#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a9n s LYS 3 N 0.00 2.78 -0.10 1.45 2.20 -1.26 -4.30 119.74 120.51 1a9n s LYS 3 Ca 0.00 2.08 -0.29 0.00 -0.36 0.00 0.00 55.97 57.39 1a9n s LYS 3 Cb 0.00 -1.97 -0.01 0.00 -1.51 0.00 0.00 37.83 34.34 1a9n s LYS 3 CO 0.00 -1.43 1.00 -1.17 -0.36 0.00 0.00 175.35 173.39 1a9n s LEU 4 N -4.09 4.26 0.26 5.43 2.96 -1.26 -4.95 118.68 121.28 1a9n s LEU 4 Ca 0.79 1.54 0.01 0.00 -0.22 0.00 0.00 54.13 56.25 1a9n s LEU 4 Cb -0.37 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.72 1a9n s LEU 4 CO 0.41 -0.43 0.10 0.28 -1.32 0.00 0.00 176.35 175.39 1a9n s THR 5 N 1.91 0.55 0.13 3.68 -1.32 -1.26 -4.62 115.64 114.70 1a9n s THR 5 Ca 0.48 -2.00 -0.24 0.00 -1.21 0.00 0.00 61.69 58.73 1a9n s THR 5 Cb -0.18 -2.63 -0.03 0.00 -1.51 0.00 0.00 72.50 68.15 1a9n s THR 5 CO 0.19 -0.01 1.65 0.00 -2.21 0.00 0.00 174.62 174.24 1a9n h ALA 6 N 2.39 -0.18 -0.81 11.08 0.00 -1.93 -0.71 119.26 129.11 1a9n h ALA 6 Ca -0.38 0.03 0.14 0.00 0.00 0.00 0.00 54.91 54.70 1a9n h ALA 6 Cb 1.25 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 19.31 1a9n h ALA 6 CO 0.61 -0.67 0.39 0.93 0.00 0.00 0.00 179.25 180.51 1a9n h GLU 7 N -0.27 0.56 -0.46 0.00 3.07 -1.97 -1.48 114.58 114.03 1a9n h GLU 7 Ca 0.08 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.90 1a9n h GLU 7 Cb 0.39 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.15 1a9n h GLU 7 CO -0.24 0.37 0.26 1.25 -1.40 0.00 0.00 179.01 179.25 1a9n h LEU 8 N 0.57 0.56 -0.86 1.33 5.85 -1.62 -2.62 115.31 118.53 1a9n h LEU 8 Ca 0.44 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 59.04 1a9n h LEU 8 Cb 0.61 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1a9n h LEU 8 CO -0.36 0.46 0.28 0.40 -0.34 0.00 0.00 178.44 178.88 1a9n h ILE 9 N 0.60 1.25 0.00 4.05 2.04 -0.52 -2.70 117.51 122.24 1a9n h ILE 9 Ca 0.16 -0.82 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 1a9n h ILE 9 Cb 0.02 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 1a9n h ILE 9 CO -0.03 0.33 -0.20 -0.33 0.00 0.00 0.00 178.15 177.92 1a9n h GLU 10 N 1.09 0.00 -0.02 2.37 5.08 -0.95 -3.10 114.58 119.05 1a9n h GLU 10 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1a9n h GLU 10 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1a9n h GLU 10 CO -0.02 0.20 -0.20 0.00 -1.00 0.00 0.00 179.01 177.99 1a9n n GLN 11 N -3.43 1.83 -2.48 2.33 -0.00 -1.02 -4.98 117.38 109.64 1a9n n GLN 11 Ca -0.00 -1.52 -0.39 0.00 -0.00 0.00 0.00 57.00 55.09 1a9n n GLN 11 Cb 0.39 -1.46 -0.04 0.00 -0.00 0.00 0.00 30.24 29.13 1a9n n GLN 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1a9n s ALA 12 N -2.17 3.25 0.19 2.61 0.00 -1.04 -4.96 121.76 119.63 1a9n s ALA 12 Ca 0.24 0.82 -0.33 0.00 0.00 0.00 0.00 51.96 52.69 1a9n s ALA 12 Cb 0.19 -3.31 -0.14 0.00 0.00 0.00 0.00 23.12 19.86 1a9n s ALA 12 CO 0.41 -0.22 1.45 0.00 0.00 0.00 0.00 175.76 177.40 1a9n n ALA 13 N 0.56 0.84 -3.40 0.00 0.00 -1.26 -4.85 120.51 112.39 1a9n n ALA 13 Ca 0.02 0.44 -0.28 0.00 0.00 0.00 0.00 53.44 53.62 1a9n n ALA 13 Cb 0.47 -2.26 -0.17 0.00 0.00 0.00 0.00 19.45 17.49 1a9n n ALA 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1a9n s GLN 14 N 0.20 2.33 0.32 0.00 0.74 -1.26 -1.94 119.66 120.05 1a9n s GLN 14 Ca 0.74 -0.63 -0.18 0.00 0.05 0.00 0.00 55.36 55.35 1a9n s GLN 14 Cb -0.71 -1.85 0.03 0.00 1.10 0.00 0.00 33.01 31.58 1a9n s GLN 14 CO 0.45 0.07 0.71 1.52 -0.55 0.00 0.00 175.29 177.49 1a9n s TYR 15 N 0.59 0.01 -0.10 1.67 -0.85 -0.83 -5.03 117.35 112.81 1a9n s TYR 15 Ca -0.15 -0.53 -0.14 0.00 -0.52 0.00 0.00 57.07 55.73 1a9n s TYR 15 Cb -0.17 0.68 -0.05 0.00 0.38 0.00 0.00 41.96 42.81 1a9n s TYR 15 CO 0.05 -1.33 0.35 0.99 -1.52 0.00 0.00 175.55 174.09 1a9n s THR 16 N -3.35 5.21 0.55 -3.49 2.01 -1.26 -0.77 115.64 114.53 1a9n s THR 16 Ca 0.14 0.69 -0.00 0.00 0.31 0.00 0.00 61.69 62.83 1a9n s THR 16 Cb -0.05 -3.67 0.11 0.00 0.01 0.00 0.00 72.50 68.89 1a9n s THR 16 CO 0.09 0.46 0.75 -0.46 -0.69 0.00 0.00 174.62 174.77 1a9n n ASN 17 N 2.89 1.00 0.22 3.53 0.23 0.12 -4.90 115.26 118.35 1a9n n ASN 17 Ca -0.12 -1.85 0.15 0.00 -0.53 0.00 0.00 54.58 52.24 1a9n n ASN 17 Cb 0.52 -0.49 0.77 0.00 -2.08 0.00 0.00 39.78 38.50 1a9n n ASN 17 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1a9n h ALA 18 N -0.58 1.00 -0.25 -2.53 0.00 -1.98 -1.96 119.26 112.97 1a9n h ALA 18 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1a9n h ALA 18 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1a9n h ALA 18 CO 0.26 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.84 1a9n n VAL 19 N -2.60 2.15 -3.23 0.00 0.24 -1.26 -4.99 118.33 108.65 1a9n n VAL 19 Ca -0.01 -1.83 -0.15 0.00 -2.04 0.00 0.00 64.34 60.31 1a9n n VAL 19 Cb 0.12 -0.19 0.08 0.00 -1.47 0.00 0.00 33.84 32.37 1a9n n VAL 19 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1a9n n ARG 20 N -0.50 -5.69 -4.32 7.34 1.74 -0.74 -5.05 116.66 109.45 1a9n n ARG 20 Ca 0.20 0.72 -0.20 0.00 -0.77 0.00 0.00 57.85 57.80 1a9n n ARG 20 Cb 0.83 -5.36 -0.11 0.00 -1.02 0.00 0.00 32.46 26.80 1a9n n ARG 20 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1a9n s ASP 21 N -4.11 2.53 -0.24 0.55 1.01 -1.26 -4.88 116.67 110.27 1a9n s ASP 21 Ca 0.02 -0.88 -0.22 0.00 0.71 0.00 0.00 52.55 52.19 1a9n s ASP 21 Cb -0.01 -0.14 -0.02 0.00 1.01 0.00 0.00 42.92 43.77 1a9n s ASP 21 CO 0.62 -0.08 0.71 -0.13 0.21 0.00 0.00 175.17 176.50 1a9n s ARG 22 N -2.91 4.16 0.01 8.23 1.81 -1.26 0.15 118.95 129.14 1a9n s ARG 22 Ca 0.15 0.71 0.07 0.00 -1.72 0.00 0.00 55.73 54.95 1a9n s ARG 22 Cb -0.05 -3.63 -0.02 0.00 -0.45 0.00 0.00 34.95 30.80 1a9n s ARG 22 CO 0.06 -0.41 -0.21 -2.00 -0.68 0.00 0.00 175.30 172.05 1a9n s GLU 23 N 2.50 1.60 -0.22 3.54 2.12 0.05 -0.21 118.70 128.07 1a9n s GLU 23 Ca 0.30 -0.82 -0.09 0.00 0.36 0.00 0.00 54.97 54.72 1a9n s GLU 23 Cb -0.16 -1.61 -0.04 0.00 0.26 0.00 0.00 34.13 32.58 1a9n s GLU 23 CO 0.09 0.43 0.11 -1.17 -0.54 0.00 0.00 175.26 174.18 1a9n s LEU 24 N -0.74 3.92 -0.46 2.70 2.96 -0.76 -1.97 118.68 124.33 1a9n s LEU 24 Ca 0.08 0.06 -0.23 0.00 -0.22 0.00 0.00 54.13 53.82 1a9n s LEU 24 Cb -0.08 -2.03 0.03 0.00 0.50 0.00 0.00 46.19 44.60 1a9n s LEU 24 CO 0.00 0.09 0.81 -0.62 -1.32 0.00 0.00 176.35 175.31 1a9n s ASP 25 N 0.90 6.41 -0.17 3.68 -1.08 -0.82 -1.49 116.67 124.10 1a9n s ASP 25 Ca 0.06 -0.12 0.16 0.00 -0.52 0.00 0.00 52.55 52.12 1a9n s ASP 25 Cb -0.13 -2.39 0.37 0.00 -1.46 0.00 0.00 42.92 39.31 1a9n s ASP 25 CO 0.03 -0.95 1.23 0.18 0.52 0.00 0.00 175.17 176.18 1a9n n LEU 26 N 6.80 2.79 -4.74 -1.34 4.77 0.56 -4.38 117.00 121.47 1a9n n LEU 26 Ca 0.02 -3.38 -0.32 0.00 -0.03 0.00 0.00 56.01 52.30 1a9n n LEU 26 Cb 0.48 -0.49 0.09 0.00 -2.33 0.00 0.00 43.42 41.18 1a9n n LEU 26 CO 0.60 0.95 0.73 -0.13 -1.33 0.00 0.00 177.39 178.21 1a9n s ARG 27 N -3.01 2.13 -0.38 3.23 0.52 -1.17 -4.14 118.95 116.14 1a9n s ARG 27 Ca 0.36 1.46 -0.02 0.00 -0.52 0.00 0.00 55.73 57.01 1a9n s ARG 27 Cb 0.32 -1.86 0.02 0.00 0.52 0.00 0.00 34.95 33.95 1a9n s ARG 27 CO 0.01 -1.78 0.05 0.41 0.02 0.00 0.00 175.30 174.01 1a9n n GLY 28 N -0.32 -0.49 1.26 -3.53 0.00 -0.84 -4.83 105.19 96.44 1a9n n GLY 28 Ca 0.11 0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.25 1a9n n GLY 28 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1a9n n TYR 29 N -2.83 0.93 -3.95 1.61 4.01 -1.26 -4.95 117.16 110.72 1a9n n TYR 29 Ca -0.02 -0.46 -0.32 0.00 -0.16 0.00 0.00 57.90 56.94 1a9n n TYR 29 Cb 0.52 -0.01 0.01 0.00 -0.31 0.00 0.00 39.34 39.55 1a9n n TYR 29 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1a9n n LYS 30 N 1.46 -4.68 -2.37 -0.72 5.02 -1.26 -4.89 118.16 110.72 1a9n n LYS 30 Ca 0.23 0.53 -0.42 0.00 -2.02 0.00 0.00 58.31 56.62 1a9n n LYS 30 Cb 0.59 -5.36 -0.03 0.00 -0.02 0.00 0.00 35.03 30.20 1a9n n LYS 30 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1a9n s ILE 31 N -3.26 3.92 -0.10 -0.18 1.01 -1.26 -4.61 121.20 116.72 1a9n s ILE 31 Ca 0.67 1.36 -0.01 0.00 0.00 0.00 0.00 60.65 62.68 1a9n s ILE 31 Cb -0.35 -3.87 -0.25 0.00 0.01 0.00 0.00 42.46 38.00 1a9n s ILE 31 CO 0.83 0.09 0.45 -0.81 0.00 0.00 0.00 174.94 175.49 1a9n n PRO 32 N 4.17 0.72 -4.63 2.79 -0.04 -1.26 -0.88 135.00 135.88 1a9n n PRO 32 Ca 0.10 0.27 -0.24 0.00 -0.04 0.00 0.00 63.50 63.59 1a9n n PRO 32 Cb 0.45 -1.73 -0.16 0.00 -0.04 0.00 0.00 33.50 32.02 1a9n n PRO 32 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1a9n s VAL 33 N -2.57 1.15 -0.17 0.52 1.01 -1.26 -3.62 120.40 115.45 1a9n s VAL 33 Ca -0.17 -0.54 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 1a9n s VAL 33 Cb 0.07 -1.01 -0.00 0.00 0.00 0.00 0.00 36.38 35.43 1a9n s VAL 33 CO 0.79 0.35 1.10 -0.63 0.00 0.00 0.00 175.10 176.70 1a9n s ILE 34 N 0.27 4.57 0.22 2.22 1.01 -1.26 -4.37 121.20 123.86 1a9n s ILE 34 Ca -0.07 1.88 -0.23 0.00 0.00 0.00 0.00 60.65 62.23 1a9n s ILE 34 Cb -0.12 -4.21 0.04 0.00 0.01 0.00 0.00 42.46 38.18 1a9n s ILE 34 CO 0.02 -0.12 0.84 -1.83 0.00 0.00 0.00 174.94 173.85 1a9n s GLU 35 N 2.93 1.50 -1.36 2.79 -1.05 -1.26 -4.52 118.70 117.73 1a9n s GLU 35 Ca 0.49 -0.83 -0.04 0.00 -0.15 0.00 0.00 54.97 54.43 1a9n s GLU 35 Cb -0.18 0.51 0.02 0.00 -0.44 0.00 0.00 34.13 34.04 1a9n s GLU 35 CO 0.12 -0.69 0.31 0.09 0.95 0.00 0.00 175.26 176.04 1a9n n ASN 36 N -0.47 -4.74 0.12 0.83 3.02 -1.26 -4.70 115.26 108.06 1a9n n ASN 36 Ca -0.05 -0.14 0.13 0.00 -0.03 0.00 0.00 54.58 54.49 1a9n n ASN 36 Cb 0.60 -3.92 0.45 0.00 -0.61 0.00 0.00 39.78 36.30 1a9n n ASN 36 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1a9n n LEU 37 N -3.44 0.75 -0.33 3.41 4.77 -1.26 -3.41 117.00 117.49 1a9n n LEU 37 Ca -0.11 0.62 0.16 0.00 -0.03 0.00 0.00 56.01 56.65 1a9n n LEU 37 Cb 0.60 -0.44 0.36 0.00 -2.33 0.00 0.00 43.42 41.61 1a9n n LEU 37 CO 0.37 -0.36 1.11 1.23 -1.33 0.00 0.00 177.39 178.41 1a9n h GLY 38 N 3.47 1.76 1.39 -0.72 0.00 -1.97 0.53 103.07 107.54 1a9n h GLY 38 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1a9n h GLY 38 CO 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 176.54 176.28 1a9n n ALA 39 N -2.39 1.31 0.49 3.60 0.00 -1.22 -0.48 120.51 121.82 1a9n n ALA 39 Ca 0.25 -0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.81 1a9n n ALA 39 Cb 0.72 -1.00 0.13 0.00 0.00 0.00 0.00 19.45 19.30 1a9n n ALA 39 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1a9n h THR 40 N 0.00 0.00 -1.57 0.00 1.35 -1.16 -3.46 112.91 108.06 1a9n h THR 40 Ca 0.00 -0.58 -0.35 0.00 -0.55 0.00 0.00 66.41 64.93 1a9n h THR 40 Cb 0.00 1.13 -0.12 0.00 -1.73 0.00 0.00 68.15 67.44 1a9n h THR 40 CO 0.00 0.00 -0.34 0.18 -0.25 0.00 0.00 175.52 175.11 1a9n n LEU 41 N -2.21 -1.32 -1.57 3.87 4.77 0.37 -1.81 117.00 119.09 1a9n n LEU 41 Ca 0.03 0.36 -0.12 0.00 -0.03 0.00 0.00 56.01 56.25 1a9n n LEU 41 Cb 0.46 -2.49 0.01 0.00 -2.33 0.00 0.00 43.42 39.07 1a9n n LEU 41 CO 0.37 -0.77 -0.05 -0.67 -1.33 0.00 0.00 177.39 174.94 1a9n n ASP 42 N -1.14 -3.88 -1.52 -1.43 -0.08 -1.26 -4.95 116.55 102.29 1a9n n ASP 42 Ca -0.18 -0.10 0.10 0.00 -1.51 0.00 0.00 54.79 53.10 1a9n n ASP 42 Cb 0.58 -2.90 0.35 0.00 2.34 0.00 0.00 41.12 41.50 1a9n n ASP 42 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1a9n n GLN 43 N -2.36 3.38 -4.43 -0.67 6.02 -0.75 -4.61 117.38 113.96 1a9n n GLN 43 Ca -0.09 -2.83 -0.27 0.00 -0.01 0.00 0.00 57.00 53.81 1a9n n GLN 43 Cb 0.58 -1.78 -0.13 0.00 1.02 0.00 0.00 30.24 29.93 1a9n n GLN 43 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1a9n s PHE 44 N -1.53 2.09 -0.10 1.08 0.08 -1.26 -4.95 117.98 113.39 1a9n s PHE 44 Ca 0.51 -0.40 0.11 0.00 0.12 0.00 0.00 56.93 57.27 1a9n s PHE 44 Cb 0.31 -1.16 -0.24 0.00 -0.57 0.00 0.00 43.02 41.36 1a9n s PHE 44 CO 0.28 0.25 0.46 -0.25 -0.10 0.00 0.00 175.22 175.86 1a9n n ASP 45 N 1.15 0.90 -3.83 1.36 8.00 0.71 -2.85 116.55 121.99 1a9n n ASP 45 Ca -0.18 0.28 -0.12 0.00 0.71 0.00 0.00 54.79 55.47 1a9n n ASP 45 Cb 0.53 0.04 -0.12 0.00 -0.02 0.00 0.00 41.12 41.55 1a9n n ASP 45 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a9n s ALA 46 N -2.57 -0.37 -0.09 2.24 0.00 -0.71 -0.83 121.76 119.43 1a9n s ALA 46 Ca -0.09 0.37 0.04 0.00 0.00 0.00 0.00 51.96 52.27 1a9n s ALA 46 Cb 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.98 1a9n s ALA 46 CO 0.81 -0.09 -0.22 0.42 0.00 0.00 0.00 175.76 176.68 1a9n s ILE 47 N -0.07 1.94 -0.36 0.00 1.01 -0.77 -1.83 121.20 121.12 1a9n s ILE 47 Ca -0.02 -0.95 -0.11 0.00 0.00 0.00 0.00 60.65 59.58 1a9n s ILE 47 Cb -0.02 -1.68 0.02 0.00 0.01 0.00 0.00 42.46 40.79 1a9n s ILE 47 CO 0.00 0.53 0.19 -0.62 0.00 0.00 0.00 174.94 175.05 1a9n s ASP 48 N 0.37 5.69 -0.18 3.58 -1.08 -0.56 -1.89 116.67 122.61 1a9n s ASP 48 Ca -0.18 -0.85 0.17 0.00 -0.52 0.00 0.00 52.55 51.17 1a9n s ASP 48 Cb -0.18 -2.02 0.52 0.00 -1.46 0.00 0.00 42.92 39.78 1a9n s ASP 48 CO 0.08 -0.33 1.41 0.49 0.52 0.00 0.00 175.17 177.35 1a9n n PHE 49 N 5.00 0.91 -0.60 -5.34 3.72 0.18 -0.32 117.46 121.01 1a9n n PHE 49 Ca -0.12 -0.89 -0.30 0.00 -0.05 0.00 0.00 57.45 56.08 1a9n n PHE 49 Cb 0.47 -0.31 0.20 0.00 -0.94 0.00 0.00 39.48 38.90 1a9n n PHE 49 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1a9n n SER 50 N -0.56 -0.55 -3.80 4.37 7.64 -1.17 -3.90 113.62 115.65 1a9n n SER 50 Ca 0.21 0.19 -0.34 0.00 1.01 0.00 0.00 58.87 59.94 1a9n n SER 50 Cb 0.89 -1.38 0.02 0.00 -1.01 0.00 0.00 64.21 62.73 1a9n n SER 50 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1a9n n ASP 51 N -4.44 -5.00 -0.57 6.43 8.00 -1.01 -2.98 116.55 116.98 1a9n n ASP 51 Ca 0.08 -1.05 0.00 0.00 0.71 0.00 0.00 54.79 54.54 1a9n n ASP 51 Cb 0.53 -2.56 0.00 0.00 -0.02 0.00 0.00 41.12 39.06 1a9n n ASP 51 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1a9n n ASN 52 N -2.42 0.42 -0.71 -2.24 3.02 -1.17 -1.99 115.26 110.17 1a9n n ASN 52 Ca -0.14 -0.47 0.06 0.00 -0.03 0.00 0.00 54.58 54.00 1a9n n ASN 52 Cb 0.59 0.00 0.15 0.00 -0.61 0.00 0.00 39.78 39.92 1a9n n ASN 52 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1a9n n GLU 53 N 0.00 1.14 -1.87 3.52 1.02 -0.06 -4.40 120.64 120.00 1a9n n GLU 53 Ca 0.00 -2.83 -0.42 0.00 -0.02 0.00 0.00 57.16 53.89 1a9n n GLU 53 Cb 0.00 -1.21 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 1a9n n GLU 53 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1a9n s ILE 54 N -2.36 2.69 -0.14 -3.67 1.01 -0.94 -4.53 121.20 113.27 1a9n s ILE 54 Ca 0.35 0.34 0.17 0.00 0.00 0.00 0.00 60.65 61.51 1a9n s ILE 54 Cb 0.34 -3.22 -0.24 0.00 0.01 0.00 0.00 42.46 39.36 1a9n s ILE 54 CO -0.07 0.01 0.36 0.54 0.00 0.00 0.00 174.94 175.78 1a9n n ARG 55 N 4.90 0.66 -4.01 2.79 1.74 -1.24 -0.54 116.66 120.96 1a9n n ARG 55 Ca 0.16 0.06 -0.19 0.00 -0.77 0.00 0.00 57.85 57.10 1a9n n ARG 55 Cb 0.39 -1.62 -0.16 0.00 -1.02 0.00 0.00 32.46 30.04 1a9n n ARG 55 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1a9n s LYS 56 N -2.73 0.60 -1.13 5.56 2.20 -1.26 -0.34 119.74 122.64 1a9n s LYS 56 Ca -0.08 -0.00 -0.18 0.00 -0.36 0.00 0.00 55.97 55.36 1a9n s LYS 56 Cb 0.08 -0.73 0.12 0.00 -1.51 0.00 0.00 37.83 35.79 1a9n s LYS 56 CO 0.84 -0.14 1.43 -1.17 -0.36 0.00 0.00 175.35 175.95 1a9n s LEU 57 N 1.13 4.50 0.00 5.43 2.96 -0.89 -4.66 118.68 127.15 1a9n s LEU 57 Ca -0.08 -2.37 -0.10 0.00 -0.22 0.00 0.00 54.13 51.37 1a9n s LEU 57 Cb -0.14 -2.47 0.04 0.00 0.50 0.00 0.00 46.19 44.12 1a9n s LEU 57 CO -0.01 -1.05 0.51 -0.67 -1.32 0.00 0.00 176.35 173.80 1a9n n ASP 58 N 7.07 -1.45 -0.15 3.68 2.03 -1.26 -0.92 116.55 125.55 1a9n n ASP 58 Ca 0.36 -2.00 -0.02 0.00 0.52 0.00 0.00 54.79 53.65 1a9n n ASP 58 Cb 0.46 2.42 -0.01 0.00 -0.72 0.00 0.00 41.12 43.27 1a9n n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a9n n GLY 59 N -0.34 0.55 3.84 0.27 0.00 -1.26 -4.60 105.19 103.64 1a9n n GLY 59 Ca -0.06 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 1a9n n GLY 59 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a9n s PHE 60 N -1.99 3.52 0.22 1.61 0.08 -1.26 -4.39 117.98 115.76 1a9n s PHE 60 Ca 0.00 1.18 -0.02 0.00 0.12 0.00 0.00 56.93 58.21 1a9n s PHE 60 Cb 0.00 -2.48 0.05 0.00 -0.57 0.00 0.00 43.02 40.02 1a9n s PHE 60 CO 0.00 0.27 0.30 -0.35 -0.10 0.00 0.00 175.22 175.34 1a9n n PRO 61 N 0.28 0.11 -2.46 0.24 -0.04 -1.26 -4.89 135.00 126.97 1a9n n PRO 61 Ca -0.01 -0.64 -0.43 0.00 -0.04 0.00 0.00 63.50 62.38 1a9n n PRO 61 Cb 0.52 -0.25 -0.02 0.00 -0.04 0.00 0.00 33.50 33.71 1a9n n PRO 61 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1a9n s LEU 62 N 0.00 4.05 -0.35 1.53 2.96 -1.26 -4.68 118.68 120.92 1a9n s LEU 62 Ca 0.18 1.44 0.01 0.00 -0.22 0.00 0.00 54.13 55.54 1a9n s LEU 62 Cb -0.01 -3.54 0.11 0.00 0.50 0.00 0.00 46.19 43.25 1a9n s LEU 62 CO 0.13 -0.87 0.13 -0.76 -1.32 0.00 0.00 176.35 173.65 1a9n s LEU 63 N 3.79 2.74 0.49 -0.68 1.43 -0.16 -4.87 118.68 121.43 1a9n s LEU 63 Ca 0.53 -1.99 0.28 0.00 -1.03 0.00 0.00 54.13 51.92 1a9n s LEU 63 Cb -0.18 -1.03 0.87 0.00 0.03 0.00 0.00 46.19 45.88 1a9n s LEU 63 CO 0.17 -0.37 1.80 0.03 0.23 0.00 0.00 176.35 178.21 1a9n h ARG 64 N 7.64 0.00 0.00 1.70 3.08 -1.90 -3.24 114.38 121.66 1a9n h ARG 64 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1a9n h ARG 64 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1a9n h ARG 64 CO 0.48 0.02 -1.37 -2.13 -1.07 0.00 0.00 179.97 175.90 1a9n n ARG 65 N -3.11 0.46 -1.94 0.04 0.63 -1.26 -4.69 116.66 106.78 1a9n n ARG 65 Ca 0.02 -0.05 -0.43 0.00 -0.92 0.00 0.00 57.85 56.48 1a9n n ARG 65 Cb 0.42 -1.60 -0.03 0.00 0.45 0.00 0.00 32.46 31.70 1a9n n ARG 65 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1a9n s LEU 66 N -4.33 4.05 -0.02 6.15 2.96 -1.13 -4.27 118.68 122.09 1a9n s LEU 66 Ca -0.01 2.01 0.02 0.00 -0.22 0.00 0.00 54.13 55.93 1a9n s LEU 66 Cb 0.13 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.26 1a9n s LEU 66 CO 0.84 -1.22 0.03 0.29 -1.32 0.00 0.00 176.35 174.98 1a9n n LYS 67 N 7.63 2.20 -5.19 1.98 5.02 -0.01 -3.76 118.16 126.03 1a9n n LYS 67 Ca 0.20 -0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 56.16 1a9n n LYS 67 Cb 0.44 -1.06 -0.17 0.00 -0.02 0.00 0.00 35.03 34.21 1a9n n LYS 67 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1a9n s THR 68 N -2.11 2.01 -0.18 -0.18 2.01 -0.15 -0.69 115.64 116.35 1a9n s THR 68 Ca -0.01 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 61.00 1a9n s THR 68 Cb 0.01 -1.74 0.04 0.00 0.01 0.00 0.00 72.50 70.82 1a9n s THR 68 CO 0.11 0.55 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.71 1a9n s LEU 69 N 0.30 2.11 -0.41 4.42 1.43 -0.38 -1.84 118.68 124.31 1a9n s LEU 69 Ca -0.17 -0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 52.03 1a9n s LEU 69 Cb -0.17 -1.22 0.04 0.00 0.03 0.00 0.00 46.19 44.87 1a9n s LEU 69 CO 0.08 -0.12 0.27 -0.76 0.23 0.00 0.00 176.35 176.06 1a9n s LEU 70 N 1.42 5.06 -0.22 1.79 1.43 -0.79 -2.03 118.68 125.34 1a9n s LEU 70 Ca 0.01 -1.12 0.11 0.00 -1.03 0.00 0.00 54.13 52.09 1a9n s LEU 70 Cb -0.15 -2.08 0.42 0.00 0.03 0.00 0.00 46.19 44.41 1a9n s LEU 70 CO -0.09 -0.48 1.22 0.52 0.23 0.00 0.00 176.35 177.76 1a9n n VAL 71 N 5.06 2.23 -0.97 -1.59 0.31 -0.53 0.47 118.33 123.32 1a9n n VAL 71 Ca -0.11 -3.29 -0.34 0.00 -0.01 0.00 0.00 64.34 60.58 1a9n n VAL 71 Cb 0.45 -0.29 0.09 0.00 -0.91 0.00 0.00 33.84 33.19 1a9n n VAL 71 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1a9n n ASN 72 N -1.10 -2.34 -3.59 4.52 3.02 -1.24 -3.83 115.26 110.70 1a9n n ASN 72 Ca 0.21 0.39 -0.22 0.00 -0.03 0.00 0.00 54.58 54.93 1a9n n ASN 72 Cb 0.71 -1.15 0.00 0.00 -0.61 0.00 0.00 39.78 38.74 1a9n n ASN 72 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1a9n n ASN 73 N -0.35 -3.00 0.00 6.41 3.02 -0.91 -2.40 115.26 118.03 1a9n n ASN 73 Ca 0.07 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 1a9n n ASN 73 Cb 0.53 -1.05 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 1a9n n ASN 73 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1a9n n ASN 74 N -1.41 0.38 -2.63 6.41 3.02 -1.15 -3.04 115.26 116.83 1a9n n ASN 74 Ca -0.17 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.32 1a9n n ASN 74 Cb 0.43 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.64 1a9n n ASN 74 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1a9n n ARG 75 N 0.00 2.19 -1.65 3.52 1.74 0.30 -4.48 116.66 118.28 1a9n n ARG 75 Ca 0.00 -3.67 -0.41 0.00 -0.77 0.00 0.00 57.85 53.00 1a9n n ARG 75 Cb 0.00 -1.77 -0.03 0.00 -1.02 0.00 0.00 32.46 29.64 1a9n n ARG 75 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1a9n s ILE 76 N -4.00 3.07 -0.35 0.55 -1.09 -0.87 -3.98 121.20 114.53 1a9n s ILE 76 Ca 0.33 0.07 0.12 0.00 -2.23 0.00 0.00 60.65 58.94 1a9n s ILE 76 Cb 0.35 -3.12 -0.15 0.00 -1.58 0.00 0.00 42.46 37.95 1a9n s ILE 76 CO -0.02 -0.09 0.42 0.00 -1.23 0.00 0.00 174.94 174.02 1a9n s ARG 78 N -2.41 0.38 -0.19 0.00 3.52 -1.18 -4.69 118.95 114.38 1a9n s ARG 78 Ca 0.01 -0.23 -0.02 0.00 -0.13 0.00 0.00 55.73 55.36 1a9n s ARG 78 Cb 0.09 0.16 -0.01 0.00 -1.56 0.00 0.00 34.95 33.63 1a9n s ARG 78 CO 0.50 -0.08 -0.08 0.42 -0.81 0.00 0.00 175.30 175.25 1a9n s ILE 79 N -0.93 3.15 0.60 4.11 1.01 -1.26 -2.10 121.20 125.77 1a9n s ILE 79 Ca -0.10 -0.58 -0.18 0.00 0.00 0.00 0.00 60.65 59.79 1a9n s ILE 79 Cb -0.06 -2.39 -0.07 0.00 0.01 0.00 0.00 42.46 39.95 1a9n s ILE 79 CO 0.01 0.46 0.65 0.61 0.00 0.00 0.00 174.94 176.67 1a9n n GLY 80 N 4.44 -1.18 0.07 6.18 0.00 -0.10 -4.78 105.19 109.83 1a9n n GLY 80 Ca -0.19 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 1a9n n GLY 80 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1a9n h GLU 81 N 0.20 0.06 -0.71 1.61 4.39 -1.94 -3.36 114.58 114.83 1a9n h GLU 81 Ca -0.46 -0.10 -0.44 0.00 0.34 0.00 0.00 59.36 58.69 1a9n h GLU 81 Cb 1.38 0.04 -0.26 0.00 -0.10 0.00 0.00 28.75 29.81 1a9n h GLU 81 CO 0.47 1.04 0.12 0.41 -1.16 0.00 0.00 179.01 179.89 1a9n n GLY 82 N 1.39 5.43 0.32 -3.84 0.00 -1.26 -4.81 105.19 102.42 1a9n n GLY 82 Ca -0.02 -1.81 0.15 0.00 0.00 0.00 0.00 46.02 44.34 1a9n n GLY 82 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1a9n h LEU 83 N 1.52 0.35 -1.37 0.99 3.38 -1.90 0.25 115.31 118.53 1a9n h LEU 83 Ca 0.42 0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.54 1a9n h LEU 83 Cb 1.60 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.46 1a9n h LEU 83 CO 0.90 -0.02 0.25 -2.24 0.09 0.00 0.00 178.44 177.42 1a9n h ASP 84 N 0.39 0.61 0.41 -0.43 2.03 -1.80 0.27 116.42 117.90 1a9n h ASP 84 Ca 0.59 -0.05 -0.02 0.00 -0.73 0.00 0.00 57.03 56.82 1a9n h ASP 84 Cb 1.15 -0.15 -0.00 0.00 -0.83 0.00 0.00 39.33 39.49 1a9n h ASP 84 CO -0.54 0.51 -0.11 1.56 -1.03 0.00 0.00 179.24 179.63 1a9n h GLN 85 N 0.69 0.00 0.00 4.15 4.20 -1.30 -2.85 115.11 120.00 1a9n h GLN 85 Ca 0.18 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.78 1a9n h GLN 85 Cb 0.05 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1a9n h GLN 85 CO -0.03 0.11 -1.68 0.00 -0.67 0.00 0.00 178.83 176.56 1a9n n ALA 86 N -2.25 2.09 -3.37 3.87 0.00 -0.65 -4.80 120.51 115.39 1a9n n ALA 86 Ca -0.02 -0.53 -0.26 0.00 0.00 0.00 0.00 53.44 52.64 1a9n n ALA 86 Cb 0.24 -0.21 -0.08 0.00 0.00 0.00 0.00 19.45 19.39 1a9n n ALA 86 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1a9n n LEU 87 N -2.18 1.29 0.20 0.00 4.77 0.87 -0.98 117.00 120.97 1a9n n LEU 87 Ca -0.11 -4.88 0.08 0.00 -0.03 0.00 0.00 56.01 51.07 1a9n n LEU 87 Cb 0.60 0.12 0.60 0.00 -2.33 0.00 0.00 43.42 42.41 1a9n n LEU 87 CO 0.25 1.99 1.09 1.55 -1.33 0.00 0.00 177.39 180.94 1a9n h PRO 88 N 4.54 0.10 -0.25 3.23 0.13 -1.73 -2.94 132.00 135.08 1a9n h PRO 88 Ca 0.15 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1a9n h PRO 88 Cb 0.82 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1a9n h PRO 88 CO 0.57 0.07 0.00 -3.47 -0.23 0.00 0.00 178.00 174.94 1a9n n ASP 89 N -4.52 3.74 -4.68 1.44 -0.08 -1.26 -4.41 116.55 106.78 1a9n n ASP 89 Ca -0.01 -2.96 -0.53 0.00 -1.51 0.00 0.00 54.79 49.79 1a9n n ASP 89 Cb 0.11 -0.52 -0.06 0.00 2.34 0.00 0.00 41.12 42.99 1a9n n ASP 89 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1a9n n LEU 90 N -0.50 2.67 -0.00 -2.67 7.94 -1.11 -4.53 117.00 118.81 1a9n n LEU 90 Ca 0.20 1.05 0.02 0.00 -1.11 0.00 0.00 56.01 56.17 1a9n n LEU 90 Cb 0.85 -1.25 -0.03 0.00 0.53 0.00 0.00 43.42 43.52 1a9n n LEU 90 CO 0.14 -0.40 -0.55 0.41 -1.11 0.00 0.00 177.39 175.88 1a9n n THR 91 N 4.30 0.02 -3.84 1.96 -1.04 0.13 -2.59 114.28 113.22 1a9n n THR 91 Ca 0.23 -0.09 -0.22 0.00 -2.04 0.00 0.00 64.05 61.93 1a9n n THR 91 Cb 0.21 0.32 -0.17 0.00 -1.82 0.00 0.00 70.33 68.87 1a9n n THR 91 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1a9n s GLU 92 N -2.25 0.62 -0.16 -2.82 2.12 -0.83 -1.26 118.70 114.13 1a9n s GLU 92 Ca -0.01 0.08 -0.01 0.00 0.36 0.00 0.00 54.97 55.38 1a9n s GLU 92 Cb 0.02 -0.92 0.04 0.00 0.26 0.00 0.00 34.13 33.53 1a9n s GLU 92 CO 0.15 -0.26 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.40 1a9n s LEU 93 N 1.76 1.48 -0.34 2.70 2.96 -0.04 -1.25 118.68 125.95 1a9n s LEU 93 Ca 0.02 -0.62 -0.07 0.00 -0.22 0.00 0.00 54.13 53.24 1a9n s LEU 93 Cb -0.13 -0.84 0.04 0.00 0.50 0.00 0.00 46.19 45.76 1a9n s LEU 93 CO -0.04 -0.20 0.11 -0.63 -1.32 0.00 0.00 176.35 174.27 1a9n s ILE 94 N 1.69 3.84 -0.21 6.68 -1.09 -0.86 -2.63 121.20 128.62 1a9n s ILE 94 Ca 0.01 -1.08 0.14 0.00 -2.23 0.00 0.00 60.65 57.49 1a9n s ILE 94 Cb -0.15 -3.15 0.46 0.00 -1.58 0.00 0.00 42.46 38.03 1a9n s ILE 94 CO -0.07 -0.16 1.35 0.18 -1.23 0.00 0.00 174.94 175.01 1a9n n LEU 95 N 4.83 3.48 -4.57 2.97 4.77 0.61 -1.46 117.00 127.64 1a9n n LEU 95 Ca -0.13 -3.43 -0.46 0.00 -0.03 0.00 0.00 56.01 51.97 1a9n n LEU 95 Cb 0.45 -0.55 -0.02 0.00 -2.33 0.00 0.00 43.42 40.96 1a9n n LEU 95 CO 0.32 0.99 0.58 0.41 -1.33 0.00 0.00 177.39 178.35 1a9n n THR 96 N -1.01 1.63 -3.37 -5.08 -1.04 -1.24 -3.36 114.28 100.82 1a9n n THR 96 Ca 0.24 -0.41 -0.18 0.00 -2.04 0.00 0.00 64.05 61.67 1a9n n THR 96 Cb 0.86 -0.87 0.05 0.00 -1.82 0.00 0.00 70.33 68.55 1a9n n THR 96 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1a9n n ASN 97 N 1.55 -6.40 -0.79 8.00 5.15 0.90 -2.15 115.26 121.52 1a9n n ASN 97 Ca 0.12 -0.69 0.00 0.00 -0.60 0.00 0.00 54.58 53.41 1a9n n ASN 97 Cb 0.29 -4.52 0.00 0.00 -0.53 0.00 0.00 39.78 35.02 1a9n n ASN 97 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1a9n n ASN 98 N -2.76 1.10 -1.67 1.20 3.02 -1.19 -2.91 115.26 112.05 1a9n n ASN 98 Ca -0.07 -0.51 -0.13 0.00 -0.03 0.00 0.00 54.58 53.83 1a9n n ASN 98 Cb 0.59 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.96 1a9n n ASN 98 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1a9n n SER 99 N -0.97 3.09 -4.65 6.41 7.64 -1.07 -4.47 113.62 119.60 1a9n n SER 99 Ca 0.00 -3.70 -0.43 0.00 1.01 0.00 0.00 58.87 55.76 1a9n n SER 99 Cb 0.00 -0.73 -0.02 0.00 -1.01 0.00 0.00 64.21 62.45 1a9n n SER 99 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1a9n s LEU 100 N -3.27 4.09 -0.02 -3.43 1.43 -1.01 -4.26 118.68 112.22 1a9n s LEU 100 Ca 0.50 1.66 0.13 0.00 -1.03 0.00 0.00 54.13 55.40 1a9n s LEU 100 Cb 0.44 -3.54 -0.20 0.00 0.03 0.00 0.00 46.19 42.92 1a9n s LEU 100 CO 0.05 -0.95 0.31 1.33 0.23 0.00 0.00 176.35 177.32 1a9n n VAL 101 N 5.76 0.00 -4.98 -1.59 0.24 -1.26 -1.82 118.33 114.67 1a9n n VAL 101 Ca 0.15 -0.30 -0.27 0.00 -2.04 0.00 0.00 64.34 61.88 1a9n n VAL 101 Cb 0.45 0.23 -0.16 0.00 -1.47 0.00 0.00 33.84 32.89 1a9n n VAL 101 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1a9n s GLU 102 N -2.90 1.82 0.31 7.34 2.02 -1.26 -4.31 118.70 121.72 1a9n s GLU 102 Ca -0.04 -0.71 0.08 0.00 0.02 0.00 0.00 54.97 54.31 1a9n s GLU 102 Cb 0.09 -1.66 0.82 0.00 0.10 0.00 0.00 34.13 33.48 1a9n s GLU 102 CO 0.56 0.36 1.75 -0.07 0.02 0.00 0.00 175.26 177.87 1a9n h LEU 103 N 5.90 0.70 -2.42 1.80 3.38 -1.91 0.21 115.31 122.98 1a9n h LEU 103 Ca -0.36 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1a9n h LEU 103 Cb 1.16 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1a9n h LEU 103 CO 0.48 0.16 -0.03 1.23 0.09 0.00 0.00 178.44 180.37 1a9n h GLY 104 N 0.64 0.00 2.00 0.83 0.00 -1.86 -1.51 103.07 103.17 1a9n h GLY 104 Ca 0.62 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.92 1a9n h GLY 104 CO -0.44 0.00 -0.11 -0.55 0.00 0.00 0.00 176.54 175.43 1a9n h ASP 105 N 0.00 0.00 0.40 0.19 3.32 -0.96 -2.56 116.42 116.81 1a9n h ASP 105 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1a9n h ASP 105 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1a9n h ASP 105 CO 0.00 0.11 -0.05 0.18 -1.72 0.00 0.00 179.24 177.77 1a9n n LEU 106 N -3.20 0.23 -0.17 1.55 4.77 -0.57 -4.35 117.00 115.26 1a9n n LEU 106 Ca 0.01 0.12 -0.02 0.00 -0.03 0.00 0.00 56.01 56.09 1a9n n LEU 106 Cb 0.44 -0.20 0.08 0.00 -2.33 0.00 0.00 43.42 41.40 1a9n n LEU 106 CO 0.32 0.04 0.96 0.44 -1.33 0.00 0.00 177.39 177.83 1a9n h ASP 107 N 0.28 0.17 0.01 -1.43 3.32 -1.56 -2.83 116.42 114.39 1a9n h ASP 107 Ca 0.00 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1a9n h ASP 107 Cb 0.29 0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1a9n h ASP 107 CO 0.00 0.12 0.00 -2.65 -1.72 0.00 0.00 179.24 174.99 1a9n n PRO 108 N -5.01 0.13 0.01 3.56 -0.02 -1.26 -2.18 135.00 130.23 1a9n n PRO 108 Ca 0.06 0.63 0.08 0.00 -2.02 0.00 0.00 63.50 62.25 1a9n n PRO 108 Cb 0.23 -1.93 0.37 0.00 -0.02 0.00 0.00 33.50 32.15 1a9n n PRO 108 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1a9n n LEU 109 N -2.20 0.06 0.16 2.45 4.77 -1.07 -2.88 117.00 118.28 1a9n n LEU 109 Ca -0.01 0.51 0.03 0.00 -0.03 0.00 0.00 56.01 56.51 1a9n n LEU 109 Cb 0.03 -0.50 0.41 0.00 -2.33 0.00 0.00 43.42 41.03 1a9n n LEU 109 CO 0.09 -0.24 0.85 0.00 -1.33 0.00 0.00 177.39 176.76 1a9n h ALA 110 N 2.55 1.52 0.00 -1.18 0.00 -1.66 -2.67 119.26 117.81 1a9n h ALA 110 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1a9n h ALA 110 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1a9n h ALA 110 CO 0.00 0.35 0.00 0.66 0.00 0.00 0.00 179.25 180.26 1a9n h SER 111 N 0.11 0.00 -1.23 0.00 4.64 -1.77 -3.41 113.55 111.90 1a9n h SER 111 Ca 0.02 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.70 1a9n h SER 111 Cb 0.44 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.43 1a9n h SER 111 CO 0.03 0.00 1.62 -0.76 -0.87 0.00 0.00 176.83 176.85 1a9n s LEU 112 N -4.88 3.83 0.51 5.97 1.43 -1.01 -4.56 118.68 119.97 1a9n s LEU 112 Ca 0.08 -1.86 0.23 0.00 -1.03 0.00 0.00 54.13 51.55 1a9n s LEU 112 Cb 0.10 -2.55 1.33 0.00 0.03 0.00 0.00 46.19 45.11 1a9n s LEU 112 CO 0.56 -1.33 2.00 0.07 0.23 0.00 0.00 176.35 177.87 1a9n h LYS 113 N 8.97 0.07 -0.02 1.70 5.09 -1.85 -2.21 116.57 128.32 1a9n h LYS 113 Ca 0.27 -0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.01 1a9n h LYS 113 Cb 0.97 -0.01 0.00 0.00 0.10 0.00 0.00 32.23 33.28 1a9n h LYS 113 CO 1.40 0.04 -0.30 -1.13 -2.09 0.00 0.00 179.45 177.37 1a9n n SER 114 N -4.41 1.92 -4.64 7.07 3.41 -1.26 -4.93 113.62 110.78 1a9n n SER 114 Ca 0.09 -1.45 -0.54 0.00 -0.26 0.00 0.00 58.87 56.71 1a9n n SER 114 Cb 0.54 0.27 -0.07 0.00 -0.26 0.00 0.00 64.21 64.70 1a9n n SER 114 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1a9n n LEU 115 N 0.09 2.60 0.00 1.04 7.94 -0.83 -4.46 117.00 123.37 1a9n n LEU 115 Ca 0.12 0.89 0.00 0.00 -1.11 0.00 0.00 56.01 55.91 1a9n n LEU 115 Cb 0.45 -1.22 0.00 0.00 0.53 0.00 0.00 43.42 43.18 1a9n n LEU 115 CO 0.24 -0.40 -0.34 0.41 -1.11 0.00 0.00 177.39 176.20 1a9n n THR 116 N 5.37 0.00 -4.04 1.96 -1.04 -0.41 -3.24 114.28 112.89 1a9n n THR 116 Ca 0.29 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.99 1a9n n THR 116 Cb 0.19 -0.19 -0.16 0.00 -1.82 0.00 0.00 70.33 68.35 1a9n n THR 116 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1a9n s TYR 117 N -1.52 2.49 -0.02 -1.42 2.02 -0.39 -1.30 117.35 117.21 1a9n s TYR 117 Ca 0.00 -1.56 0.03 0.00 -0.37 0.00 0.00 57.07 55.17 1a9n s TYR 117 Cb 0.00 -1.71 -0.00 0.00 -0.40 0.00 0.00 41.96 39.85 1a9n s TYR 117 CO 0.00 -0.75 -0.10 -1.17 -1.57 0.00 0.00 175.55 171.96 1a9n s LEU 118 N 1.38 1.91 -0.12 -1.29 2.96 -0.85 -0.86 118.68 121.81 1a9n s LEU 118 Ca 0.01 -0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 53.69 1a9n s LEU 118 Cb -0.15 -0.58 0.05 0.00 0.50 0.00 0.00 46.19 46.02 1a9n s LEU 118 CO -0.10 0.10 0.12 0.00 -1.32 0.00 0.00 176.35 175.16 1a9n n ILE 120 N 5.30 1.75 -1.55 0.00 5.41 -1.26 -0.28 119.36 128.73 1a9n n ILE 120 Ca -0.05 -1.93 -0.38 0.00 1.00 0.00 0.00 62.75 61.39 1a9n n ILE 120 Cb 0.50 -0.08 0.05 0.00 -0.71 0.00 0.00 39.64 39.40 1a9n n ILE 120 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1a9n n LEU 121 N -1.05 2.45 -3.67 1.39 4.77 -1.26 -3.29 117.00 116.33 1a9n n LEU 121 Ca 0.14 0.78 -0.23 0.00 -0.03 0.00 0.00 56.01 56.67 1a9n n LEU 121 Cb 0.60 -1.30 0.05 0.00 -2.33 0.00 0.00 43.42 40.44 1a9n n LEU 121 CO 0.03 -2.36 0.05 0.54 -1.33 0.00 0.00 177.39 174.32 1a9n n ARG 122 N -0.60 -5.83 -4.70 3.23 1.74 -1.26 -0.07 116.66 109.17 1a9n n ARG 122 Ca 0.13 0.69 -0.25 0.00 -0.77 0.00 0.00 57.85 57.65 1a9n n ARG 122 Cb 0.47 -5.49 -0.16 0.00 -1.02 0.00 0.00 32.46 26.26 1a9n n ARG 122 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1a9n s ASN 123 N -4.01 1.93 0.42 0.55 0.01 -1.21 -3.20 114.94 109.45 1a9n s ASN 123 Ca 0.22 -0.32 0.22 0.00 -0.71 0.00 0.00 52.86 52.27 1a9n s ASN 123 Cb -0.10 -0.68 1.19 0.00 0.41 0.00 0.00 41.25 42.07 1a9n s ASN 123 CO 0.79 0.10 1.78 -0.65 -1.51 0.00 0.00 177.10 177.60 1a9n h PRO 124 N 6.54 0.30 -1.02 -0.60 0.11 -1.80 -0.65 132.00 134.89 1a9n h PRO 124 Ca -0.31 -0.02 0.25 0.00 0.11 0.00 0.00 66.00 66.03 1a9n h PRO 124 Cb 1.18 -0.07 -0.09 0.00 0.11 0.00 0.00 31.00 32.13 1a9n h PRO 124 CO 0.48 0.20 0.65 -0.24 -0.21 0.00 0.00 178.00 178.88 1a9n h VAL 125 N 0.31 0.56 -1.04 3.15 3.04 -1.55 -2.39 116.25 118.34 1a9n h VAL 125 Ca 0.59 -0.15 0.27 0.00 -1.01 0.00 0.00 66.70 66.40 1a9n h VAL 125 Cb 1.65 0.10 -0.11 0.00 -2.01 0.00 0.00 31.29 30.92 1a9n h VAL 125 CO -0.25 0.08 0.64 0.74 -1.01 0.00 0.00 177.57 177.77 1a9n h THR 126 N 0.42 0.50 -0.00 3.17 2.02 -1.41 -2.20 112.91 115.41 1a9n h THR 126 Ca 0.57 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.60 1a9n h THR 126 Cb 1.41 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1a9n h THR 126 CO -0.28 0.08 -0.37 0.59 0.37 0.00 0.00 175.52 175.91 1a9n n ASN 127 N -4.75 0.39 -4.73 4.18 3.02 -0.90 -4.80 115.26 107.67 1a9n n ASN 127 Ca 0.27 -0.08 -0.33 0.00 -0.03 0.00 0.00 54.58 54.40 1a9n n ASN 127 Cb 0.85 0.06 0.09 0.00 -0.61 0.00 0.00 39.78 40.17 1a9n n ASN 127 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1a9n s LYS 128 N -2.98 2.14 0.08 3.52 1.02 -0.83 -4.92 119.74 117.77 1a9n s LYS 128 Ca 0.12 1.61 -0.31 0.00 0.02 0.00 0.00 55.97 57.41 1a9n s LYS 128 Cb 0.18 -1.85 -0.07 0.00 -0.52 0.00 0.00 37.83 35.57 1a9n s LYS 128 CO 0.65 -1.80 1.41 -1.59 -0.92 0.00 0.00 175.35 173.10 1a9n s LYS 129 N -4.12 4.30 -0.47 1.68 -2.85 -1.26 -2.97 119.74 114.05 1a9n s LYS 129 Ca 0.71 2.06 0.00 0.00 -1.00 0.00 0.00 55.97 57.74 1a9n s LYS 129 Cb -0.26 -3.35 0.00 0.00 -2.06 0.00 0.00 37.83 32.16 1a9n s LYS 129 CO 0.47 -0.49 0.00 0.72 0.10 0.00 0.00 175.35 176.15 1a9n n HIS 130 N 4.41 -0.18 0.32 1.78 8.25 -1.26 -4.95 115.22 123.58 1a9n n HIS 130 Ca 0.12 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.42 1a9n n HIS 130 Cb 0.43 -1.62 -0.08 0.00 1.12 0.00 0.00 29.99 29.84 1a9n n HIS 130 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1a9n h TYR 131 N 0.00 -1.13 -0.15 4.41 3.20 -1.84 0.14 116.97 121.59 1a9n h TYR 131 Ca -0.12 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.78 1a9n h TYR 131 Cb 0.90 0.42 -0.06 0.00 1.54 0.00 0.00 36.73 39.53 1a9n h TYR 131 CO 0.14 -0.60 -0.51 -0.09 -1.64 0.00 0.00 178.16 175.47 1a9n h ARG 132 N -0.95 -0.50 -0.27 1.82 2.43 -1.89 -1.95 114.38 113.06 1a9n h ARG 132 Ca -0.08 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1a9n h ARG 132 Cb 0.78 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 1a9n h ARG 132 CO 0.03 -0.34 0.10 -0.07 -1.51 0.00 0.00 179.97 178.19 1a9n h LEU 133 N -0.52 0.34 -0.18 3.80 -0.00 -1.94 -2.05 115.31 114.75 1a9n h LEU 133 Ca 0.03 -0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 57.87 1a9n h LEU 133 Cb 0.62 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 41.19 1a9n h LEU 133 CO -0.42 0.32 0.04 0.22 -0.00 0.00 0.00 178.44 178.60 1a9n h TYR 134 N 0.38 0.31 -0.72 1.13 3.20 -0.24 -2.33 116.97 118.70 1a9n h TYR 134 Ca 0.10 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 1a9n h TYR 134 Cb 0.09 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 1a9n h TYR 134 CO 0.00 0.42 0.31 0.28 -1.64 0.00 0.00 178.16 177.53 1a9n h VAL 135 N 0.11 1.25 -0.09 1.81 2.07 -1.10 0.48 116.25 120.78 1a9n h VAL 135 Ca 0.06 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.86 1a9n h VAL 135 Cb 0.27 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1a9n h VAL 135 CO 0.00 0.30 -0.06 0.40 0.02 0.00 0.00 177.57 178.23 1a9n h ILE 136 N 1.03 0.81 -0.33 4.57 2.04 -1.18 0.74 117.51 125.19 1a9n h ILE 136 Ca 0.24 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.94 1a9n h ILE 136 Cb 0.18 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1a9n h ILE 136 CO -0.02 0.00 -0.44 0.22 0.00 0.00 0.00 178.15 177.90 1a9n h TYR 137 N -0.07 1.09 0.00 1.37 5.03 -1.27 -2.40 116.97 120.72 1a9n h TYR 137 Ca 0.06 -0.35 -0.13 0.00 2.58 0.00 0.00 58.73 60.89 1a9n h TYR 137 Cb 0.15 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.20 1a9n h TYR 137 CO -0.18 1.18 -0.61 -0.22 -1.32 0.00 0.00 178.16 177.01 1a9n h LYS 138 N 0.69 0.00 -2.07 1.82 1.63 -0.73 -3.36 116.57 114.55 1a9n h LYS 138 Ca 0.04 0.00 -0.56 0.00 -0.85 0.00 0.00 60.65 59.28 1a9n h LYS 138 Cb 1.04 0.00 -0.40 0.00 -0.60 0.00 0.00 32.23 32.27 1a9n h LYS 138 CO 0.10 0.61 -0.97 0.28 -3.45 0.00 0.00 179.45 176.03 1a9n n VAL 139 N -3.59 0.40 0.31 2.00 0.31 0.24 -4.56 118.33 113.44 1a9n n VAL 139 Ca -0.00 -4.52 0.20 0.00 -0.01 0.00 0.00 64.34 60.00 1a9n n VAL 139 Cb 0.66 -1.62 1.00 0.00 -0.91 0.00 0.00 33.84 32.97 1a9n n VAL 139 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1a9n h PRO 140 N 3.76 0.00 0.00 5.55 0.13 -1.59 -2.72 132.00 137.13 1a9n h PRO 140 Ca 0.11 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.22 1a9n h PRO 140 Cb 0.82 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.94 1a9n h PRO 140 CO 0.58 0.01 -0.07 -0.56 -0.23 0.00 0.00 178.00 177.73 1a9n h GLN 141 N 0.00 0.00 -6.56 0.86 -0.00 -1.87 -3.43 115.11 104.12 1a9n h GLN 141 Ca -0.00 0.00 -0.53 0.00 -0.00 0.00 0.00 58.65 58.12 1a9n h GLN 141 Cb 0.19 0.00 0.03 0.00 -0.00 0.00 0.00 27.48 27.70 1a9n h GLN 141 CO 0.00 0.07 0.83 0.08 -0.00 0.00 0.00 178.83 179.82 1a9n s VAL 142 N -4.00 2.97 -0.12 1.86 1.01 -1.03 -4.43 120.40 116.67 1a9n s VAL 142 Ca -0.02 0.66 0.12 0.00 0.00 0.00 0.00 61.98 62.74 1a9n s VAL 142 Cb 0.12 -3.42 -0.17 0.00 0.00 0.00 0.00 36.38 32.90 1a9n s VAL 142 CO 0.54 0.04 0.30 -2.11 0.00 0.00 0.00 175.10 173.88 1a9n n ARG 143 N 4.19 0.93 -3.77 2.72 0.00 -0.42 -4.85 116.66 115.47 1a9n n ARG 143 Ca 0.13 -0.09 -0.28 0.00 -0.00 0.00 0.00 57.85 57.62 1a9n n ARG 143 Cb 0.40 -1.23 -0.16 0.00 -0.00 0.00 0.00 32.46 31.47 1a9n n ARG 143 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1a9n s VAL 144 N -2.67 0.66 -0.20 8.89 1.01 -0.85 -1.23 120.40 126.01 1a9n s VAL 144 Ca -0.03 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 1a9n s VAL 144 Cb 0.08 -1.10 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 1a9n s VAL 144 CO 0.49 -0.15 -0.10 -0.22 0.00 0.00 0.00 175.10 175.12 1a9n s LEU 145 N 1.80 2.67 -1.39 3.92 2.96 -0.14 -2.00 118.68 126.51 1a9n s LEU 145 Ca -0.01 -0.45 -0.08 0.00 -0.22 0.00 0.00 54.13 53.37 1a9n s LEU 145 Cb -0.17 -1.65 0.03 0.00 0.50 0.00 0.00 46.19 44.90 1a9n s LEU 145 CO -0.08 0.01 1.05 0.47 -1.32 0.00 0.00 176.35 176.49 1a9n n ASP 146 N 4.55 -4.74 -2.55 3.68 8.00 0.28 -2.30 116.55 123.47 1a9n n ASP 146 Ca -0.19 -0.65 -0.20 0.00 0.71 0.00 0.00 54.79 54.45 1a9n n ASP 146 Cb 0.51 -4.59 -0.00 0.00 -0.02 0.00 0.00 41.12 37.02 1a9n n ASP 146 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1a9n n PHE 147 N -4.71 -1.26 -4.21 1.24 3.72 -1.26 -4.99 117.46 105.98 1a9n n PHE 147 Ca -0.06 0.11 -0.20 0.00 -0.05 0.00 0.00 57.45 57.26 1a9n n PHE 147 Cb 0.58 -3.91 -0.16 0.00 -0.94 0.00 0.00 39.48 35.05 1a9n n PHE 147 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1a9n s GLN 148 N -5.20 0.83 0.34 -1.08 -1.52 -0.97 -5.13 119.66 106.93 1a9n s GLN 148 Ca 0.07 -0.15 -0.29 0.00 -1.95 0.00 0.00 55.36 53.05 1a9n s GLN 148 Cb -0.03 -0.81 -0.12 0.00 -0.22 0.00 0.00 33.01 31.83 1a9n s GLN 148 CO 0.09 -0.03 1.46 1.17 -0.25 0.00 0.00 175.29 177.72 1a9n n LYS 149 N 3.82 2.51 -2.78 2.91 4.81 -1.26 -0.97 118.16 127.20 1a9n n LYS 149 Ca -0.23 0.88 -0.43 0.00 -0.87 0.00 0.00 58.31 57.66 1a9n n LYS 149 Cb 0.52 -2.58 -0.04 0.00 0.02 0.00 0.00 35.03 32.95 1a9n n LYS 149 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1a9n s VAL 150 N -0.83 4.51 0.46 3.15 1.01 -0.37 -4.80 120.40 123.54 1a9n s VAL 150 Ca 0.57 1.08 -0.03 0.00 0.00 0.00 0.00 61.98 63.60 1a9n s VAL 150 Cb -0.51 -4.40 -0.02 0.00 0.00 0.00 0.00 36.38 31.45 1a9n s VAL 150 CO 0.60 -0.68 0.73 -0.54 0.00 0.00 0.00 175.10 175.21 1a9n s LYS 151 N 3.67 3.31 0.16 2.72 3.01 -1.26 -4.95 119.74 126.39 1a9n s LYS 151 Ca 0.39 -0.11 -0.13 0.00 -1.01 0.00 0.00 55.97 55.10 1a9n s LYS 151 Cb -0.11 -2.46 0.04 0.00 -1.01 0.00 0.00 37.83 34.29 1a9n s LYS 151 CO 0.22 -0.23 1.71 1.25 0.51 0.00 0.00 175.35 178.81 1a9n h LEU 152 N 0.31 0.72 -1.12 3.17 5.85 -1.99 -2.30 115.31 119.94 1a9n h LEU 152 Ca -0.47 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.16 1a9n h LEU 152 Cb 1.23 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 42.01 1a9n h LEU 152 CO 0.60 0.69 0.60 0.11 -0.34 0.00 0.00 178.44 180.10 1a9n h LYS 153 N 0.70 0.99 -0.37 1.25 1.57 -2.00 0.01 116.57 118.72 1a9n h LYS 153 Ca 0.17 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 1a9n h LYS 153 Cb 0.20 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1a9n h LYS 153 CO -0.01 0.66 -0.21 0.93 -0.57 0.00 0.00 179.45 180.25 1a9n h GLU 154 N 1.02 0.80 -0.39 3.15 5.08 -1.89 -1.72 114.58 120.64 1a9n h GLU 154 Ca 0.41 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1a9n h GLU 154 Cb 0.27 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1a9n h GLU 154 CO -0.17 0.99 0.26 0.00 -1.00 0.00 0.00 179.01 179.09 1a9n h ARG 155 N 0.60 0.51 -0.57 2.33 3.08 -0.66 0.23 114.38 119.90 1a9n h ARG 155 Ca 0.08 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1a9n h ARG 155 Cb 0.76 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.67 1a9n h ARG 155 CO 0.06 0.34 0.37 1.96 -1.07 0.00 0.00 179.97 181.63 1a9n h GLN 156 N 0.53 0.75 -0.59 0.04 4.20 -0.99 0.18 115.11 119.23 1a9n h GLN 156 Ca 0.14 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 1a9n h GLN 156 Cb -0.06 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.52 1a9n h GLN 156 CO -0.03 0.51 0.33 0.93 -0.67 0.00 0.00 178.83 179.89 1a9n h GLU 157 N 0.77 0.81 0.00 1.46 5.08 -0.81 -0.48 114.58 121.42 1a9n h GLU 157 Ca 0.21 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1a9n h GLU 157 Cb -0.07 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.01 1a9n h GLU 157 CO -0.04 0.60 -0.10 0.00 -1.00 0.00 0.00 179.01 178.47 1a9n h ALA 158 N 1.54 0.96 -0.04 3.43 0.00 0.18 -2.92 119.26 122.41 1a9n h ALA 158 Ca 0.21 -0.09 -0.24 0.00 0.00 0.00 0.00 54.91 54.79 1a9n h ALA 158 Cb 0.02 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1a9n h ALA 158 CO -0.04 0.12 -0.92 1.49 0.00 0.00 0.00 179.25 179.90 1a9n h GLU 159 N 0.00 0.69 0.00 0.00 4.57 0.63 -3.33 114.58 117.13 1a9n h GLU 159 Ca -0.00 -0.69 0.00 0.00 -1.18 0.00 0.00 59.36 57.49 1a9n h GLU 159 Cb 0.89 0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 1a9n h GLU 159 CO 0.01 1.28 0.00 1.63 -1.18 0.00 0.00 179.01 180.76 1a9n n LYS 160 N -3.93 0.00 -1.56 1.92 4.01 -0.73 -2.39 118.16 115.50 1a9n n LYS 160 Ca -0.10 0.27 -0.41 0.00 -0.51 0.00 0.00 58.31 57.55 1a9n n LYS 160 Cb 0.82 -1.26 0.01 0.00 -0.51 0.00 0.00 35.03 34.09 1a9n n LYS 160 CO 0.00 0.00 0.00 -0.12 -1.11 0.00 0.00 177.40 176.17 1a9n n MET 161 N -1.30 1.04 -0.19 1.97 0.00 -1.11 -1.78 117.12 115.74 1a9n n MET 161 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 57.70 58.08 1a9n n MET 161 Cb 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 33.22 31.36 1a9n n MET 161 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1a9n n PHE 162 N -0.70 0.00 0.00 1.12 3.72 -1.26 -4.73 117.46 115.61 1a9n n PHE 162 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 1a9n n PHE 162 Cb 0.40 -0.48 0.00 0.00 -0.94 0.00 0.00 39.48 38.45 1a9n n PHE 162 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1a9n n LYS 163 N -2.00 0.00 0.00 -1.08 4.81 -0.74 -4.04 118.16 115.12 1a9n n LYS 163 Ca 0.00 0.36 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 1a9n n LYS 163 Cb 0.00 -1.18 0.00 0.00 0.02 0.00 0.00 35.03 33.87 1a9n n LYS 163 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1a9n n GLY 164 N -0.79 1.77 0.43 3.14 0.00 -1.26 -4.75 105.19 103.72 1a9n n GLY 164 Ca 0.00 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 43.94 1a9n n GLY 164 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a9n h LYS 165 N 0.00 -0.32 -1.00 1.61 1.79 -1.99 0.18 116.57 116.83 1a9n h LYS 165 Ca 0.00 0.02 0.13 0.00 -2.18 0.00 0.00 60.65 58.62 1a9n h LYS 165 Cb 0.00 0.07 -0.09 0.00 -1.58 0.00 0.00 32.23 30.64 1a9n h LYS 165 CO 0.00 -0.21 0.63 -0.09 -1.08 0.00 0.00 179.45 178.69 1a9n h ARG 166 N -0.33 0.92 -0.09 3.15 1.12 -1.96 -0.39 114.38 116.80 1a9n h ARG 166 Ca 0.08 -0.06 -0.09 0.00 -1.11 0.00 0.00 59.98 58.80 1a9n h ARG 166 Cb 0.54 -0.21 -0.01 0.00 -0.01 0.00 0.00 29.97 30.28 1a9n h ARG 166 CO -0.60 0.61 -0.37 0.78 -3.11 0.00 0.00 179.97 177.28 1a9n h GLY 167 N 0.95 0.21 1.94 2.80 0.00 -1.32 -0.80 103.07 106.85 1a9n h GLY 167 Ca 0.51 -0.19 -0.11 0.00 0.00 0.00 0.00 47.33 47.54 1a9n h GLY 167 CO -0.28 0.17 -0.51 0.00 0.00 0.00 0.00 176.54 175.92 1a9n h ALA 168 N 1.46 1.10 0.00 3.60 0.00 0.94 -2.00 119.26 124.37 1a9n h ALA 168 Ca 0.02 -0.47 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 1a9n h ALA 168 Cb 0.73 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1a9n h ALA 168 CO 0.06 0.65 -0.73 0.37 0.00 0.00 0.00 179.25 179.59 1a9n h GLN 169 N 0.05 0.00 -0.31 0.00 5.75 -0.84 -2.96 115.11 116.80 1a9n h GLN 169 Ca -0.00 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.45 1a9n h GLN 169 Cb 0.93 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.47 1a9n h GLN 169 CO 0.07 0.73 0.01 1.25 -2.65 0.00 0.00 178.83 178.24 1a9n h LEU 170 N 0.00 0.53 -0.61 -2.39 5.85 -0.45 -3.03 115.31 115.22 1a9n h LEU 170 Ca -0.01 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.37 1a9n h LEU 170 Cb 1.42 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 1a9n h LEU 170 CO 0.10 0.70 0.21 0.00 -0.34 0.00 0.00 178.44 179.10 1a9n h ALA 171 N 0.85 0.80 0.00 1.25 0.00 -1.44 -2.74 119.26 117.98 1a9n h ALA 171 Ca 0.09 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1a9n h ALA 171 Cb 0.42 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1a9n h ALA 171 CO 0.01 0.46 -0.26 1.57 0.00 0.00 0.00 179.25 181.03 1a9n h LYS 172 N 0.87 0.00 -0.00 0.00 5.09 -1.55 -2.82 116.57 118.16 1a9n h LYS 172 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.94 1a9n h LYS 172 Cb 0.27 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.60 1a9n h LYS 172 CO -0.01 0.26 -0.36 -0.25 -2.09 0.00 0.00 179.45 177.01 1a9n n ASP 173 N -3.50 0.71 -1.05 7.07 8.00 -1.14 -4.07 116.55 122.56 1a9n n ASP 173 Ca -0.00 -0.53 0.08 0.00 0.71 0.00 0.00 54.79 55.05 1a9n n ASP 173 Cb 0.42 0.16 0.24 0.00 -0.02 0.00 0.00 41.12 41.93 1a9n n ASP 173 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a9n n ILE 174 N -1.10 0.86 -0.45 0.53 3.06 -1.05 -5.10 119.36 116.13 1a9n n ILE 174 Ca 0.09 -0.76 0.00 0.00 -2.50 0.00 0.00 62.75 59.58 1a9n n ILE 174 Cb 0.34 0.29 0.00 0.00 0.54 0.00 0.00 39.64 40.80 1a9n n ILE 174 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05