#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x89 s ASP 6 N 0.00 0.82 0.00 6.43 1.01 -1.26 -5.17 116.67 118.51 1x89 s ASP 6 Ca 0.00 0.06 0.04 0.00 0.71 0.00 0.00 52.55 53.36 1x89 s ASP 6 Cb 0.00 -0.13 -0.01 0.00 1.01 0.00 0.00 42.92 43.79 1x89 s ASP 6 CO 0.00 -0.21 -0.11 -0.76 0.21 0.00 0.00 175.17 174.30 1x89 s LEU 7 N 1.83 2.06 0.25 1.23 1.43 -1.26 -5.11 118.68 119.11 1x89 s LEU 7 Ca 0.01 -0.27 -0.31 0.00 -1.03 0.00 0.00 54.13 52.53 1x89 s LEU 7 Cb -0.12 -0.55 -0.11 0.00 0.03 0.00 0.00 46.19 45.44 1x89 s LEU 7 CO -0.03 0.10 1.63 -0.63 0.23 0.00 0.00 176.35 177.64 1x89 s ILE 8 N -0.43 2.16 0.57 -0.59 1.01 -1.26 -4.92 121.20 117.74 1x89 s ILE 8 Ca 0.03 0.12 -0.19 0.00 0.00 0.00 0.00 60.65 60.61 1x89 s ILE 8 Cb -0.05 -3.08 -0.05 0.00 0.01 0.00 0.00 42.46 39.29 1x89 s ILE 8 CO -0.00 0.01 1.16 -2.16 0.00 0.00 0.00 174.94 173.96 1x89 s PRO 9 N 0.28 3.17 0.44 2.79 0.04 -1.26 -4.87 135.00 135.60 1x89 s PRO 9 Ca 0.68 1.70 -0.25 0.00 0.04 0.00 0.00 61.00 63.17 1x89 s PRO 9 Cb -0.48 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.01 1x89 s PRO 9 CO 0.40 -1.02 1.36 0.00 0.04 0.00 0.00 177.00 177.78 1x89 s ALA 10 N -1.71 3.18 0.57 8.56 0.00 -1.26 -4.97 121.76 126.13 1x89 s ALA 10 Ca 0.75 1.33 -0.12 0.00 0.00 0.00 0.00 51.96 53.92 1x89 s ALA 10 Cb -0.27 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.27 1x89 s ALA 10 CO 0.30 -1.04 0.99 -1.25 0.00 0.00 0.00 175.76 174.76 1x89 s PRO 11 N -2.44 3.68 0.38 0.00 0.04 -1.26 -5.00 135.00 130.40 1x89 s PRO 11 Ca 0.61 0.73 -0.27 0.00 0.04 0.00 0.00 61.00 62.11 1x89 s PRO 11 Cb -0.40 -2.13 -0.10 0.00 0.04 0.00 0.00 34.50 31.91 1x89 s PRO 11 CO 0.51 -0.45 1.35 -1.25 0.04 0.00 0.00 177.00 177.20 1x89 s PRO 12 N -4.83 4.08 0.62 0.56 0.04 -1.26 -4.84 135.00 129.37 1x89 s PRO 12 Ca 0.55 2.27 0.30 0.00 0.04 0.00 0.00 61.00 64.16 1x89 s PRO 12 Cb -0.11 -2.88 1.62 0.00 0.04 0.00 0.00 34.50 33.18 1x89 s PRO 12 CO 0.47 -0.44 1.98 -0.07 0.04 0.00 0.00 177.00 178.98 1x89 h LEU 13 N 2.91 0.00 -2.44 -3.56 -0.00 -1.94 0.17 115.31 110.44 1x89 h LEU 13 Ca -0.50 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.39 1x89 h LEU 13 Cb 1.24 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.90 1x89 h LEU 13 CO 0.64 0.00 0.02 0.77 -0.00 0.00 0.00 178.44 179.87 1x89 h SER 14 N 0.00 0.00 -0.44 -0.43 4.64 -2.03 0.10 113.55 115.39 1x89 h SER 14 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1x89 h SER 14 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1x89 h SER 14 CO -0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1x89 n LYS 15 N -3.84 2.20 -3.95 4.77 5.02 0.59 -4.79 118.16 118.16 1x89 n LYS 15 Ca -0.02 -1.85 -0.33 0.00 -2.02 0.00 0.00 58.31 54.09 1x89 n LYS 15 Cb 0.11 -1.43 -0.14 0.00 -0.02 0.00 0.00 35.03 33.55 1x89 n LYS 15 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1x89 s VAL 16 N -1.42 2.63 0.86 -0.18 1.01 0.35 -4.98 120.40 118.67 1x89 s VAL 16 Ca 0.36 -2.04 -0.11 0.00 0.00 0.00 0.00 61.98 60.19 1x89 s VAL 16 Cb 0.19 -2.79 0.11 0.00 0.00 0.00 0.00 36.38 33.90 1x89 s VAL 16 CO 0.26 -0.48 1.15 -2.84 0.00 0.00 0.00 175.10 173.20 1x89 s PRO 17 N 1.04 1.42 -0.12 2.72 0.02 -1.26 -4.99 135.00 133.83 1x89 s PRO 17 Ca 0.05 1.54 0.02 0.00 0.02 0.00 0.00 61.00 62.63 1x89 s PRO 17 Cb -0.20 -1.77 -0.00 0.00 0.02 0.00 0.00 34.50 32.54 1x89 s PRO 17 CO -0.06 -2.33 -0.19 -1.17 -0.33 0.00 0.00 177.00 172.92 1x89 s LEU 18 N -6.21 2.35 0.05 -5.54 2.96 -1.26 -4.09 118.68 106.94 1x89 s LEU 18 Ca 0.68 -0.47 -0.32 0.00 -0.22 0.00 0.00 54.13 53.79 1x89 s LEU 18 Cb -0.23 -1.50 -0.11 0.00 0.50 0.00 0.00 46.19 44.85 1x89 s LEU 18 CO 0.55 0.15 1.85 1.67 -1.32 0.00 0.00 176.35 179.25 1x89 n GLN 19 N 3.61 2.57 -1.83 1.98 -0.06 -0.04 -4.92 117.38 118.68 1x89 n GLN 19 Ca -0.19 0.94 -0.41 0.00 -2.00 0.00 0.00 57.00 55.34 1x89 n GLN 19 Cb 0.53 -2.82 -0.01 0.00 -4.06 0.00 0.00 30.24 23.89 1x89 n GLN 19 CO 0.00 0.00 0.00 -1.14 -0.20 0.00 0.00 177.06 175.72 1x89 s GLN 20 N 3.22 4.14 -1.30 3.69 0.74 -1.26 -3.66 119.66 125.23 1x89 s GLN 20 Ca 0.86 2.53 -0.15 0.00 0.05 0.00 0.00 55.36 58.65 1x89 s GLN 20 Cb -0.55 -2.99 0.01 0.00 1.10 0.00 0.00 33.01 30.58 1x89 s GLN 20 CO 0.42 -0.51 0.54 -1.71 -0.55 0.00 0.00 175.29 173.48 1x89 n ASN 21 N 0.74 -2.60 -4.69 6.67 5.15 -1.26 -4.82 115.26 114.44 1x89 n ASN 21 Ca 0.02 -1.12 -0.43 0.00 -0.60 0.00 0.00 54.58 52.45 1x89 n ASN 21 Cb 0.39 -2.62 -0.01 0.00 -0.53 0.00 0.00 39.78 37.02 1x89 n ASN 21 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 1x89 n PHE 22 N -4.52 2.20 -3.88 1.20 -0.00 -1.24 -4.97 117.46 106.25 1x89 n PHE 22 Ca -0.20 0.56 -0.34 0.00 -0.00 0.00 0.00 57.45 57.47 1x89 n PHE 22 Cb 0.63 -2.40 -0.13 0.00 -0.00 0.00 0.00 39.48 37.57 1x89 n PHE 22 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 1x89 s GLN 23 N -1.79 1.82 0.34 -4.13 -0.21 -1.26 -4.84 119.66 109.58 1x89 s GLN 23 Ca 0.56 -1.82 0.04 0.00 0.02 0.00 0.00 55.36 54.16 1x89 s GLN 23 Cb -0.58 -3.42 0.67 0.00 1.00 0.00 0.00 33.01 30.68 1x89 s GLN 23 CO 0.62 -1.00 1.92 0.38 -2.12 0.00 0.00 175.29 175.09 1x89 h ASP 24 N 7.88 0.76 -0.38 5.90 2.03 -1.99 -2.32 116.42 128.29 1x89 h ASP 24 Ca -0.10 0.01 -0.13 0.00 -0.73 0.00 0.00 57.03 56.08 1x89 h ASP 24 Cb 1.04 -0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 39.38 1x89 h ASP 24 CO 0.62 0.47 -0.24 -0.55 -1.03 0.00 0.00 179.24 178.51 1x89 h ASN 25 N 0.85 0.91 0.74 4.15 -1.07 -1.99 -3.00 115.58 116.17 1x89 h ASN 25 Ca 0.37 -0.35 -0.11 0.00 0.07 0.00 0.00 56.30 56.28 1x89 h ASN 25 Cb 0.32 -0.25 -0.02 0.00 -2.07 0.00 0.00 38.32 36.30 1x89 h ASN 25 CO -0.14 1.10 -0.52 1.56 0.07 0.00 0.00 177.43 179.50 1x89 h GLN 26 N 0.76 0.00 0.00 4.14 1.08 -1.86 -3.04 115.11 116.19 1x89 h GLN 26 Ca 0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1x89 h GLN 26 Cb 0.79 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 1x89 h GLN 26 CO 0.07 0.52 0.00 0.35 -0.95 0.00 0.00 178.83 178.82 1x89 h PHE 27 N 0.00 0.00 -3.54 2.96 3.04 -1.33 -3.45 116.94 114.62 1x89 h PHE 27 Ca -0.01 0.00 -0.46 0.00 3.98 0.00 0.00 57.97 61.48 1x89 h PHE 27 Cb 1.04 0.00 0.21 0.00 2.56 0.00 0.00 35.95 39.76 1x89 h PHE 27 CO 0.00 0.00 0.07 -0.65 -2.02 0.00 0.00 178.31 175.71 1x89 s GLN 28 N -3.17 -0.43 0.04 1.11 -0.21 -1.15 -4.88 119.66 110.97 1x89 s GLN 28 Ca 0.09 1.07 0.00 0.00 0.02 0.00 0.00 55.36 56.54 1x89 s GLN 28 Cb 0.11 -1.59 0.00 0.00 1.00 0.00 0.00 33.01 32.52 1x89 s GLN 28 CO 0.58 -3.46 0.00 0.41 -2.12 0.00 0.00 175.29 170.69 1x89 n GLY 29 N 0.71 -1.83 3.79 3.09 0.00 0.62 -4.92 105.19 106.65 1x89 n GLY 29 Ca 0.06 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.68 1x89 n GLY 29 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x89 s LYS 30 N 0.00 4.19 -0.03 1.61 2.20 -1.26 -1.28 119.74 125.16 1x89 s LYS 30 Ca 0.00 0.59 0.04 0.00 -0.36 0.00 0.00 55.97 56.23 1x89 s LYS 30 Cb 0.00 -3.30 -0.00 0.00 -1.51 0.00 0.00 37.83 33.01 1x89 s LYS 30 CO 0.00 0.48 -0.14 -1.58 -0.36 0.00 0.00 175.35 173.75 1x89 s TRP 31 N -0.48 1.39 -0.04 4.03 0.52 0.05 -4.72 118.94 119.70 1x89 s TRP 31 Ca 0.27 -0.37 -0.13 0.00 0.02 0.00 0.00 56.10 55.90 1x89 s TRP 31 Cb -0.17 -0.95 -0.05 0.00 -1.15 0.00 0.00 33.47 31.15 1x89 s TRP 31 CO 0.15 -0.12 0.33 0.71 0.02 0.00 0.00 176.95 178.04 1x89 s TYR 32 N 0.03 3.68 -0.91 -1.98 2.02 0.67 -0.59 117.35 120.28 1x89 s TYR 32 Ca -0.02 0.85 -0.22 0.00 -0.37 0.00 0.00 57.07 57.31 1x89 s TYR 32 Cb -0.10 -2.20 0.07 0.00 -0.40 0.00 0.00 41.96 39.34 1x89 s TYR 32 CO 0.01 0.65 1.27 0.08 -1.57 0.00 0.00 175.55 175.99 1x89 s VAL 33 N -0.99 4.18 -0.45 0.71 1.01 -0.51 -0.99 120.40 123.36 1x89 s VAL 33 Ca 0.21 -0.78 0.23 0.00 0.00 0.00 0.00 61.98 61.65 1x89 s VAL 33 Cb -0.15 -4.91 0.20 0.00 0.00 0.00 0.00 36.38 31.52 1x89 s VAL 33 CO 0.10 -1.74 1.44 -0.37 0.00 0.00 0.00 175.10 174.53 1x89 h VAL 34 N 6.30 0.00 -3.62 2.92 -1.51 -1.29 -3.41 116.25 115.64 1x89 h VAL 34 Ca 0.05 -0.86 -0.14 0.00 -1.23 0.00 0.00 66.70 64.52 1x89 h VAL 34 Cb 1.03 1.67 -0.19 0.00 -2.13 0.00 0.00 31.29 31.66 1x89 h VAL 34 CO 1.28 0.00 -0.50 -0.83 -1.23 0.00 0.00 177.57 176.29 1x89 s GLY 35 N -4.10 0.09 -0.14 5.19 0.00 -0.95 -3.83 107.32 103.59 1x89 s GLY 35 Ca 0.05 -0.29 -0.08 0.00 0.00 0.00 0.00 44.72 44.40 1x89 s GLY 35 CO 0.70 -0.43 0.33 -2.27 0.00 0.00 0.00 173.10 171.43 1x89 s LEU 36 N -1.67 0.25 0.02 0.66 2.96 -0.19 -0.31 118.68 120.40 1x89 s LEU 36 Ca -0.11 0.70 -0.05 0.00 -0.22 0.00 0.00 54.13 54.44 1x89 s LEU 36 Cb -0.05 1.05 -0.01 0.00 0.50 0.00 0.00 46.19 47.68 1x89 s LEU 36 CO -0.01 -0.17 0.10 0.00 -1.32 0.00 0.00 176.35 174.95 1x89 s ALA 37 N 1.15 -0.15 0.00 5.97 0.00 -0.33 -0.69 121.76 127.71 1x89 s ALA 37 Ca -0.08 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1x89 s ALA 37 Cb -0.08 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.21 1x89 s ALA 37 CO -0.09 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.83 1x89 n GLY 38 N 1.17 0.43 0.08 0.00 0.00 -0.88 0.43 105.19 106.42 1x89 n GLY 38 Ca -0.21 -0.90 0.12 0.00 0.00 0.00 0.00 46.02 45.02 1x89 n GLY 38 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x89 n ASN 39 N 0.00 0.51 -0.75 1.61 6.94 -0.74 -2.62 115.26 120.22 1x89 n ASN 39 Ca 0.00 0.58 0.07 0.00 -0.02 0.00 0.00 54.58 55.21 1x89 n ASN 39 Cb 0.00 -0.71 0.22 0.00 -2.36 0.00 0.00 39.78 36.94 1x89 n ASN 39 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1x89 n ALA 40 N -1.69 3.04 -2.76 -2.53 0.00 -1.26 -4.70 120.51 110.60 1x89 n ALA 40 Ca 0.05 -2.52 -0.34 0.00 0.00 0.00 0.00 53.44 50.63 1x89 n ALA 40 Cb 0.32 -0.64 -0.12 0.00 0.00 0.00 0.00 19.45 19.01 1x89 n ALA 40 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1x89 s ILE 41 N -2.91 3.60 -0.01 0.00 -1.09 -1.08 -5.10 121.20 114.61 1x89 s ILE 41 Ca 0.40 -0.49 0.01 0.00 -2.23 0.00 0.00 60.65 58.34 1x89 s ILE 41 Cb 0.34 -2.50 0.00 0.00 -1.58 0.00 0.00 42.46 38.72 1x89 s ILE 41 CO 0.06 0.56 -0.04 -0.76 -1.23 0.00 0.00 174.94 173.53 1x89 s LEU 42 N -0.29 1.78 0.42 2.97 2.01 -1.26 -4.39 118.68 119.92 1x89 s LEU 42 Ca 0.04 -0.08 -0.24 0.00 0.01 0.00 0.00 54.13 53.86 1x89 s LEU 42 Cb -0.13 -0.26 -0.08 0.00 0.01 0.00 0.00 46.19 45.73 1x89 s LEU 42 CO 0.02 0.02 1.17 -0.60 1.01 0.00 0.00 176.35 177.97 1x89 s ARG 43 N 0.20 3.96 -0.08 1.70 3.52 -0.41 -5.01 118.95 122.84 1x89 s ARG 43 Ca -0.02 1.83 0.01 0.00 -0.13 0.00 0.00 55.73 57.41 1x89 s ARG 43 Cb -0.05 -2.59 0.02 0.00 -1.56 0.00 0.00 34.95 30.77 1x89 s ARG 43 CO -0.00 -0.40 -0.07 -1.21 -0.81 0.00 0.00 175.30 172.80 1x89 s GLU 44 N -2.43 1.32 0.08 5.12 0.41 -1.26 -5.05 118.70 116.89 1x89 s GLU 44 Ca 0.59 -0.23 -0.28 0.00 -0.41 0.00 0.00 54.97 54.65 1x89 s GLU 44 Cb -0.30 -1.29 -0.12 0.00 -1.78 0.00 0.00 34.13 30.64 1x89 s GLU 44 CO 0.38 -0.14 1.44 -0.44 -0.49 0.00 0.00 175.26 176.01 1x89 h ASP 45 N 7.58 -1.29 -2.88 -0.19 3.45 -2.01 -3.32 116.42 117.75 1x89 h ASP 45 Ca -0.31 0.14 -0.63 0.00 0.43 0.00 0.00 57.03 56.66 1x89 h ASP 45 Cb 1.15 0.48 -0.06 0.00 -0.56 0.00 0.00 39.33 40.34 1x89 h ASP 45 CO 0.43 -0.44 -0.30 -0.75 -1.57 0.00 0.00 179.24 176.60 1x89 s LYS 46 N -5.20 3.75 -0.23 3.56 2.36 -1.26 -4.31 119.74 118.40 1x89 s LYS 46 Ca -0.13 0.21 -0.00 0.00 -2.55 0.00 0.00 55.97 53.50 1x89 s LYS 46 Cb 0.05 -3.21 0.00 0.00 -1.05 0.00 0.00 37.83 33.62 1x89 s LYS 46 CO 0.49 0.72 0.19 -3.47 1.55 0.00 0.00 175.35 174.83 1x89 n ASP 47 N 1.90 -2.14 -4.76 1.43 2.03 -1.26 -4.98 116.55 108.76 1x89 n ASP 47 Ca -0.16 -0.11 -0.39 0.00 0.52 0.00 0.00 54.79 54.64 1x89 n ASP 47 Cb 0.53 -1.36 0.01 0.00 -0.72 0.00 0.00 41.12 39.59 1x89 n ASP 47 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1x89 s PRO 48 N -4.42 3.72 0.07 -0.67 0.04 -1.25 -4.82 135.00 127.67 1x89 s PRO 48 Ca 0.02 2.28 -0.37 0.00 0.04 0.00 0.00 61.00 62.97 1x89 s PRO 48 Cb -0.01 -2.63 -0.18 0.00 0.04 0.00 0.00 34.50 31.73 1x89 s PRO 48 CO 0.14 -0.74 1.24 0.94 0.04 0.00 0.00 177.00 178.61 1x89 n GLN 49 N -0.20 0.81 -3.58 4.56 -0.06 -1.26 -4.85 117.38 112.81 1x89 n GLN 49 Ca 0.05 0.29 -0.26 0.00 -2.00 0.00 0.00 57.00 55.09 1x89 n GLN 49 Cb 0.43 -1.88 -0.02 0.00 -4.06 0.00 0.00 30.24 24.71 1x89 n GLN 49 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 1x89 s LYS 50 N 0.26 3.52 0.42 3.69 1.02 -1.26 -1.66 119.74 125.72 1x89 s LYS 50 Ca 0.85 -0.34 -0.25 0.00 0.02 0.00 0.00 55.97 56.25 1x89 s LYS 50 Cb -1.03 -2.76 -0.08 0.00 -0.52 0.00 0.00 37.83 33.43 1x89 s LYS 50 CO 0.50 0.30 1.23 1.41 -0.92 0.00 0.00 175.35 177.88 1x89 s MET 51 N -3.73 3.94 0.33 1.68 -2.45 -0.31 -4.66 119.30 114.10 1x89 s MET 51 Ca 0.39 1.99 0.03 0.00 -1.25 0.00 0.00 55.69 56.85 1x89 s MET 51 Cb -0.10 -2.66 -0.05 0.00 1.25 0.00 0.00 34.83 33.27 1x89 s MET 51 CO 0.31 -0.46 0.10 1.52 1.05 0.00 0.00 175.02 177.54 1x89 s TYR 52 N -1.35 1.77 0.08 4.11 1.13 -1.26 -4.65 117.35 117.18 1x89 s TYR 52 Ca 0.58 -1.16 0.02 0.00 -1.41 0.00 0.00 57.07 55.11 1x89 s TYR 52 Cb -0.34 -1.11 -0.04 0.00 -1.10 0.00 0.00 41.96 39.38 1x89 s TYR 52 CO 0.43 -0.23 -0.08 0.00 -2.51 0.00 0.00 175.55 173.16 1x89 s ALA 53 N -3.41 0.91 -0.03 9.51 0.00 -0.81 -1.42 121.76 126.51 1x89 s ALA 53 Ca 0.33 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 51.16 1x89 s ALA 53 Cb 0.06 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.28 1x89 s ALA 53 CO 0.15 -0.12 -0.07 0.99 0.00 0.00 0.00 175.76 176.71 1x89 s THR 54 N -2.70 0.67 -0.11 0.00 2.01 0.24 -0.88 115.64 114.87 1x89 s THR 54 Ca 0.04 -0.27 0.01 0.00 0.31 0.00 0.00 61.69 61.79 1x89 s THR 54 Cb -0.01 -0.62 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1x89 s THR 54 CO -0.02 0.22 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.35 1x89 s ILE 55 N 0.39 2.88 -0.21 1.82 1.01 0.11 -0.77 121.20 126.42 1x89 s ILE 55 Ca -0.06 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 1x89 s ILE 55 Cb -0.10 -2.17 0.01 0.00 0.01 0.00 0.00 42.46 40.21 1x89 s ILE 55 CO 0.00 0.54 -0.11 -0.31 0.00 0.00 0.00 174.94 175.07 1x89 s TYR 56 N 0.10 2.92 -0.19 3.97 2.02 -0.41 -0.81 117.35 124.95 1x89 s TYR 56 Ca -0.07 -1.40 -0.01 0.00 -0.37 0.00 0.00 57.07 55.22 1x89 s TYR 56 Cb -0.15 -2.02 0.00 0.00 -0.40 0.00 0.00 41.96 39.40 1x89 s TYR 56 CO 0.05 -0.70 -0.11 -1.21 -1.57 0.00 0.00 175.55 172.00 1x89 s GLU 57 N 1.36 3.24 -0.09 -0.62 2.02 0.24 -0.28 118.70 124.58 1x89 s GLU 57 Ca 0.04 -0.71 -0.30 0.00 0.02 0.00 0.00 54.97 54.02 1x89 s GLU 57 Cb -0.14 -2.79 -0.03 0.00 0.10 0.00 0.00 34.13 31.27 1x89 s GLU 57 CO -0.07 -0.13 1.20 -1.17 0.02 0.00 0.00 175.26 175.11 1x89 s LEU 58 N 1.22 4.25 0.42 1.80 0.20 -1.26 -0.48 118.68 124.83 1x89 s LEU 58 Ca 0.02 1.76 0.03 0.00 0.69 0.00 0.00 54.13 56.64 1x89 s LEU 58 Cb -0.14 -3.55 0.00 0.00 -0.43 0.00 0.00 46.19 42.07 1x89 s LEU 58 CO -0.05 -0.63 0.61 -0.54 -0.29 0.00 0.00 176.35 175.45 1x89 s LYS 59 N 2.55 2.98 0.29 1.98 1.02 -0.12 -4.95 119.74 123.48 1x89 s LYS 59 Ca 0.55 -0.79 -0.02 0.00 0.02 0.00 0.00 55.97 55.72 1x89 s LYS 59 Cb -0.23 -2.66 0.41 0.00 -0.52 0.00 0.00 37.83 34.83 1x89 s LYS 59 CO 0.20 -0.23 1.92 1.49 -0.92 0.00 0.00 175.35 177.81 1x89 h GLU 60 N 0.54 1.05 0.00 1.68 4.81 -1.96 -0.59 114.58 120.11 1x89 h GLU 60 Ca -0.45 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1x89 h GLU 60 Cb 1.26 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.43 1x89 h GLU 60 CO 0.54 0.75 0.00 -0.40 -0.73 0.00 0.00 179.01 179.16 1x89 n ASP 61 N -4.37 0.00 0.00 1.04 5.75 -1.26 -4.86 116.55 112.85 1x89 n ASP 61 Ca 0.08 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 53.91 1x89 n ASP 61 Cb 0.08 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.17 1x89 n ASP 61 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1x89 n LYS 62 N -0.77 0.00 -2.32 0.11 4.76 -0.23 -5.04 118.16 114.67 1x89 n LYS 62 Ca 0.09 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.28 1x89 n LYS 62 Cb 0.04 -2.19 0.07 0.00 -1.84 0.00 0.00 35.03 31.11 1x89 n LYS 62 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1x89 s SER 63 N -3.02 4.84 -0.09 4.39 1.04 -1.26 -4.63 113.70 114.97 1x89 s SER 63 Ca 0.00 0.29 -0.01 0.00 0.48 0.00 0.00 55.95 56.71 1x89 s SER 63 Cb 0.00 -0.96 -0.03 0.00 0.10 0.00 0.00 66.02 65.13 1x89 s SER 63 CO 0.00 -1.54 -0.02 -0.31 0.98 0.00 0.00 173.24 172.34 1x89 s TYR 64 N -3.15 3.08 -0.14 5.02 1.51 -0.15 -0.95 117.35 122.58 1x89 s TYR 64 Ca 0.60 0.08 -0.21 0.00 -1.01 0.00 0.00 57.07 56.53 1x89 s TYR 64 Cb -0.10 -1.79 -0.03 0.00 -0.11 0.00 0.00 41.96 39.92 1x89 s TYR 64 CO 0.43 0.36 0.60 -0.80 -1.11 0.00 0.00 175.55 175.04 1x89 s ASN 65 N -0.68 6.77 -0.08 2.29 0.01 0.36 -0.85 114.94 122.76 1x89 s ASN 65 Ca 0.11 0.93 0.04 0.00 -0.71 0.00 0.00 52.86 53.22 1x89 s ASN 65 Cb -0.12 -2.35 0.00 0.00 0.41 0.00 0.00 41.25 39.20 1x89 s ASN 65 CO 0.02 -0.14 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.56 1x89 s VAL 66 N 1.20 1.82 -0.11 1.60 1.01 0.35 -0.59 120.40 125.68 1x89 s VAL 66 Ca 0.30 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1x89 s VAL 66 Cb -0.16 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.66 1x89 s VAL 66 CO 0.13 0.51 -0.11 -0.89 0.00 0.00 0.00 175.10 174.73 1x89 s THR 67 N 0.29 1.26 -0.10 3.92 2.01 0.01 -0.01 115.64 123.03 1x89 s THR 67 Ca -0.14 -0.46 -0.03 0.00 0.31 0.00 0.00 61.69 61.37 1x89 s THR 67 Cb -0.16 -1.20 -0.03 0.00 0.01 0.00 0.00 72.50 71.11 1x89 s THR 67 CO 0.06 0.40 0.01 -0.44 -0.69 0.00 0.00 174.62 173.97 1x89 s SER 68 N 1.35 5.33 -0.06 3.53 0.01 0.10 0.05 113.70 124.00 1x89 s SER 68 Ca -0.00 0.15 0.03 0.00 1.31 0.00 0.00 55.95 57.44 1x89 s SER 68 Cb -0.14 -1.56 0.01 0.00 0.21 0.00 0.00 66.02 64.54 1x89 s SER 68 CO -0.06 0.36 -0.14 0.54 0.41 0.00 0.00 173.24 174.36 1x89 s VAL 69 N -0.78 1.23 0.12 3.43 0.11 -0.06 -1.45 120.40 123.00 1x89 s VAL 69 Ca 0.12 -0.55 0.05 0.00 -2.93 0.00 0.00 61.98 58.67 1x89 s VAL 69 Cb -0.12 -1.10 -0.04 0.00 -1.53 0.00 0.00 36.38 33.60 1x89 s VAL 69 CO 0.02 0.37 -0.12 -0.76 -3.33 0.00 0.00 175.10 171.28 1x89 s LEU 70 N 0.46 2.44 -0.36 2.54 1.02 -0.39 -1.92 118.68 122.48 1x89 s LEU 70 Ca -0.12 -0.86 -0.14 0.00 0.02 0.00 0.00 54.13 53.04 1x89 s LEU 70 Cb -0.14 -0.44 -0.01 0.00 0.02 0.00 0.00 46.19 45.62 1x89 s LEU 70 CO 0.03 -0.22 0.26 0.12 0.02 0.00 0.00 176.35 176.56 1x89 s PHE 71 N -2.52 3.23 -0.10 0.29 5.99 -1.26 -0.39 117.98 123.21 1x89 s PHE 71 Ca 0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 56.93 56.65 1x89 s PHE 71 Cb -0.03 -2.51 0.05 0.00 0.00 0.00 0.00 43.02 40.53 1x89 s PHE 71 CO 0.02 -0.43 0.23 0.50 -0.00 0.00 0.00 175.22 175.54 1x89 s ARG 72 N 1.71 0.18 -1.34 10.12 3.52 -0.27 -4.91 118.95 127.96 1x89 s ARG 72 Ca 0.06 0.53 -0.00 0.00 -0.13 0.00 0.00 55.73 56.19 1x89 s ARG 72 Cb -0.18 -0.13 0.00 0.00 -1.56 0.00 0.00 34.95 33.09 1x89 s ARG 72 CO 0.10 -0.18 0.60 1.63 -0.81 0.00 0.00 175.30 176.65 1x89 n LYS 73 N 4.38 -4.37 -0.82 5.12 5.02 -1.26 -1.73 118.16 124.50 1x89 n LYS 73 Ca -0.23 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 1x89 n LYS 73 Cb 0.52 -4.96 0.00 0.00 -0.02 0.00 0.00 35.03 30.57 1x89 n LYS 73 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1x89 n LYS 74 N -4.31 -0.98 -4.46 1.97 5.02 -1.26 -4.98 118.16 109.16 1x89 n LYS 74 Ca -0.30 0.25 -0.24 0.00 -2.02 0.00 0.00 58.31 55.99 1x89 n LYS 74 Cb 0.68 -4.50 -0.10 0.00 -0.02 0.00 0.00 35.03 31.08 1x89 n LYS 74 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1x89 s LYS 75 N -1.35 1.68 -0.30 1.97 1.02 -0.71 -5.11 119.74 116.95 1x89 s LYS 75 Ca 0.00 -1.72 -0.22 0.00 0.02 0.00 0.00 55.97 54.05 1x89 s LYS 75 Cb 0.00 -1.80 -0.01 0.00 -0.52 0.00 0.00 37.83 35.51 1x89 s LYS 75 CO 0.00 0.34 0.71 0.00 -0.92 0.00 0.00 175.35 175.48 1x89 s ASP 77 N 1.60 5.75 -0.11 0.00 1.01 0.47 -4.96 116.67 120.44 1x89 s ASP 77 Ca 0.29 0.21 0.03 0.00 0.71 0.00 0.00 52.55 53.79 1x89 s ASP 77 Cb -0.15 -1.86 -0.00 0.00 1.01 0.00 0.00 42.92 41.92 1x89 s ASP 77 CO 0.12 0.30 -0.21 -0.31 0.21 0.00 0.00 175.17 175.27 1x89 s TYR 78 N -0.36 2.62 -0.13 4.23 2.02 -1.26 -1.26 117.35 123.21 1x89 s TYR 78 Ca 0.09 -0.93 0.03 0.00 -0.37 0.00 0.00 57.07 55.89 1x89 s TYR 78 Cb -0.12 -1.74 0.01 0.00 -0.40 0.00 0.00 41.96 39.71 1x89 s TYR 78 CO 0.02 -0.36 -0.21 -1.58 -1.57 0.00 0.00 175.55 171.85 1x89 s TRP 79 N 0.32 2.55 -0.13 2.71 0.52 -0.53 -4.98 118.94 119.40 1x89 s TRP 79 Ca -0.16 -1.23 0.02 0.00 0.02 0.00 0.00 56.10 54.75 1x89 s TRP 79 Cb -0.17 -1.74 0.00 0.00 -1.15 0.00 0.00 33.47 30.41 1x89 s TRP 79 CO 0.08 -0.55 -0.20 0.42 0.02 0.00 0.00 176.95 176.72 1x89 s ILE 80 N 0.73 2.30 0.30 2.03 1.01 -1.26 -0.73 121.20 125.59 1x89 s ILE 80 Ca -0.10 -0.91 0.06 0.00 0.00 0.00 0.00 60.65 59.70 1x89 s ILE 80 Cb -0.16 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 1x89 s ILE 80 CO 0.00 0.54 0.24 -0.13 0.00 0.00 0.00 174.94 175.60 1x89 s ARG 81 N 0.65 1.64 -0.10 2.79 1.81 0.99 -4.98 118.95 121.75 1x89 s ARG 81 Ca -0.10 -1.94 0.03 0.00 -1.72 0.00 0.00 55.73 52.00 1x89 s ARG 81 Cb -0.16 0.30 0.01 0.00 -0.45 0.00 0.00 34.95 34.65 1x89 s ARG 81 CO 0.02 -0.59 -0.19 0.99 -0.68 0.00 0.00 175.30 174.85 1x89 s THR 82 N -3.59 1.73 -0.27 0.02 2.01 -1.26 -0.49 115.64 113.79 1x89 s THR 82 Ca 0.40 -0.81 -0.07 0.00 0.31 0.00 0.00 61.69 61.52 1x89 s THR 82 Cb 0.03 -1.53 -0.01 0.00 0.01 0.00 0.00 72.50 71.01 1x89 s THR 82 CO 0.24 0.49 0.06 -0.36 -0.69 0.00 0.00 174.62 174.36 1x89 s PHE 83 N 0.59 3.10 -0.09 4.92 2.99 -0.02 0.58 117.98 130.05 1x89 s PHE 83 Ca -0.14 -0.74 -0.11 0.00 0.00 0.00 0.00 56.93 55.93 1x89 s PHE 83 Cb -0.17 -2.23 -0.05 0.00 0.00 0.00 0.00 43.02 40.57 1x89 s PHE 83 CO 0.05 -0.49 0.26 0.08 -0.00 0.00 0.00 175.22 175.12 1x89 s VAL 84 N 1.55 5.31 0.19 -0.44 1.01 -0.13 -0.97 120.40 126.91 1x89 s VAL 84 Ca 0.05 0.48 -0.33 0.00 0.00 0.00 0.00 61.98 62.18 1x89 s VAL 84 Cb -0.16 -3.55 -0.14 0.00 0.00 0.00 0.00 36.38 32.53 1x89 s VAL 84 CO 0.02 0.56 1.48 -2.65 0.00 0.00 0.00 175.10 174.51 1x89 n PRO 85 N 2.28 2.02 0.00 2.72 -0.02 -1.26 -0.46 135.00 140.28 1x89 n PRO 85 Ca -0.16 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1x89 n PRO 85 Cb 0.53 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1x89 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x89 n GLY 86 N 2.78 1.23 0.26 -1.23 0.00 0.13 -4.65 105.19 103.70 1x89 n GLY 86 Ca 0.15 -1.89 0.08 0.00 0.00 0.00 0.00 46.02 44.36 1x89 n GLY 86 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1x89 h SER 87 N 0.00 0.00 -4.51 1.61 0.02 -1.94 -3.43 113.55 105.30 1x89 h SER 87 Ca 0.00 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.59 1x89 h SER 87 Cb 0.00 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 62.31 1x89 h SER 87 CO 0.00 0.04 -0.76 -1.10 -1.14 0.00 0.00 176.83 173.87 1x89 s GLN 88 N -4.94 0.70 0.17 3.45 -0.21 -1.26 -5.08 119.66 112.49 1x89 s GLN 88 Ca -0.05 -0.78 -0.33 0.00 0.02 0.00 0.00 55.36 54.22 1x89 s GLN 88 Cb 0.17 -0.61 -0.13 0.00 1.00 0.00 0.00 33.01 33.43 1x89 s GLN 88 CO 0.67 0.14 1.63 -2.30 -2.12 0.00 0.00 175.29 173.30 1x89 n PRO 89 N 1.61 2.33 -0.00 2.91 -0.02 -1.26 -0.85 135.00 139.73 1x89 n PRO 89 Ca -0.20 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1x89 n PRO 89 Cb 0.55 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1x89 n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x89 n GLY 90 N 3.61 0.35 3.70 -1.23 0.00 -1.26 -4.56 105.19 105.80 1x89 n GLY 90 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1x89 n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x89 s GLU 91 N -1.00 2.61 0.03 1.61 2.02 -0.03 -1.17 118.70 122.77 1x89 s GLU 91 Ca 0.00 -0.80 0.01 0.00 0.02 0.00 0.00 54.97 54.19 1x89 s GLU 91 Cb 0.00 -2.58 -0.02 0.00 0.10 0.00 0.00 34.13 31.63 1x89 s GLU 91 CO 0.00 0.55 -0.04 -0.06 0.02 0.00 0.00 175.26 175.73 1x89 s PHE 92 N -1.30 0.37 0.41 1.61 0.40 -0.15 0.18 117.98 119.50 1x89 s PHE 92 Ca 0.26 -0.54 0.07 0.00 -0.60 0.00 0.00 56.93 56.12 1x89 s PHE 92 Cb -0.12 -0.25 -0.05 0.00 0.51 0.00 0.00 43.02 43.12 1x89 s PHE 92 CO 0.18 -0.17 0.21 0.95 0.70 0.00 0.00 175.22 177.09 1x89 s THR 93 N -1.52 2.34 -0.10 0.64 -4.23 0.39 -0.42 115.64 112.75 1x89 s THR 93 Ca -0.14 -1.65 -0.26 0.00 -1.18 0.00 0.00 61.69 58.46 1x89 s THR 93 Cb -0.09 -3.00 -0.02 0.00 1.34 0.00 0.00 72.50 70.73 1x89 s THR 93 CO -0.01 0.00 0.82 -0.22 -0.54 0.00 0.00 174.62 174.67 1x89 s LEU 94 N -3.93 4.26 0.60 4.79 2.96 -1.26 -0.96 118.68 125.14 1x89 s LEU 94 Ca 0.42 1.28 -0.16 0.00 -0.22 0.00 0.00 54.13 55.45 1x89 s LEU 94 Cb 0.03 -3.26 -0.03 0.00 0.50 0.00 0.00 46.19 43.43 1x89 s LEU 94 CO 0.23 -0.28 1.09 -0.83 -1.32 0.00 0.00 176.35 175.24 1x89 s GLY 95 N 1.01 2.26 -1.40 7.98 0.00 0.20 -3.94 107.32 113.43 1x89 s GLY 95 Ca 0.41 0.55 -0.03 0.00 0.00 0.00 0.00 44.72 45.65 1x89 s GLY 95 CO 0.17 0.89 0.63 0.70 0.00 0.00 0.00 173.10 175.50 1x89 n ASN 96 N -1.98 -1.41 0.28 1.64 3.02 -1.26 -4.73 115.26 110.82 1x89 n ASN 96 Ca 0.10 -0.90 0.15 0.00 -0.03 0.00 0.00 54.58 53.90 1x89 n ASN 96 Cb 0.52 -3.57 0.83 0.00 -0.61 0.00 0.00 39.78 36.95 1x89 n ASN 96 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1x89 h ILE 97 N -1.86 0.41 0.00 2.41 2.10 -1.96 -2.21 117.51 116.40 1x89 h ILE 97 Ca -0.61 -0.38 -0.00 0.00 1.08 0.00 0.00 64.86 64.94 1x89 h ILE 97 Cb 1.37 1.26 -0.00 0.00 -1.09 0.00 0.00 36.82 38.36 1x89 h ILE 97 CO 0.61 0.07 -0.02 0.11 -1.08 0.00 0.00 178.15 177.84 1x89 h LYS 98 N 0.00 0.00 -0.29 2.19 1.79 -1.89 -1.53 116.57 116.84 1x89 h LYS 98 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1x89 h LYS 98 Cb 0.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1x89 h LYS 98 CO 0.01 0.02 0.00 -1.13 -1.08 0.00 0.00 179.45 177.27 1x89 n SER 99 N -3.76 1.58 -3.92 0.86 3.41 -0.83 -4.43 113.62 106.53 1x89 n SER 99 Ca -0.03 -1.99 -0.30 0.00 -0.26 0.00 0.00 58.87 56.30 1x89 n SER 99 Cb 0.11 -0.19 -0.14 0.00 -0.26 0.00 0.00 64.21 63.73 1x89 n SER 99 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1x89 s TYR 100 N -1.61 3.17 0.05 7.33 1.51 -0.58 -5.08 117.35 122.14 1x89 s TYR 100 Ca 0.20 -3.16 -0.34 0.00 -1.01 0.00 0.00 57.07 52.76 1x89 s TYR 100 Cb 0.11 -2.74 -0.13 0.00 -0.11 0.00 0.00 41.96 39.09 1x89 s TYR 100 CO 0.14 -0.71 1.68 -0.35 -1.11 0.00 0.00 175.55 175.20 1x89 n PRO 101 N 2.93 2.08 0.00 -1.71 -0.04 -1.26 -1.26 135.00 135.74 1x89 n PRO 101 Ca 0.08 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.30 1x89 n PRO 101 Cb 0.33 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.24 1x89 n PRO 101 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1x89 n GLY 102 N 3.75 1.88 3.50 0.55 0.00 -1.26 -4.94 105.19 108.68 1x89 n GLY 102 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1x89 n GLY 102 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x89 s LEU 103 N 0.00 4.62 0.00 0.99 2.96 -0.39 -0.94 118.68 125.92 1x89 s LEU 103 Ca 0.00 -0.48 0.13 0.00 -0.22 0.00 0.00 54.13 53.56 1x89 s LEU 103 Cb 0.00 -2.63 -0.08 0.00 0.50 0.00 0.00 46.19 43.99 1x89 s LEU 103 CO 0.00 -0.76 0.63 0.35 -1.32 0.00 0.00 176.35 175.25 1x89 n THR 104 N 5.75 0.00 -3.63 3.68 -2.24 -0.20 -4.86 114.28 112.77 1x89 n THR 104 Ca -0.03 -0.28 -0.16 0.00 -2.27 0.00 0.00 64.05 61.31 1x89 n THR 104 Cb 0.47 1.07 -0.07 0.00 -2.10 0.00 0.00 70.33 69.70 1x89 n THR 104 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1x89 s SER 105 N -1.93 -0.49 -0.27 3.42 0.15 -1.20 -4.94 113.70 108.44 1x89 s SER 105 Ca 0.07 0.59 -0.15 0.00 0.70 0.00 0.00 55.95 57.16 1x89 s SER 105 Cb 0.10 0.58 0.08 0.00 -1.71 0.00 0.00 66.02 65.07 1x89 s SER 105 CO 0.43 -0.48 0.66 -0.47 1.20 0.00 0.00 173.24 174.59 1x89 s TYR 106 N -0.95 -1.05 -0.07 3.44 6.14 -1.26 -1.40 117.35 122.20 1x89 s TYR 106 Ca -0.10 2.08 -0.06 0.00 0.64 0.00 0.00 57.07 59.64 1x89 s TYR 106 Cb -0.02 0.62 0.02 0.00 0.42 0.00 0.00 41.96 42.99 1x89 s TYR 106 CO 0.06 -0.52 0.17 -1.17 0.64 0.00 0.00 175.55 174.74 1x89 s LEU 107 N 1.69 1.21 -0.06 6.97 2.96 0.40 -4.02 118.68 127.83 1x89 s LEU 107 Ca -0.10 0.36 0.05 0.00 -0.22 0.00 0.00 54.13 54.21 1x89 s LEU 107 Cb -0.06 0.58 -0.00 0.00 0.50 0.00 0.00 46.19 47.21 1x89 s LEU 107 CO -0.19 -0.08 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.86 1x89 s VAL 108 N 0.28 1.76 -0.14 1.68 1.01 0.44 -1.03 120.40 124.41 1x89 s VAL 108 Ca -0.02 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.06 1x89 s VAL 108 Cb -0.03 -1.51 0.04 0.00 0.00 0.00 0.00 36.38 34.88 1x89 s VAL 108 CO -0.01 0.50 0.00 -0.60 0.00 0.00 0.00 175.10 174.99 1x89 s ARG 109 N 0.10 0.79 -0.23 2.72 3.52 0.84 -0.98 118.95 125.71 1x89 s ARG 109 Ca -0.08 -0.22 -0.29 0.00 -0.13 0.00 0.00 55.73 55.00 1x89 s ARG 109 Cb -0.14 -1.64 -0.02 0.00 -1.56 0.00 0.00 34.95 31.59 1x89 s ARG 109 CO 0.04 -0.46 1.45 0.08 -0.81 0.00 0.00 175.30 175.61 1x89 s VAL 110 N 1.86 3.93 -0.11 7.11 1.01 -0.32 0.12 120.40 134.00 1x89 s VAL 110 Ca 0.02 1.06 -0.28 0.00 0.00 0.00 0.00 61.98 62.78 1x89 s VAL 110 Cb -0.15 -3.90 -0.24 0.00 0.00 0.00 0.00 36.38 32.09 1x89 s VAL 110 CO -0.07 -0.33 0.88 0.58 0.00 0.00 0.00 175.10 176.17 1x89 h VAL 111 N 5.96 1.67 -1.90 2.92 2.07 -1.11 -0.07 116.25 125.79 1x89 h VAL 111 Ca -0.30 -2.03 -0.03 0.00 0.82 0.00 0.00 66.70 65.16 1x89 h VAL 111 Cb 1.13 3.04 -0.20 0.00 -1.52 0.00 0.00 31.29 33.74 1x89 h VAL 111 CO 1.01 0.52 0.27 -0.94 0.02 0.00 0.00 177.57 178.45 1x89 s SER 112 N -6.08 -0.60 -0.07 0.57 1.04 -1.14 -2.35 113.70 105.07 1x89 s SER 112 Ca -0.18 0.66 -0.31 0.00 0.48 0.00 0.00 55.95 56.61 1x89 s SER 112 Cb -0.02 0.51 0.08 0.00 0.10 0.00 0.00 66.02 66.69 1x89 s SER 112 CO 0.68 -0.54 0.74 0.28 0.98 0.00 0.00 173.24 175.37 1x89 s THR 113 N -1.14 0.00 -0.76 2.02 -1.32 -1.26 -0.71 115.64 112.47 1x89 s THR 113 Ca -0.09 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.55 1x89 s THR 113 Cb -0.00 -1.00 0.56 0.00 -1.51 0.00 0.00 72.50 70.54 1x89 s THR 113 CO 0.08 0.00 1.47 -0.46 -2.21 0.00 0.00 174.62 173.50 1x89 n ASN 114 N 0.90 4.05 0.00 8.08 6.94 -1.00 -5.02 115.26 129.22 1x89 n ASN 114 Ca -0.17 -2.51 0.00 0.00 -0.02 0.00 0.00 54.58 51.88 1x89 n ASN 114 Cb 0.57 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 37.51 1x89 n ASN 114 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1x89 n TYR 115 N 0.46 0.00 1.00 -2.53 4.01 -1.26 -4.38 117.16 114.47 1x89 n TYR 115 Ca 0.21 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.06 1x89 n TYR 115 Cb 0.78 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.83 1x89 n TYR 115 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1x89 n ASN 116 N 0.44 2.21 0.00 7.72 3.02 -1.26 -4.77 115.26 122.62 1x89 n ASN 116 Ca 0.00 -1.61 0.00 0.00 -0.03 0.00 0.00 54.58 52.94 1x89 n ASN 116 Cb 0.00 0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1x89 n ASN 116 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1x89 n GLN 117 N 0.24 0.00 -3.85 3.52 7.27 -1.26 -4.76 117.38 118.54 1x89 n GLN 117 Ca 0.10 0.00 -0.09 0.00 0.07 0.00 0.00 57.00 57.08 1x89 n GLN 117 Cb 0.49 -0.32 -0.07 0.00 2.41 0.00 0.00 30.24 32.75 1x89 n GLN 117 CO 0.00 0.00 0.00 -3.38 0.07 0.00 0.00 177.06 173.75 1x89 s HIS 118 N -1.88 0.14 0.09 3.69 -3.43 -1.26 -0.80 115.29 111.84 1x89 s HIS 118 Ca 0.00 -0.55 -0.16 0.00 -0.80 0.00 0.00 55.06 53.54 1x89 s HIS 118 Cb 0.00 -0.05 0.03 0.00 -1.43 0.00 0.00 32.58 31.13 1x89 s HIS 118 CO 0.00 -0.54 0.39 0.00 -2.00 0.00 0.00 174.74 172.59 1x89 s ALA 119 N -3.80 -0.91 -0.06 -1.38 0.00 -0.37 -2.37 121.76 112.86 1x89 s ALA 119 Ca 0.04 0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.09 1x89 s ALA 119 Cb 0.05 0.54 0.01 0.00 0.00 0.00 0.00 23.12 23.71 1x89 s ALA 119 CO -0.11 -0.56 -0.13 -1.64 0.00 0.00 0.00 175.76 173.32 1x89 s MET 120 N -3.26 1.70 -0.02 0.00 -1.94 0.12 0.32 119.30 116.21 1x89 s MET 120 Ca -0.00 -0.45 0.03 0.00 -1.71 0.00 0.00 55.69 53.55 1x89 s MET 120 Cb 0.01 -1.42 0.00 0.00 2.01 0.00 0.00 34.83 35.43 1x89 s MET 120 CO -0.08 0.07 -0.10 0.08 -0.01 0.00 0.00 175.02 174.98 1x89 s VAL 121 N 0.51 0.87 -0.08 -6.03 1.01 -0.85 -0.79 120.40 115.04 1x89 s VAL 121 Ca -0.12 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.40 1x89 s VAL 121 Cb -0.15 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 1x89 s VAL 121 CO 0.03 0.26 0.09 0.12 0.00 0.00 0.00 175.10 175.61 1x89 s PHE 122 N 0.10 3.41 -0.02 5.22 2.19 0.12 -0.85 117.98 128.15 1x89 s PHE 122 Ca -0.02 0.36 0.02 0.00 0.33 0.00 0.00 56.93 57.62 1x89 s PHE 122 Cb -0.08 -1.85 0.00 0.00 -1.31 0.00 0.00 43.02 39.78 1x89 s PHE 122 CO 0.00 0.62 -0.08 -0.06 1.83 0.00 0.00 175.22 177.53 1x89 s PHE 123 N -1.03 0.83 -0.02 10.12 0.08 -0.35 -0.11 117.98 127.50 1x89 s PHE 123 Ca 0.16 -0.19 0.01 0.00 0.12 0.00 0.00 56.93 57.03 1x89 s PHE 123 Cb -0.12 -0.59 0.02 0.00 -0.57 0.00 0.00 43.02 41.76 1x89 s PHE 123 CO 0.06 -0.08 -0.01 0.21 -0.10 0.00 0.00 175.22 175.30 1x89 s LYS 124 N 0.14 0.30 0.06 0.44 2.20 -0.19 -1.44 119.74 121.24 1x89 s LYS 124 Ca -0.02 0.00 -0.05 0.00 -0.36 0.00 0.00 55.97 55.55 1x89 s LYS 124 Cb -0.07 -0.40 -0.02 0.00 -1.51 0.00 0.00 37.83 35.83 1x89 s LYS 124 CO 0.00 -0.06 0.08 -1.59 -0.36 0.00 0.00 175.35 173.42 1x89 s LYS 125 N 0.62 0.69 -0.18 4.03 -2.85 -0.17 -0.45 119.74 121.43 1x89 s LYS 125 Ca -0.06 -1.01 0.01 0.00 -1.00 0.00 0.00 55.97 53.91 1x89 s LYS 125 Cb -0.09 0.27 0.02 0.00 -2.06 0.00 0.00 37.83 35.96 1x89 s LYS 125 CO -0.01 -0.18 -0.20 0.08 0.10 0.00 0.00 175.35 175.14 1x89 s VAL 126 N -3.60 2.09 -0.07 1.79 1.01 -0.50 -0.76 120.40 120.37 1x89 s VAL 126 Ca 0.03 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1x89 s VAL 126 Cb 0.05 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.58 1x89 s VAL 126 CO -0.09 0.54 -0.08 -0.55 0.00 0.00 0.00 175.10 174.92 1x89 s SER 127 N 1.25 1.58 -1.45 3.32 0.15 -0.67 -1.03 113.70 116.85 1x89 s SER 127 Ca 0.04 -0.23 -0.06 0.00 0.70 0.00 0.00 55.95 56.40 1x89 s SER 127 Cb -0.13 -0.68 0.04 0.00 -1.71 0.00 0.00 66.02 63.54 1x89 s SER 127 CO -0.12 -0.04 0.69 0.00 1.20 0.00 0.00 173.24 174.97 1x89 n GLN 128 N 4.21 -4.30 -1.13 5.44 1.13 -0.12 -0.90 117.38 121.72 1x89 n GLN 128 Ca -0.20 0.51 -0.08 0.00 -1.94 0.00 0.00 57.00 55.28 1x89 n GLN 128 Cb 0.51 -5.03 -0.04 0.00 0.11 0.00 0.00 30.24 25.80 1x89 n GLN 128 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1x89 n ASN 129 N -2.93 -2.95 -4.77 1.08 4.13 -1.26 -4.97 115.26 103.59 1x89 n ASN 129 Ca -0.17 0.21 -0.36 0.00 1.68 0.00 0.00 54.58 55.94 1x89 n ASN 129 Cb 0.62 -2.62 -0.08 0.00 -1.54 0.00 0.00 39.78 36.17 1x89 n ASN 129 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1x89 s ARG 130 N -2.49 3.69 -0.39 3.52 0.52 -0.08 -5.09 118.95 118.64 1x89 s ARG 130 Ca 0.00 -0.22 -0.17 0.00 -0.52 0.00 0.00 55.73 54.82 1x89 s ARG 130 Cb 0.00 -3.21 0.01 0.00 0.52 0.00 0.00 34.95 32.27 1x89 s ARG 130 CO 0.00 0.55 0.42 -2.00 0.02 0.00 0.00 175.30 174.28 1x89 s GLU 131 N -0.37 3.27 0.14 3.54 2.12 -1.26 -1.67 118.70 124.46 1x89 s GLU 131 Ca 0.11 -0.62 0.04 0.00 0.36 0.00 0.00 54.97 54.85 1x89 s GLU 131 Cb -0.12 -3.91 -0.04 0.00 0.26 0.00 0.00 34.13 30.33 1x89 s GLU 131 CO 0.01 -0.74 0.15 0.71 -0.54 0.00 0.00 175.26 174.86 1x89 s TYR 132 N 2.11 3.23 0.07 5.30 1.51 0.06 -4.66 117.35 124.98 1x89 s TYR 132 Ca 0.12 0.04 -0.12 0.00 -1.01 0.00 0.00 57.07 56.10 1x89 s TYR 132 Cb -0.17 -1.57 0.01 0.00 -0.11 0.00 0.00 41.96 40.12 1x89 s TYR 132 CO 0.13 0.52 0.27 -0.59 -1.11 0.00 0.00 175.55 174.77 1x89 s PHE 133 N -1.66 -0.02 0.14 2.71 -0.71 -1.26 -1.00 117.98 116.17 1x89 s PHE 133 Ca 0.31 -0.23 -0.16 0.00 -1.04 0.00 0.00 56.93 55.81 1x89 s PHE 133 Cb -0.11 0.05 0.03 0.00 -1.21 0.00 0.00 43.02 41.79 1x89 s PHE 133 CO 0.24 -0.53 0.43 -1.59 -1.34 0.00 0.00 175.22 172.43 1x89 s LYS 134 N -3.06 1.14 -0.04 1.99 -2.85 -0.52 -1.79 119.74 114.60 1x89 s LYS 134 Ca -0.01 -0.74 0.02 0.00 -1.00 0.00 0.00 55.97 54.24 1x89 s LYS 134 Cb 0.01 0.48 0.01 0.00 -2.06 0.00 0.00 37.83 36.27 1x89 s LYS 134 CO -0.07 -0.45 -0.09 0.42 0.10 0.00 0.00 175.35 175.26 1x89 s ILE 135 N -3.82 0.85 0.10 3.79 1.09 0.17 -1.21 121.20 122.16 1x89 s ILE 135 Ca 0.04 -0.36 0.04 0.00 -1.10 0.00 0.00 60.65 59.28 1x89 s ILE 135 Cb 0.01 -0.78 -0.04 0.00 -1.06 0.00 0.00 42.46 40.59 1x89 s ILE 135 CO -0.10 0.28 0.07 0.42 -0.10 0.00 0.00 174.94 175.51 1x89 s THR 136 N 0.46 4.39 -0.27 2.92 -4.23 -0.03 -1.19 115.64 117.70 1x89 s THR 136 Ca -0.08 -0.89 -0.04 0.00 -1.18 0.00 0.00 61.69 59.50 1x89 s THR 136 Cb -0.12 -3.14 0.02 0.00 1.34 0.00 0.00 72.50 70.60 1x89 s THR 136 CO 0.01 0.07 -0.01 -0.22 -0.54 0.00 0.00 174.62 173.94 1x89 s LEU 137 N -2.53 3.46 -0.07 4.79 0.20 0.58 -2.00 118.68 123.11 1x89 s LEU 137 Ca 0.29 -0.81 -0.03 0.00 0.69 0.00 0.00 54.13 54.26 1x89 s LEU 137 Cb -0.12 -1.75 -0.04 0.00 -0.43 0.00 0.00 46.19 43.86 1x89 s LEU 137 CO 0.21 -0.15 0.07 -0.31 -0.29 0.00 0.00 176.35 175.88 1x89 s TYR 138 N 1.39 3.35 0.01 5.38 2.02 0.15 -0.77 117.35 128.87 1x89 s TYR 138 Ca 0.01 0.31 0.05 0.00 -0.37 0.00 0.00 57.07 57.07 1x89 s TYR 138 Cb -0.17 -1.82 -0.02 0.00 -0.40 0.00 0.00 41.96 39.56 1x89 s TYR 138 CO -0.02 0.58 -0.16 0.20 -1.57 0.00 0.00 175.55 174.59 1x89 s GLY 139 N -1.22 0.81 0.47 0.71 0.00 -0.16 -1.24 107.32 106.68 1x89 s GLY 139 Ca 0.17 -0.75 0.26 0.00 0.00 0.00 0.00 44.72 44.41 1x89 s GLY 139 CO 0.07 -0.66 1.87 3.21 0.00 0.00 0.00 173.10 177.59 1x89 h ARG 140 N 5.48 0.00 -5.22 2.90 -0.00 -1.25 0.19 114.38 116.48 1x89 h ARG 140 Ca -0.37 0.00 -0.66 0.00 -0.50 0.00 0.00 59.98 58.46 1x89 h ARG 140 Cb 1.16 0.00 -0.13 0.00 0.00 0.00 0.00 29.97 31.00 1x89 h ARG 140 CO 0.47 0.16 -0.52 0.95 0.00 0.00 0.00 179.97 181.03 1x89 s THR 141 N -3.67 1.16 -1.58 2.04 -4.23 -1.26 -4.76 115.64 103.34 1x89 s THR 141 Ca 0.01 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 58.81 1x89 s THR 141 Cb 0.10 -2.27 0.59 0.00 1.34 0.00 0.00 72.50 72.25 1x89 s THR 141 CO 0.61 0.00 2.02 0.29 -0.54 0.00 0.00 174.62 177.00 1x89 n LYS 142 N -1.18 0.54 -4.39 3.99 5.02 -1.26 -4.67 118.16 116.22 1x89 n LYS 142 Ca -0.16 0.01 -0.23 0.00 -2.02 0.00 0.00 58.31 55.91 1x89 n LYS 142 Cb 0.67 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 34.05 1x89 n LYS 142 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1x89 s GLU 143 N -2.42 1.13 0.22 1.97 2.02 -1.26 -4.88 118.70 115.47 1x89 s GLU 143 Ca 0.32 -1.00 0.02 0.00 0.02 0.00 0.00 54.97 54.33 1x89 s GLU 143 Cb 0.20 -1.27 -0.05 0.00 0.10 0.00 0.00 34.13 33.11 1x89 s GLU 143 CO 0.41 0.31 0.02 -0.51 0.02 0.00 0.00 175.26 175.51 1x89 s LEU 144 N -1.53 2.02 0.79 1.80 1.43 -1.26 -4.91 118.68 117.01 1x89 s LEU 144 Ca 0.05 -1.24 -0.12 0.00 -1.03 0.00 0.00 54.13 51.78 1x89 s LEU 144 Cb -0.09 -0.11 0.07 0.00 0.03 0.00 0.00 46.19 46.09 1x89 s LEU 144 CO 0.03 -0.59 1.14 0.42 0.23 0.00 0.00 176.35 177.58 1x89 s THR 145 N -3.60 2.66 0.27 5.49 -4.23 -1.26 -4.88 115.64 110.09 1x89 s THR 145 Ca 0.29 0.25 -0.03 0.00 -1.18 0.00 0.00 61.69 61.02 1x89 s THR 145 Cb 0.06 -2.62 0.27 0.00 1.34 0.00 0.00 72.50 71.55 1x89 s THR 145 CO 0.08 -0.24 1.91 0.28 -0.54 0.00 0.00 174.62 176.11 1x89 h SER 146 N -0.99 1.07 -0.61 3.99 0.02 -2.00 -2.03 113.55 112.99 1x89 h SER 146 Ca -0.45 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 60.52 1x89 h SER 146 Cb 1.26 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.52 1x89 h SER 146 CO 0.48 0.73 0.37 -0.08 -1.14 0.00 0.00 176.83 177.19 1x89 h GLU 147 N 1.24 0.71 -0.35 3.45 4.81 -1.99 0.18 114.58 122.63 1x89 h GLU 147 Ca 0.39 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.47 1x89 h GLU 147 Cb 0.01 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 1x89 h GLU 147 CO -0.12 0.47 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.31 1x89 h LEU 148 N 0.73 0.70 -0.65 1.64 3.38 -1.81 0.59 115.31 119.90 1x89 h LEU 148 Ca 0.25 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1x89 h LEU 148 Cb 0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1x89 h LEU 148 CO -0.11 0.93 -0.12 0.11 0.09 0.00 0.00 178.44 179.33 1x89 h LYS 149 N 0.60 0.93 -0.33 1.13 1.57 -0.94 -1.25 116.57 118.28 1x89 h LYS 149 Ca 0.08 -0.34 -0.15 0.00 -1.87 0.00 0.00 60.65 58.38 1x89 h LYS 149 Cb 0.73 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1x89 h LYS 149 CO 0.06 0.99 -0.40 1.49 -0.57 0.00 0.00 179.45 181.02 1x89 h GLU 150 N 0.83 0.79 -0.83 3.15 4.81 -0.29 -1.38 114.58 121.65 1x89 h GLU 150 Ca 0.13 -0.41 0.01 0.00 -0.13 0.00 0.00 59.36 58.96 1x89 h GLU 150 Cb 0.66 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.01 1x89 h GLU 150 CO 0.05 1.04 0.55 -0.97 -0.73 0.00 0.00 179.01 178.95 1x89 h ASN 151 N 0.64 0.94 -0.42 1.04 -1.24 -0.64 -1.27 115.58 114.63 1x89 h ASN 151 Ca 0.05 -0.02 -0.06 0.00 0.71 0.00 0.00 56.30 56.98 1x89 h ASN 151 Cb 0.96 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 39.76 1x89 h ASN 151 CO 0.09 0.67 0.04 0.15 -1.29 0.00 0.00 177.43 177.09 1x89 h PHE 152 N 1.11 0.78 -0.53 0.67 3.04 -0.90 -0.84 116.94 120.26 1x89 h PHE 152 Ca 0.31 -0.12 0.01 0.00 3.98 0.00 0.00 57.97 62.15 1x89 h PHE 152 Cb -0.09 -0.21 -0.03 0.00 2.56 0.00 0.00 35.95 38.18 1x89 h PHE 152 CO -0.00 0.76 0.34 0.82 -2.02 0.00 0.00 178.31 178.21 1x89 h ILE 153 N 0.57 1.11 -0.49 1.41 2.04 -0.83 0.49 117.51 121.81 1x89 h ILE 153 Ca 0.12 -0.24 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 1x89 h ILE 153 Cb 0.43 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1x89 h ILE 153 CO 0.01 0.13 0.11 0.03 0.00 0.00 0.00 178.15 178.43 1x89 h ARG 154 N 0.69 0.79 -0.41 2.37 3.08 -1.15 -0.77 114.38 118.98 1x89 h ARG 154 Ca 0.20 -0.20 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1x89 h ARG 154 Cb -0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 1x89 h ARG 154 CO -0.06 0.78 0.15 0.35 -1.07 0.00 0.00 179.97 180.12 1x89 h PHE 155 N 0.68 0.65 -0.65 3.04 3.57 -0.98 -0.85 116.94 122.39 1x89 h PHE 155 Ca 0.15 -0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.60 1x89 h PHE 155 Cb 0.35 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 1x89 h PHE 155 CO 0.02 0.58 0.43 0.77 -2.23 0.00 0.00 178.31 177.88 1x89 h SER 156 N 0.53 0.75 -0.45 0.41 0.02 -0.60 -1.99 113.55 112.22 1x89 h SER 156 Ca 0.14 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 1x89 h SER 156 Cb 0.22 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 1x89 h SER 156 CO -0.01 0.55 0.07 0.11 -1.14 0.00 0.00 176.83 176.41 1x89 h LYS 157 N 0.88 0.82 0.00 3.45 1.57 -1.06 -1.19 116.57 121.04 1x89 h LYS 157 Ca 0.24 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1x89 h LYS 157 Cb -0.09 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.11 1x89 h LYS 157 CO -0.05 0.78 0.00 0.66 -0.57 0.00 0.00 179.45 180.27 1x89 h SER 158 N 0.78 0.00 -0.62 0.86 4.64 -0.39 0.93 113.55 119.75 1x89 h SER 158 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1x89 h SER 158 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1x89 h SER 158 CO 0.01 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.15 1x89 n LEU 159 N -2.41 3.99 0.00 5.97 4.77 -0.50 -4.92 117.00 123.90 1x89 n LEU 159 Ca -0.01 -2.01 0.00 0.00 -0.03 0.00 0.00 56.01 53.97 1x89 n LEU 159 Cb 0.10 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.69 1x89 n LEU 159 CO 0.14 0.80 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 1x89 n GLY 160 N 1.28 0.74 3.70 -0.72 0.00 0.32 -4.56 105.19 105.95 1x89 n GLY 160 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 1x89 n GLY 160 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x89 s LEU 161 N 0.00 4.24 0.70 0.99 1.43 -0.92 -5.00 118.68 120.11 1x89 s LEU 161 Ca 0.00 0.91 -0.11 0.00 -1.03 0.00 0.00 54.13 53.90 1x89 s LEU 161 Cb 0.00 -2.86 0.01 0.00 0.03 0.00 0.00 46.19 43.37 1x89 s LEU 161 CO 0.00 -0.12 1.07 -2.16 0.23 0.00 0.00 176.35 175.37 1x89 s PRO 162 N 1.09 2.94 0.47 1.29 0.04 -1.26 -3.85 135.00 135.71 1x89 s PRO 162 Ca 0.30 0.70 0.19 0.00 0.04 0.00 0.00 61.00 62.23 1x89 s PRO 162 Cb -0.16 -2.01 1.19 0.00 0.04 0.00 0.00 34.50 33.56 1x89 s PRO 162 CO 0.12 -1.04 1.98 1.05 0.04 0.00 0.00 177.00 179.16 1x89 h GLU 163 N -0.66 0.23 0.00 4.56 9.09 -1.98 0.62 114.58 126.44 1x89 h GLU 163 Ca -0.45 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 58.95 1x89 h GLU 163 Cb 1.23 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 28.28 1x89 h GLU 163 CO 0.61 0.15 0.00 0.27 0.05 0.00 0.00 179.01 180.09 1x89 n ASN 164 N -4.44 0.00 -1.08 3.06 6.94 -1.26 -1.97 115.26 116.51 1x89 n ASN 164 Ca 0.10 -0.59 0.08 0.00 -0.02 0.00 0.00 54.58 54.16 1x89 n ASN 164 Cb 0.50 -0.05 0.26 0.00 -2.36 0.00 0.00 39.78 38.13 1x89 n ASN 164 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1x89 n HIS 165 N -1.05 1.01 -4.12 -2.53 8.25 0.21 -1.28 115.22 115.71 1x89 n HIS 165 Ca 0.16 -0.66 -0.33 0.00 -0.26 0.00 0.00 57.72 56.63 1x89 n HIS 165 Cb 0.10 -0.20 -0.16 0.00 1.12 0.00 0.00 29.99 30.85 1x89 n HIS 165 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1x89 s ILE 166 N -1.89 2.31 0.13 1.59 1.01 -0.83 -2.08 121.20 121.45 1x89 s ILE 166 Ca 0.40 -0.86 0.07 0.00 0.00 0.00 0.00 60.65 60.26 1x89 s ILE 166 Cb 0.27 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 1x89 s ILE 166 CO 0.17 0.52 -0.16 0.68 0.00 0.00 0.00 174.94 176.15 1x89 s VAL 167 N 1.29 1.52 -0.49 2.92 -7.23 0.13 -4.79 120.40 113.75 1x89 s VAL 167 Ca 0.04 -1.74 -0.01 0.00 -1.81 0.00 0.00 61.98 58.46 1x89 s VAL 167 Cb -0.13 -1.61 0.13 0.00 0.56 0.00 0.00 36.38 35.32 1x89 s VAL 167 CO -0.10 -0.33 0.28 -0.36 -0.31 0.00 0.00 175.10 174.27 1x89 s PHE 168 N -1.96 3.50 0.51 2.82 0.40 -1.26 -1.02 117.98 120.96 1x89 s PHE 168 Ca 0.10 -2.68 -0.20 0.00 -0.60 0.00 0.00 56.93 53.55 1x89 s PHE 168 Cb -0.06 -3.14 -0.09 0.00 0.51 0.00 0.00 43.02 40.24 1x89 s PHE 168 CO 0.04 -0.90 0.71 -2.30 0.70 0.00 0.00 175.22 173.47 1x89 n PRO 169 N 3.99 0.77 -2.86 0.24 -0.02 -1.25 -4.92 135.00 130.94 1x89 n PRO 169 Ca 0.03 0.29 -0.41 0.00 -2.02 0.00 0.00 63.50 61.39 1x89 n PRO 169 Cb 0.39 -1.81 -0.04 0.00 -0.02 0.00 0.00 33.50 32.03 1x89 n PRO 169 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1x89 s VAL 170 N -1.53 4.92 0.44 -1.45 1.01 -0.67 -4.59 120.40 118.53 1x89 s VAL 170 Ca 0.67 1.75 -0.26 0.00 0.00 0.00 0.00 61.98 64.14 1x89 s VAL 170 Cb -0.50 -4.18 -0.09 0.00 0.00 0.00 0.00 36.38 31.61 1x89 s VAL 170 CO 0.55 0.14 1.43 -2.65 0.00 0.00 0.00 175.10 174.56 1x89 n PRO 171 N 4.34 2.29 -4.17 2.72 -0.02 -1.26 -1.16 135.00 137.74 1x89 n PRO 171 Ca 0.04 0.82 -0.12 0.00 -2.02 0.00 0.00 63.50 62.22 1x89 n PRO 171 Cb 0.50 -2.62 -0.09 0.00 -0.02 0.00 0.00 33.50 31.27 1x89 n PRO 171 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1x89 s ILE 172 N -1.18 0.01 -0.18 4.25 -4.36 -1.26 -4.87 121.20 113.60 1x89 s ILE 172 Ca 0.60 -1.93 0.08 0.00 -0.26 0.00 0.00 60.65 59.15 1x89 s ILE 172 Cb -0.46 -2.44 -0.11 0.00 1.25 0.00 0.00 42.46 40.70 1x89 s ILE 172 CO 0.59 -0.03 0.26 0.47 0.24 0.00 0.00 174.94 176.47 1x89 n ASP 173 N -0.27 1.86 -4.76 4.36 8.00 -1.26 -4.88 116.55 119.59 1x89 n ASP 173 Ca 0.01 -0.31 -0.40 0.00 0.71 0.00 0.00 54.79 54.80 1x89 n ASP 173 Cb 0.65 1.22 -0.04 0.00 -0.02 0.00 0.00 41.12 42.93 1x89 n ASP 173 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1x89 s GLN 174 N -2.23 4.49 0.00 -1.24 1.11 -1.26 -4.28 119.66 116.25 1x89 s GLN 174 Ca -0.00 1.86 0.00 0.00 0.01 0.00 0.00 55.36 57.23 1x89 s GLN 174 Cb 0.06 -3.06 0.00 0.00 -1.01 0.00 0.00 33.01 28.99 1x89 s GLN 174 CO 0.35 0.05 0.00 0.00 0.01 0.00 0.00 175.29 175.70 1x89 n ILE 176 N 0.00 0.00 1.24 0.00 -5.35 -1.26 -4.92 119.36 109.06 1x89 n ILE 176 Ca 0.00 -0.06 0.13 0.00 -0.27 0.00 0.00 62.75 62.55 1x89 n ILE 176 Cb 0.00 0.26 0.30 0.00 -1.74 0.00 0.00 39.64 38.46 1x89 n ILE 176 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26