#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 0.17 -2.43 1.61 7.02 -1.26 -5.14 117.44 117.42 2k8p n TRP 2 Ca 0.00 -1.77 -0.28 0.00 -1.02 0.00 0.00 57.50 54.43 2k8p n TRP 2 Cb 0.00 -0.28 0.01 0.00 -2.42 0.00 0.00 31.31 28.62 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 -3.46 3.34 0.43 -0.99 -1.52 -1.26 -5.10 119.66 111.10 2k8p s GLN 3 Ca 0.09 0.23 0.03 0.00 -1.95 0.00 0.00 55.36 53.76 2k8p s GLN 3 Cb -0.01 -2.29 -0.02 0.00 -0.22 0.00 0.00 33.01 30.47 2k8p s GLN 3 CO 0.06 -0.43 0.10 0.00 -0.25 0.00 0.00 175.29 174.77 2k8p s ALA 4 N -2.90 3.14 0.38 6.09 0.00 -1.26 -5.17 121.76 122.03 2k8p s ALA 4 Ca 0.51 -1.12 -0.10 0.00 0.00 0.00 0.00 51.96 51.25 2k8p s ALA 4 Cb -0.10 0.60 0.04 0.00 0.00 0.00 0.00 23.12 23.66 2k8p s ALA 4 CO 0.47 -0.27 0.68 1.97 0.00 0.00 0.00 175.76 178.60 2k8p n PHE 5 N -0.97 -2.02 -4.60 0.00 -1.74 -1.26 -5.19 117.46 101.68 2k8p n PHE 5 Ca -0.08 -2.09 -0.28 0.00 -0.56 0.00 0.00 57.45 54.44 2k8p n PHE 5 Cb 0.65 0.79 -0.08 0.00 1.52 0.00 0.00 39.48 42.36 2k8p n PHE 5 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 2k8p s LYS 6 N -2.38 2.02 -0.04 3.97 1.02 -1.26 -5.16 119.74 117.91 2k8p s LYS 6 Ca 0.21 -2.25 0.06 0.00 0.02 0.00 0.00 55.97 54.01 2k8p s LYS 6 Cb -0.03 -0.91 -0.01 0.00 -0.52 0.00 0.00 37.83 36.35 2k8p s LYS 6 CO 0.16 -0.44 -0.21 -0.80 -0.92 0.00 0.00 175.35 173.14 2k8p s ASN 7 N -3.70 2.60 -0.12 2.83 0.01 -1.26 -5.13 114.94 110.18 2k8p s ASN 7 Ca 0.18 -0.42 0.02 0.00 -0.71 0.00 0.00 52.86 51.92 2k8p s ASN 7 Cb 0.02 -0.63 0.02 0.00 0.41 0.00 0.00 41.25 41.07 2k8p s ASN 7 CO 0.11 0.21 -0.16 -0.62 -1.51 0.00 0.00 177.10 175.13 2k8p s ASP 8 N -0.16 2.63 -0.40 -1.22 -1.08 -1.26 -5.05 116.67 110.13 2k8p s ASP 8 Ca -0.01 -0.48 0.08 0.00 -0.52 0.00 0.00 52.55 51.62 2k8p s ASP 8 Cb -0.12 -1.18 0.24 0.00 -1.46 0.00 0.00 42.92 40.41 2k8p s ASP 8 CO 0.02 0.01 0.54 0.00 0.52 0.00 0.00 175.17 176.27 2k8p n ALA 9 N 4.31 2.09 -3.17 3.66 0.00 -1.26 -5.02 120.51 121.12 2k8p n ALA 9 Ca -0.19 -3.19 -0.37 0.00 0.00 0.00 0.00 53.44 49.69 2k8p n ALA 9 Cb 0.51 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 19.08 2k8p n ALA 9 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2k8p n THR 10 N 1.52 4.18 -2.50 0.00 -2.24 -1.26 -5.04 114.28 108.94 2k8p n THR 10 Ca 0.20 -5.66 -0.42 0.00 -2.27 0.00 0.00 64.05 55.90 2k8p n THR 10 Cb 0.54 -2.09 -0.03 0.00 -2.10 0.00 0.00 70.33 66.65 2k8p n THR 10 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2k8p s GLU 11 N -2.68 4.41 -0.36 -0.78 -1.05 -1.26 -5.01 118.70 111.97 2k8p s GLU 11 Ca 0.34 1.65 0.04 0.00 -0.15 0.00 0.00 54.97 56.85 2k8p s GLU 11 Cb 0.09 -3.48 0.10 0.00 -0.44 0.00 0.00 34.13 30.40 2k8p s GLU 11 CO 0.06 -0.33 0.08 0.42 0.95 0.00 0.00 175.26 176.43 2k8p s ILE 12 N 1.72 2.31 -0.49 1.83 -1.09 -1.26 -5.00 121.20 119.21 2k8p s ILE 12 Ca 0.56 -2.46 0.07 0.00 -2.23 0.00 0.00 60.65 56.58 2k8p s ILE 12 Cb -0.25 -2.69 0.24 0.00 -1.58 0.00 0.00 42.46 38.17 2k8p s ILE 12 CO 0.24 -0.63 0.57 -0.38 -1.23 0.00 0.00 174.94 173.52 2k8p n ILE 13 N 4.11 0.37 -1.14 2.92 -0.00 -1.26 -5.12 119.36 119.24 2k8p n ILE 13 Ca 0.04 -4.39 -0.29 0.00 -0.00 0.00 0.00 62.75 58.11 2k8p n ILE 13 Cb 0.41 -1.99 0.20 0.00 -0.00 0.00 0.00 39.64 38.26 2k8p n ILE 13 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2k8p s PRO 14 N -1.49 -0.09 0.00 0.38 0.04 -1.26 -5.09 135.00 127.49 2k8p s PRO 14 Ca 0.36 0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.73 2k8p s PRO 14 Cb 0.14 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.99 2k8p s PRO 14 CO -0.09 -3.04 0.00 -1.91 0.04 0.00 0.00 177.00 172.00 2k8p n GLU 15 N -4.36 0.00 -4.67 4.56 2.13 -1.26 -5.19 120.64 111.85 2k8p n GLU 15 Ca 0.07 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.59 2k8p n GLU 15 Cb 0.58 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.21 2k8p n GLU 15 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2k8p s LEU 16 N 0.00 2.30 0.20 4.31 1.43 -1.26 -5.10 118.68 120.56 2k8p s LEU 16 Ca 0.00 -1.61 0.00 0.00 -1.03 0.00 0.00 54.13 51.49 2k8p s LEU 16 Cb 0.00 -0.59 0.00 0.00 0.03 0.00 0.00 46.19 45.63 2k8p s LEU 16 CO 0.00 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.39 2k8p n GLY 17 N -1.11 -0.20 3.10 -3.19 0.00 -1.26 -5.10 105.19 97.43 2k8p n GLY 17 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 1.43 -0.62 1.61 -1.05 -1.26 -5.07 118.70 111.73 2k8p s GLU 18 Ca 0.00 -0.52 0.06 0.00 -0.15 0.00 0.00 54.97 54.36 2k8p s GLU 18 Cb 0.00 -1.30 0.26 0.00 -0.44 0.00 0.00 34.13 32.66 2k8p s GLU 18 CO 0.00 0.25 0.76 0.98 0.95 0.00 0.00 175.26 178.20 2k8p n TYR 19 N 3.02 3.48 -2.09 4.83 9.36 -1.26 -5.06 117.16 129.44 2k8p n TYR 19 Ca -0.17 -4.11 -0.43 0.00 3.32 0.00 0.00 57.90 56.52 2k8p n TYR 19 Cb 0.54 -0.54 -0.03 0.00 -0.63 0.00 0.00 39.34 38.68 2k8p n TYR 19 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2k8p s PRO 20 N -2.54 3.43 -0.63 2.98 0.04 -1.26 -4.93 135.00 132.08 2k8p s PRO 20 Ca 0.41 1.33 0.06 0.00 0.04 0.00 0.00 61.00 62.84 2k8p s PRO 20 Cb 0.17 -4.15 0.24 0.00 0.04 0.00 0.00 34.50 30.81 2k8p s PRO 20 CO -0.03 -1.74 0.72 -0.85 0.04 0.00 0.00 177.00 175.13 2k8p n GLU 21 N 8.30 2.37 -1.19 4.56 0.28 -1.26 -5.10 120.64 128.61 2k8p n GLU 21 Ca 0.21 -4.57 -0.29 0.00 -0.16 0.00 0.00 57.16 52.35 2k8p n GLU 21 Cb 0.47 -2.20 0.16 0.00 1.43 0.00 0.00 31.44 31.30 2k8p n GLU 21 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2k8p s PRO 22 N -2.33 0.75 0.96 3.44 0.04 -1.26 -5.04 135.00 131.55 2k8p s PRO 22 Ca 0.39 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.94 2k8p s PRO 22 Cb 0.14 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.08 2k8p s PRO 22 CO -0.03 -2.54 1.09 -1.25 0.04 0.00 0.00 177.00 174.31 2k8p s PRO 23 N -4.96 0.75 0.33 0.56 0.04 -1.26 -5.00 135.00 125.47 2k8p s PRO 23 Ca 0.65 0.63 -0.28 0.00 0.04 0.00 0.00 61.00 62.03 2k8p s PRO 23 Cb -0.18 -1.77 -0.10 0.00 0.04 0.00 0.00 34.50 32.50 2k8p s PRO 23 CO 0.57 -2.54 1.22 -1.25 0.04 0.00 0.00 177.00 175.04 2k8p s PRO 24 N -4.96 4.37 -0.45 0.56 0.04 -1.26 -5.01 135.00 128.30 2k8p s PRO 24 Ca 0.65 2.03 0.06 0.00 0.04 0.00 0.00 61.00 63.77 2k8p s PRO 24 Cb -0.18 -3.02 0.19 0.00 0.04 0.00 0.00 34.50 31.53 2k8p s PRO 24 CO 0.57 -0.10 0.52 0.39 0.04 0.00 0.00 177.00 178.42 2k8p n GLU 25 N 0.76 0.41 -2.96 4.56 1.02 -1.26 -5.03 120.64 118.13 2k8p n GLU 25 Ca 0.01 -2.73 -0.11 0.00 -0.02 0.00 0.00 57.16 54.30 2k8p n GLU 25 Cb 0.44 -1.53 -0.03 0.00 -0.02 0.00 0.00 31.44 30.30 2k8p n GLU 25 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2k8p n LEU 26 N 2.58 -2.50 -4.29 -4.62 -0.00 -1.26 -5.13 117.00 101.77 2k8p n LEU 26 Ca 0.24 -3.39 -0.31 0.00 -0.00 0.00 0.00 56.01 52.54 2k8p n LEU 26 Cb 0.52 0.69 -0.16 0.00 -0.00 0.00 0.00 43.42 44.47 2k8p n LEU 26 CO 0.06 1.92 -0.57 -0.70 -0.00 0.00 0.00 177.39 178.10 2k8p s GLU 27 N 0.60 2.35 -0.04 1.47 2.12 -1.26 -5.11 118.70 118.82 2k8p s GLU 27 Ca 0.31 -0.91 -0.29 0.00 0.36 0.00 0.00 54.97 54.43 2k8p s GLU 27 Cb 0.02 -2.11 0.10 0.00 0.26 0.00 0.00 34.13 32.39 2k8p s GLU 27 CO -0.10 0.47 1.32 1.21 -0.54 0.00 0.00 175.26 177.62 2k8p s ASN 28 N -0.38 0.00 -0.14 -1.70 3.84 -1.26 -5.07 114.94 110.24 2k8p s ASN 28 Ca 0.03 -0.13 0.11 0.00 0.21 0.00 0.00 52.86 53.08 2k8p s ASN 28 Cb -0.12 0.10 0.26 0.00 -0.55 0.00 0.00 41.25 40.94 2k8p s ASN 28 CO 0.01 -0.19 1.21 -3.20 -2.79 0.00 0.00 177.10 172.14 2k8p n ASN 29 N -1.02 -0.45 -4.09 -4.21 2.85 -1.26 -5.13 115.26 101.96 2k8p n ASN 29 Ca 0.04 -2.07 -0.10 0.00 -0.11 0.00 0.00 54.58 52.34 2k8p n ASN 29 Cb 0.59 0.21 -0.08 0.00 1.24 0.00 0.00 39.78 41.74 2k8p n ASN 29 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 2k8p s LYS 30 N -0.46 1.33 -0.29 1.20 -0.14 -1.26 -5.18 119.74 114.94 2k8p s LYS 30 Ca 0.12 -1.41 -0.25 0.00 -1.36 0.00 0.00 55.97 53.07 2k8p s LYS 30 Cb 0.24 0.37 0.16 0.00 -1.68 0.00 0.00 37.83 36.93 2k8p s LYS 30 CO -0.07 -0.50 1.27 -0.08 -0.76 0.00 0.00 175.35 175.21 2k8p s THR 31 N -4.07 0.00 0.16 2.17 -1.32 -1.26 -5.19 115.64 106.13 2k8p s THR 31 Ca 0.29 0.00 -0.21 0.00 -1.21 0.00 0.00 61.69 60.56 2k8p s THR 31 Cb 0.03 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.08 2k8p s THR 31 CO 0.09 0.00 0.55 -0.32 -2.21 0.00 0.00 174.62 172.73 2k8p s MET 32 N 0.14 1.28 -0.30 7.08 1.75 -1.26 -5.16 119.30 122.83 2k8p s MET 32 Ca 0.05 -0.61 -0.12 0.00 -1.25 0.00 0.00 55.69 53.77 2k8p s MET 32 Cb -0.05 0.56 0.18 0.00 2.84 0.00 0.00 34.83 38.35 2k8p s MET 32 CO -0.12 -0.55 1.01 1.21 -0.65 0.00 0.00 175.02 175.92 2k8p s ASN 33 N -2.79 -0.55 -0.04 1.11 2.47 -1.26 -5.16 114.94 108.72 2k8p s ASN 33 Ca 0.03 0.32 0.02 0.00 0.42 0.00 0.00 52.86 53.65 2k8p s ASN 33 Cb -0.01 1.45 0.01 0.00 -1.45 0.00 0.00 41.25 41.25 2k8p s ASN 33 CO -0.10 -0.10 -0.08 -0.60 -3.72 0.00 0.00 177.10 172.50 2k8p s ARG 34 N 2.94 1.10 0.08 0.43 6.06 -1.26 -5.14 118.95 123.17 2k8p s ARG 34 Ca 0.03 -0.26 -0.27 0.00 -2.50 0.00 0.00 55.73 52.73 2k8p s ARG 34 Cb -0.10 -1.00 0.09 0.00 0.06 0.00 0.00 34.95 34.00 2k8p s ARG 34 CO -0.13 0.02 1.07 0.00 -2.50 0.00 0.00 175.30 173.76 2k8p s ALA 35 N 0.56 -1.86 -0.30 6.12 0.00 -1.26 -5.16 121.76 119.87 2k8p s ALA 35 Ca -0.09 0.39 -0.15 0.00 0.00 0.00 0.00 51.96 52.10 2k8p s ALA 35 Cb -0.13 0.52 0.18 0.00 0.00 0.00 0.00 23.12 23.69 2k8p s ALA 35 CO 0.01 -1.02 1.15 -1.21 0.00 0.00 0.00 175.76 174.69 2k8p s GLU 36 N -2.98 0.09 -0.06 0.00 2.02 -1.26 -5.17 118.70 111.34 2k8p s GLU 36 Ca 0.12 0.13 -0.01 0.00 0.02 0.00 0.00 54.97 55.24 2k8p s GLU 36 Cb 0.01 0.07 -0.03 0.00 0.10 0.00 0.00 34.13 34.27 2k8p s GLU 36 CO -0.00 -0.12 0.00 0.54 0.02 0.00 0.00 175.26 175.70 2k8p s ASN 37 N 2.98 5.20 -0.30 -0.19 4.22 -1.26 -5.09 114.94 120.49 2k8p s ASN 37 Ca 0.06 0.10 -0.10 0.00 -2.14 0.00 0.00 52.86 50.78 2k8p s ASN 37 Cb -0.06 -1.43 0.18 0.00 1.28 0.00 0.00 41.25 41.21 2k8p s ASN 37 CO -0.13 0.35 0.90 -0.83 -2.04 0.00 0.00 177.10 175.35 2k8p s GLY 38 N -1.08 -0.52 -0.31 0.45 0.00 -1.26 -5.11 107.32 99.48 2k8p s GLY 38 Ca 0.15 2.54 -0.10 0.00 0.00 0.00 0.00 44.72 47.31 2k8p s GLY 38 CO 0.05 3.58 1.14 -0.32 0.00 0.00 0.00 173.10 177.55 2k8p s GLY 39 N 2.85 -1.85 -0.46 0.20 0.00 -1.26 -5.09 107.32 101.71 2k8p s GLY 39 Ca 0.05 1.03 0.07 0.00 0.00 0.00 0.00 44.72 45.87 2k8p s GLY 39 CO -0.15 4.41 0.74 -2.13 0.00 0.00 0.00 173.10 175.97 2k8p n ARG 40 N 2.95 0.69 -1.18 2.90 0.63 -1.26 -5.15 116.66 116.25 2k8p n ARG 40 Ca 0.08 -2.26 -0.29 0.00 -0.92 0.00 0.00 57.85 54.46 2k8p n ARG 40 Cb 0.65 -1.41 0.16 0.00 0.45 0.00 0.00 32.46 32.31 2k8p n ARG 40 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2k8p s PRO 41 N 0.17 0.73 0.67 -0.14 0.04 -1.26 -5.02 135.00 130.19 2k8p s PRO 41 Ca 0.33 0.64 -0.15 0.00 0.04 0.00 0.00 61.00 61.86 2k8p s PRO 41 Cb 0.17 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.95 2k8p s PRO 41 CO -0.18 -2.55 1.11 -1.25 0.04 0.00 0.00 177.00 174.16 2k8p s PRO 42 N -4.95 2.77 -0.31 0.56 0.04 -1.26 -5.05 135.00 126.80 2k8p s PRO 42 Ca 0.65 1.37 -0.02 0.00 0.04 0.00 0.00 61.00 63.04 2k8p s PRO 42 Cb -0.18 -1.95 0.11 0.00 0.04 0.00 0.00 34.50 32.52 2k8p s PRO 42 CO 0.57 -1.27 0.15 -1.58 0.04 0.00 0.00 177.00 174.91 2k8p s HIS 43 N -2.38 0.68 -0.40 0.56 2.46 -1.26 -5.03 115.29 109.92 2k8p s HIS 43 Ca 0.67 -1.23 0.08 0.00 0.47 0.00 0.00 55.06 55.04 2k8p s HIS 43 Cb -0.20 -1.06 0.25 0.00 -0.13 0.00 0.00 32.58 31.44 2k8p s HIS 43 CO 0.42 -0.84 0.56 -2.39 -2.47 0.00 0.00 174.74 170.03 2k8p n HIS 44 N 4.85 -0.61 -1.83 3.88 1.44 -1.26 -5.13 115.22 116.56 2k8p n HIS 44 Ca -0.01 -3.41 -0.33 0.00 -2.01 0.00 0.00 57.72 51.96 2k8p n HIS 44 Cb 0.41 -0.18 0.04 0.00 0.12 0.00 0.00 29.99 30.37 2k8p n HIS 44 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 2k8p s PRO 45 N -1.07 2.88 -0.20 -1.40 0.04 -1.26 -5.07 135.00 128.91 2k8p s PRO 45 Ca 0.35 1.43 -0.19 0.00 0.04 0.00 0.00 61.00 62.62 2k8p s PRO 45 Cb 0.18 -1.96 0.05 0.00 0.04 0.00 0.00 34.50 32.82 2k8p s PRO 45 CO -0.12 -1.19 0.56 -0.59 0.04 0.00 0.00 177.00 175.69 2k8p s PHE 46 N -2.25 -0.61 0.54 0.56 -0.71 -1.26 -5.15 117.98 109.10 2k8p s PHE 46 Ca 0.68 1.48 -0.20 0.00 -1.04 0.00 0.00 56.93 57.85 2k8p s PHE 46 Cb -0.21 0.21 -0.08 0.00 -1.21 0.00 0.00 43.02 41.73 2k8p s PHE 46 CO 0.39 -0.30 0.83 0.39 -1.34 0.00 0.00 175.22 175.19 2k8p n GLU 47 N 2.74 0.88 -3.64 1.99 1.02 -1.26 -5.01 120.64 117.36 2k8p n GLU 47 Ca -0.14 0.33 -0.03 0.00 -0.02 0.00 0.00 57.16 57.31 2k8p n GLU 47 Cb 0.56 -1.97 -0.07 0.00 -0.02 0.00 0.00 31.44 29.95 2k8p n GLU 47 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2k8p s THR 48 N -1.51 0.00 0.20 2.62 -1.32 -1.26 -5.15 115.64 109.22 2k8p s THR 48 Ca 0.70 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.88 2k8p s THR 48 Cb -0.47 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.44 2k8p s THR 48 CO 0.52 0.00 1.20 -0.75 -2.21 0.00 0.00 174.62 173.38 2k8p s LYS 49 N 1.01 4.49 0.31 7.08 2.36 -1.26 -5.04 119.74 128.70 2k8p s LYS 49 Ca -0.06 1.90 0.01 0.00 -2.55 0.00 0.00 55.97 55.27 2k8p s LYS 49 Cb -0.04 -3.22 -0.00 0.00 -1.05 0.00 0.00 37.83 33.52 2k8p s LYS 49 CO -0.13 -0.07 0.03 -0.25 1.55 0.00 0.00 175.35 176.48 2k8p n ASP 50 N 2.30 2.36 -2.37 1.43 9.92 -1.26 -5.17 116.55 123.75 2k8p n ASP 50 Ca 0.04 -2.41 -0.10 0.00 -0.53 0.00 0.00 54.79 51.79 2k8p n ASP 50 Cb 0.44 0.36 -0.01 0.00 -0.64 0.00 0.00 41.12 41.27 2k8p n ASP 50 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 2k8p n VAL 51 N -0.74 0.00 -3.23 2.53 0.24 -1.26 -5.14 118.33 110.72 2k8p n VAL 51 Ca -0.10 -1.15 0.02 0.00 -2.04 0.00 0.00 64.34 61.06 2k8p n VAL 51 Cb 0.40 0.75 -0.02 0.00 -1.47 0.00 0.00 33.84 33.51 2k8p n VAL 51 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2k8p s SER 52 N -2.51 -1.21 0.03 -1.34 0.15 -1.26 -3.33 113.70 104.23 2k8p s SER 52 Ca 0.19 0.91 0.00 0.00 0.70 0.00 0.00 55.95 57.75 2k8p s SER 52 Cb -0.01 2.09 -0.00 0.00 -1.71 0.00 0.00 66.02 66.39 2k8p s SER 52 CO 0.14 -0.26 0.00 1.21 1.20 0.00 0.00 173.24 175.53 2k8p n GLU 53 N 5.43 1.75 -1.37 5.44 2.13 -1.26 -5.00 120.64 127.76 2k8p n GLU 53 Ca -0.03 -0.19 -0.00 0.00 0.66 0.00 0.00 57.16 57.60 2k8p n GLU 53 Cb 0.51 0.06 0.00 0.00 0.27 0.00 0.00 31.44 32.28 2k8p n GLU 53 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2k8p n TYR 54 N -0.06 -2.00 -0.05 4.31 4.01 -1.26 -4.50 117.16 117.61 2k8p n TYR 54 Ca -0.01 -0.04 -0.00 0.00 -0.16 0.00 0.00 57.90 57.69 2k8p n TYR 54 Cb 0.03 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 2k8p n TYR 54 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2k8p n SER 55 N -2.34 -1.92 -4.79 7.72 7.64 -1.26 -3.97 113.62 114.70 2k8p n SER 55 Ca 0.00 -0.05 -0.34 0.00 1.01 0.00 0.00 58.87 59.49 2k8p n SER 55 Cb 0.01 -0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.19 2k8p n SER 55 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8p s ARG 57 N -3.41 4.05 -0.24 0.00 3.52 -1.26 -4.96 118.95 116.66 2k8p s ARG 57 Ca 0.67 0.65 -0.00 0.00 -0.13 0.00 0.00 55.73 56.92 2k8p s ARG 57 Cb -0.17 -2.69 0.03 0.00 -1.56 0.00 0.00 34.95 30.56 2k8p s ARG 57 CO 0.24 0.31 -0.10 -1.21 -0.81 0.00 0.00 175.30 173.73 2k8p s GLU 58 N -2.46 2.73 0.32 5.12 2.02 -1.26 -1.98 118.70 123.19 2k8p s GLU 58 Ca 0.47 -1.03 -0.18 0.00 0.02 0.00 0.00 54.97 54.24 2k8p s GLU 58 Cb -0.13 -2.87 -0.09 0.00 0.10 0.00 0.00 34.13 31.13 2k8p s GLU 58 CO 0.19 -0.40 0.80 -1.17 0.02 0.00 0.00 175.26 174.71 2k8p s LEU 59 N 1.27 4.12 -0.18 1.80 1.98 -0.98 -4.89 118.68 121.80 2k8p s LEU 59 Ca -0.01 1.45 0.00 0.00 -2.89 0.00 0.00 54.13 52.69 2k8p s LEU 59 Cb -0.17 -4.07 0.04 0.00 0.66 0.00 0.00 46.19 42.66 2k8p s LEU 59 CO -0.06 -0.18 -0.08 -1.00 -1.89 0.00 0.00 176.35 173.14 2k8p s HIS 60 N -1.89 2.05 -0.19 5.38 3.76 -1.26 -0.79 115.29 122.35 2k8p s HIS 60 Ca 0.53 -1.34 -0.00 0.00 -0.15 0.00 0.00 55.06 54.10 2k8p s HIS 60 Cb -0.12 -1.47 0.01 0.00 1.11 0.00 0.00 32.58 32.11 2k8p s HIS 60 CO 0.18 -0.68 -0.15 -0.06 -0.85 0.00 0.00 174.74 173.17 2k8p s PHE 61 N 1.52 2.83 -0.08 1.40 0.40 -0.68 -4.97 117.98 118.41 2k8p s PHE 61 Ca -0.00 -1.43 0.04 0.00 -0.60 0.00 0.00 56.93 54.93 2k8p s PHE 61 Cb -0.16 -1.98 -0.01 0.00 0.51 0.00 0.00 43.02 41.38 2k8p s PHE 61 CO -0.08 -0.73 -0.19 0.99 0.70 0.00 0.00 175.22 175.91 2k8p s THR 62 N 1.35 2.54 0.27 0.64 2.01 -1.26 -0.27 115.64 120.92 2k8p s THR 62 Ca 0.05 -0.88 -0.21 0.00 0.31 0.00 0.00 61.69 60.96 2k8p s THR 62 Cb -0.13 -1.99 0.02 0.00 0.01 0.00 0.00 72.50 70.41 2k8p s THR 62 CO -0.10 0.56 0.70 0.00 -0.69 0.00 0.00 174.62 175.10 2k8p s ARG 63 N -0.14 1.74 -0.19 4.92 1.04 -1.01 -4.93 118.95 120.39 2k8p s ARG 63 Ca -0.03 -0.95 -0.19 0.00 -1.04 0.00 0.00 55.73 53.52 2k8p s ARG 63 Cb -0.14 0.61 -0.03 0.00 -2.04 0.00 0.00 34.95 33.35 2k8p s ARG 63 CO 0.04 -0.79 0.54 0.71 -0.04 0.00 0.00 175.30 175.75 2k8p s TYR 64 N -3.91 3.39 0.02 5.89 1.51 -1.26 -0.20 117.35 122.79 2k8p s TYR 64 Ca 0.10 0.81 -0.13 0.00 -1.01 0.00 0.00 57.07 56.85 2k8p s TYR 64 Cb -0.05 -2.68 -0.06 0.00 -0.11 0.00 0.00 41.96 39.05 2k8p s TYR 64 CO 0.05 -0.09 0.39 0.54 -1.11 0.00 0.00 175.55 175.33 2k8p s VAL 65 N 1.59 5.08 -0.16 0.71 0.11 -1.26 -5.00 120.40 121.47 2k8p s VAL 65 Ca 0.25 0.69 -0.08 0.00 -2.93 0.00 0.00 61.98 59.90 2k8p s VAL 65 Cb -0.15 -3.67 0.06 0.00 -1.53 0.00 0.00 36.38 31.08 2k8p s VAL 65 CO 0.10 0.50 0.38 0.42 -3.33 0.00 0.00 175.10 173.17 2k8p s THR 66 N -1.17 -0.07 -0.30 5.04 -4.23 -1.26 -1.68 115.64 111.97 2k8p s THR 66 Ca 0.26 0.11 -0.01 0.00 -1.18 0.00 0.00 61.69 60.87 2k8p s THR 66 Cb -0.16 -0.58 0.10 0.00 1.34 0.00 0.00 72.50 73.20 2k8p s THR 66 CO 0.14 0.04 0.09 -0.62 -0.54 0.00 0.00 174.62 173.74 2k8p s ASP 67 N 1.47 3.92 0.00 3.99 2.15 -1.24 -5.03 116.67 121.93 2k8p s ASP 67 Ca -0.09 -1.55 0.00 0.00 0.43 0.00 0.00 52.55 51.34 2k8p s ASP 67 Cb -0.09 -0.81 0.00 0.00 -0.30 0.00 0.00 42.92 41.72 2k8p s ASP 67 CO -0.12 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.08 2k8p n GLY 68 N 4.89 -1.36 0.00 2.66 0.00 -1.26 -4.25 105.19 105.87 2k8p n GLY 68 Ca -0.03 -1.83 0.07 0.00 0.00 0.00 0.00 46.02 44.23 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 0.19 -3.78 1.61 -0.04 -1.26 -4.74 135.00 126.98 2k8p n PRO 69 Ca 0.00 0.16 -0.21 0.00 -0.04 0.00 0.00 63.50 63.41 2k8p n PRO 69 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 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 -4.03 0.14 0.69 0.00 3.00 0.16 -3.68 118.95 115.24 2k8p s ARG 71 Ca 0.40 -0.07 -0.17 0.00 0.00 0.00 0.00 55.73 55.89 2k8p s ARG 71 Cb -0.08 0.06 -0.01 0.00 0.00 0.00 0.00 34.95 34.93 2k8p s ARG 71 CO 0.28 -0.02 1.02 -1.13 0.00 0.00 0.00 175.30 175.45 2k8p n SER 72 N 2.68 0.78 0.11 0.23 3.41 -0.68 -0.07 113.62 120.08 2k8p n SER 72 Ca -0.15 0.72 0.04 0.00 -0.26 0.00 0.00 58.87 59.22 2k8p n SER 72 Cb 0.58 -1.43 0.01 0.00 -0.26 0.00 0.00 64.21 63.11 2k8p n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p h ALA 73 N -0.01 0.68 -2.49 7.33 0.00 -1.53 -3.44 119.26 119.80 2k8p h ALA 73 Ca -0.48 -0.46 -0.09 0.00 0.00 0.00 0.00 54.91 53.87 2k8p h ALA 73 Cb 1.34 0.05 -0.14 0.00 0.00 0.00 0.00 17.79 19.04 2k8p h ALA 73 CO 0.49 0.56 -0.41 0.15 0.00 0.00 0.00 179.25 180.04 2k8p s LYS 74 N -3.03 0.86 0.82 0.00 1.02 -1.26 -5.14 119.74 113.01 2k8p s LYS 74 Ca 0.02 -1.03 -0.11 0.00 0.02 0.00 0.00 55.97 54.87 2k8p s LYS 74 Cb 0.08 0.33 0.09 0.00 -0.52 0.00 0.00 37.83 37.80 2k8p s LYS 74 CO 0.76 -0.27 1.09 -1.25 -0.92 0.00 0.00 175.35 174.77 2k8p s PRO 75 N -3.89 1.84 -0.11 -1.68 0.04 -1.26 -4.61 135.00 125.33 2k8p s PRO 75 Ca 0.07 1.02 0.02 0.00 0.04 0.00 0.00 61.00 62.15 2k8p s PRO 75 Cb 0.05 -1.86 0.02 0.00 0.04 0.00 0.00 34.50 32.74 2k8p s PRO 75 CO -0.09 -1.89 -0.16 0.54 0.04 0.00 0.00 177.00 175.44 2k8p s VAL 76 N -2.92 1.54 -0.33 -0.36 0.11 0.73 -4.91 120.40 114.26 2k8p s VAL 76 Ca 0.62 -0.66 -0.17 0.00 -2.93 0.00 0.00 61.98 58.84 2k8p s VAL 76 Cb -0.17 -1.41 -0.01 0.00 -1.53 0.00 0.00 36.38 33.25 2k8p s VAL 76 CO 0.56 0.45 0.45 -0.89 -3.33 0.00 0.00 175.10 172.34 2k8p s THR 77 N 1.02 5.09 -0.15 5.04 2.01 -1.26 -2.40 115.64 124.99 2k8p s THR 77 Ca -0.06 0.34 -0.04 0.00 0.31 0.00 0.00 61.69 62.25 2k8p s THR 77 Cb -0.15 -3.87 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 2k8p s THR 77 CO -0.02 -0.09 -0.02 -1.83 -0.69 0.00 0.00 174.62 171.96 2k8p s GLU 78 N 2.23 3.62 0.24 4.92 -1.05 0.62 -4.94 118.70 124.34 2k8p s GLU 78 Ca 0.16 -0.49 -0.19 0.00 -0.15 0.00 0.00 54.97 54.31 2k8p s GLU 78 Cb -0.16 -2.93 -0.08 0.00 -0.44 0.00 0.00 34.13 30.52 2k8p s GLU 78 CO 0.12 0.30 0.72 -1.17 0.95 0.00 0.00 175.26 176.19 2k8p s LEU 79 N 0.20 4.30 0.12 1.83 0.20 -1.25 -1.68 118.68 122.40 2k8p s LEU 79 Ca -0.01 1.39 0.09 0.00 0.69 0.00 0.00 54.13 56.29 2k8p s LEU 79 Cb -0.14 -3.66 -0.04 0.00 -0.43 0.00 0.00 46.19 41.93 2k8p s LEU 79 CO 0.02 -0.00 -0.23 -0.69 -0.29 0.00 0.00 176.35 175.16 2k8p s VAL 80 N -1.59 1.92 -0.31 1.68 1.01 0.03 -3.87 120.40 119.28 2k8p s VAL 80 Ca 0.45 -1.68 -0.13 0.00 0.00 0.00 0.00 61.98 60.62 2k8p s VAL 80 Cb -0.16 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2k8p s VAL 80 CO 0.20 -0.05 0.26 0.00 0.00 0.00 0.00 175.10 175.52 2k8p s SER 82 N 1.73 5.47 -0.47 0.00 1.04 -0.84 -4.98 113.70 115.65 2k8p s SER 82 Ca 0.09 -0.55 0.03 0.00 0.48 0.00 0.00 55.95 55.99 2k8p s SER 82 Cb -0.16 -0.42 0.13 0.00 0.10 0.00 0.00 66.02 65.67 2k8p s SER 82 CO 0.11 -0.89 0.25 -0.83 0.98 0.00 0.00 173.24 172.85 2k8p s GLY 83 N -4.40 2.03 -0.24 7.32 0.00 -1.26 -4.45 107.32 106.32 2k8p s GLY 83 Ca 0.56 -2.90 -0.03 0.00 0.00 0.00 0.00 44.72 42.34 2k8p s GLY 83 CO 0.34 1.29 0.37 1.62 0.00 0.00 0.00 173.10 176.72 2k8p s GLN 84 N 0.07 0.34 0.36 2.90 0.74 -1.26 -4.98 119.66 117.82 2k8p s GLN 84 Ca 0.17 0.57 -0.03 0.00 0.05 0.00 0.00 55.36 56.11 2k8p s GLN 84 Cb -0.25 -0.44 0.01 0.00 1.10 0.00 0.00 33.01 33.44 2k8p s GLN 84 CO 0.00 -0.61 0.52 0.00 -0.55 0.00 0.00 175.29 174.66 2k8p s GLY 86 N -3.17 -0.05 0.00 0.00 0.00 -1.25 -4.77 107.32 98.08 2k8p s GLY 86 Ca 0.28 -0.28 0.00 0.00 0.00 0.00 0.00 44.72 44.72 2k8p s GLY 86 CO 0.20 -0.22 0.07 -1.55 0.00 0.00 0.00 173.10 171.59 2k8p n PRO 87 N -0.39 0.00 -2.62 2.90 -0.04 -1.26 -4.62 135.00 128.97 2k8p n PRO 87 Ca -0.08 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.34 2k8p n PRO 87 Cb 0.62 -0.39 -0.04 0.00 -0.04 0.00 0.00 33.50 33.65 2k8p n PRO 87 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k8p n ALA 88 N -2.35 -3.67 -1.97 0.55 0.00 -1.21 -4.85 120.51 107.01 2k8p n ALA 88 Ca 0.00 1.94 -0.41 0.00 0.00 0.00 0.00 53.44 54.97 2k8p n ALA 88 Cb 0.00 -3.80 -0.03 0.00 0.00 0.00 0.00 19.45 15.63 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 -0.93 4.35 0.53 0.00 1.81 -1.26 -5.03 118.95 118.42 2k8p s ARG 89 Ca -0.22 2.13 0.06 0.00 -1.72 0.00 0.00 55.73 55.99 2k8p s ARG 89 Cb 0.01 -3.17 0.04 0.00 -0.45 0.00 0.00 34.95 31.38 2k8p s ARG 89 CO 0.79 -0.31 0.45 -0.51 -0.68 0.00 0.00 175.30 175.04 2k8p s LEU 90 N -0.18 2.82 0.96 2.53 1.43 -1.26 -5.10 118.68 119.88 2k8p s LEU 90 Ca 0.58 -1.15 -0.13 0.00 -1.03 0.00 0.00 54.13 52.39 2k8p s LEU 90 Cb -0.38 -1.32 0.04 0.00 0.03 0.00 0.00 46.19 44.56 2k8p s LEU 90 CO 0.40 -1.09 0.37 0.18 0.23 0.00 0.00 176.35 176.44 2k8p n LEU 91 N -1.80 -0.40 0.27 1.79 4.32 -1.26 -4.87 117.00 115.05 2k8p n LEU 91 Ca 0.01 0.30 0.17 0.00 -0.02 0.00 0.00 56.01 56.47 2k8p n LEU 91 Cb 0.64 -1.19 0.69 0.00 -1.62 0.00 0.00 43.42 41.94 2k8p n LEU 91 CO 0.39 -3.61 0.99 1.55 -1.22 0.00 0.00 177.39 175.49 2k8p h PRO 92 N -1.60 0.00 -0.59 3.23 0.13 -2.04 -3.03 132.00 128.09 2k8p h PRO 92 Ca -0.44 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.25 2k8p h PRO 92 Cb 1.29 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 32.07 2k8p h PRO 92 CO 0.34 0.00 -0.77 0.09 -0.23 0.00 0.00 178.00 177.44 2k8p n ASN 93 N -3.01 4.21 -1.19 1.44 3.02 -1.26 -4.63 115.26 113.83 2k8p n ASN 93 Ca 0.01 -3.73 0.02 0.00 -0.03 0.00 0.00 54.58 50.85 2k8p n ASN 93 Cb 0.29 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 2k8p n ASN 93 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k8p n ALA 94 N -0.78 2.44 -0.26 5.41 0.00 -1.14 -4.96 120.51 121.22 2k8p n ALA 94 Ca 0.38 -1.78 0.00 0.00 0.00 0.00 0.00 53.44 52.04 2k8p n ALA 94 Cb 0.91 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.75 2k8p n ALA 94 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2k8p n ILE 95 N 0.32 0.00 0.00 0.00 5.41 -1.26 -4.77 119.36 119.05 2k8p n ILE 95 Ca 0.00 0.39 0.00 0.00 1.00 0.00 0.00 62.75 64.14 2k8p n ILE 95 Cb 0.98 -1.13 0.00 0.00 -0.71 0.00 0.00 39.64 38.78 2k8p n ILE 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2k8p n GLY 96 N 2.08 3.60 2.47 7.39 0.00 -1.26 -5.02 105.19 114.45 2k8p n GLY 96 Ca 0.00 -0.72 -0.05 0.00 0.00 0.00 0.00 46.02 45.26 2k8p n GLY 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k8p n ARG 97 N 0.00 -4.30 -4.11 1.61 3.00 -1.26 -5.04 116.66 106.56 2k8p n ARG 97 Ca 0.00 3.26 -0.26 0.00 -0.00 0.00 0.00 57.85 60.86 2k8p n ARG 97 Cb 0.00 -4.70 -0.17 0.00 0.00 0.00 0.00 32.46 27.59 2k8p n ARG 97 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2k8p s GLY 98 N -0.60 0.78 -0.27 5.14 0.00 -1.26 -5.11 107.32 106.00 2k8p s GLY 98 Ca -0.24 -0.46 -0.26 0.00 0.00 0.00 0.00 44.72 43.75 2k8p s GLY 98 CO 0.65 0.60 1.20 -1.59 0.00 0.00 0.00 173.10 173.96 2k8p s LYS 99 N 1.37 0.32 -0.25 2.90 0.00 -1.26 -5.05 119.74 117.78 2k8p s LYS 99 Ca -0.02 0.28 0.10 0.00 0.00 0.00 0.00 55.97 56.33 2k8p s LYS 99 Cb -0.14 0.16 0.44 0.00 0.00 0.00 0.00 37.83 38.29 2k8p s LYS 99 CO -0.04 -0.06 1.27 0.91 0.00 0.00 0.00 175.35 177.42 2k8p n TRP 100 N 1.54 0.75 0.00 1.78 5.03 -1.26 -5.00 117.44 120.28 2k8p n TRP 100 Ca -0.10 -1.68 0.00 0.00 3.03 0.00 0.00 57.50 58.75 2k8p n TRP 100 Cb 0.57 -0.33 0.00 0.00 -1.03 0.00 0.00 31.31 30.52 2k8p n TRP 100 CO 0.00 0.00 0.00 1.87 -0.03 0.00 0.00 177.69 179.53 2k8p n TRP 101 N -1.04 0.00 -0.78 -5.99 -0.00 -1.26 -4.89 117.44 103.48 2k8p n TRP 101 Ca 0.27 0.00 -0.33 0.00 -0.00 0.00 0.00 57.50 57.44 2k8p n TRP 101 Cb 0.80 0.00 0.13 0.00 -0.00 0.00 0.00 31.31 32.23 2k8p n TRP 101 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 2k8p n ARG 102 N 0.00 -0.38 -1.08 5.87 1.74 -1.26 -4.98 116.66 116.57 2k8p n ARG 102 Ca 0.00 -0.07 -0.30 0.00 -0.77 0.00 0.00 57.85 56.71 2k8p n ARG 102 Cb 0.00 -1.86 0.24 0.00 -1.02 0.00 0.00 32.46 29.82 2k8p n ARG 102 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2k8p s PRO 103 N -3.65 -1.26 0.00 5.56 0.04 -1.26 -5.06 135.00 129.37 2k8p s PRO 103 Ca 0.57 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.53 2k8p s PRO 103 Cb -0.21 -1.59 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2k8p s PRO 103 CO 0.67 -3.73 0.00 0.43 0.04 0.00 0.00 177.00 174.41 2k8p n SER 104 N -4.77 0.00 0.00 6.66 7.64 -1.26 -5.03 113.62 116.86 2k8p n SER 104 Ca 0.13 0.04 0.00 0.00 1.01 0.00 0.00 58.87 60.05 2k8p n SER 104 Cb 0.59 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 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 1.74 2.07 3.70 0.23 0.00 -1.26 -5.08 105.19 106.58 2k8p n GLY 105 Ca 0.00 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 4.30 -0.78 1.61 0.04 -1.26 -4.93 135.00 133.97 2k8p s PRO 106 Ca 0.00 2.02 -0.02 0.00 0.04 0.00 0.00 61.00 63.05 2k8p s PRO 106 Cb 0.00 -3.45 0.38 0.00 0.04 0.00 0.00 34.50 31.47 2k8p s PRO 106 CO 0.00 -0.52 1.99 -0.25 0.04 0.00 0.00 177.00 178.26 2k8p n ASP 107 N 4.80 7.46 -4.94 6.66 8.00 -1.26 -4.88 116.55 132.39 2k8p n ASP 107 Ca 0.13 -3.82 -0.25 0.00 0.71 0.00 0.00 54.79 51.55 2k8p n ASP 107 Cb 0.43 -1.02 0.01 0.00 -0.02 0.00 0.00 41.12 40.53 2k8p n ASP 107 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2k8p s PHE 108 N -3.99 1.43 -0.12 1.24 0.08 -1.26 -4.17 117.98 111.19 2k8p s PHE 108 Ca 0.55 -0.86 0.19 0.00 0.12 0.00 0.00 56.93 56.93 2k8p s PHE 108 Cb 0.46 -1.95 -0.23 0.00 -0.57 0.00 0.00 43.02 40.73 2k8p s PHE 108 CO -0.30 -0.68 0.49 2.89 -0.10 0.00 0.00 175.22 177.52 2k8p n ARG 109 N -1.91 0.65 -4.14 0.44 1.85 -1.21 -1.58 116.66 110.77 2k8p n ARG 109 Ca 0.02 0.02 -0.20 0.00 -1.00 0.00 0.00 57.85 56.68 2k8p n ARG 109 Cb 0.64 -1.63 -0.16 0.00 -1.05 0.00 0.00 32.46 30.25 2k8p n ARG 109 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2k8p s ILE 111 N 1.00 3.48 1.23 0.00 -4.36 0.85 -4.84 121.20 118.56 2k8p s ILE 111 Ca -0.10 -1.58 -0.20 0.00 -0.26 0.00 0.00 60.65 58.51 2k8p s ILE 111 Cb -0.14 -2.76 0.30 0.00 1.25 0.00 0.00 42.46 41.11 2k8p s ILE 111 CO -0.00 -0.15 1.11 -2.16 0.24 0.00 0.00 174.94 173.98 2k8p s PRO 112 N -3.00 -1.48 0.03 0.37 0.04 -1.26 -1.16 135.00 128.55 2k8p s PRO 112 Ca 0.27 -0.15 -0.00 0.00 0.04 0.00 0.00 61.00 61.15 2k8p s PRO 112 Cb -0.09 -1.57 0.00 0.00 0.04 0.00 0.00 34.50 32.88 2k8p s PRO 112 CO 0.17 -3.86 0.04 -3.47 0.04 0.00 0.00 177.00 169.92 2k8p n ASP 113 N -4.85 -0.12 -4.55 6.66 -0.08 -1.23 -4.13 116.55 108.25 2k8p n ASP 113 Ca 0.14 -1.17 -0.42 0.00 -1.51 0.00 0.00 54.79 51.84 2k8p n ASP 113 Cb 0.60 0.22 0.01 0.00 2.34 0.00 0.00 41.12 44.29 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 -0.05 1.05 -3.46 -0.67 0.63 -1.26 -4.63 116.66 108.27 2k8p n ARG 114 Ca 0.00 0.38 -0.22 0.00 -0.92 0.00 0.00 57.85 57.09 2k8p n ARG 114 Cb 0.05 -1.83 0.01 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 -1.32 2.00 -0.08 -0.14 1.51 -1.26 -1.04 117.35 117.01 2k8p s TYR 115 Ca 0.63 -0.66 -0.03 0.00 -1.01 0.00 0.00 57.07 56.00 2k8p s TYR 115 Cb -0.59 -2.12 0.05 0.00 -0.11 0.00 0.00 41.96 39.19 2k8p s TYR 115 CO 0.57 -0.56 0.16 1.03 -1.11 0.00 0.00 175.55 175.63 2k8p s ARG 116 N -4.35 0.03 -0.44 -0.62 0.52 0.82 -4.52 118.95 110.39 2k8p s ARG 116 Ca 0.48 0.55 -0.16 0.00 -0.52 0.00 0.00 55.73 56.08 2k8p s ARG 116 Cb -0.04 -0.31 0.04 0.00 0.52 0.00 0.00 34.95 35.16 2k8p s ARG 116 CO 0.29 -0.32 0.38 0.00 0.02 0.00 0.00 175.30 175.68 2k8p s ALA 117 N 2.29 3.49 -0.21 2.13 0.00 -1.26 -1.66 121.76 126.53 2k8p s ALA 117 Ca 0.03 -1.81 -0.10 0.00 0.00 0.00 0.00 51.96 50.08 2k8p s ALA 117 Cb -0.12 -3.01 -0.05 0.00 0.00 0.00 0.00 23.12 19.94 2k8p s ALA 117 CO -0.06 -1.61 0.13 -1.14 0.00 0.00 0.00 175.76 173.08 2k8p s GLN 118 N 1.82 4.08 -0.22 0.00 0.74 -0.72 -4.86 119.66 120.51 2k8p s GLN 118 Ca 0.07 -0.27 -0.23 0.00 0.05 0.00 0.00 55.36 54.97 2k8p s GLN 118 Cb -0.20 -3.42 -0.01 0.00 1.10 0.00 0.00 33.01 30.47 2k8p s GLN 118 CO 0.10 0.19 0.75 1.03 -0.55 0.00 0.00 175.29 176.81 2k8p s ARG 119 N 0.67 4.20 0.15 1.67 0.52 -1.26 -1.34 118.95 123.56 2k8p s ARG 119 Ca 0.07 0.82 -0.00 0.00 -0.52 0.00 0.00 55.73 56.10 2k8p s ARG 119 Cb -0.12 -3.62 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 2k8p s ARG 119 CO 0.01 -0.40 0.32 0.54 0.02 0.00 0.00 175.30 175.79 2k8p s VAL 120 N 2.44 5.27 -0.31 3.52 0.11 0.66 -4.91 120.40 127.18 2k8p s VAL 120 Ca 0.33 -0.43 -0.05 0.00 -2.93 0.00 0.00 61.98 58.90 2k8p s VAL 120 Cb -0.16 -3.71 0.03 0.00 -1.53 0.00 0.00 36.38 31.02 2k8p s VAL 120 CO 0.09 -0.07 0.06 -1.58 -3.33 0.00 0.00 175.10 170.28 2k8p s GLN 121 N -3.07 2.70 -0.15 1.54 0.74 -1.26 -1.14 119.66 119.01 2k8p s GLN 121 Ca 0.37 -1.11 -0.12 0.00 0.05 0.00 0.00 55.36 54.55 2k8p s GLN 121 Cb -0.11 -3.34 -0.05 0.00 1.10 0.00 0.00 33.01 30.61 2k8p s GLN 121 CO 0.28 -0.58 0.23 -0.51 -0.55 0.00 0.00 175.29 174.16 2k8p s LEU 122 N 1.39 4.27 0.05 3.68 1.43 0.88 -1.31 118.68 129.07 2k8p s LEU 122 Ca -0.01 0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 53.54 2k8p s LEU 122 Cb -0.19 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 2k8p s LEU 122 CO 0.01 0.18 0.19 -0.76 0.23 0.00 0.00 176.35 176.21 2k8p s LEU 123 N 0.11 4.32 0.17 1.79 2.01 0.89 -0.10 118.68 127.87 2k8p s LEU 123 Ca 0.14 0.26 0.09 0.00 0.01 0.00 0.00 54.13 54.64 2k8p s LEU 123 Cb -0.13 -2.86 -0.04 0.00 0.01 0.00 0.00 46.19 43.17 2k8p s LEU 123 CO 0.03 0.19 -0.20 0.00 1.01 0.00 0.00 176.35 177.37 2k8p s PRO 125 N -2.69 -0.27 -0.22 0.00 0.04 -1.26 -4.82 135.00 125.78 2k8p s PRO 125 Ca 0.17 0.28 -0.36 0.00 0.04 0.00 0.00 61.00 61.12 2k8p s PRO 125 Cb -0.07 -1.68 -0.13 0.00 0.04 0.00 0.00 34.50 32.67 2k8p s PRO 125 CO 0.07 -3.15 1.92 0.41 0.04 0.00 0.00 177.00 176.29 2k8p n GLY 126 N -1.01 1.02 0.00 0.56 0.00 -1.26 -2.77 105.19 101.74 2k8p n GLY 126 Ca 0.08 0.90 0.00 0.00 0.00 0.00 0.00 46.02 47.00 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 4.89 0.14 3.60 -0.02 0.00 -1.26 -5.12 105.19 107.42 2k8p n GLY 127 Ca 0.29 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.20 2k8p n GLY 127 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k8p s GLU 128 N 0.00 0.59 0.57 1.61 2.02 -1.11 -5.17 118.70 117.20 2k8p s GLU 128 Ca 0.00 0.32 -0.08 0.00 0.02 0.00 0.00 54.97 55.22 2k8p s GLU 128 Cb 0.00 0.28 -0.03 0.00 0.10 0.00 0.00 34.13 34.48 2k8p s GLU 128 CO 0.00 -0.15 0.92 0.00 0.02 0.00 0.00 175.26 176.05 2k8p s ALA 129 N -0.63 3.23 0.48 5.21 0.00 -1.26 -4.54 121.76 124.24 2k8p s ALA 129 Ca -0.01 -0.33 -0.22 0.00 0.00 0.00 0.00 51.96 51.41 2k8p s ALA 129 Cb -0.02 -2.83 -0.07 0.00 0.00 0.00 0.00 23.12 20.20 2k8p s ALA 129 CO -0.01 -0.58 1.16 -1.25 0.00 0.00 0.00 175.76 175.08 2k8p s PRO 130 N -4.99 3.68 0.30 0.00 0.04 -1.26 -4.55 135.00 128.21 2k8p s PRO 130 Ca 0.52 1.75 0.01 0.00 0.04 0.00 0.00 61.00 63.31 2k8p s PRO 130 Cb -0.11 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 32.11 2k8p s PRO 130 CO 0.49 -0.61 0.04 0.54 0.04 0.00 0.00 177.00 177.51 2k8p n ARG 131 N -0.64 1.24 -4.06 4.56 1.74 0.85 -4.95 116.66 115.40 2k8p n ARG 131 Ca 0.08 -2.11 -0.11 0.00 -0.77 0.00 0.00 57.85 54.93 2k8p n ARG 131 Cb 0.49 0.51 -0.11 0.00 -1.02 0.00 0.00 32.46 32.32 2k8p n ARG 131 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k8p s ALA 132 N -2.50 0.52 -0.06 7.54 0.00 -1.26 -0.08 121.76 125.93 2k8p s ALA 132 Ca 0.03 -0.83 -0.02 0.00 0.00 0.00 0.00 51.96 51.14 2k8p s ALA 132 Cb -0.00 0.10 0.04 0.00 0.00 0.00 0.00 23.12 23.25 2k8p s ALA 132 CO 0.02 -0.11 0.11 0.50 0.00 0.00 0.00 175.76 176.29 2k8p s ARG 133 N -2.02 0.03 -0.10 0.00 3.00 -0.29 -4.94 118.95 114.63 2k8p s ARG 133 Ca -0.07 0.36 -0.21 0.00 -1.00 0.00 0.00 55.73 54.81 2k8p s ARG 133 Cb -0.07 -0.25 -0.04 0.00 0.00 0.00 0.00 34.95 34.60 2k8p s ARG 133 CO -0.01 -0.21 0.61 0.21 0.00 0.00 0.00 175.30 175.90 2k8p s LYS 134 N 1.45 4.38 -0.18 5.12 2.20 -1.26 -0.25 119.74 131.20 2k8p s LYS 134 Ca -0.06 0.69 -0.02 0.00 -0.36 0.00 0.00 55.97 56.23 2k8p s LYS 134 Cb -0.12 -3.46 -0.00 0.00 -1.51 0.00 0.00 37.83 32.74 2k8p s LYS 134 CO -0.05 0.07 -0.11 0.14 -0.36 0.00 0.00 175.35 175.04 2k8p s VAL 135 N 0.85 2.97 -0.54 4.02 -7.23 -0.45 -4.95 120.40 115.06 2k8p s VAL 135 Ca 0.32 -0.65 -0.22 0.00 -1.81 0.00 0.00 61.98 59.63 2k8p s VAL 135 Cb -0.16 -2.30 0.05 0.00 0.56 0.00 0.00 36.38 34.53 2k8p s VAL 135 CO 0.14 0.48 0.80 -0.60 -0.31 0.00 0.00 175.10 175.62 2k8p s ARG 136 N 1.09 3.21 0.04 4.82 3.52 -1.26 -1.76 118.95 128.61 2k8p s ARG 136 Ca 0.00 -0.62 0.08 0.00 -0.13 0.00 0.00 55.73 55.07 2k8p s ARG 136 Cb -0.15 -4.10 -0.03 0.00 -1.56 0.00 0.00 34.95 29.12 2k8p s ARG 136 CO -0.03 -1.41 -0.23 -0.48 -0.81 0.00 0.00 175.30 172.34 2k8p s LEU 137 N 3.37 2.16 0.32 -0.88 2.34 -0.66 -4.96 118.68 120.36 2k8p s LEU 137 Ca 0.23 -0.54 -0.27 0.00 0.06 0.00 0.00 54.13 53.60 2k8p s LEU 137 Cb -0.16 -1.11 -0.13 0.00 -0.56 0.00 0.00 46.19 44.23 2k8p s LEU 137 CO 0.15 0.21 1.06 0.52 -1.06 0.00 0.00 176.35 177.22 2k8p n VAL 138 N 1.88 2.06 -0.08 1.48 0.31 -1.25 -0.12 118.33 122.61 2k8p n VAL 138 Ca -0.17 -0.50 -0.09 0.00 -0.01 0.00 0.00 64.34 63.57 2k8p n VAL 138 Cb 0.53 -1.13 -0.10 0.00 -0.91 0.00 0.00 33.84 32.23 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 0.11 1.64 -4.19 3.52 0.00 -0.21 -3.92 120.51 117.46 2k8p n ALA 139 Ca 0.09 -0.85 -0.21 0.00 0.00 0.00 0.00 53.44 52.47 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 -1.13 0.00 0.00 0.00 177.50 176.37 2k8p n SER 140 N -2.75 -0.85 -3.62 0.00 3.41 -0.41 -4.99 113.62 104.41 2k8p n SER 140 Ca -0.27 -3.09 -0.15 0.00 -0.26 0.00 0.00 58.87 55.10 2k8p n SER 140 Cb 0.90 1.85 -0.07 0.00 -0.26 0.00 0.00 64.21 66.63 2k8p n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p s LYS 142 N -0.17 1.29 -0.34 0.00 1.02 -0.31 -4.91 119.74 116.33 2k8p s LYS 142 Ca -0.04 -1.13 -0.04 0.00 0.02 0.00 0.00 55.97 54.79 2k8p s LYS 142 Cb -0.03 -1.55 0.06 0.00 -0.52 0.00 0.00 37.83 35.79 2k8p s LYS 142 CO 0.04 0.37 0.08 0.00 -0.92 0.00 0.00 175.35 174.92 2k8p s LYS 144 N 1.29 2.36 -0.51 0.00 2.47 0.92 -4.91 119.74 121.37 2k8p s LYS 144 Ca -0.02 -1.27 -0.28 0.00 -1.56 0.00 0.00 55.97 52.84 2k8p s LYS 144 Cb -0.20 -2.88 0.02 0.00 -1.46 0.00 0.00 37.83 33.31 2k8p s LYS 144 CO -0.00 -0.53 1.32 1.03 0.16 0.00 0.00 175.35 177.33 2k8p s ARG 145 N 1.14 3.50 0.27 4.03 1.81 -1.20 -3.28 118.95 125.23 2k8p s ARG 145 Ca -0.07 0.57 0.02 0.00 -1.72 0.00 0.00 55.73 54.54 2k8p s ARG 145 Cb -0.19 -4.03 -0.04 0.00 -0.45 0.00 0.00 34.95 30.24 2k8p s ARG 145 CO -0.06 -1.68 0.15 -0.51 -0.68 0.00 0.00 175.30 172.52 2k8p s LEU 146 N 5.36 1.54 -0.29 2.53 1.43 -0.62 -4.98 118.68 123.66 2k8p s LEU 146 Ca 0.52 -1.49 -0.27 0.00 -1.03 0.00 0.00 54.13 51.86 2k8p s LEU 146 Cb -0.10 0.23 0.18 0.00 0.03 0.00 0.00 46.19 46.53 2k8p s LEU 146 CO 0.29 -0.85 1.37 0.28 0.23 0.00 0.00 176.35 177.67 2k8p s THR 147 N -3.77 0.00 0.30 5.49 -1.32 -1.26 -4.43 115.64 110.65 2k8p s THR 147 Ca 0.37 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 60.83 2k8p s THR 147 Cb 0.06 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 70.11 2k8p s THR 147 CO 0.16 0.00 0.41 -1.14 -2.21 0.00 0.00 174.62 171.84 2k8p n ARG 148 N 1.20 0.06 0.00 7.08 0.63 -1.26 -5.04 116.66 119.33 2k8p n ARG 148 Ca -0.07 -0.91 0.00 0.00 -0.92 0.00 0.00 57.85 55.95 2k8p n ARG 148 Cb 0.58 -0.33 0.00 0.00 0.45 0.00 0.00 32.46 33.15 2k8p n ARG 148 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2k8p n PHE 149 N -2.18 0.00 0.00 -0.14 3.72 -1.26 -5.12 117.46 112.48 2k8p n PHE 149 Ca 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.46 2k8p n PHE 149 Cb 0.21 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.75 2k8p n PHE 149 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 2k8p n HIS 150 N -1.94 -0.34 -1.24 1.38 -0.00 -1.26 -5.17 115.22 106.65 2k8p n HIS 150 Ca 0.00 0.00 0.17 0.00 -0.00 0.00 0.00 57.72 57.89 2k8p n HIS 150 Cb 0.00 0.07 -0.05 0.00 -0.00 0.00 0.00 29.99 30.01 2k8p n HIS 150 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 2k8p n ASN 151 N -1.59 -7.42 -2.28 0.26 3.02 -1.26 -5.03 115.26 100.96 2k8p n ASN 151 Ca 0.00 0.66 -0.02 0.00 -0.03 0.00 0.00 54.58 55.18 2k8p n ASN 151 Cb 0.00 -3.87 -0.02 0.00 -0.61 0.00 0.00 39.78 35.28 2k8p n ASN 151 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 2k8p n GLN 152 N -3.90 -4.17 -3.15 3.52 7.27 -1.26 -5.08 117.38 110.60 2k8p n GLN 152 Ca -0.01 3.15 0.05 0.00 0.07 0.00 0.00 57.00 60.27 2k8p n GLN 152 Cb 0.57 -4.26 -0.02 0.00 2.41 0.00 0.00 30.24 28.94 2k8p n GLN 152 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2k8p s SER 153 N -0.53 -0.55 -0.27 1.69 0.15 -1.26 -5.17 113.70 107.76 2k8p s SER 153 Ca -0.12 0.34 -0.30 0.00 0.70 0.00 0.00 55.95 56.57 2k8p s SER 153 Cb 0.01 1.46 0.18 0.00 -1.71 0.00 0.00 66.02 65.96 2k8p s SER 153 CO 0.33 -0.10 1.32 -1.61 1.20 0.00 0.00 173.24 174.37 2k8p s GLU 154 N 2.94 0.13 -0.33 5.44 0.41 -1.26 -5.14 118.70 120.89 2k8p s GLU 154 Ca 0.02 0.02 -0.08 0.00 -0.41 0.00 0.00 54.97 54.52 2k8p s GLU 154 Cb -0.11 0.06 0.19 0.00 -1.78 0.00 0.00 34.13 32.49 2k8p s GLU 154 CO -0.12 -0.04 1.00 -1.17 -0.49 0.00 0.00 175.26 174.44 2k8p s LEU 155 N -1.11 -0.46 0.45 1.80 2.96 -1.26 -5.17 118.68 115.89 2k8p s LEU 155 Ca 0.08 -0.19 -0.10 0.00 -0.22 0.00 0.00 54.13 53.70 2k8p s LEU 155 Cb -0.01 0.69 -0.06 0.00 0.50 0.00 0.00 46.19 47.31 2k8p s LEU 155 CO -0.07 -0.06 0.81 -0.75 -1.32 0.00 0.00 176.35 174.97 2k8p s LYS 156 N 2.09 3.72 -0.30 1.98 2.47 -1.26 -5.08 119.74 123.36 2k8p s LYS 156 Ca 0.16 0.46 -0.05 0.00 -1.56 0.00 0.00 55.97 54.99 2k8p s LYS 156 Cb 0.02 -2.34 0.19 0.00 -1.46 0.00 0.00 37.83 34.23 2k8p s LYS 156 CO -0.15 -0.14 0.73 0.16 0.16 0.00 0.00 175.35 176.11 2k8p s ASP 157 N -3.47 -1.12 -0.43 1.43 -4.77 -1.26 -5.11 116.67 101.95 2k8p s ASP 157 Ca 0.51 0.70 0.06 0.00 -3.30 0.00 0.00 52.55 50.52 2k8p s ASP 157 Cb -0.10 1.94 0.18 0.00 -1.09 0.00 0.00 42.92 43.84 2k8p s ASP 157 CO 0.36 -0.21 0.57 -0.36 0.70 0.00 0.00 175.17 176.23 2k8p s PHE 158 N 2.89 -1.13 -0.27 2.11 0.08 -1.26 -5.13 117.98 115.27 2k8p s PHE 158 Ca 0.14 -0.42 -0.11 0.00 0.12 0.00 0.00 56.93 56.66 2k8p s PHE 158 Cb -0.14 0.04 0.10 0.00 -0.57 0.00 0.00 43.02 42.46 2k8p s PHE 158 CO -0.18 -1.12 0.61 0.20 -0.10 0.00 0.00 175.22 174.63 2k8p s GLY 159 N 1.36 -0.62 -0.29 4.36 0.00 -1.26 -5.15 107.32 105.72 2k8p s GLY 159 Ca 0.21 2.20 -0.18 0.00 0.00 0.00 0.00 44.72 46.95 2k8p s GLY 159 CO -0.06 2.69 0.94 -1.08 0.00 0.00 0.00 173.10 175.59 2k8p s THR 160 N 2.39 0.00 0.37 0.90 -1.32 -1.26 -5.18 115.64 111.54 2k8p s THR 160 Ca -0.07 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.34 2k8p s THR 160 Cb -0.10 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.92 2k8p s THR 160 CO -0.18 0.00 0.62 -1.61 -2.21 0.00 0.00 174.62 171.24 2k8p s GLU 161 N 1.17 2.10 0.06 7.08 2.02 -1.26 -5.19 118.70 124.69 2k8p s GLU 161 Ca -0.07 -1.67 -0.05 0.00 0.02 0.00 0.00 54.97 53.20 2k8p s GLU 161 Cb -0.04 0.53 -0.02 0.00 0.10 0.00 0.00 34.13 34.70 2k8p s GLU 161 CO -0.14 -0.93 0.09 0.00 0.02 0.00 0.00 175.26 174.30 2k8p s ALA 162 N -2.61 0.07 -0.37 5.21 0.00 -1.26 -5.13 121.76 117.67 2k8p s ALA 162 Ca 0.24 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.43 2k8p s ALA 162 Cb -0.03 0.35 0.18 0.00 0.00 0.00 0.00 23.12 23.63 2k8p s ALA 162 CO 0.17 -0.41 0.74 0.00 0.00 0.00 0.00 175.76 176.27 2k8p s ALA 163 N -3.53 -2.93 -0.40 0.00 0.00 -1.26 -5.07 121.76 108.57 2k8p s ALA 163 Ca 0.03 0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.63 2k8p s ALA 163 Cb 0.04 -2.78 0.24 0.00 0.00 0.00 0.00 23.12 20.63 2k8p s ALA 163 CO -0.09 -2.22 1.06 -2.13 0.00 0.00 0.00 175.76 172.38 2k8p n ARG 164 N 4.45 0.34 -0.66 0.00 0.63 -1.26 -5.17 116.66 114.99 2k8p n ARG 164 Ca 0.09 -1.15 -0.19 0.00 -0.92 0.00 0.00 57.85 55.68 2k8p n ARG 164 Cb 0.58 -0.63 0.16 0.00 0.45 0.00 0.00 32.46 33.02 2k8p n ARG 164 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2k8p n PRO 165 N 1.94 -2.40 -3.88 -0.14 -0.04 -1.26 -5.10 135.00 124.13 2k8p n PRO 165 Ca 0.07 -1.12 -0.09 0.00 -0.04 0.00 0.00 63.50 62.33 2k8p n PRO 165 Cb 0.66 -1.05 -0.04 0.00 -0.04 0.00 0.00 33.50 33.02 2k8p n PRO 165 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2k8p s GLN 166 N -4.59 1.50 0.22 0.54 -0.21 -1.26 -5.19 119.66 110.68 2k8p s GLN 166 Ca 0.45 -1.06 -0.19 0.00 0.02 0.00 0.00 55.36 54.59 2k8p s GLN 166 Cb -0.04 0.51 0.03 0.00 1.00 0.00 0.00 33.01 34.50 2k8p s GLN 166 CO 0.35 -0.64 0.60 0.15 -2.12 0.00 0.00 175.29 173.63 2k8p s LYS 167 N -3.94 1.52 0.26 2.91 1.02 -1.26 -5.19 119.74 115.06 2k8p s LYS 167 Ca 0.15 -0.89 -0.21 0.00 0.02 0.00 0.00 55.97 55.04 2k8p s LYS 167 Cb -0.01 0.56 0.03 0.00 -0.52 0.00 0.00 37.83 37.88 2k8p s LYS 167 CO 0.04 -0.67 0.70 0.20 -0.92 0.00 0.00 175.35 174.70 2k8p s GLY 168 N -2.89 -0.14 0.20 -3.33 0.00 -1.26 -5.19 107.32 94.72 2k8p s GLY 168 Ca 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 44.72 44.57 2k8p s GLY 168 CO 0.00 -0.08 0.30 -0.96 0.00 0.00 0.00 173.10 172.37 2k8p n ARG 169 N -0.45 0.43 -4.90 2.90 1.85 -1.26 -5.17 116.66 110.07 2k8p n ARG 169 Ca -0.06 -1.49 -0.26 0.00 -1.00 0.00 0.00 57.85 55.04 2k8p n ARG 169 Cb 0.60 1.50 -0.16 0.00 -1.05 0.00 0.00 32.46 33.35 2k8p n ARG 169 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2k8p s LYS 170 N -2.37 1.77 0.19 2.89 2.20 -1.26 -5.12 119.74 118.04 2k8p s LYS 170 Ca 0.15 -0.65 -0.30 0.00 -0.36 0.00 0.00 55.97 54.80 2k8p s LYS 170 Cb -0.01 -1.58 -0.09 0.00 -1.51 0.00 0.00 37.83 34.64 2k8p s LYS 170 CO 0.11 0.30 1.31 -1.25 -0.36 0.00 0.00 175.35 175.46 2k8p s PRO 171 N -0.12 4.39 -0.14 4.03 0.04 -1.26 -5.03 135.00 136.90 2k8p s PRO 171 Ca -0.00 2.04 -0.07 0.00 0.04 0.00 0.00 61.00 63.01 2k8p s PRO 171 Cb -0.10 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 2k8p s PRO 171 CO 0.01 -0.26 0.11 0.50 0.04 0.00 0.00 177.00 177.40 2k8p s ARG 172 N 0.01 3.65 1.09 4.56 6.06 -1.26 -5.10 118.95 127.96 2k8p s ARG 172 Ca 0.57 -0.21 -0.15 0.00 -2.50 0.00 0.00 55.73 53.44 2k8p s ARG 172 Cb -0.36 -3.21 0.23 0.00 0.06 0.00 0.00 34.95 31.67 2k8p s ARG 172 CO 0.37 0.58 1.10 -1.25 -2.50 0.00 0.00 175.30 173.61 2k8p s PRO 173 N -0.48 -0.29 0.04 5.12 0.04 -1.26 -5.09 135.00 133.08 2k8p s PRO 173 Ca 0.11 0.26 0.01 0.00 0.04 0.00 0.00 61.00 61.43 2k8p s PRO 173 Cb -0.12 -1.68 -0.03 0.00 0.04 0.00 0.00 34.50 32.72 2k8p s PRO 173 CO 0.02 -3.16 -0.05 1.03 0.04 0.00 0.00 177.00 174.88 2k8p s ARG 174 N -5.14 0.49 -0.14 4.56 0.52 -1.26 -5.15 118.95 112.84 2k8p s ARG 174 Ca 0.68 -0.85 -0.02 0.00 -0.52 0.00 0.00 55.73 55.01 2k8p s ARG 174 Cb -0.15 -0.03 0.05 0.00 0.52 0.00 0.00 34.95 35.34 2k8p s ARG 174 CO 0.57 -0.03 0.02 0.00 0.02 0.00 0.00 175.30 175.89 2k8p s ALA 175 N -2.15 0.84 0.61 2.13 0.00 -1.26 -5.14 121.76 116.79 2k8p s ALA 175 Ca -0.07 -0.42 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 2k8p s ALA 175 Cb -0.05 -0.98 0.04 0.00 0.00 0.00 0.00 23.12 22.13 2k8p s ALA 175 CO -0.03 -0.86 0.88 1.03 0.00 0.00 0.00 175.76 176.78 2k8p s ARG 176 N 1.92 2.43 0.01 0.00 0.52 -1.26 -5.12 118.95 117.46 2k8p s ARG 176 Ca 0.02 -0.52 -0.12 0.00 -0.52 0.00 0.00 55.73 54.59 2k8p s ARG 176 Cb -0.15 -2.35 0.01 0.00 0.52 0.00 0.00 34.95 32.99 2k8p s ARG 176 CO -0.07 -0.92 0.25 -1.54 0.02 0.00 0.00 175.30 173.05 2k8p s SER 177 N -4.45 -0.09 -0.29 0.23 1.04 -1.26 -5.17 113.70 103.71 2k8p s SER 177 Ca 0.58 -0.11 -0.25 0.00 0.48 0.00 0.00 55.95 56.65 2k8p s SER 177 Cb -0.10 0.29 0.16 0.00 0.10 0.00 0.00 66.02 66.47 2k8p s SER 177 CO 0.41 -0.48 1.25 0.00 0.98 0.00 0.00 173.24 175.40 2k8p s ALA 178 N -1.79 -2.11 -0.05 5.32 0.00 -1.26 -5.07 121.76 116.80 2k8p s ALA 178 Ca -0.11 1.77 0.01 0.00 0.00 0.00 0.00 51.96 53.63 2k8p s ALA 178 Cb -0.04 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.44 2k8p s ALA 178 CO 0.01 -0.17 -0.04 1.63 0.00 0.00 0.00 175.76 177.19 2k8p n LYS 179 N 1.80 0.48 0.00 0.00 4.76 -1.26 -5.02 118.16 118.92 2k8p n LYS 179 Ca -0.11 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 2k8p n LYS 179 Cb 0.56 -1.11 0.00 0.00 -1.84 0.00 0.00 35.03 32.64 2k8p n LYS 179 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k8p n ALA 180 N -2.61 0.00 -1.30 7.82 0.00 -1.26 -4.92 120.51 118.24 2k8p n ALA 180 Ca -0.10 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.51 2k8p n ALA 180 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.00 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 2.29 -7.79 -4.52 0.00 5.15 -1.26 -4.99 115.26 104.14 2k8p n ASN 181 Ca 0.00 0.83 -0.27 0.00 -0.60 0.00 0.00 54.58 54.54 2k8p n ASN 181 Cb 0.00 -4.14 -0.10 0.00 -0.53 0.00 0.00 39.78 35.02 2k8p n ASN 181 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k8p s GLN 182 N -2.88 1.92 -0.16 1.20 -2.07 -1.26 -5.16 119.66 111.25 2k8p s GLN 182 Ca 0.00 -2.13 -0.10 0.00 -1.82 0.00 0.00 55.36 51.31 2k8p s GLN 182 Cb 0.00 -1.22 0.05 0.00 -1.09 0.00 0.00 33.01 30.76 2k8p s GLN 182 CO 0.00 -0.23 0.39 0.00 -1.32 0.00 0.00 175.29 174.13 2k8p s ALA 183 N -3.00 -0.98 0.41 2.60 0.00 -1.26 -5.16 121.76 114.37 2k8p s ALA 183 Ca 0.27 1.38 -0.22 0.00 0.00 0.00 0.00 51.96 53.39 2k8p s ALA 183 Cb 0.07 -0.83 -0.11 0.00 0.00 0.00 0.00 23.12 22.25 2k8p s ALA 183 CO 0.13 -0.24 0.95 -2.00 0.00 0.00 0.00 175.76 174.61 2k8p s GLU 184 N 1.12 4.29 -0.37 0.00 2.12 -1.26 -4.99 118.70 119.60 2k8p s GLU 184 Ca -0.07 1.17 0.07 0.00 0.36 0.00 0.00 54.97 56.50 2k8p s GLU 184 Cb -0.07 -2.31 0.29 0.00 0.26 0.00 0.00 34.13 32.30 2k8p s GLU 184 CO -0.09 0.02 1.26 -0.11 -0.54 0.00 0.00 175.26 175.80 2k8p n LEU 185 N -0.40 -1.68 -3.38 2.70 7.94 -1.26 -5.10 117.00 115.83 2k8p n LEU 185 Ca 0.06 -2.95 -0.12 0.00 -1.11 0.00 0.00 56.01 51.89 2k8p n LEU 185 Cb 0.53 0.29 -0.09 0.00 0.53 0.00 0.00 43.42 44.69 2k8p n LEU 185 CO 0.39 1.67 -0.10 -0.70 -1.11 0.00 0.00 177.39 177.53 2k8p s GLU 186 N 0.15 0.33 -0.04 1.96 -6.30 -1.26 -5.02 118.70 108.52 2k8p s GLU 186 Ca 0.16 0.29 -0.10 0.00 -2.50 0.00 0.00 54.97 52.82 2k8p s GLU 186 Cb 0.29 -0.61 -0.31 0.00 0.00 0.00 0.00 34.13 33.51 2k8p s GLU 186 CO -0.07 -0.78 0.71 -0.91 0.02 0.00 0.00 175.26 174.24 2k8p h ASN 187 N 8.22 0.61 -1.73 -1.70 2.35 -2.06 -3.50 115.58 117.77 2k8p h ASN 187 Ca -0.16 -0.89 0.09 0.00 -0.55 0.00 0.00 56.30 54.79 2k8p h ASN 187 Cb 1.13 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.28 2k8p h ASN 187 CO 0.28 1.75 -0.11 0.00 -1.65 0.00 0.00 177.43 177.70 2k8p n ALA 188 N -2.83 -0.82 1.73 -0.83 0.00 -1.26 -5.35 120.51 111.16 2k8p n ALA 188 Ca -0.23 0.10 0.15 0.00 0.00 0.00 0.00 53.44 53.46 2k8p n ALA 188 Cb 1.08 -0.28 0.72 0.00 0.00 0.00 0.00 19.45 20.96 2k8p n ALA 188 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48