#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8p n TRP 2 N 0.00 -2.11 -4.39 1.61 7.02 -1.26 -4.98 117.44 113.34 2k8p n TRP 2 Ca 0.00 0.87 -0.19 0.00 -1.02 0.00 0.00 57.50 57.16 2k8p n TRP 2 Cb 0.00 -4.09 -0.10 0.00 -2.42 0.00 0.00 31.31 24.69 2k8p n TRP 2 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 2k8p s GLN 3 N -6.39 1.48 0.29 -0.99 -0.21 -1.26 -5.17 119.66 107.41 2k8p s GLN 3 Ca 0.38 -1.78 0.01 0.00 0.02 0.00 0.00 55.36 53.99 2k8p s GLN 3 Cb -0.19 -0.80 -0.00 0.00 1.00 0.00 0.00 33.01 33.02 2k8p s GLN 3 CO 0.83 -0.10 0.02 0.00 -2.12 0.00 0.00 175.29 173.92 2k8p n ALA 4 N -0.54 0.28 -2.92 6.09 0.00 -1.26 -5.17 120.51 117.00 2k8p n ALA 4 Ca -0.04 -1.35 -0.11 0.00 0.00 0.00 0.00 53.44 51.94 2k8p n ALA 4 Cb 0.65 0.78 -0.12 0.00 0.00 0.00 0.00 19.45 20.76 2k8p n ALA 4 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2k8p s PHE 5 N -2.20 0.30 -0.13 0.00 0.40 -1.26 -5.14 117.98 109.94 2k8p s PHE 5 Ca 0.03 -0.38 -0.01 0.00 -0.60 0.00 0.00 56.93 55.97 2k8p s PHE 5 Cb 0.00 -0.20 0.03 0.00 0.51 0.00 0.00 43.02 43.37 2k8p s PHE 5 CO 0.02 -0.12 -0.05 0.15 0.70 0.00 0.00 175.22 175.93 2k8p s LYS 6 N -1.09 1.28 -0.64 0.44 1.02 -1.26 -5.02 119.74 114.47 2k8p s LYS 6 Ca -0.10 -0.29 -0.00 0.00 0.02 0.00 0.00 55.97 55.59 2k8p s LYS 6 Cb -0.07 -1.66 0.43 0.00 -0.52 0.00 0.00 37.83 36.00 2k8p s LYS 6 CO -0.00 -0.36 1.86 -1.71 -0.92 0.00 0.00 175.35 174.22 2k8p n ASN 7 N 4.96 7.09 -3.85 2.83 2.85 -1.26 -4.91 115.26 122.97 2k8p n ASN 7 Ca -0.11 -3.79 -0.26 0.00 -0.11 0.00 0.00 54.58 50.31 2k8p n ASN 7 Cb 0.49 -0.88 -0.17 0.00 1.24 0.00 0.00 39.78 40.46 2k8p n ASN 7 CO 0.00 0.00 0.00 1.51 -2.11 0.00 0.00 177.26 176.66 2k8p s ASP 8 N -2.02 2.04 -0.36 1.20 -4.77 -1.26 -5.07 116.67 106.44 2k8p s ASP 8 Ca 0.59 -0.27 -0.00 0.00 -3.30 0.00 0.00 52.55 49.57 2k8p s ASP 8 Cb 0.47 -0.69 0.19 0.00 -1.09 0.00 0.00 42.92 41.79 2k8p s ASP 8 CO -0.11 -0.16 0.82 0.00 0.70 0.00 0.00 175.17 176.42 2k8p s ALA 9 N 1.80 -3.29 -0.43 2.11 0.00 -1.26 -5.08 121.76 115.61 2k8p s ALA 9 Ca 0.04 0.79 0.06 0.00 0.00 0.00 0.00 51.96 52.86 2k8p s ALA 9 Cb -0.13 -2.83 0.21 0.00 0.00 0.00 0.00 23.12 20.37 2k8p s ALA 9 CO -0.07 -2.27 0.52 -2.37 0.00 0.00 0.00 175.76 171.57 2k8p n THR 10 N 4.31 -0.73 -3.42 0.00 5.66 -1.26 -5.13 114.28 113.71 2k8p n THR 10 Ca 0.08 -3.07 -0.31 0.00 -3.05 0.00 0.00 64.05 57.71 2k8p n THR 10 Cb 0.59 -1.02 -0.05 0.00 -1.55 0.00 0.00 70.33 68.30 2k8p n THR 10 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2k8p s GLU 11 N -0.19 3.73 -0.48 1.09 -1.05 -1.26 -5.06 118.70 115.48 2k8p s GLU 11 Ca 0.33 0.15 -0.07 0.00 -0.15 0.00 0.00 54.97 55.23 2k8p s GLU 11 Cb 0.10 -2.67 0.12 0.00 -0.44 0.00 0.00 34.13 31.25 2k8p s GLU 11 CO -0.15 0.30 0.33 0.42 0.95 0.00 0.00 175.26 177.10 2k8p s ILE 12 N -1.89 3.96 -0.51 1.83 1.01 -1.26 -4.97 121.20 119.37 2k8p s ILE 12 Ca 0.46 -1.99 0.07 0.00 0.00 0.00 0.00 60.65 59.18 2k8p s ILE 12 Cb -0.11 -3.62 0.24 0.00 0.01 0.00 0.00 42.46 38.97 2k8p s ILE 12 CO 0.24 -0.77 0.59 -0.38 0.00 0.00 0.00 174.94 174.63 2k8p n ILE 13 N 4.66 0.61 -1.40 2.92 2.08 -1.26 -5.11 119.36 121.86 2k8p n ILE 13 Ca -0.04 -4.49 -0.32 0.00 0.56 0.00 0.00 62.75 58.46 2k8p n ILE 13 Cb 0.41 -2.01 0.08 0.00 -0.75 0.00 0.00 39.64 37.37 2k8p n ILE 13 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2k8p s PRO 14 N -1.61 2.41 -0.07 0.38 0.04 -1.26 -4.99 135.00 129.89 2k8p s PRO 14 Ca 0.36 1.23 0.10 0.00 0.04 0.00 0.00 61.00 62.73 2k8p s PRO 14 Cb 0.14 -1.91 -0.14 0.00 0.04 0.00 0.00 34.50 32.63 2k8p s PRO 14 CO -0.08 -1.54 0.10 0.39 0.04 0.00 0.00 177.00 175.92 2k8p n GLU 15 N -3.21 1.67 -3.82 4.56 1.02 -1.26 -4.90 120.64 114.70 2k8p n GLU 15 Ca 0.09 -0.04 -0.30 0.00 -0.02 0.00 0.00 57.16 56.90 2k8p n GLU 15 Cb 0.53 -1.26 -0.15 0.00 -0.02 0.00 0.00 31.44 30.54 2k8p n GLU 15 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k8p s LEU 16 N -4.39 2.55 -0.04 -4.62 1.43 -1.26 -4.96 118.68 107.40 2k8p s LEU 16 Ca -0.05 -1.52 0.21 0.00 -1.03 0.00 0.00 54.13 51.74 2k8p s LEU 16 Cb 0.04 -1.01 -0.28 0.00 0.03 0.00 0.00 46.19 44.97 2k8p s LEU 16 CO 0.42 -0.36 0.47 0.61 0.23 0.00 0.00 176.35 177.72 2k8p n GLY 17 N 4.75 -1.05 3.80 -3.19 0.00 -1.26 -4.98 105.19 103.25 2k8p n GLY 17 Ca -0.04 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.29 2k8p n GLY 17 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k8p s GLU 18 N -3.28 2.28 -0.40 1.61 1.03 -1.26 -5.10 118.70 113.58 2k8p s GLU 18 Ca -0.07 -1.89 0.07 0.00 0.03 0.00 0.00 54.97 53.11 2k8p s GLU 18 Cb 0.12 -2.04 0.23 0.00 -0.80 0.00 0.00 34.13 31.65 2k8p s GLU 18 CO 0.88 -0.28 0.48 0.66 -1.33 0.00 0.00 175.26 175.68 2k8p n TYR 19 N -1.42 -0.44 -1.17 4.83 4.01 -1.26 -5.13 117.16 116.58 2k8p n TYR 19 Ca -0.02 -3.51 -0.29 0.00 -0.16 0.00 0.00 57.90 53.92 2k8p n TYR 19 Cb 0.64 -0.22 0.17 0.00 -0.31 0.00 0.00 39.34 39.62 2k8p n TYR 19 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2k8p s PRO 20 N -0.93 0.58 0.17 -0.72 0.04 -1.26 -5.08 135.00 127.79 2k8p s PRO 20 Ca 0.35 0.58 0.06 0.00 0.04 0.00 0.00 61.00 62.02 2k8p s PRO 20 Cb 0.14 -1.75 -0.05 0.00 0.04 0.00 0.00 34.50 32.89 2k8p s PRO 20 CO -0.13 -2.65 -0.11 -1.21 0.04 0.00 0.00 177.00 172.95 2k8p s GLU 21 N -4.95 1.17 0.96 4.56 2.02 -1.26 -5.16 118.70 116.04 2k8p s GLU 21 Ca 0.65 -1.52 -0.12 0.00 0.02 0.00 0.00 54.97 54.00 2k8p s GLU 21 Cb -0.18 -0.79 0.17 0.00 0.10 0.00 0.00 34.13 33.42 2k8p s GLU 21 CO 0.57 0.10 1.09 -1.25 0.02 0.00 0.00 175.26 175.80 2k8p s PRO 22 N -3.72 0.74 0.96 0.39 0.04 -1.26 -5.04 135.00 127.12 2k8p s PRO 22 Ca 0.20 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.75 2k8p s PRO 22 Cb 0.02 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 32.96 2k8p s PRO 22 CO 0.03 -2.55 1.09 -1.25 0.04 0.00 0.00 177.00 174.37 2k8p s PRO 23 N -4.95 0.72 0.63 0.56 0.04 -1.26 -5.02 135.00 125.73 2k8p s PRO 23 Ca 0.65 0.64 -0.16 0.00 0.04 0.00 0.00 61.00 62.16 2k8p s PRO 23 Cb -0.18 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 2k8p s PRO 23 CO 0.57 -2.56 1.11 -1.25 0.04 0.00 0.00 177.00 174.92 2k8p s PRO 24 N -4.95 2.95 -0.33 0.56 0.04 -1.26 -5.03 135.00 126.99 2k8p s PRO 24 Ca 0.65 1.44 -0.09 0.00 0.04 0.00 0.00 61.00 63.03 2k8p s PRO 24 Cb -0.18 -1.97 0.20 0.00 0.04 0.00 0.00 34.50 32.59 2k8p s PRO 24 CO 0.57 -1.14 1.08 -1.83 0.04 0.00 0.00 177.00 175.72 2k8p s GLU 25 N -3.90 0.16 -0.31 4.56 -1.05 -1.26 -5.05 118.70 111.85 2k8p s GLU 25 Ca 0.68 -0.09 0.10 0.00 -0.15 0.00 0.00 54.97 55.52 2k8p s GLU 25 Cb -0.21 0.01 0.35 0.00 -0.44 0.00 0.00 34.13 33.84 2k8p s GLU 25 CO 0.38 -0.22 1.38 1.47 0.95 0.00 0.00 175.26 179.22 2k8p n LEU 26 N 3.35 -1.36 -4.69 1.83 -0.00 -1.26 -5.15 117.00 109.72 2k8p n LEU 26 Ca 0.07 -2.96 -0.31 0.00 -0.00 0.00 0.00 56.01 52.81 2k8p n LEU 26 Cb 0.64 0.21 0.15 0.00 -0.00 0.00 0.00 43.42 44.42 2k8p n LEU 26 CO -0.12 1.65 0.68 -1.61 -0.00 0.00 0.00 177.39 177.99 2k8p s GLU 27 N 0.12 1.27 0.20 1.47 2.02 -1.26 -5.06 118.70 117.46 2k8p s GLU 27 Ca 0.10 1.40 -0.01 0.00 0.02 0.00 0.00 54.97 56.48 2k8p s GLU 27 Cb 0.38 -1.77 -0.04 0.00 0.10 0.00 0.00 34.13 32.80 2k8p s GLU 27 CO -0.10 -2.41 0.11 1.21 0.02 0.00 0.00 175.26 174.09 2k8p s ASN 28 N -2.88 0.32 0.03 -0.19 3.04 -1.26 -5.18 114.94 108.83 2k8p s ASN 28 Ca 0.65 -1.36 -0.02 0.00 0.04 0.00 0.00 52.86 52.17 2k8p s ASN 28 Cb -0.21 0.34 -0.02 0.00 -1.54 0.00 0.00 41.25 39.81 2k8p s ASN 28 CO 0.58 -0.81 0.00 0.20 -3.04 0.00 0.00 177.10 174.03 2k8p s ASN 29 N -3.17 0.29 0.26 -4.21 0.01 -1.26 -5.17 114.94 101.69 2k8p s ASN 29 Ca 0.37 -0.64 0.06 0.00 -0.71 0.00 0.00 52.86 51.93 2k8p s ASN 29 Cb 0.07 0.16 -0.05 0.00 0.41 0.00 0.00 41.25 41.84 2k8p s ASN 29 CO 0.11 -0.44 -0.05 -1.59 -1.51 0.00 0.00 177.10 173.62 2k8p s LYS 30 N -2.43 1.46 0.27 -0.60 0.00 -1.26 -5.17 119.74 112.02 2k8p s LYS 30 Ca -0.07 -1.73 -0.05 0.00 0.00 0.00 0.00 55.97 54.12 2k8p s LYS 30 Cb -0.03 -0.99 -0.01 0.00 0.00 0.00 0.00 37.83 36.80 2k8p s LYS 30 CO -0.04 0.01 0.36 -0.08 0.00 0.00 0.00 175.35 175.60 2k8p s THR 31 N -3.13 0.00 0.35 3.79 -1.32 -1.26 -5.19 115.64 108.88 2k8p s THR 31 Ca 0.28 -1.67 0.03 0.00 -1.21 0.00 0.00 61.69 59.12 2k8p s THR 31 Cb 0.04 -2.44 -0.01 0.00 -1.51 0.00 0.00 72.50 68.58 2k8p s THR 31 CO 0.10 0.00 0.39 0.23 -2.21 0.00 0.00 174.62 173.14 2k8p n MET 32 N -0.42 0.57 -4.27 7.08 2.81 -1.26 -5.19 117.12 116.44 2k8p n MET 32 Ca 0.01 -3.13 -0.15 0.00 -1.81 0.00 0.00 57.70 52.62 2k8p n MET 32 Cb 0.63 2.78 -0.10 0.00 -0.71 0.00 0.00 33.22 35.81 2k8p n MET 32 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 2k8p s ASN 33 N -3.30 1.39 0.25 7.83 2.47 -1.26 -5.17 114.94 117.15 2k8p s ASN 33 Ca 0.35 -1.20 -0.02 0.00 0.42 0.00 0.00 52.86 52.41 2k8p s ASN 33 Cb 0.01 0.09 -0.02 0.00 -1.45 0.00 0.00 41.25 39.87 2k8p s ASN 33 CO 0.25 -0.56 0.28 -0.13 -3.72 0.00 0.00 177.10 173.22 2k8p s ARG 34 N -3.91 1.47 0.32 0.43 0.52 -1.26 -5.19 118.95 111.34 2k8p s ARG 34 Ca 0.26 -1.64 -0.01 0.00 -0.52 0.00 0.00 55.73 53.83 2k8p s ARG 34 Cb 0.06 0.35 -0.01 0.00 0.52 0.00 0.00 34.95 35.86 2k8p s ARG 34 CO 0.06 -0.54 0.38 0.00 0.02 0.00 0.00 175.30 175.22 2k8p s ALA 35 N -3.85 1.03 -0.29 2.13 0.00 -1.26 -5.18 121.76 114.34 2k8p s ALA 35 Ca 0.35 -1.64 -0.24 0.00 0.00 0.00 0.00 51.96 50.43 2k8p s ALA 35 Cb 0.04 1.26 0.16 0.00 0.00 0.00 0.00 23.12 24.58 2k8p s ALA 35 CO 0.15 -0.74 1.23 -2.00 0.00 0.00 0.00 175.76 174.40 2k8p s GLU 36 N -3.35 0.27 0.27 0.00 2.12 -1.26 -5.19 118.70 111.55 2k8p s GLU 36 Ca 0.34 0.33 -0.17 0.00 0.36 0.00 0.00 54.97 55.82 2k8p s GLU 36 Cb 0.01 0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.53 2k8p s GLU 36 CO 0.20 -0.03 0.62 1.21 -0.54 0.00 0.00 175.26 176.72 2k8p s ASN 37 N 0.24 -0.18 -0.28 -1.70 2.47 -1.26 -5.19 114.94 109.05 2k8p s ASN 37 Ca 0.04 -0.76 -0.34 0.00 0.42 0.00 0.00 52.86 52.22 2k8p s ASN 37 Cb -0.05 0.67 0.17 0.00 -1.45 0.00 0.00 41.25 40.60 2k8p s ASN 37 CO -0.11 -1.27 1.36 -0.83 -3.72 0.00 0.00 177.10 172.53 2k8p s GLY 38 N -2.97 -0.07 0.29 1.21 0.00 -1.26 -5.19 107.32 99.33 2k8p s GLY 38 Ca 0.16 2.34 -0.19 0.00 0.00 0.00 0.00 44.72 47.03 2k8p s GLY 38 CO 0.08 0.86 0.92 -0.32 0.00 0.00 0.00 173.10 174.64 2k8p s GLY 39 N -1.55 0.26 0.11 0.20 0.00 -1.26 -5.18 107.32 99.90 2k8p s GLY 39 Ca 0.10 -0.57 0.04 0.00 0.00 0.00 0.00 44.72 44.29 2k8p s GLY 39 CO -0.05 1.18 -0.10 1.09 0.00 0.00 0.00 173.10 175.22 2k8p s ARG 40 N -2.16 0.92 0.96 2.90 3.03 -1.26 -5.16 118.95 118.18 2k8p s ARG 40 Ca 0.19 -1.28 -0.12 0.00 2.03 0.00 0.00 55.73 56.55 2k8p s ARG 40 Cb -0.04 -0.53 0.17 0.00 -1.03 0.00 0.00 34.95 33.52 2k8p s ARG 40 CO 0.08 0.07 1.09 -1.25 -1.13 0.00 0.00 175.30 174.16 2k8p s PRO 41 N -3.26 0.74 0.12 3.89 0.04 -1.26 -5.06 135.00 130.22 2k8p s PRO 41 Ca 0.10 0.64 -0.02 0.00 0.04 0.00 0.00 61.00 61.76 2k8p s PRO 41 Cb 0.00 -1.76 0.03 0.00 0.04 0.00 0.00 34.50 32.81 2k8p s PRO 41 CO -0.00 -2.55 0.11 -0.35 0.04 0.00 0.00 177.00 174.25 2k8p n PRO 42 N -4.07 -1.23 -2.41 0.56 -0.04 -1.26 -5.06 135.00 121.49 2k8p n PRO 42 Ca 0.06 -0.17 -0.25 0.00 -0.04 0.00 0.00 63.50 63.10 2k8p n PRO 42 Cb 0.56 -0.16 0.10 0.00 -0.04 0.00 0.00 33.50 33.96 2k8p n PRO 42 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2k8p s HIS 43 N -1.20 2.07 -0.47 0.54 3.76 -1.26 -5.08 115.29 113.65 2k8p s HIS 43 Ca 0.07 0.01 0.06 0.00 -0.15 0.00 0.00 55.06 55.05 2k8p s HIS 43 Cb -0.01 -3.17 0.22 0.00 1.11 0.00 0.00 32.58 30.73 2k8p s HIS 43 CO 0.05 -1.66 0.72 0.72 -0.85 0.00 0.00 174.74 173.72 2k8p n HIS 44 N -2.92 -2.61 -0.87 1.40 8.25 -1.26 -5.15 115.22 112.05 2k8p n HIS 44 Ca 0.12 -2.19 -0.20 0.00 -0.26 0.00 0.00 57.72 55.19 2k8p n HIS 44 Cb 0.60 1.02 0.17 0.00 1.12 0.00 0.00 29.99 32.91 2k8p n HIS 44 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2k8p n PRO 45 N 2.04 -2.47 -3.93 -0.41 -0.04 -1.26 -5.10 135.00 123.83 2k8p n PRO 45 Ca 0.16 -1.19 -0.11 0.00 -0.04 0.00 0.00 63.50 62.32 2k8p n PRO 45 Cb 0.58 -1.11 -0.01 0.00 -0.04 0.00 0.00 33.50 32.92 2k8p n PRO 45 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2k8p s PHE 46 N -2.35 0.52 0.26 0.54 -0.71 -1.26 -5.19 117.98 109.79 2k8p s PHE 46 Ca 0.48 -1.00 -0.01 0.00 -1.04 0.00 0.00 56.93 55.37 2k8p s PHE 46 Cb -0.05 0.43 -0.03 0.00 -1.21 0.00 0.00 43.02 42.17 2k8p s PHE 46 CO 0.37 -1.37 0.27 -1.21 -1.34 0.00 0.00 175.22 171.94 2k8p s GLU 47 N -2.69 1.50 -0.29 1.99 2.02 -1.26 -5.17 118.70 114.80 2k8p s GLU 47 Ca 0.22 -1.70 -0.15 0.00 0.02 0.00 0.00 54.97 53.37 2k8p s GLU 47 Cb -0.03 0.34 0.10 0.00 0.10 0.00 0.00 34.13 34.64 2k8p s GLU 47 CO 0.15 -0.55 0.71 0.99 0.02 0.00 0.00 175.26 176.58 2k8p s THR 48 N -3.79 -0.22 0.38 3.63 2.01 -1.26 -5.18 115.64 111.22 2k8p s THR 48 Ca 0.36 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.42 2k8p s THR 48 Cb 0.04 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2k8p s THR 48 CO 0.17 0.00 0.22 -0.54 -0.69 0.00 0.00 174.62 173.78 2k8p s LYS 49 N 1.89 1.89 -0.22 4.92 -0.14 -1.26 -5.18 119.74 121.65 2k8p s LYS 49 Ca -0.09 -2.14 -0.33 0.00 -1.36 0.00 0.00 55.97 52.05 2k8p s LYS 49 Cb -0.06 -0.09 0.15 0.00 -1.68 0.00 0.00 37.83 36.15 2k8p s LYS 49 CO -0.19 -0.61 1.22 0.34 -0.76 0.00 0.00 175.35 175.35 2k8p s ASP 50 N -3.51 -0.14 -0.23 2.83 -1.08 -1.26 -5.19 116.67 108.09 2k8p s ASP 50 Ca 0.32 0.07 -0.31 0.00 -0.52 0.00 0.00 52.55 52.12 2k8p s ASP 50 Cb 0.02 0.13 0.16 0.00 -1.46 0.00 0.00 42.92 41.77 2k8p s ASP 50 CO 0.22 -0.19 1.23 0.54 0.52 0.00 0.00 175.17 177.49 2k8p s VAL 51 N -1.79 0.00 -0.23 1.11 0.11 -1.26 -5.19 120.40 113.15 2k8p s VAL 51 Ca 0.08 0.00 -0.32 0.00 -2.93 0.00 0.00 61.98 58.81 2k8p s VAL 51 Cb -0.01 -1.00 0.16 0.00 -1.53 0.00 0.00 36.38 34.00 2k8p s VAL 51 CO -0.05 0.00 1.24 -0.55 -3.33 0.00 0.00 175.10 172.41 2k8p s SER 52 N -1.26 -0.13 0.00 3.54 0.15 -1.26 -5.08 113.70 109.66 2k8p s SER 52 Ca 0.06 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.81 2k8p s SER 52 Cb -0.01 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.42 2k8p s SER 52 CO -0.05 -0.16 0.00 1.21 1.20 0.00 0.00 173.24 175.45 2k8p n GLU 53 N 0.35 0.00 -1.20 5.44 4.07 -1.26 -5.08 120.64 122.96 2k8p n GLU 53 Ca -0.02 0.00 -0.29 0.00 -0.06 0.00 0.00 57.16 56.80 2k8p n GLU 53 Cb 0.58 -0.07 0.18 0.00 -0.06 0.00 0.00 31.44 32.08 2k8p n GLU 53 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 2k8p s TYR 54 N -0.56 1.95 -0.85 4.31 1.51 -1.26 -4.96 117.35 117.48 2k8p s TYR 54 Ca 0.00 0.89 -0.18 0.00 -1.01 0.00 0.00 57.07 56.77 2k8p s TYR 54 Cb 0.00 -3.31 0.14 0.00 -0.11 0.00 0.00 41.96 38.68 2k8p s TYR 54 CO 0.00 -2.99 0.99 -1.12 -1.11 0.00 0.00 175.55 171.31 2k8p s SER 55 N -3.58 6.58 -0.25 2.29 0.01 -1.26 -4.94 113.70 112.55 2k8p s SER 55 Ca 0.66 -2.05 -0.22 0.00 1.31 0.00 0.00 55.95 55.65 2k8p s SER 55 Cb -0.17 -2.35 0.06 0.00 0.21 0.00 0.00 66.02 63.78 2k8p s SER 55 CO 0.57 -0.98 0.65 0.00 0.41 0.00 0.00 173.24 173.89 2k8p s ARG 57 N 0.46 2.13 -0.29 0.00 3.52 0.97 -4.91 118.95 120.84 2k8p s ARG 57 Ca -0.01 0.90 -0.29 0.00 -0.13 0.00 0.00 55.73 56.20 2k8p s ARG 57 Cb -0.05 -4.63 -0.00 0.00 -1.56 0.00 0.00 34.95 28.71 2k8p s ARG 57 CO -0.01 -3.44 1.33 -1.21 -0.81 0.00 0.00 175.30 171.16 2k8p s GLU 58 N 8.05 3.91 -0.18 5.12 2.02 -1.26 -3.23 118.70 133.13 2k8p s GLU 58 Ca 0.88 1.30 -0.19 0.00 0.02 0.00 0.00 54.97 56.98 2k8p s GLU 58 Cb -0.14 -3.89 -0.03 0.00 0.10 0.00 0.00 34.13 30.16 2k8p s GLU 58 CO 0.19 -1.12 0.52 -0.51 0.02 0.00 0.00 175.26 174.36 2k8p s LEU 59 N 4.42 4.18 -0.21 1.80 2.01 -0.98 -4.94 118.68 124.97 2k8p s LEU 59 Ca 0.58 0.73 0.01 0.00 0.01 0.00 0.00 54.13 55.46 2k8p s LEU 59 Cb -0.18 -2.73 0.04 0.00 0.01 0.00 0.00 46.19 43.34 2k8p s LEU 59 CO 0.23 -0.15 -0.13 -1.00 1.01 0.00 0.00 176.35 176.32 2k8p s HIS 60 N 1.43 2.70 0.00 0.29 3.76 -1.26 -0.20 115.29 122.01 2k8p s HIS 60 Ca 0.25 -1.77 0.03 0.00 -0.15 0.00 0.00 55.06 53.43 2k8p s HIS 60 Cb -0.15 -1.77 -0.03 0.00 1.11 0.00 0.00 32.58 31.73 2k8p s HIS 60 CO 0.10 -0.79 -0.06 -0.06 -0.85 0.00 0.00 174.74 173.08 2k8p s PHE 61 N 1.30 2.89 0.16 1.40 0.40 -0.95 -4.99 117.98 118.20 2k8p s PHE 61 Ca -0.01 -0.04 0.10 0.00 -0.60 0.00 0.00 56.93 56.38 2k8p s PHE 61 Cb -0.16 -1.61 -0.04 0.00 0.51 0.00 0.00 43.02 41.72 2k8p s PHE 61 CO -0.09 0.38 -0.19 0.99 0.70 0.00 0.00 175.22 177.01 2k8p s THR 62 N -1.00 2.72 -0.22 0.64 2.01 -1.26 -2.00 115.64 116.53 2k8p s THR 62 Ca 0.17 -1.73 -0.37 0.00 0.31 0.00 0.00 61.69 60.07 2k8p s THR 62 Cb -0.11 -2.29 0.15 0.00 0.01 0.00 0.00 72.50 70.26 2k8p s THR 62 CO 0.08 -0.02 1.41 -0.60 -0.69 0.00 0.00 174.62 174.79 2k8p s ARG 63 N -2.48 0.02 0.11 4.92 3.52 -1.14 -4.99 118.95 118.92 2k8p s ARG 63 Ca 0.20 -0.01 -0.13 0.00 -0.13 0.00 0.00 55.73 55.66 2k8p s ARG 63 Cb -0.09 0.01 -0.06 0.00 -1.56 0.00 0.00 34.95 33.24 2k8p s ARG 63 CO 0.11 -0.01 0.50 0.71 -0.81 0.00 0.00 175.30 175.80 2k8p s TYR 64 N -2.02 3.61 -0.08 5.12 1.51 -1.26 -0.20 117.35 124.03 2k8p s TYR 64 Ca 0.13 0.98 0.01 0.00 -1.01 0.00 0.00 57.07 57.18 2k8p s TYR 64 Cb 0.02 -2.30 -0.03 0.00 -0.11 0.00 0.00 41.96 39.55 2k8p s TYR 64 CO -0.04 0.47 -0.11 0.54 -1.11 0.00 0.00 175.55 175.31 2k8p s VAL 65 N -1.41 3.34 -0.09 0.71 0.11 -1.26 -4.94 120.40 116.86 2k8p s VAL 65 Ca 0.35 -0.60 -0.04 0.00 -2.93 0.00 0.00 61.98 58.76 2k8p s VAL 65 Cb -0.15 -2.36 0.04 0.00 -1.53 0.00 0.00 36.38 32.38 2k8p s VAL 65 CO 0.18 0.57 0.20 0.42 -3.33 0.00 0.00 175.10 173.15 2k8p s THR 66 N -0.47 -0.05 -0.31 5.04 -4.23 -1.26 -1.78 115.64 112.58 2k8p s THR 66 Ca 0.06 0.17 -0.01 0.00 -1.18 0.00 0.00 61.69 60.73 2k8p s THR 66 Cb -0.12 -0.32 0.10 0.00 1.34 0.00 0.00 72.50 73.50 2k8p s THR 66 CO 0.02 0.07 0.10 -0.62 -0.54 0.00 0.00 174.62 173.65 2k8p s ASP 67 N 1.26 4.02 0.00 3.99 2.15 -1.24 -5.02 116.67 121.82 2k8p s ASP 67 Ca -0.09 -1.64 0.00 0.00 0.43 0.00 0.00 52.55 51.25 2k8p s ASP 67 Cb -0.11 -0.85 0.00 0.00 -0.30 0.00 0.00 42.92 41.66 2k8p s ASP 67 CO -0.07 -0.42 0.00 0.61 -0.17 0.00 0.00 175.17 175.12 2k8p n GLY 68 N 4.85 -1.39 0.00 2.66 0.00 -1.26 -4.22 105.19 105.83 2k8p n GLY 68 Ca -0.02 -1.79 0.07 0.00 0.00 0.00 0.00 46.02 44.28 2k8p n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k8p n PRO 69 N 0.00 0.16 -3.78 1.61 -0.04 -1.26 -4.74 135.00 126.95 2k8p n PRO 69 Ca 0.00 0.17 -0.21 0.00 -0.04 0.00 0.00 63.50 63.43 2k8p n PRO 69 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2k8p n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k8p s ARG 71 N -4.02 0.15 0.61 0.00 3.00 -0.12 -3.61 118.95 114.95 2k8p s ARG 71 Ca 0.40 -0.06 -0.18 0.00 0.00 0.00 0.00 55.73 55.88 2k8p s ARG 71 Cb -0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 34.95 34.68 2k8p s ARG 71 CO 0.28 0.04 0.97 0.45 0.00 0.00 0.00 175.30 177.04 2k8p n SER 72 N 3.05 0.78 0.08 0.23 2.88 -0.73 -0.48 113.62 119.43 2k8p n SER 72 Ca -0.12 0.80 -0.10 0.00 -1.33 0.00 0.00 58.87 58.11 2k8p n SER 72 Cb 0.59 -1.40 -0.09 0.00 -0.75 0.00 0.00 64.21 62.57 2k8p n SER 72 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k8p h ALA 73 N 0.43 0.32 -2.45 -1.46 0.00 -1.47 -3.45 119.26 111.18 2k8p h ALA 73 Ca -0.49 -0.85 -0.22 0.00 0.00 0.00 0.00 54.91 53.36 2k8p h ALA 73 Cb 1.36 -0.08 -0.16 0.00 0.00 0.00 0.00 17.79 18.91 2k8p h ALA 73 CO 0.51 1.06 -0.70 0.15 0.00 0.00 0.00 179.25 180.27 2k8p s LYS 74 N -2.84 0.72 1.07 0.00 1.02 -1.26 -5.12 119.74 113.33 2k8p s LYS 74 Ca -0.02 -1.17 -0.14 0.00 0.02 0.00 0.00 55.97 54.66 2k8p s LYS 74 Cb 0.09 -0.15 0.22 0.00 -0.52 0.00 0.00 37.83 37.47 2k8p s LYS 74 CO 0.84 -0.02 1.10 -1.25 -0.92 0.00 0.00 175.35 175.10 2k8p s PRO 75 N -3.30 -0.12 0.50 -1.68 0.04 -1.26 -4.63 135.00 124.55 2k8p s PRO 75 Ca 0.06 0.33 0.01 0.00 0.04 0.00 0.00 61.00 61.44 2k8p s PRO 75 Cb 0.02 -1.69 -0.01 0.00 0.04 0.00 0.00 34.50 32.86 2k8p s PRO 75 CO -0.04 -3.06 0.01 0.14 0.04 0.00 0.00 177.00 174.09 2k8p s VAL 76 N -2.98 1.11 -0.23 -0.36 -7.23 0.72 -4.96 120.40 106.48 2k8p s VAL 76 Ca 0.67 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.81 2k8p s VAL 76 Cb -0.16 -2.17 0.11 0.00 0.56 0.00 0.00 36.38 34.71 2k8p s VAL 76 CO 0.57 0.00 0.27 -0.89 -0.31 0.00 0.00 175.10 174.74 2k8p s THR 77 N -2.91 -0.40 -0.14 5.32 2.01 -1.26 -2.86 115.64 115.40 2k8p s THR 77 Ca 0.07 -0.16 -0.08 0.00 0.31 0.00 0.00 61.69 61.83 2k8p s THR 77 Cb 0.02 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.73 2k8p s THR 77 CO 0.04 -0.23 0.13 -1.83 -0.69 0.00 0.00 174.62 172.04 2k8p s GLU 78 N 2.38 3.66 0.25 4.92 -1.05 -0.85 -4.94 118.70 123.07 2k8p s GLU 78 Ca 0.09 -0.17 -0.06 0.00 -0.15 0.00 0.00 54.97 54.68 2k8p s GLU 78 Cb -0.15 -3.24 -0.06 0.00 -0.44 0.00 0.00 34.13 30.24 2k8p s GLU 78 CO -0.16 0.62 0.52 -1.17 0.95 0.00 0.00 175.26 176.02 2k8p s LEU 79 N -0.57 4.12 0.05 1.83 0.20 -1.26 -2.24 118.68 120.80 2k8p s LEU 79 Ca 0.13 0.72 0.01 0.00 0.69 0.00 0.00 54.13 55.68 2k8p s LEU 79 Cb -0.12 -3.51 -0.03 0.00 -0.43 0.00 0.00 46.19 42.10 2k8p s LEU 79 CO 0.02 -0.13 -0.06 -0.69 -0.29 0.00 0.00 176.35 175.20 2k8p s VAL 80 N -1.96 0.44 -0.22 1.68 1.01 0.72 -4.26 120.40 117.82 2k8p s VAL 80 Ca 0.44 -1.26 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 2k8p s VAL 80 Cb -0.11 -0.80 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 2k8p s VAL 80 CO 0.27 -0.55 0.22 0.00 0.00 0.00 0.00 175.10 175.05 2k8p s SER 82 N 0.98 -0.86 0.00 0.00 1.04 -1.20 -4.97 113.70 108.69 2k8p s SER 82 Ca 0.11 1.43 0.00 0.00 0.48 0.00 0.00 55.95 57.97 2k8p s SER 82 Cb -0.14 1.37 0.00 0.00 0.10 0.00 0.00 66.02 67.36 2k8p s SER 82 CO 0.05 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.65 2k8p n GLY 83 N 3.94 0.87 3.28 7.32 0.00 -1.26 -0.02 105.19 119.30 2k8p n GLY 83 Ca -0.19 -2.02 -0.14 0.00 0.00 0.00 0.00 46.02 43.67 2k8p n GLY 83 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k8p s GLN 84 N -1.33 0.67 0.23 1.61 0.74 -1.26 -3.72 119.66 116.61 2k8p s GLN 84 Ca 0.00 -0.01 0.07 0.00 0.05 0.00 0.00 55.36 55.47 2k8p s GLN 84 Cb 0.00 0.31 -0.04 0.00 1.10 0.00 0.00 33.01 34.38 2k8p s GLN 84 CO 0.00 -0.18 0.12 0.00 -0.55 0.00 0.00 175.29 174.69 2k8p s GLY 86 N -3.61 1.59 1.08 0.00 0.00 -1.26 -4.92 107.32 100.20 2k8p s GLY 86 Ca 0.32 -0.61 -0.15 0.00 0.00 0.00 0.00 44.72 44.28 2k8p s GLY 86 CO 0.23 -0.12 1.10 2.56 0.00 0.00 0.00 173.10 176.87 2k8p s PRO 87 N -5.52 -0.22 -0.06 2.90 0.04 -1.26 -5.01 135.00 125.87 2k8p s PRO 87 Ca 0.62 0.29 0.14 0.00 0.04 0.00 0.00 61.00 62.09 2k8p s PRO 87 Cb -0.12 -1.68 0.26 0.00 0.04 0.00 0.00 34.50 33.01 2k8p s PRO 87 CO 0.50 -3.12 1.12 0.00 0.04 0.00 0.00 177.00 175.54 2k8p n ALA 88 N -4.41 2.46 -2.46 8.56 0.00 -1.26 -5.08 120.51 118.33 2k8p n ALA 88 Ca 0.08 -2.14 -0.22 0.00 0.00 0.00 0.00 53.44 51.16 2k8p n ALA 88 Cb 0.58 -0.53 -0.10 0.00 0.00 0.00 0.00 19.45 19.40 2k8p n ALA 88 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k8p s ARG 89 N -1.10 1.62 -0.28 0.00 0.52 -1.26 -5.16 118.95 113.29 2k8p s ARG 89 Ca 0.23 -1.84 -0.18 0.00 -0.52 0.00 0.00 55.73 53.43 2k8p s ARG 89 Cb 0.24 -1.21 0.11 0.00 0.52 0.00 0.00 34.95 34.61 2k8p s ARG 89 CO -0.06 0.01 0.83 -1.17 0.02 0.00 0.00 175.30 174.94 2k8p s LEU 90 N -3.48 -0.72 0.24 2.53 1.98 -1.26 -5.18 118.68 112.79 2k8p s LEU 90 Ca 0.31 1.18 0.11 0.00 -2.89 0.00 0.00 54.13 52.84 2k8p s LEU 90 Cb 0.05 2.10 -0.05 0.00 0.66 0.00 0.00 46.19 48.95 2k8p s LEU 90 CO 0.13 -0.19 -0.16 -0.76 -1.89 0.00 0.00 176.35 173.48 2k8p s LEU 91 N 1.30 2.70 0.09 -0.68 2.01 -1.26 -5.06 118.68 117.78 2k8p s LEU 91 Ca -0.08 -0.85 -0.16 0.00 0.01 0.00 0.00 54.13 53.06 2k8p s LEU 91 Cb -0.04 -1.31 -0.10 0.00 0.01 0.00 0.00 46.19 44.75 2k8p s LEU 91 CO -0.15 0.07 1.40 1.55 1.01 0.00 0.00 176.35 180.23 2k8p h PRO 92 N 2.59 0.63 0.00 1.29 0.13 -2.04 -3.36 132.00 131.25 2k8p h PRO 92 Ca -0.44 -0.33 -0.12 0.00 -0.87 0.00 0.00 66.00 64.24 2k8p h PRO 92 Cb 1.23 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 2k8p h PRO 92 CO 0.56 0.93 -1.66 -1.71 -0.23 0.00 0.00 178.00 175.89 2k8p n ASN 93 N -4.32 2.38 -3.11 1.44 2.85 -1.26 -5.04 115.26 108.19 2k8p n ASN 93 Ca -0.04 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.28 2k8p n ASN 93 Cb 0.45 1.04 0.08 0.00 1.24 0.00 0.00 39.78 42.58 2k8p n ASN 93 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k8p n ALA 94 N -2.22 -1.73 -1.63 5.20 0.00 -1.26 -4.89 120.51 113.98 2k8p n ALA 94 Ca -0.12 -0.04 -0.48 0.00 0.00 0.00 0.00 53.44 52.81 2k8p n ALA 94 Cb 0.65 -2.28 -0.04 0.00 0.00 0.00 0.00 19.45 17.78 2k8p n ALA 94 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k8p n ILE 95 N -3.76 0.30 0.00 0.00 -5.35 -1.26 -4.93 119.36 104.36 2k8p n ILE 95 Ca -0.24 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 2k8p n ILE 95 Cb 0.64 -1.20 0.00 0.00 -1.74 0.00 0.00 39.64 37.34 2k8p n ILE 95 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2k8p n GLY 96 N 2.71 2.06 2.03 3.28 0.00 -1.26 -5.11 105.19 108.90 2k8p n GLY 96 Ca 0.16 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2k8p n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8p n ARG 97 N 0.00 0.00 0.00 1.61 1.74 -1.26 -5.10 116.66 113.65 2k8p n ARG 97 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2k8p n ARG 97 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2k8p n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k8p n GLY 98 N 1.11 0.09 5.37 -0.13 0.00 -1.26 -5.08 105.19 105.30 2k8p n GLY 98 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2k8p n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k8p n LYS 99 N 0.00 -0.72 -2.61 1.61 4.76 -1.26 -4.95 118.16 114.99 2k8p n LYS 99 Ca 0.00 0.48 -0.09 0.00 -2.87 0.00 0.00 58.31 55.82 2k8p n LYS 99 Cb 0.00 -0.88 -0.01 0.00 -1.84 0.00 0.00 35.03 32.29 2k8p n LYS 99 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 2k8p n TRP 100 N -2.30 -0.14 -3.15 2.13 8.01 -1.26 -4.93 117.44 115.80 2k8p n TRP 100 Ca 0.00 -0.73 -0.21 0.00 -1.31 0.00 0.00 57.50 55.25 2k8p n TRP 100 Cb 0.16 -0.11 0.02 0.00 -2.01 0.00 0.00 31.31 29.37 2k8p n TRP 100 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.69 177.59 2k8p n TRP 101 N -0.54 -3.13 -0.84 -5.99 7.02 -1.26 -4.93 117.44 107.78 2k8p n TRP 101 Ca -0.05 1.28 -0.31 0.00 -1.02 0.00 0.00 57.50 57.40 2k8p n TRP 101 Cb 0.19 -3.10 0.15 0.00 -2.42 0.00 0.00 31.31 26.13 2k8p n TRP 101 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2k8p s ARG 102 N -2.59 1.24 0.66 -0.99 3.00 -1.26 -4.99 118.95 114.03 2k8p s ARG 102 Ca 0.30 1.42 -0.15 0.00 0.00 0.00 0.00 55.73 57.30 2k8p s ARG 102 Cb -0.06 -1.76 0.00 0.00 0.00 0.00 0.00 34.95 33.13 2k8p s ARG 102 CO 0.82 -2.43 1.11 -1.25 0.00 0.00 0.00 175.30 173.55 2k8p s PRO 103 N -4.71 2.78 -1.42 3.54 0.04 -1.26 -3.62 135.00 130.36 2k8p s PRO 103 Ca 0.65 1.38 -0.10 0.00 0.04 0.00 0.00 61.00 62.98 2k8p s PRO 103 Cb -0.21 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.41 2k8p s PRO 103 CO 0.58 -1.26 1.11 0.43 0.04 0.00 0.00 177.00 177.89 2k8p n SER 104 N -2.45 -5.96 -1.83 6.66 7.64 -1.26 -4.99 113.62 111.42 2k8p n SER 104 Ca 0.10 -0.59 0.00 0.00 1.01 0.00 0.00 58.87 59.39 2k8p n SER 104 Cb 0.52 -4.71 0.00 0.00 -1.01 0.00 0.00 64.21 59.01 2k8p n SER 104 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k8p n GLY 105 N -1.91 1.38 3.58 0.23 0.00 -1.24 -5.01 105.19 102.23 2k8p n GLY 105 Ca 0.01 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 2k8p n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k8p s PRO 106 N -1.63 3.15 0.22 1.61 0.04 -1.26 -4.91 135.00 132.22 2k8p s PRO 106 Ca 0.00 1.08 -0.21 0.00 0.04 0.00 0.00 61.00 61.91 2k8p s PRO 106 Cb 0.00 -4.23 0.07 0.00 0.04 0.00 0.00 34.50 30.38 2k8p s PRO 106 CO 0.00 -2.09 0.97 0.34 0.04 0.00 0.00 177.00 176.26 2k8p s ASP 107 N 6.37 -0.03 1.18 6.66 -1.08 -1.26 -5.03 116.67 123.48 2k8p s ASP 107 Ca 0.73 -0.73 -0.12 0.00 -0.52 0.00 0.00 52.55 51.90 2k8p s ASP 107 Cb -0.18 0.58 0.19 0.00 -1.46 0.00 0.00 42.92 42.04 2k8p s ASP 107 CO 0.29 -1.13 0.58 0.49 0.52 0.00 0.00 175.17 175.92 2k8p n PHE 108 N -0.62 -3.36 0.08 -5.34 3.01 -1.26 -4.98 117.46 104.99 2k8p n PHE 108 Ca -0.05 -0.53 0.00 0.00 1.01 0.00 0.00 57.45 57.88 2k8p n PHE 108 Cb 0.60 -0.66 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 2k8p n PHE 108 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2k8p n ARG 109 N -3.63 0.00 -4.00 -1.08 1.74 -1.03 -4.56 116.66 104.10 2k8p n ARG 109 Ca 0.08 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.93 2k8p n ARG 109 Cb 0.33 0.00 -0.17 0.00 -1.02 0.00 0.00 32.46 31.61 2k8p n ARG 109 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k8p s ILE 111 N 1.47 5.31 1.20 0.00 -4.36 0.11 -4.86 121.20 120.06 2k8p s ILE 111 Ca -0.02 -0.56 -0.19 0.00 -0.26 0.00 0.00 60.65 59.63 2k8p s ILE 111 Cb -0.13 -3.72 0.28 0.00 1.25 0.00 0.00 42.46 40.14 2k8p s ILE 111 CO -0.04 -0.06 1.11 -2.16 0.24 0.00 0.00 174.94 174.03 2k8p s PRO 112 N -3.10 -1.17 0.00 0.37 0.04 -1.26 -1.15 135.00 128.73 2k8p s PRO 112 Ca 0.35 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.36 2k8p s PRO 112 Cb -0.11 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 32.83 2k8p s PRO 112 CO 0.28 -3.68 0.00 -3.47 0.04 0.00 0.00 177.00 170.17 2k8p n ASP 113 N -4.75 0.00 -4.57 6.66 -0.08 -1.20 -4.13 116.55 108.49 2k8p n ASP 113 Ca 0.13 -0.98 -0.44 0.00 -1.51 0.00 0.00 54.79 51.99 2k8p n ASP 113 Cb 0.59 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 44.04 2k8p n ASP 113 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 2k8p n ARG 114 N 0.00 1.20 -3.23 -0.67 0.63 -1.26 -4.63 116.66 108.69 2k8p n ARG 114 Ca 0.00 0.42 -0.20 0.00 -0.92 0.00 0.00 57.85 57.15 2k8p n ARG 114 Cb 0.00 -1.79 0.02 0.00 0.45 0.00 0.00 32.46 31.14 2k8p n ARG 114 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2k8p s TYR 115 N -1.13 1.99 -0.10 -0.14 1.51 -1.26 -1.17 117.35 117.05 2k8p s TYR 115 Ca 0.60 -0.63 -0.04 0.00 -1.01 0.00 0.00 57.07 56.00 2k8p s TYR 115 Cb -0.68 -2.20 0.05 0.00 -0.11 0.00 0.00 41.96 39.02 2k8p s TYR 115 CO 0.59 -0.71 0.18 0.50 -1.11 0.00 0.00 175.55 175.00 2k8p s ARG 116 N -4.45 0.06 -0.44 -0.62 6.06 0.92 -4.50 118.95 115.98 2k8p s ARG 116 Ca 0.54 0.57 -0.24 0.00 -2.50 0.00 0.00 55.73 54.10 2k8p s ARG 116 Cb -0.06 -0.31 0.02 0.00 0.06 0.00 0.00 34.95 34.67 2k8p s ARG 116 CO 0.33 -0.33 0.85 0.00 -2.50 0.00 0.00 175.30 173.65 2k8p s ALA 117 N 2.32 3.29 -0.08 6.12 0.00 -1.26 -1.50 121.76 130.64 2k8p s ALA 117 Ca 0.03 -0.86 -0.07 0.00 0.00 0.00 0.00 51.96 51.06 2k8p s ALA 117 Cb -0.12 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 2k8p s ALA 117 CO -0.07 -1.92 0.19 -1.14 0.00 0.00 0.00 175.76 172.82 2k8p s GLN 118 N 3.46 3.50 -0.02 0.00 0.74 -0.33 -4.89 119.66 122.12 2k8p s GLN 118 Ca 0.33 -0.10 0.01 0.00 0.05 0.00 0.00 55.36 55.65 2k8p s GLN 118 Cb -0.11 -3.17 -0.03 0.00 1.10 0.00 0.00 33.01 30.79 2k8p s GLN 118 CO 0.23 0.74 -0.00 1.03 -0.55 0.00 0.00 175.29 176.74 2k8p s ARG 119 N -1.25 2.84 0.28 1.67 0.52 -1.26 -0.10 118.95 121.64 2k8p s ARG 119 Ca 0.19 -0.56 0.08 0.00 -0.52 0.00 0.00 55.73 54.92 2k8p s ARG 119 Cb -0.13 -2.70 -0.06 0.00 0.52 0.00 0.00 34.95 32.59 2k8p s ARG 119 CO 0.08 0.65 -0.09 0.14 0.02 0.00 0.00 175.30 176.10 2k8p s VAL 120 N -1.03 1.83 -0.34 3.52 -7.23 0.12 -4.95 120.40 112.31 2k8p s VAL 120 Ca 0.18 -2.18 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 2k8p s VAL 120 Cb -0.11 -2.40 0.09 0.00 0.56 0.00 0.00 36.38 34.52 2k8p s VAL 120 CO 0.08 -0.34 0.06 -1.58 -0.31 0.00 0.00 175.10 173.01 2k8p s GLN 121 N -3.68 1.82 -0.18 4.82 0.74 -1.26 -1.50 119.66 120.42 2k8p s GLN 121 Ca 0.29 -1.73 -0.20 0.00 0.05 0.00 0.00 55.36 53.77 2k8p s GLN 121 Cb 0.02 -3.26 -0.03 0.00 1.10 0.00 0.00 33.01 30.84 2k8p s GLN 121 CO 0.12 -0.89 0.60 -0.51 -0.55 0.00 0.00 175.29 174.06 2k8p s LEU 122 N 1.03 4.16 0.05 3.68 1.43 -0.46 -1.17 118.68 127.40 2k8p s LEU 122 Ca 0.06 0.82 -0.03 0.00 -1.03 0.00 0.00 54.13 53.95 2k8p s LEU 122 Cb -0.20 -2.85 -0.04 0.00 0.03 0.00 0.00 46.19 43.13 2k8p s LEU 122 CO -0.06 -0.22 0.24 -0.76 0.23 0.00 0.00 176.35 175.78 2k8p s LEU 123 N 1.69 4.35 0.24 1.79 2.01 0.37 0.05 118.68 129.16 2k8p s LEU 123 Ca 0.28 0.40 0.10 0.00 0.01 0.00 0.00 54.13 54.92 2k8p s LEU 123 Cb -0.16 -2.89 -0.04 0.00 0.01 0.00 0.00 46.19 43.11 2k8p s LEU 123 CO 0.11 0.19 -0.11 0.00 1.01 0.00 0.00 176.35 177.54 2k8p s PRO 125 N -3.26 -0.94 4.64 0.00 0.04 -1.26 -4.63 135.00 129.59 2k8p s PRO 125 Ca 0.28 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.35 2k8p s PRO 125 Cb -0.07 -1.62 0.00 0.00 0.04 0.00 0.00 34.50 32.85 2k8p s PRO 125 CO 0.16 -3.55 0.00 0.41 0.04 0.00 0.00 177.00 174.07 2k8p n GLY 126 N -0.98 3.14 0.56 0.56 0.00 -1.26 -2.22 105.19 105.00 2k8p n GLY 126 Ca 0.12 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.16 2k8p n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k8p n GLY 127 N 0.00 0.19 3.65 -0.02 0.00 -1.26 -4.99 105.19 102.75 2k8p n GLY 127 Ca 0.00 -0.51 -0.50 0.00 0.00 0.00 0.00 46.02 45.01 2k8p n GLY 127 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k8p n GLU 128 N 0.48 1.65 -0.92 1.61 1.02 -0.94 -4.92 120.64 118.62 2k8p n GLU 128 Ca 0.09 0.60 -0.31 0.00 -0.02 0.00 0.00 57.16 57.52 2k8p n GLU 128 Cb 0.41 -2.33 0.14 0.00 -0.02 0.00 0.00 31.44 29.64 2k8p n GLU 128 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k8p s ALA 129 N 1.73 1.78 1.19 0.62 0.00 -1.26 -4.20 121.76 121.62 2k8p s ALA 129 Ca 0.86 0.48 -0.19 0.00 0.00 0.00 0.00 51.96 53.11 2k8p s ALA 129 Cb -0.84 -3.39 0.28 0.00 0.00 0.00 0.00 23.12 19.18 2k8p s ALA 129 CO 0.48 -2.37 1.11 -1.25 0.00 0.00 0.00 175.76 173.72 2k8p s PRO 130 N -4.73 -1.12 -0.20 0.00 0.04 -1.26 -4.42 135.00 123.31 2k8p s PRO 130 Ca 0.65 -0.03 -0.05 0.00 0.04 0.00 0.00 61.00 61.61 2k8p s PRO 130 Cb -0.21 -1.60 0.10 0.00 0.04 0.00 0.00 34.50 32.83 2k8p s PRO 130 CO 0.57 -3.65 0.35 0.50 0.04 0.00 0.00 177.00 174.81 2k8p s ARG 131 N -5.37 0.28 0.21 4.56 3.00 0.11 -4.98 118.95 116.76 2k8p s ARG 131 Ca 0.70 0.74 -0.30 0.00 -1.00 0.00 0.00 55.73 55.88 2k8p s ARG 131 Cb -0.10 -0.13 -0.08 0.00 0.00 0.00 0.00 34.95 34.63 2k8p s ARG 131 CO 0.56 -0.42 1.03 0.00 0.00 0.00 0.00 175.30 176.47 2k8p s ALA 132 N 2.53 3.35 0.03 6.12 0.00 -1.26 -1.36 121.76 131.16 2k8p s ALA 132 Ca 0.04 0.74 0.07 0.00 0.00 0.00 0.00 51.96 52.80 2k8p s ALA 132 Cb -0.13 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 2k8p s ALA 132 CO -0.13 -0.04 -0.19 0.50 0.00 0.00 0.00 175.76 175.90 2k8p s ARG 133 N -0.81 1.35 -0.11 0.00 6.06 -0.56 -4.94 118.95 119.93 2k8p s ARG 133 Ca 0.45 -0.84 -0.02 0.00 -2.50 0.00 0.00 55.73 52.82 2k8p s ARG 133 Cb -0.28 -1.41 -0.03 0.00 0.06 0.00 0.00 34.95 33.29 2k8p s ARG 133 CO 0.35 0.36 -0.04 0.21 -2.50 0.00 0.00 175.30 173.68 2k8p s LYS 134 N -0.98 3.24 -0.15 5.12 2.20 -1.26 0.15 119.74 128.05 2k8p s LYS 134 Ca 0.06 -0.51 -0.01 0.00 -0.36 0.00 0.00 55.97 55.16 2k8p s LYS 134 Cb -0.08 -2.78 0.04 0.00 -1.51 0.00 0.00 37.83 33.50 2k8p s LYS 134 CO 0.01 0.47 -0.04 0.14 -0.36 0.00 0.00 175.35 175.57 2k8p s VAL 135 N -0.26 0.97 -0.61 4.02 -7.23 0.85 -4.98 120.40 113.16 2k8p s VAL 135 Ca 0.04 -0.51 -0.27 0.00 -1.81 0.00 0.00 61.98 59.44 2k8p s VAL 135 Cb -0.13 -1.16 0.03 0.00 0.56 0.00 0.00 36.38 35.69 2k8p s VAL 135 CO 0.02 0.14 1.16 -0.60 -0.31 0.00 0.00 175.10 175.51 2k8p s ARG 136 N 1.70 3.40 0.02 4.82 3.52 -1.26 -1.19 118.95 129.96 2k8p s ARG 136 Ca 0.01 0.02 0.08 0.00 -0.13 0.00 0.00 55.73 55.71 2k8p s ARG 136 Cb -0.15 -4.06 -0.03 0.00 -1.56 0.00 0.00 34.95 29.15 2k8p s ARG 136 CO -0.08 -1.75 -0.22 -0.51 -0.81 0.00 0.00 175.30 171.94 2k8p s LEU 137 N 4.91 2.37 0.33 -0.88 1.02 -0.57 -4.95 118.68 120.91 2k8p s LEU 137 Ca 0.38 -0.47 -0.27 0.00 0.02 0.00 0.00 54.13 53.79 2k8p s LEU 137 Cb -0.09 -1.41 -0.13 0.00 0.02 0.00 0.00 46.19 44.59 2k8p s LEU 137 CO 0.22 0.28 1.03 0.52 0.02 0.00 0.00 176.35 178.42 2k8p n VAL 138 N 1.86 2.08 -0.06 -1.59 0.31 -1.26 -0.06 118.33 119.61 2k8p n VAL 138 Ca -0.17 -0.50 -0.07 0.00 -0.01 0.00 0.00 64.34 63.60 2k8p n VAL 138 Cb 0.52 -1.09 -0.09 0.00 -0.91 0.00 0.00 33.84 32.26 2k8p n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k8p n ALA 139 N 0.06 1.69 -2.57 3.52 0.00 -0.40 -4.07 120.51 118.73 2k8p n ALA 139 Ca 0.09 -0.78 -0.15 0.00 0.00 0.00 0.00 53.44 52.60 2k8p n ALA 139 Cb 0.34 0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.74 2k8p n ALA 139 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2k8p s SER 140 N -4.66 0.81 -0.25 0.00 0.01 -0.31 -4.99 113.70 104.31 2k8p s SER 140 Ca -0.08 -1.47 -0.22 0.00 1.31 0.00 0.00 55.95 55.49 2k8p s SER 140 Cb 0.04 0.55 0.07 0.00 0.21 0.00 0.00 66.02 66.88 2k8p s SER 140 CO 0.48 -1.09 0.66 0.00 0.41 0.00 0.00 173.24 173.70 2k8p s LYS 142 N 0.52 1.57 -0.22 0.00 1.02 -0.30 -4.21 119.74 118.12 2k8p s LYS 142 Ca -0.01 -1.45 -0.05 0.00 0.02 0.00 0.00 55.97 54.47 2k8p s LYS 142 Cb -0.05 -1.90 -0.02 0.00 -0.52 0.00 0.00 37.83 35.34 2k8p s LYS 142 CO -0.02 0.42 0.01 0.00 -0.92 0.00 0.00 175.35 174.84 2k8p s LYS 144 N 1.35 0.62 -0.21 0.00 2.20 -0.42 -4.79 119.74 118.48 2k8p s LYS 144 Ca 0.04 -0.16 0.01 0.00 -0.36 0.00 0.00 55.97 55.51 2k8p s LYS 144 Cb -0.15 0.27 0.04 0.00 -1.51 0.00 0.00 37.83 36.49 2k8p s LYS 144 CO 0.01 -0.16 -0.13 0.50 -0.36 0.00 0.00 175.35 175.21 2k8p s ARG 145 N -1.20 2.30 0.88 4.03 3.52 -1.26 -2.46 118.95 124.76 2k8p s ARG 145 Ca -0.12 -0.96 -0.10 0.00 -0.13 0.00 0.00 55.73 54.41 2k8p s ARG 145 Cb -0.05 -2.57 0.17 0.00 -1.56 0.00 0.00 34.95 30.95 2k8p s ARG 145 CO 0.04 -0.41 1.21 -0.51 -0.81 0.00 0.00 175.30 174.81 2k8p s LEU 146 N 1.30 2.81 -0.29 -0.88 2.01 -1.26 -4.98 118.68 117.39 2k8p s LEU 146 Ca -0.02 0.04 -0.21 0.00 0.01 0.00 0.00 54.13 53.95 2k8p s LEU 146 Cb -0.16 -2.18 0.14 0.00 0.01 0.00 0.00 46.19 43.99 2k8p s LEU 146 CO -0.09 -2.42 1.06 0.28 1.01 0.00 0.00 176.35 176.19 2k8p s THR 147 N -3.62 0.00 -1.01 5.49 -1.32 -1.26 -4.54 115.64 109.38 2k8p s THR 147 Ca 0.71 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 61.19 2k8p s THR 147 Cb -0.04 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.94 2k8p s THR 147 CO 0.50 0.00 0.84 -1.14 -2.21 0.00 0.00 174.62 172.61 2k8p n ARG 148 N 2.77 -5.44 -4.23 7.08 0.63 -1.26 -5.03 116.66 111.18 2k8p n ARG 148 Ca -0.15 0.72 -0.26 0.00 -0.92 0.00 0.00 57.85 57.24 2k8p n ARG 148 Cb 0.57 -5.34 -0.08 0.00 0.45 0.00 0.00 32.46 28.05 2k8p n ARG 148 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 2k8p s PHE 149 N -3.31 2.79 -0.29 -0.14 5.36 -1.26 -5.12 117.98 116.01 2k8p s PHE 149 Ca 0.02 -0.16 -0.16 0.00 -0.96 0.00 0.00 56.93 55.66 2k8p s PHE 149 Cb -0.00 -1.33 0.17 0.00 -0.34 0.00 0.00 43.02 41.51 2k8p s PHE 149 CO 0.62 0.53 1.07 -1.58 -1.46 0.00 0.00 175.22 174.40 2k8p s HIS 150 N -1.83 -0.43 -0.30 10.12 2.46 -1.26 -5.17 115.29 118.89 2k8p s HIS 150 Ca 0.28 0.83 -0.18 0.00 0.47 0.00 0.00 55.06 56.46 2k8p s HIS 150 Cb -0.09 0.26 0.19 0.00 -0.13 0.00 0.00 32.58 32.81 2k8p s HIS 150 CO 0.18 -0.21 1.21 0.54 -2.47 0.00 0.00 174.74 173.99 2k8p s ASN 151 N 1.52 -0.18 0.18 9.88 4.22 -1.26 -5.18 114.94 124.12 2k8p s ASN 151 Ca -0.07 0.30 0.08 0.00 -2.14 0.00 0.00 52.86 51.03 2k8p s ASN 151 Cb -0.03 0.93 -0.04 0.00 1.28 0.00 0.00 41.25 43.38 2k8p s ASN 151 CO -0.14 -0.05 -0.15 -1.10 -2.04 0.00 0.00 177.10 173.62 2k8p s GLN 152 N 0.93 1.28 0.33 3.55 1.11 -1.26 -5.16 119.66 120.43 2k8p s GLN 152 Ca -0.06 -1.50 0.08 0.00 0.01 0.00 0.00 55.36 53.90 2k8p s GLN 152 Cb -0.03 -1.15 -0.04 0.00 -1.01 0.00 0.00 33.01 30.78 2k8p s GLN 152 CO -0.12 0.21 0.15 -1.12 0.01 0.00 0.00 175.29 174.42 2k8p s SER 153 N -3.03 4.79 -0.19 5.90 0.01 -1.26 -5.12 113.70 114.80 2k8p s SER 153 Ca 0.19 -0.70 0.01 0.00 1.31 0.00 0.00 55.95 56.76 2k8p s SER 153 Cb -0.03 -0.81 0.02 0.00 0.21 0.00 0.00 66.02 65.42 2k8p s SER 153 CO 0.06 -0.26 -0.18 -0.70 0.41 0.00 0.00 173.24 172.57 2k8p s GLU 154 N -3.84 2.94 0.19 12.44 2.12 -1.26 -5.12 118.70 126.16 2k8p s GLU 154 Ca 0.37 -0.87 0.06 0.00 0.36 0.00 0.00 54.97 54.90 2k8p s GLU 154 Cb -0.04 -2.62 -0.04 0.00 0.26 0.00 0.00 34.13 31.69 2k8p s GLU 154 CO 0.23 -0.24 0.08 -0.51 -0.54 0.00 0.00 175.26 174.28 2k8p s LEU 155 N 1.28 3.58 -0.04 2.70 1.02 -1.26 -5.13 118.68 120.83 2k8p s LEU 155 Ca 0.04 -0.28 0.04 0.00 0.02 0.00 0.00 54.13 53.94 2k8p s LEU 155 Cb -0.14 -2.19 0.00 0.00 0.02 0.00 0.00 46.19 43.89 2k8p s LEU 155 CO -0.12 0.06 -0.15 -0.54 0.02 0.00 0.00 176.35 175.63 2k8p s LYS 156 N -3.17 1.59 -0.32 1.70 1.02 -1.26 -5.09 119.74 114.21 2k8p s LYS 156 Ca 0.30 -0.51 -0.02 0.00 0.02 0.00 0.00 55.97 55.76 2k8p s LYS 156 Cb -0.09 -1.38 0.19 0.00 -0.52 0.00 0.00 37.83 36.02 2k8p s LYS 156 CO 0.21 0.18 0.82 0.34 -0.92 0.00 0.00 175.35 175.98 2k8p s ASP 157 N 0.18 -1.01 -0.17 2.83 -1.08 -1.26 -5.14 116.67 111.02 2k8p s ASP 157 Ca -0.06 -0.07 -0.05 0.00 -0.52 0.00 0.00 52.55 51.86 2k8p s ASP 157 Cb -0.12 1.53 0.08 0.00 -1.46 0.00 0.00 42.92 42.96 2k8p s ASP 157 CO 0.02 -0.16 0.29 -0.36 0.52 0.00 0.00 175.17 175.48 2k8p s PHE 158 N 2.59 -0.51 -0.21 -5.34 0.08 -1.26 -5.15 117.98 108.19 2k8p s PHE 158 Ca 0.18 0.88 -0.23 0.00 0.12 0.00 0.00 56.93 57.88 2k8p s PHE 158 Cb -0.04 -0.04 0.06 0.00 -0.57 0.00 0.00 43.02 42.42 2k8p s PHE 158 CO -0.20 -0.47 0.63 0.20 -0.10 0.00 0.00 175.22 175.27 2k8p s GLY 159 N 2.45 -0.48 -0.16 4.36 0.00 -1.26 -5.15 107.32 107.08 2k8p s GLY 159 Ca 0.04 1.71 -0.05 0.00 0.00 0.00 0.00 44.72 46.41 2k8p s GLY 159 CO -0.11 1.45 0.32 -1.08 0.00 0.00 0.00 173.10 173.68 2k8p s THR 160 N 0.15 -0.50 -0.04 0.90 -1.32 -1.26 -5.14 115.64 108.43 2k8p s THR 160 Ca -0.01 0.21 -0.01 0.00 -1.21 0.00 0.00 61.69 60.66 2k8p s THR 160 Cb -0.04 -0.55 0.03 0.00 -1.51 0.00 0.00 72.50 70.44 2k8p s THR 160 CO 0.02 0.07 0.07 -0.70 -2.21 0.00 0.00 174.62 171.87 2k8p s GLU 161 N 2.48 -0.01 0.08 7.08 2.12 -1.26 -5.15 118.70 124.04 2k8p s GLU 161 Ca 0.01 0.29 0.05 0.00 0.36 0.00 0.00 54.97 55.68 2k8p s GLU 161 Cb -0.12 -0.28 -0.03 0.00 0.26 0.00 0.00 34.13 33.95 2k8p s GLU 161 CO -0.10 -0.21 -0.13 0.00 -0.54 0.00 0.00 175.26 174.28 2k8p s ALA 162 N 1.39 1.18 -0.30 6.30 0.00 -1.26 -5.13 121.76 123.93 2k8p s ALA 162 Ca -0.06 -1.06 -0.06 0.00 0.00 0.00 0.00 51.96 50.78 2k8p s ALA 162 Cb -0.12 -0.06 0.18 0.00 0.00 0.00 0.00 23.12 23.11 2k8p s ALA 162 CO -0.04 0.11 0.78 0.00 0.00 0.00 0.00 175.76 176.62 2k8p s ALA 163 N -1.61 -2.70 -0.40 0.00 0.00 -1.26 -5.09 121.76 110.70 2k8p s ALA 163 Ca 0.00 1.73 0.07 0.00 0.00 0.00 0.00 51.96 53.77 2k8p s ALA 163 Cb -0.08 -2.27 0.24 0.00 0.00 0.00 0.00 23.12 21.01 2k8p s ALA 163 CO 0.02 -1.34 0.55 -2.13 0.00 0.00 0.00 175.76 172.85 2k8p n ARG 164 N 5.43 0.67 -1.04 0.00 3.00 -1.26 -5.14 116.66 118.32 2k8p n ARG 164 Ca -0.04 -3.05 -0.30 0.00 -0.00 0.00 0.00 57.85 54.46 2k8p n ARG 164 Cb 0.52 -1.28 0.25 0.00 0.00 0.00 0.00 32.46 31.95 2k8p n ARG 164 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2k8p n PRO 165 N 1.57 -3.15 -3.82 -0.14 -0.04 -1.26 -5.09 135.00 123.07 2k8p n PRO 165 Ca 0.20 -1.75 -0.12 0.00 -0.04 0.00 0.00 63.50 61.79 2k8p n PRO 165 Cb 0.54 -1.64 -0.12 0.00 -0.04 0.00 0.00 33.50 32.24 2k8p n PRO 165 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2k8p s GLN 166 N -5.48 0.29 -0.18 0.54 0.74 -1.26 -5.15 119.66 109.16 2k8p s GLN 166 Ca 0.71 0.13 -0.07 0.00 0.05 0.00 0.00 55.36 56.18 2k8p s GLN 166 Cb -0.07 0.14 0.08 0.00 1.10 0.00 0.00 33.01 34.26 2k8p s GLN 166 CO 0.55 -0.05 0.39 0.21 -0.55 0.00 0.00 175.29 175.84 2k8p s LYS 167 N -0.23 0.30 0.00 1.67 2.36 -1.26 -5.15 119.74 117.43 2k8p s LYS 167 Ca -0.03 0.94 0.00 0.00 -2.55 0.00 0.00 55.97 54.33 2k8p s LYS 167 Cb -0.03 0.21 0.00 0.00 -1.05 0.00 0.00 37.83 36.96 2k8p s LYS 167 CO 0.01 -0.24 0.00 0.41 1.55 0.00 0.00 175.35 177.08 2k8p n GLY 168 N 5.18 1.09 3.44 5.54 0.00 -1.26 -5.19 105.19 114.00 2k8p n GLY 168 Ca -0.11 -0.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.90 2k8p n GLY 168 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8p s ARG 169 N -1.71 1.06 -0.52 1.61 0.52 -1.26 -5.10 118.95 113.56 2k8p s ARG 169 Ca 0.00 -0.06 0.07 0.00 -0.52 0.00 0.00 55.73 55.22 2k8p s ARG 169 Cb 0.00 0.49 0.25 0.00 0.52 0.00 0.00 34.95 36.21 2k8p s ARG 169 CO 0.00 -0.37 0.63 1.63 0.02 0.00 0.00 175.30 177.21 2k8p n LYS 170 N 0.55 1.60 -2.23 3.54 4.76 -1.26 -5.10 118.16 120.02 2k8p n LYS 170 Ca -0.19 -3.94 -0.41 0.00 -2.87 0.00 0.00 58.31 50.90 2k8p n LYS 170 Cb 0.59 -1.74 -0.03 0.00 -1.84 0.00 0.00 35.03 32.02 2k8p n LYS 170 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2k8p s PRO 171 N -1.80 4.40 -0.47 1.97 0.04 -1.26 -4.98 135.00 132.90 2k8p s PRO 171 Ca 0.37 2.05 0.05 0.00 0.04 0.00 0.00 61.00 63.51 2k8p s PRO 171 Cb 0.16 -3.18 0.24 0.00 0.04 0.00 0.00 34.50 31.76 2k8p s PRO 171 CO -0.06 -0.21 0.93 -2.13 0.04 0.00 0.00 177.00 175.56 2k8p n ARG 172 N 2.32 0.71 -2.24 4.56 3.00 -1.26 -5.15 116.66 118.60 2k8p n ARG 172 Ca 0.05 -1.62 -0.41 0.00 -0.00 0.00 0.00 57.85 55.87 2k8p n ARG 172 Cb 0.43 -1.34 -0.03 0.00 0.00 0.00 0.00 32.46 31.52 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k8p s PRO 173 N 0.64 4.43 0.47 -0.14 0.04 -1.26 -5.03 135.00 134.15 2k8p s PRO 173 Ca 0.31 2.06 -0.07 0.00 0.04 0.00 0.00 61.00 63.34 2k8p s PRO 173 Cb 0.23 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.57 2k8p s PRO 173 CO -0.23 -0.12 0.79 -0.98 0.04 0.00 0.00 177.00 176.49 2k8p s ARG 174 N -1.02 3.60 -0.25 4.56 1.70 -1.26 -5.10 118.95 121.17 2k8p s ARG 174 Ca 0.51 0.27 -0.26 0.00 -0.47 0.00 0.00 55.73 55.79 2k8p s ARG 174 Cb -0.37 -2.37 0.08 0.00 -0.57 0.00 0.00 34.95 31.72 2k8p s ARG 174 CO 0.44 -0.17 0.77 0.00 -1.08 0.00 0.00 175.30 175.26 2k8p s ALA 175 N -2.66 -1.81 -0.06 7.88 0.00 -1.26 -5.17 121.76 118.68 2k8p s ALA 175 Ca 0.48 1.94 -0.04 0.00 0.00 0.00 0.00 51.96 54.35 2k8p s ALA 175 Cb -0.10 -1.11 0.03 0.00 0.00 0.00 0.00 23.12 21.93 2k8p s ALA 175 CO 0.42 -0.33 0.14 0.50 0.00 0.00 0.00 175.76 176.50 2k8p s ARG 176 N 0.20 0.13 -0.43 0.00 3.52 -1.26 -5.08 118.95 116.03 2k8p s ARG 176 Ca -0.00 0.28 0.02 0.00 -0.13 0.00 0.00 55.73 55.89 2k8p s ARG 176 Cb -0.05 -0.04 0.23 0.00 -1.56 0.00 0.00 34.95 33.53 2k8p s ARG 176 CO 0.01 -0.09 0.98 -1.13 -0.81 0.00 0.00 175.30 174.26 2k8p n SER 177 N 3.58 -2.38 -3.73 -2.12 3.41 -1.26 -5.13 113.62 106.00 2k8p n SER 177 Ca -0.19 -2.43 -0.26 0.00 -0.26 0.00 0.00 58.87 55.73 2k8p n SER 177 Cb 0.56 1.35 -0.17 0.00 -0.26 0.00 0.00 64.21 65.68 2k8p n SER 177 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p s ALA 178 N 0.64 0.85 0.67 7.33 0.00 -1.26 -5.14 121.76 124.85 2k8p s ALA 178 Ca 0.29 -0.51 0.05 0.00 0.00 0.00 0.00 51.96 51.78 2k8p s ALA 178 Cb 0.15 -1.06 0.12 0.00 0.00 0.00 0.00 23.12 22.33 2k8p s ALA 178 CO -0.14 -1.01 0.92 0.15 0.00 0.00 0.00 175.76 175.68 2k8p s LYS 179 N 1.92 1.90 -0.15 0.00 3.01 -1.26 -5.08 119.74 120.08 2k8p s LYS 179 Ca 0.01 -1.48 -0.12 0.00 -1.01 0.00 0.00 55.97 53.37 2k8p s LYS 179 Cb -0.16 -2.49 -0.06 0.00 -1.01 0.00 0.00 37.83 34.11 2k8p s LYS 179 CO -0.07 -1.24 -0.26 0.00 0.51 0.00 0.00 175.35 174.28 2k8p n ALA 180 N -2.58 1.54 -1.39 5.17 0.00 -1.26 -5.12 120.51 116.87 2k8p n ALA 180 Ca 0.17 -0.71 0.18 0.00 0.00 0.00 0.00 53.44 53.08 2k8p n ALA 180 Cb 0.61 0.16 -0.06 0.00 0.00 0.00 0.00 19.45 20.16 2k8p n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k8p n ASN 181 N -4.08 -8.33 -3.03 0.00 2.85 -1.26 -4.96 115.26 96.46 2k8p n ASN 181 Ca -0.24 0.93 -0.07 0.00 -0.11 0.00 0.00 54.58 55.09 2k8p n ASN 181 Cb 0.57 -4.45 0.01 0.00 1.24 0.00 0.00 39.78 37.15 2k8p n ASN 181 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 2k8p n GLN 182 N -4.22 -1.85 -3.69 1.20 7.27 -1.26 -5.01 117.38 109.82 2k8p n GLN 182 Ca -0.03 1.74 -0.30 0.00 0.07 0.00 0.00 57.00 58.49 2k8p n GLN 182 Cb 0.64 -5.36 -0.14 0.00 2.41 0.00 0.00 30.24 27.79 2k8p n GLN 182 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2k8p s ALA 183 N -2.74 1.65 0.01 1.69 0.00 -1.26 -5.10 121.76 116.01 2k8p s ALA 183 Ca 0.13 -2.00 -0.28 0.00 0.00 0.00 0.00 51.96 49.82 2k8p s ALA 183 Cb -0.03 -1.71 0.08 0.00 0.00 0.00 0.00 23.12 21.46 2k8p s ALA 183 CO 0.77 -1.86 0.70 -2.00 0.00 0.00 0.00 175.76 173.38 2k8p s GLU 184 N 1.13 1.06 -0.83 0.00 2.12 -1.26 -5.08 118.70 115.85 2k8p s GLU 184 Ca 0.13 -0.05 0.02 0.00 0.36 0.00 0.00 54.97 55.43 2k8p s GLU 184 Cb -0.20 0.50 0.31 0.00 0.26 0.00 0.00 34.13 35.00 2k8p s GLU 184 CO -0.14 -0.40 1.31 -0.11 -0.54 0.00 0.00 175.26 175.39 2k8p n LEU 185 N 0.35 5.71 -4.59 2.70 7.94 -1.26 -5.06 117.00 122.79 2k8p n LEU 185 Ca -0.16 -5.48 -0.34 0.00 -1.11 0.00 0.00 56.01 48.92 2k8p n LEU 185 Cb 0.60 -0.90 0.11 0.00 0.53 0.00 0.00 43.42 43.77 2k8p n LEU 185 CO 0.18 2.10 0.44 -1.84 -1.11 0.00 0.00 177.39 177.16 2k8p n GLU 186 N 0.22 0.10 -3.61 1.96 -0.00 -1.26 -5.03 120.64 113.01 2k8p n GLU 186 Ca 0.36 0.10 -0.08 0.00 -0.00 0.00 0.00 57.16 57.54 2k8p n GLU 186 Cb 0.34 -2.19 -0.06 0.00 -0.00 0.00 0.00 31.44 29.54 2k8p n GLU 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2k8p s ASN 187 N -1.97 -0.30 1.12 -1.84 2.20 -1.26 -5.18 114.94 107.72 2k8p s ASN 187 Ca 0.68 0.41 -0.18 0.00 -0.94 0.00 0.00 52.86 52.84 2k8p s ASN 187 Cb -0.29 0.37 0.26 0.00 -2.00 0.00 0.00 41.25 39.58 2k8p s ASN 187 CO 0.56 -0.21 1.19 0.00 -2.94 0.00 0.00 177.10 175.70 2k8p s ALA 188 N -0.66 1.20 -1.48 3.54 0.00 -1.26 -5.35 121.76 117.75 2k8p s ALA 188 Ca 0.02 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.94 2k8p s ALA 188 Cb -0.02 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.25 2k8p s ALA 188 CO -0.04 -3.17 0.37 0.66 0.00 0.00 0.00 175.76 173.58