0.00 19.45 18.63 2wh1 n ALA 133 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2wh1 n ILE 134 N -2.16 1.27 -0.32 0.00 2.08 0.20 -3.23 119.36 117.20 2wh1 n ILE 134 Ca -0.01 -0.35 0.17 0.00 0.56 0.00 0.00 62.75 63.11 2wh1 n ILE 134 Cb 0.06 -1.74 0.36 0.00 -0.75 0.00 0.00 39.64 37.57 2wh1 n ILE 134 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2wh1 h LYS 135 N -0.71 0.41 0.12 0.38 1.79 -0.03 -1.58 116.57 116.95 2wh1 h LYS 135 Ca -0.58 -0.02 -0.19 0.00 -2.18 0.00 0.00 60.65 57.68 2wh1 h LYS 135 Cb 1.55 -0.09 0.01 0.00 -1.58 0.00 0.00 32.23 32.12 2wh1 h LYS 135 CO -0.32 0.27 -0.87 1.96 -1.08 0.00 0.00 179.45 179.41 2wh1 h GLN 136 N 0.42 0.25 0.00 3.15 4.20 -0.13 -0.86 115.11 122.14 2wh1 h GLN 136 Ca 0.62 -0.42 0.00 0.00 0.06 0.00 0.00 58.65 58.91 2wh1 h GLN 136 Cb 1.23 0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.17 2wh1 h GLN 136 CO -0.54 1.20 0.12 0.00 -0.67 0.00 0.00 178.83 178.94 2wh1 n ALA 137 N -2.75 0.84 -0.09 3.87 0.00 -0.80 -1.02 120.51 120.55 2wh1 n ALA 137 Ca -0.16 0.11 -0.19 0.00 0.00 0.00 0.00 53.44 53.19 2wh1 n ALA 137 Cb 0.80 -0.98 -0.07 0.00 0.00 0.00 0.00 19.45 19.20 2wh1 n ALA 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wh1 n VAL 138 N -1.89 1.04 0.00 0.00 0.31 -0.66 -4.09 118.33 113.03 2wh1 n VAL 138 Ca -0.01 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 2wh1 n VAL 138 Cb 0.14 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.45 2wh1 n VAL 138 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2wh1 n GLN 139 N -3.68 0.00 0.00 5.55 -0.06 -0.33 -0.67 117.38 118.20 2wh1 n GLN 139 Ca -0.36 0.44 0.00 0.00 -2.00 0.00 0.00 57.00 55.08 2wh1 n GLN 139 Cb 0.78 -1.53 0.00 0.00 -4.06 0.00 0.00 30.24 25.44 2wh1 n GLN 139 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2wh1 n ARG 140 N -1.44 0.00 -0.34 3.69 0.63 -0.19 -2.58 116.66 116.43 2wh1 n ARG 140 Ca 0.00 0.24 0.30 0.00 -0.92 0.00 0.00 57.85 57.47 2wh1 n ARG 140 Cb 0.03 -0.70 0.63 0.00 0.45 0.00 0.00 32.46 32.86 2wh1 n ARG 140 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2wh1 h VAL 141 N 0.00 0.42 0.09 5.15 2.07 -1.61 0.28 116.25 122.65 2wh1 h VAL 141 Ca 0.00 -0.07 -0.27 0.00 0.82 0.00 0.00 66.70 67.18 2wh1 h VAL 141 Cb 0.00 0.21 0.03 0.00 -1.52 0.00 0.00 31.29 30.00 2wh1 h VAL 141 CO 0.00 0.04 -1.11 0.24 0.02 0.00 0.00 177.57 176.76 2wh1 h MET 142 N 0.20 0.59 -0.35 1.57 2.86 -1.08 -3.20 114.93 115.52 2wh1 h MET 142 Ca 0.62 -0.76 -0.03 0.00 -2.06 0.00 0.00 59.70 57.46 2wh1 h MET 142 Cb 1.97 0.24 -0.02 0.00 0.06 0.00 0.00 31.60 33.86 2wh1 h MET 142 CO -0.19 1.33 0.07 1.49 1.06 0.00 0.00 176.91 180.67 2wh1 h GLU 143 N 0.20 0.51 -1.60 1.72 4.81 -0.33 -2.16 114.58 117.73 2wh1 h GLU 143 Ca -0.16 -0.09 -0.57 0.00 -0.13 0.00 0.00 59.36 58.41 2wh1 h GLU 143 Cb 1.79 -0.09 -0.22 0.00 0.63 0.00 0.00 28.75 30.86 2wh1 h GLU 143 CO 0.21 0.49 0.70 -1.13 -0.73 0.00 0.00 179.01 178.55 2wh1 n SER 144 N -4.33 7.08 -1.94 1.04 3.41 0.49 -4.97 113.62 114.40 2wh1 n SER 144 Ca 0.02 -3.49 0.00 0.00 -0.26 0.00 0.00 58.87 55.14 2wh1 n SER 144 Cb 0.19 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.06 2wh1 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wh1 n GLY 145 N -0.10 -4.19 0.00 5.00 0.00 -0.81 -4.94 105.19 100.15 2wh1 n GLY 145 Ca 0.50 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2wh1 n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wh1 n ALA 146 N 1.31 0.00 1.13 4.61 0.00 -1.25 -4.77 120.51 121.54 2wh1 n ALA 146 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2wh1 n ALA 146 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 2wh1 n ALA 146 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wh1 n LYS 147 N 0.00 0.57 0.00 0.00 4.76 -1.06 -4.76 118.16 117.67 2wh1 n LYS 147 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2wh1 n LYS 147 Cb 0.00 -1.07 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 2wh1 n LYS 147 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wh1 n GLY 148 N 0.07 2.09 3.34 0.72 0.00 -1.23 -0.59 105.19 109.60 2wh1 n GLY 148 Ca 0.02 0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 2wh1 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wh1 s ALA 149 N -0.39 1.88 0.00 4.61 0.00 0.17 -0.24 121.76 127.79 2wh1 s ALA 149 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.14 2wh1 s ALA 149 Cb 0.00 0.57 0.00 0.00 0.00 0.00 0.00 23.12 23.69 2wh1 s ALA 149 CO 0.00 -0.28 0.00 1.17 0.00 0.00 0.00 175.76 176.65 2wh1 n LYS 150 N -0.46 0.00 -4.73 0.00 4.81 -0.89 -2.81 118.16 114.08 2wh1 n LYS 150 Ca -0.04 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.14 2wh1 n LYS 150 Cb 0.64 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 35.53 2wh1 n LYS 150 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2wh1 s VAL 151 N 0.00 1.32 -0.10 3.15 1.01 -0.74 0.29 120.40 125.32 2wh1 s VAL 151 Ca 0.00 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.39 2wh1 s VAL 151 Cb 0.00 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.22 2wh1 s VAL 151 CO 0.00 0.39 -0.18 -0.63 0.00 0.00 0.00 175.10 174.69 2wh1 s ILE 152 N 0.40 1.64 0.09 2.22 1.01 0.69 -3.43 121.20 123.82 2wh1 s ILE 152 Ca -0.11 -0.75 0.05 0.00 0.00 0.00 0.00 60.65 59.85 2wh1 s ILE 152 Cb -0.14 -1.47 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 2wh1 s ILE 152 CO 0.04 0.47 -0.02 -0.69 0.00 0.00 0.00 174.94 174.73 2wh1 s VAL 153 N 0.76 3.88 0.00 2.92 1.01 0.15 -1.44 120.40 127.68 2wh1 s VAL 153 Ca -0.11 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 60.84 2wh1 s VAL 153 Cb -0.16 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.39 2wh1 s VAL 153 CO 0.02 0.13 0.00 -1.54 0.00 0.00 0.00 175.10 173.70 2wh1 n SER 154 N 0.63 0.00 -4.66 3.32 3.41 -1.00 -1.43 113.62 113.89 2wh1 n SER 154 Ca -0.11 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.21 2wh1 n SER 154 Cb 0.52 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.64 2wh1 n SER 154 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2wh1 s GLY 155 N -0.39 1.57 0.00 5.00 0.00 -0.98 -4.15 107.32 108.36 2wh1 s GLY 155 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.25 2wh1 s GLY 155 CO 0.00 0.14 0.00 0.54 0.00 0.00 0.00 173.10 173.78 2wh1 n ARG 156 N -4.09 0.00 -0.88 2.90 5.12 -1.26 -4.61 116.66 113.84 2wh1 n ARG 156 Ca 0.06 0.00 -0.26 0.00 -1.93 0.00 0.00 57.85 55.72 2wh1 n ARG 156 Cb 0.58 -2.42 -0.09 0.00 -1.16 0.00 0.00 32.46 29.37 2wh1 n ARG 156 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2wh1 n ILE 157 N -2.17 0.00 0.00 0.55 5.41 -1.26 0.28 119.36 122.17 2wh1 n ILE 157 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2wh1 n ILE 157 Cb 0.00 -0.30 0.00 0.00 -0.71 0.00 0.00 39.64 38.63 2wh1 n ILE 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wh1 n GLY 158 N 3.98 3.16 0.00 7.39 0.00 -1.26 -3.91 105.19 114.54 2wh1 n GLY 158 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2wh1 n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wh1 n GLY 159 N -1.79 0.91 3.76 -0.02 0.00 0.79 -5.09 105.19 103.76 2wh1 n GLY 159 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2wh1 n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wh1 s ALA 160 N -2.00 3.65 0.13 4.61 0.00 -1.25 -4.91 121.76 122.00 2wh1 s ALA 160 Ca 0.00 1.51 -0.30 0.00 0.00 0.00 0.00 51.96 53.17 2wh1 s ALA 160 Cb 0.00 -3.61 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 2wh1 s ALA 160 CO 0.00 -0.95 1.51 1.49 0.00 0.00 0.00 175.76 177.81 2wh1 h GLU 161 N 4.16 -0.22 -6.32 0.00 4.81 -1.96 -3.38 114.58 111.67 2wh1 h GLU 161 Ca -0.48 0.02 -0.55 0.00 -0.13 0.00 0.00 59.36 58.21 2wh1 h GLU 161 Cb 1.23 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.64 2wh1 h GLU 161 CO 0.73 -0.15 0.67 -1.14 -0.73 0.00 0.00 179.01 178.40 2wh1 s GLN 162 N -5.42 4.37 0.19 1.92 2.00 -1.26 -4.90 119.66 116.55 2wh1 s GLN 162 Ca -0.13 1.65 -0.30 0.00 -2.00 0.00 0.00 55.36 54.59 2wh1 s GLN 162 Cb 0.09 -3.54 -0.08 0.00 0.80 0.00 0.00 33.01 30.27 2wh1 s GLN 162 CO 0.58 -0.42 1.24 0.00 -0.50 0.00 0.00 175.29 176.18 2wh1 s ALA 163 N 2.10 3.47 0.17 1.58 0.00 -1.26 -4.65 121.76 123.17 2wh1 s ALA 163 Ca 0.55 1.01 0.06 0.00 0.00 0.00 0.00 51.96 53.58 2wh1 s ALA 163 Cb -0.24 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 2wh1 s ALA 163 CO 0.22 -0.43 -0.13 1.03 0.00 0.00 0.00 175.76 176.45 2wh1 s ARG 164 N -0.21 1.20 -0.30 0.00 0.52 -1.26 -4.77 118.95 114.14 2wh1 s ARG 164 Ca 0.54 -1.50 -0.06 0.00 -0.52 0.00 0.00 55.73 54.18 2wh1 s ARG 164 Cb -0.34 -0.93 0.02 0.00 0.52 0.00 0.00 34.95 34.22 2wh1 s ARG 164 CO 0.37 0.15 0.08 0.99 0.02 0.00 0.00 175.30 176.91 2wh1 s THR 165 N -3.00 3.87 -0.33 0.02 2.01 -1.26 -2.33 115.64 114.62 2wh1 s THR 165 Ca 0.19 -0.81 -0.19 0.00 0.31 0.00 0.00 61.69 61.20 2wh1 s THR 165 Cb -0.00 -3.03 -0.01 0.00 0.01 0.00 0.00 72.50 69.47 2wh1 s THR 165 CO 0.04 0.03 0.55 -0.70 -0.69 0.00 0.00 174.62 173.86 2wh1 s GLU 166 N 1.47 3.76 0.00 4.92 2.56 -0.51 -4.92 118.70 125.98 2wh1 s GLU 166 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.97 55.02 2wh1 s GLU 166 Cb -0.18 -3.77 0.00 0.00 2.00 0.00 0.00 34.13 32.19 2wh1 s GLU 166 CO 0.02 -0.60 0.00 1.87 -0.56 0.00 0.00 175.26 175.99 2wh1 n TRP 167 N 5.79 -1.76 0.00 5.30 -0.00 -1.26 0.34 117.44 125.84 2wh1 n TRP 167 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.47 2wh1 n TRP 167 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.80 2wh1 n TRP 167 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2wh1 n ALA 168 N -3.00 0.00 -3.82 5.87 0.00 -1.22 -4.89 120.51 113.45 2wh1 n ALA 168 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 2wh1 n ALA 168 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2wh1 n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wh1 s ALA 169 N 0.00 -1.06 0.18 0.00 0.00 -1.26 -1.79 121.76 117.84 2wh1 s ALA 169 Ca 0.00 -0.45 -0.16 0.00 0.00 0.00 0.00 51.96 51.35 2wh1 s ALA 169 Cb 0.00 0.82 0.03 0.00 0.00 0.00 0.00 23.12 23.96 2wh1 s ALA 169 CO 0.00 -1.02 0.47 -1.14 0.00 0.00 0.00 175.76 174.08 2wh1 s GLN 170 N -3.53 1.30 4.10 0.00 0.74 -1.12 -4.97 119.66 116.18 2wh1 s GLN 170 Ca 0.13 -0.87 0.00 0.00 0.05 0.00 0.00 55.36 54.67 2wh1 s GLN 170 Cb -0.06 0.50 0.00 0.00 1.10 0.00 0.00 33.01 34.55 2wh1 s GLN 170 CO 0.08 -0.54 0.00 0.41 -0.55 0.00 0.00 175.29 174.70 2wh1 n GLY 171 N -0.31 0.44 2.85 2.59 0.00 -1.26 -0.65 105.19 108.85 2wh1 n GLY 171 Ca -0.11 -0.94 -0.18 0.00 0.00 0.00 0.00 46.02 44.79 2wh1 n GLY 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wh1 s ARG 172 N 0.00 0.45 -0.36 1.61 0.52 0.24 -4.91 118.95 116.50 2wh1 s ARG 172 Ca 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 55.73 55.22 2wh1 s ARG 172 Cb 0.00 -0.56 0.14 0.00 0.52 0.00 0.00 34.95 35.05 2wh1 s ARG 172 CO 0.00 -0.10 0.22 0.08 0.02 0.00 0.00 175.30 175.52 2wh1 s VAL 173 N 0.87 0.28 -1.05 3.52 1.01 -1.26 -3.78 120.40 120.00 2wh1 s VAL 173 Ca -0.10 -1.86 -0.12 0.00 0.00 0.00 0.00 61.98 59.90 2wh1 s VAL 173 Cb -0.13 -1.22 0.22 0.00 0.00 0.00 0.00 36.38 35.26 2wh1 s VAL 173 CO -0.01 -1.00 1.11 -2.16 0.00 0.00 0.00 175.10 173.05 2wh1 s PRO 174 N 0.93 3.98 0.00 2.72 0.04 -1.26 -4.88 135.00 136.53 2wh1 s PRO 174 Ca 0.19 -2.75 0.12 0.00 0.04 0.00 0.00 61.00 58.60 2wh1 s PRO 174 Cb -0.21 -4.69 0.69 0.00 0.04 0.00 0.00 34.50 30.33 2wh1 s PRO 174 CO -0.00 -1.43 1.13 1.28 0.04 0.00 0.00 177.00 178.01 2wh1 n LEU 175 N 4.08 0.00 -0.81 -3.56 4.32 -1.26 -1.87 117.00 117.91 2wh1 n LEU 175 Ca 0.25 0.00 0.11 0.00 -0.02 0.00 0.00 56.01 56.35 2wh1 n LEU 175 Cb 0.43 -0.00 0.08 0.00 -1.62 0.00 0.00 43.42 42.30 2wh1 n LEU 175 CO 0.48 -0.00 0.55 1.41 -1.22 0.00 0.00 177.39 178.60 2wh1 n HIS 176 N -1.00 0.00 -3.74 -1.77 8.25 -1.26 -4.85 115.22 110.84 2wh1 n HIS 176 Ca 0.09 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.17 2wh1 n HIS 176 Cb 0.04 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.03 2wh1 n HIS 176 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2wh1 s THR 177 N -1.88 4.05 0.00 1.59 2.01 -0.78 -5.02 115.64 115.60 2wh1 s THR 177 Ca 0.24 -0.70 0.00 0.00 0.31 0.00 0.00 61.69 61.54 2wh1 s THR 177 Cb 0.18 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 69.58 2wh1 s THR 177 CO 0.31 0.05 0.94 0.18 -0.69 0.00 0.00 174.62 175.41 2wh1 n LEU 178 N 4.88 0.00 -3.47 4.42 7.99 -1.26 -3.52 117.00 126.04 2wh1 n LEU 178 Ca -0.14 0.94 -0.30 0.00 -0.01 0.00 0.00 56.01 56.50 2wh1 n LEU 178 Cb 0.48 -0.44 -0.08 0.00 -0.11 0.00 0.00 43.42 43.26 2wh1 n LEU 178 CO 0.32 -0.44 1.24 -2.11 -1.51 0.00 0.00 177.39 174.88 2wh1 n ARG 179 N -2.17 0.00 0.00 3.23 1.85 -1.26 -3.67 116.66 114.64 2wh1 n ARG 179 Ca 0.00 -0.76 0.00 0.00 -1.00 0.00 0.00 57.85 56.09 2wh1 n ARG 179 Cb 0.00 -2.19 0.00 0.00 -1.05 0.00 0.00 32.46 29.22 2wh1 n ARG 179 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wh1 n ALA 180 N 7.45 0.00 -1.65 2.89 0.00 -1.23 -4.09 120.51 123.88 2wh1 n ALA 180 Ca 0.32 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.70 2wh1 n ALA 180 Cb 0.31 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.77 2wh1 n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wh1 n ASN 181 N 0.00 -2.23 -4.64 0.00 5.15 -1.24 -3.89 115.26 108.40 2wh1 n ASN 181 Ca 0.00 0.06 -0.34 0.00 -0.60 0.00 0.00 54.58 53.71 2wh1 n ASN 181 Cb 0.11 -0.57 -0.10 0.00 -0.53 0.00 0.00 39.78 38.69 2wh1 n ASN 181 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2wh1 s ILE 182 N -0.43 4.03 -0.30 -1.44 1.01 -1.26 -2.13 121.20 120.68 2wh1 s ILE 182 Ca 0.05 -0.45 -0.14 0.00 0.00 0.00 0.00 60.65 60.12 2wh1 s ILE 182 Cb -0.01 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2wh1 s ILE 182 CO 0.12 0.53 0.33 -0.62 0.00 0.00 0.00 174.94 175.31 2wh1 s ASP 183 N -1.06 6.17 -0.24 3.58 3.68 0.32 -4.87 116.67 124.25 2wh1 s ASP 183 Ca 0.15 -0.01 -0.11 0.00 2.13 0.00 0.00 52.55 54.71 2wh1 s ASP 183 Cb -0.11 -2.19 -0.05 0.00 -1.45 0.00 0.00 42.92 39.12 2wh1 s ASP 183 CO 0.04 -0.23 0.19 -0.47 0.13 0.00 0.00 175.17 174.83 2wh1 s TYR 184 N 1.98 3.32 -0.11 -5.34 5.04 -1.26 -0.77 117.35 120.22 2wh1 s TYR 184 Ca 0.12 0.26 0.02 0.00 -2.44 0.00 0.00 57.07 55.02 2wh1 s TYR 184 Cb -0.16 -2.30 0.02 0.00 0.35 0.00 0.00 41.96 39.86 2wh1 s TYR 184 CO 0.11 0.05 -0.15 0.20 -1.34 0.00 0.00 175.55 174.42 2wh1 s GLY 185 N 1.09 1.02 -0.01 8.97 0.00 0.28 -4.36 107.32 114.31 2wh1 s GLY 185 Ca 0.09 -0.71 0.04 0.00 0.00 0.00 0.00 44.72 44.13 2wh1 s GLY 185 CO 0.05 0.26 -0.13 -0.12 0.00 0.00 0.00 173.10 173.17 2wh1 s PHE 186 N 1.02 1.15 -0.21 1.90 5.36 -1.25 -0.30 117.98 125.65 2wh1 s PHE 186 Ca -0.06 -0.23 -0.26 0.00 -0.96 0.00 0.00 56.93 55.41 2wh1 s PHE 186 Cb -0.15 -0.75 0.07 0.00 -0.34 0.00 0.00 43.02 41.85 2wh1 s PHE 186 CO -0.02 -0.04 0.70 0.00 -1.46 0.00 0.00 175.22 174.40 2wh1 s ALA 187 N -0.21 -1.76 0.71 11.12 0.00 -0.92 -4.92 121.76 125.79 2wh1 s ALA 187 Ca 0.03 1.82 -0.11 0.00 0.00 0.00 0.00 51.96 53.70 2wh1 s ALA 187 Cb -0.06 -0.86 0.02 0.00 0.00 0.00 0.00 23.12 22.22 2wh1 s ALA 187 CO -0.00 -0.34 1.08 -0.51 0.00 0.00 0.00 175.76 175.98 2wh1 s LEU 188 N -0.04 2.93 -0.46 0.00 2.01 -1.26 -2.56 118.68 119.29 2wh1 s LEU 188 Ca -0.03 1.32 0.06 0.00 0.01 0.00 0.00 54.13 55.49 2wh1 s LEU 188 Cb -0.04 -4.14 0.19 0.00 0.01 0.00 0.00 46.19 42.22 2wh1 s LEU 188 CO 0.03 -1.44 0.56 0.00 1.01 0.00 0.00 176.35 176.51 2wh1 n ALA 189 N -3.09 0.47 -2.01 4.21 0.00 -1.24 -4.84 120.51 114.01 2wh1 n ALA 189 Ca 0.07 -2.09 -0.41 0.00 0.00 0.00 0.00 53.44 51.00 2wh1 n ALA 189 Cb 0.56 -1.12 -0.04 0.00 0.00 0.00 0.00 19.45 18.85 2wh1 n ALA 189 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2wh1 s ARG 190 N 0.39 4.53 0.22 0.00 1.70 -1.26 -2.84 118.95 121.69 2wh1 s ARG 190 Ca 0.32 1.84 0.01 0.00 -0.47 0.00 0.00 55.73 57.43 2wh1 s ARG 190 Cb 0.04 -3.24 -0.00 0.00 -0.57 0.00 0.00 34.95 31.18 2wh1 s ARG 190 CO -0.13 -0.02 0.03 0.25 -1.08 0.00 0.00 175.30 174.35 2wh1 n THR 191 N 2.27 0.00 0.10 4.99 -2.24 0.18 -4.87 114.28 114.71 2wh1 n THR 191 Ca 0.03 -1.15 -0.00 0.00 -2.27 0.00 0.00 64.05 60.66 2wh1 n THR 191 Cb 0.45 0.31 0.29 0.00 -2.10 0.00 0.00 70.33 69.28 2wh1 n THR 191 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2wh1 h THR 192 N 1.21 1.26 0.00 4.28 2.02 -1.98 -3.14 112.91 116.56 2wh1 h THR 192 Ca -0.18 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 65.78 2wh1 h THR 192 Cb 0.60 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 2wh1 h THR 192 CO 0.29 0.37 -1.60 0.00 0.37 0.00 0.00 175.52 174.95 2wh1 n TYR 193 N -4.13 0.30 -3.64 3.16 0.18 -1.26 -5.08 117.16 106.69 2wh1 n TYR 193 Ca -0.01 0.09 0.00 0.00 1.88 0.00 0.00 57.90 59.86 2wh1 n TYR 193 Cb 0.39 -0.61 0.00 0.00 -0.38 0.00 0.00 39.34 38.74 2wh1 n TYR 193 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2wh1 n GLY 194 N 1.25 -0.82 3.87 -7.48 0.00 -1.19 -5.15 105.19 95.68 2wh1 n GLY 194 Ca -0.02 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 2wh1 n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wh1 s VAL 195 N -3.00 5.06 0.39 1.61 1.01 -1.26 0.50 120.40 124.72 2wh1 s VAL 195 Ca 0.00 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.46 2wh1 s VAL 195 Cb 0.00 -3.48 -0.06 0.00 0.00 0.00 0.00 36.38 32.84 2wh1 s VAL 195 CO 0.00 0.10 0.04 -0.76 0.00 0.00 0.00 175.10 174.48 2wh1 s LEU 196 N -2.56 2.43 -0.04 3.92 2.01 -1.13 -4.75 118.68 118.56 2wh1 s LEU 196 Ca 0.33 -1.45 0.03 0.00 0.01 0.00 0.00 54.13 53.05 2wh1 s LEU 196 Cb -0.12 -0.59 0.00 0.00 0.01 0.00 0.00 46.19 45.49 2wh1 s LEU 196 CO 0.26 -0.62 -0.12 -0.83 1.01 0.00 0.00 176.35 176.04 2wh1 s GLY 197 N -3.64 0.70 -0.26 -3.19 0.00 -1.26 -3.72 107.32 95.94 2wh1 s GLY 197 Ca 0.30 -0.45 0.03 0.00 0.00 0.00 0.00 44.72 44.59 2wh1 s GLY 197 CO 0.14 -0.12 -0.07 0.14 0.00 0.00 0.00 173.10 173.19 2wh1 s VAL 198 N 0.25 2.02 -0.14 1.40 1.01 -1.06 -2.38 120.40 121.51 2wh1 s VAL 198 Ca -0.06 -1.63 0.02 0.00 0.00 0.00 0.00 61.98 60.32 2wh1 s VAL 198 Cb -0.11 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.06 2wh1 s VAL 198 CO 0.02 -0.12 -0.20 -0.54 0.00 0.00 0.00 175.10 174.25 2wh1 s LYS 199 N 1.15 3.07 -0.03 2.72 1.02 -0.52 -2.16 119.74 124.99 2wh1 s LYS 199 Ca -0.06 -0.83 0.05 0.00 0.02 0.00 0.00 55.97 55.16 2wh1 s LYS 199 Cb -0.20 -2.47 -0.01 0.00 -0.52 0.00 0.00 37.83 34.64 2wh1 s LYS 199 CO -0.06 0.02 -0.20 0.00 -0.92 0.00 0.00 175.35 174.19 2wh1 s ALA 200 N 0.76 1.69 -0.16 5.17 0.00 0.59 -0.22 121.76 129.58 2wh1 s ALA 200 Ca -0.08 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.08 2wh1 s ALA 200 Cb -0.16 -0.50 0.02 0.00 0.00 0.00 0.00 23.12 22.48 2wh1 s ALA 200 CO -0.00 0.35 -0.20 0.71 0.00 0.00 0.00 175.76 176.62 2wh1 s TYR 201 N -0.20 2.63 -0.19 0.00 1.51 0.14 -0.56 117.35 120.69 2wh1 s TYR 201 Ca 0.01 -1.44 0.01 0.00 -1.01 0.00 0.00 57.07 54.64 2wh1 s TYR 201 Cb -0.10 -1.82 0.03 0.00 -0.11 0.00 0.00 41.96 39.96 2wh1 s TYR 201 CO 0.01 -0.69 -0.18 0.42 -1.11 0.00 0.00 175.55 174.00 2wh1 s ILE 202 N 1.07 2.01 -0.25 2.71 -1.09 0.05 -2.10 121.20 123.61 2wh1 s ILE 202 Ca -0.01 -0.99 -0.16 0.00 -2.23 0.00 0.00 60.65 57.25 2wh1 s ILE 202 Cb -0.14 -1.87 -0.03 0.00 -1.58 0.00 0.00 42.46 38.84 2wh1 s ILE 202 CO -0.07 0.45 0.43 0.12 -1.23 0.00 0.00 174.94 174.64 2wh1 s PHE 203 N 1.29 3.28 0.00 3.97 5.36 0.67 0.12 117.98 132.66 2wh1 s PHE 203 Ca 0.03 0.53 0.00 0.00 -0.96 0.00 0.00 56.93 56.53 2wh1 s PHE 203 Cb -0.14 -2.61 0.00 0.00 -0.34 0.00 0.00 43.02 39.93 2wh1 s PHE 203 CO -0.12 -0.20 0.00 1.28 -1.46 0.00 0.00 175.22 174.72 2wh1 n LEU 204 N 5.22 0.00 0.00 6.12 4.77 -0.90 -2.56 117.00 129.64 2wh1 n LEU 204 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2wh1 n LEU 204 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2wh1 n LEU 204 CO 0.39 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2wh1 n GLY 205 N 4.77 -2.33 0.00 -0.72 0.00 -1.24 -4.76 105.19 100.91 2wh1 n GLY 205 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 2wh1 n GLY 205 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wh1 n GLU 206 N -0.50 0.00 -0.67 1.61 2.13 -1.26 -4.48 120.64 117.46 2wh1 n GLU 206 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2wh1 n GLU 206 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2wh1 n GLU 206 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2wh1 n VAL 207 N 0.00 0.00 0.00 6.31 0.31 -1.26 -4.81 118.33 118.88 2wh1 n VAL 207 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2wh1 n VAL 207 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2wh1 n VAL 207 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51