#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wro n LYS 2 N 0.00 0.00 0.00 0.03 5.02 -1.26 -4.72 118.16 117.22 2wro n LYS 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2wro n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2wro n LYS 2 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wro n GLY 3 N 0.00 5.52 0.00 0.72 0.00 -1.26 -3.56 105.19 106.61 2wro n GLY 3 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2wro n GLY 3 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2wro n ILE 4 N 0.00 0.00 -4.19 -0.61 3.06 -1.26 -4.83 119.36 111.53 2wro n ILE 4 Ca 0.00 0.00 -0.15 0.00 -2.50 0.00 0.00 62.75 60.10 2wro n ILE 4 Cb 0.00 0.00 -0.11 0.00 0.54 0.00 0.00 39.64 40.07 2wro n ILE 4 CO 0.00 0.00 0.00 -0.76 -2.50 0.00 0.00 176.55 173.29 2wro s LEU 5 N 0.00 2.42 0.00 9.51 1.43 -1.26 -3.50 118.68 127.27 2wro s LEU 5 Ca 0.00 -0.83 -0.04 0.00 -1.03 0.00 0.00 54.13 52.23 2wro s LEU 5 Cb 0.00 -0.34 0.02 0.00 0.03 0.00 0.00 46.19 45.89 2wro s LEU 5 CO 0.00 -0.25 0.27 0.61 0.23 0.00 0.00 176.35 177.21 2wro n GLY 6 N 0.49 2.01 2.67 -3.19 0.00 -1.24 -4.40 105.19 101.53 2wro n GLY 6 Ca -0.15 -1.24 -0.27 0.00 0.00 0.00 0.00 46.02 44.35 2wro n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wro s VAL 7 N -2.62 0.20 -0.28 1.61 0.11 -1.17 -1.87 120.40 116.38 2wro s VAL 7 Ca 0.08 -0.37 -0.32 0.00 -2.93 0.00 0.00 61.98 58.44 2wro s VAL 7 Cb -0.01 -0.80 -0.09 0.00 -1.53 0.00 0.00 36.38 33.95 2wro s VAL 7 CO 0.06 -0.26 2.20 1.17 -3.33 0.00 0.00 175.10 174.94 2wro n LYS 8 N 5.17 1.51 -0.13 1.54 4.81 -1.09 -3.24 118.16 126.72 2wro n LYS 8 Ca -0.08 0.41 0.11 0.00 -0.87 0.00 0.00 58.31 57.89 2wro n LYS 8 Cb 0.48 -2.82 0.29 0.00 0.02 0.00 0.00 35.03 33.00 2wro n LYS 8 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 2wro n VAL 9 N 7.38 0.35 0.00 3.15 3.14 -1.06 0.16 118.33 131.46 2wro n VAL 9 Ca 0.36 -0.54 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 2wro n VAL 9 Cb 0.33 0.68 0.00 0.00 -1.06 0.00 0.00 33.84 33.79 2wro n VAL 9 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2wro n GLY 10 N 1.31 -0.45 3.21 7.55 0.00 -1.26 -4.86 105.19 110.70 2wro n GLY 10 Ca 0.17 -2.22 -0.10 0.00 0.00 0.00 0.00 46.02 43.87 2wro n GLY 10 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2wro s MET 11 N 0.00 0.78 0.33 1.61 0.23 -1.26 -1.58 119.30 119.41 2wro s MET 11 Ca 0.00 -0.67 -0.07 0.00 -1.03 0.00 0.00 55.69 53.91 2wro s MET 11 Cb 0.00 0.33 0.03 0.00 -1.53 0.00 0.00 34.83 33.66 2wro s MET 11 CO 0.00 -0.24 0.56 -2.37 -2.03 0.00 0.00 175.02 170.94 2wro n THR 12 N 0.43 0.00 -4.38 3.16 5.66 0.09 -4.96 114.28 114.28 2wro n THR 12 Ca -0.18 -1.24 -0.26 0.00 -3.05 0.00 0.00 64.05 59.32 2wro n THR 12 Cb 0.60 0.92 -0.10 0.00 -1.55 0.00 0.00 70.33 70.20 2wro n THR 12 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wro s ARG 13 N -2.40 1.76 0.03 1.09 1.70 -1.26 0.27 118.95 120.14 2wro s ARG 13 Ca 0.20 -1.49 0.03 0.00 -0.47 0.00 0.00 55.73 54.01 2wro s ARG 13 Cb -0.03 -1.95 -0.02 0.00 -0.57 0.00 0.00 34.95 32.39 2wro s ARG 13 CO 0.15 0.39 -0.09 0.96 -1.08 0.00 0.00 175.30 175.63 2wro s ILE 14 N -1.88 0.72 -1.15 4.99 -4.36 0.19 -4.90 121.20 114.80 2wro s ILE 14 Ca 0.24 -0.85 -0.18 0.00 -0.26 0.00 0.00 60.65 59.60 2wro s ILE 14 Cb -0.08 -0.69 0.11 0.00 1.25 0.00 0.00 42.46 43.05 2wro s ILE 14 CO 0.13 -0.13 1.48 -0.36 0.24 0.00 0.00 174.94 176.30 2wro s PHE 15 N -0.90 3.01 0.31 1.37 0.08 -1.26 -0.69 117.98 119.91 2wro s PHE 15 Ca -0.03 -1.59 -0.27 0.00 0.12 0.00 0.00 56.93 55.16 2wro s PHE 15 Cb -0.07 -4.53 -0.10 0.00 -0.57 0.00 0.00 43.02 37.75 2wro s PHE 15 CO 0.01 -1.65 0.95 -0.98 -0.10 0.00 0.00 175.22 173.45 2wro s ARG 16 N 3.29 4.61 5.78 0.44 1.70 -1.26 -4.71 118.95 128.79 2wro s ARG 16 Ca 0.45 1.37 0.00 0.00 -0.47 0.00 0.00 55.73 57.08 2wro s ARG 16 Cb -0.00 -2.86 0.00 0.00 -0.57 0.00 0.00 34.95 31.51 2wro s ARG 16 CO -0.01 0.30 0.00 -3.47 -1.08 0.00 0.00 175.30 171.03 2wro n ASP 17 N 0.67 0.00 0.00 -2.89 4.64 -1.26 -1.86 116.55 115.86 2wro n ASP 17 Ca 0.01 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.42 2wro n ASP 17 Cb 0.50 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.58 2wro n ASP 17 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 2wro n ASP 18 N 8.92 4.97 0.00 1.67 2.03 -1.26 -5.02 116.55 127.86 2wro n ASP 18 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2wro n ASP 18 Cb 0.00 0.96 0.00 0.00 -0.72 0.00 0.00 41.12 41.36 2wro n ASP 18 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2wro n ARG 19 N -1.52 2.47 -3.65 -0.67 1.85 -0.77 -5.05 116.66 109.32 2wro n ARG 19 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 57.85 56.84 2wro n ARG 19 Cb 0.03 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.38 2wro n ARG 19 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wro s ALA 20 N -3.18 -2.41 0.02 2.89 0.00 -1.26 -4.20 121.76 113.61 2wro s ALA 20 Ca 0.00 1.93 0.01 0.00 0.00 0.00 0.00 51.96 53.89 2wro s ALA 20 Cb 0.00 -1.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.27 2wro s ALA 20 CO 0.00 -0.25 -0.04 0.14 0.00 0.00 0.00 175.76 175.61 2wro s VAL 21 N 0.74 0.20 0.14 0.00 -7.23 0.14 -4.93 120.40 109.45 2wro s VAL 21 Ca -0.03 -0.69 -0.30 0.00 -1.81 0.00 0.00 61.98 59.15 2wro s VAL 21 Cb -0.03 -0.29 -0.06 0.00 0.56 0.00 0.00 36.38 36.55 2wro s VAL 21 CO -0.12 -0.31 0.96 -2.16 -0.31 0.00 0.00 175.10 173.15 2wro s PRO 22 N -1.06 4.73 0.05 4.82 0.04 -1.26 0.53 135.00 142.85 2wro s PRO 22 Ca -0.10 1.46 -0.02 0.00 0.04 0.00 0.00 61.00 62.38 2wro s PRO 22 Cb -0.07 -3.36 -0.03 0.00 0.04 0.00 0.00 34.50 31.08 2wro s PRO 22 CO -0.00 0.28 -0.00 0.14 0.04 0.00 0.00 177.00 177.45 2wro s VAL 23 N -0.24 0.19 -0.16 -0.36 -7.23 0.76 -4.01 120.40 109.35 2wro s VAL 23 Ca 0.46 -1.60 -0.01 0.00 -1.81 0.00 0.00 61.98 59.02 2wro s VAL 23 Cb -0.24 -1.32 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 2wro s VAL 23 CO 0.30 -0.89 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.19 2wro s THR 24 N -3.54 2.90 0.27 5.32 2.01 0.39 -0.73 115.64 122.26 2wro s THR 24 Ca 0.03 -0.69 -0.25 0.00 0.31 0.00 0.00 61.69 61.10 2wro s THR 24 Cb 0.05 -2.24 -0.09 0.00 0.01 0.00 0.00 72.50 70.22 2wro s THR 24 CO -0.09 0.50 0.87 -0.69 -0.69 0.00 0.00 174.62 174.52 2wro s VAL 25 N 0.83 4.31 -0.28 3.82 1.01 -0.61 -0.84 120.40 128.63 2wro s VAL 25 Ca -0.04 1.70 -0.02 0.00 0.00 0.00 0.00 61.98 63.61 2wro s VAL 25 Cb -0.15 -4.02 0.11 0.00 0.00 0.00 0.00 36.38 32.33 2wro s VAL 25 CO 0.00 0.24 0.20 -0.63 0.00 0.00 0.00 175.10 174.91 2wro s ILE 26 N -1.50 -0.23 -0.83 2.22 1.01 -1.24 -2.55 121.20 118.09 2wro s ILE 26 Ca 0.46 -0.60 -0.25 0.00 0.00 0.00 0.00 60.65 60.25 2wro s ILE 26 Cb -0.19 -0.96 -0.11 0.00 0.01 0.00 0.00 42.46 41.21 2wro s ILE 26 CO 0.24 -0.59 2.25 -0.22 0.00 0.00 0.00 174.94 176.63 2wro s LEU 27 N 2.22 2.96 -0.35 2.97 2.96 -1.20 -1.37 118.68 126.88 2wro s LEU 27 Ca 0.09 -0.21 -0.04 0.00 -0.22 0.00 0.00 54.13 53.75 2wro s LEU 27 Cb -0.15 -2.55 0.01 0.00 0.50 0.00 0.00 46.19 43.99 2wro s LEU 27 CO -0.34 -3.51 2.88 0.00 -1.32 0.00 0.00 176.35 174.06 2wro n ALA 28 N 17.13 6.31 -0.95 5.97 0.00 -0.07 -3.06 120.51 145.85 2wro n ALA 28 Ca 0.45 -2.66 -0.37 0.00 0.00 0.00 0.00 53.44 50.86 2wro n ALA 28 Cb 0.44 -2.11 0.05 0.00 0.00 0.00 0.00 19.45 17.83 2wro n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wro n GLY 29 N 1.17 -2.87 3.09 0.00 0.00 -1.26 -4.56 105.19 100.76 2wro n GLY 29 Ca 0.46 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 2wro n GLY 29 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wro n PRO 30 N 1.87 0.00 -3.54 1.61 -0.02 -1.26 -4.82 135.00 128.85 2wro n PRO 30 Ca -0.02 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.19 2wro n PRO 30 Cb 0.72 -0.92 -0.11 0.00 -0.02 0.00 0.00 33.50 33.17 2wro n PRO 30 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wro n PRO 32 N 2.95 1.12 -2.29 0.00 -0.02 -1.24 -2.25 135.00 133.28 2wro n PRO 32 Ca 0.23 0.41 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 2wro n PRO 32 Cb 0.42 -2.07 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2wro n PRO 32 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wro s VAL 33 N 2.52 3.72 -0.70 -1.45 0.11 -1.26 -2.89 120.40 120.44 2wro s VAL 33 Ca 0.94 -0.84 0.01 0.00 -2.93 0.00 0.00 61.98 59.16 2wro s VAL 33 Cb -1.04 -4.62 0.08 0.00 -1.53 0.00 0.00 36.38 29.27 2wro s VAL 33 CO 0.60 -1.43 0.75 0.55 -3.33 0.00 0.00 175.10 172.24 2wro n VAL 34 N 7.33 0.53 0.00 2.04 3.14 -0.90 -4.83 118.33 125.65 2wro n VAL 34 Ca 0.40 -0.16 0.00 0.00 -2.96 0.00 0.00 64.34 61.62 2wro n VAL 34 Cb 0.48 -0.60 0.00 0.00 -1.06 0.00 0.00 33.84 32.66 2wro n VAL 34 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 2wro n GLN 35 N 0.13 -3.31 -3.87 1.45 7.27 -1.24 -4.88 117.38 112.93 2wro n GLN 35 Ca 0.04 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 57.03 2wro n GLN 35 Cb 0.42 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 33.06 2wro n GLN 35 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2wro s ARG 36 N -1.90 1.91 -0.46 3.69 3.00 -1.26 -3.52 118.95 120.40 2wro s ARG 36 Ca 0.00 -1.19 0.05 0.00 0.00 0.00 0.00 55.73 54.60 2wro s ARG 36 Cb 0.00 0.59 0.18 0.00 0.00 0.00 0.00 34.95 35.72 2wro s ARG 36 CO 0.00 -0.87 0.54 1.03 0.00 0.00 0.00 175.30 176.00 2wro s ARG 37 N -3.39 0.95 0.11 3.54 1.81 -1.26 -4.91 118.95 115.79 2wro s ARG 37 Ca 0.14 -1.38 -0.34 0.00 -1.72 0.00 0.00 55.73 52.44 2wro s ARG 37 Cb -0.05 -0.61 -0.18 0.00 -0.45 0.00 0.00 34.95 33.66 2wro s ARG 37 CO 0.09 -1.33 0.89 2.41 -0.68 0.00 0.00 175.30 176.69 2wro n THR 38 N 3.14 0.91 0.25 0.02 -1.04 -1.26 -1.89 114.28 114.40 2wro n THR 38 Ca 0.21 -0.23 0.08 0.00 -2.04 0.00 0.00 64.05 62.08 2wro n THR 38 Cb 0.52 -0.18 0.61 0.00 -1.82 0.00 0.00 70.33 69.46 2wro n THR 38 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2wro h PRO 39 N 2.36 0.00 0.00 -2.82 0.13 -1.91 0.24 132.00 130.00 2wro h PRO 39 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2wro h PRO 39 Cb 1.42 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.55 2wro h PRO 39 CO 0.63 0.12 0.00 0.93 -0.23 0.00 0.00 178.00 179.45 2wro h GLU 40 N 0.00 0.00 0.00 0.86 5.08 -1.94 -1.57 114.58 117.01 2wro h GLU 40 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wro h GLU 40 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2wro h GLU 40 CO 0.02 0.00 0.00 0.36 -1.00 0.00 0.00 179.01 178.39 2wro n LYS 41 N -2.31 1.85 0.02 2.33 2.85 -0.04 -4.88 118.16 117.98 2wro n LYS 41 Ca 0.05 -1.20 0.00 0.00 -1.05 0.00 0.00 58.31 56.11 2wro n LYS 41 Cb 0.41 -0.98 0.00 0.00 -0.65 0.00 0.00 35.03 33.81 2wro n LYS 41 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2wro n ASP 42 N -0.35 -0.14 0.00 -5.58 8.00 0.63 -4.87 116.55 114.24 2wro n ASP 42 Ca 0.00 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.57 2wro n ASP 42 Cb 0.19 0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 2wro n ASP 42 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wro n GLY 43 N 0.68 -0.93 2.01 0.44 0.00 -0.59 -4.99 105.19 101.81 2wro n GLY 43 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wro n GLY 43 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2wro n TYR 44 N 0.00 -1.52 -0.43 1.61 4.11 -1.26 -4.91 117.16 114.75 2wro n TYR 44 Ca 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 57.90 57.99 2wro n TYR 44 Cb 0.00 0.66 0.00 0.00 -0.00 0.00 0.00 39.34 40.00 2wro n TYR 44 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.86 179.27 2wro n THR 45 N -2.58 -1.41 -3.20 -3.48 -1.04 -0.80 -4.69 114.28 97.07 2wro n THR 45 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 2wro n THR 45 Cb 0.00 -1.57 -0.02 0.00 -1.82 0.00 0.00 70.33 66.92 2wro n THR 45 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wro s ALA 46 N 0.00 -2.68 -0.09 2.41 0.00 -1.26 -3.43 121.76 116.70 2wro s ALA 46 Ca 0.00 1.76 -0.29 0.00 0.00 0.00 0.00 51.96 53.43 2wro s ALA 46 Cb 0.00 -2.25 -0.06 0.00 0.00 0.00 0.00 23.12 20.81 2wro s ALA 46 CO 0.00 -1.32 1.98 0.08 0.00 0.00 0.00 175.76 176.51 2wro s VAL 47 N 2.86 3.15 -0.20 0.00 1.01 -1.14 -4.36 120.40 121.72 2wro s VAL 47 Ca 0.10 0.17 -0.23 0.00 0.00 0.00 0.00 61.98 62.02 2wro s VAL 47 Cb -0.13 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.10 2wro s VAL 47 CO -0.17 -0.05 0.73 -1.58 0.00 0.00 0.00 175.10 174.03 2wro s GLN 48 N 5.12 4.23 0.09 2.72 0.74 -1.23 -3.47 119.66 127.85 2wro s GLN 48 Ca 0.89 0.81 0.04 0.00 0.05 0.00 0.00 55.36 57.16 2wro s GLN 48 Cb -0.36 -3.59 -0.04 0.00 1.10 0.00 0.00 33.01 30.12 2wro s GLN 48 CO 0.37 -0.32 0.01 -0.51 -0.55 0.00 0.00 175.29 174.29 2wro s LEU 49 N 2.16 3.50 0.33 3.68 2.01 -0.31 -2.11 118.68 127.94 2wro s LEU 49 Ca 0.33 -0.15 0.07 0.00 0.01 0.00 0.00 54.13 54.39 2wro s LEU 49 Cb -0.16 -2.22 -0.06 0.00 0.01 0.00 0.00 46.19 43.75 2wro s LEU 49 CO 0.11 0.18 -0.04 -0.83 1.01 0.00 0.00 176.35 176.77 2wro s GLY 50 N -2.29 2.09 0.00 -3.19 0.00 -1.14 -0.54 107.32 102.25 2wro s GLY 50 Ca 0.26 -2.05 0.00 0.00 0.00 0.00 0.00 44.72 42.93 2wro s GLY 50 CO 0.18 -1.94 0.00 0.33 0.00 0.00 0.00 173.10 171.67 2wro n PHE 51 N -0.73 0.00 0.00 1.90 -0.00 -0.68 -3.65 117.46 114.30 2wro n PHE 51 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.40 2wro n PHE 51 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.12 2wro n PHE 51 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 2wro n LEU 52 N 0.00 0.00 0.00 -2.13 7.94 -1.25 -4.49 117.00 117.07 2wro n LEU 52 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2wro n LEU 52 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2wro n LEU 52 CO 0.00 0.00 0.00 -2.65 -1.11 0.00 0.00 177.39 173.63 2wro n PRO 53 N 0.00 0.00 -0.98 1.96 -0.02 -1.26 -0.36 135.00 134.34 2wro n PRO 53 Ca 0.00 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.10 2wro n PRO 53 Cb 0.00 -0.00 0.04 0.00 -0.02 0.00 0.00 33.50 33.52 2wro n PRO 53 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wro n GLN 54 N 0.00 -0.09 0.00 -0.52 10.64 -1.26 -3.12 117.38 123.03 2wro n GLN 54 Ca 0.00 -0.02 0.00 0.00 -1.83 0.00 0.00 57.00 55.15 2wro n GLN 54 Cb 0.00 -1.05 0.00 0.00 -0.86 0.00 0.00 30.24 28.33 2wro n GLN 54 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2wro n ASN 55 N 3.17 0.00 -0.00 2.61 4.05 -1.26 -2.24 115.26 121.59 2wro n ASN 55 Ca -0.02 0.00 -0.00 0.00 0.45 0.00 0.00 54.58 55.01 2wro n ASN 55 Cb 0.71 0.00 -0.00 0.00 1.23 0.00 0.00 39.78 41.72 2wro n ASN 55 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 2wro n PRO 56 N 0.00 -0.00 0.00 1.20 -0.02 -1.26 -4.67 135.00 130.25 2wro n PRO 56 Ca 0.00 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2wro n PRO 56 Cb 0.00 -1.12 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 2wro n PRO 56 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2wro n LYS 57 N -2.76 0.00 -0.16 -0.52 3.00 -1.26 -5.00 118.16 111.46 2wro n LYS 57 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.37 2wro n LYS 57 Cb 0.00 0.00 0.15 0.00 0.00 0.00 0.00 35.03 35.18 2wro n LYS 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2wro n ARG 58 N 0.00 2.61 0.05 1.64 3.00 -1.26 -4.59 116.66 118.12 2wro n ARG 58 Ca 0.00 -1.98 -0.05 0.00 -0.01 0.00 0.00 57.85 55.81 2wro n ARG 58 Cb 0.00 -1.27 0.15 0.00 0.00 0.00 0.00 32.46 31.33 2wro n ARG 58 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 2wro h VAL 59 N 2.14 1.33 0.00 1.55 3.04 -1.94 -3.48 116.25 118.88 2wro h VAL 59 Ca 0.00 -1.68 0.00 0.00 -1.01 0.00 0.00 66.70 64.01 2wro h VAL 59 Cb 0.71 1.74 0.00 0.00 -2.01 0.00 0.00 31.29 31.73 2wro h VAL 59 CO 0.00 0.51 0.00 -0.46 -1.01 0.00 0.00 177.57 176.61 2wro n ASN 60 N -3.98 0.00 0.00 3.17 0.23 -1.26 -3.70 115.26 109.71 2wro n ASN 60 Ca -0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.03 2wro n ASN 60 Cb 0.54 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.24 2wro n ASN 60 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 2wro n ARG 61 N 0.62 0.00 -0.50 -3.83 0.63 -1.26 0.90 116.66 113.22 2wro n ARG 61 Ca 0.00 0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.91 2wro n ARG 61 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.88 2wro n ARG 61 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2wro n PRO 62 N -2.28 1.00 -0.14 -0.14 -0.04 -1.24 -4.20 135.00 127.95 2wro n PRO 62 Ca 0.00 -0.18 0.28 0.00 -0.04 0.00 0.00 63.50 63.56 2wro n PRO 62 Cb 0.00 -1.27 0.72 0.00 -0.04 0.00 0.00 33.50 32.91 2wro n PRO 62 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2wro h LEU 63 N 3.63 0.00 -1.72 1.53 6.46 0.33 -3.45 115.31 122.08 2wro h LEU 63 Ca 0.03 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.70 2wro h LEU 63 Cb 0.91 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.85 2wro h LEU 63 CO 0.06 0.00 -0.55 1.17 -0.62 0.00 0.00 178.44 178.50 2wro n LYS 64 N -4.06 -0.53 0.04 1.25 4.81 -1.26 -4.81 118.16 113.59 2wro n LYS 64 Ca 0.17 0.54 -0.08 0.00 -0.87 0.00 0.00 58.31 58.07 2wro n LYS 64 Cb 0.96 -0.73 0.08 0.00 0.02 0.00 0.00 35.03 35.36 2wro n LYS 64 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2wro h GLY 65 N 1.67 0.47 0.00 3.14 0.00 -1.93 -3.44 103.07 102.98 2wro h GLY 65 Ca -0.14 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.63 2wro h GLY 65 CO 0.06 0.50 0.00 1.57 0.00 0.00 0.00 176.54 178.67 2wro n HIS 66 N -3.93 0.00 -1.75 5.60 -0.00 -1.26 -4.31 115.22 109.57 2wro n HIS 66 Ca -0.03 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.35 2wro n HIS 66 Cb 0.61 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.65 2wro n HIS 66 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.34 176.46 2wro s PHE 67 N 0.00 2.45 0.13 1.57 5.99 -1.26 -4.95 117.98 121.90 2wro s PHE 67 Ca 0.00 1.56 -0.26 0.00 0.00 0.00 0.00 56.93 58.24 2wro s PHE 67 Cb 0.00 -3.29 -0.04 0.00 0.00 0.00 0.00 43.02 39.69 2wro s PHE 67 CO 0.00 -1.97 1.63 0.00 -0.00 0.00 0.00 175.22 174.87 2wro h ALA 68 N 0.15 -0.35 0.00 11.12 0.00 -1.95 -2.28 119.26 125.95 2wro h ALA 68 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2wro h ALA 68 Cb 1.27 0.51 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2wro h ALA 68 CO 0.53 -0.77 0.00 1.63 0.00 0.00 0.00 179.25 180.64 2wro n LYS 69 N -5.39 0.00 -0.41 0.00 4.01 -1.26 -3.88 118.16 111.23 2wro n LYS 69 Ca -0.04 0.00 -0.08 0.00 -0.51 0.00 0.00 58.31 57.68 2wro n LYS 69 Cb 0.30 -1.47 -0.05 0.00 -0.51 0.00 0.00 35.03 33.30 2wro n LYS 69 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2wro n ALA 70 N -0.77 3.17 -1.46 7.82 0.00 -0.86 -4.71 120.51 123.71 2wro n ALA 70 Ca 0.00 -0.90 -0.41 0.00 0.00 0.00 0.00 53.44 52.13 2wro n ALA 70 Cb 0.00 -2.46 -0.02 0.00 0.00 0.00 0.00 19.45 16.97 2wro n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wro n GLY 71 N 3.15 3.70 2.14 0.00 0.00 -1.25 -4.45 105.19 108.48 2wro n GLY 71 Ca 0.21 -1.44 -0.02 0.00 0.00 0.00 0.00 46.02 44.76 2wro n GLY 71 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wro n VAL 72 N 5.29 -6.70 -1.13 1.61 0.31 -1.26 -4.90 118.33 111.55 2wro n VAL 72 Ca 0.52 0.63 -0.42 0.00 -0.01 0.00 0.00 64.34 65.07 2wro n VAL 72 Cb 0.37 -5.57 -0.04 0.00 -0.91 0.00 0.00 33.84 27.69 2wro n VAL 72 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wro n GLU 73 N -0.10 0.00 -1.54 5.55 4.71 -1.26 -4.65 120.64 123.35 2wro n GLU 73 Ca 0.04 0.00 -0.32 0.00 -0.01 0.00 0.00 57.16 56.86 2wro n GLU 73 Cb 0.14 -0.98 0.07 0.00 -1.01 0.00 0.00 31.44 29.66 2wro n GLU 73 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2wro s PRO 74 N -0.38 2.53 0.22 3.49 0.04 -1.18 -4.41 135.00 135.30 2wro s PRO 74 Ca 0.61 1.33 0.12 0.00 0.04 0.00 0.00 61.00 63.09 2wro s PRO 74 Cb -0.86 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 31.74 2wro s PRO 74 CO 0.44 -1.45 1.39 0.28 0.04 0.00 0.00 177.00 177.70 2wro h VAL 75 N -0.45 1.24 -2.49 -0.36 2.07 -0.23 -3.35 116.25 112.68 2wro h VAL 75 Ca -0.45 -2.71 -0.70 0.00 0.82 0.00 0.00 66.70 63.66 2wro h VAL 75 Cb 1.24 2.58 -0.35 0.00 -1.52 0.00 0.00 31.29 33.24 2wro h VAL 75 CO 0.53 0.70 0.06 -1.14 0.02 0.00 0.00 177.57 177.73 2wro n ARG 76 N -3.30 3.55 0.00 1.57 3.00 -1.25 -5.01 116.66 115.22 2wro n ARG 76 Ca 0.01 -4.64 0.00 0.00 -0.00 0.00 0.00 57.85 53.22 2wro n ARG 76 Cb 0.81 -2.37 0.00 0.00 0.00 0.00 0.00 32.46 30.90 2wro n ARG 76 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2wro n ILE 77 N 0.89 0.00 -3.85 5.15 5.41 -1.26 -3.45 119.36 122.25 2wro n ILE 77 Ca 0.30 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.93 2wro n ILE 77 Cb 0.37 0.00 -0.11 0.00 -0.71 0.00 0.00 39.64 39.19 2wro n ILE 77 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 2wro s LEU 78 N 0.00 1.52 0.05 1.39 0.05 -1.26 -1.69 118.68 118.73 2wro s LEU 78 Ca 0.00 0.01 0.02 0.00 0.05 0.00 0.00 54.13 54.21 2wro s LEU 78 Cb 0.00 0.59 -0.03 0.00 -2.05 0.00 0.00 46.19 44.70 2wro s LEU 78 CO 0.00 -0.23 -0.07 -0.13 -0.55 0.00 0.00 176.35 175.37 2wro s ARG 79 N -0.74 0.55 0.00 1.48 3.00 0.30 -4.94 118.95 118.59 2wro s ARG 79 Ca -0.08 -0.84 0.00 0.00 0.00 0.00 0.00 55.73 54.81 2wro s ARG 79 Cb -0.05 -0.21 0.00 0.00 0.00 0.00 0.00 34.95 34.69 2wro s ARG 79 CO 0.01 0.02 0.00 0.39 0.00 0.00 0.00 175.30 175.72 2wro n GLU 80 N 1.21 1.61 0.00 3.54 1.02 -1.26 -1.16 120.64 125.59 2wro n GLU 80 Ca -0.21 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.93 2wro n GLU 80 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.98 2wro n GLU 80 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2wro n ILE 81 N -0.39 0.00 -3.87 -3.67 2.08 -1.23 -4.51 119.36 107.78 2wro n ILE 81 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 2wro n ILE 81 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 2wro n ILE 81 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 2wro n ARG 82 N 0.00 0.00 -1.18 0.38 3.00 -1.26 -4.45 116.66 113.16 2wro n ARG 82 Ca 0.00 0.00 -0.46 0.00 -0.00 0.00 0.00 57.85 57.39 2wro n ARG 82 Cb 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.60 2wro n ARG 82 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2wro n ASP 83 N -3.23 0.79 0.00 6.15 10.43 -1.22 -4.02 116.55 125.45 2wro n ASP 83 Ca 0.00 0.80 0.00 0.00 2.57 0.00 0.00 54.79 58.16 2wro n ASP 83 Cb 0.00 -0.60 0.00 0.00 1.84 0.00 0.00 41.12 42.36 2wro n ASP 83 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 2wro n PHE 84 N 2.64 0.00 -3.38 1.24 -0.00 -1.26 0.33 117.46 117.04 2wro n PHE 84 Ca 0.21 0.00 0.02 0.00 -0.00 0.00 0.00 57.45 57.68 2wro n PHE 84 Cb -0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 39.42 2wro n PHE 84 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 2wro s ASN 85 N 0.00 -1.01 0.00 -2.13 3.84 -1.26 -2.89 114.94 111.49 2wro s ASN 85 Ca 0.00 1.03 0.00 0.00 0.21 0.00 0.00 52.86 54.10 2wro s ASN 85 Cb 0.00 2.01 0.00 0.00 -0.55 0.00 0.00 41.25 42.71 2wro s ASN 85 CO 0.00 -0.19 0.00 -0.81 -2.79 0.00 0.00 177.10 173.31 2wro n PRO 86 N 5.34 3.19 -2.81 0.43 -0.04 -1.26 -5.06 135.00 134.80 2wro n PRO 86 Ca -0.07 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.98 2wro n PRO 86 Cb 0.51 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.93 2wro n PRO 86 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2wro s GLU 87 N 3.14 4.60 0.00 0.54 -1.05 -1.26 -4.85 118.70 119.82 2wro s GLU 87 Ca 0.00 1.31 0.00 0.00 -0.15 0.00 0.00 54.97 56.13 2wro s GLU 87 Cb 0.00 -3.39 0.00 0.00 -0.44 0.00 0.00 34.13 30.30 2wro s GLU 87 CO 0.00 0.17 0.00 0.41 0.95 0.00 0.00 175.26 176.79 2wro n GLY 88 N 2.47 0.06 3.23 -3.83 0.00 -1.26 -4.53 105.19 101.32 2wro n GLY 88 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 2wro n GLY 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wro s ASP 89 N 0.32 -0.31 0.00 1.61 2.15 -1.26 -5.00 116.67 114.18 2wro s ASP 89 Ca 0.00 0.54 0.00 0.00 0.43 0.00 0.00 52.55 53.52 2wro s ASP 89 Cb 0.00 0.60 0.00 0.00 -0.30 0.00 0.00 42.92 43.22 2wro s ASP 89 CO 0.00 -0.19 0.00 0.41 -0.17 0.00 0.00 175.17 175.22 2wro n THR 90 N 2.53 0.00 -4.14 1.71 -1.04 -1.26 -4.76 114.28 107.32 2wro n THR 90 Ca -0.15 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.51 2wro n THR 90 Cb 0.57 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 69.00 2wro n THR 90 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2wro s VAL 91 N 0.00 4.76 0.00 12.58 1.01 -0.95 -4.89 120.40 132.91 2wro s VAL 91 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.91 2wro s VAL 91 Cb 0.00 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.31 2wro s VAL 91 CO 0.00 0.57 0.00 0.35 0.00 0.00 0.00 175.10 176.02 2wro n THR 92 N 2.50 0.00 -0.02 3.92 -2.24 -1.26 -2.10 114.28 115.08 2wro n THR 92 Ca -0.18 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.62 2wro n THR 92 Cb 0.54 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.63 2wro n THR 92 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2wro n VAL 93 N 0.00 0.73 0.24 2.28 0.31 -1.26 -4.31 118.33 116.32 2wro n VAL 93 Ca 0.00 -0.66 0.09 0.00 -0.01 0.00 0.00 64.34 63.76 2wro n VAL 93 Cb 0.00 -0.33 0.46 0.00 -0.91 0.00 0.00 33.84 33.06 2wro n VAL 93 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2wro h GLU 94 N 0.00 0.00 -0.53 5.55 3.07 -1.97 0.28 114.58 120.99 2wro h GLU 94 Ca -0.20 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.64 2wro h GLU 94 Cb 1.51 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.40 2wro h GLU 94 CO 0.02 0.00 0.26 0.82 -1.40 0.00 0.00 179.01 178.70 2wro h ILE 95 N 0.00 1.18 -3.79 3.13 1.08 -1.94 -3.40 117.51 113.76 2wro h ILE 95 Ca 0.00 -0.49 -0.66 0.00 -0.39 0.00 0.00 64.86 63.32 2wro h ILE 95 Cb 0.84 0.50 -0.19 0.00 -3.07 0.00 0.00 36.82 34.90 2wro h ILE 95 CO 0.00 0.20 -0.52 -0.36 -0.69 0.00 0.00 178.15 176.79 2wro s PHE 96 N -5.44 3.21 0.08 1.37 0.08 0.98 -5.08 117.98 113.18 2wro s PHE 96 Ca -0.09 -0.10 0.03 0.00 0.12 0.00 0.00 56.93 56.88 2wro s PHE 96 Cb 0.17 -2.40 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 2wro s PHE 96 CO 0.77 -0.27 0.08 0.15 -0.10 0.00 0.00 175.22 175.84 2wro s LYS 97 N 1.72 2.88 -0.27 0.44 1.02 -1.26 -4.79 119.74 119.48 2wro s LYS 97 Ca 0.06 -0.69 -0.33 0.00 0.02 0.00 0.00 55.97 55.03 2wro s LYS 97 Cb -0.17 -2.73 -0.10 0.00 -0.52 0.00 0.00 37.83 34.32 2wro s LYS 97 CO 0.10 0.57 2.14 -2.30 -0.92 0.00 0.00 175.35 174.93 2wro n PRO 98 N 0.47 1.51 0.00 -1.68 -0.02 -1.26 -1.81 135.00 132.21 2wro n PRO 98 Ca -0.09 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 2wro n PRO 98 Cb 0.52 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 2wro n PRO 98 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wro n GLY 99 N 5.92 1.05 3.82 -1.23 0.00 -0.57 -5.04 105.19 109.14 2wro n GLY 99 Ca 0.35 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.01 2wro n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wro s GLU 100 N 0.00 4.18 -0.40 1.61 2.02 -0.75 -4.81 118.70 120.55 2wro s GLU 100 Ca 0.00 0.78 -0.14 0.00 0.02 0.00 0.00 54.97 55.62 2wro s GLU 100 Cb 0.00 -2.88 0.02 0.00 0.10 0.00 0.00 34.13 31.37 2wro s GLU 100 CO 0.00 0.41 0.29 1.03 0.02 0.00 0.00 175.26 177.00 2wro s ARG 101 N -1.99 2.99 -0.11 1.61 1.81 -1.26 -0.19 118.95 121.80 2wro s ARG 101 Ca 0.42 -1.00 -0.02 0.00 -1.72 0.00 0.00 55.73 53.41 2wro s ARG 101 Cb -0.16 -3.94 -0.03 0.00 -0.45 0.00 0.00 34.95 30.37 2wro s ARG 101 CO 0.20 -0.72 -0.05 0.14 -0.68 0.00 0.00 175.30 174.19 2wro s VAL 102 N 1.67 3.83 0.86 3.52 -7.23 -0.11 0.13 120.40 123.07 2wro s VAL 102 Ca 0.05 -0.40 -0.13 0.00 -1.81 0.00 0.00 61.98 59.68 2wro s VAL 102 Cb -0.19 -2.63 0.12 0.00 0.56 0.00 0.00 36.38 34.24 2wro s VAL 102 CO 0.10 0.55 1.23 -1.81 -0.31 0.00 0.00 175.10 174.85 2wro s ASP 103 N -0.21 4.06 -0.20 4.85 1.01 -1.22 -0.27 116.67 124.69 2wro s ASP 103 Ca 0.03 0.61 -0.19 0.00 0.71 0.00 0.00 52.55 53.71 2wro s ASP 103 Cb -0.13 -0.96 0.05 0.00 1.01 0.00 0.00 42.92 42.90 2wro s ASP 103 CO 0.02 -2.17 0.55 -0.69 0.21 0.00 0.00 175.17 173.09 2wro s VAL 104 N -3.68 0.00 -0.05 -1.27 1.01 -1.26 -2.89 120.40 112.26 2wro s VAL 104 Ca 0.66 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.66 2wro s VAL 104 Cb -0.09 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 2wro s VAL 104 CO 0.50 -0.00 -0.11 -0.89 0.00 0.00 0.00 175.10 174.60 2wro s THR 105 N 0.23 3.33 0.32 3.92 2.01 -0.97 -2.63 115.64 121.85 2wro s THR 105 Ca -0.00 -0.65 -0.02 0.00 0.31 0.00 0.00 61.69 61.32 2wro s THR 105 Cb -0.04 -2.34 -0.01 0.00 0.01 0.00 0.00 72.50 70.12 2wro s THR 105 CO 0.01 0.57 0.41 -0.83 -0.69 0.00 0.00 174.62 174.09 2wro s GLY 106 N -0.84 1.51 -0.88 4.40 0.00 -1.05 -3.37 107.32 107.09 2wro s GLY 106 Ca 0.12 -1.55 -0.09 0.00 0.00 0.00 0.00 44.72 43.20 2wro s GLY 106 CO 0.02 -1.07 0.81 -1.59 0.00 0.00 0.00 173.10 171.26 2wro s THR 107 N -3.33 5.25 0.44 0.90 2.01 -1.25 -0.90 115.64 118.75 2wro s THR 107 Ca 0.32 -2.98 -0.22 0.00 0.31 0.00 0.00 61.69 59.13 2wro s THR 107 Cb 0.01 -4.24 -0.12 0.00 0.01 0.00 0.00 72.50 68.15 2wro s THR 107 CO 0.19 -1.05 0.50 -1.54 -0.69 0.00 0.00 174.62 172.03 2wro n SER 108 N 3.35 -1.09 -4.63 3.53 3.41 -0.86 -2.75 113.62 114.58 2wro n SER 108 Ca 0.16 0.88 -0.37 0.00 -0.26 0.00 0.00 58.87 59.29 2wro n SER 108 Cb 0.42 -1.10 0.07 0.00 -0.26 0.00 0.00 64.21 63.35 2wro n SER 108 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wro n LYS 109 N 0.60 0.72 -3.33 4.33 5.02 -1.26 0.23 118.16 124.46 2wro n LYS 109 Ca 0.11 0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 56.28 2wro n LYS 109 Cb 0.41 -2.25 -0.09 0.00 -0.02 0.00 0.00 35.03 33.08 2wro n LYS 109 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2wro s GLY 110 N -1.47 1.87 0.00 0.72 0.00 -1.26 -0.46 107.32 106.71 2wro s GLY 110 Ca 0.76 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 44.25 2wro s GLY 110 CO 0.47 1.12 0.98 0.54 0.00 0.00 0.00 173.10 176.22 2wro n ARG 111 N 5.55 2.90 0.00 2.90 1.74 -1.00 -4.97 116.66 123.78 2wro n ARG 111 Ca -0.07 -1.47 0.00 0.00 -0.77 0.00 0.00 57.85 55.54 2wro n ARG 111 Cb 0.49 -0.99 0.00 0.00 -1.02 0.00 0.00 32.46 30.94 2wro n ARG 111 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wro n GLY 112 N -0.48 0.75 3.50 -0.13 0.00 -1.25 -4.28 105.19 103.29 2wro n GLY 112 Ca 0.00 -0.69 -0.44 0.00 0.00 0.00 0.00 46.02 44.89 2wro n GLY 112 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2wro n PHE 113 N 0.00 1.40 -4.02 1.61 7.35 -1.24 -2.40 117.46 120.17 2wro n PHE 113 Ca 0.00 0.22 -0.24 0.00 -0.76 0.00 0.00 57.45 56.67 2wro n PHE 113 Cb 0.00 -2.55 -0.17 0.00 0.35 0.00 0.00 39.48 37.11 2wro n PHE 113 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2wro s ALA 114 N 9.08 1.01 0.42 3.13 0.00 0.56 -4.85 121.76 131.12 2wro s ALA 114 Ca 1.10 -0.31 -0.22 0.00 0.00 0.00 0.00 51.96 52.53 2wro s ALA 114 Cb -0.69 -0.72 -0.10 0.00 0.00 0.00 0.00 23.12 21.61 2wro s ALA 114 CO 0.41 -0.27 1.00 0.20 0.00 0.00 0.00 175.76 177.11 2wro s GLY 115 N 1.47 2.58 0.42 0.00 0.00 -1.26 -2.30 107.32 108.23 2wro s GLY 115 Ca -0.01 0.56 -0.22 0.00 0.00 0.00 0.00 44.72 45.05 2wro s GLY 115 CO -0.04 0.92 0.47 1.55 0.00 0.00 0.00 173.10 176.00 2wro n VAL 116 N -0.42 1.61 0.00 1.40 3.14 -1.26 -2.96 118.33 119.84 2wro n VAL 116 Ca 0.06 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.94 2wro n VAL 116 Cb 0.52 -0.45 0.00 0.00 -1.06 0.00 0.00 33.84 32.84 2wro n VAL 116 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2wro n MET 117 N 0.70 0.00 0.00 1.45 0.00 -1.26 -4.66 117.12 113.35 2wro n MET 117 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.82 2wro n MET 117 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.62 2wro n MET 117 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2wro n LYS 118 N 0.00 1.44 -0.03 2.12 4.81 -1.15 -4.09 118.16 121.25 2wro n LYS 118 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.29 2wro n LYS 118 Cb 0.00 -0.77 -0.12 0.00 0.02 0.00 0.00 35.03 34.16 2wro n LYS 118 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2wro h ARG 119 N 0.00 0.16 0.00 1.64 2.43 -1.79 -3.38 114.38 113.43 2wro h ARG 119 Ca 0.00 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 2wro h ARG 119 Cb 0.54 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 2wro h ARG 119 CO 0.00 0.96 0.00 0.91 -1.51 0.00 0.00 179.97 180.33 2wro n TRP 120 N -4.49 0.00 -2.19 2.20 7.02 -1.26 -5.00 117.44 113.73 2wro n TRP 120 Ca -0.10 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.36 2wro n TRP 120 Cb 0.53 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.40 2wro n TRP 120 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2wro n ASN 121 N -0.32 -4.63 -0.70 -0.99 4.05 -1.26 -4.79 115.26 106.63 2wro n ASN 121 Ca 0.00 1.28 0.00 0.00 0.45 0.00 0.00 54.58 56.31 2wro n ASN 121 Cb 0.02 -4.32 0.00 0.00 1.23 0.00 0.00 39.78 36.71 2wro n ASN 121 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 2wro n PHE 122 N 1.39 0.00 -0.25 1.20 3.01 -1.26 -4.69 117.46 116.85 2wro n PHE 122 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.31 2wro n PHE 122 Cb 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.71 2wro n PHE 122 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wro n ALA 123 N -3.00 0.00 -0.39 4.37 0.00 -1.26 -4.84 120.51 115.39 2wro n ALA 123 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 2wro n ALA 123 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2wro n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wro n GLY 124 N 0.00 1.11 2.75 0.00 0.00 -1.26 -4.42 105.19 103.36 2wro n GLY 124 Ca 0.00 -0.65 -0.04 0.00 0.00 0.00 0.00 46.02 45.33 2wro n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wro n GLY 125 N 4.60 -0.65 3.58 -0.02 0.00 -1.26 -3.24 105.19 108.21 2wro n GLY 125 Ca 0.32 0.52 -0.29 0.00 0.00 0.00 0.00 46.02 46.57 2wro n GLY 125 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wro s PRO 126 N 0.86 2.64 0.21 1.61 0.02 -1.26 -4.82 135.00 134.26 2wro s PRO 126 Ca 0.29 -1.12 0.18 0.00 0.02 0.00 0.00 61.00 60.38 2wro s PRO 126 Cb 0.04 -5.25 0.68 0.00 0.02 0.00 0.00 34.50 29.99 2wro s PRO 126 CO -0.07 -3.73 0.65 -0.25 -0.33 0.00 0.00 177.00 173.26 2wro n ASP 127 N 13.74 0.04 0.00 2.53 9.92 -1.26 -4.55 116.55 136.97 2wro n ASP 127 Ca 0.44 0.48 0.00 0.00 -0.53 0.00 0.00 54.79 55.18 2wro n ASP 127 Cb 0.47 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.71 2wro n ASP 127 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2wro n SER 128 N -3.08 0.00 0.00 -2.24 3.41 -1.26 -5.01 113.62 105.44 2wro n SER 128 Ca 0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 2wro n SER 128 Cb 0.76 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 2wro n SER 128 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2wro n HIS 129 N 0.00 0.00 0.00 7.33 8.25 -1.26 -4.48 115.22 125.06 2wro n HIS 129 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2wro n HIS 129 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2wro n HIS 129 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wro n GLY 130 N 0.00 -3.22 1.30 -1.41 0.00 -1.26 -4.91 105.19 95.69 2wro n GLY 130 Ca 0.00 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.21 2wro n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wro n ALA 131 N -3.00 -2.89 0.00 4.61 0.00 -1.26 -4.98 120.51 112.98 2wro n ALA 131 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2wro n ALA 131 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 2wro n ALA 131 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2wro n HIS 132 N -0.81 0.00 1.70 0.00 -0.00 -1.26 -4.71 115.22 110.13 2wro n HIS 132 Ca 0.01 0.00 0.15 0.00 0.46 0.00 0.00 57.72 58.35 2wro n HIS 132 Cb 0.21 0.00 0.84 0.00 -0.12 0.00 0.00 29.99 30.92 2wro n HIS 132 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2wro n LYS 133 N -0.62 0.74 -2.24 1.57 5.02 -1.26 -3.80 118.16 117.57 2wro n LYS 133 Ca 0.00 -0.04 -0.14 0.00 -2.02 0.00 0.00 58.31 56.12 2wro n LYS 133 Cb 0.06 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.61 2wro n LYS 133 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2wro n ILE 134 N -1.10 2.01 0.34 -0.18 -6.64 -1.26 -4.88 119.36 107.65 2wro n ILE 134 Ca 0.19 -3.64 0.00 0.00 -1.77 0.00 0.00 62.75 57.53 2wro n ILE 134 Cb 0.18 -0.18 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 2wro n ILE 134 CO 0.00 0.00 0.00 1.41 -1.77 0.00 0.00 176.55 176.19 2wro n HIS 135 N -0.66 0.00 -0.69 4.28 8.25 -1.25 -3.12 115.22 122.04 2wro n HIS 135 Ca 0.29 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 2wro n HIS 135 Cb 0.90 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.99 2wro n HIS 135 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2wro n ARG 136 N 0.17 0.00 -1.71 -0.41 1.74 -1.20 -4.52 116.66 110.73 2wro n ARG 136 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 2wro n ARG 136 Cb 0.05 0.00 0.06 0.00 -1.02 0.00 0.00 32.46 31.55 2wro n ARG 136 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2wro s HIS 137 N 0.00 2.32 -2.00 -1.55 3.76 -1.18 -4.87 115.29 111.77 2wro s HIS 137 Ca 0.00 1.56 0.23 0.00 -0.15 0.00 0.00 55.06 56.71 2wro s HIS 137 Cb 0.00 -3.38 1.39 0.00 1.11 0.00 0.00 32.58 31.70 2wro s HIS 137 CO 0.00 -2.21 1.78 -2.30 -0.85 0.00 0.00 174.74 171.16 2wro n PRO 138 N -2.28 0.80 0.00 8.40 -0.02 -1.26 -4.55 135.00 136.09 2wro n PRO 138 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2wro n PRO 138 Cb 0.51 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 2wro n PRO 138 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wro n GLY 139 N 0.57 3.61 3.76 -1.23 0.00 -1.26 -4.57 105.19 106.07 2wro n GLY 139 Ca 0.17 0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 2wro n GLY 139 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wro s SER 140 N -4.00 5.43 0.00 1.61 0.15 -1.26 -4.93 113.70 110.70 2wro s SER 140 Ca 0.00 2.36 0.00 0.00 0.70 0.00 0.00 55.95 59.01 2wro s SER 140 Cb 0.00 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2wro s SER 140 CO 0.00 -1.43 0.00 2.30 1.20 0.00 0.00 173.24 175.31 2wro n ILE 141 N -1.35 0.00 -2.57 6.45 -5.35 -1.26 -5.12 119.36 110.16 2wro n ILE 141 Ca 0.12 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.60 2wro n ILE 141 Cb 0.49 -0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.22 2wro n ILE 141 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wro n GLY 142 N 1.94 6.62 0.00 3.28 0.00 -1.26 -4.64 105.19 111.12 2wro n GLY 142 Ca 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.10 2wro n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wro n ASN 143 N 0.00 0.00 0.00 1.61 5.03 -1.26 -5.12 115.26 115.52 2wro n ASN 143 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 2wro n ASN 143 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2wro n ASN 143 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2wro n ARG 144 N 0.00 0.00 0.00 3.52 1.74 -1.26 -4.94 116.66 115.72 2wro n ARG 144 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2wro n ARG 144 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2wro n ARG 144 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2wro n LYS 145 N 0.00 0.00 -3.33 5.56 0.00 -1.26 -0.62 118.16 118.51 2wro n LYS 145 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 58.31 58.34 2wro n LYS 145 Cb 0.00 -1.29 -0.03 0.00 0.00 0.00 0.00 35.03 33.71 2wro n LYS 145 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2wro s THR 146 N -1.46 -0.66 0.29 3.15 -4.23 -1.26 -4.57 115.64 106.91 2wro s THR 146 Ca 0.00 0.00 0.07 0.00 -1.18 0.00 0.00 61.69 60.58 2wro s THR 146 Cb 0.00 -1.00 0.03 0.00 1.34 0.00 0.00 72.50 72.87 2wro s THR 146 CO 0.00 0.00 1.69 1.55 -0.54 0.00 0.00 174.62 177.32 2wro h PRO 147 N 7.81 0.19 0.00 3.99 0.13 -1.96 -3.46 132.00 138.70 2wro h PRO 147 Ca -0.17 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2wro h PRO 147 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2wro h PRO 147 CO 0.08 0.61 0.00 0.41 -0.23 0.00 0.00 178.00 178.87 2wro n GLY 148 N -0.12 0.80 3.21 1.56 0.00 0.21 -5.02 105.19 105.83 2wro n GLY 148 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 2wro n GLY 148 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wro s ARG 149 N -0.34 0.94 -0.05 1.61 1.70 -1.26 -5.04 118.95 116.50 2wro s ARG 149 Ca 0.00 -1.28 -0.28 0.00 -0.47 0.00 0.00 55.73 53.70 2wro s ARG 149 Cb 0.00 -0.59 -0.03 0.00 -0.57 0.00 0.00 34.95 33.77 2wro s ARG 149 CO 0.00 0.08 0.89 0.08 -1.08 0.00 0.00 175.30 175.28 2wro s VAL 150 N -2.79 4.91 -0.17 4.99 1.01 -1.26 -4.69 120.40 122.39 2wro s VAL 150 Ca 0.10 1.84 -0.35 0.00 0.00 0.00 0.00 61.98 63.58 2wro s VAL 150 Cb -0.01 -4.22 -0.11 0.00 0.00 0.00 0.00 36.38 32.04 2wro s VAL 150 CO 0.00 0.15 1.96 -1.22 0.00 0.00 0.00 175.10 175.98 2wro n TYR 151 N 4.18 2.14 -1.55 5.22 4.01 -1.26 -4.86 117.16 125.04 2wro n TYR 151 Ca 0.04 0.09 -0.42 0.00 -0.16 0.00 0.00 57.90 57.45 2wro n TYR 151 Cb 0.50 -2.63 0.01 0.00 -0.31 0.00 0.00 39.34 36.92 2wro n TYR 151 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2wro n LYS 152 N 7.00 1.05 -2.55 -0.72 4.81 -1.26 -2.24 118.16 124.25 2wro n LYS 152 Ca 0.27 0.38 -0.10 0.00 -0.87 0.00 0.00 58.31 57.99 2wro n LYS 152 Cb 0.28 -1.82 0.01 0.00 0.02 0.00 0.00 35.03 33.52 2wro n LYS 152 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wro n GLY 153 N 1.40 0.11 1.90 3.14 0.00 -1.26 -4.93 105.19 105.55 2wro n GLY 153 Ca 0.10 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 2wro n GLY 153 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2wro n LYS 154 N -2.20 1.73 -0.80 1.61 3.00 -0.95 -4.93 118.16 115.63 2wro n LYS 154 Ca -0.06 -0.91 0.00 0.00 -0.00 0.00 0.00 58.31 57.34 2wro n LYS 154 Cb 0.56 -1.69 0.00 0.00 0.00 0.00 0.00 35.03 33.90 2wro n LYS 154 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2wro n LYS 155 N 1.83 -0.23 -4.40 1.64 5.02 -1.26 -4.98 118.16 115.77 2wro n LYS 155 Ca 0.30 0.22 -0.23 0.00 -2.02 0.00 0.00 58.31 56.58 2wro n LYS 155 Cb 0.72 -0.21 -0.08 0.00 -0.02 0.00 0.00 35.03 35.44 2wro n LYS 155 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2wro s MET 156 N 0.00 1.89 0.04 1.97 -1.94 -1.26 -4.96 119.30 115.04 2wro s MET 156 Ca 0.00 -2.13 -0.37 0.00 -1.71 0.00 0.00 55.69 51.47 2wro s MET 156 Cb 0.00 -0.10 -0.17 0.00 2.01 0.00 0.00 34.83 36.57 2wro s MET 156 CO 0.00 -0.60 1.37 0.00 -0.01 0.00 0.00 175.02 175.78 2wro n ALA 157 N -0.79 -1.04 -3.00 3.03 0.00 -1.26 -4.66 120.51 112.79 2wro n ALA 157 Ca 0.01 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2wro n ALA 157 Cb 0.63 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 18.01 2wro n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wro n GLY 158 N 2.65 0.66 3.67 0.00 0.00 -0.97 -4.90 105.19 106.29 2wro n GLY 158 Ca 0.19 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 2wro n GLY 158 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wro s HIS 159 N -2.49 2.41 -0.12 1.61 5.65 -1.25 0.21 115.29 121.31 2wro s HIS 159 Ca 0.00 0.55 -0.01 0.00 0.25 0.00 0.00 55.06 55.85 2wro s HIS 159 Cb 0.00 -3.75 0.03 0.00 -1.18 0.00 0.00 32.58 27.68 2wro s HIS 159 CO 0.00 -2.98 -0.04 -0.47 -0.65 0.00 0.00 174.74 170.59 2wro s TYR 160 N 3.49 1.28 0.00 3.88 6.04 -1.01 -4.92 117.35 126.11 2wro s TYR 160 Ca 0.66 -0.67 0.00 0.00 0.04 0.00 0.00 57.07 57.11 2wro s TYR 160 Cb -0.30 -1.12 0.00 0.00 -1.04 0.00 0.00 41.96 39.50 2wro s TYR 160 CO 0.25 -0.49 0.00 0.41 -1.54 0.00 0.00 175.55 174.18 2wro n GLY 161 N 4.99 0.59 3.51 8.97 0.00 -1.26 -2.37 105.19 119.63 2wro n GLY 161 Ca -0.11 -2.18 -0.21 0.00 0.00 0.00 0.00 46.02 43.53 2wro n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wro n ALA 162 N 0.41 -1.61 -3.82 4.61 0.00 0.62 -4.79 120.51 115.95 2wro n ALA 162 Ca 0.00 0.21 -0.11 0.00 0.00 0.00 0.00 53.44 53.54 2wro n ALA 162 Cb 0.00 -4.18 -0.03 0.00 0.00 0.00 0.00 19.45 15.25 2wro n ALA 162 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2wro n GLU 163 N -4.61 0.54 -1.69 0.00 0.28 -1.25 -4.78 120.64 109.14 2wro n GLU 163 Ca -0.12 -2.22 -0.43 0.00 -0.16 0.00 0.00 57.16 54.24 2wro n GLU 163 Cb 0.61 2.12 -0.03 0.00 1.43 0.00 0.00 31.44 35.57 2wro n GLU 163 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2wro n ARG 164 N -0.46 2.75 -4.52 3.44 0.63 -1.25 -2.02 116.66 115.24 2wro n ARG 164 Ca 0.01 1.00 -0.25 0.00 -0.92 0.00 0.00 57.85 57.69 2wro n ARG 164 Cb 0.46 -2.90 -0.09 0.00 0.45 0.00 0.00 32.46 30.38 2wro n ARG 164 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2wro s VAL 165 N 2.93 0.98 -0.48 5.15 1.01 -0.08 -4.93 120.40 124.98 2wro s VAL 165 Ca 0.83 -2.00 0.05 0.00 0.00 0.00 0.00 61.98 60.86 2wro s VAL 165 Cb -0.49 -2.54 0.22 0.00 0.00 0.00 0.00 36.38 33.57 2wro s VAL 165 CO 0.39 0.00 0.88 0.41 0.00 0.00 0.00 175.10 176.77 2wro n THR 166 N -0.86 0.00 0.50 3.92 -1.04 -1.25 -2.53 114.28 113.01 2wro n THR 166 Ca -0.06 -1.18 0.00 0.00 -2.04 0.00 0.00 64.05 60.77 2wro n THR 166 Cb 0.66 1.24 0.00 0.00 -1.82 0.00 0.00 70.33 70.41 2wro n THR 166 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 2wro n VAL 167 N 2.14 0.09 0.00 12.58 3.14 -1.08 -4.85 118.33 130.35 2wro n VAL 167 Ca 0.12 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.50 2wro n VAL 167 Cb 0.61 -0.34 0.00 0.00 -1.06 0.00 0.00 33.84 33.05 2wro n VAL 167 CO 0.00 0.00 0.00 1.15 -6.46 0.00 0.00 176.83 171.52 2wro n MET 168 N 0.34 0.00 -3.67 1.45 0.00 -1.25 -4.37 117.12 109.62 2wro n MET 168 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 57.70 57.45 2wro n MET 168 Cb 0.15 0.00 0.07 0.00 0.00 0.00 0.00 33.22 33.43 2wro n MET 168 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 2wro n ASN 169 N 0.00 -5.89 -4.77 3.17 4.05 -1.17 -4.85 115.26 105.79 2wro n ASN 169 Ca 0.00 -0.60 -0.29 0.00 0.45 0.00 0.00 54.58 54.14 2wro n ASN 169 Cb 0.00 -4.78 0.11 0.00 1.23 0.00 0.00 39.78 36.34 2wro n ASN 169 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2wro s LEU 170 N -7.28 2.53 -0.27 1.20 1.02 0.63 -4.74 118.68 111.77 2wro s LEU 170 Ca 0.58 0.70 -0.06 0.00 0.02 0.00 0.00 54.13 55.37 2wro s LEU 170 Cb -0.27 -3.11 -0.00 0.00 0.02 0.00 0.00 46.19 42.83 2wro s LEU 170 CO 0.75 -2.05 0.05 -0.70 0.02 0.00 0.00 176.35 174.42 2wro s GLU 171 N -5.63 3.27 -1.02 1.70 -6.30 -1.26 -0.94 118.70 108.53 2wro s GLU 171 Ca 0.64 -0.72 -0.26 0.00 -2.50 0.00 0.00 54.97 52.12 2wro s GLU 171 Cb -0.10 -3.28 -0.19 0.00 0.00 0.00 0.00 34.13 30.56 2wro s GLU 171 CO 0.50 -0.33 2.17 0.08 0.02 0.00 0.00 175.26 177.70 2wro s VAL 172 N 1.52 3.07 0.00 3.70 1.01 0.73 -2.96 120.40 127.47 2wro s VAL 172 Ca 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.92 2wro s VAL 172 Cb -0.16 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.42 2wro s VAL 172 CO 0.01 -0.13 0.89 0.52 0.00 0.00 0.00 175.10 176.40 2wro n VAL 173 N 8.89 0.00 -3.94 2.92 0.31 -1.01 -1.52 118.33 123.98 2wro n VAL 173 Ca 0.43 1.39 -0.10 0.00 -0.01 0.00 0.00 64.34 66.05 2wro n VAL 173 Cb 0.46 -2.02 -0.11 0.00 -0.91 0.00 0.00 33.84 31.26 2wro n VAL 173 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wro s ASP 174 N -2.74 0.16 -0.07 4.52 3.68 -1.21 -4.35 116.67 116.65 2wro s ASP 174 Ca 0.00 -0.40 0.03 0.00 2.13 0.00 0.00 52.55 54.31 2wro s ASP 174 Cb 0.00 0.14 0.01 0.00 -1.45 0.00 0.00 42.92 41.62 2wro s ASP 174 CO 0.00 -0.32 -0.15 0.54 0.13 0.00 0.00 175.17 175.36 2wro s VAL 175 N -1.43 1.38 -0.37 1.11 0.11 -1.26 -0.85 120.40 119.09 2wro s VAL 175 Ca -0.16 -0.62 -0.09 0.00 -2.93 0.00 0.00 61.98 58.19 2wro s VAL 175 Cb -0.09 -1.23 0.04 0.00 -1.53 0.00 0.00 36.38 33.57 2wro s VAL 175 CO -0.00 0.41 0.17 -0.63 -3.33 0.00 0.00 175.10 171.72 2wro s ILE 176 N 0.58 4.15 0.59 7.04 1.01 0.55 -4.93 121.20 130.18 2wro s ILE 176 Ca -0.16 -1.08 0.29 0.00 0.00 0.00 0.00 60.65 59.70 2wro s ILE 176 Cb -0.16 -3.37 0.37 0.00 0.01 0.00 0.00 42.46 39.30 2wro s ILE 176 CO 0.05 -0.26 1.99 1.55 0.00 0.00 0.00 174.94 178.27 2wro h PRO 177 N 8.33 0.00 0.00 2.79 0.13 -1.95 -3.01 132.00 138.29 2wro h PRO 177 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2wro h PRO 177 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2wro h PRO 177 CO 0.65 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.51 2wro n GLU 178 N -3.69 0.00 0.00 0.86 4.07 -1.26 -4.09 120.64 116.52 2wro n GLU 178 Ca 0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 2wro n GLU 178 Cb 0.50 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.88 2wro n GLU 178 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 2wro n GLU 179 N 0.00 0.03 -0.96 5.31 4.07 -1.26 -4.70 120.64 123.13 2wro n GLU 179 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2wro n GLU 179 Cb 0.00 -1.00 0.00 0.00 -0.06 0.00 0.00 31.44 30.38 2wro n GLU 179 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2wro n ASN 180 N -0.28 -1.93 -4.73 4.31 3.02 -1.14 -4.72 115.26 109.78 2wro n ASN 180 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 2wro n ASN 180 Cb 0.00 -0.76 -0.03 0.00 -0.61 0.00 0.00 39.78 38.39 2wro n ASN 180 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2wro s LEU 181 N 0.00 4.37 -0.60 3.41 1.02 -1.20 -0.89 118.68 124.80 2wro s LEU 181 Ca 0.00 2.70 0.05 0.00 0.02 0.00 0.00 54.13 56.90 2wro s LEU 181 Cb 0.00 -3.61 0.18 0.00 0.02 0.00 0.00 46.19 42.78 2wro s LEU 181 CO 0.00 -0.80 0.47 -0.11 0.02 0.00 0.00 176.35 175.93 2wro n LEU 182 N 3.09 1.86 -4.76 1.79 7.94 -0.47 -0.33 117.00 126.11 2wro n LEU 182 Ca 0.10 -4.95 -0.40 0.00 -1.11 0.00 0.00 56.01 49.66 2wro n LEU 182 Cb 0.39 -0.28 0.02 0.00 0.53 0.00 0.00 43.42 44.08 2wro n LEU 182 CO 0.62 1.83 1.06 -0.76 -1.11 0.00 0.00 177.39 179.03 2wro s LEU 183 N -1.07 4.09 0.18 -1.96 1.02 -0.03 -3.60 118.68 117.31 2wro s LEU 183 Ca 0.29 2.91 -0.09 0.00 0.02 0.00 0.00 54.13 57.27 2wro s LEU 183 Cb 0.01 -3.96 -0.01 0.00 0.02 0.00 0.00 46.19 42.25 2wro s LEU 183 CO -0.16 -1.21 0.29 0.68 0.02 0.00 0.00 176.35 175.96 2wro s VAL 184 N -1.21 0.05 -0.46 -1.59 -7.23 -0.02 -2.42 120.40 107.53 2wro s VAL 184 Ca 0.62 -1.45 0.00 0.00 -1.81 0.00 0.00 61.98 59.34 2wro s VAL 184 Cb -0.43 -1.94 0.00 0.00 0.56 0.00 0.00 36.38 34.57 2wro s VAL 184 CO 0.56 -0.24 0.66 0.29 -0.31 0.00 0.00 175.10 176.05 2wro n LYS 185 N -0.24 0.00 0.00 4.82 4.76 -1.16 0.15 118.16 126.50 2wro n LYS 185 Ca -0.06 0.19 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2wro n LYS 185 Cb 0.63 -1.76 0.00 0.00 -1.84 0.00 0.00 35.03 32.06 2wro n LYS 185 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wro n GLY 186 N -1.16 -1.93 2.44 0.72 0.00 -1.26 -4.43 105.19 99.57 2wro n GLY 186 Ca 0.00 -1.65 -0.16 0.00 0.00 0.00 0.00 46.02 44.21 2wro n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wro n ALA 187 N 0.07 -0.28 -2.67 4.61 0.00 -1.26 -4.91 120.51 116.07 2wro n ALA 187 Ca 0.00 0.24 -0.43 0.00 0.00 0.00 0.00 53.44 53.25 2wro n ALA 187 Cb 0.00 -1.72 -0.02 0.00 0.00 0.00 0.00 19.45 17.71 2wro n ALA 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wro s VAL 188 N -2.63 4.73 0.00 0.00 0.11 -1.26 -4.80 120.40 116.55 2wro s VAL 188 Ca 0.00 2.04 0.00 0.00 -2.93 0.00 0.00 61.98 61.09 2wro s VAL 188 Cb 0.00 -4.31 0.00 0.00 -1.53 0.00 0.00 36.38 30.54 2wro s VAL 188 CO 0.00 -0.10 0.00 -0.81 -3.33 0.00 0.00 175.10 170.86 2wro n PRO 189 N 5.72 1.45 -1.31 1.54 -0.04 -1.26 -4.91 135.00 136.18 2wro n PRO 189 Ca 0.10 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.61 2wro n PRO 189 Cb 0.47 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.91 2wro n PRO 189 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wro n GLY 190 N 0.00 -3.72 3.73 0.55 0.00 -1.14 -4.70 105.19 99.90 2wro n GLY 190 Ca 0.00 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 2wro n GLY 190 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wro s PRO 191 N -4.91 0.01 -0.23 1.61 0.02 -1.11 -4.81 135.00 125.58 2wro s PRO 191 Ca 0.00 0.03 -0.29 0.00 0.02 0.00 0.00 61.00 60.76 2wro s PRO 191 Cb 0.00 -1.73 -0.00 0.00 0.02 0.00 0.00 34.50 32.79 2wro s PRO 191 CO 0.00 -2.91 1.21 1.21 -0.33 0.00 0.00 177.00 176.18 2wro s ASN 192 N -4.08 6.90 0.00 2.53 3.04 -1.26 -3.07 114.94 119.00 2wro s ASN 192 Ca 0.69 1.43 0.00 0.00 0.04 0.00 0.00 52.86 55.02 2wro s ASN 192 Cb -0.11 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 37.06 2wro s ASN 192 CO 0.55 -0.84 0.00 0.61 -3.04 0.00 0.00 177.10 174.38 2wro n GLY 193 N 3.77 1.99 3.85 1.21 0.00 0.42 -4.98 105.19 111.44 2wro n GLY 193 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 2wro n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wro s GLY 194 N -2.01 2.12 0.34 -0.02 0.00 -1.17 -4.54 107.32 102.03 2wro s GLY 194 Ca 0.00 0.05 -0.25 0.00 0.00 0.00 0.00 44.72 44.52 2wro s GLY 194 CO 0.00 0.29 0.58 -0.10 0.00 0.00 0.00 173.10 173.87 2wro n LEU 195 N -1.14 -0.28 -3.05 0.66 7.94 -1.26 -2.68 117.00 117.19 2wro n LEU 195 Ca 0.05 1.01 -0.10 0.00 -1.11 0.00 0.00 56.01 55.85 2wro n LEU 195 Cb 0.54 -1.08 -0.03 0.00 0.53 0.00 0.00 43.42 43.38 2wro n LEU 195 CO 0.45 -2.76 -0.02 0.68 -1.11 0.00 0.00 177.39 174.62 2wro s VAL 196 N -1.30 -0.61 0.59 1.96 -7.23 -0.78 -4.39 120.40 108.64 2wro s VAL 196 Ca 0.62 -1.23 -0.19 0.00 -1.81 0.00 0.00 61.98 59.37 2wro s VAL 196 Cb -0.71 -0.37 -0.03 0.00 0.56 0.00 0.00 36.38 35.83 2wro s VAL 196 CO 0.59 -0.36 1.23 0.27 -0.31 0.00 0.00 175.10 176.52 2wro s ILE 197 N 0.90 2.49 0.15 -0.62 -4.36 -1.22 -3.71 121.20 114.84 2wro s ILE 197 Ca 0.27 0.31 0.01 0.00 -0.26 0.00 0.00 60.65 60.98 2wro s ILE 197 Cb -0.02 -3.13 0.01 0.00 1.25 0.00 0.00 42.46 40.57 2wro s ILE 197 CO -0.08 -0.06 0.10 0.52 0.24 0.00 0.00 174.94 175.66 2wro n VAL 198 N -1.55 0.00 0.00 8.37 0.31 -1.23 -2.29 118.33 121.95 2wro n VAL 198 Ca 0.13 -0.61 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 2wro n VAL 198 Cb 0.49 -0.30 0.00 0.00 -0.91 0.00 0.00 33.84 33.12 2wro n VAL 198 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2wro n ARG 199 N -0.78 0.00 -4.33 5.55 0.63 -1.14 -4.34 116.66 112.24 2wro n ARG 199 Ca -0.01 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 56.75 2wro n ARG 199 Cb 0.17 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 32.98 2wro n ARG 199 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 2wro s GLU 200 N -0.29 1.38 0.33 -0.14 1.03 -1.23 -4.07 118.70 115.71 2wro s GLU 200 Ca 0.00 -1.72 -0.03 0.00 0.03 0.00 0.00 54.97 53.24 2wro s GLU 200 Cb 0.00 -0.48 0.07 0.00 -0.80 0.00 0.00 34.13 32.92 2wro s GLU 200 CO 0.00 -0.18 0.46 -2.37 -1.33 0.00 0.00 175.26 171.83 2wro n THR 201 N -0.45 0.00 -2.16 1.83 5.66 0.35 -3.42 114.28 116.09 2wro n THR 201 Ca -0.03 -0.49 -0.25 0.00 -3.05 0.00 0.00 64.05 60.22 2wro n THR 201 Cb 0.65 -1.51 0.01 0.00 -1.55 0.00 0.00 70.33 67.93 2wro n THR 201 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2wro n LYS 202 N -1.92 3.54 0.03 1.09 4.01 -1.26 -4.76 118.16 118.88 2wro n LYS 202 Ca 0.06 -4.26 0.12 0.00 -0.51 0.00 0.00 58.31 53.72 2wro n LYS 202 Cb 0.23 -2.27 0.48 0.00 -0.51 0.00 0.00 35.03 32.96 2wro n LYS 202 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 2wro n LYS 203 N -0.64 0.05 0.02 1.97 3.00 -1.26 -4.78 118.16 116.52 2wro n LYS 203 Ca 0.43 0.14 0.00 0.00 -0.00 0.00 0.00 58.31 58.88 2wro n LYS 203 Cb 0.86 -1.58 0.00 0.00 0.00 0.00 0.00 35.03 34.31 2wro n LYS 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wro n ALA 204 N -1.56 0.00 0.00 3.14 0.00 -1.26 -5.29 120.51 115.54 2wro n ALA 204 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2wro n ALA 204 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.74 2wro n ALA 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50