#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 0.00 -4.73 1.61 7.02 -1.26 -5.10 117.44 114.99 2k8p n TRP 2 Ca 0.00 -0.42 -0.26 0.00 -1.02 0.00 0.00 57.50 55.80 2k8p n TRP 2 Cb 0.00 0.16 -0.16 0.00 -2.42 0.00 0.00 31.31 28.89 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 0.00 1.82 -0.30 -0.99 -0.21 -1.26 -5.00 119.66 113.72 2k8p s GLN 3 Ca 0.14 -0.52 0.11 0.00 0.02 0.00 0.00 55.36 55.11 2k8p s GLN 3 Cb 0.16 -1.52 0.36 0.00 1.00 0.00 0.00 33.01 33.02 2k8p s GLN 3 CO -0.07 0.13 1.46 0.00 -2.12 0.00 0.00 175.29 174.69 2k8p n ALA 4 N 3.51 2.83 -1.26 6.09 0.00 -1.26 -5.15 120.51 125.27 2k8p n ALA 4 Ca -0.20 -0.94 0.15 0.00 0.00 0.00 0.00 53.44 52.45 2k8p n ALA 4 Cb 0.52 -0.76 -0.08 0.00 0.00 0.00 0.00 19.45 19.13 2k8p n ALA 4 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2k8p n PHE 5 N -1.36 -3.37 -3.57 0.00 3.72 -1.26 -4.75 117.46 106.87 2k8p n PHE 5 Ca -0.18 1.85 -0.40 0.00 -0.05 0.00 0.00 57.45 58.67 2k8p n PHE 5 Cb 0.85 -3.07 -0.08 0.00 -0.94 0.00 0.00 39.48 36.24 2k8p n PHE 5 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2k8p s LYS 6 N -4.02 2.65 -0.54 -1.08 1.02 -1.26 -4.97 119.74 111.54 2k8p s LYS 6 Ca 0.00 -2.08 0.06 0.00 0.02 0.00 0.00 55.97 53.97 2k8p s LYS 6 Cb 0.00 -3.94 0.21 0.00 -0.52 0.00 0.00 37.83 33.58 2k8p s LYS 6 CO 0.00 -1.20 0.54 0.09 -0.92 0.00 0.00 175.35 173.86 2k8p n ASN 7 N 4.37 1.71 -3.59 2.83 3.02 -1.26 -5.10 115.26 117.23 2k8p n ASN 7 Ca -0.00 -2.95 -0.11 0.00 -0.03 0.00 0.00 54.58 51.49 2k8p n ASN 7 Cb 0.41 -0.66 0.04 0.00 -0.61 0.00 0.00 39.78 38.96 2k8p n ASN 7 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2k8p n ASP 8 N 1.71 1.11 -2.78 6.41 9.92 -1.26 -5.13 116.55 126.53 2k8p n ASP 8 Ca 0.25 -1.82 0.00 0.00 -0.53 0.00 0.00 54.79 52.69 2k8p n ASP 8 Cb 0.44 -0.25 0.00 0.00 -0.64 0.00 0.00 41.12 40.67 2k8p n ASP 8 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k8p n ALA 9 N -2.67 0.00 -2.93 2.24 0.00 -1.26 -4.36 120.51 111.53 2k8p n ALA 9 Ca -0.08 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.20 2k8p n ALA 9 Cb 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.77 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 -0.71 -0.73 -1.18 0.00 -2.24 -1.26 -4.93 114.28 103.24 2k8p n THR 10 Ca 0.00 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 2k8p n THR 10 Cb 0.00 -1.61 0.24 0.00 -2.10 0.00 0.00 70.33 66.86 2k8p n THR 10 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2k8p s GLU 11 N -5.54 -1.24 -0.64 -0.78 2.02 -1.26 -5.00 118.70 106.26 2k8p s GLU 11 Ca 0.21 -0.20 -0.05 0.00 0.02 0.00 0.00 54.97 54.94 2k8p s GLU 11 Cb -0.11 -1.61 0.17 0.00 0.10 0.00 0.00 34.13 32.68 2k8p s GLU 11 CO 0.25 -3.70 0.48 0.42 0.02 0.00 0.00 175.26 172.74 2k8p s ILE 12 N -3.13 4.06 -0.56 -1.63 1.09 -1.26 -4.96 121.20 114.80 2k8p s ILE 12 Ca 0.72 -2.76 0.07 0.00 -1.10 0.00 0.00 60.65 57.58 2k8p s ILE 12 Cb -0.07 -3.62 0.25 0.00 -1.06 0.00 0.00 42.46 37.96 2k8p s ILE 12 CO 0.55 -0.89 0.69 -0.38 -0.10 0.00 0.00 174.94 174.81 2k8p n ILE 13 N 3.72 1.47 -2.09 2.92 2.08 -1.26 -5.07 119.36 121.12 2k8p n ILE 13 Ca 0.07 -4.87 -0.43 0.00 0.56 0.00 0.00 62.75 58.08 2k8p n ILE 13 Cb 0.40 -2.04 -0.03 0.00 -0.75 0.00 0.00 39.64 37.22 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 -2.12 3.46 -0.30 0.38 0.04 -1.26 -4.91 135.00 130.30 2k8p s PRO 14 Ca 0.39 1.36 -0.15 0.00 0.04 0.00 0.00 61.00 62.64 2k8p s PRO 14 Cb 0.16 -4.13 0.18 0.00 0.04 0.00 0.00 34.50 30.74 2k8p s PRO 14 CO -0.04 -1.70 1.12 -2.00 0.04 0.00 0.00 177.00 174.42 2k8p s GLU 15 N 5.34 0.11 1.05 4.56 2.12 -1.26 -5.17 118.70 125.45 2k8p s GLU 15 Ca 0.75 0.18 -0.16 0.00 0.36 0.00 0.00 54.97 56.10 2k8p s GLU 15 Cb -0.21 0.10 0.22 0.00 0.26 0.00 0.00 34.13 34.50 2k8p s GLU 15 CO 0.33 -0.14 1.19 -0.51 -0.54 0.00 0.00 175.26 175.59 2k8p s LEU 16 N 2.97 1.73 0.00 2.70 1.02 -1.26 -5.04 118.68 120.79 2k8p s LEU 16 Ca 0.02 0.59 0.00 0.00 0.02 0.00 0.00 54.13 54.76 2k8p s LEU 16 Cb -0.08 -2.58 0.00 0.00 0.02 0.00 0.00 46.19 43.56 2k8p s LEU 16 CO -0.12 -3.25 0.15 0.61 0.02 0.00 0.00 176.35 173.76 2k8p n GLY 17 N -2.24 -1.39 2.94 -3.19 0.00 -1.26 -4.92 105.19 95.13 2k8p n GLY 17 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 2k8p n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k8p s GLU 18 N -0.31 0.97 -0.72 1.61 2.02 -1.26 -5.08 118.70 115.93 2k8p s GLU 18 Ca 0.00 -0.20 0.04 0.00 0.02 0.00 0.00 54.97 54.84 2k8p s GLU 18 Cb 0.00 -0.91 0.23 0.00 0.10 0.00 0.00 34.13 33.55 2k8p s GLU 18 CO 0.00 -0.01 0.76 0.98 0.02 0.00 0.00 175.26 177.00 2k8p n TYR 19 N 3.80 3.50 -2.17 1.61 9.36 -1.26 -5.07 117.16 126.93 2k8p n TYR 19 Ca -0.23 -4.06 -0.42 0.00 3.32 0.00 0.00 57.90 56.50 2k8p n TYR 19 Cb 0.52 -0.68 -0.03 0.00 -0.63 0.00 0.00 39.34 38.52 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 -2.19 4.25 -0.51 2.98 0.04 -1.26 -4.97 135.00 133.35 2k8p s PRO 20 Ca 0.35 2.02 0.06 0.00 0.04 0.00 0.00 61.00 63.47 2k8p s PRO 20 Cb 0.08 -3.67 0.22 0.00 0.04 0.00 0.00 34.50 31.18 2k8p s PRO 20 CO -0.05 -0.65 0.55 -0.85 0.04 0.00 0.00 177.00 176.04 2k8p n GLU 21 N 5.82 1.29 -1.18 4.56 0.28 -1.26 -5.12 120.64 125.03 2k8p n GLU 21 Ca 0.14 -3.80 -0.29 0.00 -0.16 0.00 0.00 57.16 53.05 2k8p n GLU 21 Cb 0.43 -1.74 0.16 0.00 1.43 0.00 0.00 31.44 31.72 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 -1.37 0.75 0.96 3.44 0.04 -1.26 -5.04 135.00 132.53 2k8p s PRO 22 Ca 0.35 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.91 2k8p s PRO 22 Cb 0.11 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.05 2k8p s PRO 22 CO -0.11 -2.54 1.09 -1.25 0.04 0.00 0.00 177.00 174.23 2k8p s PRO 23 N -4.95 0.74 0.72 0.56 0.04 -1.26 -5.02 135.00 125.82 2k8p s PRO 23 Ca 0.65 0.63 -0.13 0.00 0.04 0.00 0.00 61.00 62.19 2k8p s PRO 23 Cb -0.18 -1.76 0.03 0.00 0.04 0.00 0.00 34.50 32.62 2k8p s PRO 23 CO 0.57 -2.55 1.10 -1.25 0.04 0.00 0.00 177.00 174.91 2k8p s PRO 24 N -4.95 2.52 -0.32 0.56 0.04 -1.26 -5.06 135.00 126.53 2k8p s PRO 24 Ca 0.65 1.28 0.03 0.00 0.04 0.00 0.00 61.00 63.00 2k8p s PRO 24 Cb -0.18 -1.92 0.19 0.00 0.04 0.00 0.00 34.50 32.63 2k8p s PRO 24 CO 0.57 -1.45 0.69 -1.83 0.04 0.00 0.00 177.00 175.03 2k8p s GLU 25 N -4.50 0.54 -0.13 4.56 -1.05 -1.26 -5.02 118.70 111.85 2k8p s GLU 25 Ca 0.64 0.24 0.11 0.00 -0.15 0.00 0.00 54.97 55.82 2k8p s GLU 25 Cb -0.19 0.17 0.26 0.00 -0.44 0.00 0.00 34.13 33.93 2k8p s GLU 25 CO 0.49 -0.93 1.20 1.47 0.95 0.00 0.00 175.26 178.44 2k8p n LEU 26 N 5.01 -0.44 -4.87 1.83 -0.00 -1.26 -5.13 117.00 112.14 2k8p n LEU 26 Ca 0.07 -2.46 -0.31 0.00 -0.00 0.00 0.00 56.01 53.31 2k8p n LEU 26 Cb 0.56 0.08 -0.04 0.00 -0.00 0.00 0.00 43.42 44.02 2k8p n LEU 26 CO -0.06 1.32 0.35 -1.61 -0.00 0.00 0.00 177.39 177.38 2k8p s GLU 27 N -0.44 3.81 -0.29 1.47 8.01 -1.26 -5.09 118.70 124.92 2k8p s GLU 27 Ca 0.12 0.40 -0.17 0.00 0.01 0.00 0.00 54.97 55.33 2k8p s GLU 27 Cb 0.24 -2.50 0.15 0.00 -4.31 0.00 0.00 34.13 27.71 2k8p s GLU 27 CO -0.07 0.13 1.02 1.21 0.01 0.00 0.00 175.26 177.55 2k8p s ASN 28 N -2.77 -0.45 -0.28 -0.19 3.84 -1.26 -5.18 114.94 108.65 2k8p s ASN 28 Ca 0.50 0.73 -0.27 0.00 0.21 0.00 0.00 52.86 54.02 2k8p s ASN 28 Cb -0.11 1.15 0.19 0.00 -0.55 0.00 0.00 41.25 41.93 2k8p s ASN 28 CO 0.25 -0.12 1.36 0.21 -2.79 0.00 0.00 177.10 176.02 2k8p s ASN 29 N 1.22 -0.07 0.15 -4.21 3.84 -1.26 -5.05 114.94 109.56 2k8p s ASN 29 Ca -0.08 0.11 0.11 0.00 0.21 0.00 0.00 52.86 53.21 2k8p s ASN 29 Cb -0.04 0.10 -0.04 0.00 -0.55 0.00 0.00 41.25 40.72 2k8p s ASN 29 CO -0.14 -0.05 -0.26 -1.59 -2.79 0.00 0.00 177.10 172.27 2k8p s LYS 30 N -0.56 1.44 0.12 0.43 0.00 -1.26 -4.94 119.74 114.97 2k8p s LYS 30 Ca 0.08 -1.40 -0.01 0.00 0.00 0.00 0.00 55.97 54.63 2k8p s LYS 30 Cb -0.03 -1.89 -0.04 0.00 0.00 0.00 0.00 37.83 35.88 2k8p s LYS 30 CO -0.10 0.43 0.04 0.95 0.00 0.00 0.00 175.35 176.67 2k8p s THR 31 N -1.25 0.12 -0.30 3.79 -4.23 -1.26 -4.50 115.64 108.01 2k8p s THR 31 Ca 0.16 -1.89 -0.10 0.00 -1.18 0.00 0.00 61.69 58.68 2k8p s THR 31 Cb -0.09 -1.95 0.18 0.00 1.34 0.00 0.00 72.50 71.98 2k8p s THR 31 CO 0.07 -0.57 0.99 -0.32 -0.54 0.00 0.00 174.62 174.26 2k8p s MET 32 N -4.02 0.21 0.30 3.99 1.75 -1.26 -5.18 119.30 115.08 2k8p s MET 32 Ca 0.21 0.25 0.03 0.00 -1.25 0.00 0.00 55.69 54.93 2k8p s MET 32 Cb 0.08 0.12 -0.06 0.00 2.84 0.00 0.00 34.83 37.81 2k8p s MET 32 CO -0.00 -0.34 0.08 1.21 -0.65 0.00 0.00 175.02 175.31 2k8p s ASN 33 N 2.94 1.91 -0.14 1.11 3.84 -1.26 -5.17 114.94 118.17 2k8p s ASN 33 Ca 0.18 -1.39 -0.31 0.00 0.21 0.00 0.00 52.86 51.55 2k8p s ASN 33 Cb -0.05 0.03 0.13 0.00 -0.55 0.00 0.00 41.25 40.81 2k8p s ASN 33 CO -0.20 -0.66 1.07 0.00 -2.79 0.00 0.00 177.10 174.51 2k8p s ARG 34 N -3.94 0.52 -0.28 0.43 1.70 -1.26 -5.18 118.95 110.94 2k8p s ARG 34 Ca 0.37 -0.07 -0.18 0.00 -0.47 0.00 0.00 55.73 55.38 2k8p s ARG 34 Cb 0.08 0.24 0.09 0.00 -0.57 0.00 0.00 34.95 34.79 2k8p s ARG 34 CO 0.15 -0.20 0.76 0.00 -1.08 0.00 0.00 175.30 174.92 2k8p s ALA 35 N -2.05 -1.93 1.09 7.88 0.00 -1.26 -5.17 121.76 120.32 2k8p s ALA 35 Ca 0.05 2.30 -0.18 0.00 0.00 0.00 0.00 51.96 54.13 2k8p s ALA 35 Cb -0.01 -1.43 0.25 0.00 0.00 0.00 0.00 23.12 21.93 2k8p s ALA 35 CO -0.04 -0.36 1.24 -1.21 0.00 0.00 0.00 175.76 175.38 2k8p s GLU 36 N 1.32 -0.37 -0.14 0.00 0.41 -1.26 -5.09 118.70 113.57 2k8p s GLU 36 Ca -0.08 -0.32 -0.06 0.00 -0.41 0.00 0.00 54.97 54.11 2k8p s GLU 36 Cb -0.05 -1.72 0.06 0.00 -1.78 0.00 0.00 34.13 30.65 2k8p s GLU 36 CO -0.15 -3.10 0.31 0.54 -0.49 0.00 0.00 175.26 172.37 2k8p s ASN 37 N -4.49 -0.06 -0.40 -0.19 2.20 -1.26 -5.07 114.94 105.67 2k8p s ASN 37 Ca 0.74 0.70 0.10 0.00 -0.94 0.00 0.00 52.86 53.45 2k8p s ASN 37 Cb -0.05 0.75 0.31 0.00 -2.00 0.00 0.00 41.25 40.26 2k8p s ASN 37 CO 0.54 -0.21 0.75 0.61 -2.94 0.00 0.00 177.10 175.86 2k8p n GLY 38 N 4.88 2.64 0.00 0.45 0.00 -1.26 -5.04 105.19 106.85 2k8p n GLY 38 Ca -0.15 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.64 2k8p n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k8p n GLY 39 N 0.69 1.48 3.81 -0.02 0.00 -1.26 -5.16 105.19 104.72 2k8p n GLY 39 Ca 0.20 0.21 -0.31 0.00 0.00 0.00 0.00 46.02 46.11 2k8p n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8p s ARG 40 N -0.13 2.86 0.96 1.61 1.81 -1.26 -5.04 118.95 119.76 2k8p s ARG 40 Ca 0.00 1.05 -0.12 0.00 -1.72 0.00 0.00 55.73 54.94 2k8p s ARG 40 Cb 0.00 -1.98 0.17 0.00 -0.45 0.00 0.00 34.95 32.69 2k8p s ARG 40 CO 0.00 -1.16 1.09 -1.25 -0.68 0.00 0.00 175.30 173.30 2k8p s PRO 41 N -4.84 0.73 0.86 3.54 0.04 -1.26 -5.05 135.00 129.02 2k8p s PRO 41 Ca 0.60 0.64 -0.15 0.00 0.04 0.00 0.00 61.00 62.13 2k8p s PRO 41 Cb -0.15 -1.76 0.21 0.00 0.04 0.00 0.00 34.50 32.84 2k8p s PRO 41 CO 0.52 -2.56 0.77 -0.35 0.04 0.00 0.00 177.00 175.42 2k8p n PRO 42 N -4.07 -2.51 -1.75 0.56 -0.04 -1.26 -4.95 135.00 120.99 2k8p n PRO 42 Ca 0.06 -1.23 -0.42 0.00 -0.04 0.00 0.00 63.50 61.87 2k8p n PRO 42 Cb 0.56 -1.15 -0.00 0.00 -0.04 0.00 0.00 33.50 32.87 2k8p n PRO 42 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2k8p n HIS 43 N -4.16 2.74 -1.32 0.54 1.44 -1.26 -4.97 115.22 108.23 2k8p n HIS 43 Ca 0.11 0.46 -0.31 0.00 -2.01 0.00 0.00 57.72 55.97 2k8p n HIS 43 Cb 0.41 -2.50 0.09 0.00 0.12 0.00 0.00 29.99 28.11 2k8p n HIS 43 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k8p s HIS 44 N -0.99 2.67 0.49 -1.40 3.76 -1.26 -5.05 115.29 113.51 2k8p s HIS 44 Ca 0.55 1.49 -0.08 0.00 -0.15 0.00 0.00 55.06 56.87 2k8p s HIS 44 Cb -0.51 -3.03 0.12 0.00 1.11 0.00 0.00 32.58 30.27 2k8p s HIS 44 CO 0.62 -1.74 0.43 -0.35 -0.85 0.00 0.00 174.74 172.85 2k8p n PRO 45 N -3.48 -1.87 -0.98 8.40 -0.04 -1.26 -4.93 135.00 130.84 2k8p n PRO 45 Ca 0.09 -0.69 -0.20 0.00 -0.04 0.00 0.00 63.50 62.66 2k8p n PRO 45 Cb 0.53 -0.65 0.13 0.00 -0.04 0.00 0.00 33.50 33.48 2k8p n PRO 45 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2k8p n PHE 46 N -3.45 2.42 -1.56 0.54 -0.00 -1.26 -4.83 117.46 109.32 2k8p n PHE 46 Ca 0.06 -1.67 -0.19 0.00 -0.00 0.00 0.00 57.45 55.64 2k8p n PHE 46 Cb 0.23 -0.85 -0.08 0.00 -0.00 0.00 0.00 39.48 38.78 2k8p n PHE 46 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2k8p n GLU 47 N -0.75 -1.42 -3.08 -4.13 1.02 -1.26 -3.43 120.64 107.60 2k8p n GLU 47 Ca 0.47 1.18 -0.13 0.00 -0.02 0.00 0.00 57.16 58.66 2k8p n GLU 47 Cb 1.33 -5.54 0.01 0.00 -0.02 0.00 0.00 31.44 27.23 2k8p n GLU 47 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2k8p n THR 48 N -2.40 -9.08 -2.91 2.62 -1.04 -1.26 -4.89 114.28 95.32 2k8p n THR 48 Ca -0.19 0.45 -0.44 0.00 -2.04 0.00 0.00 64.05 61.83 2k8p n THR 48 Cb 0.65 -6.24 -0.03 0.00 -1.82 0.00 0.00 70.33 62.89 2k8p n THR 48 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2k8p s LYS 49 N -2.83 3.57 0.09 -2.82 -0.14 -1.22 -4.92 119.74 111.47 2k8p s LYS 49 Ca 0.21 -1.69 -0.09 0.00 -1.36 0.00 0.00 55.97 53.04 2k8p s LYS 49 Cb -0.05 -4.89 0.03 0.00 -1.68 0.00 0.00 37.83 31.25 2k8p s LYS 49 CO 0.79 -1.79 0.43 -3.47 -0.76 0.00 0.00 175.35 170.56 2k8p n ASP 50 N 6.68 -0.77 -3.89 2.83 -0.08 -1.26 -5.12 116.55 114.94 2k8p n ASP 50 Ca 0.22 -1.43 -0.30 0.00 -1.51 0.00 0.00 54.79 51.78 2k8p n ASP 50 Cb 0.49 1.26 -0.13 0.00 2.34 0.00 0.00 41.12 45.08 2k8p n ASP 50 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2k8p s VAL 51 N -2.39 2.38 -0.31 5.18 1.01 -1.26 -5.01 120.40 120.00 2k8p s VAL 51 Ca 0.09 -3.31 0.04 0.00 0.00 0.00 0.00 61.98 58.81 2k8p s VAL 51 Cb -0.01 -2.64 0.17 0.00 0.00 0.00 0.00 36.38 33.90 2k8p s VAL 51 CO 0.03 -0.85 0.48 -0.94 0.00 0.00 0.00 175.10 173.82 2k8p s SER 52 N -0.34 -0.38 0.07 3.32 1.04 -1.26 -5.16 113.70 110.99 2k8p s SER 52 Ca 0.18 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.29 2k8p s SER 52 Cb -0.22 1.44 0.00 0.00 0.10 0.00 0.00 66.02 67.34 2k8p s SER 52 CO -0.03 -0.31 0.03 1.21 0.98 0.00 0.00 173.24 175.12 2k8p n GLU 53 N 5.21 0.94 -2.54 4.02 4.07 -1.26 -4.65 120.64 126.42 2k8p n GLU 53 Ca 0.04 -0.11 -0.04 0.00 -0.06 0.00 0.00 57.16 56.99 2k8p n GLU 53 Cb 0.51 -0.01 -0.03 0.00 -0.06 0.00 0.00 31.44 31.85 2k8p n GLU 53 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2k8p n TYR 54 N -1.09 -4.07 -2.12 4.31 4.01 -1.26 -4.83 117.16 112.11 2k8p n TYR 54 Ca 0.01 2.23 0.10 0.00 -0.16 0.00 0.00 57.90 60.08 2k8p n TYR 54 Cb 0.02 -3.78 -0.03 0.00 -0.31 0.00 0.00 39.34 35.24 2k8p n TYR 54 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2k8p n SER 55 N 1.33 -6.15 -4.73 7.72 2.88 -1.26 -4.66 113.62 108.75 2k8p n SER 55 Ca -0.29 0.82 -0.41 0.00 -1.33 0.00 0.00 58.87 57.65 2k8p n SER 55 Cb 0.45 -2.37 -0.03 0.00 -0.75 0.00 0.00 64.21 61.51 2k8p n SER 55 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k8p s ARG 57 N 0.13 4.20 -0.26 0.00 1.70 -0.41 -4.79 118.95 119.52 2k8p s ARG 57 Ca 0.54 2.44 -0.36 0.00 -0.47 0.00 0.00 55.73 57.88 2k8p s ARG 57 Cb -0.31 -3.05 -0.12 0.00 -0.57 0.00 0.00 34.95 30.91 2k8p s ARG 57 CO 0.34 -0.48 2.01 -1.91 -1.08 0.00 0.00 175.30 174.18 2k8p n GLU 58 N 1.66 1.44 -3.50 3.89 2.13 -1.26 -4.27 120.64 120.73 2k8p n GLU 58 Ca 0.05 0.47 -0.42 0.00 0.66 0.00 0.00 57.16 57.92 2k8p n GLU 58 Cb 0.39 -2.48 -0.09 0.00 0.27 0.00 0.00 31.44 29.53 2k8p n GLU 58 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2k8p s LEU 59 N 5.69 5.26 -0.24 4.31 2.96 -1.19 -5.02 118.68 130.46 2k8p s LEU 59 Ca 1.02 -1.28 -0.07 0.00 -0.22 0.00 0.00 54.13 53.59 2k8p s LEU 59 Cb -0.83 -2.09 -0.02 0.00 0.50 0.00 0.00 46.19 43.74 2k8p s LEU 59 CO 0.53 -0.55 0.05 -1.00 -1.32 0.00 0.00 176.35 174.06 2k8p s HIS 60 N 1.56 3.06 -0.26 5.38 3.76 -1.26 -0.60 115.29 126.94 2k8p s HIS 60 Ca 0.03 -0.52 0.00 0.00 -0.15 0.00 0.00 55.06 54.43 2k8p s HIS 60 Cb -0.22 -2.21 0.04 0.00 1.11 0.00 0.00 32.58 31.30 2k8p s HIS 60 CO 0.06 -0.39 -0.08 -0.06 -0.85 0.00 0.00 174.74 173.42 2k8p s PHE 61 N 1.57 3.17 0.47 1.40 0.08 0.68 -4.94 117.98 120.40 2k8p s PHE 61 Ca 0.06 -1.94 -0.13 0.00 0.12 0.00 0.00 56.93 55.04 2k8p s PHE 61 Cb -0.15 -2.01 -0.07 0.00 -0.57 0.00 0.00 43.02 40.22 2k8p s PHE 61 CO 0.02 -0.81 0.89 0.99 -0.10 0.00 0.00 175.22 176.21 2k8p s THR 62 N 1.22 4.67 -0.29 0.64 2.01 -1.26 -1.42 115.64 121.21 2k8p s THR 62 Ca -0.04 0.90 -0.27 0.00 0.31 0.00 0.00 61.69 62.59 2k8p s THR 62 Cb -0.18 -3.74 0.19 0.00 0.01 0.00 0.00 72.50 68.77 2k8p s THR 62 CO -0.05 -0.66 1.37 -0.60 -0.69 0.00 0.00 174.62 174.00 2k8p s ARG 63 N -4.08 0.09 -0.16 4.92 3.00 -0.92 -4.96 118.95 116.83 2k8p s ARG 63 Ca 0.55 0.05 -0.23 0.00 -1.00 0.00 0.00 55.73 55.11 2k8p s ARG 63 Cb -0.10 0.04 -0.02 0.00 0.00 0.00 0.00 34.95 34.87 2k8p s ARG 63 CO 0.33 -0.02 0.70 0.71 0.00 0.00 0.00 175.30 177.02 2k8p s TYR 64 N -0.56 3.43 -0.09 5.12 2.02 -1.26 -0.10 117.35 125.91 2k8p s TYR 64 Ca 0.08 1.09 -0.12 0.00 -0.37 0.00 0.00 57.07 57.74 2k8p s TYR 64 Cb -0.03 -2.86 -0.05 0.00 -0.40 0.00 0.00 41.96 38.63 2k8p s TYR 64 CO -0.11 -0.13 0.29 0.54 -1.57 0.00 0.00 175.55 174.57 2k8p s VAL 65 N 1.73 5.27 -0.14 0.71 0.11 -1.26 -4.97 120.40 121.85 2k8p s VAL 65 Ca 0.33 0.55 -0.08 0.00 -2.93 0.00 0.00 61.98 59.85 2k8p s VAL 65 Cb -0.16 -3.59 0.05 0.00 -1.53 0.00 0.00 36.38 31.15 2k8p s VAL 65 CO 0.12 0.52 0.34 0.42 -3.33 0.00 0.00 175.10 173.17 2k8p s THR 66 N -0.49 -0.03 -0.29 5.04 -4.23 -1.26 -1.80 115.64 112.58 2k8p s THR 66 Ca 0.18 0.11 -0.01 0.00 -1.18 0.00 0.00 61.69 60.80 2k8p s THR 66 Cb -0.14 -0.50 0.09 0.00 1.34 0.00 0.00 72.50 73.29 2k8p s THR 66 CO 0.07 0.05 0.08 -0.62 -0.54 0.00 0.00 174.62 173.66 2k8p s ASP 67 N 1.28 3.91 0.00 3.99 -1.08 -1.24 -5.03 116.67 118.51 2k8p s ASP 67 Ca -0.09 -1.54 0.00 0.00 -0.52 0.00 0.00 52.55 50.41 2k8p s ASP 67 Cb -0.09 -0.86 0.00 0.00 -1.46 0.00 0.00 42.92 40.51 2k8p s ASP 67 CO -0.10 -0.39 0.00 0.61 0.52 0.00 0.00 175.17 175.80 2k8p n GLY 68 N 4.85 -1.30 0.00 2.66 0.00 -1.26 -4.24 105.19 105.90 2k8p n GLY 68 Ca -0.03 -1.81 0.07 0.00 0.00 0.00 0.00 46.02 44.25 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 -3.86 1.61 -0.04 -1.26 -4.74 135.00 126.90 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 -0.03 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 -3.99 0.19 0.67 0.00 3.00 0.27 -3.63 118.95 115.46 2k8p s ARG 71 Ca 0.38 -0.20 -0.17 0.00 0.00 0.00 0.00 55.73 55.73 2k8p s ARG 71 Cb -0.08 0.08 -0.01 0.00 0.00 0.00 0.00 34.95 34.94 2k8p s ARG 71 CO 0.28 -0.03 1.10 -1.13 0.00 0.00 0.00 175.30 175.51 2k8p n SER 72 N 2.39 1.17 0.10 0.23 3.41 -0.74 -0.09 113.62 120.08 2k8p n SER 72 Ca -0.17 0.76 -0.03 0.00 -0.26 0.00 0.00 58.87 59.16 2k8p n SER 72 Cb 0.58 -1.46 -0.03 0.00 -0.26 0.00 0.00 64.21 63.03 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 0.18 0.52 -2.40 7.33 0.00 -1.52 -3.45 119.26 119.93 2k8p h ALA 73 Ca -0.49 -0.72 -0.11 0.00 0.00 0.00 0.00 54.91 53.60 2k8p h ALA 73 Cb 1.34 -0.13 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 2k8p h ALA 73 CO 0.50 0.99 -0.51 0.15 0.00 0.00 0.00 179.25 180.37 2k8p s LYS 74 N -2.89 0.77 0.44 0.00 1.02 -1.26 -5.14 119.74 112.68 2k8p s LYS 74 Ca 0.02 -1.11 -0.24 0.00 0.02 0.00 0.00 55.97 54.67 2k8p s LYS 74 Cb 0.09 0.28 -0.08 0.00 -0.52 0.00 0.00 37.83 37.61 2k8p s LYS 74 CO 0.79 -0.21 1.17 -1.25 -0.92 0.00 0.00 175.35 174.93 2k8p s PRO 75 N -3.90 3.84 0.08 -1.68 0.04 -1.26 -4.64 135.00 127.47 2k8p s PRO 75 Ca 0.07 1.80 -0.10 0.00 0.04 0.00 0.00 61.00 62.82 2k8p s PRO 75 Cb 0.06 -2.48 -0.06 0.00 0.04 0.00 0.00 34.50 32.06 2k8p s PRO 75 CO -0.09 -0.49 0.40 0.54 0.04 0.00 0.00 177.00 177.39 2k8p s VAL 76 N -1.51 5.10 -0.39 -0.36 0.11 0.86 -4.86 120.40 119.35 2k8p s VAL 76 Ca 0.62 0.43 -0.14 0.00 -2.93 0.00 0.00 61.98 59.95 2k8p s VAL 76 Cb -0.29 -3.64 0.01 0.00 -1.53 0.00 0.00 36.38 30.93 2k8p s VAL 76 CO 0.36 0.28 0.28 -0.89 -3.33 0.00 0.00 175.10 171.80 2k8p s THR 77 N -1.41 5.26 0.01 5.04 2.01 -1.26 -2.17 115.64 123.12 2k8p s THR 77 Ca 0.33 -0.54 -0.02 0.00 0.31 0.00 0.00 61.69 61.77 2k8p s THR 77 Cb -0.14 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 2k8p s THR 77 CO 0.18 -0.23 0.19 -0.70 -0.69 0.00 0.00 174.62 173.37 2k8p s GLU 78 N 1.69 3.42 0.04 4.92 2.12 -0.51 -4.94 118.70 125.45 2k8p s GLU 78 Ca 0.05 -0.37 0.06 0.00 0.36 0.00 0.00 54.97 55.07 2k8p s GLU 78 Cb -0.19 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.10 2k8p s GLU 78 CO 0.10 0.65 -0.13 -1.17 -0.54 0.00 0.00 175.26 174.17 2k8p s LEU 79 N -2.12 2.86 0.05 2.70 0.20 -1.26 -0.23 118.68 120.87 2k8p s LEU 79 Ca 0.30 -0.33 -0.05 0.00 0.69 0.00 0.00 54.13 54.74 2k8p s LEU 79 Cb -0.13 -1.66 -0.02 0.00 -0.43 0.00 0.00 46.19 43.95 2k8p s LEU 79 CO 0.22 0.25 0.08 -0.69 -0.29 0.00 0.00 176.35 175.92 2k8p s VAL 80 N -0.99 0.15 -0.30 1.68 1.01 0.24 -4.51 120.40 117.68 2k8p s VAL 80 Ca 0.16 -1.27 -0.13 0.00 0.00 0.00 0.00 61.98 60.74 2k8p s VAL 80 Cb -0.11 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.14 2k8p s VAL 80 CO 0.07 -0.70 0.28 0.00 0.00 0.00 0.00 175.10 174.75 2k8p s SER 82 N 1.72 -0.78 0.00 0.00 1.04 -1.26 -5.02 113.70 109.41 2k8p s SER 82 Ca 0.10 1.40 0.00 0.00 0.48 0.00 0.00 55.95 57.92 2k8p s SER 82 Cb -0.16 1.38 0.00 0.00 0.10 0.00 0.00 66.02 67.34 2k8p s SER 82 CO 0.11 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.70 2k8p n GLY 83 N 3.21 1.42 3.60 7.32 0.00 -1.26 -1.29 105.19 118.19 2k8p n GLY 83 Ca -0.16 -1.86 -0.26 0.00 0.00 0.00 0.00 46.02 43.74 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 -1.28 2.16 0.37 1.61 0.74 -1.26 -4.66 119.66 117.35 2k8p s GLN 84 Ca 0.00 -1.30 -0.10 0.00 0.05 0.00 0.00 55.36 54.02 2k8p s GLN 84 Cb 0.00 -2.18 0.03 0.00 1.10 0.00 0.00 33.01 31.96 2k8p s GLN 84 CO 0.00 0.42 0.66 0.00 -0.55 0.00 0.00 175.29 175.82 2k8p n GLY 86 N -0.56 3.02 0.37 0.00 0.00 -1.26 -4.85 105.19 101.92 2k8p n GLY 86 Ca -0.04 -1.95 -0.03 0.00 0.00 0.00 0.00 46.02 44.00 2k8p n GLY 86 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k8p n PRO 87 N -1.37 -1.25 -1.30 1.61 -0.04 -1.26 -4.90 135.00 126.49 2k8p n PRO 87 Ca 0.00 -0.18 -0.09 0.00 -0.04 0.00 0.00 63.50 63.19 2k8p n PRO 87 Cb 0.00 -0.17 0.12 0.00 -0.04 0.00 0.00 33.50 33.40 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 -3.20 4.31 -3.16 0.55 0.00 -1.26 -5.05 120.51 112.71 2k8p n ALA 88 Ca -0.02 -3.54 -0.22 0.00 0.00 0.00 0.00 53.44 49.66 2k8p n ALA 88 Cb 0.06 -0.34 0.05 0.00 0.00 0.00 0.00 19.45 19.22 2k8p n ALA 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k8p n ARG 89 N -0.91 0.67 -2.68 0.00 5.12 -1.26 -4.92 116.66 112.68 2k8p n ARG 89 Ca 0.31 -2.81 -0.04 0.00 -1.93 0.00 0.00 57.85 53.38 2k8p n ARG 89 Cb 0.83 -0.13 -0.03 0.00 -1.16 0.00 0.00 32.46 31.96 2k8p n ARG 89 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 2k8p n LEU 90 N 0.00 -6.59 -4.80 0.55 0.00 -1.26 -4.97 117.00 99.93 2k8p n LEU 90 Ca 0.12 1.97 -0.31 0.00 0.00 0.00 0.00 56.01 57.79 2k8p n LEU 90 Cb 0.54 -3.20 0.07 0.00 0.00 0.00 0.00 43.42 40.83 2k8p n LEU 90 CO 0.34 -3.73 0.70 -0.76 0.00 0.00 0.00 177.39 173.95 2k8p s LEU 91 N -0.93 3.01 0.20 -1.96 1.02 -1.26 -4.97 118.68 113.78 2k8p s LEU 91 Ca -0.19 1.66 -0.04 0.00 0.02 0.00 0.00 54.13 55.58 2k8p s LEU 91 Cb 0.01 -4.43 0.14 0.00 0.02 0.00 0.00 46.19 41.94 2k8p s LEU 91 CO 0.74 -1.75 1.56 1.55 0.02 0.00 0.00 176.35 178.46 2k8p h PRO 92 N -0.93 0.66 0.00 1.29 0.13 -2.02 -3.37 132.00 127.76 2k8p h PRO 92 Ca -0.44 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.34 2k8p h PRO 92 Cb 1.23 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2k8p h PRO 92 CO 0.55 0.95 0.00 0.09 -0.23 0.00 0.00 178.00 179.36 2k8p n ASN 93 N -4.03 0.00 -0.42 1.44 5.03 -1.26 -4.92 115.26 111.10 2k8p n ASN 93 Ca -0.02 0.48 -0.05 0.00 0.87 0.00 0.00 54.58 55.85 2k8p n ASN 93 Cb 0.53 -0.43 -0.02 0.00 -1.02 0.00 0.00 39.78 38.84 2k8p n ASN 93 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k8p n ALA 94 N -1.79 -0.08 -0.46 5.41 0.00 -1.26 -4.79 120.51 117.54 2k8p n ALA 94 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2k8p n ALA 94 Cb 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.20 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 -2.40 0.00 -1.10 0.00 5.41 -1.26 -4.94 119.36 115.08 2k8p n ILE 95 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.70 2k8p n ILE 95 Cb 0.40 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.33 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 0.00 3.85 3.39 7.39 0.00 -1.26 -4.94 105.19 113.62 2k8p n GLY 96 Ca 0.00 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.49 -3.64 1.61 1.74 -1.26 -5.02 116.66 108.60 2k8p n ARG 97 Ca 0.00 1.19 -0.07 0.00 -0.77 0.00 0.00 57.85 58.21 2k8p n ARG 97 Cb 0.00 -4.09 -0.07 0.00 -1.02 0.00 0.00 32.46 27.28 2k8p n ARG 97 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2k8p s GLY 98 N -2.92 -0.63 -0.90 -0.13 0.00 -1.26 -5.09 107.32 96.38 2k8p s GLY 98 Ca 0.02 2.39 -0.02 0.00 0.00 0.00 0.00 44.72 47.11 2k8p s GLY 98 CO 0.82 2.42 0.79 0.54 0.00 0.00 0.00 173.10 177.68 2k8p s LYS 99 N 1.71 3.32 0.22 2.90 1.02 -1.26 -5.03 119.74 122.63 2k8p s LYS 99 Ca -0.10 -3.26 0.04 0.00 0.02 0.00 0.00 55.97 52.67 2k8p s LYS 99 Cb -0.06 -3.99 -0.02 0.00 -0.52 0.00 0.00 37.83 33.25 2k8p s LYS 99 CO -0.20 -1.26 0.16 -2.67 -0.92 0.00 0.00 175.35 170.46 2k8p n TRP 100 N 2.37 -0.36 -2.97 3.18 2.14 -1.26 -5.10 117.44 115.44 2k8p n TRP 100 Ca 0.21 -1.77 -0.19 0.00 2.07 0.00 0.00 57.50 57.82 2k8p n TRP 100 Cb 0.37 0.14 -0.02 0.00 -0.81 0.00 0.00 31.31 30.99 2k8p n TRP 100 CO 0.00 0.00 0.00 1.87 2.07 0.00 0.00 177.69 181.63 2k8p n TRP 101 N -0.45 1.59 -1.04 -2.67 -0.00 -1.26 -5.11 117.44 108.49 2k8p n TRP 101 Ca 0.03 -3.62 -0.34 0.00 -0.00 0.00 0.00 57.50 53.57 2k8p n TRP 101 Cb 0.39 -0.40 0.10 0.00 -0.00 0.00 0.00 31.31 31.40 2k8p n TRP 101 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 177.69 180.58 2k8p n ARG 102 N 0.02 0.03 -2.05 5.87 1.85 -1.26 -4.80 116.66 116.33 2k8p n ARG 102 Ca 0.25 0.06 -0.28 0.00 -1.00 0.00 0.00 57.85 56.88 2k8p n ARG 102 Cb 0.62 -1.92 -0.05 0.00 -1.05 0.00 0.00 32.46 30.06 2k8p n ARG 102 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2k8p s PRO 103 N -3.32 2.56 -0.24 2.89 0.04 -1.26 -4.93 135.00 130.74 2k8p s PRO 103 Ca 0.63 -0.21 -0.29 0.00 0.04 0.00 0.00 61.00 61.17 2k8p s PRO 103 Cb -0.28 -5.00 -0.03 0.00 0.04 0.00 0.00 34.50 29.23 2k8p s PRO 103 CO 0.61 -3.32 1.67 -1.12 0.04 0.00 0.00 177.00 174.88 2k8p s SER 104 N 8.04 6.26 -0.11 6.66 0.01 -1.26 -3.80 113.70 129.50 2k8p s SER 104 Ca 0.70 1.58 -0.01 0.00 1.31 0.00 0.00 55.95 59.53 2k8p s SER 104 Cb -0.07 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2k8p s SER 104 CO 0.01 -1.36 0.11 0.61 0.41 0.00 0.00 173.24 173.02 2k8p n GLY 105 N 4.84 -0.54 3.63 3.44 0.00 -1.26 -5.06 105.19 110.24 2k8p n GLY 105 Ca 0.20 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.56 -0.54 -0.38 1.61 0.04 -1.25 -5.07 135.00 126.86 2k8p s PRO 106 Ca 0.01 0.18 0.05 0.00 0.04 0.00 0.00 61.00 61.28 2k8p s PRO 106 Cb -0.00 -1.65 0.17 0.00 0.04 0.00 0.00 34.50 33.05 2k8p s PRO 106 CO 0.13 -3.31 0.48 -0.51 0.04 0.00 0.00 177.00 173.83 2k8p s ASP 107 N -3.69 -0.02 0.34 6.66 1.01 -1.26 -5.01 116.67 114.71 2k8p s ASP 107 Ca 0.68 -1.13 0.09 0.00 0.71 0.00 0.00 52.55 52.91 2k8p s ASP 107 Cb -0.14 1.19 0.84 0.00 1.01 0.00 0.00 42.92 45.82 2k8p s ASP 107 CO 0.57 -0.23 1.82 -0.26 0.21 0.00 0.00 175.17 177.27 2k8p h PHE 108 N 7.15 0.89 -1.72 4.23 0.04 -1.92 -3.42 116.94 122.20 2k8p h PHE 108 Ca 0.04 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.85 2k8p h PHE 108 Cb 1.11 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.99 2k8p h PHE 108 CO 0.25 0.24 -0.02 -2.13 -0.60 0.00 0.00 178.31 176.05 2k8p n ARG 109 N -4.65 -0.09 -3.64 1.51 3.00 -1.26 -0.72 116.66 110.80 2k8p n ARG 109 Ca 0.21 0.06 -0.05 0.00 -0.00 0.00 0.00 57.85 58.07 2k8p n ARG 109 Cb 0.58 -0.12 -0.07 0.00 0.00 0.00 0.00 32.46 32.86 2k8p n ARG 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k8p s ILE 111 N 1.37 3.68 1.22 0.00 -4.36 0.83 -4.85 121.20 119.10 2k8p s ILE 111 Ca -0.08 -1.46 -0.20 0.00 -0.26 0.00 0.00 60.65 58.64 2k8p s ILE 111 Cb -0.04 -2.86 0.30 0.00 1.25 0.00 0.00 42.46 41.11 2k8p s ILE 111 CO -0.16 -0.13 1.11 -2.16 0.24 0.00 0.00 174.94 173.84 2k8p s PRO 112 N -2.99 -1.40 0.01 0.37 0.04 -1.26 -1.04 135.00 128.73 2k8p s PRO 112 Ca 0.28 -0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.19 2k8p s PRO 112 Cb -0.09 -1.58 -0.00 0.00 0.04 0.00 0.00 34.50 32.87 2k8p s PRO 112 CO 0.18 -3.82 0.01 -3.47 0.04 0.00 0.00 177.00 169.95 2k8p n ASP 113 N -4.82 -0.04 -4.59 6.66 -0.08 -1.21 -4.12 116.55 108.35 2k8p n ASP 113 Ca 0.14 -1.06 -0.46 0.00 -1.51 0.00 0.00 54.79 51.90 2k8p n ASP 113 Cb 0.60 0.07 -0.03 0.00 2.34 0.00 0.00 41.12 44.10 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 -0.02 1.35 -2.89 -0.67 0.63 -1.26 -4.62 116.66 109.18 2k8p n ARG 114 Ca 0.00 0.48 -0.20 0.00 -0.92 0.00 0.00 57.85 57.21 2k8p n ARG 114 Cb 0.02 -1.94 0.06 0.00 0.45 0.00 0.00 32.46 31.04 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 -0.54 1.95 -0.25 -0.14 1.51 -1.26 -0.44 117.35 118.19 2k8p s TYR 115 Ca 0.66 -0.48 -0.06 0.00 -1.01 0.00 0.00 57.07 56.19 2k8p s TYR 115 Cb -0.76 -2.47 0.13 0.00 -0.11 0.00 0.00 41.96 38.75 2k8p s TYR 115 CO 0.55 -1.05 0.49 0.50 -1.11 0.00 0.00 175.55 174.93 2k8p s ARG 116 N -4.69 0.43 -0.10 -0.62 3.52 -0.58 -4.53 118.95 112.38 2k8p s ARG 116 Ca 0.61 1.01 -0.23 0.00 -0.13 0.00 0.00 55.73 56.98 2k8p s ARG 116 Cb -0.07 0.31 -0.03 0.00 -1.56 0.00 0.00 34.95 33.59 2k8p s ARG 116 CO 0.38 -0.40 0.71 0.00 -0.81 0.00 0.00 175.30 175.19 2k8p s ALA 117 N 2.71 3.39 -0.02 6.12 0.00 -1.26 -3.26 121.76 129.43 2k8p s ALA 117 Ca 0.05 0.07 0.07 0.00 0.00 0.00 0.00 51.96 52.15 2k8p s ALA 117 Cb -0.13 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 2k8p s ALA 117 CO -0.16 -0.24 -0.24 -1.14 0.00 0.00 0.00 175.76 173.97 2k8p s GLN 118 N 1.14 2.04 -0.19 0.00 0.74 -0.23 -4.94 119.66 118.22 2k8p s GLN 118 Ca 0.37 -0.87 -0.16 0.00 0.05 0.00 0.00 55.36 54.75 2k8p s GLN 118 Cb -0.17 -1.93 -0.04 0.00 1.10 0.00 0.00 33.01 31.97 2k8p s GLN 118 CO 0.16 0.50 0.41 1.03 -0.55 0.00 0.00 175.29 176.84 2k8p s ARG 119 N -0.51 4.20 0.13 1.67 0.52 -1.26 -0.29 118.95 123.42 2k8p s ARG 119 Ca 0.08 0.24 0.03 0.00 -0.52 0.00 0.00 55.73 55.56 2k8p s ARG 119 Cb -0.10 -3.52 -0.04 0.00 0.52 0.00 0.00 34.95 31.82 2k8p s ARG 119 CO -0.00 0.00 0.18 0.54 0.02 0.00 0.00 175.30 176.04 2k8p s VAL 120 N 1.17 4.89 -0.30 3.52 0.11 0.70 -4.92 120.40 125.57 2k8p s VAL 120 Ca 0.20 -0.80 -0.10 0.00 -2.93 0.00 0.00 61.98 58.35 2k8p s VAL 120 Cb -0.15 -3.47 -0.02 0.00 -1.53 0.00 0.00 36.38 31.22 2k8p s VAL 120 CO 0.08 -0.03 0.16 -1.58 -3.33 0.00 0.00 175.10 170.40 2k8p s GLN 121 N -2.94 3.52 -0.14 1.54 0.74 -1.26 -1.06 119.66 120.06 2k8p s GLN 121 Ca 0.32 -0.60 -0.04 0.00 0.05 0.00 0.00 55.36 55.09 2k8p s GLN 121 Cb -0.11 -3.58 -0.03 0.00 1.10 0.00 0.00 33.01 30.38 2k8p s GLN 121 CO 0.25 -0.34 0.02 -0.51 -0.55 0.00 0.00 175.29 174.16 2k8p s LEU 122 N 1.66 3.61 0.06 3.68 1.43 0.95 -1.28 118.68 128.79 2k8p s LEU 122 Ca 0.06 0.06 0.02 0.00 -1.03 0.00 0.00 54.13 53.24 2k8p s LEU 122 Cb -0.17 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 2k8p s LEU 122 CO 0.07 0.25 0.12 -0.76 0.23 0.00 0.00 176.35 176.27 2k8p s LEU 123 N -0.13 3.98 0.19 1.79 2.01 0.87 -0.35 118.68 127.05 2k8p s LEU 123 Ca 0.05 0.09 0.11 0.00 0.01 0.00 0.00 54.13 54.40 2k8p s LEU 123 Cb -0.12 -2.60 -0.04 0.00 0.01 0.00 0.00 46.19 43.43 2k8p s LEU 123 CO 0.02 0.18 -0.23 0.00 1.01 0.00 0.00 176.35 177.33 2k8p s PRO 125 N -2.70 -0.05 -0.59 0.00 0.04 -1.26 -4.82 135.00 125.61 2k8p s PRO 125 Ca 0.20 0.35 -0.30 0.00 0.04 0.00 0.00 61.00 61.29 2k8p s PRO 125 Cb -0.08 -1.70 -0.12 0.00 0.04 0.00 0.00 34.50 32.64 2k8p s PRO 125 CO 0.10 -3.02 2.43 0.41 0.04 0.00 0.00 177.00 176.95 2k8p n GLY 126 N -1.04 0.10 0.00 0.56 0.00 -1.26 -3.03 105.19 100.52 2k8p n GLY 126 Ca 0.07 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.97 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 6.30 0.25 3.62 -0.02 0.00 -1.26 -5.15 105.19 108.93 2k8p n GLY 127 Ca 0.46 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.36 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 2.03 0.30 1.61 2.02 -1.17 -5.18 118.70 118.31 2k8p s GLU 128 Ca 0.00 -1.61 0.04 0.00 0.02 0.00 0.00 54.97 53.41 2k8p s GLU 128 Cb 0.00 0.52 -0.03 0.00 0.10 0.00 0.00 34.13 34.72 2k8p s GLU 128 CO 0.00 -0.89 0.45 0.00 0.02 0.00 0.00 175.26 174.84 2k8p s ALA 129 N -2.81 3.90 0.50 5.21 0.00 -1.26 -4.74 121.76 122.56 2k8p s ALA 129 Ca 0.24 -1.17 -0.21 0.00 0.00 0.00 0.00 51.96 50.82 2k8p s ALA 129 Cb -0.02 -1.85 -0.07 0.00 0.00 0.00 0.00 23.12 21.18 2k8p s ALA 129 CO 0.16 0.09 1.15 -1.25 0.00 0.00 0.00 175.76 175.91 2k8p s PRO 130 N -4.14 3.58 0.25 0.00 0.04 -1.26 -4.57 135.00 128.90 2k8p s PRO 130 Ca 0.38 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.13 2k8p s PRO 130 Cb -0.09 -2.23 -0.00 0.00 0.04 0.00 0.00 34.50 32.21 2k8p s PRO 130 CO 0.32 -0.68 0.01 0.54 0.04 0.00 0.00 177.00 177.23 2k8p n ARG 131 N -0.84 1.33 -4.28 4.56 1.74 0.52 -4.96 116.66 114.74 2k8p n ARG 131 Ca 0.09 -1.82 -0.17 0.00 -0.77 0.00 0.00 57.85 55.18 2k8p n ARG 131 Cb 0.49 0.53 -0.14 0.00 -1.02 0.00 0.00 32.46 32.33 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 -2.44 0.75 -0.09 7.54 0.00 -1.26 -0.03 121.76 126.22 2k8p s ALA 132 Ca 0.01 -0.51 0.02 0.00 0.00 0.00 0.00 51.96 51.48 2k8p s ALA 132 Cb 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2k8p s ALA 132 CO 0.01 0.15 -0.13 0.50 0.00 0.00 0.00 175.76 176.28 2k8p s ARG 133 N -0.60 1.93 -0.11 0.00 6.06 -0.22 -4.93 118.95 121.08 2k8p s ARG 133 Ca 0.01 -0.47 -0.23 0.00 -2.50 0.00 0.00 55.73 52.54 2k8p s ARG 133 Cb -0.05 -1.65 -0.03 0.00 0.06 0.00 0.00 34.95 33.27 2k8p s ARG 133 CO 0.00 -0.04 0.72 0.21 -2.50 0.00 0.00 175.30 173.68 2k8p s LYS 134 N 0.92 4.38 -0.12 5.12 2.20 -1.26 -0.21 119.74 130.76 2k8p s LYS 134 Ca -0.09 0.87 0.00 0.00 -0.36 0.00 0.00 55.97 56.39 2k8p s LYS 134 Cb -0.15 -3.49 -0.02 0.00 -1.51 0.00 0.00 37.83 32.66 2k8p s LYS 134 CO 0.00 -0.06 -0.13 0.14 -0.36 0.00 0.00 175.35 174.94 2k8p s VAL 135 N 1.24 3.08 -0.47 4.02 -7.23 0.61 -4.96 120.40 116.69 2k8p s VAL 135 Ca 0.36 -0.66 -0.14 0.00 -1.81 0.00 0.00 61.98 59.74 2k8p s VAL 135 Cb -0.17 -2.29 0.08 0.00 0.56 0.00 0.00 36.38 34.56 2k8p s VAL 135 CO 0.16 0.53 0.37 -0.60 -0.31 0.00 0.00 175.10 175.25 2k8p s ARG 136 N 0.25 2.88 -0.00 4.82 6.06 -1.26 -1.06 118.95 130.63 2k8p s ARG 136 Ca -0.09 -1.42 0.04 0.00 -2.50 0.00 0.00 55.73 51.76 2k8p s ARG 136 Cb -0.15 -4.06 -0.01 0.00 0.06 0.00 0.00 34.95 30.78 2k8p s ARG 136 CO 0.05 -1.04 -0.13 -0.51 -2.50 0.00 0.00 175.30 171.17 2k8p s LEU 137 N 1.58 2.04 0.59 -0.88 1.02 -1.20 -5.00 118.68 116.83 2k8p s LEU 137 Ca 0.04 -0.26 -0.18 0.00 0.02 0.00 0.00 54.13 53.75 2k8p s LEU 137 Cb -0.25 -0.65 -0.07 0.00 0.02 0.00 0.00 46.19 45.25 2k8p s LEU 137 CO 0.05 0.14 0.67 0.55 0.02 0.00 0.00 176.35 177.78 2k8p n VAL 138 N 2.67 2.74 -0.11 -1.59 3.14 -1.26 -1.53 118.33 122.39 2k8p n VAL 138 Ca -0.14 -0.49 -0.22 0.00 -2.96 0.00 0.00 64.34 60.52 2k8p n VAL 138 Cb 0.55 -0.84 -0.08 0.00 -1.06 0.00 0.00 33.84 32.42 2k8p n VAL 138 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2k8p n ALA 139 N -1.78 1.62 -4.41 1.55 0.00 0.42 -4.31 120.51 113.60 2k8p n ALA 139 Ca 0.12 -0.85 -0.28 0.00 0.00 0.00 0.00 53.44 52.43 2k8p n ALA 139 Cb 0.48 0.21 -0.04 0.00 0.00 0.00 0.00 19.45 20.09 2k8p n ALA 139 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2k8p n SER 140 N -3.86 3.05 -3.66 0.00 7.64 -0.63 -5.01 113.62 111.13 2k8p n SER 140 Ca -0.41 -2.91 -0.14 0.00 1.01 0.00 0.00 58.87 56.41 2k8p n SER 140 Cb 0.81 0.20 -0.08 0.00 -1.01 0.00 0.00 64.21 64.13 2k8p n SER 140 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8p s LYS 142 N -0.01 1.29 -0.31 0.00 1.02 -0.21 -4.88 119.74 116.63 2k8p s LYS 142 Ca -0.02 -1.31 -0.01 0.00 0.02 0.00 0.00 55.97 54.64 2k8p s LYS 142 Cb -0.04 -1.58 0.06 0.00 -0.52 0.00 0.00 37.83 35.76 2k8p s LYS 142 CO 0.02 0.36 0.02 0.00 -0.92 0.00 0.00 175.35 174.82 2k8p s LYS 144 N 1.19 0.64 -0.47 0.00 2.20 -1.25 -4.91 119.74 117.14 2k8p s LYS 144 Ca -0.03 -0.19 -0.20 0.00 -0.36 0.00 0.00 55.97 55.19 2k8p s LYS 144 Cb -0.20 0.28 0.04 0.00 -1.51 0.00 0.00 37.83 36.44 2k8p s LYS 144 CO -0.02 -0.17 0.63 0.50 -0.36 0.00 0.00 175.35 175.93 2k8p s ARG 145 N -1.27 3.19 -0.05 4.03 3.00 0.10 -3.21 118.95 124.73 2k8p s ARG 145 Ca -0.13 -0.64 0.06 0.00 -1.00 0.00 0.00 55.73 54.01 2k8p s ARG 145 Cb -0.05 -4.03 -0.02 0.00 0.00 0.00 0.00 34.95 30.86 2k8p s ARG 145 CO 0.04 -1.12 -0.23 -1.17 0.00 0.00 0.00 175.30 172.82 2k8p s LEU 146 N 2.73 2.19 -0.43 -0.88 2.96 -1.26 -5.04 118.68 118.95 2k8p s LEU 146 Ca 0.18 -0.45 0.08 0.00 -0.22 0.00 0.00 54.13 53.72 2k8p s LEU 146 Cb -0.17 -1.40 0.34 0.00 0.50 0.00 0.00 46.19 45.46 2k8p s LEU 146 CO 0.15 0.27 1.08 0.41 -1.32 0.00 0.00 176.35 176.94 2k8p n THR 147 N 2.76 -0.00 0.00 3.68 -1.04 -1.26 -5.04 114.28 113.38 2k8p n THR 147 Ca -0.17 -2.06 0.00 0.00 -2.04 0.00 0.00 64.05 59.78 2k8p n THR 147 Cb 0.52 1.13 0.00 0.00 -1.82 0.00 0.00 70.33 70.15 2k8p n THR 147 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2k8p n ARG 148 N 0.23 0.00 -2.82 -2.82 1.74 -1.26 -4.81 116.66 106.92 2k8p n ARG 148 Ca 0.08 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2k8p n ARG 148 Cb 0.71 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 32.15 2k8p n ARG 148 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2k8p n PHE 149 N 0.00 -3.13 -4.66 -1.55 -0.00 -1.26 -5.05 117.46 101.81 2k8p n PHE 149 Ca 0.00 1.40 -0.32 0.00 -0.00 0.00 0.00 57.45 58.53 2k8p n PHE 149 Cb 0.00 -3.34 -0.06 0.00 -0.00 0.00 0.00 39.48 36.08 2k8p n PHE 149 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 2k8p n HIS 150 N 0.88 0.98 0.08 -5.13 8.25 -1.26 -5.09 115.22 113.93 2k8p n HIS 150 Ca -0.01 -2.49 -0.04 0.00 -0.26 0.00 0.00 57.72 54.91 2k8p n HIS 150 Cb 0.13 -0.35 -0.02 0.00 1.12 0.00 0.00 29.99 30.87 2k8p n HIS 150 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 2k8p h ASN 151 N 1.16 -0.23 0.00 0.41 2.35 -2.02 -3.43 115.58 113.82 2k8p h ASN 151 Ca -0.42 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.24 2k8p h ASN 151 Cb 1.28 0.06 -0.19 0.00 0.05 0.00 0.00 38.32 39.52 2k8p h ASN 151 CO 0.69 0.14 -0.61 1.67 -1.65 0.00 0.00 177.43 177.66 2k8p n GLN 152 N -4.42 0.00 -2.53 0.81 -0.06 -1.26 -5.09 117.38 104.83 2k8p n GLN 152 Ca -0.03 -1.28 -0.05 0.00 -2.00 0.00 0.00 57.00 53.63 2k8p n GLN 152 Cb 0.11 0.00 -0.04 0.00 -4.06 0.00 0.00 30.24 26.25 2k8p n GLN 152 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 2k8p n SER 153 N 0.21 -0.77 -4.16 1.69 7.64 -1.26 -4.60 113.62 112.37 2k8p n SER 153 Ca -0.04 1.27 -0.33 0.00 1.01 0.00 0.00 58.87 60.78 2k8p n SER 153 Cb 0.86 -5.03 -0.16 0.00 -1.01 0.00 0.00 64.21 58.87 2k8p n SER 153 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2k8p s GLU 154 N -0.75 3.03 -0.05 1.43 1.03 -1.26 -4.22 118.70 117.91 2k8p s GLU 154 Ca -0.26 -0.83 -0.02 0.00 0.03 0.00 0.00 54.97 53.88 2k8p s GLU 154 Cb 0.02 -2.52 0.03 0.00 -0.80 0.00 0.00 34.13 30.87 2k8p s GLU 154 CO 0.75 -0.10 0.08 -1.17 -1.33 0.00 0.00 175.26 173.50 2k8p s LEU 155 N 1.03 0.10 0.35 1.83 0.20 -1.26 -5.14 118.68 115.78 2k8p s LEU 155 Ca -0.02 0.12 -0.00 0.00 0.69 0.00 0.00 54.13 54.92 2k8p s LEU 155 Cb -0.14 -0.06 -0.00 0.00 -0.43 0.00 0.00 46.19 45.56 2k8p s LEU 155 CO -0.06 -0.25 0.45 -0.54 -0.29 0.00 0.00 176.35 175.65 2k8p s LYS 156 N 2.20 1.92 -0.17 1.98 1.02 -1.26 -5.03 119.74 120.40 2k8p s LYS 156 Ca 0.05 -1.83 -0.34 0.00 0.02 0.00 0.00 55.97 53.86 2k8p s LYS 156 Cb -0.12 0.43 0.13 0.00 -0.52 0.00 0.00 37.83 37.75 2k8p s LYS 156 CO -0.04 -0.78 1.17 -0.51 -0.92 0.00 0.00 175.35 174.27 2k8p s ASP 157 N -3.27 -0.17 0.00 2.83 1.01 -1.26 -5.19 116.67 110.62 2k8p s ASP 157 Ca 0.32 0.00 0.00 0.00 0.71 0.00 0.00 52.55 53.59 2k8p s ASP 157 Cb -0.00 0.18 0.00 0.00 1.01 0.00 0.00 42.92 44.10 2k8p s ASP 157 CO 0.22 -0.28 0.00 0.49 0.21 0.00 0.00 175.17 175.81 2k8p n PHE 158 N -0.11 -0.10 -2.84 4.23 3.72 -1.26 -5.19 117.46 115.92 2k8p n PHE 158 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2k8p n PHE 158 Cb 0.59 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.13 2k8p n PHE 158 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k8p n GLY 159 N 0.00 6.39 3.60 1.37 0.00 -1.26 -5.18 105.19 110.10 2k8p n GLY 159 Ca 0.00 -1.70 -0.08 0.00 0.00 0.00 0.00 46.02 44.24 2k8p n GLY 159 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2k8p s THR 160 N 0.30 0.00 0.16 2.61 -1.32 -1.26 -5.19 115.64 110.95 2k8p s THR 160 Ca 0.00 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.50 2k8p s THR 160 Cb 0.00 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.94 2k8p s THR 160 CO 0.00 0.00 -0.02 -1.61 -2.21 0.00 0.00 174.62 170.78 2k8p s GLU 161 N -1.03 1.07 0.26 7.08 2.02 -1.26 -5.17 118.70 121.67 2k8p s GLU 161 Ca 0.02 -1.50 -0.09 0.00 0.02 0.00 0.00 54.97 53.42 2k8p s GLU 161 Cb -0.01 -0.31 -0.01 0.00 0.10 0.00 0.00 34.13 33.91 2k8p s GLU 161 CO -0.02 -0.09 0.43 0.00 0.02 0.00 0.00 175.26 175.60 2k8p s ALA 162 N -3.61 0.13 0.90 5.21 0.00 -1.26 -5.18 121.76 117.95 2k8p s ALA 162 Ca 0.21 -1.10 -0.08 0.00 0.00 0.00 0.00 51.96 50.99 2k8p s ALA 162 Cb 0.06 1.13 0.14 0.00 0.00 0.00 0.00 23.12 24.44 2k8p s ALA 162 CO 0.02 -0.80 0.85 0.00 0.00 0.00 0.00 175.76 175.83 2k8p n ALA 163 N -0.39 -0.73 -2.96 0.00 0.00 -1.26 -5.08 120.51 110.10 2k8p n ALA 163 Ca -0.01 -1.23 -0.15 0.00 0.00 0.00 0.00 53.44 52.06 2k8p n ALA 163 Cb 0.62 0.02 -0.01 0.00 0.00 0.00 0.00 19.45 20.08 2k8p n ALA 163 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k8p n ARG 164 N -2.75 0.69 -1.09 0.00 0.63 -1.26 -5.15 116.66 107.74 2k8p n ARG 164 Ca 0.11 -2.40 -0.30 0.00 -0.92 0.00 0.00 57.85 54.34 2k8p n ARG 164 Cb 0.40 -1.39 0.23 0.00 0.45 0.00 0.00 32.46 32.15 2k8p n ARG 164 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2k8p s PRO 165 N -0.02 -1.05 0.35 -0.14 0.04 -1.26 -5.09 135.00 127.82 2k8p s PRO 165 Ca 0.33 -0.01 0.04 0.00 0.04 0.00 0.00 61.00 61.40 2k8p s PRO 165 Cb 0.18 -1.61 -0.06 0.00 0.04 0.00 0.00 34.50 33.05 2k8p s PRO 165 CO -0.18 -3.61 0.06 1.14 0.04 0.00 0.00 177.00 174.46 2k8p s GLN 166 N -5.36 1.74 0.06 4.56 -2.07 -1.26 -5.17 119.66 112.17 2k8p s GLN 166 Ca 0.70 -1.99 -0.04 0.00 -1.82 0.00 0.00 55.36 52.21 2k8p s GLN 166 Cb -0.11 -0.90 -0.02 0.00 -1.09 0.00 0.00 33.01 30.89 2k8p s GLN 166 CO 0.56 -0.24 0.06 0.15 -1.32 0.00 0.00 175.29 174.50 2k8p s LYS 167 N -3.85 0.68 -0.30 9.60 1.02 -1.26 -5.14 119.74 120.49 2k8p s LYS 167 Ca 0.33 -1.09 -0.14 0.00 0.02 0.00 0.00 55.97 55.09 2k8p s LYS 167 Cb 0.07 0.26 0.18 0.00 -0.52 0.00 0.00 37.83 37.82 2k8p s LYS 167 CO 0.15 -0.17 1.13 0.20 -0.92 0.00 0.00 175.35 175.74 2k8p s GLY 168 N -2.82 -0.95 0.47 -3.33 0.00 -1.26 -5.18 107.32 94.26 2k8p s GLY 168 Ca 0.05 2.21 0.02 0.00 0.00 0.00 0.00 44.72 47.00 2k8p s GLY 168 CO -0.10 4.21 0.18 -0.96 0.00 0.00 0.00 173.10 176.42 2k8p n ARG 169 N 4.90 0.84 -4.03 2.90 1.85 -1.26 -5.15 116.66 116.71 2k8p n ARG 169 Ca 0.10 -3.18 -0.21 0.00 -1.00 0.00 0.00 57.85 53.56 2k8p n ARG 169 Cb 0.59 0.61 -0.04 0.00 -1.05 0.00 0.00 32.46 32.58 2k8p n ARG 169 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 2k8p s LYS 170 N -3.81 3.05 0.90 2.89 3.01 -1.26 -5.11 119.74 119.40 2k8p s LYS 170 Ca 0.13 -1.00 -0.12 0.00 -1.01 0.00 0.00 55.97 53.98 2k8p s LYS 170 Cb -0.01 -2.65 0.13 0.00 -1.01 0.00 0.00 37.83 34.29 2k8p s LYS 170 CO 0.08 0.37 1.09 -1.25 0.51 0.00 0.00 175.35 176.16 2k8p s PRO 171 N -3.90 1.23 0.53 -1.68 0.04 -1.26 -5.04 135.00 124.91 2k8p s PRO 171 Ca 0.34 0.81 -0.07 0.00 0.04 0.00 0.00 61.00 62.13 2k8p s PRO 171 Cb -0.08 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2k8p s PRO 171 CO 0.26 -2.26 0.86 1.03 0.04 0.00 0.00 177.00 176.94 2k8p s ARG 172 N -4.94 3.48 0.20 4.56 0.52 -1.26 -5.03 118.95 116.48 2k8p s ARG 172 Ca 0.63 0.32 -0.30 0.00 -0.52 0.00 0.00 55.73 55.86 2k8p s ARG 172 Cb -0.18 -2.29 -0.09 0.00 0.52 0.00 0.00 34.95 32.92 2k8p s ARG 172 CO 0.57 -0.36 1.30 -1.25 0.02 0.00 0.00 175.30 175.58 2k8p s PRO 173 N -4.89 4.40 0.35 3.54 0.04 -1.26 -5.04 135.00 132.15 2k8p s PRO 173 Ca 0.50 2.04 0.03 0.00 0.04 0.00 0.00 61.00 63.61 2k8p s PRO 173 Cb -0.10 -3.20 -0.02 0.00 0.04 0.00 0.00 34.50 31.22 2k8p s PRO 173 CO 0.47 -0.24 0.53 1.03 0.04 0.00 0.00 177.00 178.83 2k8p s ARG 174 N -0.12 3.27 -0.29 4.56 0.52 -1.26 -5.12 118.95 120.52 2k8p s ARG 174 Ca 0.56 -0.62 -0.15 0.00 -0.52 0.00 0.00 55.73 55.00 2k8p s ARG 174 Cb -0.36 -2.72 0.13 0.00 0.52 0.00 0.00 34.95 32.52 2k8p s ARG 174 CO 0.38 0.07 0.88 0.00 0.02 0.00 0.00 175.30 176.64 2k8p s ALA 175 N -2.28 -2.22 -0.11 2.13 0.00 -1.26 -5.16 121.76 112.86 2k8p s ALA 175 Ca 0.42 2.25 0.01 0.00 0.00 0.00 0.00 51.96 54.65 2k8p s ALA 175 Cb -0.10 -1.70 0.02 0.00 0.00 0.00 0.00 23.12 21.35 2k8p s ALA 175 CO 0.34 -0.50 -0.13 0.50 0.00 0.00 0.00 175.76 175.97 2k8p s ARG 176 N 1.72 2.01 -0.03 0.00 3.52 -1.26 -5.12 118.95 119.79 2k8p s ARG 176 Ca -0.08 -0.48 -0.01 0.00 -0.13 0.00 0.00 55.73 55.03 2k8p s ARG 176 Cb -0.05 -1.78 0.02 0.00 -1.56 0.00 0.00 34.95 31.58 2k8p s ARG 176 CO -0.17 -0.11 0.06 -1.54 -0.81 0.00 0.00 175.30 172.73 2k8p s SER 177 N 1.15 -0.01 -0.20 -2.12 1.04 -1.26 -5.15 113.70 107.16 2k8p s SER 177 Ca -0.04 0.12 -0.13 0.00 0.48 0.00 0.00 55.95 56.38 2k8p s SER 177 Cb -0.14 0.04 0.06 0.00 0.10 0.00 0.00 66.02 66.08 2k8p s SER 177 CO -0.03 -0.10 0.51 0.00 0.98 0.00 0.00 173.24 174.59 2k8p s ALA 178 N 0.80 -1.32 0.54 5.32 0.00 -1.26 -5.17 121.76 120.67 2k8p s ALA 178 Ca -0.06 1.72 0.08 0.00 0.00 0.00 0.00 51.96 53.69 2k8p s ALA 178 Cb -0.09 -1.02 0.05 0.00 0.00 0.00 0.00 23.12 22.06 2k8p s ALA 178 CO -0.03 -0.29 0.57 0.21 0.00 0.00 0.00 175.76 176.23 2k8p s LYS 179 N 1.12 2.32 -0.29 0.00 2.20 -1.26 -5.12 119.74 118.70 2k8p s LYS 179 Ca -0.07 -1.79 0.02 0.00 -0.36 0.00 0.00 55.97 53.76 2k8p s LYS 179 Cb -0.06 -2.38 0.16 0.00 -1.51 0.00 0.00 37.83 34.04 2k8p s LYS 179 CO -0.10 -0.67 0.39 0.00 -0.36 0.00 0.00 175.35 174.60 2k8p s ALA 180 N -2.69 -1.07 -0.18 3.13 0.00 -1.26 -5.13 121.76 114.56 2k8p s ALA 180 Ca 0.48 0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.54 2k8p s ALA 180 Cb -0.04 -2.03 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 2k8p s ALA 180 CO 0.30 -1.74 -0.08 1.21 0.00 0.00 0.00 175.76 175.44 2k8p s ASN 181 N 2.51 4.18 0.11 0.00 3.84 -1.26 -5.11 114.94 119.21 2k8p s ASN 181 Ca 0.10 -0.35 0.06 0.00 0.21 0.00 0.00 52.86 52.88 2k8p s ASN 181 Cb -0.13 -1.68 -0.04 0.00 -0.55 0.00 0.00 41.25 38.86 2k8p s ASN 181 CO -0.31 0.07 -0.15 -1.10 -2.79 0.00 0.00 177.10 172.82 2k8p s GLN 182 N 0.91 1.00 0.24 0.43 -0.21 -1.26 -5.16 119.66 115.61 2k8p s GLN 182 Ca -0.02 -1.16 -0.05 0.00 0.02 0.00 0.00 55.36 54.15 2k8p s GLN 182 Cb -0.15 -0.98 -0.02 0.00 1.00 0.00 0.00 33.01 32.86 2k8p s GLN 182 CO 0.00 0.20 0.31 0.00 -2.12 0.00 0.00 175.29 173.69 2k8p s ALA 183 N -1.76 0.64 0.06 6.09 0.00 -1.26 -5.18 121.76 120.35 2k8p s ALA 183 Ca 0.06 -1.40 0.03 0.00 0.00 0.00 0.00 51.96 50.65 2k8p s ALA 183 Cb -0.07 1.25 -0.03 0.00 0.00 0.00 0.00 23.12 24.27 2k8p s ALA 183 CO 0.03 -0.72 -0.09 -2.00 0.00 0.00 0.00 175.76 172.99 2k8p s GLU 184 N -3.93 0.67 -0.41 0.00 2.12 -1.26 -5.07 118.70 110.81 2k8p s GLU 184 Ca 0.32 -0.95 0.09 0.00 0.36 0.00 0.00 54.97 54.79 2k8p s GLU 184 Cb 0.03 -0.37 0.37 0.00 0.26 0.00 0.00 34.13 34.41 2k8p s GLU 184 CO 0.13 0.06 1.25 -0.11 -0.54 0.00 0.00 175.26 176.05 2k8p n LEU 185 N 1.03 -1.83 -3.56 2.70 7.94 -1.26 -5.03 117.00 116.99 2k8p n LEU 185 Ca -0.20 -3.59 -0.41 0.00 -1.11 0.00 0.00 56.01 50.71 2k8p n LEU 185 Cb 0.56 0.35 -0.01 0.00 0.53 0.00 0.00 43.42 44.85 2k8p n LEU 185 CO 0.23 1.95 2.77 1.21 -1.11 0.00 0.00 177.39 182.45 2k8p n GLU 186 N -0.25 3.59 -0.66 1.96 2.13 -1.26 -4.96 120.64 121.20 2k8p n GLU 186 Ca 0.01 -2.77 -0.25 0.00 0.66 0.00 0.00 57.16 54.82 2k8p n GLU 186 Cb 0.80 -2.94 0.22 0.00 0.27 0.00 0.00 31.44 29.78 2k8p n GLU 186 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2k8p n ASN 187 N 4.06 -2.45 -3.65 4.31 4.13 -1.26 -5.08 115.26 115.31 2k8p n ASN 187 Ca 0.61 -0.96 0.00 0.00 1.68 0.00 0.00 54.58 55.92 2k8p n ASN 187 Cb 0.30 -0.82 0.00 0.00 -1.54 0.00 0.00 39.78 37.72 2k8p n ASN 187 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k8p s ALA 188 N -2.75 -2.12 -1.30 5.41 0.00 -1.26 -5.33 121.76 114.40 2k8p s ALA 188 Ca 0.57 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.80 2k8p s ALA 188 Cb -0.07 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.66 2k8p s ALA 188 CO 0.45 -1.08 0.33 0.66 0.00 0.00 0.00 175.76 176.12