#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o1w n ASN 2 N 0.00 -1.66 0.05 3.17 5.15 -1.25 -1.27 115.26 119.45 1o1w n ASN 2 Ca 0.00 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 53.93 1o1w n ASN 2 Cb 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.22 1o1w n ASN 2 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1o1w h GLU 3 N 0.00 -0.26 0.00 1.20 3.07 -2.01 -3.39 114.58 113.19 1o1w h GLU 3 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1o1w h GLU 3 Cb 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1o1w h GLU 3 CO 0.00 -0.17 -0.14 1.28 -1.40 0.00 0.00 179.01 178.58 1o1w n LEU 4 N -3.39 0.11 0.00 1.33 7.99 -1.25 -5.12 117.00 116.67 1o1w n LEU 4 Ca -0.03 -0.40 0.00 0.00 -0.01 0.00 0.00 56.01 55.57 1o1w n LEU 4 Cb 0.14 -0.01 0.00 0.00 -0.11 0.00 0.00 43.42 43.44 1o1w n LEU 4 CO 0.06 0.10 0.00 0.00 -1.51 0.00 0.00 177.39 176.04 1o1w n TYR 5 N -0.04 0.00 -2.72 -1.77 0.18 -0.40 -3.89 117.16 108.52 1o1w n TYR 5 Ca 0.00 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.35 1o1w n TYR 5 Cb 0.55 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.48 1o1w n TYR 5 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1o1w s GLN 6 N -1.93 3.53 -0.51 -3.48 1.11 -0.87 -3.83 119.66 113.68 1o1w s GLN 6 Ca 0.00 0.19 -0.26 0.00 0.01 0.00 0.00 55.36 55.30 1o1w s GLN 6 Cb 0.00 -3.97 -0.06 0.00 -1.01 0.00 0.00 33.01 27.97 1o1w s GLN 6 CO 0.00 -1.42 2.29 -1.17 0.01 0.00 0.00 175.29 175.00 1o1w s LEU 7 N 4.24 3.38 0.00 2.90 0.20 -1.26 -4.56 118.68 123.59 1o1w s LEU 7 Ca 0.40 0.93 0.00 0.00 0.69 0.00 0.00 54.13 56.14 1o1w s LEU 7 Cb -0.09 -2.52 0.00 0.00 -0.43 0.00 0.00 46.19 43.15 1o1w s LEU 7 CO 0.26 -2.78 0.00 1.21 -0.29 0.00 0.00 176.35 174.75 1o1w n GLU 8 N 9.05 0.00 -0.50 1.98 4.07 -1.26 -4.93 120.64 129.05 1o1w n GLU 8 Ca 0.33 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.43 1o1w n GLU 8 Cb 0.54 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.92 1o1w n GLU 8 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1o1w n LYS 9 N -0.04 -0.10 -4.26 5.31 4.01 -1.13 -4.86 118.16 117.09 1o1w n LYS 9 Ca 0.00 0.02 -0.16 0.00 -0.51 0.00 0.00 58.31 57.66 1o1w n LYS 9 Cb 0.00 -4.39 -0.09 0.00 -0.51 0.00 0.00 35.03 30.04 1o1w n LYS 9 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 1o1w s GLU 10 N -1.01 1.51 -0.39 1.97 -1.05 -1.26 -3.86 118.70 114.61 1o1w s GLU 10 Ca 0.00 -1.84 -0.45 0.00 -0.15 0.00 0.00 54.97 52.53 1o1w s GLU 10 Cb 0.00 0.22 -0.20 0.00 -0.44 0.00 0.00 34.13 33.71 1o1w s GLU 10 CO 0.00 -0.51 1.47 -0.35 0.95 0.00 0.00 175.26 176.82 1o1w n PRO 11 N -0.48 0.00 -3.49 -4.83 -0.04 -1.26 -4.71 135.00 120.20 1o1w n PRO 11 Ca 0.04 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.15 1o1w n PRO 11 Cb 0.64 -1.48 -0.06 0.00 -0.04 0.00 0.00 33.50 32.57 1o1w n PRO 11 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1o1w s ILE 12 N 2.32 5.00 0.49 0.52 1.01 -1.26 -4.97 121.20 124.31 1o1w s ILE 12 Ca 1.01 0.59 0.26 0.00 0.00 0.00 0.00 60.65 62.50 1o1w s ILE 12 Cb -1.43 -3.68 0.44 0.00 0.01 0.00 0.00 42.46 37.80 1o1w s ILE 12 CO 0.76 0.25 1.88 1.62 0.00 0.00 0.00 174.94 179.45 1o1w h VAL 13 N 2.79 0.60 0.00 2.92 3.04 -2.03 -3.39 116.25 120.18 1o1w h VAL 13 Ca -0.49 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 1o1w h VAL 13 Cb 1.19 0.44 0.00 0.00 -2.01 0.00 0.00 31.29 30.91 1o1w h VAL 13 CO 0.66 0.03 0.00 0.61 -1.01 0.00 0.00 177.57 177.86 1o1w n GLY 14 N -1.63 -1.92 3.43 3.17 0.00 -1.26 -5.18 105.19 101.79 1o1w n GLY 14 Ca 0.18 0.90 -0.22 0.00 0.00 0.00 0.00 46.02 46.89 1o1w n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o1w s ALA 15 N 0.00 2.45 0.64 4.61 0.00 -1.26 -5.03 121.76 123.16 1o1w s ALA 15 Ca 0.00 -1.83 -0.18 0.00 0.00 0.00 0.00 51.96 49.96 1o1w s ALA 15 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 1o1w s ALA 15 CO 0.00 0.13 1.09 -1.91 0.00 0.00 0.00 175.76 175.07 1o1w n GLU 16 N -0.55 0.91 -3.87 0.00 4.07 0.25 -4.63 120.64 116.82 1o1w n GLU 16 Ca -0.06 0.36 -0.35 0.00 -0.06 0.00 0.00 57.16 57.05 1o1w n GLU 16 Cb 0.61 -2.32 -0.09 0.00 -0.06 0.00 0.00 31.44 29.58 1o1w n GLU 16 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 1o1w s THR 17 N -1.51 5.01 0.10 6.31 -4.23 -1.26 0.23 115.64 120.30 1o1w s THR 17 Ca 0.79 0.05 0.04 0.00 -1.18 0.00 0.00 61.69 61.38 1o1w s THR 17 Cb -0.39 -3.28 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 1o1w s THR 17 CO 0.44 0.44 -0.10 -0.36 -0.54 0.00 0.00 174.62 174.50 1o1w s PHE 18 N 0.51 1.06 0.13 3.99 0.40 0.57 -2.56 117.98 122.08 1o1w s PHE 18 Ca 0.05 -0.69 0.10 0.00 -0.60 0.00 0.00 56.93 55.79 1o1w s PHE 18 Cb -0.12 -0.58 -0.04 0.00 0.51 0.00 0.00 43.02 42.79 1o1w s PHE 18 CO 0.00 -0.01 -0.21 -0.47 0.70 0.00 0.00 175.22 175.23 1o1w s TYR 19 N -2.66 2.44 -0.23 0.36 6.14 -0.49 -2.87 117.35 120.04 1o1w s TYR 19 Ca 0.07 -0.31 -0.09 0.00 0.64 0.00 0.00 57.07 57.39 1o1w s TYR 19 Cb -0.01 -1.29 0.10 0.00 0.42 0.00 0.00 41.96 41.18 1o1w s TYR 19 CO -0.00 0.39 0.50 0.08 0.64 0.00 0.00 175.55 177.16 1o1w s VAL 20 N -1.22 -0.60 -0.29 3.14 1.01 0.48 -2.80 120.40 120.13 1o1w s VAL 20 Ca 0.17 0.10 -0.17 0.00 0.00 0.00 0.00 61.98 62.09 1o1w s VAL 20 Cb -0.10 -0.77 0.13 0.00 0.00 0.00 0.00 36.38 35.64 1o1w s VAL 20 CO 0.09 0.04 0.92 -0.62 0.00 0.00 0.00 175.10 175.54 1o1w s ASP 21 N 2.43 -0.59 0.03 3.32 2.15 -0.99 -3.69 116.67 119.34 1o1w s ASP 21 Ca -0.05 0.95 0.01 0.00 0.43 0.00 0.00 52.55 53.90 1o1w s ASP 21 Cb -0.11 1.22 -0.02 0.00 -0.30 0.00 0.00 42.92 43.71 1o1w s ASP 21 CO -0.15 -0.15 -0.05 -0.83 -0.17 0.00 0.00 175.17 173.82 1o1w s GLY 22 N 1.30 0.35 -0.25 2.66 0.00 -1.26 -2.83 107.32 107.28 1o1w s GLY 22 Ca -0.08 -0.59 -0.01 0.00 0.00 0.00 0.00 44.72 44.04 1o1w s GLY 22 CO -0.15 -0.64 -0.08 0.00 0.00 0.00 0.00 173.10 172.24 1o1w s ALA 23 N -1.17 2.65 -0.05 3.20 0.00 0.42 -4.50 121.76 122.31 1o1w s ALA 23 Ca -0.10 -1.53 -0.02 0.00 0.00 0.00 0.00 51.96 50.30 1o1w s ALA 23 Cb -0.08 -1.65 0.04 0.00 0.00 0.00 0.00 23.12 21.42 1o1w s ALA 23 CO -0.00 -0.90 0.10 0.00 0.00 0.00 0.00 175.76 174.96 1o1w s ALA 24 N 1.27 -0.02 -0.32 0.00 0.00 -1.09 -0.13 121.76 121.47 1o1w s ALA 24 Ca -0.02 0.43 -0.36 0.00 0.00 0.00 0.00 51.96 52.01 1o1w s ALA 24 Cb -0.17 -0.57 -0.12 0.00 0.00 0.00 0.00 23.12 22.26 1o1w s ALA 24 CO -0.05 -0.36 2.11 -1.71 0.00 0.00 0.00 175.76 175.75 1o1w n ASN 25 N 4.85 2.26 0.02 0.00 5.15 0.27 -4.46 115.26 123.34 1o1w n ASN 25 Ca -0.14 0.54 -0.12 0.00 -0.60 0.00 0.00 54.58 54.26 1o1w n ASN 25 Cb 0.50 -1.25 -0.08 0.00 -0.53 0.00 0.00 39.78 38.42 1o1w n ASN 25 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 1o1w h ARG 26 N 11.48 0.02 -0.35 1.20 1.12 -1.80 1.14 114.38 127.19 1o1w h ARG 26 Ca -0.31 -0.00 0.10 0.00 -1.11 0.00 0.00 59.98 58.66 1o1w h ARG 26 Cb 1.32 -0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 31.26 1o1w h ARG 26 CO 1.01 0.14 0.64 1.49 -3.11 0.00 0.00 179.97 180.13 1o1w h GLU 27 N -0.11 0.00 0.00 0.20 4.81 -1.88 0.30 114.58 117.90 1o1w h GLU 27 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1o1w h GLU 27 Cb 0.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1o1w h GLU 27 CO -0.00 0.00 0.00 2.41 -0.73 0.00 0.00 179.01 180.69 1o1w n THR 28 N -3.20 0.00 -3.42 0.32 -1.04 -1.01 -5.05 114.28 100.87 1o1w n THR 28 Ca 0.06 -0.45 -0.13 0.00 -2.04 0.00 0.00 64.05 61.49 1o1w n THR 28 Cb 0.77 1.03 0.00 0.00 -1.82 0.00 0.00 70.33 70.32 1o1w n THR 28 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1o1w n LYS 29 N -0.57 -1.46 -3.61 -2.82 4.01 0.39 -4.66 118.16 109.44 1o1w n LYS 29 Ca 0.00 1.15 -0.07 0.00 -0.51 0.00 0.00 58.31 58.88 1o1w n LYS 29 Cb 0.01 -4.00 -0.05 0.00 -0.51 0.00 0.00 35.03 30.49 1o1w n LYS 29 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 1o1w s LEU 30 N -4.42 -0.23 0.00 -0.35 0.20 -0.76 -2.29 118.68 110.83 1o1w s LEU 30 Ca 0.01 0.25 0.00 0.00 0.69 0.00 0.00 54.13 55.08 1o1w s LEU 30 Cb -0.00 1.53 0.00 0.00 -0.43 0.00 0.00 46.19 47.29 1o1w s LEU 30 CO 0.82 -0.21 0.00 0.61 -0.29 0.00 0.00 176.35 177.28 1o1w n GLY 31 N 0.64 -0.26 3.53 7.98 0.00 -1.25 0.94 105.19 116.77 1o1w n GLY 31 Ca -0.06 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 45.04 1o1w n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o1w s LYS 32 N -2.00 1.81 -0.30 1.61 3.01 0.82 -2.56 119.74 122.12 1o1w s LYS 32 Ca 0.00 -1.86 -0.12 0.00 -1.01 0.00 0.00 55.97 52.98 1o1w s LYS 32 Cb 0.00 -1.75 0.15 0.00 -1.01 0.00 0.00 37.83 35.22 1o1w s LYS 32 CO 0.00 0.20 0.82 0.00 0.51 0.00 0.00 175.35 176.88 1o1w s ALA 33 N -2.57 -2.45 0.00 5.17 0.00 0.55 -0.44 121.76 122.02 1o1w s ALA 33 Ca 0.32 2.12 0.00 0.00 0.00 0.00 0.00 51.96 54.40 1o1w s ALA 33 Cb -0.00 -1.98 0.00 0.00 0.00 0.00 0.00 23.12 21.14 1o1w s ALA 33 CO 0.16 -1.01 0.00 0.41 0.00 0.00 0.00 175.76 175.33 1o1w n GLY 34 N 5.23 4.56 3.59 0.00 0.00 -1.13 0.55 105.19 117.99 1o1w n GLY 34 Ca -0.09 -1.65 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 1o1w n GLY 34 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o1w s TYR 35 N -1.49 -0.30 -0.08 1.61 1.13 -1.11 -2.35 117.35 114.77 1o1w s TYR 35 Ca 0.00 0.08 -0.02 0.00 -1.41 0.00 0.00 57.07 55.72 1o1w s TYR 35 Cb 0.00 0.58 0.04 0.00 -1.10 0.00 0.00 41.96 41.48 1o1w s TYR 35 CO 0.00 -0.72 0.04 0.54 -2.51 0.00 0.00 175.55 172.89 1o1w s VAL 36 N -3.32 0.15 0.41 -3.49 0.11 -1.12 -2.63 120.40 110.51 1o1w s VAL 36 Ca 0.07 0.13 -0.01 0.00 -2.93 0.00 0.00 61.98 59.24 1o1w s VAL 36 Cb -0.01 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.36 1o1w s VAL 36 CO -0.05 0.12 0.64 0.28 -3.33 0.00 0.00 175.10 172.76 1o1w s THR 37 N 2.06 4.79 -1.24 5.04 -1.32 -1.11 -1.40 115.64 122.45 1o1w s THR 37 Ca 0.04 -0.29 0.00 0.00 -1.21 0.00 0.00 61.69 60.23 1o1w s THR 37 Cb -0.13 -3.77 0.00 0.00 -1.51 0.00 0.00 72.50 67.09 1o1w s THR 37 CO -0.05 -0.58 0.62 -0.46 -2.21 0.00 0.00 174.62 171.93 1o1w n ASN 38 N -1.99 0.00 -1.17 8.08 2.04 -1.06 0.31 115.26 121.48 1o1w n ASN 38 Ca -0.02 0.18 0.10 0.00 -0.44 0.00 0.00 54.58 54.39 1o1w n ASN 38 Cb 0.56 -0.18 0.28 0.00 -2.53 0.00 0.00 39.78 37.91 1o1w n ASN 38 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1o1w n ARG 39 N -1.12 2.50 -3.02 -3.83 1.74 -1.26 -4.93 116.66 106.74 1o1w n ARG 39 Ca 0.00 -2.25 -0.12 0.00 -0.77 0.00 0.00 57.85 54.70 1o1w n ARG 39 Cb 0.04 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.04 1o1w n ARG 39 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1o1w n GLY 40 N 1.46 -0.06 3.67 -0.13 0.00 0.15 -5.03 105.19 105.25 1o1w n GLY 40 Ca 0.21 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1o1w n GLY 40 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1o1w s ARG 41 N -5.19 2.61 -0.07 1.61 3.52 -1.20 -4.93 118.95 115.31 1o1w s ARG 41 Ca 0.12 -0.75 -0.03 0.00 -0.13 0.00 0.00 55.73 54.94 1o1w s ARG 41 Cb -0.05 -2.57 0.04 0.00 -1.56 0.00 0.00 34.95 30.81 1o1w s ARG 41 CO 0.47 0.58 0.13 -0.65 -0.81 0.00 0.00 175.30 175.02 1o1w s GLN 42 N -1.92 0.01 0.37 5.12 -1.52 -1.25 -2.74 119.66 117.73 1o1w s GLN 42 Ca 0.22 0.48 0.04 0.00 -1.95 0.00 0.00 55.36 54.15 1o1w s GLN 42 Cb -0.12 -0.31 -0.05 0.00 -0.22 0.00 0.00 33.01 32.32 1o1w s GLN 42 CO 0.14 -0.29 0.08 -1.59 -0.25 0.00 0.00 175.29 173.38 1o1w s LYS 43 N 2.06 1.79 -0.07 2.91 0.00 -1.08 -4.95 119.74 120.40 1o1w s LYS 43 Ca 0.01 -2.04 -0.26 0.00 0.00 0.00 0.00 55.97 53.69 1o1w s LYS 43 Cb -0.12 -0.85 0.06 0.00 0.00 0.00 0.00 37.83 36.92 1o1w s LYS 43 CO -0.05 -0.29 0.58 0.54 0.00 0.00 0.00 175.35 176.13 1o1w s VAL 44 N -3.23 0.01 0.08 1.79 0.11 -1.25 -2.74 120.40 115.17 1o1w s VAL 44 Ca 0.30 -0.11 -0.10 0.00 -2.93 0.00 0.00 61.98 59.14 1o1w s VAL 44 Cb 0.06 -0.89 0.00 0.00 -1.53 0.00 0.00 36.38 34.03 1o1w s VAL 44 CO 0.14 -0.06 0.22 0.68 -3.33 0.00 0.00 175.10 172.75 1o1w s VAL 45 N -1.00 0.13 -0.02 2.04 -7.23 0.19 -4.86 120.40 109.64 1o1w s VAL 45 Ca -0.10 -1.03 -0.13 0.00 -1.81 0.00 0.00 61.98 58.91 1o1w s VAL 45 Cb -0.02 -1.22 -0.05 0.00 0.56 0.00 0.00 36.38 35.65 1o1w s VAL 45 CO 0.07 -0.57 0.35 0.42 -0.31 0.00 0.00 175.10 175.06 1o1w s THR 46 N -3.53 5.13 0.08 5.32 -4.23 -1.25 -0.33 115.64 116.83 1o1w s THR 46 Ca 0.02 0.70 -0.12 0.00 -1.18 0.00 0.00 61.69 61.11 1o1w s THR 46 Cb 0.03 -3.65 -0.06 0.00 1.34 0.00 0.00 72.50 70.16 1o1w s THR 46 CO -0.09 0.58 0.44 -0.76 -0.54 0.00 0.00 174.62 174.25 1o1w s LEU 47 N -1.09 4.38 -0.15 4.79 2.01 -1.06 -4.88 118.68 122.69 1o1w s LEU 47 Ca 0.22 0.91 -0.04 0.00 0.01 0.00 0.00 54.13 55.23 1o1w s LEU 47 Cb -0.16 -2.96 0.05 0.00 0.01 0.00 0.00 46.19 43.13 1o1w s LEU 47 CO 0.12 0.19 0.08 0.42 1.01 0.00 0.00 176.35 178.16 1o1w s THR 48 N -1.34 -0.01 0.00 5.49 -4.23 -1.25 -3.83 115.64 110.47 1o1w s THR 48 Ca 0.32 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.73 1o1w s THR 48 Cb -0.15 -0.55 0.00 0.00 1.34 0.00 0.00 72.50 73.14 1o1w s THR 48 CO 0.17 -0.18 0.00 0.47 -0.54 0.00 0.00 174.62 174.54 1o1w n ASP 49 N 5.25 -4.33 -4.74 3.99 8.00 -0.97 -4.95 116.55 118.80 1o1w n ASP 49 Ca -0.07 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.05 1o1w n ASP 49 Cb 0.49 -2.62 -0.06 0.00 -0.02 0.00 0.00 41.12 38.91 1o1w n ASP 49 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1o1w s THR 50 N -1.33 5.05 1.07 -3.53 -4.23 -1.26 -5.00 115.64 106.41 1o1w s THR 50 Ca 0.00 1.13 -0.12 0.00 -1.18 0.00 0.00 61.69 61.52 1o1w s THR 50 Cb 0.00 -3.89 0.23 0.00 1.34 0.00 0.00 72.50 70.18 1o1w s THR 50 CO 0.00 0.37 1.06 -0.89 -0.54 0.00 0.00 174.62 174.62 1o1w s THR 51 N 0.23 2.09 0.16 3.99 2.01 -1.26 -4.46 115.64 118.40 1o1w s THR 51 Ca 0.30 0.03 -0.20 0.00 0.31 0.00 0.00 61.69 62.13 1o1w s THR 51 Cb -0.17 -2.29 0.08 0.00 0.01 0.00 0.00 72.50 70.13 1o1w s THR 51 CO 0.14 -0.04 1.64 -0.55 -0.69 0.00 0.00 174.62 175.12 1o1w h ASN 52 N -2.23 -0.64 0.23 3.53 7.08 -1.87 0.47 115.58 122.14 1o1w h ASN 52 Ca -0.57 0.14 -0.06 0.00 -3.08 0.00 0.00 56.30 52.73 1o1w h ASN 52 Cb 1.33 0.34 -0.01 0.00 -2.08 0.00 0.00 38.32 37.90 1o1w h ASN 52 CO 0.53 -0.22 -0.27 1.56 -2.08 0.00 0.00 177.43 176.95 1o1w h GLN 53 N -0.14 0.06 0.00 4.14 4.20 -1.89 -1.28 115.11 120.21 1o1w h GLN 53 Ca 0.18 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.80 1o1w h GLN 53 Cb 0.41 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 1o1w h GLN 53 CO -0.44 0.32 -0.33 0.87 -0.67 0.00 0.00 178.83 178.58 1o1w h LYS 54 N 0.05 0.00 -0.60 1.46 6.56 -0.95 0.55 116.57 123.65 1o1w h LYS 54 Ca 0.01 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.57 1o1w h LYS 54 Cb 0.50 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.13 1o1w h LYS 54 CO 0.04 0.33 0.27 1.79 -2.06 0.00 0.00 179.45 179.81 1o1w h THR 55 N 0.00 1.21 0.00 -0.16 1.35 0.99 0.50 112.91 116.80 1o1w h THR 55 Ca -0.00 -0.61 -0.09 0.00 -0.55 0.00 0.00 66.41 65.15 1o1w h THR 55 Cb 0.77 0.46 -0.01 0.00 -1.73 0.00 0.00 68.15 67.64 1o1w h THR 55 CO 0.04 0.25 -0.45 -0.33 -0.25 0.00 0.00 175.52 174.79 1o1w h GLU 56 N 0.86 0.00 -0.24 4.72 4.39 -1.30 -2.71 114.58 120.29 1o1w h GLU 56 Ca 0.21 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.82 1o1w h GLU 56 Cb 0.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1o1w h GLU 56 CO -0.02 0.43 -0.18 1.25 -1.16 0.00 0.00 179.01 179.33 1o1w h LEU 57 N 0.00 0.58 -0.06 1.33 5.85 0.14 0.64 115.31 123.78 1o1w h LEU 57 Ca -0.01 -0.44 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 1o1w h LEU 57 Cb 1.33 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 1o1w h LEU 57 CO 0.06 0.90 0.03 -0.61 -0.34 0.00 0.00 178.44 178.48 1o1w h GLN 58 N 0.26 0.09 -0.58 1.25 5.75 -0.14 -1.16 115.11 120.58 1o1w h GLN 58 Ca 0.05 -0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.57 1o1w h GLN 58 Cb 0.71 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.21 1o1w h GLN 58 CO 0.05 0.17 0.38 0.00 -2.65 0.00 0.00 178.83 176.78 1o1w h ALA 59 N 0.92 1.70 -0.70 3.38 0.00 -1.39 -0.55 119.26 122.63 1o1w h ALA 59 Ca 0.02 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.01 1o1w h ALA 59 Cb 0.11 -0.19 -0.08 0.00 0.00 0.00 0.00 17.79 17.63 1o1w h ALA 59 CO -0.00 0.23 0.31 0.82 0.00 0.00 0.00 179.25 180.61 1o1w h ILE 60 N 0.67 0.78 -0.51 0.00 2.04 0.15 0.47 117.51 121.12 1o1w h ILE 60 Ca 0.23 -0.18 0.13 0.00 1.00 0.00 0.00 64.86 66.04 1o1w h ILE 60 Cb 0.09 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 1o1w h ILE 60 CO -0.06 0.09 0.36 0.22 0.00 0.00 0.00 178.15 178.76 1o1w h TYR 61 N 0.52 0.12 0.32 1.37 5.03 -0.36 -0.82 116.97 123.13 1o1w h TYR 61 Ca 0.36 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.65 1o1w h TYR 61 Cb 0.43 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 38.68 1o1w h TYR 61 CO -0.14 0.05 -0.15 -0.07 -1.32 0.00 0.00 178.16 176.54 1o1w h LEU 62 N 0.11 -0.36 -2.28 2.82 3.38 0.02 0.19 115.31 119.19 1o1w h LEU 62 Ca 0.24 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1o1w h LEU 62 Cb 0.82 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1o1w h LEU 62 CO -0.03 -0.03 -0.05 0.00 0.09 0.00 0.00 178.44 178.43 1o1w h ALA 63 N -0.16 1.35 0.00 1.53 0.00 -1.06 0.41 119.26 121.33 1o1w h ALA 63 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1o1w h ALA 63 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1o1w h ALA 63 CO 0.07 0.06 -0.51 -0.07 0.00 0.00 0.00 179.25 178.81 1o1w h LEU 64 N 0.00 0.00 0.09 0.00 3.38 -0.92 -2.70 115.31 115.16 1o1w h LEU 64 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1o1w h LEU 64 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1o1w h LEU 64 CO 0.01 0.00 -0.04 1.56 0.09 0.00 0.00 178.44 180.06 1o1w h GLN 65 N 0.00 -0.12 -0.72 1.13 1.08 0.17 -3.27 115.11 113.38 1o1w h GLN 65 Ca 0.00 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1o1w h GLN 65 Cb 0.98 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.44 1o1w h GLN 65 CO 0.00 0.31 0.00 -0.25 -0.95 0.00 0.00 178.83 177.94 1o1w n ASP 66 N -4.93 4.06 0.27 1.46 9.92 -1.17 -4.57 116.55 121.58 1o1w n ASP 66 Ca -0.09 -2.05 -0.17 0.00 -0.53 0.00 0.00 54.79 51.95 1o1w n ASP 66 Cb 0.25 -0.50 -0.09 0.00 -0.64 0.00 0.00 41.12 40.14 1o1w n ASP 66 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 1o1w h SER 67 N 4.25 -1.27 0.00 -2.24 4.64 -1.52 -3.48 113.55 113.93 1o1w h SER 67 Ca 0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1o1w h SER 67 Cb 1.05 0.42 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1o1w h SER 67 CO 0.03 -0.62 0.00 0.61 -0.87 0.00 0.00 176.83 175.98 1o1w n GLY 68 N -1.54 1.20 0.00 -0.77 0.00 -1.26 -4.77 105.19 98.05 1o1w n GLY 68 Ca -0.11 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1o1w n GLY 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o1w n LEU 69 N 0.00 0.00 -4.25 0.99 4.77 -1.26 -4.38 117.00 112.86 1o1w n LEU 69 Ca 0.00 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.64 1o1w n LEU 69 Cb 0.00 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 1o1w n LEU 69 CO 0.00 0.00 -0.43 -1.83 -1.33 0.00 0.00 177.39 173.80 1o1w s GLU 70 N 0.00 3.26 0.32 3.23 -1.05 -1.26 -0.31 118.70 122.89 1o1w s GLU 70 Ca 0.00 -0.69 0.03 0.00 -0.15 0.00 0.00 54.97 54.16 1o1w s GLU 70 Cb 0.00 -2.85 -0.04 0.00 -0.44 0.00 0.00 34.13 30.79 1o1w s GLU 70 CO 0.00 -0.18 0.11 0.14 0.95 0.00 0.00 175.26 176.28 1o1w s VAL 71 N 1.36 0.65 -0.41 1.83 -7.23 0.14 -0.58 120.40 116.15 1o1w s VAL 71 Ca 0.05 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.12 1o1w s VAL 71 Cb -0.14 -2.58 0.07 0.00 0.56 0.00 0.00 36.38 34.29 1o1w s VAL 71 CO -0.06 0.00 0.25 0.20 -0.31 0.00 0.00 175.10 175.18 1o1w s ASN 72 N -3.43 5.67 -0.56 4.85 0.02 0.62 -0.90 114.94 121.21 1o1w s ASN 72 Ca 0.34 -1.39 -0.18 0.00 -1.02 0.00 0.00 52.86 50.62 1o1w s ASN 72 Cb 0.06 -2.00 0.10 0.00 0.02 0.00 0.00 41.25 39.44 1o1w s ASN 72 CO 0.15 -0.51 0.63 -0.63 0.02 0.00 0.00 177.10 176.76 1o1w s ILE 73 N 1.46 4.95 -0.48 0.60 1.01 0.23 -0.31 121.20 128.66 1o1w s ILE 73 Ca 0.03 -1.08 -0.21 0.00 0.00 0.00 0.00 60.65 59.39 1o1w s ILE 73 Cb -0.22 -4.41 0.04 0.00 0.01 0.00 0.00 42.46 37.88 1o1w s ILE 73 CO 0.03 -1.00 0.68 -0.69 0.00 0.00 0.00 174.94 173.96 1o1w s VAL 74 N 2.34 4.78 -0.02 2.92 1.01 -1.14 -2.76 120.40 127.54 1o1w s VAL 74 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 1o1w s VAL 74 Cb -0.25 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 31.86 1o1w s VAL 74 CO 0.06 -0.74 0.04 -0.89 0.00 0.00 0.00 175.10 173.57 1o1w s THR 75 N 2.91 -0.03 -0.76 3.92 2.01 -1.10 -0.39 115.64 122.20 1o1w s THR 75 Ca 0.21 0.10 -0.24 0.00 0.31 0.00 0.00 61.69 62.07 1o1w s THR 75 Cb -0.16 -0.07 0.06 0.00 0.01 0.00 0.00 72.50 72.34 1o1w s THR 75 CO 0.17 0.04 1.15 -1.81 -0.69 0.00 0.00 174.62 173.48 1o1w s ASP 76 N 0.51 6.26 -0.30 3.53 1.01 -1.26 -4.00 116.67 122.43 1o1w s ASP 76 Ca -0.04 -0.99 -0.05 0.00 0.71 0.00 0.00 52.55 52.18 1o1w s ASP 76 Cb -0.06 -2.48 0.19 0.00 1.01 0.00 0.00 42.92 41.57 1o1w s ASP 76 CO -0.02 -1.54 0.77 -0.55 0.21 0.00 0.00 175.17 174.04 1o1w s SER 77 N 3.86 -1.06 0.01 0.27 0.15 -1.26 -4.77 113.70 110.90 1o1w s SER 77 Ca 0.31 0.58 0.28 0.00 0.70 0.00 0.00 55.95 57.81 1o1w s SER 77 Cb -0.10 1.86 1.18 0.00 -1.71 0.00 0.00 66.02 67.25 1o1w s SER 77 CO 0.07 -0.20 1.90 0.00 1.20 0.00 0.00 173.24 176.21 1o1w n GLN 78 N 5.43 0.02 -0.07 5.44 10.64 -1.26 -1.92 117.38 135.66 1o1w n GLN 78 Ca -0.02 0.03 -0.10 0.00 -1.83 0.00 0.00 57.00 55.07 1o1w n GLN 78 Cb 0.53 -1.52 -0.09 0.00 -0.86 0.00 0.00 30.24 28.29 1o1w n GLN 78 CO 0.00 0.00 0.00 -0.92 -1.83 0.00 0.00 177.06 174.31 1o1w h TYR 79 N 0.00 0.00 -0.92 2.61 5.03 -1.94 -2.78 116.97 118.96 1o1w h TYR 79 Ca 0.00 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.36 1o1w h TYR 79 Cb 0.50 0.00 -0.06 0.00 1.55 0.00 0.00 36.73 38.72 1o1w h TYR 79 CO 0.00 0.74 0.60 0.00 -1.32 0.00 0.00 178.16 178.18 1o1w h ALA 80 N -0.28 1.46 -0.97 1.82 0.00 -1.85 0.34 119.26 119.79 1o1w h ALA 80 Ca -0.01 -0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.11 1o1w h ALA 80 Cb 0.74 -0.29 -0.12 0.00 0.00 0.00 0.00 17.79 18.11 1o1w h ALA 80 CO -0.00 0.42 0.53 1.25 0.00 0.00 0.00 179.25 181.44 1o1w h LEU 81 N 1.10 0.57 0.06 0.00 6.46 -1.42 1.12 115.31 123.20 1o1w h LEU 81 Ca 0.39 0.14 -0.13 0.00 -0.12 0.00 0.00 57.88 58.16 1o1w h LEU 81 Cb 0.13 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.12 1o1w h LEU 81 CO -0.14 0.08 -0.61 1.23 -0.62 0.00 0.00 178.44 178.38 1o1w h GLY 82 N 0.53 0.16 0.00 3.75 0.00 -0.18 -3.32 103.07 104.00 1o1w h GLY 82 Ca 0.61 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1o1w h GLY 82 CO -0.49 0.35 -0.32 -2.22 0.00 0.00 0.00 176.54 173.86 1o1w h ILE 83 N -0.69 0.00 -0.54 2.60 1.08 -0.12 -3.13 117.51 116.71 1o1w h ILE 83 Ca -0.13 -0.98 0.16 0.00 -0.39 0.00 0.00 64.86 63.52 1o1w h ILE 83 Cb 1.36 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.09 1o1w h ILE 83 CO 0.04 0.00 0.63 -0.29 -0.69 0.00 0.00 178.15 177.84 1o1w h ILE 84 N -0.98 0.25 0.01 -0.67 -0.00 0.11 0.95 117.51 117.18 1o1w h ILE 84 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 64.86 64.60 1o1w h ILE 84 Cb 0.32 0.49 -0.04 0.00 -0.00 0.00 0.00 36.82 37.59 1o1w h ILE 84 CO 0.00 0.00 -1.40 -0.61 -0.00 0.00 0.00 178.15 176.14 1o1w h GLN 85 N 0.00 0.02 -1.88 2.19 4.15 -1.52 -3.35 115.11 114.71 1o1w h GLN 85 Ca 0.26 -0.03 -0.45 0.00 0.77 0.00 0.00 58.65 59.19 1o1w h GLN 85 Cb 1.52 0.01 -0.17 0.00 0.21 0.00 0.00 27.48 29.05 1o1w h GLN 85 CO -0.00 0.75 0.38 0.00 -1.93 0.00 0.00 178.83 178.03 1o1w n ALA 86 N -2.48 6.16 -3.30 3.38 0.00 0.33 -4.86 120.51 119.73 1o1w n ALA 86 Ca -0.10 -2.71 -0.17 0.00 0.00 0.00 0.00 53.44 50.46 1o1w n ALA 86 Cb 1.00 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1o1w n ALA 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1o1w n GLN 87 N 0.79 -1.01 -0.20 0.00 3.00 -1.20 -4.71 117.38 114.05 1o1w n GLN 87 Ca 0.45 0.50 -0.01 0.00 -0.01 0.00 0.00 57.00 57.92 1o1w n GLN 87 Cb 0.57 -1.41 0.01 0.00 0.00 0.00 0.00 30.24 29.41 1o1w n GLN 87 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1o1w n PRO 88 N -1.79 1.07 0.32 -1.09 -0.04 -1.17 -4.39 135.00 127.92 1o1w n PRO 88 Ca -0.20 -0.17 0.14 0.00 -0.04 0.00 0.00 63.50 63.23 1o1w n PRO 88 Cb 0.45 -1.07 0.74 0.00 -0.04 0.00 0.00 33.50 33.58 1o1w n PRO 88 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1o1w h ASP 89 N 0.33 0.00 0.00 3.54 3.32 -1.84 -3.06 116.42 118.71 1o1w h ASP 89 Ca 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1o1w h ASP 89 Cb 1.07 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 1o1w h ASP 89 CO 0.07 0.00 -0.02 0.00 -1.72 0.00 0.00 179.24 177.57 1o1w n GLN 90 N -2.89 0.00 -4.57 3.56 -0.00 -1.26 -4.72 117.38 107.50 1o1w n GLN 90 Ca -0.01 -0.06 -0.31 0.00 -0.00 0.00 0.00 57.00 56.63 1o1w n GLN 90 Cb 0.45 0.03 -0.12 0.00 -0.00 0.00 0.00 30.24 30.60 1o1w n GLN 90 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1o1w s SER 91 N -0.06 3.89 0.81 2.61 0.01 -1.16 -5.05 113.70 114.76 1o1w s SER 91 Ca 0.00 -0.43 0.00 0.00 1.31 0.00 0.00 55.95 56.83 1o1w s SER 91 Cb 0.00 -0.64 0.00 0.00 0.21 0.00 0.00 66.02 65.59 1o1w s SER 91 CO 0.00 0.24 0.00 1.21 0.41 0.00 0.00 173.24 175.10 1o1w n GLU 92 N 1.40 0.00 -1.26 12.44 4.07 -1.26 -4.74 120.64 131.29 1o1w n GLU 92 Ca -0.16 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.53 1o1w n GLU 92 Cb 0.52 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.89 1o1w n GLU 92 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1o1w n SER 93 N 2.02 -2.24 0.06 4.31 7.64 -1.26 -4.89 113.62 119.26 1o1w n SER 93 Ca 0.00 0.86 -0.05 0.00 1.01 0.00 0.00 58.87 60.69 1o1w n SER 93 Cb 0.00 -0.85 -0.10 0.00 -1.01 0.00 0.00 64.21 62.25 1o1w n SER 93 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1o1w h GLU 94 N 0.50 0.00 0.55 1.43 4.11 -1.95 -3.33 114.58 115.90 1o1w h GLU 94 Ca -0.32 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.08 1o1w h GLU 94 Cb 1.36 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.62 1o1w h GLU 94 CO 0.47 0.77 -0.27 1.25 0.07 0.00 0.00 179.01 181.30 1o1w h LEU 95 N 0.00 -0.63 -1.97 3.06 5.85 -1.95 -2.40 115.31 117.27 1o1w h LEU 95 Ca -0.07 -0.01 0.20 0.00 0.84 0.00 0.00 57.88 58.84 1o1w h LEU 95 Cb 1.74 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.90 1o1w h LEU 95 CO 0.10 -0.40 0.56 -0.37 -0.34 0.00 0.00 178.44 177.99 1o1w h VAL 96 N -0.82 0.51 0.37 1.05 -1.51 -1.87 0.03 116.25 114.02 1o1w h VAL 96 Ca -0.08 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.38 1o1w h VAL 96 Cb 0.60 0.59 -0.00 0.00 -2.13 0.00 0.00 31.29 30.35 1o1w h VAL 96 CO 0.13 0.00 -0.21 0.78 -1.23 0.00 0.00 177.57 177.03 1o1w h ASN 97 N 0.00 -0.53 -0.57 4.19 -0.26 -1.35 0.20 115.58 117.26 1o1w h ASN 97 Ca 0.33 0.03 -0.03 0.00 -0.56 0.00 0.00 56.30 56.08 1o1w h ASN 97 Cb 1.45 0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 38.83 1o1w h ASN 97 CO -0.00 -0.35 0.27 -0.61 -1.06 0.00 0.00 177.43 175.68 1o1w h GLN 98 N -0.56 0.86 -0.67 0.81 -0.00 -0.96 -1.69 115.11 112.90 1o1w h GLN 98 Ca -0.04 -0.12 -0.06 0.00 -0.00 0.00 0.00 58.65 58.43 1o1w h GLN 98 Cb 0.45 -0.16 -0.03 0.00 0.00 0.00 0.00 27.48 27.74 1o1w h GLN 98 CO 0.05 0.68 0.18 0.82 0.00 0.00 0.00 178.83 180.56 1o1w h ILE 99 N 0.85 1.25 -0.05 2.39 5.03 -0.82 -3.03 117.51 123.13 1o1w h ILE 99 Ca 0.21 -0.92 -0.05 0.00 -0.12 0.00 0.00 64.86 63.98 1o1w h ILE 99 Cb 0.12 0.55 0.00 0.00 -3.03 0.00 0.00 36.82 34.46 1o1w h ILE 99 CO -0.02 0.35 -0.17 0.40 -0.68 0.00 0.00 178.15 178.03 1o1w h ILE 100 N 1.00 1.44 -0.98 -0.67 1.08 -0.15 -2.39 117.51 116.84 1o1w h ILE 100 Ca 0.21 -1.57 0.27 0.00 -0.39 0.00 0.00 64.86 63.39 1o1w h ILE 100 Cb 0.33 2.33 -0.14 0.00 -3.07 0.00 0.00 36.82 36.28 1o1w h ILE 100 CO -0.00 0.44 0.52 -0.33 -0.69 0.00 0.00 178.15 178.08 1o1w h GLU 101 N -0.32 0.40 -0.14 2.37 4.39 -1.29 1.64 114.58 121.62 1o1w h GLU 101 Ca -0.01 -0.02 -0.15 0.00 0.34 0.00 0.00 59.36 59.52 1o1w h GLU 101 Cb 0.79 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.34 1o1w h GLU 101 CO 0.04 0.26 -0.56 1.96 -1.16 0.00 0.00 179.01 179.55 1o1w h GLN 102 N 0.41 0.44 0.00 2.33 7.50 -1.51 -2.45 115.11 121.82 1o1w h GLN 102 Ca 0.66 -0.28 -0.03 0.00 0.50 0.00 0.00 58.65 59.51 1o1w h GLN 102 Cb 1.38 0.03 -0.00 0.00 0.05 0.00 0.00 27.48 28.94 1o1w h GLN 102 CO -0.56 0.88 -0.13 1.25 -1.50 0.00 0.00 178.83 178.77 1o1w h LEU 103 N 0.34 0.00 -0.23 1.46 6.46 0.26 -2.88 115.31 120.71 1o1w h LEU 103 Ca 0.00 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.70 1o1w h LEU 103 Cb 1.08 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.00 1o1w h LEU 103 CO 0.10 0.13 -0.10 0.40 -0.62 0.00 0.00 178.44 178.35 1o1w h ILE 104 N 0.00 1.30 0.00 4.05 2.04 0.92 -2.75 117.51 123.07 1o1w h ILE 104 Ca -0.00 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.69 1o1w h ILE 104 Cb 0.53 1.59 0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1o1w h ILE 104 CO 0.02 0.36 0.00 2.29 0.00 0.00 0.00 178.15 180.82 1o1w n LYS 105 N -4.52 0.84 -0.84 2.37 2.85 -1.09 -4.80 118.16 112.96 1o1w n LYS 105 Ca -0.04 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 1o1w n LYS 105 Cb 0.33 -1.12 0.00 0.00 -0.65 0.00 0.00 35.03 33.60 1o1w n LYS 105 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 1o1w n LYS 106 N -0.34 0.94 0.00 -1.58 2.85 -1.04 -4.99 118.16 114.01 1o1w n LYS 106 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1o1w n LYS 106 Cb 0.06 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.44 1o1w n LYS 106 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1o1w n GLU 107 N 0.00 0.00 -3.53 -1.58 4.07 0.58 -4.75 120.64 115.42 1o1w n GLU 107 Ca 0.00 0.00 -0.18 0.00 -0.06 0.00 0.00 57.16 56.92 1o1w n GLU 107 Cb 0.00 -0.16 -0.06 0.00 -0.06 0.00 0.00 31.44 31.16 1o1w n GLU 107 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 1o1w s LYS 108 N 0.00 1.05 -0.11 5.31 -2.85 -0.75 -2.05 119.74 120.34 1o1w s LYS 108 Ca 0.00 0.24 0.01 0.00 -1.00 0.00 0.00 55.97 55.22 1o1w s LYS 108 Cb 0.00 0.49 0.02 0.00 -2.06 0.00 0.00 37.83 36.28 1o1w s LYS 108 CO 0.00 -0.33 -0.14 0.14 0.10 0.00 0.00 175.35 175.12 1o1w s VAL 109 N -1.21 1.43 -0.61 1.79 -7.23 -1.25 0.23 120.40 113.54 1o1w s VAL 109 Ca -0.11 -0.59 -0.27 0.00 -1.81 0.00 0.00 61.98 59.20 1o1w s VAL 109 Cb -0.00 -1.32 0.03 0.00 0.56 0.00 0.00 36.38 35.65 1o1w s VAL 109 CO 0.10 0.43 1.16 -0.47 -0.31 0.00 0.00 175.10 176.00 1o1w s TYR 110 N 1.09 2.58 -0.27 2.82 5.04 -0.08 -2.85 117.35 125.69 1o1w s TYR 110 Ca -0.05 0.22 -0.12 0.00 -2.44 0.00 0.00 57.07 54.68 1o1w s TYR 110 Cb -0.14 -4.45 -0.05 0.00 0.35 0.00 0.00 41.96 37.67 1o1w s TYR 110 CO -0.03 -1.64 0.22 -0.51 -1.34 0.00 0.00 175.55 172.26 1o1w s LEU 111 N 4.89 4.05 0.02 6.97 1.43 -1.21 0.78 118.68 135.61 1o1w s LEU 111 Ca 0.38 0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 1o1w s LEU 111 Cb -0.09 -2.19 -0.02 0.00 0.03 0.00 0.00 46.19 43.93 1o1w s LEU 111 CO 0.22 -0.05 -0.00 0.00 0.23 0.00 0.00 176.35 176.75 1o1w s ALA 112 N 1.64 0.05 -0.24 4.21 0.00 -1.11 -4.53 121.76 121.77 1o1w s ALA 112 Ca 0.09 -0.51 -0.16 0.00 0.00 0.00 0.00 51.96 51.39 1o1w s ALA 112 Cb -0.15 0.14 0.07 0.00 0.00 0.00 0.00 23.12 23.18 1o1w s ALA 112 CO 0.09 -0.17 0.61 -0.46 0.00 0.00 0.00 175.76 175.83 1o1w s TRP 113 N -1.43 -0.87 -0.04 0.00 -0.00 -1.26 -2.70 118.94 112.65 1o1w s TRP 113 Ca -0.16 1.82 0.07 0.00 -0.00 0.00 0.00 56.10 57.83 1o1w s TRP 113 Cb -0.09 0.46 -0.02 0.00 -0.00 0.00 0.00 33.47 33.81 1o1w s TRP 113 CO -0.01 -0.44 -0.23 0.08 -0.00 0.00 0.00 176.95 176.35 1o1w s VAL 114 N 1.29 2.26 -0.45 5.86 1.01 -1.26 -4.95 120.40 124.15 1o1w s VAL 114 Ca -0.08 -1.02 -0.40 0.00 0.00 0.00 0.00 61.98 60.48 1o1w s VAL 114 Cb -0.06 -1.81 -0.17 0.00 0.00 0.00 0.00 36.38 34.34 1o1w s VAL 114 CO -0.14 0.58 1.87 -2.65 0.00 0.00 0.00 175.10 174.76 1o1w n PRO 115 N 2.54 0.00 0.00 2.72 -0.02 -1.26 -4.59 135.00 134.39 1o1w n PRO 115 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1o1w n PRO 115 Cb 0.51 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 1o1w n PRO 115 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1o1w n ALA 116 N 6.33 0.00 -0.07 3.55 0.00 -1.26 -5.04 120.51 124.02 1o1w n ALA 116 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1o1w n ALA 116 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.41 1o1w n ALA 116 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1o1w n HIS 117 N 0.00 0.00 -2.22 0.00 8.25 -1.26 -4.99 115.22 115.00 1o1w n HIS 117 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.43 1o1w n HIS 117 Cb 0.00 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.19 1o1w n HIS 117 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 1o1w n LYS 118 N 0.00 1.68 -3.91 -0.41 0.00 -1.26 -4.96 118.16 109.30 1o1w n LYS 118 Ca 0.00 -3.21 -0.29 0.00 -0.00 0.00 0.00 58.31 54.81 1o1w n LYS 118 Cb 0.01 -1.35 -0.12 0.00 -0.00 0.00 0.00 35.03 33.57 1o1w n LYS 118 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1o1w s GLY 119 N -3.13 2.84 0.00 2.58 0.00 -1.26 -4.93 107.32 103.42 1o1w s GLY 119 Ca 0.37 -3.72 0.00 0.00 0.00 0.00 0.00 44.72 41.37 1o1w s GLY 119 CO -0.06 1.06 0.00 1.39 0.00 0.00 0.00 173.10 175.49 1o1w n ILE 120 N 2.22 0.00 0.00 0.90 -0.00 -1.26 -4.71 119.36 116.51 1o1w n ILE 120 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.91 1o1w n ILE 120 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.98 1o1w n ILE 120 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1o1w n GLY 121 N 2.24 -2.52 3.26 7.39 0.00 -1.26 -4.62 105.19 109.68 1o1w n GLY 121 Ca 0.00 0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1o1w n GLY 121 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o1w s GLY 122 N 0.00 1.96 0.00 -0.02 0.00 -1.26 -4.85 107.32 103.14 1o1w s GLY 122 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 44.72 42.58 1o1w s GLY 122 CO 0.00 0.95 0.00 -2.01 0.00 0.00 0.00 173.10 172.04 1o1w n ASN 123 N 4.88 0.46 -2.95 1.64 5.15 -1.26 -5.07 115.26 118.12 1o1w n ASN 123 Ca -0.10 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.75 1o1w n ASN 123 Cb 0.43 0.00 0.07 0.00 -0.53 0.00 0.00 39.78 39.75 1o1w n ASN 123 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1o1w n GLU 124 N -2.86 -4.46 -3.33 1.20 4.07 -1.26 -2.88 120.64 111.12 1o1w n GLU 124 Ca 0.00 0.69 -0.23 0.00 -0.06 0.00 0.00 57.16 57.56 1o1w n GLU 124 Cb 0.44 -5.16 0.00 0.00 -0.06 0.00 0.00 31.44 26.66 1o1w n GLU 124 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 1o1w n GLN 125 N -3.36 -3.57 -3.64 5.31 -0.06 -1.26 -4.92 117.38 105.87 1o1w n GLN 125 Ca -0.19 0.52 -0.08 0.00 -2.00 0.00 0.00 57.00 55.26 1o1w n GLN 125 Cb 0.63 -5.25 -0.07 0.00 -4.06 0.00 0.00 30.24 21.49 1o1w n GLN 125 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1o1w s VAL 126 N -2.96 0.00 0.00 1.69 0.11 -1.14 -5.10 120.40 113.00 1o1w s VAL 126 Ca 0.39 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.44 1o1w s VAL 126 Cb -0.20 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.65 1o1w s VAL 126 CO 0.48 0.00 0.00 -0.67 -3.33 0.00 0.00 175.10 171.58 1o1w n ASP 127 N 2.77 0.00 -1.74 3.54 2.03 -1.26 -4.66 116.55 117.23 1o1w n ASP 127 Ca -0.15 0.06 -0.04 0.00 0.52 0.00 0.00 54.79 55.18 1o1w n ASP 127 Cb 0.56 -0.39 0.02 0.00 -0.72 0.00 0.00 41.12 40.60 1o1w n ASP 127 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1o1w n LYS 128 N -2.18 0.61 -3.00 -0.67 4.76 -1.26 -5.06 118.16 111.37 1o1w n LYS 128 Ca 0.00 -1.01 -0.14 0.00 -2.87 0.00 0.00 58.31 54.29 1o1w n LYS 128 Cb 0.00 0.45 0.02 0.00 -1.84 0.00 0.00 35.03 33.65 1o1w n LYS 128 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1o1w n LEU 129 N -0.69 -6.77 -4.58 -0.35 0.00 -1.26 -4.83 117.00 98.51 1o1w n LEU 129 Ca -0.21 0.37 -0.41 0.00 0.00 0.00 0.00 56.01 55.76 1o1w n LEU 129 Cb 0.75 -3.02 -0.03 0.00 0.00 0.00 0.00 43.42 41.12 1o1w n LEU 129 CO -0.14 -1.83 1.50 0.68 0.00 0.00 0.00 177.39 177.60 1o1w s VAL 130 N -2.39 3.51 -0.83 1.96 -7.23 -1.26 -4.89 120.40 109.27 1o1w s VAL 130 Ca 0.27 0.45 0.02 0.00 -1.81 0.00 0.00 61.98 60.90 1o1w s VAL 130 Cb -0.06 -3.88 0.32 0.00 0.56 0.00 0.00 36.38 33.32 1o1w s VAL 130 CO 0.79 -0.70 1.38 -0.24 -0.31 0.00 0.00 175.10 176.03 1o1w n SER 131 N 10.99 5.92 -1.95 4.85 2.88 -1.26 -4.78 113.62 130.27 1o1w n SER 131 Ca 0.20 -3.65 -0.21 0.00 -1.33 0.00 0.00 58.87 53.89 1o1w n SER 131 Cb 0.49 -0.91 -0.05 0.00 -0.75 0.00 0.00 64.21 62.99 1o1w n SER 131 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o1w n ALA 132 N 0.05 -0.45 -1.07 -1.46 0.00 -1.26 -4.95 120.51 111.37 1o1w n ALA 132 Ca 0.38 0.26 -0.31 0.00 0.00 0.00 0.00 53.44 53.77 1o1w n ALA 132 Cb 0.33 -2.09 0.12 0.00 0.00 0.00 0.00 19.45 17.81 1o1w n ALA 132 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1o1w s GLY 133 N -2.44 1.67 -0.76 0.00 0.00 -1.26 -4.91 107.32 99.62 1o1w s GLY 133 Ca 0.00 0.32 -0.04 0.00 0.00 0.00 0.00 44.72 45.00 1o1w s GLY 133 CO 0.00 0.71 2.62 1.39 0.00 0.00 0.00 173.10 177.82 1o1w n ILE 134 N -3.80 4.02 -2.59 0.90 2.08 -1.26 -4.19 119.36 114.52 1o1w n ILE 134 Ca 0.10 -3.51 0.02 0.00 0.56 0.00 0.00 62.75 59.92 1o1w n ILE 134 Cb 0.53 -1.75 0.03 0.00 -0.75 0.00 0.00 39.64 37.70 1o1w n ILE 134 CO 0.00 0.00 0.00 -2.11 0.56 0.00 0.00 176.55 175.00 1o1w n ARG 135 N 1.12 0.58 -2.49 0.38 0.00 -1.26 -3.34 116.66 111.66 1o1w n ARG 135 Ca 0.53 -2.42 -0.36 0.00 -0.00 0.00 0.00 57.85 55.61 1o1w n ARG 135 Cb 0.44 -0.48 -0.03 0.00 -0.00 0.00 0.00 32.46 32.39 1o1w n ARG 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1o1w s LYS 136 N -1.21 3.94 -0.24 2.89 -2.85 -1.26 -2.68 119.74 118.33 1o1w s LYS 136 Ca 0.30 1.50 -0.10 0.00 -1.00 0.00 0.00 55.97 56.67 1o1w s LYS 136 Cb 0.35 -2.34 -0.05 0.00 -2.06 0.00 0.00 37.83 33.74 1o1w s LYS 136 CO -0.12 -0.33 0.14 0.14 0.10 0.00 0.00 175.35 175.27 1o1w s VAL 137 N -1.76 5.11 -2.00 1.79 -7.23 -1.26 -2.88 120.40 112.17 1o1w s VAL 137 Ca 0.63 0.09 0.24 0.00 -1.81 0.00 0.00 61.98 61.13 1o1w s VAL 137 Cb -0.21 -3.38 0.69 0.00 0.56 0.00 0.00 36.38 34.04 1o1w s VAL 137 CO 0.26 0.35 1.81 -0.11 -0.31 0.00 0.00 175.10 177.09