#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 -3.69 -3.89 1.61 7.02 -1.26 -5.06 117.44 112.18 2k8p n TRP 2 Ca 0.00 1.57 -0.11 0.00 -1.02 0.00 0.00 57.50 57.94 2k8p n TRP 2 Cb 0.00 -3.94 -0.12 0.00 -2.42 0.00 0.00 31.31 24.83 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 -2.04 0.24 0.01 -0.99 -1.52 -1.26 -5.17 119.66 108.93 2k8p s GLN 3 Ca 0.11 -0.20 0.00 0.00 -1.95 0.00 0.00 55.36 53.32 2k8p s GLN 3 Cb -0.03 0.10 -0.00 0.00 -0.22 0.00 0.00 33.01 32.86 2k8p s GLN 3 CO 0.76 -0.05 0.00 0.00 -0.25 0.00 0.00 175.29 175.76 2k8p n ALA 4 N 2.29 0.01 -4.25 6.09 0.00 -1.26 -5.18 120.51 118.21 2k8p n ALA 4 Ca -0.18 -0.03 -0.18 0.00 0.00 0.00 0.00 53.44 53.05 2k8p n ALA 4 Cb 0.57 0.02 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 2k8p n ALA 4 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2k8p n PHE 5 N -0.01 0.24 -3.65 0.00 -1.74 -1.26 -5.16 117.46 105.87 2k8p n PHE 5 Ca -0.00 -1.43 -0.07 0.00 -0.56 0.00 0.00 57.45 55.39 2k8p n PHE 5 Cb 0.01 -0.21 -0.08 0.00 1.52 0.00 0.00 39.48 40.72 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 -3.13 0.61 -0.27 3.97 1.02 -1.26 -5.13 119.74 115.55 2k8p s LYS 6 Ca 0.05 1.14 -0.03 0.00 0.02 0.00 0.00 55.97 57.14 2k8p s LYS 6 Cb -0.00 0.17 0.09 0.00 -0.52 0.00 0.00 37.83 37.57 2k8p s LYS 6 CO 0.03 -0.16 0.11 -0.80 -0.92 0.00 0.00 175.35 173.61 2k8p s ASN 7 N 1.73 3.48 -0.06 2.83 -0.87 -1.26 -5.12 114.94 115.68 2k8p s ASN 7 Ca -0.09 -1.26 -0.05 0.00 -1.57 0.00 0.00 52.86 49.89 2k8p s ASN 7 Cb -0.07 -0.50 0.02 0.00 -0.02 0.00 0.00 41.25 40.68 2k8p s ASN 7 CO -0.18 -0.41 0.15 -1.81 -2.57 0.00 0.00 177.10 172.28 2k8p s ASP 8 N 1.95 -0.15 -0.30 -1.22 1.01 -1.26 -5.14 116.67 111.56 2k8p s ASP 8 Ca 0.07 0.30 -0.10 0.00 0.71 0.00 0.00 52.55 53.54 2k8p s ASP 8 Cb -0.16 0.29 0.17 0.00 1.01 0.00 0.00 42.92 44.23 2k8p s ASP 8 CO -0.28 -0.06 0.84 0.00 0.21 0.00 0.00 175.17 175.88 2k8p s ALA 9 N 0.17 -2.64 -0.32 5.23 0.00 -1.26 -5.13 121.76 117.81 2k8p s ALA 9 Ca -0.01 1.90 0.05 0.00 0.00 0.00 0.00 51.96 53.91 2k8p s ALA 9 Cb -0.02 -2.14 0.18 0.00 0.00 0.00 0.00 23.12 21.14 2k8p s ALA 9 CO -0.00 -1.17 0.54 0.99 0.00 0.00 0.00 175.76 176.11 2k8p s THR 10 N 2.77 -0.87 0.12 0.00 2.01 -1.26 -5.15 115.64 113.25 2k8p s THR 10 Ca 0.04 -0.13 -0.23 0.00 0.31 0.00 0.00 61.69 61.68 2k8p s THR 10 Cb -0.11 -0.79 -0.07 0.00 0.01 0.00 0.00 72.50 71.54 2k8p s THR 10 CO -0.17 -0.10 0.70 -1.83 -0.69 0.00 0.00 174.62 172.53 2k8p s GLU 11 N 2.50 4.44 -0.40 4.92 1.03 -1.26 -5.05 118.70 124.89 2k8p s GLU 11 Ca 0.11 1.00 0.03 0.00 0.03 0.00 0.00 54.97 56.15 2k8p s GLU 11 Cb -0.10 -3.27 0.11 0.00 -0.80 0.00 0.00 34.13 30.07 2k8p s GLU 11 CO -0.22 0.55 0.13 0.42 -1.33 0.00 0.00 175.26 174.81 2k8p s ILE 12 N -0.97 2.08 -0.47 1.83 1.01 -1.26 -5.00 121.20 118.43 2k8p s ILE 12 Ca 0.34 -2.51 0.08 0.00 0.00 0.00 0.00 60.65 58.55 2k8p s ILE 12 Cb -0.22 -2.51 0.26 0.00 0.01 0.00 0.00 42.46 40.01 2k8p s ILE 12 CO 0.23 -0.70 0.62 -0.38 0.00 0.00 0.00 174.94 174.72 2k8p n ILE 13 N 3.94 0.43 -1.09 2.92 2.08 -1.26 -5.12 119.36 121.26 2k8p n ILE 13 Ca 0.04 -4.49 -0.30 0.00 0.56 0.00 0.00 62.75 58.57 2k8p n ILE 13 Cb 0.38 -1.87 0.23 0.00 -0.75 0.00 0.00 39.64 37.64 2k8p n ILE 13 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2k8p s PRO 14 N -1.75 -1.00 -0.30 0.38 0.04 -1.26 -5.08 135.00 126.02 2k8p s PRO 14 Ca 0.37 0.02 -0.04 0.00 0.04 0.00 0.00 61.00 61.39 2k8p s PRO 14 Cb 0.18 -1.61 0.19 0.00 0.04 0.00 0.00 34.50 33.29 2k8p s PRO 14 CO -0.08 -3.58 0.80 -2.00 0.04 0.00 0.00 177.00 172.18 2k8p s GLU 15 N -5.34 0.38 -0.06 4.56 2.12 -1.26 -5.15 118.70 113.96 2k8p s GLU 15 Ca 0.70 0.52 -0.00 0.00 0.36 0.00 0.00 54.97 56.55 2k8p s GLU 15 Cb -0.11 0.27 0.03 0.00 0.26 0.00 0.00 34.13 34.58 2k8p s GLU 15 CO 0.56 -0.57 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.18 2k8p s LEU 16 N 2.89 0.92 -0.41 2.70 1.43 -1.26 -5.04 118.68 119.91 2k8p s LEU 16 Ca 0.14 -0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.20 2k8p s LEU 16 Cb -0.10 -0.43 0.31 0.00 0.03 0.00 0.00 46.19 46.01 2k8p s LEU 16 CO -0.21 -0.13 1.20 0.61 0.23 0.00 0.00 176.35 178.05 2k8p n GLY 17 N 4.64 -0.22 2.86 -3.19 0.00 -1.26 -5.09 105.19 102.94 2k8p n GLY 17 Ca -0.16 0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 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 0.22 1.52 -0.45 1.61 1.03 -1.26 -5.00 118.70 116.38 2k8p s GLU 18 Ca 0.22 -2.12 0.07 0.00 0.03 0.00 0.00 54.97 53.18 2k8p s GLU 18 Cb 0.28 -2.83 0.23 0.00 -0.80 0.00 0.00 34.13 31.02 2k8p s GLU 18 CO -0.12 -1.08 0.53 0.98 -1.33 0.00 0.00 175.26 174.24 2k8p n TYR 19 N 3.65 0.38 -2.23 4.83 9.36 -1.26 -5.12 117.16 126.77 2k8p n TYR 19 Ca 0.05 -3.65 -0.35 0.00 3.32 0.00 0.00 57.90 57.27 2k8p n TYR 19 Cb 0.36 -0.30 0.00 0.00 -0.63 0.00 0.00 39.34 38.77 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 -1.22 3.32 -0.45 2.98 0.04 -1.26 -5.02 135.00 133.40 2k8p s PRO 20 Ca 0.35 1.60 0.03 0.00 0.04 0.00 0.00 61.00 63.02 2k8p s PRO 20 Cb 0.14 -2.00 0.24 0.00 0.04 0.00 0.00 34.50 32.91 2k8p s PRO 20 CO -0.11 -0.87 0.96 -0.85 0.04 0.00 0.00 177.00 176.17 2k8p n GLU 21 N -1.36 0.52 -2.10 4.56 0.28 -1.26 -5.12 120.64 116.15 2k8p n GLU 21 Ca 0.12 -1.47 -0.43 0.00 -0.16 0.00 0.00 57.16 55.22 2k8p n GLU 21 Cb 0.51 -1.03 -0.03 0.00 1.43 0.00 0.00 31.44 32.32 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 0.63 3.58 0.96 3.44 0.04 -1.26 -5.00 135.00 137.40 2k8p s PRO 22 Ca 0.29 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 62.69 2k8p s PRO 22 Cb 0.17 -4.10 0.17 0.00 0.04 0.00 0.00 34.50 30.78 2k8p s PRO 22 CO -0.16 -1.55 1.09 -1.25 0.04 0.00 0.00 177.00 175.17 2k8p s PRO 23 N 5.10 0.72 0.29 0.56 0.04 -1.26 -5.06 135.00 135.39 2k8p s PRO 23 Ca 0.73 0.63 -0.05 0.00 0.04 0.00 0.00 61.00 62.36 2k8p s PRO 23 Cb -0.22 -1.76 0.07 0.00 0.04 0.00 0.00 34.50 32.63 2k8p s PRO 23 CO 0.32 -2.56 0.25 -0.35 0.04 0.00 0.00 177.00 174.70 2k8p n PRO 24 N -4.08 -1.51 -3.07 0.56 -0.04 -1.26 -5.09 135.00 120.52 2k8p n PRO 24 Ca 0.06 -0.41 0.04 0.00 -0.04 0.00 0.00 63.50 63.15 2k8p n PRO 24 Cb 0.56 -0.38 -0.00 0.00 -0.04 0.00 0.00 33.50 33.64 2k8p n PRO 24 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2k8p s GLU 25 N -3.58 0.35 0.00 0.54 2.12 -1.26 -5.17 118.70 111.71 2k8p s GLU 25 Ca 0.16 0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.61 2k8p s GLU 25 Cb -0.02 0.10 0.00 0.00 0.26 0.00 0.00 34.13 34.47 2k8p s GLU 25 CO 0.13 -0.58 0.00 1.28 -0.54 0.00 0.00 175.26 175.54 2k8p n LEU 26 N 4.71 0.00 -3.57 2.70 4.32 -1.26 -5.19 117.00 118.71 2k8p n LEU 26 Ca 0.08 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.99 2k8p n LEU 26 Cb 0.58 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.34 2k8p n LEU 26 CO -0.10 0.00 0.84 -1.61 -1.22 0.00 0.00 177.39 175.30 2k8p s GLU 27 N 0.11 0.54 0.07 3.23 2.02 -1.26 -5.19 118.70 118.21 2k8p s GLU 27 Ca 0.00 -0.02 -0.25 0.00 0.02 0.00 0.00 54.97 54.72 2k8p s GLU 27 Cb 0.00 0.25 0.08 0.00 0.10 0.00 0.00 34.13 34.57 2k8p s GLU 27 CO 0.00 -0.20 1.16 -1.71 0.02 0.00 0.00 175.26 174.53 2k8p n ASN 28 N 0.34 -1.42 -1.06 -0.19 2.85 -1.26 -5.06 115.26 109.46 2k8p n ASN 28 Ca -0.07 -1.53 -0.03 0.00 -0.11 0.00 0.00 54.58 52.84 2k8p n ASN 28 Cb 0.59 2.25 -0.04 0.00 1.24 0.00 0.00 39.78 43.82 2k8p n ASN 28 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 2k8p n ASN 29 N -1.16 -0.36 -4.46 1.20 0.23 -1.26 -5.01 115.26 104.43 2k8p n ASN 29 Ca 0.02 -1.90 -0.27 0.00 -0.53 0.00 0.00 54.58 51.89 2k8p n ASN 29 Cb 0.57 0.10 -0.11 0.00 -2.08 0.00 0.00 39.78 38.26 2k8p n ASN 29 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2k8p s LYS 30 N 0.00 1.65 0.08 -3.83 3.01 -1.26 -5.05 119.74 114.35 2k8p s LYS 30 Ca 0.08 -1.46 -0.04 0.00 -1.01 0.00 0.00 55.97 53.54 2k8p s LYS 30 Cb 0.10 -1.92 -0.03 0.00 -1.01 0.00 0.00 37.83 34.97 2k8p s LYS 30 CO -0.04 0.41 0.08 -0.08 0.51 0.00 0.00 175.35 176.22 2k8p s THR 31 N -1.67 0.17 0.64 2.17 -1.32 -1.26 -0.61 115.64 113.76 2k8p s THR 31 Ca 0.22 -1.59 0.05 0.00 -1.21 0.00 0.00 61.69 59.16 2k8p s THR 31 Cb -0.08 -1.55 0.11 0.00 -1.51 0.00 0.00 72.50 69.46 2k8p s THR 31 CO 0.11 -0.76 0.88 -0.04 -2.21 0.00 0.00 174.62 172.60 2k8p s MET 32 N -3.92 2.01 -0.02 7.08 -1.94 -1.26 -4.92 119.30 116.33 2k8p s MET 32 Ca 0.09 -1.40 0.01 0.00 -1.71 0.00 0.00 55.69 52.68 2k8p s MET 32 Cb 0.07 -2.50 0.01 0.00 2.01 0.00 0.00 34.83 34.41 2k8p s MET 32 CO -0.08 -1.13 -0.03 1.21 -0.01 0.00 0.00 175.02 174.98 2k8p s ASN 33 N -4.70 0.53 0.30 3.03 2.47 -1.26 -5.13 114.94 110.18 2k8p s ASN 33 Ca 0.64 -0.07 0.07 0.00 0.42 0.00 0.00 52.86 53.92 2k8p s ASN 33 Cb -0.06 -0.17 -0.06 0.00 -1.45 0.00 0.00 41.25 39.51 2k8p s ASN 33 CO 0.41 -0.01 -0.07 -0.13 -3.72 0.00 0.00 177.10 173.58 2k8p s ARG 34 N 0.43 1.63 -0.18 0.43 0.52 -1.26 -5.14 118.95 115.39 2k8p s ARG 34 Ca -0.05 -1.83 -0.11 0.00 -0.52 0.00 0.00 55.73 53.23 2k8p s ARG 34 Cb -0.08 -1.31 -0.05 0.00 0.52 0.00 0.00 34.95 34.03 2k8p s ARG 34 CO -0.01 0.06 0.17 0.00 0.02 0.00 0.00 175.30 175.55 2k8p s ALA 35 N -2.90 3.69 0.39 2.13 0.00 -1.26 -5.10 121.76 118.71 2k8p s ALA 35 Ca 0.31 -0.62 0.08 0.00 0.00 0.00 0.00 51.96 51.72 2k8p s ALA 35 Cb 0.03 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 2k8p s ALA 35 CO 0.13 0.21 0.21 -1.21 0.00 0.00 0.00 175.76 175.10 2k8p s GLU 36 N 0.19 2.35 -0.11 0.00 2.02 -1.26 -5.13 118.70 116.76 2k8p s GLU 36 Ca 0.11 -1.67 -0.03 0.00 0.02 0.00 0.00 54.97 53.40 2k8p s GLU 36 Cb -0.12 -2.14 -0.03 0.00 0.10 0.00 0.00 34.13 31.94 2k8p s GLU 36 CO 0.00 -0.05 0.03 -0.80 0.02 0.00 0.00 175.26 174.46 2k8p s ASN 37 N -3.94 5.45 0.19 -0.19 0.01 -1.26 -5.11 114.94 110.09 2k8p s ASN 37 Ca 0.41 0.17 0.05 0.00 -0.71 0.00 0.00 52.86 52.79 2k8p s ASN 37 Cb -0.00 -1.65 -0.05 0.00 0.41 0.00 0.00 41.25 39.96 2k8p s ASN 37 CO 0.24 0.35 -0.08 -0.83 -1.51 0.00 0.00 177.10 175.27 2k8p s GLY 38 N -0.68 1.31 0.00 0.66 0.00 -1.26 -5.09 107.32 102.27 2k8p s GLY 38 Ca 0.11 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.21 2k8p s GLY 38 CO 0.02 -1.66 0.00 0.61 0.00 0.00 0.00 173.10 172.07 2k8p n GLY 39 N -0.32 -0.98 2.43 0.20 0.00 -1.26 -5.10 105.19 100.16 2k8p n GLY 39 Ca -0.08 0.48 -0.27 0.00 0.00 0.00 0.00 46.02 46.15 2k8p n GLY 39 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k8p n ARG 40 N 0.00 2.38 -1.18 1.61 1.85 -1.26 -4.91 116.66 115.16 2k8p n ARG 40 Ca 0.00 -4.57 -0.29 0.00 -1.00 0.00 0.00 57.85 51.99 2k8p n ARG 40 Cb 0.00 -2.19 0.16 0.00 -1.05 0.00 0.00 32.46 29.38 2k8p n ARG 40 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2k8p s PRO 41 N -2.35 0.74 0.26 2.89 0.04 -1.26 -4.82 135.00 130.49 2k8p s PRO 41 Ca 0.39 0.64 -0.29 0.00 0.04 0.00 0.00 61.00 61.77 2k8p s PRO 41 Cb 0.14 -1.76 -0.09 0.00 0.04 0.00 0.00 34.50 32.83 2k8p s PRO 41 CO -0.02 -2.55 1.26 -1.25 0.04 0.00 0.00 177.00 174.48 2k8p s PRO 42 N -4.95 4.43 -0.03 0.56 0.04 -1.26 -4.97 135.00 128.83 2k8p s PRO 42 Ca 0.65 2.06 0.01 0.00 0.04 0.00 0.00 61.00 63.75 2k8p s PRO 42 Cb -0.18 -3.15 0.02 0.00 0.04 0.00 0.00 34.50 31.23 2k8p s PRO 42 CO 0.57 -0.13 -0.02 -1.01 0.04 0.00 0.00 177.00 176.46 2k8p s HIS 43 N -0.61 0.44 -0.46 0.56 3.76 -1.26 -5.08 115.29 112.64 2k8p s HIS 43 Ca 0.51 -0.06 0.06 0.00 -0.15 0.00 0.00 55.06 55.42 2k8p s HIS 43 Cb -0.37 -0.46 0.22 0.00 1.11 0.00 0.00 32.58 33.09 2k8p s HIS 43 CO 0.44 -0.13 0.51 0.72 -0.85 0.00 0.00 174.74 175.42 2k8p n HIS 44 N 4.00 0.36 -1.14 1.40 8.25 -1.26 -5.12 115.22 121.71 2k8p n HIS 44 Ca -0.26 -3.64 -0.29 0.00 -0.26 0.00 0.00 57.72 53.28 2k8p n HIS 44 Cb 0.51 -0.24 0.20 0.00 1.12 0.00 0.00 29.99 31.57 2k8p n HIS 44 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2k8p s PRO 45 N -1.08 -0.09 -0.10 -0.41 0.04 -1.26 -4.99 135.00 127.11 2k8p s PRO 45 Ca 0.35 0.34 -0.28 0.00 0.04 0.00 0.00 61.00 61.45 2k8p s PRO 45 Cb 0.12 -1.69 -0.02 0.00 0.04 0.00 0.00 34.50 32.95 2k8p s PRO 45 CO -0.12 -3.04 0.92 -0.06 0.04 0.00 0.00 177.00 174.73 2k8p s PHE 46 N -2.98 3.53 0.43 0.56 0.08 -1.26 -5.05 117.98 113.29 2k8p s PHE 46 Ca 0.67 1.49 0.08 0.00 0.12 0.00 0.00 56.93 59.29 2k8p s PHE 46 Cb -0.16 -3.08 -0.01 0.00 -0.57 0.00 0.00 43.02 39.20 2k8p s PHE 46 CO 0.57 -0.15 0.44 -1.21 -0.10 0.00 0.00 175.22 174.77 2k8p s GLU 47 N 1.70 2.56 -0.30 0.44 2.02 -1.26 -4.79 118.70 119.07 2k8p s GLU 47 Ca 0.45 -1.52 -0.07 0.00 0.02 0.00 0.00 54.97 53.86 2k8p s GLU 47 Cb -0.18 -2.45 0.17 0.00 0.10 0.00 0.00 34.13 31.77 2k8p s GLU 47 CO 0.19 -0.27 0.75 0.95 0.02 0.00 0.00 175.26 176.90 2k8p s THR 48 N -2.48 -0.80 -1.20 3.63 -4.23 -1.26 -5.09 115.64 104.22 2k8p s THR 48 Ca 0.49 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.87 2k8p s THR 48 Cb -0.05 -1.00 0.18 0.00 1.34 0.00 0.00 72.50 72.97 2k8p s THR 48 CO 0.29 0.00 1.41 -0.54 -0.54 0.00 0.00 174.62 175.24 2k8p s LYS 49 N 2.83 4.09 -0.07 3.99 -0.14 -1.26 -4.92 119.74 124.26 2k8p s LYS 49 Ca 0.08 -2.60 -0.31 0.00 -1.36 0.00 0.00 55.97 51.78 2k8p s LYS 49 Cb -0.12 -5.03 0.07 0.00 -1.68 0.00 0.00 37.83 31.07 2k8p s LYS 49 CO -0.18 -1.74 0.69 0.16 -0.76 0.00 0.00 175.35 173.52 2k8p s ASP 50 N 2.76 -0.66 -0.35 2.83 1.47 -1.26 -5.13 116.67 116.33 2k8p s ASP 50 Ca 0.42 0.76 0.02 0.00 1.18 0.00 0.00 52.55 54.93 2k8p s ASP 50 Cb -0.03 0.60 0.15 0.00 -0.34 0.00 0.00 42.92 43.29 2k8p s ASP 50 CO -0.01 -0.58 0.34 -0.69 0.68 0.00 0.00 175.17 174.91 2k8p s VAL 51 N -1.09 -0.29 -0.14 2.11 1.01 -1.26 -4.95 120.40 115.79 2k8p s VAL 51 Ca -0.10 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.92 2k8p s VAL 51 Cb -0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 2k8p s VAL 51 CO 0.09 -0.61 0.19 -1.54 0.00 0.00 0.00 175.10 173.23 2k8p n SER 52 N 4.43 0.32 -1.64 3.32 3.41 -1.26 -5.08 113.62 117.12 2k8p n SER 52 Ca 0.09 -0.66 -0.02 0.00 -0.26 0.00 0.00 58.87 58.01 2k8p n SER 52 Cb 0.44 0.80 0.01 0.00 -0.26 0.00 0.00 64.21 65.21 2k8p n SER 52 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2k8p n GLU 53 N -0.82 0.34 -0.04 4.33 2.13 -1.26 -5.06 120.64 120.26 2k8p n GLU 53 Ca 0.01 -0.68 -0.02 0.00 0.66 0.00 0.00 57.16 57.12 2k8p n GLU 53 Cb 0.04 0.87 -0.08 0.00 0.27 0.00 0.00 31.44 32.54 2k8p n GLU 53 CO 0.00 0.00 0.00 2.48 -0.41 0.00 0.00 177.13 179.20 2k8p n TYR 54 N -0.20 0.00 -4.47 4.31 4.11 -1.26 -5.00 117.16 114.65 2k8p n TYR 54 Ca -0.02 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 57.67 2k8p n TYR 54 Cb 0.20 -0.41 -0.04 0.00 -0.00 0.00 0.00 39.34 39.08 2k8p n TYR 54 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 2k8p n SER 55 N -2.21 2.82 -4.57 9.48 7.64 -1.15 -3.46 113.62 122.17 2k8p n SER 55 Ca -0.12 -2.39 -0.41 0.00 1.01 0.00 0.00 58.87 56.96 2k8p n SER 55 Cb 0.65 0.24 -0.03 0.00 -1.01 0.00 0.00 64.21 64.06 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 5.88 3.18 -0.14 0.00 3.00 -0.48 -4.86 118.95 125.53 2k8p s ARG 57 Ca 0.59 1.31 -0.29 0.00 -1.00 0.00 0.00 55.73 56.34 2k8p s ARG 57 Cb -0.13 -4.24 -0.05 0.00 0.00 0.00 0.00 34.95 30.53 2k8p s ARG 57 CO 0.25 -2.04 1.93 -1.21 0.00 0.00 0.00 175.30 174.23 2k8p s GLU 58 N 5.97 3.68 0.50 5.12 8.01 -1.26 -3.92 118.70 136.80 2k8p s GLU 58 Ca 0.79 2.09 -0.05 0.00 0.01 0.00 0.00 54.97 57.81 2k8p s GLU 58 Cb -0.21 -4.19 -0.02 0.00 -4.31 0.00 0.00 34.13 25.40 2k8p s GLU 58 CO 0.31 -1.46 0.80 -0.51 0.01 0.00 0.00 175.26 174.41 2k8p s LEU 59 N 6.02 3.55 -0.17 1.80 2.01 -0.57 -4.94 118.68 126.38 2k8p s LEU 59 Ca 0.87 0.83 -0.05 0.00 0.01 0.00 0.00 54.13 55.78 2k8p s LEU 59 Cb -0.33 -3.75 0.08 0.00 0.01 0.00 0.00 46.19 42.20 2k8p s LEU 59 CO 0.35 -0.69 0.33 -1.00 1.01 0.00 0.00 176.35 176.36 2k8p s HIS 60 N -2.78 -0.61 0.19 0.29 3.76 -1.26 -0.23 115.29 114.66 2k8p s HIS 60 Ca 0.49 1.13 0.11 0.00 -0.15 0.00 0.00 55.06 56.63 2k8p s HIS 60 Cb -0.10 0.08 -0.04 0.00 1.11 0.00 0.00 32.58 33.63 2k8p s HIS 60 CO 0.44 -0.46 -0.19 -0.06 -0.85 0.00 0.00 174.74 173.62 2k8p s PHE 61 N 2.50 2.41 0.25 1.40 0.40 -0.82 -4.96 117.98 119.16 2k8p s PHE 61 Ca 0.02 -0.32 0.11 0.00 -0.60 0.00 0.00 56.93 56.14 2k8p s PHE 61 Cb -0.13 -1.19 -0.05 0.00 0.51 0.00 0.00 43.02 42.17 2k8p s PHE 61 CO -0.11 0.51 -0.19 0.99 0.70 0.00 0.00 175.22 177.12 2k8p s THR 62 N -1.69 2.24 -0.22 0.64 2.01 -1.26 -1.24 115.64 116.13 2k8p s THR 62 Ca 0.22 -2.31 -0.27 0.00 0.31 0.00 0.00 61.69 59.63 2k8p s THR 62 Cb -0.08 -2.20 0.12 0.00 0.01 0.00 0.00 72.50 70.35 2k8p s THR 62 CO 0.12 -0.43 1.00 -0.13 -0.69 0.00 0.00 174.62 174.48 2k8p s ARG 63 N -3.47 0.57 -0.26 4.92 1.81 -1.08 -4.96 118.95 116.49 2k8p s ARG 63 Ca 0.27 0.40 -0.19 0.00 -1.72 0.00 0.00 55.73 54.49 2k8p s ARG 63 Cb -0.04 0.27 -0.02 0.00 -0.45 0.00 0.00 34.95 34.71 2k8p s ARG 63 CO 0.12 -0.13 0.56 0.71 -0.68 0.00 0.00 175.30 175.88 2k8p s TYR 64 N -0.40 3.27 -0.19 -0.53 2.02 -1.26 -1.45 117.35 118.82 2k8p s TYR 64 Ca 0.00 0.70 -0.12 0.00 -0.37 0.00 0.00 57.07 57.29 2k8p s TYR 64 Cb -0.03 -2.76 -0.05 0.00 -0.40 0.00 0.00 41.96 38.72 2k8p s TYR 64 CO -0.02 -0.30 0.20 0.54 -1.57 0.00 0.00 175.55 174.40 2k8p s VAL 65 N 2.37 5.36 -0.09 0.71 0.11 -1.26 -5.00 120.40 122.61 2k8p s VAL 65 Ca 0.23 0.33 -0.04 0.00 -2.93 0.00 0.00 61.98 59.57 2k8p s VAL 65 Cb -0.16 -3.54 0.05 0.00 -1.53 0.00 0.00 36.38 31.20 2k8p s VAL 65 CO 0.09 0.40 0.19 0.42 -3.33 0.00 0.00 175.10 172.87 2k8p s THR 66 N 0.51 -0.21 -0.15 5.04 -4.23 -1.26 -0.91 115.64 114.44 2k8p s THR 66 Ca 0.11 0.27 0.01 0.00 -1.18 0.00 0.00 61.69 60.91 2k8p s THR 66 Cb -0.12 -0.32 0.01 0.00 1.34 0.00 0.00 72.50 73.41 2k8p s THR 66 CO 0.01 0.11 -0.19 -0.62 -0.54 0.00 0.00 174.62 173.39 2k8p s ASP 67 N 1.89 3.35 0.42 3.99 2.15 -1.21 -4.95 116.67 122.30 2k8p s ASP 67 Ca -0.02 -0.55 0.00 0.00 0.43 0.00 0.00 52.55 52.41 2k8p s ASP 67 Cb -0.12 -1.50 0.00 0.00 -0.30 0.00 0.00 42.92 41.01 2k8p s ASP 67 CO -0.07 0.08 0.00 0.61 -0.17 0.00 0.00 175.17 175.62 2k8p n GLY 68 N 4.09 -0.02 0.00 2.66 0.00 -1.26 -3.20 105.19 107.47 2k8p n GLY 68 Ca -0.20 -0.97 0.07 0.00 0.00 0.00 0.00 46.02 44.93 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 0.21 -3.29 1.61 -0.04 -1.26 -4.75 135.00 127.48 2k8p n PRO 69 Ca 0.00 0.14 -0.20 0.00 -0.04 0.00 0.00 63.50 63.40 2k8p n PRO 69 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 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 -4.39 1.15 0.45 0.00 3.03 -0.35 -3.36 118.95 115.48 2k8p s ARG 71 Ca 0.52 -0.11 -0.25 0.00 2.03 0.00 0.00 55.73 57.92 2k8p s ARG 71 Cb -0.06 0.54 -0.08 0.00 -1.03 0.00 0.00 34.95 34.32 2k8p s ARG 71 CO 0.32 -0.43 1.33 -1.54 -1.13 0.00 0.00 175.30 173.84 2k8p s SER 72 N -1.96 6.02 0.33 -2.89 1.04 -0.09 0.12 113.70 116.27 2k8p s SER 72 Ca -0.05 2.70 0.17 0.00 0.48 0.00 0.00 55.95 59.25 2k8p s SER 72 Cb -0.01 -2.64 0.47 0.00 0.10 0.00 0.00 66.02 63.95 2k8p s SER 72 CO -0.01 -1.06 1.63 0.00 0.98 0.00 0.00 173.24 174.78 2k8p h ALA 73 N 2.32 0.88 -2.47 5.32 0.00 -1.72 -3.46 119.26 120.13 2k8p h ALA 73 Ca -0.50 -0.41 -0.09 0.00 0.00 0.00 0.00 54.91 53.90 2k8p h ALA 73 Cb 1.26 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.84 2k8p h ALA 73 CO 0.61 0.56 -0.42 0.15 0.00 0.00 0.00 179.25 180.16 2k8p s LYS 74 N -3.40 0.83 0.60 0.00 1.02 -1.26 -5.14 119.74 112.39 2k8p s LYS 74 Ca 0.01 -1.03 -0.17 0.00 0.02 0.00 0.00 55.97 54.80 2k8p s LYS 74 Cb 0.10 0.32 -0.03 0.00 -0.52 0.00 0.00 37.83 37.70 2k8p s LYS 74 CO 0.71 -0.25 1.12 -1.25 -0.92 0.00 0.00 175.35 174.76 2k8p s PRO 75 N -3.88 3.09 -0.18 -1.68 0.04 -1.26 -4.73 135.00 126.39 2k8p s PRO 75 Ca 0.07 1.50 -0.09 0.00 0.04 0.00 0.00 61.00 62.52 2k8p s PRO 75 Cb 0.05 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 2k8p s PRO 75 CO -0.10 -1.04 0.11 0.54 0.04 0.00 0.00 177.00 176.55 2k8p s VAL 76 N -2.05 5.25 -0.46 -0.36 0.11 -0.53 -4.90 120.40 117.47 2k8p s VAL 76 Ca 0.70 0.13 -0.18 0.00 -2.93 0.00 0.00 61.98 59.70 2k8p s VAL 76 Cb -0.22 -3.37 0.04 0.00 -1.53 0.00 0.00 36.38 31.30 2k8p s VAL 76 CO 0.34 0.48 0.52 -0.89 -3.33 0.00 0.00 175.10 172.22 2k8p s THR 77 N 0.11 5.00 -0.24 5.04 2.01 -1.26 -2.63 115.64 123.67 2k8p s THR 77 Ca 0.08 -0.42 -0.05 0.00 0.31 0.00 0.00 61.69 61.61 2k8p s THR 77 Cb -0.11 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.23 2k8p s THR 77 CO -0.00 -0.59 -0.00 -1.83 -0.69 0.00 0.00 174.62 171.51 2k8p s GLU 78 N 2.33 3.42 0.26 4.92 -1.05 -0.37 -4.99 118.70 123.23 2k8p s GLU 78 Ca 0.14 -0.61 -0.29 0.00 -0.15 0.00 0.00 54.97 54.05 2k8p s GLU 78 Cb -0.18 -3.13 -0.09 0.00 -0.44 0.00 0.00 34.13 30.28 2k8p s GLU 78 CO 0.13 -0.22 1.19 -1.17 0.95 0.00 0.00 175.26 176.14 2k8p s LEU 79 N 1.52 4.48 0.17 1.83 0.20 -1.25 -1.94 118.68 123.69 2k8p s LEU 79 Ca 0.06 2.38 0.10 0.00 0.69 0.00 0.00 54.13 57.36 2k8p s LEU 79 Cb -0.15 -3.63 -0.04 0.00 -0.43 0.00 0.00 46.19 41.94 2k8p s LEU 79 CO -0.01 -0.33 -0.17 -0.69 -0.29 0.00 0.00 176.35 174.86 2k8p s VAL 80 N -0.78 2.79 -0.25 1.68 1.01 0.69 -4.08 120.40 121.45 2k8p s VAL 80 Ca 0.49 -1.77 -0.12 0.00 0.00 0.00 0.00 61.98 60.58 2k8p s VAL 80 Cb -0.35 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 2k8p s VAL 80 CO 0.43 -0.07 0.22 0.00 0.00 0.00 0.00 175.10 175.68 2k8p s SER 82 N 1.31 -0.63 0.00 0.00 0.15 -1.25 -4.93 113.70 108.35 2k8p s SER 82 Ca 0.10 0.72 0.00 0.00 0.70 0.00 0.00 55.95 57.47 2k8p s SER 82 Cb -0.15 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 2k8p s SER 82 CO 0.07 -0.56 0.00 0.61 1.20 0.00 0.00 173.24 174.56 2k8p n GLY 83 N 0.99 -0.37 3.28 9.45 0.00 -1.26 -1.38 105.19 115.89 2k8p n GLY 83 Ca -0.18 -2.26 -0.12 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.49 0.84 0.48 1.61 0.74 -1.23 -4.46 119.66 117.15 2k8p s GLN 84 Ca 0.00 -0.43 0.06 0.00 0.05 0.00 0.00 55.36 55.04 2k8p s GLN 84 Cb 0.00 0.37 -0.01 0.00 1.10 0.00 0.00 33.01 34.47 2k8p s GLN 84 CO 0.00 -0.27 0.25 0.00 -0.55 0.00 0.00 175.29 174.72 2k8p s GLY 86 N -4.06 -0.25 0.67 0.00 0.00 -1.22 -4.96 107.32 97.49 2k8p s GLY 86 Ca 0.33 0.28 -0.14 0.00 0.00 0.00 0.00 44.72 45.18 2k8p s GLY 86 CO 0.19 0.71 1.11 2.56 0.00 0.00 0.00 173.10 177.67 2k8p s PRO 87 N -2.72 2.74 -0.06 2.90 0.04 -1.26 -4.69 135.00 131.95 2k8p s PRO 87 Ca 0.15 1.36 -0.05 0.00 0.04 0.00 0.00 61.00 62.51 2k8p s PRO 87 Cb 0.01 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.62 2k8p s PRO 87 CO 0.00 -1.29 0.10 0.00 0.04 0.00 0.00 177.00 175.85 2k8p n ALA 88 N -2.54 -2.85 -1.26 8.56 0.00 -1.26 -4.94 120.51 116.22 2k8p n ALA 88 Ca 0.10 1.18 -0.01 0.00 0.00 0.00 0.00 53.44 54.71 2k8p n ALA 88 Cb 0.52 -2.52 0.22 0.00 0.00 0.00 0.00 19.45 17.67 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 1.47 2.30 -3.45 0.00 1.74 -1.26 -4.92 116.66 112.54 2k8p n ARG 89 Ca -0.17 -3.05 0.01 0.00 -0.77 0.00 0.00 57.85 53.88 2k8p n ARG 89 Cb 0.26 -1.86 -0.04 0.00 -1.02 0.00 0.00 32.46 29.79 2k8p n ARG 89 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2k8p s LEU 90 N -3.10 -0.66 0.34 0.55 1.98 -1.26 -5.17 118.68 111.36 2k8p s LEU 90 Ca 0.45 0.91 0.01 0.00 -2.89 0.00 0.00 54.13 52.61 2k8p s LEU 90 Cb 0.39 1.76 -0.03 0.00 0.66 0.00 0.00 46.19 48.97 2k8p s LEU 90 CO 0.04 -0.13 0.53 -0.76 -1.89 0.00 0.00 176.35 174.14 2k8p s LEU 91 N 2.48 4.02 0.24 -0.68 1.02 -1.26 -5.02 118.68 119.49 2k8p s LEU 91 Ca -0.03 0.35 0.01 0.00 0.02 0.00 0.00 54.13 54.48 2k8p s LEU 91 Cb -0.07 -3.21 0.27 0.00 0.02 0.00 0.00 46.19 43.20 2k8p s LEU 91 CO -0.18 -0.30 1.61 1.55 0.02 0.00 0.00 176.35 179.05 2k8p h PRO 92 N 0.79 0.45 -1.97 1.29 0.13 -2.04 -3.37 132.00 127.27 2k8p h PRO 92 Ca -0.50 -0.24 -0.55 0.00 -0.87 0.00 0.00 66.00 63.84 2k8p h PRO 92 Cb 1.22 0.01 -0.38 0.00 0.13 0.00 0.00 31.00 31.98 2k8p h PRO 92 CO 0.61 0.80 -1.09 0.09 -0.23 0.00 0.00 178.00 178.18 2k8p n ASN 93 N -4.01 0.08 -1.91 1.44 3.02 -1.26 -4.90 115.26 107.73 2k8p n ASN 93 Ca -0.02 -2.69 -0.00 0.00 -0.03 0.00 0.00 54.58 51.84 2k8p n ASN 93 Cb 0.52 -0.59 0.02 0.00 -0.61 0.00 0.00 39.78 39.13 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 1.47 2.81 -0.01 5.41 0.00 -1.26 -4.81 120.51 124.11 2k8p n ALA 94 Ca 0.21 -1.89 -0.04 0.00 0.00 0.00 0.00 53.44 51.72 2k8p n ALA 94 Cb 0.53 -0.70 -0.12 0.00 0.00 0.00 0.00 19.45 19.16 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 -0.20 1.32 0.00 0.00 2.08 -1.26 -4.81 119.36 116.49 2k8p n ILE 95 Ca -0.05 -0.75 0.00 0.00 0.56 0.00 0.00 62.75 62.51 2k8p n ILE 95 Cb 0.92 -0.77 0.00 0.00 -0.75 0.00 0.00 39.64 39.05 2k8p n ILE 95 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2k8p n GLY 96 N 1.51 -0.08 3.24 7.39 0.00 -1.26 -5.07 105.19 110.91 2k8p n GLY 96 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 2k8p n GLY 96 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8p s ARG 97 N -0.23 2.51 -0.24 1.61 3.00 -1.26 -5.12 118.95 119.22 2k8p s ARG 97 Ca 0.00 -0.85 -0.28 0.00 0.00 0.00 0.00 55.73 54.60 2k8p s ARG 97 Cb 0.00 -2.09 0.15 0.00 0.00 0.00 0.00 34.95 33.01 2k8p s ARG 97 CO 0.00 0.32 1.14 0.20 0.00 0.00 0.00 175.30 176.96 2k8p s GLY 98 N -0.04 -0.08 -0.20 -3.53 0.00 -1.26 -4.73 107.32 97.48 2k8p s GLY 98 Ca -0.06 2.58 -0.02 0.00 0.00 0.00 0.00 44.72 47.22 2k8p s GLY 98 CO 0.04 1.42 0.01 0.54 0.00 0.00 0.00 173.10 175.11 2k8p s LYS 99 N -0.53 0.94 -0.05 2.90 -0.14 -1.26 -5.11 119.74 116.50 2k8p s LYS 99 Ca 0.03 -0.59 -0.02 0.00 -1.36 0.00 0.00 55.97 54.03 2k8p s LYS 99 Cb -0.03 -2.25 0.03 0.00 -1.68 0.00 0.00 37.83 33.91 2k8p s LYS 99 CO -0.05 -0.62 0.08 -1.58 -0.76 0.00 0.00 175.35 172.42 2k8p s TRP 100 N 1.72 -0.03 0.00 3.18 0.23 -1.26 -5.00 118.94 117.78 2k8p s TRP 100 Ca -0.02 0.33 0.06 0.00 -2.03 0.00 0.00 56.10 54.44 2k8p s TRP 100 Cb -0.18 -0.31 0.11 0.00 0.03 0.00 0.00 33.47 33.12 2k8p s TRP 100 CO -0.07 -0.17 0.92 -2.67 0.96 0.00 0.00 176.95 175.91 2k8p n TRP 101 N 4.83 0.00 -2.58 -1.98 2.14 -1.26 -5.11 117.44 113.48 2k8p n TRP 101 Ca -0.14 -0.25 -0.41 0.00 2.07 0.00 0.00 57.50 58.77 2k8p n TRP 101 Cb 0.50 0.14 -0.04 0.00 -0.81 0.00 0.00 31.31 31.10 2k8p n TRP 101 CO 0.00 0.00 0.00 0.50 2.07 0.00 0.00 177.69 180.26 2k8p s ARG 102 N 0.00 4.65 0.88 -2.67 6.06 -1.26 -5.03 118.95 121.57 2k8p s ARG 102 Ca 0.08 1.64 -0.11 0.00 -2.50 0.00 0.00 55.73 54.84 2k8p s ARG 102 Cb 0.10 -3.30 0.12 0.00 0.06 0.00 0.00 34.95 31.93 2k8p s ARG 102 CO -0.04 0.16 1.09 -1.25 -2.50 0.00 0.00 175.30 172.76 2k8p s PRO 103 N -0.41 1.37 0.25 5.12 0.04 -1.26 -5.01 135.00 135.10 2k8p s PRO 103 Ca 0.48 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.38 2k8p s PRO 103 Cb -0.28 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.44 2k8p s PRO 103 CO 0.34 -2.17 0.00 0.43 0.04 0.00 0.00 177.00 175.63 2k8p n SER 104 N -3.84 -0.15 -3.41 6.66 7.64 -1.26 -5.17 113.62 114.09 2k8p n SER 104 Ca 0.07 0.43 -0.05 0.00 1.01 0.00 0.00 58.87 60.33 2k8p n SER 104 Cb 0.55 0.36 0.01 0.00 -1.01 0.00 0.00 64.21 64.12 2k8p n SER 104 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2k8p s GLY 105 N -4.84 0.06 0.30 0.23 0.00 -1.26 -5.15 107.32 96.66 2k8p s GLY 105 Ca 0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 44.72 44.12 2k8p s GLY 105 CO 0.00 0.86 1.23 2.56 0.00 0.00 0.00 173.10 177.76 2k8p s PRO 106 N -2.67 4.46 0.44 2.90 0.04 -1.26 -5.05 135.00 133.86 2k8p s PRO 106 Ca 0.17 2.06 0.03 0.00 0.04 0.00 0.00 61.00 63.29 2k8p s PRO 106 Cb -0.03 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.36 2k8p s PRO 106 CO 0.06 -0.05 0.08 -0.51 0.04 0.00 0.00 177.00 176.63 2k8p s ASP 107 N -0.56 3.23 0.48 6.66 1.11 -1.26 -4.98 116.67 121.36 2k8p s ASP 107 Ca 0.48 -1.65 0.04 0.00 0.18 0.00 0.00 52.55 51.59 2k8p s ASP 107 Cb -0.37 0.47 0.04 0.00 1.07 0.00 0.00 42.92 44.13 2k8p s ASP 107 CO 0.48 -0.89 0.31 0.33 1.18 0.00 0.00 175.17 176.57 2k8p n PHE 108 N -1.02 -0.40 -2.32 4.23 7.35 -1.26 -4.70 117.46 119.34 2k8p n PHE 108 Ca -0.10 -2.10 -0.07 0.00 -0.76 0.00 0.00 57.45 54.42 2k8p n PHE 108 Cb 0.66 -0.38 0.04 0.00 0.35 0.00 0.00 39.48 40.14 2k8p n PHE 108 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2k8p n ARG 109 N -1.56 0.36 -3.82 -4.13 3.00 -1.26 -4.82 116.66 104.43 2k8p n ARG 109 Ca -0.05 -0.85 -0.35 0.00 -0.00 0.00 0.00 57.85 56.60 2k8p n ARG 109 Cb 0.56 -0.22 -0.08 0.00 0.00 0.00 0.00 32.46 32.72 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 0.28 4.59 1.11 0.00 -4.36 0.86 -4.91 121.20 118.76 2k8p s ILE 111 Ca 0.07 1.08 -0.16 0.00 -0.26 0.00 0.00 60.65 61.38 2k8p s ILE 111 Cb -0.11 -3.70 0.24 0.00 1.25 0.00 0.00 42.46 40.14 2k8p s ILE 111 CO -0.01 -0.58 1.10 -2.16 0.24 0.00 0.00 174.94 173.53 2k8p s PRO 112 N -3.86 -0.50 0.02 0.37 0.04 -1.26 -1.33 135.00 128.48 2k8p s PRO 112 Ca 0.57 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.80 2k8p s PRO 112 Cb -0.10 -1.66 -0.00 0.00 0.04 0.00 0.00 34.50 32.78 2k8p s PRO 112 CO 0.29 -3.28 0.02 -3.47 0.04 0.00 0.00 177.00 170.60 2k8p n ASP 113 N -4.50 -0.06 -4.56 6.66 -0.08 -1.21 -4.27 116.55 108.53 2k8p n ASP 113 Ca 0.09 -1.11 -0.42 0.00 -1.51 0.00 0.00 54.79 51.84 2k8p n ASP 113 Cb 0.58 0.13 0.00 0.00 2.34 0.00 0.00 41.12 44.17 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 -0.03 1.11 -3.43 -0.67 0.63 -1.26 -4.62 116.66 108.38 2k8p n ARG 114 Ca 0.00 0.40 -0.22 0.00 -0.92 0.00 0.00 57.85 57.11 2k8p n ARG 114 Cb 0.03 -1.83 0.01 0.00 0.45 0.00 0.00 32.46 31.13 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 -1.26 2.00 -0.16 -0.14 1.51 -1.26 -1.00 117.35 117.03 2k8p s TYR 115 Ca 0.62 -0.66 -0.04 0.00 -1.01 0.00 0.00 57.07 55.98 2k8p s TYR 115 Cb -0.62 -2.13 0.08 0.00 -0.11 0.00 0.00 41.96 39.18 2k8p s TYR 115 CO 0.58 -0.58 0.21 0.50 -1.11 0.00 0.00 175.55 175.15 2k8p s ARG 116 N -4.37 0.14 -0.52 -0.62 3.52 0.52 -4.53 118.95 113.09 2k8p s ARG 116 Ca 0.49 0.38 -0.21 0.00 -0.13 0.00 0.00 55.73 56.26 2k8p s ARG 116 Cb -0.04 -0.79 0.05 0.00 -1.56 0.00 0.00 34.95 32.60 2k8p s ARG 116 CO 0.30 -0.50 0.74 0.00 -0.81 0.00 0.00 175.30 175.02 2k8p s ALA 117 N 2.33 3.30 0.04 6.12 0.00 -1.26 -2.23 121.76 130.06 2k8p s ALA 117 Ca 0.05 -1.57 -0.02 0.00 0.00 0.00 0.00 51.96 50.41 2k8p s ALA 117 Cb -0.14 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 2k8p s ALA 117 CO -0.10 -2.15 0.23 -1.14 0.00 0.00 0.00 175.76 172.60 2k8p s GLN 118 N 3.11 3.48 -0.24 0.00 0.74 -0.49 -4.84 119.66 121.41 2k8p s GLN 118 Ca 0.20 -0.31 -0.08 0.00 0.05 0.00 0.00 55.36 55.23 2k8p s GLN 118 Cb -0.17 -3.05 -0.03 0.00 1.10 0.00 0.00 33.01 30.86 2k8p s GLN 118 CO 0.14 0.62 0.09 1.03 -0.55 0.00 0.00 175.29 176.62 2k8p s ARG 119 N -2.21 3.74 0.23 1.67 0.52 -1.26 -0.09 118.95 121.55 2k8p s ARG 119 Ca 0.32 -0.44 -0.07 0.00 -0.52 0.00 0.00 55.73 55.02 2k8p s ARG 119 Cb -0.13 -3.35 -0.06 0.00 0.52 0.00 0.00 34.95 31.93 2k8p s ARG 119 CO 0.23 -0.12 0.51 0.54 0.02 0.00 0.00 175.30 176.48 2k8p s VAL 120 N 1.45 5.02 -0.33 3.52 0.11 0.70 -4.89 120.40 125.98 2k8p s VAL 120 Ca 0.06 0.23 -0.08 0.00 -2.93 0.00 0.00 61.98 59.26 2k8p s VAL 120 Cb -0.15 -3.66 0.02 0.00 -1.53 0.00 0.00 36.38 31.07 2k8p s VAL 120 CO 0.04 -0.13 0.12 -1.58 -3.33 0.00 0.00 175.10 170.23 2k8p s GLN 121 N -3.02 2.88 -0.08 1.54 0.74 -1.26 -1.30 119.66 119.16 2k8p s GLN 121 Ca 0.45 -1.01 -0.08 0.00 0.05 0.00 0.00 55.36 54.76 2k8p s GLN 121 Cb -0.11 -3.49 -0.04 0.00 1.10 0.00 0.00 33.01 30.46 2k8p s GLN 121 CO 0.25 -0.58 0.21 -0.51 -0.55 0.00 0.00 175.29 174.11 2k8p s LEU 122 N 1.48 4.41 0.10 3.68 1.43 0.89 -1.93 118.68 128.73 2k8p s LEU 122 Ca 0.01 0.58 0.08 0.00 -1.03 0.00 0.00 54.13 53.77 2k8p s LEU 122 Cb -0.18 -2.25 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 2k8p s LEU 122 CO 0.04 0.37 -0.14 -0.76 0.23 0.00 0.00 176.35 176.09 2k8p s LEU 123 N -1.13 2.87 -0.36 1.79 2.01 0.12 -0.29 118.68 123.70 2k8p s LEU 123 Ca 0.18 -0.44 -0.01 0.00 0.01 0.00 0.00 54.13 53.87 2k8p s LEU 123 Cb -0.13 -1.69 0.09 0.00 0.01 0.00 0.00 46.19 44.47 2k8p s LEU 123 CO 0.07 0.19 0.10 0.00 1.01 0.00 0.00 176.35 177.72 2k8p n PRO 125 N 4.52 0.08 0.08 0.00 -0.04 -1.26 -2.79 135.00 135.59 2k8p n PRO 125 Ca -0.05 0.21 -0.06 0.00 -0.04 0.00 0.00 63.50 63.57 2k8p n PRO 125 Cb 0.42 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.45 2k8p n PRO 125 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2k8p h GLY 126 N 2.45 0.25 0.00 0.55 0.00 -1.92 -3.47 103.07 100.93 2k8p h GLY 126 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2k8p h GLY 126 CO 0.00 0.31 0.00 0.61 0.00 0.00 0.00 176.54 177.46 2k8p n GLY 127 N 0.48 0.74 3.82 4.60 0.00 -1.12 -5.14 105.19 108.57 2k8p n GLY 127 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 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 2.69 0.81 1.61 0.41 -1.26 -5.03 118.70 117.93 2k8p s GLU 128 Ca 0.00 0.82 -0.11 0.00 -0.41 0.00 0.00 54.97 55.27 2k8p s GLU 128 Cb 0.00 -1.97 0.08 0.00 -1.78 0.00 0.00 34.13 30.45 2k8p s GLU 128 CO 0.00 -1.24 1.10 0.00 -0.49 0.00 0.00 175.26 174.63 2k8p s ALA 129 N -3.10 2.06 0.54 5.21 0.00 -1.26 -4.32 121.76 120.89 2k8p s ALA 129 Ca 0.59 0.26 -0.20 0.00 0.00 0.00 0.00 51.96 52.61 2k8p s ALA 129 Cb -0.14 -3.28 -0.06 0.00 0.00 0.00 0.00 23.12 19.64 2k8p s ALA 129 CO 0.55 -1.96 1.13 -1.25 0.00 0.00 0.00 175.76 174.22 2k8p s PRO 130 N -4.88 3.39 0.46 0.00 0.04 -1.26 -4.51 135.00 128.24 2k8p s PRO 130 Ca 0.62 1.62 0.03 0.00 0.04 0.00 0.00 61.00 63.31 2k8p s PRO 130 Cb -0.18 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.30 2k8p s PRO 130 CO 0.56 -0.82 0.03 1.03 0.04 0.00 0.00 177.00 177.85 2k8p s ARG 131 N -3.24 2.08 0.03 4.56 0.52 0.60 -4.98 118.95 118.52 2k8p s ARG 131 Ca 0.72 -2.29 0.02 0.00 -0.52 0.00 0.00 55.73 53.66 2k8p s ARG 131 Cb -0.24 -1.33 -0.02 0.00 0.52 0.00 0.00 34.95 33.88 2k8p s ARG 131 CO 0.27 -0.33 -0.06 0.00 0.02 0.00 0.00 175.30 175.21 2k8p s ALA 132 N -2.94 0.42 -0.03 2.13 0.00 -1.26 -0.08 121.76 120.00 2k8p s ALA 132 Ca 0.15 -0.61 -0.01 0.00 0.00 0.00 0.00 51.96 51.50 2k8p s ALA 132 Cb 0.03 0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.23 2k8p s ALA 132 CO 0.08 -0.03 0.05 0.50 0.00 0.00 0.00 175.76 176.36 2k8p s ARG 133 N -1.26 -0.06 0.31 0.00 3.00 -0.42 -4.95 118.95 115.58 2k8p s ARG 133 Ca -0.09 0.29 -0.22 0.00 -1.00 0.00 0.00 55.73 54.71 2k8p s ARG 133 Cb -0.08 -0.38 -0.09 0.00 0.00 0.00 0.00 34.95 34.39 2k8p s ARG 133 CO -0.00 -0.25 0.85 0.21 0.00 0.00 0.00 175.30 176.11 2k8p s LYS 134 N 1.64 4.34 -0.04 5.12 2.20 -1.26 -0.21 119.74 131.53 2k8p s LYS 134 Ca -0.02 1.07 -0.00 0.00 -0.36 0.00 0.00 55.97 56.66 2k8p s LYS 134 Cb -0.12 -2.65 0.03 0.00 -1.51 0.00 0.00 37.83 33.57 2k8p s LYS 134 CO -0.03 0.24 -0.00 0.14 -0.36 0.00 0.00 175.35 175.33 2k8p s VAL 135 N -1.75 0.26 -0.54 4.02 -7.23 0.87 -4.94 120.40 111.10 2k8p s VAL 135 Ca 0.51 0.09 -0.21 0.00 -1.81 0.00 0.00 61.98 60.56 2k8p s VAL 135 Cb -0.15 -0.38 0.06 0.00 0.56 0.00 0.00 36.38 36.47 2k8p s VAL 135 CO 0.20 0.19 0.74 -0.60 -0.31 0.00 0.00 175.10 175.32 2k8p s ARG 136 N 1.33 3.17 0.04 4.82 3.52 -1.26 -1.40 118.95 129.17 2k8p s ARG 136 Ca -0.05 -0.75 0.08 0.00 -0.13 0.00 0.00 55.73 54.88 2k8p s ARG 136 Cb -0.13 -4.11 -0.03 0.00 -1.56 0.00 0.00 34.95 29.12 2k8p s ARG 136 CO -0.02 -1.36 -0.24 -0.48 -0.81 0.00 0.00 175.30 172.38 2k8p s LEU 137 N 3.10 2.16 0.33 -0.88 2.34 -0.95 -4.97 118.68 119.81 2k8p s LEU 137 Ca 0.19 -0.55 -0.27 0.00 0.06 0.00 0.00 54.13 53.56 2k8p s LEU 137 Cb -0.18 -1.15 -0.13 0.00 -0.56 0.00 0.00 46.19 44.18 2k8p s LEU 137 CO 0.13 0.22 1.13 0.52 -1.06 0.00 0.00 176.35 177.29 2k8p n VAL 138 N 1.86 2.08 -0.08 1.48 0.31 -1.26 -0.35 118.33 122.37 2k8p n VAL 138 Ca -0.17 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.56 2k8p n VAL 138 Cb 0.52 -1.27 -0.10 0.00 -0.91 0.00 0.00 33.84 32.08 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 0.14 1.62 -2.49 3.52 0.00 -0.18 -3.93 120.51 119.20 2k8p n ALA 139 Ca 0.07 -0.90 -0.16 0.00 0.00 0.00 0.00 53.44 52.45 2k8p n ALA 139 Cb 0.35 -0.01 -0.07 0.00 0.00 0.00 0.00 19.45 19.72 2k8p n ALA 139 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2k8p s SER 140 N -5.23 1.14 -0.23 0.00 0.01 -0.42 -4.99 113.70 103.97 2k8p s SER 140 Ca -0.15 -1.59 -0.22 0.00 1.31 0.00 0.00 55.95 55.31 2k8p s SER 140 Cb 0.05 0.56 0.06 0.00 0.21 0.00 0.00 66.02 66.90 2k8p s SER 140 CO 0.53 -1.10 0.62 0.00 0.41 0.00 0.00 173.24 173.70 2k8p s LYS 142 N 0.32 1.43 -0.24 0.00 1.02 -0.44 -4.93 119.74 116.91 2k8p s LYS 142 Ca -0.00 -1.45 -0.01 0.00 0.02 0.00 0.00 55.97 54.53 2k8p s LYS 142 Cb -0.04 -1.75 0.03 0.00 -0.52 0.00 0.00 37.83 35.55 2k8p s LYS 142 CO 0.01 0.38 -0.09 0.00 -0.92 0.00 0.00 175.35 174.73 2k8p s LYS 144 N 1.31 1.24 -0.30 0.00 2.20 -1.24 -4.92 119.74 118.03 2k8p s LYS 144 Ca 0.01 -1.14 0.02 0.00 -0.36 0.00 0.00 55.97 54.50 2k8p s LYS 144 Cb -0.16 -1.50 0.08 0.00 -1.51 0.00 0.00 37.83 34.74 2k8p s LYS 144 CO -0.06 0.36 0.00 0.50 -0.36 0.00 0.00 175.35 175.79 2k8p s ARG 145 N -1.75 1.56 -0.25 4.03 3.52 -1.26 -4.13 118.95 120.67 2k8p s ARG 145 Ca 0.08 -1.48 0.01 0.00 -0.13 0.00 0.00 55.73 54.20 2k8p s ARG 145 Cb -0.10 -2.85 0.07 0.00 -1.56 0.00 0.00 34.95 30.51 2k8p s ARG 145 CO 0.04 -0.80 -0.03 -1.17 -0.81 0.00 0.00 175.30 172.53 2k8p s LEU 146 N 1.14 2.65 0.24 -0.88 0.20 -1.26 -4.91 118.68 115.86 2k8p s LEU 146 Ca 0.03 -1.27 0.01 0.00 0.69 0.00 0.00 54.13 53.59 2k8p s LEU 146 Cb -0.19 -1.17 -0.04 0.00 -0.43 0.00 0.00 46.19 44.36 2k8p s LEU 146 CO -0.09 -0.26 0.13 0.42 -0.29 0.00 0.00 176.35 176.25 2k8p s THR 147 N 1.39 0.26 0.44 3.68 -4.23 -1.26 -4.81 115.64 111.11 2k8p s THR 147 Ca -0.03 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.54 2k8p s THR 147 Cb -0.19 -2.55 -0.04 0.00 1.34 0.00 0.00 72.50 71.05 2k8p s THR 147 CO -0.08 0.00 0.15 -0.13 -0.54 0.00 0.00 174.62 174.02 2k8p s ARG 148 N -4.04 2.18 0.47 3.99 1.81 -1.26 -5.16 118.95 116.94 2k8p s ARG 148 Ca 0.38 -1.98 0.03 0.00 -1.72 0.00 0.00 55.73 52.44 2k8p s ARG 148 Cb 0.07 -1.88 -0.03 0.00 -0.45 0.00 0.00 34.95 32.66 2k8p s ARG 148 CO 0.14 -0.18 0.02 0.12 -0.68 0.00 0.00 175.30 174.72 2k8p s PHE 149 N -2.67 1.98 0.50 -0.53 5.36 -1.26 -5.11 117.98 116.25 2k8p s PHE 149 Ca 0.35 -0.95 0.02 0.00 -0.96 0.00 0.00 56.93 55.39 2k8p s PHE 149 Cb 0.04 -1.56 -0.02 0.00 -0.34 0.00 0.00 43.02 41.14 2k8p s PHE 149 CO 0.19 0.19 0.04 -3.38 -1.46 0.00 0.00 175.22 170.80 2k8p s HIS 150 N -2.91 1.93 0.31 10.12 -3.43 -1.26 -4.77 115.29 115.28 2k8p s HIS 150 Ca 0.15 -0.91 0.06 0.00 -0.80 0.00 0.00 55.06 53.56 2k8p s HIS 150 Cb 0.04 -1.66 -0.02 0.00 -1.43 0.00 0.00 32.58 29.50 2k8p s HIS 150 CO 0.08 0.19 0.21 0.09 -2.00 0.00 0.00 174.74 173.31 2k8p n ASN 151 N -1.27 -0.05 -1.70 7.38 4.13 -1.26 -5.01 115.26 117.48 2k8p n ASN 151 Ca -0.16 -2.90 -0.00 0.00 1.68 0.00 0.00 54.58 53.20 2k8p n ASN 151 Cb 0.67 1.28 0.01 0.00 -1.54 0.00 0.00 39.78 40.19 2k8p n ASN 151 CO 0.00 0.00 0.00 1.67 0.28 0.00 0.00 177.26 179.21 2k8p n GLN 152 N -0.63 0.14 -2.13 3.52 7.27 -1.26 -5.02 117.38 119.27 2k8p n GLN 152 Ca 0.03 -0.35 -0.32 0.00 0.07 0.00 0.00 57.00 56.43 2k8p n GLN 152 Cb 0.53 0.50 -0.01 0.00 2.41 0.00 0.00 30.24 33.66 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 -1.73 6.41 -0.21 1.69 0.15 -1.26 -5.07 113.70 113.68 2k8p s SER 153 Ca 0.07 1.50 -0.04 0.00 0.70 0.00 0.00 55.95 58.18 2k8p s SER 153 Cb -0.01 -2.49 0.10 0.00 -1.71 0.00 0.00 66.02 61.91 2k8p s SER 153 CO 0.01 -0.74 0.26 -1.83 1.20 0.00 0.00 173.24 172.14 2k8p s GLU 154 N -4.62 0.22 -1.08 5.44 -1.05 -1.26 -5.08 118.70 111.27 2k8p s GLU 154 Ca 0.57 0.31 -0.08 0.00 -0.15 0.00 0.00 54.97 55.62 2k8p s GLU 154 Cb -0.11 -0.98 0.27 0.00 -0.44 0.00 0.00 34.13 32.88 2k8p s GLU 154 CO 0.43 -0.63 1.07 1.28 0.95 0.00 0.00 175.26 178.36 2k8p n LEU 155 N 5.33 5.33 0.00 1.83 4.32 -1.26 -5.02 117.00 127.53 2k8p n LEU 155 Ca -0.05 -5.06 -0.00 0.00 -0.02 0.00 0.00 56.01 50.88 2k8p n LEU 155 Cb 0.50 -1.41 0.00 0.00 -1.62 0.00 0.00 43.42 40.89 2k8p n LEU 155 CO 0.07 1.40 0.00 1.17 -1.22 0.00 0.00 177.39 178.81 2k8p n LYS 156 N 2.57 1.05 -3.87 3.23 4.81 -1.26 -5.15 118.16 119.55 2k8p n LYS 156 Ca 0.24 -0.01 -0.11 0.00 -0.87 0.00 0.00 58.31 57.56 2k8p n LYS 156 Cb 0.39 -0.00 -0.09 0.00 0.02 0.00 0.00 35.03 35.34 2k8p n LYS 156 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 2k8p s ASP 157 N -1.01 0.03 0.00 3.14 1.47 -1.26 -5.17 116.67 113.87 2k8p s ASP 157 Ca 0.00 -0.25 0.00 0.00 1.18 0.00 0.00 52.55 53.48 2k8p s ASP 157 Cb -0.00 0.23 0.00 0.00 -0.34 0.00 0.00 42.92 42.81 2k8p s ASP 157 CO 0.00 -0.42 0.00 0.49 0.68 0.00 0.00 175.17 175.92 2k8p n PHE 158 N 1.22 0.00 0.00 2.11 3.72 -1.26 -5.17 117.46 118.08 2k8p n PHE 158 Ca -0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.18 2k8p n PHE 158 Cb 0.56 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.10 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 0.73 -1.12 2.80 1.37 0.00 -1.26 -5.09 105.19 102.62 2k8p n GLY 159 Ca 0.00 -1.49 -0.17 0.00 0.00 0.00 0.00 46.02 44.35 2k8p n GLY 159 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k8p s THR 160 N 0.00 0.15 0.17 2.61 -4.23 -1.26 -4.84 115.64 108.24 2k8p s THR 160 Ca 0.00 0.12 0.01 0.00 -1.18 0.00 0.00 61.69 60.64 2k8p s THR 160 Cb 0.00 -0.26 0.01 0.00 1.34 0.00 0.00 72.50 73.59 2k8p s THR 160 CO 0.00 0.15 0.09 -0.62 -0.54 0.00 0.00 174.62 173.70 2k8p n GLU 161 N 4.27 1.33 -4.37 3.99 1.02 0.22 -4.92 120.64 122.20 2k8p n GLU 161 Ca -0.24 -1.10 -0.23 0.00 -0.02 0.00 0.00 57.16 55.56 2k8p n GLU 161 Cb 0.50 0.17 -0.08 0.00 -0.02 0.00 0.00 31.44 32.01 2k8p n GLU 161 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k8p s ALA 162 N -2.25 3.00 0.02 0.62 0.00 -1.26 -3.98 121.76 117.90 2k8p s ALA 162 Ca 0.07 -1.75 -0.00 0.00 0.00 0.00 0.00 51.96 50.28 2k8p s ALA 162 Cb -0.01 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.56 2k8p s ALA 162 CO 0.05 0.27 0.03 0.00 0.00 0.00 0.00 175.76 176.10 2k8p n ALA 163 N -0.79 -0.02 -2.88 0.00 0.00 -1.26 -5.01 120.51 110.56 2k8p n ALA 163 Ca -0.06 -0.10 -0.21 0.00 0.00 0.00 0.00 53.44 53.07 2k8p n ALA 163 Cb 0.59 0.08 -0.03 0.00 0.00 0.00 0.00 19.45 20.10 2k8p n ALA 163 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k8p s ARG 164 N -2.05 3.25 0.19 0.00 3.00 -1.26 -5.12 118.95 116.96 2k8p s ARG 164 Ca 0.02 -0.88 -0.03 0.00 0.00 0.00 0.00 55.73 54.84 2k8p s ARG 164 Cb -0.00 -2.78 0.05 0.00 0.00 0.00 0.00 34.95 32.22 2k8p s ARG 164 CO 0.01 0.38 0.17 -0.35 0.00 0.00 0.00 175.30 175.51 2k8p n PRO 165 N -1.36 -1.35 -3.86 3.54 -0.04 -1.26 -5.11 135.00 125.56 2k8p n PRO 165 Ca -0.08 -0.27 -0.09 0.00 -0.04 0.00 0.00 63.50 63.03 2k8p n PRO 165 Cb 0.57 -0.25 -0.04 0.00 -0.04 0.00 0.00 33.50 33.74 2k8p n PRO 165 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2k8p s GLN 166 N -3.38 1.55 0.00 0.54 0.74 -1.26 -5.19 119.66 112.66 2k8p s GLN 166 Ca 0.11 -1.03 -0.30 0.00 0.05 0.00 0.00 55.36 54.19 2k8p s GLN 166 Cb -0.01 0.53 0.11 0.00 1.10 0.00 0.00 33.01 34.74 2k8p s GLN 166 CO 0.08 -0.67 1.16 0.21 -0.55 0.00 0.00 175.29 175.52 2k8p s LYS 167 N -3.94 0.62 0.00 1.67 2.20 -1.26 -5.19 119.74 113.84 2k8p s LYS 167 Ca 0.14 -0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.43 2k8p s LYS 167 Cb -0.02 0.22 0.00 0.00 -1.51 0.00 0.00 37.83 36.52 2k8p s LYS 167 CO 0.04 -0.28 0.00 0.41 -0.36 0.00 0.00 175.35 175.16 2k8p n GLY 168 N -0.40 1.52 3.57 5.54 0.00 -1.26 -5.18 105.19 108.97 2k8p n GLY 168 Ca -0.07 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.06 2k8p n GLY 168 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8p s ARG 169 N -2.00 1.90 0.32 1.61 0.52 -1.26 -5.16 118.95 114.88 2k8p s ARG 169 Ca 0.00 -2.11 0.02 0.00 -0.52 0.00 0.00 55.73 53.12 2k8p s ARG 169 Cb 0.00 -1.20 -0.03 0.00 0.52 0.00 0.00 34.95 34.24 2k8p s ARG 169 CO 0.00 -0.22 0.50 0.15 0.02 0.00 0.00 175.30 175.75 2k8p s LYS 170 N -3.80 3.41 0.56 3.54 3.01 -1.26 -5.08 119.74 120.11 2k8p s LYS 170 Ca 0.28 -0.52 -0.19 0.00 -1.01 0.00 0.00 55.97 54.54 2k8p s LYS 170 Cb 0.07 -2.73 -0.05 0.00 -1.01 0.00 0.00 37.83 34.11 2k8p s LYS 170 CO 0.14 0.19 1.13 -1.25 0.51 0.00 0.00 175.35 176.06 2k8p s PRO 171 N -4.23 3.28 -0.56 -1.68 0.04 -1.26 -5.01 135.00 125.58 2k8p s PRO 171 Ca 0.39 1.58 0.07 0.00 0.04 0.00 0.00 61.00 63.08 2k8p s PRO 171 Cb -0.09 -2.00 0.25 0.00 0.04 0.00 0.00 34.50 32.70 2k8p s PRO 171 CO 0.34 -0.90 0.67 -2.13 0.04 0.00 0.00 177.00 175.01 2k8p n ARG 172 N -1.46 1.91 -1.14 4.56 0.63 -1.26 -5.11 116.66 114.79 2k8p n ARG 172 Ca 0.11 -4.19 -0.29 0.00 -0.92 0.00 0.00 57.85 52.57 2k8p n ARG 172 Cb 0.51 -1.91 0.19 0.00 0.45 0.00 0.00 32.46 31.70 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2k8p s PRO 173 N -2.02 -0.02 0.32 -0.14 0.04 -1.26 -5.09 135.00 126.83 2k8p s PRO 173 Ca 0.38 0.37 0.04 0.00 0.04 0.00 0.00 61.00 61.83 2k8p s PRO 173 Cb 0.15 -1.70 -0.03 0.00 0.04 0.00 0.00 34.50 32.96 2k8p s PRO 173 CO -0.05 -3.00 0.20 -0.98 0.04 0.00 0.00 177.00 173.21 2k8p s ARG 174 N -5.05 1.66 -0.10 4.56 1.70 -1.26 -5.18 118.95 115.28 2k8p s ARG 174 Ca 0.67 -1.96 -0.33 0.00 -0.47 0.00 0.00 55.73 53.64 2k8p s ARG 174 Cb -0.17 0.05 0.14 0.00 -0.57 0.00 0.00 34.95 34.40 2k8p s ARG 174 CO 0.57 -0.53 1.37 0.00 -1.08 0.00 0.00 175.30 175.64 2k8p s ALA 175 N -3.56 -2.36 0.32 7.88 0.00 -1.26 -5.19 121.76 117.59 2k8p s ALA 175 Ca 0.36 1.04 -0.15 0.00 0.00 0.00 0.00 51.96 53.22 2k8p s ALA 175 Cb 0.04 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.35 2k8p s ALA 175 CO 0.21 -0.96 0.66 1.03 0.00 0.00 0.00 175.76 176.69 2k8p s ARG 176 N -2.18 1.91 0.04 0.00 0.52 -1.26 -5.17 118.95 112.81 2k8p s ARG 176 Ca 0.14 -1.31 0.04 0.00 -0.52 0.00 0.00 55.73 54.08 2k8p s ARG 176 Cb 0.05 0.56 -0.04 0.00 0.52 0.00 0.00 34.95 36.05 2k8p s ARG 176 CO -0.05 -0.86 -0.05 -1.12 0.02 0.00 0.00 175.30 173.25 2k8p s SER 177 N -3.04 4.76 -0.71 0.23 0.01 -1.26 -5.08 113.70 108.62 2k8p s SER 177 Ca 0.18 -0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.28 2k8p s SER 177 Cb -0.04 -1.11 0.18 0.00 0.21 0.00 0.00 66.02 65.26 2k8p s SER 177 CO 0.11 0.24 0.53 0.00 0.41 0.00 0.00 173.24 174.53 2k8p s ALA 178 N -1.11 3.80 -0.15 1.44 0.00 -1.26 -5.04 121.76 119.43 2k8p s ALA 178 Ca 0.20 -3.59 0.00 0.00 0.00 0.00 0.00 51.96 48.57 2k8p s ALA 178 Cb -0.11 -2.50 0.02 0.00 0.00 0.00 0.00 23.12 20.53 2k8p s ALA 178 CO 0.11 -2.11 -0.14 0.15 0.00 0.00 0.00 175.76 173.77 2k8p s LYS 179 N -0.85 2.33 0.01 0.00 3.01 -1.26 -5.12 119.74 117.86 2k8p s LYS 179 Ca 0.22 -0.58 -0.02 0.00 -1.01 0.00 0.00 55.97 54.58 2k8p s LYS 179 Cb -0.13 -2.14 -0.01 0.00 -1.01 0.00 0.00 37.83 34.54 2k8p s LYS 179 CO -0.09 -0.24 0.03 0.00 0.51 0.00 0.00 175.35 175.56 2k8p s ALA 180 N 1.47 -0.04 0.05 5.17 0.00 -1.26 -5.17 121.76 121.99 2k8p s ALA 180 Ca 0.05 -0.34 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 2k8p s ALA 180 Cb -0.13 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.11 2k8p s ALA 180 CO -0.11 -0.15 0.34 -0.80 0.00 0.00 0.00 175.76 175.04 2k8p s ASN 181 N -1.18 -0.17 0.00 0.00 -0.87 -1.26 -5.04 114.94 106.42 2k8p s ASN 181 Ca -0.13 -0.15 0.00 0.00 -1.57 0.00 0.00 52.86 51.01 2k8p s ASN 181 Cb -0.08 0.38 0.00 0.00 -0.02 0.00 0.00 41.25 41.53 2k8p s ASN 181 CO -0.00 -0.64 0.00 1.67 -2.57 0.00 0.00 177.10 175.56 2k8p n GLN 182 N 0.52 0.00 -1.30 -0.60 7.27 -1.26 -5.17 117.38 116.84 2k8p n GLN 182 Ca -0.18 0.00 0.17 0.00 0.07 0.00 0.00 57.00 57.05 2k8p n GLN 182 Cb 0.60 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 33.18 2k8p n GLN 182 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2k8p n ALA 183 N -1.06 -3.40 0.00 1.69 0.00 -1.26 -5.02 120.51 111.45 2k8p n ALA 183 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 53.44 54.09 2k8p n ALA 183 Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.14 2k8p n ALA 183 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2k8p n GLU 184 N -4.13 0.00 -0.97 0.00 0.28 -1.26 -5.00 120.64 109.56 2k8p n GLU 184 Ca -0.04 0.00 -0.23 0.00 -0.16 0.00 0.00 57.16 56.73 2k8p n GLU 184 Cb 0.61 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.41 2k8p n GLU 184 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2k8p n LEU 185 N -0.28 6.02 -5.00 -1.84 -0.00 -1.26 -4.88 117.00 109.77 2k8p n LEU 185 Ca 0.00 -3.32 -0.21 0.00 -0.00 0.00 0.00 56.01 52.48 2k8p n LEU 185 Cb 0.00 -1.28 0.06 0.00 -0.00 0.00 0.00 43.42 42.20 2k8p n LEU 185 CO 0.00 1.39 0.38 -0.70 -0.00 0.00 0.00 177.39 178.46 2k8p s GLU 186 N 2.18 2.31 -0.06 1.96 2.12 -1.26 -5.06 118.70 120.90 2k8p s GLU 186 Ca 0.56 -1.10 -0.15 0.00 0.36 0.00 0.00 54.97 54.64 2k8p s GLU 186 Cb 0.19 -2.52 -0.10 0.00 0.26 0.00 0.00 34.13 31.97 2k8p s GLU 186 CO -0.03 -0.87 0.60 -0.91 -0.54 0.00 0.00 175.26 173.51 2k8p h ASN 187 N 0.02 -0.27 -3.17 -1.70 2.35 -2.07 -3.49 115.58 107.25 2k8p h ASN 187 Ca -0.38 -0.14 0.38 0.00 -0.55 0.00 0.00 56.30 55.61 2k8p h ASN 187 Cb 1.28 0.07 -0.09 0.00 0.05 0.00 0.00 38.32 39.63 2k8p h ASN 187 CO 0.46 0.23 -0.50 0.00 -1.65 0.00 0.00 177.43 175.97 2k8p n ALA 188 N -2.69 -3.60 0.34 -0.83 0.00 -1.26 -5.28 120.51 107.20 2k8p n ALA 188 Ca -0.06 0.44 0.03 0.00 0.00 0.00 0.00 53.44 53.84 2k8p n ALA 188 Cb 0.20 -1.24 0.16 0.00 0.00 0.00 0.00 19.45 18.57 2k8p n ALA 188 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16