#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2w h ARG 2 N 0.00 0.00 -0.29 0.03 3.08 -1.88 -3.35 114.38 111.97 1k2w h ARG 2 Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.84 1k2w h ARG 2 Cb 0.00 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 29.89 1k2w h ARG 2 CO 0.00 0.09 -0.57 1.28 -1.07 0.00 0.00 179.97 179.71 1k2w n LEU 3 N -2.84 3.62 -4.69 3.04 4.77 -0.52 -4.88 117.00 115.49 1k2w n LEU 3 Ca -0.01 -4.19 -0.42 0.00 -0.03 0.00 0.00 56.01 51.36 1k2w n LEU 3 Cb 0.61 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1k2w n LEU 3 CO 0.39 1.64 1.43 -0.62 -1.33 0.00 0.00 177.39 178.91 1k2w s ASP 4 N -3.30 6.47 -0.05 -1.43 -1.08 -0.96 -2.71 116.67 113.61 1k2w s ASP 4 Ca 0.43 2.68 0.00 0.00 -0.52 0.00 0.00 52.55 55.14 1k2w s ASP 4 Cb 0.39 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 39.28 1k2w s ASP 4 CO -0.03 -0.97 0.00 0.61 0.52 0.00 0.00 175.17 175.30 1k2w n GLY 5 N 4.17 0.45 3.65 2.66 0.00 -0.68 -4.98 105.19 110.47 1k2w n GLY 5 Ca 0.17 -0.69 -0.24 0.00 0.00 0.00 0.00 46.02 45.27 1k2w n GLY 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k2w s LYS 6 N -1.36 2.33 -0.03 1.61 1.02 -1.10 -4.97 119.74 117.24 1k2w s LYS 6 Ca 0.00 -1.34 0.05 0.00 0.02 0.00 0.00 55.97 54.71 1k2w s LYS 6 Cb 0.00 -2.21 -0.02 0.00 -0.52 0.00 0.00 37.83 35.07 1k2w s LYS 6 CO 0.00 0.39 -0.19 0.95 -0.92 0.00 0.00 175.35 175.58 1k2w s THR 7 N -2.17 2.70 -0.02 2.17 -4.23 -1.26 -0.24 115.64 112.59 1k2w s THR 7 Ca 0.30 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 1k2w s THR 7 Cb -0.07 -2.03 0.02 0.00 1.34 0.00 0.00 72.50 71.76 1k2w s THR 7 CO 0.20 0.56 0.00 0.00 -0.54 0.00 0.00 174.62 174.83 1k2w s ALA 8 N -0.72 0.25 -0.26 3.99 0.00 -0.25 -0.81 121.76 123.95 1k2w s ALA 8 Ca 0.11 0.16 -0.10 0.00 0.00 0.00 0.00 51.96 52.13 1k2w s ALA 8 Cb -0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 1k2w s ALA 8 CO 0.01 -0.06 0.15 -1.17 0.00 0.00 0.00 175.76 174.69 1k2w s LEU 9 N 0.86 3.86 -0.24 0.00 0.20 -0.08 -1.52 118.68 121.76 1k2w s LEU 9 Ca -0.08 -0.05 0.02 0.00 0.69 0.00 0.00 54.13 54.71 1k2w s LEU 9 Cb -0.12 -2.06 0.05 0.00 -0.43 0.00 0.00 46.19 43.63 1k2w s LEU 9 CO -0.02 -0.03 -0.13 -0.63 -0.29 0.00 0.00 176.35 175.26 1k2w s ILE 10 N 1.61 2.19 0.30 6.68 1.01 -1.16 -1.06 121.20 130.78 1k2w s ILE 10 Ca 0.07 -1.42 -0.28 0.00 0.00 0.00 0.00 60.65 59.02 1k2w s ILE 10 Cb -0.15 -2.19 -0.09 0.00 0.01 0.00 0.00 42.46 40.04 1k2w s ILE 10 CO 0.08 0.13 1.01 0.42 0.00 0.00 0.00 174.94 176.59 1k2w s THR 11 N 1.17 3.83 -1.38 2.92 -4.23 -0.97 -3.16 115.64 113.82 1k2w s THR 11 Ca -0.05 1.70 -0.03 0.00 -1.18 0.00 0.00 61.69 62.13 1k2w s THR 11 Cb -0.18 -4.03 0.00 0.00 1.34 0.00 0.00 72.50 69.64 1k2w s THR 11 CO -0.07 0.30 0.43 0.61 -0.54 0.00 0.00 174.62 175.35 1k2w n GLY 12 N 1.01 -0.35 1.22 3.99 0.00 -0.38 -2.12 105.19 108.56 1k2w n GLY 12 Ca 0.00 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.07 1k2w n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k2w n SER 13 N -1.83 3.57 0.13 1.61 3.41 -1.12 -4.30 113.62 115.08 1k2w n SER 13 Ca -0.12 -2.27 -0.00 0.00 -0.26 0.00 0.00 58.87 56.22 1k2w n SER 13 Cb 0.62 -0.47 0.27 0.00 -0.26 0.00 0.00 64.21 64.36 1k2w n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k2w h ALA 14 N 3.81 1.21 -4.30 7.33 0.00 -1.90 -3.19 119.26 122.23 1k2w h ALA 14 Ca 0.00 -0.38 -0.34 0.00 0.00 0.00 0.00 54.91 54.19 1k2w h ALA 14 Cb 1.08 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.70 1k2w h ALA 14 CO 0.14 0.55 -0.29 0.54 0.00 0.00 0.00 179.25 180.20 1k2w n ARG 15 N -4.05 0.47 0.00 0.00 1.74 -1.26 -4.82 116.66 108.74 1k2w n ARG 15 Ca -0.02 -2.70 0.00 0.00 -0.77 0.00 0.00 57.85 54.37 1k2w n ARG 15 Cb 0.45 2.37 0.00 0.00 -1.02 0.00 0.00 32.46 34.26 1k2w n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k2w n GLY 16 N -0.53 1.65 0.33 -0.13 0.00 -1.26 -2.66 105.19 102.59 1k2w n GLY 16 Ca 0.04 -0.51 0.01 0.00 0.00 0.00 0.00 46.02 45.56 1k2w n GLY 16 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1k2w h ILE 17 N 0.00 1.18 -0.92 -0.61 2.04 -1.97 -1.95 117.51 115.28 1k2w h ILE 17 Ca 0.00 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.48 1k2w h ILE 17 Cb 0.00 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 36.34 1k2w h ILE 17 CO 0.00 0.19 0.61 1.23 0.00 0.00 0.00 178.15 180.17 1k2w h GLY 18 N 0.89 1.30 1.58 5.37 0.00 -1.76 -1.64 103.07 108.81 1k2w h GLY 18 Ca 0.22 -0.47 -0.15 0.00 0.00 0.00 0.00 47.33 46.93 1k2w h GLY 18 CO -0.04 0.45 -0.56 -0.09 0.00 0.00 0.00 176.54 176.30 1k2w h ARG 19 N 1.22 0.44 -0.68 4.80 2.43 -1.13 -2.56 114.38 118.91 1k2w h ARG 19 Ca 0.34 -0.28 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 1k2w h ARG 19 Cb -0.10 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1k2w h ARG 19 CO -0.08 0.88 0.17 0.00 -1.51 0.00 0.00 179.97 179.42 1k2w h ALA 20 N 1.06 1.01 -0.35 2.80 0.00 -0.98 -0.85 119.26 121.96 1k2w h ALA 20 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1k2w h ALA 20 Cb 1.08 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1k2w h ALA 20 CO 0.10 0.64 0.10 0.74 0.00 0.00 0.00 179.25 180.83 1k2w h PHE 21 N 1.02 0.58 -0.18 0.00 0.05 -1.23 -1.31 116.94 115.87 1k2w h PHE 21 Ca 0.21 -0.06 0.00 0.00 3.82 0.00 0.00 57.97 61.94 1k2w h PHE 21 Cb 0.35 -0.17 -0.01 0.00 2.00 0.00 0.00 35.95 38.13 1k2w h PHE 21 CO 0.03 0.57 0.12 0.00 -0.18 0.00 0.00 178.31 178.84 1k2w h ALA 22 N 0.94 0.23 -0.93 2.45 0.00 -1.15 0.16 119.26 120.97 1k2w h ALA 22 Ca 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1k2w h ALA 22 Cb 0.27 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1k2w h ALA 22 CO -0.00 -0.29 0.56 0.93 0.00 0.00 0.00 179.25 180.45 1k2w h GLU 23 N 0.23 1.26 -0.38 0.00 5.08 -1.10 -1.11 114.58 118.56 1k2w h GLU 23 Ca 0.07 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1k2w h GLU 23 Cb -0.02 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 1k2w h GLU 23 CO -0.01 0.88 -0.03 0.00 -1.00 0.00 0.00 179.01 178.84 1k2w h ALA 24 N 1.31 0.52 -0.47 3.43 0.00 -0.77 -1.95 119.26 121.34 1k2w h ALA 24 Ca 0.33 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1k2w h ALA 24 Cb -0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1k2w h ALA 24 CO -0.06 0.33 0.06 1.88 0.00 0.00 0.00 179.25 181.45 1k2w h TYR 25 N 0.51 0.76 -0.26 0.00 -1.99 -0.43 -1.99 116.97 113.57 1k2w h TYR 25 Ca 0.10 -0.08 -0.09 0.00 2.00 0.00 0.00 58.73 60.66 1k2w h TYR 25 Cb 0.52 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 1k2w h TYR 25 CO 0.04 0.68 -0.24 0.28 -0.00 0.00 0.00 178.16 178.93 1k2w h VAL 26 N 0.70 1.26 -0.02 -2.88 2.07 -1.04 -2.11 116.25 114.24 1k2w h VAL 26 Ca 0.15 -1.25 -0.07 0.00 0.82 0.00 0.00 66.70 66.35 1k2w h VAL 26 Cb 0.35 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1k2w h VAL 26 CO 0.01 0.40 -0.32 -0.09 0.02 0.00 0.00 177.57 177.58 1k2w h ARG 27 N 0.44 0.04 -0.49 1.57 2.43 -0.64 -2.26 114.38 115.46 1k2w h ARG 27 Ca 0.07 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1k2w h ARG 27 Cb 0.66 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1k2w h ARG 27 CO 0.05 0.36 0.00 0.39 -1.51 0.00 0.00 179.97 179.26 1k2w n GLU 28 N -4.14 1.77 -1.53 0.20 -0.58 -0.86 -4.72 120.64 110.78 1k2w n GLU 28 Ca -0.02 -0.84 0.00 0.00 -0.42 0.00 0.00 57.16 55.88 1k2w n GLU 28 Cb 0.37 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 29.84 1k2w n GLU 28 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1k2w n GLY 29 N 0.57 0.68 3.72 0.62 0.00 -0.85 -1.44 105.19 108.48 1k2w n GLY 29 Ca 0.08 -0.73 -0.23 0.00 0.00 0.00 0.00 46.02 45.14 1k2w n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2w s ALA 30 N -2.00 3.43 -0.18 4.61 0.00 -0.85 -1.68 121.76 125.09 1k2w s ALA 30 Ca 0.00 -1.77 -0.08 0.00 0.00 0.00 0.00 51.96 50.12 1k2w s ALA 30 Cb 0.00 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 1k2w s ALA 30 CO 0.00 0.10 0.07 1.03 0.00 0.00 0.00 175.76 176.95 1k2w s ARG 31 N -3.81 3.97 0.24 0.00 0.52 0.66 -4.36 118.95 116.17 1k2w s ARG 31 Ca 0.36 -0.33 0.09 0.00 -0.52 0.00 0.00 55.73 55.33 1k2w s ARG 31 Cb -0.04 -3.22 -0.05 0.00 0.52 0.00 0.00 34.95 32.16 1k2w s ARG 31 CO 0.22 0.30 -0.16 0.14 0.02 0.00 0.00 175.30 175.82 1k2w s VAL 32 N 0.30 2.00 -0.23 3.52 -7.23 -0.92 -1.09 120.40 116.76 1k2w s VAL 32 Ca 0.04 -2.28 0.02 0.00 -1.81 0.00 0.00 61.98 57.95 1k2w s VAL 32 Cb -0.12 -2.18 0.04 0.00 0.56 0.00 0.00 36.38 34.68 1k2w s VAL 32 CO -0.00 -0.50 -0.14 0.00 -0.31 0.00 0.00 175.10 174.15 1k2w s ALA 33 N -2.80 2.48 -0.86 1.32 0.00 -0.58 -1.80 121.76 119.51 1k2w s ALA 33 Ca 0.26 -1.52 -0.23 0.00 0.00 0.00 0.00 51.96 50.47 1k2w s ALA 33 Cb -0.02 -1.43 0.07 0.00 0.00 0.00 0.00 23.12 21.75 1k2w s ALA 33 CO 0.10 -0.83 1.23 0.42 0.00 0.00 0.00 175.76 176.69 1k2w s ILE 34 N 1.19 4.16 -0.13 0.00 -1.09 0.12 -2.97 121.20 122.47 1k2w s ILE 34 Ca -0.03 -0.62 -0.14 0.00 -2.23 0.00 0.00 60.65 57.63 1k2w s ILE 34 Cb -0.17 -4.88 -0.05 0.00 -1.58 0.00 0.00 42.46 35.78 1k2w s ILE 34 CO -0.08 -1.72 0.33 0.00 -1.23 0.00 0.00 174.94 172.24 1k2w s ALA 35 N 4.39 3.60 0.15 9.38 0.00 -1.19 -2.06 121.76 136.03 1k2w s ALA 35 Ca 0.35 -0.40 -0.19 0.00 0.00 0.00 0.00 51.96 51.73 1k2w s ALA 35 Cb -0.06 -2.41 0.05 0.00 0.00 0.00 0.00 23.12 20.69 1k2w s ALA 35 CO -0.00 0.14 0.51 0.34 0.00 0.00 0.00 175.76 176.75 1k2w s ASP 36 N 0.26 -0.38 0.36 0.00 2.15 -0.97 -1.25 116.67 116.84 1k2w s ASP 36 Ca 0.19 -0.20 0.18 0.00 0.43 0.00 0.00 52.55 53.15 1k2w s ASP 36 Cb -0.14 0.54 0.59 0.00 -0.30 0.00 0.00 42.92 43.62 1k2w s ASP 36 CO 0.06 -0.93 1.69 -0.29 -0.17 0.00 0.00 175.17 175.52 1k2w h ILE 37 N 2.18 0.88 -3.24 4.11 2.10 -1.78 0.19 117.51 121.95 1k2w h ILE 37 Ca -0.33 -1.63 -0.74 0.00 1.08 0.00 0.00 64.86 63.24 1k2w h ILE 37 Cb 1.28 2.00 -0.26 0.00 -1.09 0.00 0.00 36.82 38.75 1k2w h ILE 37 CO 0.42 0.39 -0.33 0.21 -1.08 0.00 0.00 178.15 177.76 1k2w s ASN 38 N -6.43 5.94 0.54 2.19 2.47 -1.26 -4.67 114.94 113.71 1k2w s ASN 38 Ca 0.01 -1.73 0.20 0.00 0.42 0.00 0.00 52.86 51.75 1k2w s ASN 38 Cb 0.10 -2.11 1.40 0.00 -1.45 0.00 0.00 41.25 39.19 1k2w s ASN 38 CO 0.69 -0.73 2.15 0.25 -3.72 0.00 0.00 177.10 175.75 1k2w h LEU 39 N 8.66 0.00 0.61 3.21 5.85 -1.92 -1.60 115.31 130.11 1k2w h LEU 39 Ca -0.26 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 1k2w h LEU 39 Cb 1.09 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 1k2w h LEU 39 CO 0.92 0.00 -0.37 -0.08 -0.34 0.00 0.00 178.44 178.57 1k2w h GLU 40 N 0.00 -0.89 -0.66 1.25 4.81 -1.96 0.13 114.58 117.26 1k2w h GLU 40 Ca 0.03 0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1k2w h GLU 40 Cb 0.11 0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 1k2w h GLU 40 CO -0.00 -0.59 0.33 0.00 -0.73 0.00 0.00 179.01 178.02 1k2w h ALA 41 N -0.60 0.85 -0.20 2.92 0.00 -1.92 -1.82 119.26 118.50 1k2w h ALA 41 Ca -0.07 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.75 1k2w h ALA 41 Cb 0.74 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1k2w h ALA 41 CO 0.08 0.40 -0.07 0.00 0.00 0.00 0.00 179.25 179.66 1k2w h ALA 42 N 1.15 0.11 -0.41 0.00 0.00 -1.06 -1.30 119.26 117.75 1k2w h ALA 42 Ca 0.23 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1k2w h ALA 42 Cb 0.10 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1k2w h ALA 42 CO -0.03 -0.50 0.26 0.00 0.00 0.00 0.00 179.25 178.98 1k2w h ARG 43 N -0.03 0.55 -0.43 0.00 3.08 -0.52 -1.59 114.38 115.44 1k2w h ARG 43 Ca 0.10 -0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.18 1k2w h ARG 43 Cb 0.18 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.05 1k2w h ARG 43 CO -0.22 0.38 0.05 0.00 -1.07 0.00 0.00 179.97 179.11 1k2w h ALA 44 N 1.13 0.45 -0.45 0.04 0.00 -0.81 0.20 119.26 119.82 1k2w h ALA 44 Ca 0.15 0.11 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 1k2w h ALA 44 Cb -0.03 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1k2w h ALA 44 CO -0.03 -0.35 -0.27 1.15 0.00 0.00 0.00 179.25 179.75 1k2w h THR 45 N 0.17 1.27 -0.70 0.00 2.02 -1.09 -1.64 112.91 112.94 1k2w h THR 45 Ca 0.21 -1.44 -0.02 0.00 0.77 0.00 0.00 66.41 65.94 1k2w h THR 45 Cb 0.29 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 1k2w h THR 45 CO -0.31 0.49 0.37 0.00 0.37 0.00 0.00 175.52 176.44 1k2w h ALA 46 N 0.86 0.90 -0.52 6.16 0.00 -0.78 0.25 119.26 126.12 1k2w h ALA 46 Ca 0.09 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1k2w h ALA 46 Cb 0.85 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1k2w h ALA 46 CO 0.08 0.42 -0.06 0.00 0.00 0.00 0.00 179.25 179.69 1k2w h ALA 47 N 1.18 0.92 -0.60 0.00 0.00 -0.90 -1.77 119.26 118.10 1k2w h ALA 47 Ca 0.24 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1k2w h ALA 47 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1k2w h ALA 47 CO -0.04 0.64 0.02 1.49 0.00 0.00 0.00 179.25 181.36 1k2w h GLU 48 N 0.84 1.04 0.03 0.00 4.81 -0.76 -3.17 114.58 117.37 1k2w h GLU 48 Ca 0.14 -0.31 -0.23 0.00 -0.13 0.00 0.00 59.36 58.84 1k2w h GLU 48 Cb 0.58 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.85 1k2w h GLU 48 CO 0.04 1.00 -0.98 0.82 -0.73 0.00 0.00 179.01 179.16 1k2w h ILE 49 N 0.95 1.46 0.00 2.32 2.04 -0.82 -3.50 117.51 119.96 1k2w h ILE 49 Ca 0.17 -2.65 0.00 0.00 1.00 0.00 0.00 64.86 63.38 1k2w h ILE 49 Cb 0.52 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 1k2w h ILE 49 CO 0.03 0.78 0.00 0.61 0.00 0.00 0.00 178.15 179.57 1k2w n GLY 50 N 1.05 1.28 0.31 5.37 0.00 -0.68 -4.80 105.19 107.72 1k2w n GLY 50 Ca -0.06 -2.23 0.11 0.00 0.00 0.00 0.00 46.02 43.84 1k2w n GLY 50 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1k2w h PRO 51 N 0.00 0.00 0.00 1.61 0.11 -1.89 -0.60 132.00 131.22 1k2w h PRO 51 Ca 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 1k2w h PRO 51 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1k2w h PRO 51 CO 0.00 0.00 -0.58 0.00 -0.21 0.00 0.00 178.00 177.21 1k2w h ALA 52 N 1.06 0.74 -3.10 -0.75 0.00 -1.91 -3.46 119.26 111.84 1k2w h ALA 52 Ca 0.00 -0.30 -0.66 0.00 0.00 0.00 0.00 54.91 53.95 1k2w h ALA 52 Cb 0.91 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.58 1k2w h ALA 52 CO 0.00 0.38 -0.56 0.00 0.00 0.00 0.00 179.25 179.07 1k2w s ALA 53 N -3.10 3.51 0.14 0.00 0.00 -0.24 -2.17 121.76 119.90 1k2w s ALA 53 Ca 0.03 -0.73 0.08 0.00 0.00 0.00 0.00 51.96 51.34 1k2w s ALA 53 Cb 0.07 -1.77 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 1k2w s ALA 53 CO 0.74 0.46 -0.19 0.00 0.00 0.00 0.00 175.76 176.77 1k2w s ALA 55 N -1.67 3.89 -0.28 0.00 0.00 -1.26 0.14 121.76 122.59 1k2w s ALA 55 Ca 0.11 -1.04 -0.21 0.00 0.00 0.00 0.00 51.96 50.82 1k2w s ALA 55 Cb -0.08 -1.70 0.10 0.00 0.00 0.00 0.00 23.12 21.44 1k2w s ALA 55 CO 0.05 0.57 0.82 -1.50 0.00 0.00 0.00 175.76 175.70 1k2w s ILE 56 N -1.71 0.00 0.17 0.00 2.07 -0.88 -4.89 121.20 115.97 1k2w s ILE 56 Ca 0.34 0.00 -0.30 0.00 -1.41 0.00 0.00 60.65 59.28 1k2w s ILE 56 Cb -0.11 -1.00 -0.08 0.00 0.13 0.00 0.00 42.46 41.40 1k2w s ILE 56 CO 0.27 0.00 1.11 0.00 -1.91 0.00 0.00 174.94 174.41 1k2w s ALA 57 N 0.90 3.38 -0.15 1.50 0.00 -1.26 -2.28 121.76 123.84 1k2w s ALA 57 Ca -0.04 0.83 -0.08 0.00 0.00 0.00 0.00 51.96 52.66 1k2w s ALA 57 Cb -0.05 -3.36 0.05 0.00 0.00 0.00 0.00 23.12 19.77 1k2w s ALA 57 CO -0.10 -0.23 0.37 -1.17 0.00 0.00 0.00 175.76 174.63 1k2w s LEU 58 N -0.31 0.06 -0.41 0.00 2.96 0.66 -4.80 118.68 116.84 1k2w s LEU 58 Ca 0.50 0.79 0.03 0.00 -0.22 0.00 0.00 54.13 55.23 1k2w s LEU 58 Cb -0.30 1.18 0.12 0.00 0.50 0.00 0.00 46.19 47.69 1k2w s LEU 58 CO 0.35 -0.18 0.16 -0.62 -1.32 0.00 0.00 176.35 174.73 1k2w s ASP 59 N 1.34 4.31 0.00 3.68 -1.08 -1.26 -2.27 116.67 121.38 1k2w s ASP 59 Ca -0.09 -2.42 0.00 0.00 -0.52 0.00 0.00 52.55 49.51 1k2w s ASP 59 Cb -0.09 -1.41 0.00 0.00 -1.46 0.00 0.00 42.92 39.97 1k2w s ASP 59 CO -0.11 -0.32 0.87 1.33 0.52 0.00 0.00 175.17 177.46 1k2w n VAL 60 N 3.87 1.49 0.88 1.11 0.24 -1.26 -0.90 118.33 123.76 1k2w n VAL 60 Ca 0.04 0.49 0.12 0.00 -2.04 0.00 0.00 64.34 62.95 1k2w n VAL 60 Cb 0.38 -1.49 0.28 0.00 -1.47 0.00 0.00 33.84 31.53 1k2w n VAL 60 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1k2w n THR 61 N -1.37 0.25 -4.01 3.34 -2.24 -1.26 -3.98 114.28 105.01 1k2w n THR 61 Ca 0.00 -0.51 -0.31 0.00 -2.27 0.00 0.00 64.05 60.96 1k2w n THR 61 Cb 0.12 0.84 -0.16 0.00 -2.10 0.00 0.00 70.33 69.03 1k2w n THR 61 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1k2w s ASP 62 N -1.68 3.38 0.27 3.42 2.15 -0.08 -5.01 116.67 119.12 1k2w s ASP 62 Ca 0.35 -0.87 -0.01 0.00 0.43 0.00 0.00 52.55 52.45 1k2w s ASP 62 Cb 0.20 -1.26 0.53 0.00 -0.30 0.00 0.00 42.92 42.10 1k2w s ASP 62 CO 0.30 -0.13 1.78 -0.61 -0.17 0.00 0.00 175.17 176.34 1k2w h GLN 63 N 7.97 0.70 -0.15 4.34 5.75 -1.87 -1.09 115.11 130.76 1k2w h GLN 63 Ca -0.29 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.19 1k2w h GLN 63 Cb 1.10 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.47 1k2w h GLN 63 CO 0.49 0.46 0.01 0.00 -2.65 0.00 0.00 178.83 177.14 1k2w h ALA 64 N 1.55 0.13 -0.53 3.38 0.00 -1.95 -0.01 119.26 121.84 1k2w h ALA 64 Ca 0.47 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.40 1k2w h ALA 64 Cb 0.60 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1k2w h ALA 64 CO -0.33 -0.44 0.29 1.03 0.00 0.00 0.00 179.25 179.80 1k2w h SER 65 N 0.06 0.64 0.04 0.00 0.87 -1.63 -1.39 113.55 112.14 1k2w h SER 65 Ca 0.07 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1k2w h SER 65 Cb 0.07 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1k2w h SER 65 CO -0.11 0.52 -0.02 0.40 -0.53 0.00 0.00 176.83 177.10 1k2w h ILE 66 N 0.73 1.15 -0.56 2.23 2.04 -0.26 -1.77 117.51 121.08 1k2w h ILE 66 Ca 0.19 -0.62 -0.05 0.00 1.00 0.00 0.00 64.86 65.38 1k2w h ILE 66 Cb 0.02 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1k2w h ILE 66 CO -0.03 0.16 0.15 0.44 0.00 0.00 0.00 178.15 178.86 1k2w h ASP 67 N -0.32 0.79 -0.46 1.72 3.32 -0.79 -2.44 116.42 118.24 1k2w h ASP 67 Ca -0.01 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.83 1k2w h ASP 67 Cb 0.29 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1k2w h ASP 67 CO 0.01 0.77 -0.00 0.03 -1.72 0.00 0.00 179.24 178.32 1k2w h ARG 68 N 0.82 0.82 -0.24 3.56 3.08 -1.21 -1.78 114.38 119.43 1k2w h ARG 68 Ca 0.18 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1k2w h ARG 68 Cb 0.28 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1k2w h ARG 68 CO -0.00 0.88 0.14 0.00 -1.07 0.00 0.00 179.97 179.91 1k2w h VAL 70 N 0.29 1.12 -0.55 0.00 2.07 -1.41 -2.04 116.25 115.73 1k2w h VAL 70 Ca 0.09 -0.46 0.07 0.00 0.82 0.00 0.00 66.70 67.21 1k2w h VAL 70 Cb 0.04 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 1k2w h VAL 70 CO -0.02 0.12 0.24 0.00 0.02 0.00 0.00 177.57 177.93 1k2w h ALA 71 N 0.72 0.70 -0.39 1.67 0.00 -1.28 0.54 119.26 121.22 1k2w h ALA 71 Ca -0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1k2w h ALA 71 Cb 0.23 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1k2w h ALA 71 CO 0.01 -0.15 0.21 1.49 0.00 0.00 0.00 179.25 180.81 1k2w h GLU 72 N 0.45 0.55 -0.29 0.00 4.81 -1.10 -2.11 114.58 116.88 1k2w h GLU 72 Ca 0.26 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.36 1k2w h GLU 72 Cb 0.25 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1k2w h GLU 72 CO -0.23 0.46 -0.10 -0.07 -0.73 0.00 0.00 179.01 178.33 1k2w h LEU 73 N 0.50 0.46 -1.21 1.64 3.38 -0.95 -1.32 115.31 117.81 1k2w h LEU 73 Ca 0.14 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1k2w h LEU 73 Cb 0.07 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1k2w h LEU 73 CO -0.02 0.61 -0.21 -0.07 0.09 0.00 0.00 178.44 178.84 1k2w h LEU 74 N 0.45 0.28 -0.13 1.67 3.38 -0.51 0.26 115.31 120.70 1k2w h LEU 74 Ca 0.09 -0.07 -0.24 0.00 0.09 0.00 0.00 57.88 57.74 1k2w h LEU 74 Cb 0.46 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.14 1k2w h LEU 74 CO 0.03 0.50 -0.98 0.44 0.09 0.00 0.00 178.44 178.52 1k2w h ASP 75 N 0.26 0.61 -0.05 -0.43 3.32 -0.80 0.13 116.42 119.47 1k2w h ASP 75 Ca 0.05 -0.50 -0.24 0.00 0.02 0.00 0.00 57.03 56.36 1k2w h ASP 75 Cb 0.52 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.90 1k2w h ASP 75 CO 0.04 1.30 -0.91 0.03 -1.72 0.00 0.00 179.24 177.98 1k2w h ARG 76 N 0.26 0.73 0.00 3.56 3.08 -0.92 -3.39 114.38 117.70 1k2w h ARG 76 Ca -0.09 -0.68 -0.29 0.00 0.07 0.00 0.00 59.98 58.99 1k2w h ARG 76 Cb 1.62 0.17 -0.05 0.00 0.08 0.00 0.00 29.97 31.79 1k2w h ARG 76 CO 0.17 1.27 -2.08 0.91 -1.07 0.00 0.00 179.97 179.18 1k2w n TRP 77 N -3.89 0.00 0.00 3.04 8.01 0.87 -5.01 117.44 120.46 1k2w n TRP 77 Ca -0.09 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.10 1k2w n TRP 77 Cb 0.81 -0.75 0.00 0.00 -2.01 0.00 0.00 31.31 29.36 1k2w n TRP 77 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1k2w n GLY 78 N 2.35 3.27 3.62 6.99 0.00 0.47 -4.99 105.19 116.90 1k2w n GLY 78 Ca -0.30 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.66 1k2w n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k2w s SER 79 N -1.10 -0.17 -0.36 1.61 1.04 -1.26 -4.98 113.70 108.48 1k2w s SER 79 Ca 0.00 0.20 -0.07 0.00 0.48 0.00 0.00 55.95 56.56 1k2w s SER 79 Cb 0.00 0.17 0.05 0.00 0.10 0.00 0.00 66.02 66.34 1k2w s SER 79 CO 0.00 -0.14 0.15 -0.63 0.98 0.00 0.00 173.24 173.60 1k2w s ILE 80 N -0.89 3.87 0.05 -1.02 1.01 -1.26 -4.77 121.20 118.19 1k2w s ILE 80 Ca 0.05 -1.25 -0.09 0.00 0.00 0.00 0.00 60.65 59.36 1k2w s ILE 80 Cb -0.01 -3.27 -0.31 0.00 0.01 0.00 0.00 42.46 38.88 1k2w s ILE 80 CO -0.05 -0.29 1.07 0.44 0.00 0.00 0.00 174.94 176.10 1k2w h ASP 81 N 8.26 0.59 -4.19 3.58 3.32 -1.81 -3.45 116.42 122.71 1k2w h ASP 81 Ca -0.22 -0.64 -0.45 0.00 0.02 0.00 0.00 57.03 55.74 1k2w h ASP 81 Cb 1.08 -0.19 -0.28 0.00 0.22 0.00 0.00 39.33 40.16 1k2w h ASP 81 CO 0.65 1.50 -0.80 -0.63 -1.72 0.00 0.00 179.24 178.24 1k2w s ILE 82 N -2.63 1.00 -0.13 0.35 1.01 0.01 -0.96 121.20 119.85 1k2w s ILE 82 Ca -0.06 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 59.94 1k2w s ILE 82 Cb 0.06 -0.86 0.03 0.00 0.01 0.00 0.00 42.46 41.71 1k2w s ILE 82 CO 0.91 0.21 -0.04 -0.22 0.00 0.00 0.00 174.94 175.80 1k2w s LEU 83 N -0.49 1.14 -0.36 2.97 1.98 -0.35 -0.90 118.68 122.67 1k2w s LEU 83 Ca 0.04 -0.40 -0.05 0.00 -2.89 0.00 0.00 54.13 50.83 1k2w s LEU 83 Cb -0.05 -0.72 0.07 0.00 0.66 0.00 0.00 46.19 46.14 1k2w s LEU 83 CO -0.00 -0.18 0.12 -0.69 -1.89 0.00 0.00 176.35 173.71 1k2w s VAL 84 N 1.78 3.51 -1.23 1.68 1.01 -0.22 -0.92 120.40 126.01 1k2w s VAL 84 Ca 0.03 -1.47 -0.20 0.00 0.00 0.00 0.00 61.98 60.35 1k2w s VAL 84 Cb -0.14 -3.12 0.05 0.00 0.00 0.00 0.00 36.38 33.17 1k2w s VAL 84 CO -0.07 -0.33 1.72 0.20 0.00 0.00 0.00 175.10 176.61 1k2w s ASN 85 N 1.58 6.53 0.06 3.32 0.01 -0.41 -2.29 114.94 123.74 1k2w s ASN 85 Ca 0.00 -2.14 0.20 0.00 -0.71 0.00 0.00 52.86 50.22 1k2w s ASN 85 Cb -0.21 -2.58 -0.15 0.00 0.41 0.00 0.00 41.25 38.72 1k2w s ASN 85 CO -0.00 -1.49 0.74 -3.20 -1.51 0.00 0.00 177.10 171.63 1k2w n ASN 86 N 9.32 0.55 -4.71 -1.22 5.15 -1.23 -2.85 115.26 120.27 1k2w n ASN 86 Ca 0.45 0.22 -0.43 0.00 -0.60 0.00 0.00 54.58 54.23 1k2w n ASN 86 Cb 0.47 0.83 -0.03 0.00 -0.53 0.00 0.00 39.78 40.52 1k2w n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1k2w n ALA 87 N -2.32 2.39 -3.55 5.20 0.00 -0.90 -4.88 120.51 116.45 1k2w n ALA 87 Ca -0.07 0.41 -0.07 0.00 0.00 0.00 0.00 53.44 53.71 1k2w n ALA 87 Cb 0.70 -2.47 -0.02 0.00 0.00 0.00 0.00 19.45 17.66 1k2w n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k2w s ALA 88 N 0.94 -1.89 0.09 0.00 0.00 -1.26 -4.64 121.76 115.00 1k2w s ALA 88 Ca 0.75 1.09 0.09 0.00 0.00 0.00 0.00 51.96 53.88 1k2w s ALA 88 Cb -0.55 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 1k2w s ALA 88 CO 0.36 -0.70 -0.23 -0.51 0.00 0.00 0.00 175.76 174.68 1k2w s LEU 89 N -2.45 2.26 0.12 0.00 1.43 -1.26 -5.02 118.68 113.76 1k2w s LEU 89 Ca 0.07 -0.65 0.10 0.00 -1.03 0.00 0.00 54.13 52.61 1k2w s LEU 89 Cb -0.01 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.16 1k2w s LEU 89 CO -0.07 0.13 -0.21 0.12 0.23 0.00 0.00 176.35 176.54 1k2w s PHE 90 N -1.03 2.45 -0.03 0.29 2.19 -1.26 -4.94 117.98 115.65 1k2w s PHE 90 Ca 0.09 -0.31 -0.29 0.00 0.33 0.00 0.00 56.93 56.75 1k2w s PHE 90 Cb -0.10 -1.32 0.10 0.00 -1.31 0.00 0.00 43.02 40.40 1k2w s PHE 90 CO 0.04 0.36 0.86 0.34 1.83 0.00 0.00 175.22 178.65 1k2w s ASP 91 N -2.07 -0.43 -0.02 6.13 3.68 -1.26 -5.11 116.67 117.60 1k2w s ASP 91 Ca 0.16 0.20 -0.10 0.00 2.13 0.00 0.00 52.55 54.94 1k2w s ASP 91 Cb -0.10 0.41 0.01 0.00 -1.45 0.00 0.00 42.92 41.79 1k2w s ASP 91 CO 0.08 -0.58 0.22 -1.48 0.13 0.00 0.00 175.17 173.54 1k2w s LEU 92 N -1.97 1.22 0.00 -1.34 0.05 -1.26 -4.40 118.68 110.98 1k2w s LEU 92 Ca 0.01 -0.00 0.00 0.00 0.05 0.00 0.00 54.13 54.18 1k2w s LEU 92 Cb -0.01 0.93 0.00 0.00 -2.05 0.00 0.00 46.19 45.06 1k2w s LEU 92 CO -0.04 -0.36 0.00 0.00 -0.55 0.00 0.00 176.35 175.39 1k2w n ALA 93 N 1.57 0.00 -0.54 1.48 0.00 -0.34 -5.01 120.51 117.67 1k2w n ALA 93 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.94 1k2w n ALA 93 Cb 0.56 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.24 1k2w n ALA 93 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1k2w s PRO 94 N -1.45 -0.47 0.11 0.00 0.02 -1.26 -4.37 135.00 127.58 1k2w s PRO 94 Ca 0.00 1.09 -0.25 0.00 0.02 0.00 0.00 61.00 61.86 1k2w s PRO 94 Cb 0.00 -1.59 -0.08 0.00 0.02 0.00 0.00 34.50 32.85 1k2w s PRO 94 CO 0.00 -3.50 1.66 0.82 -0.33 0.00 0.00 177.00 175.65 1k2w h ILE 95 N -2.47 0.55 0.00 2.83 1.08 -1.97 -1.95 117.51 115.59 1k2w h ILE 95 Ca -0.56 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 63.91 1k2w h ILE 95 Cb 1.31 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 35.62 1k2w h ILE 95 CO 0.47 0.00 0.00 1.33 -0.69 0.00 0.00 178.15 179.26 1k2w n VAL 96 N -5.32 0.60 0.02 1.67 0.24 -1.26 -2.13 118.33 112.15 1k2w n VAL 96 Ca -0.06 0.15 0.01 0.00 -2.04 0.00 0.00 64.34 62.40 1k2w n VAL 96 Cb 0.24 -1.02 0.02 0.00 -1.47 0.00 0.00 33.84 31.61 1k2w n VAL 96 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1k2w n GLU 97 N -1.20 1.21 -2.25 7.34 1.02 -0.76 -5.02 120.64 120.97 1k2w n GLU 97 Ca 0.04 -1.13 -0.42 0.00 -0.02 0.00 0.00 57.16 55.63 1k2w n GLU 97 Cb 0.05 -1.04 -0.03 0.00 -0.02 0.00 0.00 31.44 30.40 1k2w n GLU 97 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1k2w s ILE 98 N -0.60 3.50 0.11 -3.67 1.01 -0.91 -4.85 121.20 115.78 1k2w s ILE 98 Ca 0.03 1.09 0.02 0.00 0.00 0.00 0.00 60.65 61.80 1k2w s ILE 98 Cb 0.02 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 1k2w s ILE 98 CO 0.03 0.10 0.21 0.42 0.00 0.00 0.00 174.94 175.69 1k2w s THR 99 N 0.94 5.14 0.44 2.92 -4.23 -1.26 -4.98 115.64 114.61 1k2w s THR 99 Ca 0.62 -0.62 0.10 0.00 -1.18 0.00 0.00 61.69 60.60 1k2w s THR 99 Cb -0.35 -3.57 0.25 0.00 1.34 0.00 0.00 72.50 70.17 1k2w s THR 99 CO 0.31 0.03 2.06 0.03 -0.54 0.00 0.00 174.62 176.51 1k2w h ARG 100 N 2.71 0.34 -0.39 3.99 2.47 -1.99 -1.46 114.38 120.05 1k2w h ARG 100 Ca -0.47 -0.03 -0.07 0.00 -1.26 0.00 0.00 59.98 58.15 1k2w h ARG 100 Cb 1.18 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 29.41 1k2w h ARG 100 CO 0.71 0.26 -0.02 0.93 0.56 0.00 0.00 179.97 182.41 1k2w h GLU 101 N 0.34 0.70 0.03 0.04 4.39 -1.99 0.29 114.58 118.38 1k2w h GLU 101 Ca 0.09 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.55 1k2w h GLU 101 Cb 0.04 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1k2w h GLU 101 CO -0.01 0.81 -0.01 1.03 -1.16 0.00 0.00 179.01 179.66 1k2w h SER 102 N 0.52 -0.03 -0.10 1.42 0.87 -1.71 -2.96 113.55 111.55 1k2w h SER 102 Ca 0.11 -0.17 0.04 0.00 -1.23 0.00 0.00 61.79 60.54 1k2w h SER 102 Cb 0.51 0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 62.42 1k2w h SER 102 CO 0.02 0.15 -0.30 0.22 -0.53 0.00 0.00 176.83 176.40 1k2w h TYR 103 N -0.22 -0.82 -0.65 2.24 3.20 -1.15 -3.00 116.97 116.57 1k2w h TYR 103 Ca -0.00 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.04 1k2w h TYR 103 Cb 0.21 0.38 -0.11 0.00 1.54 0.00 0.00 36.73 38.74 1k2w h TYR 103 CO -0.01 -0.38 0.02 -0.44 -1.64 0.00 0.00 178.16 175.70 1k2w h ASP 104 N -0.39 -0.26 0.66 -2.11 3.45 -0.89 -2.30 116.42 114.57 1k2w h ASP 104 Ca 0.09 0.16 -0.03 0.00 0.43 0.00 0.00 57.03 57.68 1k2w h ASP 104 Cb 0.53 0.28 0.01 0.00 -0.56 0.00 0.00 39.33 39.58 1k2w h ASP 104 CO -0.32 -0.12 -0.32 0.03 -1.57 0.00 0.00 179.24 176.95 1k2w h ARG 105 N 0.13 -0.85 -0.67 3.56 3.08 -1.47 -1.66 114.38 116.50 1k2w h ARG 105 Ca 0.34 0.06 0.12 0.00 0.07 0.00 0.00 59.98 60.57 1k2w h ARG 105 Cb 0.57 0.19 -0.08 0.00 0.08 0.00 0.00 29.97 30.73 1k2w h ARG 105 CO -0.55 -0.54 0.24 -0.07 -1.07 0.00 0.00 179.97 177.98 1k2w h LEU 106 N -1.17 0.21 -0.60 3.04 3.38 -1.52 0.34 115.31 118.99 1k2w h LEU 106 Ca -0.09 0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 1k2w h LEU 106 Cb 0.71 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1k2w h LEU 106 CO 0.15 0.11 -0.53 -0.26 0.09 0.00 0.00 178.44 177.99 1k2w h PHE 107 N 0.40 0.57 -0.27 1.13 -1.00 -1.49 0.24 116.94 116.53 1k2w h PHE 107 Ca 0.35 -0.20 -0.01 0.00 2.81 0.00 0.00 57.97 60.93 1k2w h PHE 107 Cb 0.49 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.92 1k2w h PHE 107 CO -0.18 0.89 0.14 0.00 -1.61 0.00 0.00 178.31 177.56 1k2w h ALA 108 N 1.07 0.35 0.00 2.45 0.00 -0.06 0.18 119.26 123.24 1k2w h ALA 108 Ca 0.01 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1k2w h ALA 108 Cb 1.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1k2w h ALA 108 CO 0.10 -0.11 -0.64 0.82 0.00 0.00 0.00 179.25 179.42 1k2w h ILE 109 N 0.32 1.00 -0.52 0.00 2.04 -0.36 -1.05 117.51 118.93 1k2w h ILE 109 Ca 0.09 -1.97 -0.09 0.00 1.00 0.00 0.00 64.86 63.89 1k2w h ILE 109 Cb 0.08 2.11 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 1k2w h ILE 109 CO -0.01 0.34 -0.04 0.78 0.00 0.00 0.00 178.15 179.22 1k2w h ASN 110 N -1.00 0.93 0.00 1.72 2.35 -0.64 -3.12 115.58 115.82 1k2w h ASN 110 Ca -0.16 -0.32 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1k2w h ASN 110 Cb 0.98 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 39.10 1k2w h ASN 110 CO -0.10 1.03 -0.68 0.52 -1.65 0.00 0.00 177.43 176.55 1k2w n VAL 111 N -4.26 1.05 -0.12 2.81 0.31 -0.80 -4.07 118.33 113.24 1k2w n VAL 111 Ca 0.01 0.25 -0.05 0.00 -0.01 0.00 0.00 64.34 64.55 1k2w n VAL 111 Cb 0.35 -2.10 0.02 0.00 -0.91 0.00 0.00 33.84 31.21 1k2w n VAL 111 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1k2w h SER 112 N -0.70 -0.28 -0.64 4.52 0.87 -0.70 -0.79 113.55 115.83 1k2w h SER 112 Ca 0.00 0.11 0.07 0.00 -1.23 0.00 0.00 61.79 60.74 1k2w h SER 112 Cb 0.68 0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 62.80 1k2w h SER 112 CO 0.00 -0.09 0.33 1.23 -0.53 0.00 0.00 176.83 177.76 1k2w h GLY 113 N 0.05 0.94 0.94 5.77 0.00 -1.11 -1.87 103.07 107.78 1k2w h GLY 113 Ca 0.20 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 1k2w h GLY 113 CO -0.38 0.10 -0.04 -0.84 0.00 0.00 0.00 176.54 175.38 1k2w h THR 114 N 0.59 1.27 0.83 4.70 2.02 -1.48 -2.02 112.91 118.83 1k2w h THR 114 Ca 0.30 -1.08 -0.04 0.00 0.77 0.00 0.00 66.41 66.36 1k2w h THR 114 Cb 0.25 1.23 0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1k2w h THR 114 CO -0.22 0.36 -0.40 0.25 0.37 0.00 0.00 175.52 175.88 1k2w h LEU 115 N 0.48 -0.94 -1.54 2.58 5.85 -0.86 -1.18 115.31 119.70 1k2w h LEU 115 Ca 0.10 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1k2w h LEU 115 Cb 0.53 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 1k2w h LEU 115 CO 0.03 -0.64 -0.24 -0.26 -0.34 0.00 0.00 178.44 176.99 1k2w h PHE 116 N -1.17 0.00 -0.29 1.25 0.04 -1.46 -0.47 116.94 114.84 1k2w h PHE 116 Ca -0.11 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.54 1k2w h PHE 116 Cb 0.85 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.99 1k2w h PHE 116 CO 0.03 0.24 -0.30 1.98 -0.60 0.00 0.00 178.31 179.65 1k2w h MET 117 N 0.00 0.62 -0.25 1.51 4.05 -1.34 -1.28 114.93 118.23 1k2w h MET 117 Ca -0.00 -0.27 -0.04 0.00 -0.28 0.00 0.00 59.70 59.11 1k2w h MET 117 Cb 0.44 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.21 1k2w h MET 117 CO 0.03 0.85 0.01 0.52 0.23 0.00 0.00 176.91 178.55 1k2w h MET 118 N 0.53 0.44 -0.59 0.39 2.07 -0.10 -2.76 114.93 114.92 1k2w h MET 118 Ca 0.06 -0.14 0.00 0.00 -2.07 0.00 0.00 59.70 57.56 1k2w h MET 118 Cb 0.79 -0.04 -0.03 0.00 -1.87 0.00 0.00 31.60 30.45 1k2w h MET 118 CO 0.06 0.60 0.38 0.37 1.07 0.00 0.00 176.91 179.39 1k2w h GLN 119 N 0.22 0.78 0.01 1.72 4.15 -0.95 0.16 115.11 121.21 1k2w h GLN 119 Ca 0.07 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.43 1k2w h GLN 119 Cb 0.40 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.92 1k2w h GLN 119 CO 0.01 0.54 -0.00 0.00 -1.93 0.00 0.00 178.83 177.44 1k2w h ALA 120 N 1.20 -0.01 -0.10 3.38 0.00 -1.21 -1.36 119.26 121.16 1k2w h ALA 120 Ca 0.21 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1k2w h ALA 120 Cb -0.06 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1k2w h ALA 120 CO -0.04 -0.48 -0.59 0.28 0.00 0.00 0.00 179.25 178.42 1k2w h VAL 121 N -0.07 1.37 -0.09 0.00 2.07 -1.41 -2.78 116.25 115.33 1k2w h VAL 121 Ca -0.00 -1.92 -0.00 0.00 0.82 0.00 0.00 66.70 65.60 1k2w h VAL 121 Cb 0.07 1.94 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1k2w h VAL 121 CO 0.00 0.57 0.04 0.00 0.02 0.00 0.00 177.57 178.21 1k2w h ALA 122 N 1.14 0.12 -0.61 1.67 0.00 -0.56 0.71 119.26 121.73 1k2w h ALA 122 Ca -0.00 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 54.95 1k2w h ALA 122 Cb 1.10 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.76 1k2w h ALA 122 CO 0.10 -0.31 0.11 0.00 0.00 0.00 0.00 179.25 179.14 1k2w h ARG 123 N 0.02 0.23 -0.34 0.00 3.08 -1.17 0.32 114.38 116.51 1k2w h ARG 123 Ca 0.03 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1k2w h ARG 123 Cb 0.13 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 1k2w h ARG 123 CO -0.00 0.15 0.14 0.00 -1.07 0.00 0.00 179.97 179.19 1k2w h ALA 124 N 1.50 0.45 -0.59 0.04 0.00 -1.18 -1.50 119.26 117.98 1k2w h ALA 124 Ca 0.32 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1k2w h ALA 124 Cb 0.50 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1k2w h ALA 124 CO -0.43 0.04 0.35 0.52 0.00 0.00 0.00 179.25 179.73 1k2w h MET 125 N 0.41 0.81 -0.72 0.00 2.86 0.51 0.34 114.93 119.14 1k2w h MET 125 Ca 0.12 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 1k2w h MET 125 Cb 0.18 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 1k2w h MET 125 CO -0.01 0.59 0.41 0.82 1.06 0.00 0.00 176.91 179.78 1k2w h ILE 126 N 0.80 1.21 -0.08 -1.22 2.04 -0.25 -1.39 117.51 118.61 1k2w h ILE 126 Ca 0.21 -0.51 -0.09 0.00 1.00 0.00 0.00 64.86 65.47 1k2w h ILE 126 Cb 0.00 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1k2w h ILE 126 CO -0.04 0.23 -0.36 0.00 0.00 0.00 0.00 178.15 177.98 1k2w h ALA 127 N 1.21 1.24 -0.20 1.87 0.00 -0.79 -2.51 119.26 120.08 1k2w h ALA 127 Ca 0.25 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1k2w h ALA 127 Cb 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1k2w h ALA 127 CO -0.04 0.53 -0.03 0.78 0.00 0.00 0.00 179.25 180.49 1k2w h GLY 128 N 1.14 0.31 0.00 0.00 0.00 0.72 -3.47 103.07 101.78 1k2w h GLY 128 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1k2w h GLY 128 CO 0.05 0.16 0.00 0.61 0.00 0.00 0.00 176.54 177.36 1k2w n GLY 129 N -1.07 0.68 1.00 4.60 0.00 -0.81 -4.88 105.19 104.71 1k2w n GLY 129 Ca -0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1k2w n GLY 129 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1k2w n ARG 130 N -2.60 0.71 0.00 1.61 1.85 -1.26 -5.10 116.66 111.87 1k2w n ARG 130 Ca 0.00 -2.51 0.00 0.00 -1.00 0.00 0.00 57.85 54.34 1k2w n ARG 130 Cb 0.00 -0.77 0.00 0.00 -1.05 0.00 0.00 32.46 30.65 1k2w n ARG 130 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1k2w n GLY 131 N -0.29 0.91 0.00 2.89 0.00 -1.26 -5.02 105.19 102.43 1k2w n GLY 131 Ca 0.11 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1k2w n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k2w n GLY 132 N 0.00 -1.69 3.07 -0.02 0.00 -0.90 -4.88 105.19 100.77 1k2w n GLY 132 Ca 0.00 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.63 1k2w n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k2w s LYS 133 N -1.52 2.20 -0.09 1.61 -0.14 -0.13 -1.80 119.74 119.86 1k2w s LYS 133 Ca 0.00 -0.57 0.04 0.00 -1.36 0.00 0.00 55.97 54.08 1k2w s LYS 133 Cb 0.00 -1.83 0.00 0.00 -1.68 0.00 0.00 37.83 34.33 1k2w s LYS 133 CO 0.00 -0.01 -0.22 0.42 -0.76 0.00 0.00 175.35 174.78 1k2w s ILE 134 N 0.83 1.93 -0.15 2.17 1.01 0.14 -1.22 121.20 125.92 1k2w s ILE 134 Ca -0.10 -0.95 -0.00 0.00 0.00 0.00 0.00 60.65 59.60 1k2w s ILE 134 Cb -0.15 -1.68 0.03 0.00 0.01 0.00 0.00 42.46 40.67 1k2w s ILE 134 CO 0.01 0.53 -0.09 -0.63 0.00 0.00 0.00 174.94 174.76 1k2w s ILE 135 N 0.37 1.28 0.17 2.92 1.01 -0.09 -2.00 121.20 124.86 1k2w s ILE 135 Ca -0.18 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 59.91 1k2w s ILE 135 Cb -0.18 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.94 1k2w s ILE 135 CO 0.08 0.30 0.33 0.20 0.00 0.00 0.00 174.94 175.85 1k2w s ASN 136 N 1.59 6.36 -0.35 3.58 0.01 -0.15 -1.29 114.94 124.69 1k2w s ASN 136 Ca 0.03 0.28 -0.10 0.00 -0.71 0.00 0.00 52.86 52.36 1k2w s ASN 136 Cb -0.14 -1.96 0.02 0.00 0.41 0.00 0.00 41.25 39.59 1k2w s ASN 136 CO -0.09 0.01 0.17 -0.04 -1.51 0.00 0.00 177.10 175.65 1k2w s MET 137 N -3.25 2.93 0.00 -0.60 -1.94 -1.13 -1.53 119.30 113.78 1k2w s MET 137 Ca 0.36 -1.00 0.00 0.00 -1.71 0.00 0.00 55.69 53.34 1k2w s MET 137 Cb -0.11 -3.63 0.00 0.00 2.01 0.00 0.00 34.83 33.10 1k2w s MET 137 CO 0.29 -0.61 0.00 0.00 -0.01 0.00 0.00 175.02 174.68 1k2w n ALA 138 N 4.96 0.00 0.00 3.03 0.00 0.11 -4.95 120.51 123.66 1k2w n ALA 138 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1k2w n ALA 138 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1k2w n ALA 138 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1k2w n SER 139 N 0.00 0.00 0.21 0.00 2.88 -1.26 -4.43 113.62 111.02 1k2w n SER 139 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1k2w n SER 139 Cb 0.00 0.00 0.68 0.00 -0.75 0.00 0.00 64.21 64.14 1k2w n SER 139 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 1k2w h GLN 140 N 0.00 0.00 0.00 -1.46 3.07 -1.56 0.30 115.11 115.45 1k2w h GLN 140 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 1k2w h GLN 140 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.56 1k2w h GLN 140 CO 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 178.83 178.92 1k2w h ALA 141 N 1.93 1.08 0.00 0.06 0.00 -1.85 0.17 119.26 120.65 1k2w h ALA 141 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1k2w h ALA 141 Cb 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1k2w h ALA 141 CO -0.00 0.00 -0.21 0.41 0.00 0.00 0.00 179.25 179.45 1k2w n GLY 142 N -1.11 -1.50 0.10 0.00 0.00 0.10 -3.88 105.19 98.91 1k2w n GLY 142 Ca -0.03 -0.15 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 1k2w n GLY 142 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1k2w h ARG 143 N 0.00 0.19 -2.64 1.61 2.47 -0.73 -3.37 114.38 111.90 1k2w h ARG 143 Ca 0.00 -0.32 -0.10 0.00 -1.26 0.00 0.00 59.98 58.30 1k2w h ARG 143 Cb 0.62 0.12 -0.21 0.00 -1.65 0.00 0.00 29.97 28.85 1k2w h ARG 143 CO 0.00 1.01 -0.13 -0.98 0.56 0.00 0.00 179.97 180.43 1k2w s ARG 144 N -2.62 0.71 0.85 0.04 3.03 -1.20 -5.14 118.95 114.62 1k2w s ARG 144 Ca -0.08 0.22 -0.12 0.00 2.03 0.00 0.00 55.73 57.78 1k2w s ARG 144 Cb 0.07 0.33 0.10 0.00 -1.03 0.00 0.00 34.95 34.43 1k2w s ARG 144 CO 0.84 -0.17 1.11 0.20 -1.13 0.00 0.00 175.30 176.14 1k2w s GLY 145 N -0.71 1.60 0.02 3.88 0.00 -1.26 -4.64 107.32 106.20 1k2w s GLY 145 Ca -0.08 -0.30 0.01 0.00 0.00 0.00 0.00 44.72 44.35 1k2w s GLY 145 CO 0.04 0.18 -0.04 -0.54 0.00 0.00 0.00 173.10 172.75 1k2w s GLU 146 N -5.16 0.31 0.18 2.90 2.02 -1.26 -5.07 118.70 112.62 1k2w s GLU 146 Ca 0.62 -0.41 -0.15 0.00 0.02 0.00 0.00 54.97 55.06 1k2w s GLU 146 Cb -0.15 -0.13 0.16 0.00 0.10 0.00 0.00 34.13 34.11 1k2w s GLU 146 CO 0.54 0.02 1.66 0.00 0.02 0.00 0.00 175.26 177.51 1k2w h ALA 147 N 5.28 0.37 -0.61 5.21 0.00 -1.98 -2.69 119.26 124.84 1k2w h ALA 147 Ca -0.30 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1k2w h ALA 147 Cb 1.20 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1k2w h ALA 147 CO 0.45 -0.43 0.00 1.28 0.00 0.00 0.00 179.25 180.55 1k2w n LEU 148 N -5.32 5.19 -1.53 0.00 4.77 -1.26 -4.40 117.00 114.44 1k2w n LEU 148 Ca 0.05 -2.68 0.02 0.00 -0.03 0.00 0.00 56.01 53.37 1k2w n LEU 148 Cb 0.27 -0.63 0.06 0.00 -2.33 0.00 0.00 43.42 40.79 1k2w n LEU 148 CO 0.12 0.73 0.12 0.52 -1.33 0.00 0.00 177.39 177.55 1k2w n VAL 149 N 0.86 0.77 -0.14 4.08 0.31 -1.02 -1.20 118.33 121.99 1k2w n VAL 149 Ca 0.27 -1.91 -0.08 0.00 -0.01 0.00 0.00 64.34 62.61 1k2w n VAL 149 Cb 1.03 0.68 -0.03 0.00 -0.91 0.00 0.00 33.84 34.61 1k2w n VAL 149 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1k2w h GLY 150 N 1.29 -0.38 0.87 2.92 0.00 -1.76 -0.56 103.07 105.44 1k2w h GLY 150 Ca -0.14 0.48 -0.03 0.00 0.00 0.00 0.00 47.33 47.65 1k2w h GLY 150 CO 0.12 -0.19 -0.37 -2.08 0.00 0.00 0.00 176.54 174.02 1k2w h VAL 151 N -0.27 0.25 -0.64 4.60 2.07 -1.89 -1.61 116.25 118.76 1k2w h VAL 151 Ca 0.17 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.75 1k2w h VAL 151 Cb 0.56 0.25 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 1k2w h VAL 151 CO -0.58 0.00 0.34 0.22 0.02 0.00 0.00 177.57 177.57 1k2w h TYR 152 N -0.92 0.62 -0.49 1.57 3.20 -1.73 -2.09 116.97 117.13 1k2w h TYR 152 Ca -0.08 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 1k2w h TYR 152 Cb 0.74 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 1k2w h TYR 152 CO -0.09 0.28 0.30 0.00 -1.64 0.00 0.00 178.16 177.02 1k2w h ALA 154 N 1.15 1.01 -0.67 0.00 0.00 -0.75 -0.27 119.26 119.73 1k2w h ALA 154 Ca 0.18 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1k2w h ALA 154 Cb -0.03 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1k2w h ALA 154 CO -0.03 0.22 0.18 1.79 0.00 0.00 0.00 179.25 181.41 1k2w h THR 155 N 0.88 1.26 0.00 0.00 1.35 -1.04 -1.75 112.91 113.60 1k2w h THR 155 Ca 0.32 -0.92 -0.10 0.00 -0.55 0.00 0.00 66.41 65.16 1k2w h THR 155 Cb 0.09 0.58 -0.01 0.00 -1.73 0.00 0.00 68.15 67.07 1k2w h THR 155 CO -0.14 0.35 -0.47 0.11 -0.25 0.00 0.00 175.52 175.12 1k2w h LYS 156 N 0.99 0.00 -0.43 4.72 1.79 -0.98 -2.00 116.57 120.66 1k2w h LYS 156 Ca 0.21 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.55 1k2w h LYS 156 Cb 0.34 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.98 1k2w h LYS 156 CO -0.00 0.47 -0.25 0.00 -1.08 0.00 0.00 179.45 178.60 1k2w h ALA 157 N 1.53 0.76 -0.08 3.86 0.00 -0.67 -2.34 119.26 122.31 1k2w h ALA 157 Ca -0.00 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1k2w h ALA 157 Cb 0.97 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1k2w h ALA 157 CO 0.06 0.66 -0.33 0.00 0.00 0.00 0.00 179.25 179.64 1k2w h ALA 158 N 0.95 1.30 -0.15 0.00 0.00 -0.99 -2.13 119.26 118.24 1k2w h ALA 158 Ca 0.10 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1k2w h ALA 158 Cb 0.80 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1k2w h ALA 158 CO 0.07 0.49 0.01 0.28 0.00 0.00 0.00 179.25 180.10 1k2w h VAL 159 N 0.14 1.24 -0.99 0.00 2.07 -1.06 0.63 116.25 118.28 1k2w h VAL 159 Ca 0.02 -0.77 0.05 0.00 0.82 0.00 0.00 66.70 66.81 1k2w h VAL 159 Cb 0.66 1.46 -0.06 0.00 -1.52 0.00 0.00 31.29 31.83 1k2w h VAL 159 CO 0.05 0.23 0.64 0.40 0.02 0.00 0.00 177.57 178.91 1k2w h ILE 160 N 0.02 1.14 -0.25 4.57 2.04 -1.23 0.21 117.51 124.01 1k2w h ILE 160 Ca 0.04 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.45 1k2w h ILE 160 Cb 0.34 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.22 1k2w h ILE 160 CO 0.01 0.22 0.02 -1.28 0.00 0.00 0.00 178.15 177.12 1k2w h SER 161 N 1.22 0.42 -0.24 1.72 0.87 -1.10 -2.58 113.55 113.86 1k2w h SER 161 Ca 0.40 -0.29 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 1k2w h SER 161 Cb 0.06 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 1k2w h SER 161 CO -0.14 0.60 -0.00 -0.07 -0.53 0.00 0.00 176.83 176.69 1k2w h LEU 162 N 0.22 0.51 -1.26 2.23 3.38 -0.27 -1.43 115.31 118.68 1k2w h LEU 162 Ca 0.07 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1k2w h LEU 162 Cb 0.38 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1k2w h LEU 162 CO 0.01 0.58 0.14 0.74 0.09 0.00 0.00 178.44 179.99 1k2w h THR 163 N 0.52 1.18 -0.02 0.22 2.02 -0.40 -0.52 112.91 115.91 1k2w h THR 163 Ca 0.11 -0.63 -0.06 0.00 0.77 0.00 0.00 66.41 66.61 1k2w h THR 163 Cb 0.34 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 1k2w h THR 163 CO 0.01 0.23 -0.21 1.56 0.37 0.00 0.00 175.52 177.49 1k2w h GLN 164 N 0.64 0.18 -0.71 6.66 4.20 -0.96 -0.88 115.11 124.24 1k2w h GLN 164 Ca 0.15 -0.16 0.02 0.00 0.06 0.00 0.00 58.65 58.72 1k2w h GLN 164 Cb 0.20 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 1k2w h GLN 164 CO -0.01 0.85 0.46 0.77 -0.67 0.00 0.00 178.83 180.23 1k2w h SER 165 N -0.44 0.77 -0.17 1.46 0.02 -1.17 -1.05 113.55 112.97 1k2w h SER 165 Ca -0.02 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.81 1k2w h SER 165 Cb 0.91 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 1k2w h SER 165 CO 0.04 0.55 -0.30 0.00 -1.14 0.00 0.00 176.83 175.98 1k2w h ALA 166 N 1.28 0.27 -0.33 3.77 0.00 -1.17 -1.84 119.26 121.25 1k2w h ALA 166 Ca 0.27 -0.41 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1k2w h ALA 166 Cb -0.05 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.63 1k2w h ALA 166 CO -0.08 0.29 -0.12 0.78 0.00 0.00 0.00 179.25 180.12 1k2w h GLY 167 N 0.16 0.17 1.60 0.00 0.00 -0.86 0.59 103.07 104.74 1k2w h GLY 167 Ca 0.01 0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.40 1k2w h GLY 167 CO 0.07 -0.15 -0.30 1.41 0.00 0.00 0.00 176.54 177.57 1k2w h LEU 168 N -0.06 0.46 0.18 3.11 3.38 -1.20 -2.11 115.31 119.07 1k2w h LEU 168 Ca 0.16 -0.17 -0.30 0.00 0.09 0.00 0.00 57.88 57.66 1k2w h LEU 168 Cb 0.31 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 40.95 1k2w h LEU 168 CO -0.37 0.74 -1.35 -1.13 0.09 0.00 0.00 178.44 176.43 1k2w h ASN 169 N 0.40 0.63 0.57 -0.43 -1.24 -0.63 -3.37 115.58 111.51 1k2w h ASN 169 Ca 0.05 -0.67 0.00 0.00 0.71 0.00 0.00 56.30 56.39 1k2w h ASN 169 Cb 0.72 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.57 1k2w h ASN 169 CO 0.06 1.52 -0.73 0.18 -1.29 0.00 0.00 177.43 177.17 1k2w n LEU 170 N -3.63 0.62 0.28 0.34 4.77 0.20 -4.15 117.00 115.44 1k2w n LEU 170 Ca -0.12 0.04 0.13 0.00 -0.03 0.00 0.00 56.01 56.03 1k2w n LEU 170 Cb 1.06 -0.17 0.82 0.00 -2.33 0.00 0.00 43.42 42.80 1k2w n LEU 170 CO 0.57 0.05 1.10 -0.29 -1.33 0.00 0.00 177.39 177.49 1k2w h ILE 171 N 0.00 0.68 0.00 -0.08 6.09 -1.36 -0.47 117.51 122.37 1k2w h ILE 171 Ca 0.00 -0.02 -0.01 0.00 -1.37 0.00 0.00 64.86 63.46 1k2w h ILE 171 Cb 0.65 1.01 -0.00 0.00 0.47 0.00 0.00 36.82 38.95 1k2w h ILE 171 CO 0.00 0.01 -0.04 0.08 -3.07 0.00 0.00 178.15 175.12 1k2w h ARG 172 N 0.00 0.00 -0.59 2.19 0.11 -1.82 -2.10 114.38 112.17 1k2w h ARG 172 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1k2w h ARG 172 Cb 0.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.09 1k2w h ARG 172 CO 0.00 0.04 0.00 0.72 0.10 0.00 0.00 179.97 180.83 1k2w n HIS 173 N -3.22 0.79 -1.10 4.08 8.25 -0.20 -4.92 115.22 118.89 1k2w n HIS 173 Ca -0.01 -0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 1k2w n HIS 173 Cb 0.24 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.35 1k2w n HIS 173 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1k2w n GLY 174 N 1.55 0.45 3.31 -1.41 0.00 -0.79 -4.00 105.19 104.30 1k2w n GLY 174 Ca 0.22 -0.97 -0.35 0.00 0.00 0.00 0.00 46.02 44.91 1k2w n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k2w s ILE 175 N -2.00 3.50 -0.18 -0.61 1.01 -1.11 -2.12 121.20 119.69 1k2w s ILE 175 Ca 0.00 -0.57 -0.19 0.00 0.00 0.00 0.00 60.65 59.89 1k2w s ILE 175 Cb 0.00 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 1k2w s ILE 175 CO 0.00 0.32 0.53 0.20 0.00 0.00 0.00 174.94 175.99 1k2w s ASN 176 N 1.47 6.62 -0.18 3.58 -0.87 -0.75 -3.26 114.94 121.56 1k2w s ASN 176 Ca 0.04 0.75 0.01 0.00 -1.57 0.00 0.00 52.86 52.09 1k2w s ASN 176 Cb -0.15 -2.30 0.02 0.00 -0.02 0.00 0.00 41.25 38.79 1k2w s ASN 176 CO -0.02 -0.15 -0.19 -0.69 -2.57 0.00 0.00 177.10 173.49 1k2w s VAL 177 N 1.42 2.19 0.23 1.60 1.01 -1.26 -0.68 120.40 124.90 1k2w s VAL 177 Ca 0.26 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 1k2w s VAL 177 Cb -0.15 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 1k2w s VAL 177 CO 0.10 0.53 0.26 0.20 0.00 0.00 0.00 175.10 176.19 1k2w s ASN 178 N 1.28 0.23 0.07 3.32 0.01 -0.84 -1.52 114.94 117.47 1k2w s ASN 178 Ca 0.04 -1.29 0.02 0.00 -0.71 0.00 0.00 52.86 50.92 1k2w s ASN 178 Cb -0.13 0.47 -0.03 0.00 0.41 0.00 0.00 41.25 41.96 1k2w s ASN 178 CO -0.11 -0.97 -0.06 0.00 -1.51 0.00 0.00 177.10 174.44 1k2w s ALA 179 N -4.01 0.72 -0.09 0.60 0.00 0.58 -0.98 121.76 118.58 1k2w s ALA 179 Ca 0.34 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1k2w s ALA 179 Cb 0.04 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 1k2w s ALA 179 CO 0.13 -0.16 -0.12 0.42 0.00 0.00 0.00 175.76 176.03 1k2w s ILE 180 N -2.64 3.23 -0.36 0.00 1.01 -0.58 -0.95 121.20 120.90 1k2w s ILE 180 Ca 0.01 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 60.06 1k2w s ILE 180 Cb -0.01 -2.32 0.10 0.00 0.01 0.00 0.00 42.46 40.25 1k2w s ILE 180 CO -0.03 0.56 0.08 0.00 0.00 0.00 0.00 174.94 175.56 1k2w s ALA 181 N -0.33 2.87 0.80 9.38 0.00 0.02 0.04 121.76 134.54 1k2w s ALA 181 Ca 0.03 -2.59 -0.11 0.00 0.00 0.00 0.00 51.96 49.29 1k2w s ALA 181 Cb -0.13 -1.98 0.07 0.00 0.00 0.00 0.00 23.12 21.09 1k2w s ALA 181 CO 0.02 -1.74 1.09 -2.14 0.00 0.00 0.00 175.76 172.99 1k2w s PRO 182 N 0.77 2.07 0.00 0.00 0.02 -1.26 -1.93 135.00 134.67 1k2w s PRO 182 Ca 0.12 0.77 0.00 0.00 0.02 0.00 0.00 61.00 61.91 1k2w s PRO 182 Cb -0.20 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1k2w s PRO 182 CO -0.08 -1.66 0.00 0.41 -0.33 0.00 0.00 177.00 175.34 1k2w n GLY 183 N -1.81 0.47 3.38 0.52 0.00 -1.24 -1.68 105.19 104.83 1k2w n GLY 183 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1k2w n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1k2w s VAL 184 N 2.21 4.88 -0.14 1.61 -7.23 -1.26 -4.70 120.40 115.77 1k2w s VAL 184 Ca 0.00 -1.00 -0.11 0.00 -1.81 0.00 0.00 61.98 59.05 1k2w s VAL 184 Cb 0.00 -3.84 -0.05 0.00 0.56 0.00 0.00 36.38 33.05 1k2w s VAL 184 CO 0.00 -0.43 0.24 -0.69 -0.31 0.00 0.00 175.10 173.91 1k2w s VAL 185 N 1.58 5.34 0.44 1.32 1.01 -1.26 0.73 120.40 129.56 1k2w s VAL 185 Ca 0.03 0.43 -0.25 0.00 0.00 0.00 0.00 61.98 62.20 1k2w s VAL 185 Cb -0.22 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 1k2w s VAL 185 CO 0.06 0.48 1.29 -0.62 0.00 0.00 0.00 175.10 176.32 1k2w s ASP 186 N -0.13 6.09 0.23 3.32 3.68 -0.57 -4.85 116.67 124.44 1k2w s ASP 186 Ca 0.15 2.62 -0.22 0.00 2.13 0.00 0.00 52.55 57.23 1k2w s ASP 186 Cb -0.13 -2.63 0.04 0.00 -1.45 0.00 0.00 42.92 38.75 1k2w s ASP 186 CO 0.04 -1.00 0.83 -0.83 0.13 0.00 0.00 175.17 174.34 1k2w s GLY 187 N -0.88 -0.12 0.06 2.66 0.00 -1.26 -4.94 107.32 102.84 1k2w s GLY 187 Ca 0.61 -0.15 -0.16 0.00 0.00 0.00 0.00 44.72 45.02 1k2w s GLY 187 CO 0.46 0.00 1.25 1.05 0.00 0.00 0.00 173.10 175.86 1k2w h GLU 188 N 2.00 0.63 -0.09 2.90 4.11 -2.04 -2.83 114.58 119.26 1k2w h GLU 188 Ca -0.22 -0.53 0.03 0.00 0.07 0.00 0.00 59.36 58.70 1k2w h GLU 188 Cb 1.24 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 1k2w h GLU 188 CO 0.25 1.15 0.78 1.12 0.07 0.00 0.00 179.01 182.38 1k2w h HIS 189 N 0.28 0.00 0.00 2.06 2.07 -1.99 1.34 115.15 118.91 1k2w h HIS 189 Ca -0.05 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.47 1k2w h HIS 189 Cb 1.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.27 1k2w h HIS 189 CO 0.11 0.00 0.00 -1.49 -3.07 0.00 0.00 177.93 173.48 1k2w h TRP 190 N 0.00 0.00 -0.02 6.12 4.06 -1.89 -2.32 115.95 121.90 1k2w h TRP 190 Ca 0.04 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.99 1k2w h TRP 190 Cb 1.60 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.76 1k2w h TRP 190 CO 0.00 0.00 0.01 -0.44 -3.56 0.00 0.00 178.44 174.45 1k2w h ASP 191 N 0.00 0.03 -0.02 -3.49 5.19 0.16 -0.56 116.42 117.73 1k2w h ASP 191 Ca 0.00 -0.14 -0.19 0.00 -0.62 0.00 0.00 57.03 56.08 1k2w h ASP 191 Cb 0.30 -0.01 0.01 0.00 0.18 0.00 0.00 39.33 39.82 1k2w h ASP 191 CO 0.00 0.16 -0.74 1.23 -3.12 0.00 0.00 179.24 176.78 1k2w h GLY 192 N -0.10 0.59 0.57 2.75 0.00 -1.69 -2.97 103.07 102.22 1k2w h GLY 192 Ca 0.01 -1.00 0.09 0.00 0.00 0.00 0.00 47.33 46.43 1k2w h GLY 192 CO -0.00 0.88 0.46 -2.08 0.00 0.00 0.00 176.54 175.81 1k2w h VAL 193 N 0.10 0.93 -0.71 4.60 2.07 -1.42 0.37 116.25 122.18 1k2w h VAL 193 Ca -0.09 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 1k2w h VAL 193 Cb 1.42 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1k2w h VAL 193 CO 0.15 0.15 0.24 -0.78 0.02 0.00 0.00 177.57 177.34 1k2w h ASP 194 N 0.80 1.02 -0.61 0.57 3.58 -1.15 -2.13 116.42 118.50 1k2w h ASP 194 Ca 0.38 -0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.64 1k2w h ASP 194 Cb 0.32 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 1k2w h ASP 194 CO -0.23 0.95 0.39 0.00 -2.88 0.00 0.00 179.24 177.46 1k2w h ALA 195 N 1.11 0.77 0.35 -0.78 0.00 -1.01 0.10 119.26 119.81 1k2w h ALA 195 Ca 0.23 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1k2w h ALA 195 Cb 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1k2w h ALA 195 CO -0.01 0.22 -0.37 0.87 0.00 0.00 0.00 179.25 179.96 1k2w h LYS 196 N 0.82 -0.72 -0.75 0.00 1.79 -0.57 -0.21 116.57 116.92 1k2w h LYS 196 Ca 0.22 0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.74 1k2w h LYS 196 Cb -0.06 0.16 -0.04 0.00 -1.58 0.00 0.00 32.23 30.71 1k2w h LYS 196 CO -0.05 -0.48 0.45 0.74 -1.08 0.00 0.00 179.45 179.04 1k2w h PHE 197 N -0.75 0.99 -0.99 -1.35 -1.00 -1.25 0.11 116.94 112.69 1k2w h PHE 197 Ca -0.02 -0.00 0.09 0.00 2.81 0.00 0.00 57.97 60.85 1k2w h PHE 197 Cb 0.68 -0.32 -0.07 0.00 3.61 0.00 0.00 35.95 39.84 1k2w h PHE 197 CO -0.22 0.66 0.63 0.00 -1.61 0.00 0.00 178.31 177.77 1k2w h ALA 198 N 1.24 1.42 0.07 2.45 0.00 -0.47 0.12 119.26 124.09 1k2w h ALA 198 Ca 0.27 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.90 1k2w h ALA 198 Cb -0.04 -0.26 0.02 0.00 0.00 0.00 0.00 17.79 17.52 1k2w h ALA 198 CO -0.05 0.33 -1.14 0.22 0.00 0.00 0.00 179.25 178.61 1k2w h ASP 199 N 1.08 0.78 1.01 0.00 3.58 -0.44 -0.37 116.42 122.05 1k2w h ASP 199 Ca 0.46 -0.69 -0.08 0.00 0.42 0.00 0.00 57.03 57.14 1k2w h ASP 199 Cb 0.31 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.10 1k2w h ASP 199 CO -0.21 1.50 -0.38 1.88 -2.88 0.00 0.00 179.24 179.14 1k2w h TYR 200 N 0.28 0.00 0.00 0.28 0.99 -0.23 -3.33 116.97 114.96 1k2w h TYR 200 Ca -0.15 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.58 1k2w h TYR 200 Cb 1.80 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.53 1k2w h TYR 200 CO 0.10 0.38 -0.02 0.39 -0.00 0.00 0.00 178.16 179.01 1k2w n GLU 201 N -3.43 1.97 -3.35 4.88 1.02 0.35 -5.02 120.64 117.06 1k2w n GLU 201 Ca 0.00 -1.89 -0.18 0.00 -0.02 0.00 0.00 57.16 55.07 1k2w n GLU 201 Cb 0.55 -1.17 0.05 0.00 -0.02 0.00 0.00 31.44 30.85 1k2w n GLU 201 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1k2w n ASN 202 N -0.86 -6.43 -4.21 1.62 5.15 -0.96 -5.02 115.26 104.54 1k2w n ASN 202 Ca 0.07 -0.71 -0.23 0.00 -0.60 0.00 0.00 54.58 53.11 1k2w n ASN 202 Cb 0.45 -4.66 -0.13 0.00 -0.53 0.00 0.00 39.78 34.90 1k2w n ASN 202 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1k2w s LEU 203 N -5.47 2.20 0.41 1.20 1.43 -0.19 -5.05 118.68 113.21 1k2w s LEU 203 Ca 0.39 -0.54 -0.27 0.00 -1.03 0.00 0.00 54.13 52.69 1k2w s LEU 203 Cb -0.08 -0.80 -0.10 0.00 0.03 0.00 0.00 46.19 45.24 1k2w s LEU 203 CO 0.78 0.08 1.40 -2.65 0.23 0.00 0.00 176.35 176.19 1k2w n PRO 204 N 1.68 2.32 -1.64 1.29 -0.02 -1.26 -4.61 135.00 132.77 1k2w n PRO 204 Ca -0.18 0.82 -0.48 0.00 -2.02 0.00 0.00 63.50 61.64 1k2w n PRO 204 Cb 0.54 -2.56 -0.05 0.00 -0.02 0.00 0.00 33.50 31.41 1k2w n PRO 204 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1k2w n ARG 205 N 0.17 2.04 0.00 -0.52 1.74 -1.26 -1.11 116.66 117.72 1k2w n ARG 205 Ca 0.04 0.71 0.00 0.00 -0.77 0.00 0.00 57.85 57.83 1k2w n ARG 205 Cb 0.39 -2.72 0.00 0.00 -1.02 0.00 0.00 32.46 29.11 1k2w n ARG 205 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k2w n GLY 206 N 4.91 0.17 0.22 -0.13 0.00 -1.26 -4.95 105.19 104.15 1k2w n GLY 206 Ca 0.26 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.13 1k2w n GLY 206 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1k2w h GLU 207 N 3.92 0.74 0.04 1.61 4.57 -1.46 -3.06 114.58 120.93 1k2w h GLU 207 Ca 0.00 -0.55 0.00 0.00 -1.18 0.00 0.00 59.36 57.63 1k2w h GLU 207 Cb 0.00 0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.69 1k2w h GLU 207 CO 0.00 1.17 -0.03 -0.22 -1.18 0.00 0.00 179.01 178.75 1k2w h LYS 208 N 0.53 -0.07 -0.09 1.92 1.63 -1.88 0.13 116.57 118.74 1k2w h LYS 208 Ca -0.03 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1k2w h LYS 208 Cb 1.29 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.93 1k2w h LYS 208 CO 0.14 -0.05 -0.01 -0.22 -3.45 0.00 0.00 179.45 175.87 1k2w h LYS 209 N -0.07 0.12 0.07 1.90 3.64 -1.91 -1.52 116.57 118.81 1k2w h LYS 209 Ca -0.00 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1k2w h LYS 209 Cb 0.07 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1k2w h LYS 209 CO -0.00 0.15 -0.04 -0.09 -2.27 0.00 0.00 179.45 177.20 1k2w h ARG 210 N 0.13 -0.10 -0.20 1.90 2.43 -1.29 -2.75 114.38 114.50 1k2w h ARG 210 Ca 0.03 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1k2w h ARG 210 Cb 0.10 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.62 1k2w h ARG 210 CO 0.00 0.42 -0.12 1.96 -1.51 0.00 0.00 179.97 180.72 1k2w h GLN 211 N -0.68 -0.10 -0.54 0.20 4.20 -0.43 -1.22 115.11 116.55 1k2w h GLN 211 Ca -0.01 0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.76 1k2w h GLN 211 Cb 0.56 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.31 1k2w h GLN 211 CO 0.02 -0.07 0.25 0.28 -0.67 0.00 0.00 178.83 178.64 1k2w h VAL 212 N -0.11 0.91 -0.66 -0.54 2.07 -1.38 -1.22 116.25 115.33 1k2w h VAL 212 Ca 0.11 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 1k2w h VAL 212 Cb 0.28 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 1k2w h VAL 212 CO -0.27 0.09 0.29 1.23 0.02 0.00 0.00 177.57 178.92 1k2w h GLY 213 N 0.48 1.03 2.00 2.17 0.00 -1.13 -2.77 103.07 104.85 1k2w h GLY 213 Ca 0.25 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1k2w h GLY 213 CO -0.20 0.51 -0.07 0.00 0.00 0.00 0.00 176.54 176.79 1k2w h ALA 214 N 1.12 1.01 0.00 3.60 0.00 -0.74 -3.04 119.26 121.22 1k2w h ALA 214 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1k2w h ALA 214 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1k2w h ALA 214 CO -0.02 0.08 -0.01 0.00 0.00 0.00 0.00 179.25 179.30 1k2w h ALA 215 N 1.93 0.99 -2.39 0.00 0.00 -0.94 -3.45 119.26 115.41 1k2w h ALA 215 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 1k2w h ALA 215 Cb 0.59 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1k2w h ALA 215 CO 0.01 0.00 0.97 0.08 0.00 0.00 0.00 179.25 180.31 1k2w s VAL 216 N -3.18 3.35 0.20 0.00 1.01 -1.15 -4.90 120.40 115.73 1k2w s VAL 216 Ca 0.08 0.71 -0.17 0.00 0.00 0.00 0.00 61.98 62.60 1k2w s VAL 216 Cb 0.07 -3.46 0.19 0.00 0.00 0.00 0.00 36.38 33.19 1k2w s VAL 216 CO 0.65 -0.02 1.60 -0.65 0.00 0.00 0.00 175.10 176.69 1k2w h PRO 217 N 8.44 -0.08 -1.11 2.72 0.11 -1.83 0.62 132.00 140.86 1k2w h PRO 217 Ca -0.40 0.01 0.31 0.00 0.11 0.00 0.00 66.00 66.02 1k2w h PRO 217 Cb 1.19 0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 1k2w h PRO 217 CO 0.93 -0.06 0.77 0.35 -0.21 0.00 0.00 178.00 179.78 1k2w h PHE 218 N -0.09 0.23 0.00 0.65 3.57 -1.69 -3.45 116.94 116.16 1k2w h PHE 218 Ca 0.28 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1k2w h PHE 218 Cb 0.53 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.21 1k2w h PHE 218 CO -0.60 0.02 0.00 0.41 -2.23 0.00 0.00 178.31 175.90 1k2w n GLY 219 N -1.66 1.04 3.65 2.40 0.00 0.21 -5.10 105.19 105.73 1k2w n GLY 219 Ca 0.25 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.21 1k2w n GLY 219 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1k2w s ARG 220 N -0.52 1.14 0.54 1.61 1.70 -1.25 -4.87 118.95 117.30 1k2w s ARG 220 Ca 0.00 -0.56 -0.18 0.00 -0.47 0.00 0.00 55.73 54.52 1k2w s ARG 220 Cb 0.00 0.44 -0.06 0.00 -0.57 0.00 0.00 34.95 34.75 1k2w s ARG 220 CO 0.00 -0.51 1.05 1.41 -1.08 0.00 0.00 175.30 176.16 1k2w s MET 221 N -3.34 3.58 0.88 3.89 -2.45 -1.26 -4.82 119.30 115.77 1k2w s MET 221 Ca 0.09 1.28 -0.10 0.00 -1.25 0.00 0.00 55.69 55.71 1k2w s MET 221 Cb -0.02 -2.07 0.12 0.00 1.25 0.00 0.00 34.83 34.12 1k2w s MET 221 CO -0.02 -0.61 1.13 0.20 1.05 0.00 0.00 175.02 176.77 1k2w s GLY 222 N -2.37 1.68 0.03 2.11 0.00 0.22 -4.76 107.32 104.24 1k2w s GLY 222 Ca 0.65 0.49 0.01 0.00 0.00 0.00 0.00 44.72 45.88 1k2w s GLY 222 CO 0.28 0.89 -0.05 -1.60 0.00 0.00 0.00 173.10 172.62 1k2w s ARG 223 N -4.72 0.39 0.47 2.90 3.52 -1.26 -1.51 118.95 118.74 1k2w s ARG 223 Ca 0.65 -0.63 0.17 0.00 -0.13 0.00 0.00 55.73 55.79 1k2w s ARG 223 Cb -0.21 -0.09 1.15 0.00 -1.56 0.00 0.00 34.95 34.24 1k2w s ARG 223 CO 0.57 0.00 2.01 0.00 -0.81 0.00 0.00 175.30 177.08 1k2w h ALA 224 N 4.70 2.13 0.00 6.12 0.00 -1.98 -0.32 119.26 129.91 1k2w h ALA 224 Ca -0.33 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1k2w h ALA 224 Cb 1.21 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1k2w h ALA 224 CO 0.42 -0.24 -0.08 0.93 0.00 0.00 0.00 179.25 180.27 1k2w h GLU 225 N 0.25 0.00 0.00 0.00 3.07 -1.98 -2.24 114.58 113.68 1k2w h GLU 225 Ca 0.23 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.00 1k2w h GLU 225 Cb 0.57 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 1k2w h GLU 225 CO -0.05 0.08 -0.40 -0.44 -1.40 0.00 0.00 179.01 176.81 1k2w h ASP 226 N 0.00 0.00 0.65 1.42 3.32 -1.47 -3.29 116.42 117.05 1k2w h ASP 226 Ca -0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 1k2w h ASP 226 Cb 0.34 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 1k2w h ASP 226 CO 0.01 0.40 -1.45 0.18 -1.72 0.00 0.00 179.24 176.66 1k2w n LEU 227 N -3.77 0.71 -0.19 1.55 4.32 -0.85 -4.46 117.00 114.32 1k2w n LEU 227 Ca -0.01 0.30 0.05 0.00 -0.02 0.00 0.00 56.01 56.33 1k2w n LEU 227 Cb 0.47 0.06 0.33 0.00 -1.62 0.00 0.00 43.42 42.67 1k2w n LEU 227 CO 0.38 0.07 1.22 0.71 -1.22 0.00 0.00 177.39 178.55 1k2w h THR 228 N 0.00 1.05 -0.36 -5.08 1.35 -1.60 -2.14 112.91 106.13 1k2w h THR 228 Ca -0.13 -0.28 0.02 0.00 -0.55 0.00 0.00 66.41 65.47 1k2w h THR 228 Cb 1.43 0.18 -0.02 0.00 -1.73 0.00 0.00 68.15 68.01 1k2w h THR 228 CO 0.03 0.15 0.20 1.23 -0.25 0.00 0.00 175.52 176.88 1k2w h GLY 229 N 0.80 0.49 1.18 5.82 0.00 -1.78 -1.11 103.07 108.48 1k2w h GLY 229 Ca 0.30 -0.15 -0.13 0.00 0.00 0.00 0.00 47.33 47.35 1k2w h GLY 229 CO -0.10 0.13 -0.24 1.98 0.00 0.00 0.00 176.54 178.31 1k2w h MET 230 N 0.42 0.93 -0.75 4.80 -1.53 -1.75 -2.01 114.93 115.04 1k2w h MET 230 Ca 0.14 -0.41 0.06 0.00 -3.44 0.00 0.00 59.70 56.05 1k2w h MET 230 Cb 0.01 -0.03 -0.06 0.00 -0.55 0.00 0.00 31.60 30.98 1k2w h MET 230 CO -0.07 1.07 0.44 0.00 0.14 0.00 0.00 176.91 178.49 1k2w h ALA 231 N 0.91 1.02 0.39 0.39 0.00 -0.93 -1.64 119.26 119.41 1k2w h ALA 231 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1k2w h ALA 231 Cb 0.81 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1k2w h ALA 231 CO 0.07 0.16 -0.19 0.82 0.00 0.00 0.00 179.25 180.11 1k2w h ILE 232 N 0.82 0.50 -0.66 0.00 2.04 -1.13 -3.31 117.51 115.77 1k2w h ILE 232 Ca 0.33 -0.58 0.12 0.00 1.00 0.00 0.00 64.86 65.73 1k2w h ILE 232 Cb 0.17 0.73 -0.13 0.00 -0.74 0.00 0.00 36.82 36.85 1k2w h ILE 232 CO -0.17 0.09 -0.26 0.15 0.00 0.00 0.00 178.15 177.95 1k2w h PHE 233 N -0.91 -0.68 0.00 1.37 3.57 -1.17 0.71 116.94 119.83 1k2w h PHE 233 Ca -0.05 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1k2w h PHE 233 Cb 0.55 0.40 0.00 0.00 2.79 0.00 0.00 35.95 39.68 1k2w h PHE 233 CO 0.02 -0.35 0.00 1.28 -2.23 0.00 0.00 178.31 177.03 1k2w n LEU 234 N -5.45 0.05 -0.64 0.59 4.77 -0.63 -1.54 117.00 114.15 1k2w n LEU 234 Ca 0.07 0.52 0.09 0.00 -0.03 0.00 0.00 56.01 56.66 1k2w n LEU 234 Cb 0.36 -0.52 0.05 0.00 -2.33 0.00 0.00 43.42 40.98 1k2w n LEU 234 CO 0.00 -0.50 0.47 0.00 -1.33 0.00 0.00 177.39 176.03 1k2w n ALA 235 N -1.52 2.67 -2.18 -1.18 0.00 0.23 -4.89 120.51 113.64 1k2w n ALA 235 Ca 0.00 -0.62 -0.21 0.00 0.00 0.00 0.00 53.44 52.62 1k2w n ALA 235 Cb 0.03 -0.61 0.02 0.00 0.00 0.00 0.00 19.45 18.89 1k2w n ALA 235 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1k2w s THR 236 N -1.64 3.40 -0.93 0.00 -4.23 -0.59 -4.98 115.64 106.67 1k2w s THR 236 Ca 0.19 -0.70 0.18 0.00 -1.18 0.00 0.00 61.69 60.19 1k2w s THR 236 Cb 0.15 -3.23 0.16 0.00 1.34 0.00 0.00 72.50 70.91 1k2w s THR 236 CO 0.28 -0.14 1.58 -0.81 -0.54 0.00 0.00 174.62 174.98 1k2w n PRO 237 N -2.08 0.03 0.00 3.99 -0.04 -1.26 -2.34 135.00 133.30 1k2w n PRO 237 Ca 0.04 0.23 0.11 0.00 -0.04 0.00 0.00 63.50 63.84 1k2w n PRO 237 Cb 0.59 -1.56 0.60 0.00 -0.04 0.00 0.00 33.50 33.09 1k2w n PRO 237 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1k2w n GLU 238 N -1.61 0.52 -0.06 0.54 1.02 -1.26 -2.27 120.64 117.52 1k2w n GLU 238 Ca 0.04 0.04 0.08 0.00 -0.02 0.00 0.00 57.16 57.29 1k2w n GLU 238 Cb 0.21 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.24 1k2w n GLU 238 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1k2w n ALA 239 N -1.12 2.21 0.30 0.62 0.00 -0.99 -4.74 120.51 116.79 1k2w n ALA 239 Ca 0.14 -2.22 0.16 0.00 0.00 0.00 0.00 53.44 51.52 1k2w n ALA 239 Cb 0.11 -0.29 0.93 0.00 0.00 0.00 0.00 19.45 20.19 1k2w n ALA 239 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1k2w h ASP 240 N 0.05 0.00 -0.07 0.00 3.32 -1.60 -1.93 116.42 116.20 1k2w h ASP 240 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1k2w h ASP 240 Cb 0.89 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1k2w h ASP 240 CO 0.00 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.56 1k2w n TYR 241 N -3.60 0.06 -3.10 4.55 9.36 -1.26 -4.82 117.16 118.34 1k2w n TYR 241 Ca -0.03 -0.03 -0.42 0.00 3.32 0.00 0.00 57.90 60.74 1k2w n TYR 241 Cb 0.13 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 38.77 1k2w n TYR 241 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1k2w s ILE 242 N -1.94 4.84 -0.04 2.97 1.01 -0.73 -5.04 121.20 122.27 1k2w s ILE 242 Ca 0.33 0.32 0.03 0.00 0.00 0.00 0.00 60.65 61.33 1k2w s ILE 242 Cb 0.20 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.51 1k2w s ILE 242 CO 0.31 -0.49 -0.13 -0.69 0.00 0.00 0.00 174.94 173.94 1k2w s VAL 243 N 2.81 1.13 -1.49 2.92 1.01 -1.26 -4.71 120.40 120.81 1k2w s VAL 243 Ca 0.24 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 1k2w s VAL 243 Cb -0.14 -0.99 0.01 0.00 0.00 0.00 0.00 36.38 35.25 1k2w s VAL 243 CO 0.18 0.34 0.18 0.00 0.00 0.00 0.00 175.10 175.80 1k2w n ALA 244 N 3.34 -0.79 -2.89 5.51 0.00 -0.58 -4.99 120.51 120.12 1k2w n ALA 244 Ca -0.19 0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.18 1k2w n ALA 244 Cb 0.53 -2.44 -0.04 0.00 0.00 0.00 0.00 19.45 17.50 1k2w n ALA 244 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1k2w s GLN 245 N -5.28 3.21 -0.23 0.00 -1.52 -1.26 -4.59 119.66 109.99 1k2w s GLN 245 Ca 0.11 -0.80 0.01 0.00 -1.95 0.00 0.00 55.36 52.72 1k2w s GLN 245 Cb -0.05 -2.79 0.06 0.00 -0.22 0.00 0.00 33.01 30.01 1k2w s GLN 245 CO 0.13 0.46 -0.06 0.99 -0.25 0.00 0.00 175.29 176.56 1k2w s THR 246 N -1.89 1.55 -0.24 -0.19 2.01 -1.26 -0.31 115.64 115.31 1k2w s THR 246 Ca 0.33 -1.17 -0.12 0.00 0.31 0.00 0.00 61.69 61.04 1k2w s THR 246 Cb -0.10 -1.77 -0.05 0.00 0.01 0.00 0.00 72.50 70.59 1k2w s THR 246 CO 0.27 -0.04 0.25 -0.31 -0.69 0.00 0.00 174.62 174.09 1k2w s TYR 247 N 1.40 3.31 -0.08 4.92 4.12 -0.13 -4.90 117.35 125.98 1k2w s TYR 247 Ca -0.05 0.33 -0.26 0.00 0.02 0.00 0.00 57.07 57.10 1k2w s TYR 247 Cb -0.18 -2.39 -0.03 0.00 -1.52 0.00 0.00 41.96 37.85 1k2w s TYR 247 CO -0.07 -0.03 0.85 -0.80 0.02 0.00 0.00 175.55 175.53 1k2w s ASN 248 N 1.24 7.11 -0.59 2.29 0.01 -1.26 -0.80 114.94 122.94 1k2w s ASN 248 Ca 0.11 1.35 0.05 0.00 -0.71 0.00 0.00 52.86 53.66 1k2w s ASN 248 Cb -0.14 -2.48 0.18 0.00 0.41 0.00 0.00 41.25 39.21 1k2w s ASN 248 CO 0.07 -0.27 0.46 0.52 -1.51 0.00 0.00 177.10 176.37 1k2w n VAL 249 N 4.17 0.61 -1.29 1.60 0.31 -0.81 -4.91 118.33 118.02 1k2w n VAL 249 Ca 0.04 -4.36 0.03 0.00 -0.01 0.00 0.00 64.34 60.03 1k2w n VAL 249 Cb 0.50 -1.99 0.04 0.00 -0.91 0.00 0.00 33.84 31.49 1k2w n VAL 249 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1k2w n ASP 250 N 2.15 1.01 -1.37 4.52 3.85 -1.26 -3.70 116.55 121.75 1k2w n ASP 250 Ca 0.24 -2.19 -0.17 0.00 -0.71 0.00 0.00 54.79 51.96 1k2w n ASP 250 Cb 0.41 -0.22 -0.06 0.00 -1.35 0.00 0.00 41.12 39.90 1k2w n ASP 250 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1k2w n GLY 251 N -0.52 1.42 0.83 6.12 0.00 -1.26 -2.46 105.19 109.31 1k2w n GLY 251 Ca 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1k2w n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k2w n GLY 252 N -0.93 0.64 0.38 -0.02 0.00 -1.26 -1.75 105.19 102.26 1k2w n GLY 252 Ca -0.17 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.01 1k2w n GLY 252 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1k2w h ASN 253 N 0.00 0.38 -4.27 1.61 -1.24 -1.85 -3.42 115.58 106.79 1k2w h ASN 253 Ca 0.00 0.02 -0.18 0.00 0.71 0.00 0.00 56.30 56.86 1k2w h ASN 253 Cb 0.00 -0.05 -0.24 0.00 0.73 0.00 0.00 38.32 38.76 1k2w h ASN 253 CO 0.00 0.19 -0.55 0.86 -1.29 0.00 0.00 177.43 176.64 1k2w s TRP 254 N -5.39 -0.05 -0.16 0.67 -0.11 -1.26 -5.04 118.94 107.60 1k2w s TRP 254 Ca -0.08 0.12 -0.01 0.00 1.22 0.00 0.00 56.10 57.36 1k2w s TRP 254 Cb 0.21 -0.00 -0.01 0.00 -1.50 0.00 0.00 33.47 32.17 1k2w s TRP 254 CO 0.77 -0.15 -0.12 -1.64 -4.62 0.00 0.00 176.95 171.19 1k2w s MET 255 N -0.53 3.35 0.00 5.86 -1.94 -1.26 -4.92 119.30 119.86 1k2w s MET 255 Ca -0.06 -0.68 0.00 0.00 -1.71 0.00 0.00 55.69 53.24 1k2w s MET 255 Cb -0.04 -2.72 0.00 0.00 2.01 0.00 0.00 34.83 34.08 1k2w s MET 255 CO 0.01 0.08 0.04 0.43 -0.01 0.00 0.00 175.02 175.56