#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8p s TRP 2 N 0.00 0.86 0.00 1.61 0.52 -1.26 -5.13 118.94 115.54 2k8p s TRP 2 Ca 0.00 -1.16 0.00 0.00 0.02 0.00 0.00 56.10 54.96 2k8p s TRP 2 Cb 0.00 0.03 0.00 0.00 -1.15 0.00 0.00 33.47 32.35 2k8p s TRP 2 CO 0.00 -1.13 0.00 1.04 0.02 0.00 0.00 176.95 176.88 2k8p n GLN 3 N -0.52 0.00 -1.13 4.98 1.13 -1.26 -4.86 117.38 115.72 2k8p n GLN 3 Ca -0.00 0.00 -0.03 0.00 -1.94 0.00 0.00 57.00 55.03 2k8p n GLN 3 Cb 0.62 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.96 2k8p n GLN 3 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k8p n ALA 4 N 0.05 1.07 -1.26 -1.58 0.00 -1.26 -5.15 120.51 112.38 2k8p n ALA 4 Ca 0.00 -0.41 0.15 0.00 0.00 0.00 0.00 53.44 53.19 2k8p n ALA 4 Cb 0.00 -0.40 -0.08 0.00 0.00 0.00 0.00 19.45 18.97 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 -0.22 -3.38 -3.74 0.00 3.72 -1.26 -5.09 117.46 107.49 2k8p n PHE 5 Ca -0.13 1.86 0.00 0.00 -0.05 0.00 0.00 57.45 59.13 2k8p n PHE 5 Cb 0.54 -3.07 0.00 0.00 -0.94 0.00 0.00 39.48 36.01 2k8p n PHE 5 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 2k8p n LYS 6 N -4.05 0.10 -1.30 -1.08 4.81 -1.26 -5.17 118.16 110.21 2k8p n LYS 6 Ca -0.08 -0.28 0.16 0.00 -0.87 0.00 0.00 58.31 57.25 2k8p n LYS 6 Cb 0.60 0.41 -0.07 0.00 0.02 0.00 0.00 35.03 35.99 2k8p n LYS 6 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2k8p n ASN 7 N -0.55 -7.62 -4.51 3.14 3.02 -1.26 -4.98 115.26 102.50 2k8p n ASN 7 Ca 0.00 1.05 -0.25 0.00 -0.03 0.00 0.00 54.58 55.35 2k8p n ASN 7 Cb 0.15 -4.30 -0.10 0.00 -0.61 0.00 0.00 39.78 34.92 2k8p n ASN 7 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2k8p s ASP 8 N -7.01 3.67 -0.37 6.41 1.11 -1.26 -5.12 116.67 114.10 2k8p s ASP 8 Ca 0.00 -1.10 0.02 0.00 0.18 0.00 0.00 52.55 51.65 2k8p s ASP 8 Cb 0.00 -0.33 0.15 0.00 1.07 0.00 0.00 42.92 43.81 2k8p s ASP 8 CO 0.00 -0.07 0.31 0.00 1.18 0.00 0.00 175.17 176.59 2k8p s ALA 9 N -2.55 0.35 -1.41 5.23 0.00 -1.26 -5.05 121.76 117.08 2k8p s ALA 9 Ca 0.31 -1.56 -0.14 0.00 0.00 0.00 0.00 51.96 50.58 2k8p s ALA 9 Cb -0.02 -1.82 0.07 0.00 0.00 0.00 0.00 23.12 21.35 2k8p s ALA 9 CO 0.16 -2.11 2.09 0.25 0.00 0.00 0.00 175.76 176.15 2k8p n THR 10 N 3.91 3.68 1.43 0.00 -2.24 -1.26 -4.64 114.28 115.15 2k8p n THR 10 Ca 0.15 -3.41 0.15 0.00 -2.27 0.00 0.00 64.05 58.66 2k8p n THR 10 Cb 0.42 -2.53 0.72 0.00 -2.10 0.00 0.00 70.33 66.84 2k8p n THR 10 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k8p n GLU 11 N 6.00 0.50 -3.55 -0.78 -0.58 -1.26 -4.57 120.64 116.40 2k8p n GLU 11 Ca 0.49 -0.06 -0.41 0.00 -0.42 0.00 0.00 57.16 56.77 2k8p n GLU 11 Cb 0.39 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.68 2k8p n GLU 11 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2k8p s ILE 12 N -2.54 4.23 -0.63 -3.67 1.09 -1.26 -4.98 121.20 113.44 2k8p s ILE 12 Ca 0.29 -1.88 0.06 0.00 -1.10 0.00 0.00 60.65 58.02 2k8p s ILE 12 Cb 0.20 -3.78 0.22 0.00 -1.06 0.00 0.00 42.46 38.04 2k8p s ILE 12 CO 0.47 -0.79 0.64 -0.38 -0.10 0.00 0.00 174.94 174.77 2k8p n ILE 13 N 4.79 1.80 -1.81 2.92 2.08 -1.26 -5.10 119.36 122.78 2k8p n ILE 13 Ca -0.06 -4.96 -0.33 0.00 0.56 0.00 0.00 62.75 57.95 2k8p n ILE 13 Cb 0.41 -2.10 0.04 0.00 -0.75 0.00 0.00 39.64 37.24 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 -1.99 2.86 -0.29 0.38 0.04 -1.26 -5.05 135.00 129.68 2k8p s PRO 14 Ca 0.35 1.41 -0.01 0.00 0.04 0.00 0.00 61.00 62.78 2k8p s PRO 14 Cb 0.09 -1.96 0.13 0.00 0.04 0.00 0.00 34.50 32.80 2k8p s PRO 14 CO -0.07 -1.21 0.25 -1.21 0.04 0.00 0.00 177.00 174.80 2k8p s GLU 15 N -4.02 0.30 0.55 4.56 2.02 -1.26 -5.14 118.70 115.71 2k8p s GLU 15 Ca 0.67 -0.30 -0.19 0.00 0.02 0.00 0.00 54.97 55.17 2k8p s GLU 15 Cb -0.21 -0.82 -0.07 0.00 0.10 0.00 0.00 34.13 33.13 2k8p s GLU 15 CO 0.40 -1.04 0.82 1.47 0.02 0.00 0.00 175.26 176.94 2k8p n LEU 16 N 5.24 2.49 -3.00 1.80 -0.00 -1.26 -4.98 117.00 117.28 2k8p n LEU 16 Ca -0.03 0.83 -0.17 0.00 -0.00 0.00 0.00 56.01 56.64 2k8p n LEU 16 Cb 0.45 -1.31 -0.02 0.00 -0.00 0.00 0.00 43.42 42.55 2k8p n LEU 16 CO 0.02 -2.20 -0.08 0.61 -0.00 0.00 0.00 177.39 175.74 2k8p n GLY 17 N 1.44 1.73 3.49 1.47 0.00 -1.26 -5.06 105.19 107.00 2k8p n GLY 17 Ca 0.12 -0.86 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.48 3.77 -0.61 1.61 2.02 -1.26 -4.87 118.70 118.87 2k8p s GLU 18 Ca 0.34 -1.88 0.06 0.00 0.02 0.00 0.00 54.97 53.51 2k8p s GLU 18 Cb 0.21 -5.10 0.26 0.00 0.10 0.00 0.00 34.13 29.60 2k8p s GLU 18 CO -0.16 -1.90 0.76 0.98 0.02 0.00 0.00 175.26 174.96 2k8p n TYR 19 N 6.93 3.40 -2.26 1.61 9.36 -1.26 -5.09 117.16 129.86 2k8p n TYR 19 Ca 0.31 -4.10 -0.36 0.00 3.32 0.00 0.00 57.90 57.07 2k8p n TYR 19 Cb 0.47 -0.54 -0.01 0.00 -0.63 0.00 0.00 39.34 38.64 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 -2.51 3.63 -0.53 2.98 0.04 -1.26 -5.01 135.00 132.33 2k8p s PRO 20 Ca 0.41 1.72 0.06 0.00 0.04 0.00 0.00 61.00 63.23 2k8p s PRO 20 Cb 0.17 -2.28 0.22 0.00 0.04 0.00 0.00 34.50 32.65 2k8p s PRO 20 CO -0.03 -0.65 0.57 -1.91 0.04 0.00 0.00 177.00 175.02 2k8p n GLU 21 N -0.75 1.44 -2.10 4.56 2.13 -1.26 -5.08 120.64 119.58 2k8p n GLU 21 Ca 0.09 -3.92 -0.43 0.00 0.66 0.00 0.00 57.16 53.55 2k8p n GLU 21 Cb 0.49 -1.82 -0.03 0.00 0.27 0.00 0.00 31.44 30.35 2k8p n GLU 21 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2k8p s PRO 22 N -1.49 3.59 0.96 5.31 0.04 -1.26 -5.00 135.00 137.16 2k8p s PRO 22 Ca 0.35 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 62.74 2k8p s PRO 22 Cb 0.11 -4.09 0.17 0.00 0.04 0.00 0.00 34.50 30.72 2k8p s PRO 22 CO -0.10 -1.54 1.09 -1.25 0.04 0.00 0.00 177.00 175.24 2k8p s PRO 23 N 5.08 0.75 1.18 0.56 0.04 -1.26 -5.05 135.00 136.29 2k8p s PRO 23 Ca 0.73 0.64 -0.18 0.00 0.04 0.00 0.00 61.00 62.23 2k8p s PRO 23 Cb -0.22 -1.76 0.27 0.00 0.04 0.00 0.00 34.50 32.83 2k8p s PRO 23 CO 0.31 -2.54 1.11 -1.25 0.04 0.00 0.00 177.00 174.67 2k8p s PRO 24 N -4.95 -1.01 -0.35 0.56 0.04 -1.26 -5.07 135.00 122.95 2k8p s PRO 24 Ca 0.65 0.01 -0.05 0.00 0.04 0.00 0.00 61.00 61.64 2k8p s PRO 24 Cb -0.18 -1.61 0.19 0.00 0.04 0.00 0.00 34.50 32.93 2k8p s PRO 24 CO 0.57 -3.59 0.97 -2.00 0.04 0.00 0.00 177.00 173.00 2k8p s GLU 25 N -5.34 0.34 -0.38 4.56 2.12 -1.26 -5.10 118.70 113.63 2k8p s GLU 25 Ca 0.70 -0.18 0.02 0.00 0.36 0.00 0.00 54.97 55.87 2k8p s GLU 25 Cb -0.11 0.02 0.16 0.00 0.26 0.00 0.00 34.13 34.46 2k8p s GLU 25 CO 0.56 -0.46 0.29 -0.51 -0.54 0.00 0.00 175.26 174.60 2k8p s LEU 26 N 1.68 1.10 0.12 2.70 1.43 -1.26 -5.13 118.68 119.33 2k8p s LEU 26 Ca 0.18 -2.59 0.08 0.00 -1.03 0.00 0.00 54.13 50.76 2k8p s LEU 26 Cb 0.04 -0.34 -0.04 0.00 0.03 0.00 0.00 46.19 45.87 2k8p s LEU 26 CO -0.12 -0.24 -0.11 -1.61 0.23 0.00 0.00 176.35 174.50 2k8p s GLU 27 N 0.59 2.06 -0.13 1.70 2.02 -1.26 -5.13 118.70 118.56 2k8p s GLU 27 Ca 0.26 -1.10 0.02 0.00 0.02 0.00 0.00 54.97 54.17 2k8p s GLU 27 Cb -0.09 -2.25 0.00 0.00 0.10 0.00 0.00 34.13 31.89 2k8p s GLU 27 CO -0.10 0.49 -0.20 0.54 0.02 0.00 0.00 175.26 176.01 2k8p s ASN 28 N -2.35 3.29 -0.13 -0.19 2.20 -1.26 -5.12 114.94 111.39 2k8p s ASN 28 Ca 0.22 -0.54 0.01 0.00 -0.94 0.00 0.00 52.86 51.60 2k8p s ASN 28 Cb -0.10 -1.47 -0.01 0.00 -2.00 0.00 0.00 41.25 37.66 2k8p s ASN 28 CO 0.14 0.11 -0.15 0.54 -2.94 0.00 0.00 177.10 174.80 2k8p s ASN 29 N 0.65 3.83 0.47 3.54 4.22 -1.26 -5.12 114.94 121.27 2k8p s ASN 29 Ca -0.10 -0.38 0.05 0.00 -2.14 0.00 0.00 52.86 50.29 2k8p s ASN 29 Cb -0.16 -1.57 -0.03 0.00 1.28 0.00 0.00 41.25 40.77 2k8p s ASN 29 CO 0.02 0.16 0.14 -1.59 -2.04 0.00 0.00 177.10 173.79 2k8p s LYS 30 N 0.38 2.18 -0.02 3.55 -2.85 -1.26 -5.16 119.74 116.56 2k8p s LYS 30 Ca -0.12 -2.11 -0.27 0.00 -1.00 0.00 0.00 55.97 52.46 2k8p s LYS 30 Cb -0.16 -1.80 0.06 0.00 -2.06 0.00 0.00 37.83 33.87 2k8p s LYS 30 CO 0.06 -0.29 0.61 -0.08 0.10 0.00 0.00 175.35 175.75 2k8p s THR 31 N -2.75 0.01 0.11 3.79 -1.32 -1.26 -5.18 115.64 109.04 2k8p s THR 31 Ca 0.27 -0.09 -0.05 0.00 -1.21 0.00 0.00 61.69 60.62 2k8p s THR 31 Cb 0.03 -0.95 -0.02 0.00 -1.51 0.00 0.00 72.50 70.04 2k8p s THR 31 CO 0.15 -0.05 0.11 -0.04 -2.21 0.00 0.00 174.62 172.58 2k8p s MET 32 N -1.53 0.87 -0.24 7.08 -1.94 -1.26 -5.17 119.30 117.11 2k8p s MET 32 Ca -0.10 -1.21 -0.29 0.00 -1.71 0.00 0.00 55.69 52.39 2k8p s MET 32 Cb -0.01 0.29 0.16 0.00 2.01 0.00 0.00 34.83 37.28 2k8p s MET 32 CO 0.06 -0.26 1.20 0.54 -0.01 0.00 0.00 175.02 176.55 2k8p s ASN 33 N -2.95 -0.21 -0.30 3.03 4.22 -1.26 -5.17 114.94 112.30 2k8p s ASN 33 Ca 0.13 0.27 -0.16 0.00 -2.14 0.00 0.00 52.86 50.96 2k8p s ASN 33 Cb 0.06 0.23 0.17 0.00 1.28 0.00 0.00 41.25 42.99 2k8p s ASN 33 CO -0.05 -0.16 1.09 -0.60 -2.04 0.00 0.00 177.10 175.34 2k8p s ARG 34 N -0.81 0.23 -0.28 3.55 3.52 -1.26 -5.18 118.95 118.72 2k8p s ARG 34 Ca 0.04 0.47 -0.26 0.00 -0.13 0.00 0.00 55.73 55.86 2k8p s ARG 34 Cb -0.02 0.18 0.15 0.00 -1.56 0.00 0.00 34.95 33.70 2k8p s ARG 34 CO -0.05 -0.06 1.17 0.00 -0.81 0.00 0.00 175.30 175.55 2k8p s ALA 35 N 1.78 -2.06 0.17 6.12 0.00 -1.26 -5.19 121.76 121.33 2k8p s ALA 35 Ca -0.05 1.79 -0.15 0.00 0.00 0.00 0.00 51.96 53.55 2k8p s ALA 35 Cb -0.04 -1.50 0.02 0.00 0.00 0.00 0.00 23.12 21.61 2k8p s ALA 35 CO -0.15 -0.20 0.45 -1.83 0.00 0.00 0.00 175.76 174.03 2k8p s GLU 36 N 0.02 1.26 0.28 0.00 1.03 -1.26 -5.18 118.70 114.85 2k8p s GLU 36 Ca 0.04 -0.89 -0.20 0.00 0.03 0.00 0.00 54.97 53.95 2k8p s GLU 36 Cb -0.05 0.48 0.05 0.00 -0.80 0.00 0.00 34.13 33.81 2k8p s GLU 36 CO -0.09 -0.51 0.85 0.54 -1.33 0.00 0.00 175.26 174.72 2k8p s ASN 37 N -2.88 -0.10 0.00 0.83 2.20 -1.26 -5.18 114.94 108.56 2k8p s ASN 37 Ca 0.09 -0.78 0.00 0.00 -0.94 0.00 0.00 52.86 51.23 2k8p s ASN 37 Cb 0.01 0.69 0.00 0.00 -2.00 0.00 0.00 41.25 39.95 2k8p s ASN 37 CO -0.04 -1.33 0.00 0.61 -2.94 0.00 0.00 177.10 173.40 2k8p n GLY 38 N -0.53 0.70 0.06 0.45 0.00 -1.26 -5.16 105.19 99.45 2k8p n GLY 38 Ca -0.06 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.40 -1.83 3.32 -0.02 0.00 -1.26 -5.10 105.19 99.90 2k8p n GLY 39 Ca 0.00 -1.07 -0.19 0.00 0.00 0.00 0.00 46.02 44.76 2k8p n GLY 39 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k8p s ARG 40 N -4.07 1.24 0.96 1.61 3.03 -1.26 -5.15 118.95 115.31 2k8p s ARG 40 Ca 0.00 -1.46 -0.12 0.00 2.03 0.00 0.00 55.73 56.18 2k8p s ARG 40 Cb 0.00 -1.12 0.17 0.00 -1.03 0.00 0.00 34.95 32.97 2k8p s ARG 40 CO 0.00 0.20 1.09 -1.25 -1.13 0.00 0.00 175.30 174.22 2k8p s PRO 41 N -3.21 0.73 0.95 3.89 0.04 -1.26 -5.04 135.00 131.10 2k8p s PRO 41 Ca 0.18 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.73 2k8p s PRO 41 Cb -0.03 -1.76 0.16 0.00 0.04 0.00 0.00 34.50 32.91 2k8p s PRO 41 CO 0.06 -2.56 1.09 -1.25 0.04 0.00 0.00 177.00 174.38 2k8p s PRO 42 N -4.95 0.82 -0.27 0.56 0.04 -1.26 -5.03 135.00 124.90 2k8p s PRO 42 Ca 0.65 0.66 -0.06 0.00 0.04 0.00 0.00 61.00 62.29 2k8p s PRO 42 Cb -0.18 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2k8p s PRO 42 CO 0.57 -2.50 0.04 -1.01 0.04 0.00 0.00 177.00 174.15 2k8p s HIS 43 N -2.95 3.10 -0.45 0.56 3.76 -1.26 -5.00 115.29 113.06 2k8p s HIS 43 Ca 0.64 -0.98 0.07 0.00 -0.15 0.00 0.00 55.06 54.64 2k8p s HIS 43 Cb -0.18 -2.21 0.24 0.00 1.11 0.00 0.00 32.58 31.54 2k8p s HIS 43 CO 0.57 -0.57 0.71 0.72 -0.85 0.00 0.00 174.74 175.33 2k8p n HIS 44 N 4.84 -2.02 -1.10 1.40 8.25 -1.26 -5.15 115.22 120.18 2k8p n HIS 44 Ca -0.15 -2.56 -0.30 0.00 -0.26 0.00 0.00 57.72 54.45 2k8p n HIS 44 Cb 0.49 0.71 0.23 0.00 1.12 0.00 0.00 29.99 32.53 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 -0.12 -0.88 0.27 -0.41 0.04 -1.26 -5.07 135.00 127.56 2k8p s PRO 45 Ca 0.33 0.05 0.08 0.00 0.04 0.00 0.00 61.00 61.51 2k8p s PRO 45 Cb 0.19 -1.63 -0.04 0.00 0.04 0.00 0.00 34.50 33.07 2k8p s PRO 45 CO -0.18 -3.51 0.12 -0.06 0.04 0.00 0.00 177.00 173.41 2k8p s PHE 46 N -3.00 2.88 0.04 0.56 0.08 -1.26 -5.13 117.98 112.15 2k8p s PHE 46 Ca 0.70 -0.20 -0.28 0.00 0.12 0.00 0.00 56.93 57.27 2k8p s PHE 46 Cb -0.12 -1.38 0.09 0.00 -0.57 0.00 0.00 43.02 41.05 2k8p s PHE 46 CO 0.56 0.51 0.98 -1.83 -0.10 0.00 0.00 175.22 175.35 2k8p s GLU 47 N -3.79 0.89 -0.29 0.44 -1.05 -1.26 -5.17 118.70 108.46 2k8p s GLU 47 Ca 0.33 -0.42 -0.13 0.00 -0.15 0.00 0.00 54.97 54.61 2k8p s GLU 47 Cb -0.06 0.35 0.12 0.00 -0.44 0.00 0.00 34.13 34.09 2k8p s GLU 47 CO 0.23 -0.40 0.72 0.99 0.95 0.00 0.00 175.26 177.75 2k8p s THR 48 N -3.06 -0.59 -0.15 1.83 2.01 -1.26 -5.16 115.64 109.26 2k8p s THR 48 Ca 0.09 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 62.02 2k8p s THR 48 Cb -0.01 -1.00 0.06 0.00 0.01 0.00 0.00 72.50 71.57 2k8p s THR 48 CO -0.04 0.00 0.34 -0.54 -0.69 0.00 0.00 174.62 173.70 2k8p s LYS 49 N 2.38 0.29 -0.26 4.92 -0.14 -1.26 -5.16 119.74 120.52 2k8p s LYS 49 Ca -0.07 0.75 -0.38 0.00 -1.36 0.00 0.00 55.97 54.91 2k8p s LYS 49 Cb -0.09 0.00 0.15 0.00 -1.68 0.00 0.00 37.83 36.22 2k8p s LYS 49 CO -0.19 -0.19 1.36 -0.51 -0.76 0.00 0.00 175.35 175.05 2k8p s ASP 50 N 1.70 -0.03 -0.21 2.83 1.01 -1.26 -5.18 116.67 115.52 2k8p s ASP 50 Ca -0.07 -0.00 -0.27 0.00 0.71 0.00 0.00 52.55 52.92 2k8p s ASP 50 Cb -0.10 0.04 0.11 0.00 1.01 0.00 0.00 42.92 43.97 2k8p s ASP 50 CO -0.11 -0.06 0.93 0.54 0.21 0.00 0.00 175.17 176.68 2k8p s VAL 51 N -2.10 0.00 0.08 -1.27 0.11 -1.26 -5.18 120.40 110.77 2k8p s VAL 51 Ca 0.12 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 59.07 2k8p s VAL 51 Cb -0.01 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 2k8p s VAL 51 CO -0.03 0.00 0.20 -0.55 -3.33 0.00 0.00 175.10 171.39 2k8p s SER 52 N -0.31 0.09 0.52 3.54 0.15 -1.26 -5.18 113.70 111.25 2k8p s SER 52 Ca -0.01 -0.57 0.09 0.00 0.70 0.00 0.00 55.95 56.16 2k8p s SER 52 Cb -0.03 0.33 0.06 0.00 -1.71 0.00 0.00 66.02 64.67 2k8p s SER 52 CO -0.01 -0.69 0.67 -0.70 1.20 0.00 0.00 173.24 173.71 2k8p s GLU 53 N -3.53 2.44 -0.29 5.44 2.56 -1.26 -5.07 118.70 119.00 2k8p s GLU 53 Ca 0.02 -1.58 0.20 0.00 0.00 0.00 0.00 54.97 53.62 2k8p s GLU 53 Cb 0.03 -2.60 0.48 0.00 2.00 0.00 0.00 34.13 34.05 2k8p s GLU 53 CO -0.09 -0.65 1.04 2.48 -0.56 0.00 0.00 175.26 177.48 2k8p n TYR 54 N -2.05 1.11 0.00 5.30 4.11 -1.26 -4.95 117.16 119.41 2k8p n TYR 54 Ca 0.11 -2.44 0.00 0.00 -0.00 0.00 0.00 57.90 55.58 2k8p n TYR 54 Cb 0.61 -0.25 0.00 0.00 -0.00 0.00 0.00 39.34 39.70 2k8p n TYR 54 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 2k8p n SER 55 N -0.36 0.00 -3.27 9.48 3.41 -1.08 -2.78 113.62 119.02 2k8p n SER 55 Ca 0.07 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.67 2k8p n SER 55 Cb 0.81 0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 64.93 2k8p n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p s ARG 57 N 2.75 4.19 -0.35 0.00 1.70 0.65 -4.85 118.95 123.04 2k8p s ARG 57 Ca 0.15 2.44 -0.26 0.00 -0.47 0.00 0.00 55.73 57.59 2k8p s ARG 57 Cb -0.15 -3.06 0.01 0.00 -0.57 0.00 0.00 34.95 31.18 2k8p s ARG 57 CO -0.19 -0.52 0.93 -1.21 -1.08 0.00 0.00 175.30 173.23 2k8p s GLU 58 N -0.54 3.89 0.18 3.89 8.01 -1.26 -3.70 118.70 129.17 2k8p s GLU 58 Ca 0.61 0.65 0.04 0.00 0.01 0.00 0.00 54.97 56.28 2k8p s GLU 58 Cb -0.45 -3.78 -0.04 0.00 -4.31 0.00 0.00 34.13 25.55 2k8p s GLU 58 CO 0.47 -0.91 0.22 -0.51 0.01 0.00 0.00 175.26 174.54 2k8p s LEU 59 N 3.43 4.06 -0.18 1.80 1.43 -1.12 -4.95 118.68 123.15 2k8p s LEU 59 Ca 0.38 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 2k8p s LEU 59 Cb -0.12 -2.63 0.04 0.00 0.03 0.00 0.00 46.19 43.51 2k8p s LEU 59 CO 0.17 0.03 -0.07 -1.00 0.23 0.00 0.00 176.35 175.71 2k8p s HIS 60 N -1.83 1.97 -0.09 0.29 3.76 -1.26 -0.14 115.29 117.99 2k8p s HIS 60 Ca 0.33 -1.28 -0.04 0.00 -0.15 0.00 0.00 55.06 53.92 2k8p s HIS 60 Cb -0.10 -1.44 -0.04 0.00 1.11 0.00 0.00 32.58 32.11 2k8p s HIS 60 CO 0.26 -0.67 0.08 -0.06 -0.85 0.00 0.00 174.74 173.51 2k8p s PHE 61 N 1.54 3.39 0.01 1.40 0.40 0.82 -4.91 117.98 120.63 2k8p s PHE 61 Ca -0.00 0.36 0.04 0.00 -0.60 0.00 0.00 56.93 56.73 2k8p s PHE 61 Cb -0.16 -1.86 -0.03 0.00 0.51 0.00 0.00 43.02 41.48 2k8p s PHE 61 CO -0.08 0.61 -0.08 0.99 0.70 0.00 0.00 175.22 177.37 2k8p s THR 62 N -0.99 3.56 -0.20 0.64 2.01 -1.26 -1.12 115.64 118.28 2k8p s THR 62 Ca 0.15 -0.81 -0.27 0.00 0.31 0.00 0.00 61.69 61.07 2k8p s THR 62 Cb -0.12 -2.54 0.08 0.00 0.01 0.00 0.00 72.50 69.93 2k8p s THR 62 CO 0.05 0.39 0.77 -0.60 -0.69 0.00 0.00 174.62 174.54 2k8p s ARG 63 N -1.41 0.84 -0.20 4.92 3.52 -1.16 -4.95 118.95 120.51 2k8p s ARG 63 Ca 0.17 0.66 -0.19 0.00 -0.13 0.00 0.00 55.73 56.24 2k8p s ARG 63 Cb -0.11 0.41 -0.03 0.00 -1.56 0.00 0.00 34.95 33.66 2k8p s ARG 63 CO 0.07 -0.17 0.55 0.71 -0.81 0.00 0.00 175.30 175.65 2k8p s TYR 64 N -0.22 3.37 -0.02 5.12 1.51 -1.26 -1.07 117.35 124.77 2k8p s TYR 64 Ca -0.03 0.81 -0.09 0.00 -1.01 0.00 0.00 57.07 56.75 2k8p s TYR 64 Cb -0.03 -2.71 -0.05 0.00 -0.11 0.00 0.00 41.96 39.06 2k8p s TYR 64 CO 0.03 -0.13 0.29 0.54 -1.11 0.00 0.00 175.55 175.16 2k8p s VAL 65 N 1.74 5.26 -0.11 0.71 0.11 -1.26 -5.01 120.40 121.84 2k8p s VAL 65 Ca 0.25 0.39 -0.07 0.00 -2.93 0.00 0.00 61.98 59.62 2k8p s VAL 65 Cb -0.16 -3.57 0.04 0.00 -1.53 0.00 0.00 36.38 31.17 2k8p s VAL 65 CO 0.10 0.48 0.27 0.42 -3.33 0.00 0.00 175.10 173.03 2k8p s THR 66 N -1.18 -0.03 -0.28 5.04 -4.23 -1.26 -1.67 115.64 112.03 2k8p s THR 66 Ca 0.24 0.10 -0.04 0.00 -1.18 0.00 0.00 61.69 60.81 2k8p s THR 66 Cb -0.14 -0.40 0.10 0.00 1.34 0.00 0.00 72.50 73.40 2k8p s THR 66 CO 0.12 0.04 0.12 -0.62 -0.54 0.00 0.00 174.62 173.75 2k8p s ASP 67 N 0.97 3.50 0.00 3.99 2.15 -1.25 -5.03 116.67 121.00 2k8p s ASP 67 Ca -0.07 -1.27 0.00 0.00 0.43 0.00 0.00 52.55 51.64 2k8p s ASP 67 Cb -0.08 -0.40 0.00 0.00 -0.30 0.00 0.00 42.92 42.14 2k8p s ASP 67 CO -0.07 -0.43 0.00 0.61 -0.17 0.00 0.00 175.17 175.11 2k8p n GLY 68 N 5.21 -1.59 0.00 2.66 0.00 -1.26 -4.29 105.19 105.92 2k8p n GLY 68 Ca -0.06 -1.89 0.07 0.00 0.00 0.00 0.00 46.02 44.14 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 0.15 -3.30 1.61 -0.04 -1.26 -4.75 135.00 127.41 2k8p n PRO 69 Ca 0.00 0.18 -0.19 0.00 -0.04 0.00 0.00 63.50 63.45 2k8p n PRO 69 Cb 0.00 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.95 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 -4.24 0.38 0.22 0.00 3.00 0.55 -3.80 118.95 115.06 2k8p s ARG 71 Ca 0.51 0.01 -0.32 0.00 0.00 0.00 0.00 55.73 55.94 2k8p s ARG 71 Cb -0.07 0.17 -0.13 0.00 0.00 0.00 0.00 34.95 34.92 2k8p s ARG 71 CO 0.30 -0.08 1.51 -1.13 0.00 0.00 0.00 175.30 175.90 2k8p n SER 72 N 2.26 3.09 0.23 0.23 3.41 -0.67 -0.21 113.62 121.97 2k8p n SER 72 Ca -0.17 1.12 0.10 0.00 -0.26 0.00 0.00 58.87 59.66 2k8p n SER 72 Cb 0.57 -1.46 0.56 0.00 -0.26 0.00 0.00 64.21 63.62 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 4.99 1.18 -2.47 7.33 0.00 -1.76 -3.45 119.26 125.07 2k8p h ALA 73 Ca -0.45 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.17 2k8p h ALA 73 Cb 1.26 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 2k8p h ALA 73 CO 0.82 0.26 -0.42 0.15 0.00 0.00 0.00 179.25 180.05 2k8p s LYS 74 N -3.96 0.83 1.02 0.00 1.02 -1.26 -5.12 119.74 112.27 2k8p s LYS 74 Ca -0.01 -1.03 -0.13 0.00 0.02 0.00 0.00 55.97 54.82 2k8p s LYS 74 Cb 0.12 0.32 0.20 0.00 -0.52 0.00 0.00 37.83 37.95 2k8p s LYS 74 CO 0.63 -0.25 1.09 -1.25 -0.92 0.00 0.00 175.35 174.65 2k8p s PRO 75 N -3.88 0.29 -0.13 -1.68 0.04 -1.26 -4.69 135.00 123.69 2k8p s PRO 75 Ca 0.07 0.48 0.02 0.00 0.04 0.00 0.00 61.00 61.60 2k8p s PRO 75 Cb 0.05 -1.72 -0.00 0.00 0.04 0.00 0.00 34.50 32.87 2k8p s PRO 75 CO -0.10 -2.82 -0.19 0.54 0.04 0.00 0.00 177.00 174.48 2k8p s VAL 76 N -2.97 2.48 -0.38 -0.36 0.11 -0.23 -4.92 120.40 114.12 2k8p s VAL 76 Ca 0.66 -0.86 -0.22 0.00 -2.93 0.00 0.00 61.98 58.63 2k8p s VAL 76 Cb -0.19 -2.00 0.01 0.00 -1.53 0.00 0.00 36.38 32.67 2k8p s VAL 76 CO 0.58 0.54 0.72 -0.89 -3.33 0.00 0.00 175.10 172.71 2k8p s THR 77 N 0.51 4.79 -0.04 5.04 2.01 -1.26 -2.99 115.64 123.70 2k8p s THR 77 Ca -0.12 0.67 0.06 0.00 0.31 0.00 0.00 61.69 62.60 2k8p s THR 77 Cb -0.16 -4.17 -0.02 0.00 0.01 0.00 0.00 72.50 68.15 2k8p s THR 77 CO 0.05 -0.43 -0.21 -1.83 -0.69 0.00 0.00 174.62 171.51 2k8p s GLU 78 N 2.96 2.35 0.21 4.92 -1.05 -0.27 -4.95 118.70 122.86 2k8p s GLU 78 Ca 0.28 -0.82 -0.29 0.00 -0.15 0.00 0.00 54.97 53.98 2k8p s GLU 78 Cb -0.14 -2.21 -0.08 0.00 -0.44 0.00 0.00 34.13 31.26 2k8p s GLU 78 CO 0.17 0.56 0.91 -1.17 0.95 0.00 0.00 175.26 176.68 2k8p s LEU 79 N -0.58 4.62 0.12 1.83 0.20 -1.24 -0.13 118.68 123.50 2k8p s LEU 79 Ca 0.09 1.87 0.09 0.00 0.69 0.00 0.00 54.13 56.87 2k8p s LEU 79 Cb -0.11 -3.55 -0.04 0.00 -0.43 0.00 0.00 46.19 42.06 2k8p s LEU 79 CO 0.00 0.14 -0.18 -0.69 -0.29 0.00 0.00 176.35 175.33 2k8p s VAL 80 N -1.01 2.83 -0.30 1.68 1.01 0.81 -4.48 120.40 120.94 2k8p s VAL 80 Ca 0.41 -1.53 -0.13 0.00 0.00 0.00 0.00 61.98 60.73 2k8p s VAL 80 Cb -0.25 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 2k8p s VAL 80 CO 0.31 0.08 0.26 0.00 0.00 0.00 0.00 175.10 175.75 2k8p s SER 82 N 1.73 -0.63 0.00 0.00 0.15 -1.24 -5.04 113.70 108.66 2k8p s SER 82 Ca 0.09 0.71 0.00 0.00 0.70 0.00 0.00 55.95 57.45 2k8p s SER 82 Cb -0.16 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 2k8p s SER 82 CO 0.11 -0.56 0.00 0.61 1.20 0.00 0.00 173.24 174.59 2k8p n GLY 83 N 0.96 0.86 3.09 9.45 0.00 -1.26 -0.25 105.19 118.03 2k8p n GLY 83 Ca -0.18 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.62 0.50 0.08 1.61 0.74 -0.88 -4.88 119.66 115.21 2k8p s GLN 84 Ca 0.00 -0.62 -0.08 0.00 0.05 0.00 0.00 55.36 54.71 2k8p s GLN 84 Cb 0.00 0.20 -0.06 0.00 1.10 0.00 0.00 33.01 34.25 2k8p s GLN 84 CO 0.00 -0.12 0.37 0.00 -0.55 0.00 0.00 175.29 174.99 2k8p s GLY 86 N -1.91 1.42 0.62 0.00 0.00 -1.12 -3.56 107.32 102.77 2k8p s GLY 86 Ca 0.34 -1.70 -0.17 0.00 0.00 0.00 0.00 44.72 43.20 2k8p s GLY 86 CO 0.19 -1.59 1.12 2.56 0.00 0.00 0.00 173.10 175.38 2k8p s PRO 87 N -3.91 3.00 -0.02 2.90 0.04 -1.02 -4.75 135.00 131.25 2k8p s PRO 87 Ca 0.28 1.47 0.14 0.00 0.04 0.00 0.00 61.00 62.93 2k8p s PRO 87 Cb 0.06 -1.97 0.25 0.00 0.04 0.00 0.00 34.50 32.88 2k8p s PRO 87 CO 0.07 -1.10 1.10 0.00 0.04 0.00 0.00 177.00 177.11 2k8p n ALA 88 N -2.00 2.28 -1.35 8.56 0.00 -1.26 -5.10 120.51 121.63 2k8p n ALA 88 Ca 0.11 -1.86 -0.09 0.00 0.00 0.00 0.00 53.44 51.59 2k8p n ALA 88 Cb 0.52 -0.61 0.09 0.00 0.00 0.00 0.00 19.45 19.45 2k8p n ALA 88 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2k8p n ARG 89 N 0.14 -0.75 -3.74 0.00 1.85 -1.26 -4.34 116.66 108.57 2k8p n ARG 89 Ca 0.05 -0.87 -0.28 0.00 -1.00 0.00 0.00 57.85 55.74 2k8p n ARG 89 Cb 0.92 -0.61 0.03 0.00 -1.05 0.00 0.00 32.46 31.75 2k8p n ARG 89 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 2k8p n LEU 90 N 0.00 -2.48 -4.41 2.89 0.00 -1.26 -4.91 117.00 106.83 2k8p n LEU 90 Ca 0.07 -0.66 -0.33 0.00 0.00 0.00 0.00 56.01 55.09 2k8p n LEU 90 Cb 0.25 -2.57 0.12 0.00 0.00 0.00 0.00 43.42 41.22 2k8p n LEU 90 CO 0.18 0.42 -0.11 0.18 0.00 0.00 0.00 177.39 178.06 2k8p n LEU 91 N -4.52 -0.37 -0.11 -1.96 4.32 -1.26 -4.92 117.00 108.18 2k8p n LEU 91 Ca 0.02 0.30 -0.12 0.00 -0.02 0.00 0.00 56.01 56.18 2k8p n LEU 91 Cb 0.54 -1.19 -0.01 0.00 -1.62 0.00 0.00 43.42 41.14 2k8p n LEU 91 CO 0.69 -3.60 0.55 1.55 -1.22 0.00 0.00 177.39 175.36 2k8p h PRO 92 N -1.60 0.90 0.00 3.23 0.13 -1.96 -3.34 132.00 129.35 2k8p h PRO 92 Ca -0.44 -0.47 -0.36 0.00 -0.87 0.00 0.00 66.00 63.85 2k8p h PRO 92 Cb 1.29 0.02 -0.07 0.00 0.13 0.00 0.00 31.00 32.37 2k8p h PRO 92 CO 0.35 1.12 -2.37 0.09 -0.23 0.00 0.00 178.00 176.95 2k8p n ASN 93 N -4.05 1.72 -2.74 1.44 4.13 -1.26 -5.08 115.26 109.41 2k8p n ASN 93 Ca -0.02 -0.10 -0.01 0.00 1.68 0.00 0.00 54.58 56.12 2k8p n ASN 93 Cb 0.55 -0.10 -0.01 0.00 -1.54 0.00 0.00 39.78 38.67 2k8p n ASN 93 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k8p n ALA 94 N -3.11 -3.35 -0.01 5.41 0.00 -1.26 -5.00 120.51 113.19 2k8p n ALA 94 Ca -0.41 0.89 -0.01 0.00 0.00 0.00 0.00 53.44 53.91 2k8p n ALA 94 Cb 0.99 -1.81 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2k8p n ALA 94 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k8p n ILE 95 N 1.04 0.20 -3.79 0.00 -5.35 -1.26 -4.99 119.36 105.21 2k8p n ILE 95 Ca -0.10 -0.14 -0.36 0.00 -0.27 0.00 0.00 62.75 61.88 2k8p n ILE 95 Cb 0.19 -0.62 -0.12 0.00 -1.74 0.00 0.00 39.64 37.36 2k8p n ILE 95 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2k8p s GLY 96 N -3.24 1.83 -0.25 3.28 0.00 -1.26 -5.07 107.32 102.62 2k8p s GLY 96 Ca -0.02 -1.02 0.02 0.00 0.00 0.00 0.00 44.72 43.70 2k8p s GLY 96 CO 0.15 0.43 -0.11 -1.60 0.00 0.00 0.00 173.10 171.98 2k8p s ARG 97 N 1.32 2.20 -0.00 2.90 3.52 -1.26 -4.94 118.95 122.68 2k8p s ARG 97 Ca 0.05 -1.24 0.20 0.00 -0.13 0.00 0.00 55.73 54.62 2k8p s ARG 97 Cb -0.15 -2.81 0.34 0.00 -1.56 0.00 0.00 34.95 30.78 2k8p s ARG 97 CO 0.04 -0.54 1.14 0.41 -0.81 0.00 0.00 175.30 175.54 2k8p n GLY 98 N 4.49 0.94 1.25 8.12 0.00 -1.26 -5.14 105.19 113.59 2k8p n GLY 98 Ca -0.14 -0.68 0.16 0.00 0.00 0.00 0.00 46.02 45.36 2k8p n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k8p n LYS 99 N 0.38 -2.77 -3.75 1.61 4.01 -1.26 -4.84 118.16 111.55 2k8p n LYS 99 Ca 0.05 2.14 -0.30 0.00 -0.51 0.00 0.00 58.31 59.69 2k8p n LYS 99 Cb 1.05 -3.28 -0.14 0.00 -0.51 0.00 0.00 35.03 32.16 2k8p n LYS 99 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 2k8p s TRP 100 N -3.44 2.08 -0.08 2.13 0.23 -1.26 -4.91 118.94 113.69 2k8p s TRP 100 Ca 0.00 -2.30 0.13 0.00 -2.03 0.00 0.00 56.10 51.90 2k8p s TRP 100 Cb 0.00 -1.95 -0.19 0.00 0.03 0.00 0.00 33.47 31.36 2k8p s TRP 100 CO 0.00 -0.82 0.16 1.87 0.96 0.00 0.00 176.95 179.11 2k8p n TRP 101 N 3.96 0.00 -1.27 -1.98 -0.00 -1.26 -5.01 117.44 111.87 2k8p n TRP 101 Ca 0.05 0.00 -0.31 0.00 -0.00 0.00 0.00 57.50 57.24 2k8p n TRP 101 Cb 0.37 -0.52 0.09 0.00 -0.00 0.00 0.00 31.31 31.26 2k8p n TRP 101 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 2k8p s ARG 102 N -2.60 2.18 0.33 5.87 0.52 -1.26 -4.93 118.95 119.06 2k8p s ARG 102 Ca -0.06 1.11 0.26 0.00 -0.52 0.00 0.00 55.73 56.52 2k8p s ARG 102 Cb 0.06 -1.89 1.08 0.00 0.52 0.00 0.00 34.95 34.72 2k8p s ARG 102 CO 0.56 -1.68 1.78 -1.00 0.02 0.00 0.00 175.30 174.98 2k8p h PRO 103 N -1.15 0.00 -5.10 3.54 0.13 -2.02 -3.46 132.00 123.93 2k8p h PRO 103 Ca -0.44 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.35 2k8p h PRO 103 Cb 1.24 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.49 2k8p h PRO 103 CO 0.52 0.00 -0.58 0.45 -0.23 0.00 0.00 178.00 178.16 2k8p n SER 104 N -2.44 -5.63 -0.57 1.44 2.88 -1.26 -4.96 113.62 103.09 2k8p n SER 104 Ca 0.02 -0.46 0.00 0.00 -1.33 0.00 0.00 58.87 57.10 2k8p n SER 104 Cb 0.24 -4.34 0.00 0.00 -0.75 0.00 0.00 64.21 59.36 2k8p n SER 104 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2k8p n GLY 105 N -1.77 3.50 0.10 0.46 0.00 -1.26 -2.43 105.19 103.80 2k8p n GLY 105 Ca 0.00 -1.24 -0.13 0.00 0.00 0.00 0.00 46.02 44.65 2k8p n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k8p h PRO 106 N 0.00 0.20 0.00 1.61 0.13 -1.94 -3.44 132.00 128.56 2k8p h PRO 106 Ca 0.00 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 2k8p h PRO 106 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2k8p h PRO 106 CO 0.00 0.63 0.00 -3.47 -0.23 0.00 0.00 178.00 174.93 2k8p n ASP 107 N -4.68 0.00 -0.00 1.44 2.03 -1.26 -3.66 116.55 110.42 2k8p n ASP 107 Ca -0.07 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.24 2k8p n ASP 107 Cb 0.31 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.71 2k8p n ASP 107 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2k8p n PHE 108 N 0.00 0.00 -3.95 -0.67 -0.00 -1.26 -5.06 117.46 106.51 2k8p n PHE 108 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2k8p n PHE 108 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 39.48 39.47 2k8p n PHE 108 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2k8p n ARG 109 N -2.55 0.00 -3.47 -4.13 3.00 -1.24 -5.03 116.66 103.25 2k8p n ARG 109 Ca -0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.47 2k8p n ARG 109 Cb 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.40 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 -0.09 4.56 1.06 0.00 -4.36 0.86 -4.91 121.20 118.33 2k8p s ILE 111 Ca 0.22 1.14 -0.14 0.00 -0.26 0.00 0.00 60.65 61.61 2k8p s ILE 111 Cb -0.15 -3.68 0.22 0.00 1.25 0.00 0.00 42.46 40.11 2k8p s ILE 111 CO 0.09 -0.49 1.10 -2.16 0.24 0.00 0.00 174.94 173.72 2k8p s PRO 112 N -3.65 -0.09 0.02 0.37 0.04 -1.26 -1.41 135.00 129.02 2k8p s PRO 112 Ca 0.58 0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.95 2k8p s PRO 112 Cb -0.10 -1.69 -0.00 0.00 0.04 0.00 0.00 34.50 32.75 2k8p s PRO 112 CO 0.25 -3.04 0.02 -3.47 0.04 0.00 0.00 177.00 170.80 2k8p n ASP 113 N -4.36 -0.06 -4.55 6.66 -0.08 -1.20 -4.36 116.55 108.61 2k8p n ASP 113 Ca 0.07 -1.11 -0.42 0.00 -1.51 0.00 0.00 54.79 51.82 2k8p n ASP 113 Cb 0.58 0.11 0.01 0.00 2.34 0.00 0.00 41.12 44.16 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 1.06 -3.45 -0.67 3.00 -1.26 -4.62 116.66 110.69 2k8p n ARG 114 Ca 0.00 0.38 -0.22 0.00 -0.00 0.00 0.00 57.85 58.02 2k8p n ARG 114 Cb 0.03 -1.82 0.01 0.00 0.00 0.00 0.00 32.46 30.68 2k8p n ARG 114 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2k8p s TYR 115 N -1.30 2.00 -0.15 -0.14 1.51 -1.26 -0.81 117.35 117.20 2k8p s TYR 115 Ca 0.63 -0.66 -0.04 0.00 -1.01 0.00 0.00 57.07 55.99 2k8p s TYR 115 Cb -0.60 -2.12 0.07 0.00 -0.11 0.00 0.00 41.96 39.20 2k8p s TYR 115 CO 0.57 -0.57 0.22 1.03 -1.11 0.00 0.00 175.55 175.70 2k8p s ARG 116 N -4.36 0.14 -0.48 -0.62 0.52 0.90 -4.52 118.95 110.54 2k8p s ARG 116 Ca 0.48 0.47 -0.20 0.00 -0.52 0.00 0.00 55.73 55.97 2k8p s ARG 116 Cb -0.04 -0.59 0.04 0.00 0.52 0.00 0.00 34.95 34.88 2k8p s ARG 116 CO 0.30 -0.45 0.62 0.00 0.02 0.00 0.00 175.30 175.79 2k8p s ALA 117 N 2.35 3.37 0.09 2.13 0.00 -1.26 -1.79 121.76 126.65 2k8p s ALA 117 Ca 0.04 -1.55 0.01 0.00 0.00 0.00 0.00 51.96 50.47 2k8p s ALA 117 Cb -0.14 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 2k8p s ALA 117 CO -0.09 -1.91 0.20 -1.14 0.00 0.00 0.00 175.76 172.82 2k8p s GLN 118 N 2.68 3.32 -0.23 0.00 0.74 -0.29 -4.85 119.66 121.04 2k8p s GLN 118 Ca 0.17 -0.54 -0.06 0.00 0.05 0.00 0.00 55.36 54.98 2k8p s GLN 118 Cb -0.17 -2.95 -0.02 0.00 1.10 0.00 0.00 33.01 30.97 2k8p s GLN 118 CO 0.14 0.57 0.02 1.03 -0.55 0.00 0.00 175.29 176.51 2k8p s ARG 119 N -2.71 3.58 0.14 1.67 0.52 -1.26 -0.14 118.95 120.74 2k8p s ARG 119 Ca 0.34 -0.53 -0.02 0.00 -0.52 0.00 0.00 55.73 55.00 2k8p s ARG 119 Cb -0.12 -3.17 -0.05 0.00 0.52 0.00 0.00 34.95 32.13 2k8p s ARG 119 CO 0.27 -0.12 0.34 0.54 0.02 0.00 0.00 175.30 176.35 2k8p s VAL 120 N 1.38 5.23 -0.41 3.52 0.11 0.06 -4.90 120.40 125.39 2k8p s VAL 120 Ca 0.05 -0.19 -0.13 0.00 -2.93 0.00 0.00 61.98 58.77 2k8p s VAL 120 Cb -0.15 -3.66 0.04 0.00 -1.53 0.00 0.00 36.38 31.08 2k8p s VAL 120 CO 0.01 0.00 0.29 -1.58 -3.33 0.00 0.00 175.10 170.49 2k8p s GLN 121 N -2.82 2.89 -0.03 1.54 0.74 -1.26 -1.25 119.66 119.47 2k8p s GLN 121 Ca 0.39 -1.14 -0.19 0.00 0.05 0.00 0.00 55.36 54.47 2k8p s GLN 121 Cb -0.12 -3.92 -0.05 0.00 1.10 0.00 0.00 33.01 30.02 2k8p s GLN 121 CO 0.27 -0.81 0.52 -0.51 -0.55 0.00 0.00 175.29 174.21 2k8p s LEU 122 N 1.61 4.40 0.08 3.68 1.43 0.70 -2.11 118.68 128.46 2k8p s LEU 122 Ca 0.04 1.03 0.04 0.00 -1.03 0.00 0.00 54.13 54.21 2k8p s LEU 122 Cb -0.20 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.19 2k8p s LEU 122 CO 0.08 0.13 0.01 -0.76 0.23 0.00 0.00 176.35 176.04 2k8p s LEU 123 N -0.22 3.52 0.27 1.79 2.01 0.71 -0.17 118.68 126.60 2k8p s LEU 123 Ca 0.28 -0.13 0.10 0.00 0.01 0.00 0.00 54.13 54.39 2k8p s LEU 123 Cb -0.17 -2.22 -0.05 0.00 0.01 0.00 0.00 46.19 43.76 2k8p s LEU 123 CO 0.15 0.19 -0.06 0.00 1.01 0.00 0.00 176.35 177.63 2k8p s PRO 125 N -3.63 -0.62 -0.56 0.00 0.04 -1.26 -4.80 135.00 124.18 2k8p s PRO 125 Ca 0.31 0.15 -0.26 0.00 0.04 0.00 0.00 61.00 61.24 2k8p s PRO 125 Cb -0.06 -1.65 -0.09 0.00 0.04 0.00 0.00 34.50 32.75 2k8p s PRO 125 CO 0.18 -3.35 2.42 0.41 0.04 0.00 0.00 177.00 176.70 2k8p n GLY 126 N -1.00 0.10 0.00 0.56 0.00 -1.26 -2.05 105.19 101.54 2k8p n GLY 126 Ca 0.10 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.71 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 6.17 0.61 3.02 -0.02 0.00 -1.26 -5.14 105.19 108.57 2k8p n GLY 127 Ca 0.40 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.16 2k8p n GLY 127 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k8p n GLU 128 N 0.00 0.82 -4.39 1.61 -0.58 -0.87 -5.17 120.64 112.06 2k8p n GLU 128 Ca 0.00 -3.09 -0.24 0.00 -0.42 0.00 0.00 57.16 53.41 2k8p n GLU 128 Cb 0.00 1.16 -0.09 0.00 -0.57 0.00 0.00 31.44 31.94 2k8p n GLU 128 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k8p s ALA 129 N -2.83 2.96 0.92 0.62 0.00 -1.26 -4.78 121.76 117.39 2k8p s ALA 129 Ca 0.07 -1.80 -0.12 0.00 0.00 0.00 0.00 51.96 50.12 2k8p s ALA 129 Cb 0.00 -0.47 0.14 0.00 0.00 0.00 0.00 23.12 22.80 2k8p s ALA 129 CO 0.05 0.25 1.09 -1.25 0.00 0.00 0.00 175.76 175.91 2k8p s PRO 130 N -3.60 1.04 0.36 0.00 0.04 -1.26 -4.34 135.00 127.25 2k8p s PRO 130 Ca 0.31 0.75 -0.01 0.00 0.04 0.00 0.00 61.00 62.09 2k8p s PRO 130 Cb -0.05 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2k8p s PRO 130 CO 0.17 -2.37 0.49 0.50 0.04 0.00 0.00 177.00 175.83 2k8p s ARG 131 N -4.94 1.99 -0.02 4.56 3.52 0.76 -4.98 118.95 119.85 2k8p s ARG 131 Ca 0.64 -1.83 0.04 0.00 -0.13 0.00 0.00 55.73 54.44 2k8p s ARG 131 Cb -0.18 0.45 -0.01 0.00 -1.56 0.00 0.00 34.95 33.65 2k8p s ARG 131 CO 0.57 -0.83 -0.13 0.00 -0.81 0.00 0.00 175.30 174.10 2k8p s ALA 132 N -2.89 1.13 -0.10 6.12 0.00 -1.26 -0.22 121.76 124.54 2k8p s ALA 132 Ca 0.31 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.72 2k8p s ALA 132 Cb -0.01 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.82 2k8p s ALA 132 CO 0.22 0.26 -0.08 0.50 0.00 0.00 0.00 175.76 176.66 2k8p s ARG 133 N -0.21 1.49 0.18 0.00 6.06 -0.38 -4.95 118.95 121.14 2k8p s ARG 133 Ca 0.03 -0.26 -0.26 0.00 -2.50 0.00 0.00 55.73 52.73 2k8p s ARG 133 Cb -0.06 -1.49 -0.08 0.00 0.06 0.00 0.00 34.95 33.37 2k8p s ARG 133 CO -0.00 -0.20 0.81 0.21 -2.50 0.00 0.00 175.30 173.62 2k8p s LYS 134 N 1.48 4.64 -0.07 5.12 2.20 -1.26 -0.76 119.74 131.08 2k8p s LYS 134 Ca 0.00 1.23 -0.01 0.00 -0.36 0.00 0.00 55.97 56.84 2k8p s LYS 134 Cb -0.13 -3.27 0.03 0.00 -1.51 0.00 0.00 37.83 32.95 2k8p s LYS 134 CO -0.05 0.55 -0.02 0.14 -0.36 0.00 0.00 175.35 175.61 2k8p s VAL 135 N -1.13 0.54 -0.53 4.02 -7.23 0.80 -4.97 120.40 111.90 2k8p s VAL 135 Ca 0.37 -0.01 -0.21 0.00 -1.81 0.00 0.00 61.98 60.32 2k8p s VAL 135 Cb -0.24 -0.64 0.06 0.00 0.56 0.00 0.00 36.38 36.12 2k8p s VAL 135 CO 0.28 0.27 0.73 -0.60 -0.31 0.00 0.00 175.10 175.47 2k8p s ARG 136 N 1.69 3.17 0.09 4.82 6.06 -1.26 -1.14 118.95 132.38 2k8p s ARG 136 Ca 0.01 -0.75 0.10 0.00 -2.50 0.00 0.00 55.73 52.60 2k8p s ARG 136 Cb -0.13 -4.10 -0.03 0.00 0.06 0.00 0.00 34.95 30.75 2k8p s ARG 136 CO -0.05 -1.34 -0.26 -0.48 -2.50 0.00 0.00 175.30 170.67 2k8p s LEU 137 N 3.05 2.25 0.33 -0.88 2.34 -0.74 -4.94 118.68 120.09 2k8p s LEU 137 Ca 0.19 -0.68 -0.27 0.00 0.06 0.00 0.00 54.13 53.44 2k8p s LEU 137 Cb -0.18 -1.22 -0.13 0.00 -0.56 0.00 0.00 46.19 44.11 2k8p s LEU 137 CO 0.13 0.20 1.05 0.52 -1.06 0.00 0.00 176.35 177.20 2k8p n VAL 138 N 1.29 2.07 -0.07 1.48 0.31 -1.26 -0.07 118.33 122.08 2k8p n VAL 138 Ca -0.18 -0.50 -0.08 0.00 -0.01 0.00 0.00 64.34 63.57 2k8p n VAL 138 Cb 0.53 -1.13 -0.10 0.00 -0.91 0.00 0.00 33.84 32.23 2k8p n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k8p n ALA 139 N 0.08 1.65 -2.56 3.52 0.00 0.01 -3.69 120.51 119.52 2k8p n ALA 139 Ca 0.09 -0.85 -0.15 0.00 0.00 0.00 0.00 53.44 52.52 2k8p n ALA 139 Cb 0.34 0.00 -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 -4.97 0.89 -0.20 0.00 0.01 -0.40 -4.98 113.70 104.06 2k8p s SER 140 Ca -0.12 -1.50 -0.22 0.00 1.31 0.00 0.00 55.95 55.42 2k8p s SER 140 Cb 0.05 0.55 0.06 0.00 0.21 0.00 0.00 66.02 66.89 2k8p s SER 140 CO 0.51 -1.10 0.61 0.00 0.41 0.00 0.00 173.24 173.67 2k8p s LYS 142 N 0.04 1.30 -0.34 0.00 1.02 -0.50 -4.93 119.74 116.33 2k8p s LYS 142 Ca -0.02 -1.37 -0.04 0.00 0.02 0.00 0.00 55.97 54.56 2k8p s LYS 142 Cb -0.04 -1.52 0.06 0.00 -0.52 0.00 0.00 37.83 35.81 2k8p s LYS 142 CO 0.02 0.33 0.09 0.00 -0.92 0.00 0.00 175.35 174.88 2k8p s LYS 144 N 1.30 0.83 -0.68 0.00 2.20 -1.25 -4.92 119.74 117.22 2k8p s LYS 144 Ca -0.01 -0.67 -0.27 0.00 -0.36 0.00 0.00 55.97 54.66 2k8p s LYS 144 Cb -0.20 0.35 0.01 0.00 -1.51 0.00 0.00 37.83 36.48 2k8p s LYS 144 CO 0.00 -0.27 1.55 0.50 -0.36 0.00 0.00 175.35 176.77 2k8p s ARG 145 N -3.07 2.93 -0.21 4.03 3.00 -1.26 -4.37 118.95 119.99 2k8p s ARG 145 Ca -0.01 0.15 -0.01 0.00 -1.00 0.00 0.00 55.73 54.85 2k8p s ARG 145 Cb 0.01 -4.28 0.06 0.00 0.00 0.00 0.00 34.95 30.74 2k8p s ARG 145 CO -0.07 -2.42 -0.00 -1.17 0.00 0.00 0.00 175.30 171.64 2k8p s LEU 146 N 7.29 1.75 0.25 -0.88 2.96 -1.26 -4.99 118.68 123.80 2k8p s LEU 146 Ca 0.50 -0.97 0.08 0.00 -0.22 0.00 0.00 54.13 53.52 2k8p s LEU 146 Cb -0.10 -0.84 -0.05 0.00 0.50 0.00 0.00 46.19 45.70 2k8p s LEU 146 CO 0.17 -0.28 -0.11 0.28 -1.32 0.00 0.00 176.35 175.09 2k8p s THR 147 N 1.67 1.82 0.01 3.68 -1.32 -1.26 -4.53 115.64 115.71 2k8p s THR 147 Ca -0.03 -2.20 -0.29 0.00 -1.21 0.00 0.00 61.69 57.95 2k8p s THR 147 Cb -0.18 -2.27 0.11 0.00 -1.51 0.00 0.00 72.50 68.65 2k8p s THR 147 CO -0.07 -0.43 1.19 0.00 -2.21 0.00 0.00 174.62 173.10 2k8p s ARG 148 N -3.66 0.60 0.30 7.08 1.70 -1.26 -5.19 118.95 118.52 2k8p s ARG 148 Ca 0.27 -0.32 0.04 0.00 -0.47 0.00 0.00 55.73 55.25 2k8p s ARG 148 Cb 0.01 0.21 -0.03 0.00 -0.57 0.00 0.00 34.95 34.56 2k8p s ARG 148 CO 0.10 -0.27 0.21 -0.59 -1.08 0.00 0.00 175.30 173.67 2k8p s PHE 149 N -2.66 1.60 -0.26 5.89 -0.12 -1.26 -5.18 117.98 116.00 2k8p s PHE 149 Ca 0.13 -1.50 -0.26 0.00 -0.05 0.00 0.00 56.93 55.25 2k8p s PHE 149 Cb 0.03 -0.76 0.10 0.00 -0.63 0.00 0.00 43.02 41.76 2k8p s PHE 149 CO -0.03 -0.69 0.87 -1.58 -0.05 0.00 0.00 175.22 173.74 2k8p s HIS 150 N -3.61 -0.63 0.52 3.49 2.46 -1.26 -5.18 115.29 111.09 2k8p s HIS 150 Ca 0.38 1.48 0.03 0.00 0.47 0.00 0.00 55.06 57.43 2k8p s HIS 150 Cb 0.04 0.33 0.01 0.00 -0.13 0.00 0.00 32.58 32.83 2k8p s HIS 150 CO 0.21 -0.33 0.21 0.54 -2.47 0.00 0.00 174.74 172.90 2k8p s ASN 151 N 0.14 4.39 -0.28 9.88 4.22 -1.26 -5.16 114.94 126.88 2k8p s ASN 151 Ca 0.01 -1.44 -0.19 0.00 -2.14 0.00 0.00 52.86 49.09 2k8p s ASN 151 Cb -0.04 0.45 0.10 0.00 1.28 0.00 0.00 41.25 43.03 2k8p s ASN 151 CO -0.02 -0.97 0.83 0.00 -2.04 0.00 0.00 177.10 174.91 2k8p s GLN 152 N -4.08 0.61 -0.28 3.55 -2.07 -1.26 -5.17 119.66 110.97 2k8p s GLN 152 Ca 0.21 0.92 -0.22 0.00 -1.82 0.00 0.00 55.36 54.45 2k8p s GLN 152 Cb -0.00 0.20 0.08 0.00 -1.09 0.00 0.00 33.01 32.20 2k8p s GLN 152 CO 0.12 -0.11 0.76 0.45 -1.32 0.00 0.00 175.29 175.20 2k8p s SER 153 N 1.06 -0.76 -0.16 12.60 0.15 -1.26 -5.17 113.70 120.16 2k8p s SER 153 Ca -0.05 1.37 -0.17 0.00 0.70 0.00 0.00 55.95 57.79 2k8p s SER 153 Cb -0.05 1.36 0.05 0.00 -1.71 0.00 0.00 66.02 65.67 2k8p s SER 153 CO -0.12 -0.23 0.47 -1.61 1.20 0.00 0.00 173.24 172.95 2k8p s GLU 154 N 0.81 0.59 0.28 5.44 2.02 -1.26 -5.18 118.70 121.41 2k8p s GLU 154 Ca -0.03 0.56 0.06 0.00 0.02 0.00 0.00 54.97 55.58 2k8p s GLU 154 Cb -0.05 0.28 -0.06 0.00 0.10 0.00 0.00 34.13 34.41 2k8p s GLU 154 CO -0.07 -0.09 -0.05 -0.48 0.02 0.00 0.00 175.26 174.59 2k8p s LEU 155 N 0.03 2.45 0.00 1.80 2.34 -1.26 -5.16 118.68 118.88 2k8p s LEU 155 Ca -0.02 -1.20 0.00 0.00 0.06 0.00 0.00 54.13 52.97 2k8p s LEU 155 Cb -0.03 -0.60 0.00 0.00 -0.56 0.00 0.00 46.19 45.00 2k8p s LEU 155 CO 0.01 -0.37 0.00 2.29 -1.06 0.00 0.00 176.35 177.23 2k8p n LYS 156 N -0.58 0.00 -3.63 1.48 2.85 -1.26 -5.19 118.16 111.84 2k8p n LYS 156 Ca -0.05 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.20 2k8p n LYS 156 Cb 0.64 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 35.01 2k8p n LYS 156 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2k8p s ASP 157 N -0.97 -0.09 0.00 -5.58 2.15 -1.26 -5.19 116.67 105.73 2k8p s ASP 157 Ca 0.00 -0.14 0.00 0.00 0.43 0.00 0.00 52.55 52.84 2k8p s ASP 157 Cb 0.00 0.20 0.00 0.00 -0.30 0.00 0.00 42.92 42.82 2k8p s ASP 157 CO 0.00 -0.36 0.00 0.49 -0.17 0.00 0.00 175.17 175.13 2k8p n PHE 158 N -0.41 0.00 0.00 -5.34 3.72 -1.26 -5.16 117.46 109.01 2k8p n PHE 158 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 2k8p n PHE 158 Cb 0.62 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.16 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 0.23 3.48 3.63 1.37 0.00 -1.26 -5.18 105.19 107.47 2k8p n GLY 159 Ca 0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 46.02 45.37 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 0.00 0.00 -0.07 2.61 -1.32 -1.26 -5.19 115.64 110.41 2k8p s THR 160 Ca 0.00 0.00 -0.32 0.00 -1.21 0.00 0.00 61.69 60.16 2k8p s THR 160 Cb 0.00 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 70.12 2k8p s THR 160 CO 0.00 0.00 1.38 -1.61 -2.21 0.00 0.00 174.62 172.18 2k8p s GLU 161 N -0.02 0.14 0.09 7.08 2.02 -1.26 -5.19 118.70 121.56 2k8p s GLU 161 Ca 0.04 -0.08 -0.25 0.00 0.02 0.00 0.00 54.97 54.69 2k8p s GLU 161 Cb -0.04 0.05 0.08 0.00 0.10 0.00 0.00 34.13 34.31 2k8p s GLU 161 CO -0.08 -0.07 0.70 0.00 0.02 0.00 0.00 175.26 175.84 2k8p s ALA 162 N -2.12 -1.69 -0.13 5.21 0.00 -1.26 -5.16 121.76 116.61 2k8p s ALA 162 Ca 0.18 0.73 -0.07 0.00 0.00 0.00 0.00 51.96 52.80 2k8p s ALA 162 Cb 0.06 0.65 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 2k8p s ALA 162 CO -0.05 -0.71 0.12 0.00 0.00 0.00 0.00 175.76 175.11 2k8p s ALA 163 N -3.35 3.76 -0.41 0.00 0.00 -1.26 -5.05 121.76 115.45 2k8p s ALA 163 Ca 0.02 -0.67 0.07 0.00 0.00 0.00 0.00 51.96 51.37 2k8p s ALA 163 Cb -0.01 -1.92 0.22 0.00 0.00 0.00 0.00 23.12 21.41 2k8p s ALA 163 CO -0.10 0.54 0.51 -2.13 0.00 0.00 0.00 175.76 174.58 2k8p n ARG 164 N 2.25 0.56 -0.24 0.00 0.63 -1.26 -5.13 116.66 113.46 2k8p n ARG 164 Ca -0.19 -3.03 -0.07 0.00 -0.92 0.00 0.00 57.85 53.64 2k8p n ARG 164 Cb 0.54 -1.37 0.06 0.00 0.45 0.00 0.00 32.46 32.14 2k8p n ARG 164 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2k8p n PRO 165 N 1.90 -1.52 -4.19 -0.14 -0.04 -1.26 -5.09 135.00 124.66 2k8p n PRO 165 Ca 0.22 -0.41 -0.16 0.00 -0.04 0.00 0.00 63.50 63.12 2k8p n PRO 165 Cb 0.53 -0.38 -0.11 0.00 -0.04 0.00 0.00 33.50 33.49 2k8p n PRO 165 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2k8p s GLN 166 N -3.57 0.89 -0.34 0.54 -2.07 -1.26 -5.12 119.66 108.72 2k8p s GLN 166 Ca 0.16 -1.15 0.05 0.00 -1.82 0.00 0.00 55.36 52.61 2k8p s GLN 166 Cb -0.02 -0.67 0.19 0.00 -1.09 0.00 0.00 33.01 31.42 2k8p s GLN 166 CO 0.13 0.12 0.64 0.15 -1.32 0.00 0.00 175.29 175.01 2k8p s LYS 167 N -2.60 0.62 -0.26 9.60 1.02 -1.26 -5.14 119.74 121.72 2k8p s LYS 167 Ca 0.05 0.21 -0.08 0.00 0.02 0.00 0.00 55.97 56.18 2k8p s LYS 167 Cb -0.05 0.18 -0.02 0.00 -0.52 0.00 0.00 37.83 37.42 2k8p s LYS 167 CO 0.01 -1.04 0.08 0.20 -0.92 0.00 0.00 175.35 173.69 2k8p s GLY 168 N 2.45 1.78 0.07 -3.33 0.00 -1.26 -5.09 107.32 101.95 2k8p s GLY 168 Ca 0.13 -1.21 0.06 0.00 0.00 0.00 0.00 44.72 43.71 2k8p s GLY 168 CO -0.19 0.57 -0.17 1.09 0.00 0.00 0.00 173.10 174.41 2k8p s ARG 169 N 1.60 1.02 0.05 2.90 1.70 -1.26 -5.16 118.95 119.81 2k8p s ARG 169 Ca 0.06 -0.96 0.00 0.00 -0.47 0.00 0.00 55.73 54.35 2k8p s ARG 169 Cb -0.16 -1.12 -0.04 0.00 -0.57 0.00 0.00 34.95 33.07 2k8p s ARG 169 CO 0.04 0.27 -0.04 -1.59 -1.08 0.00 0.00 175.30 172.89 2k8p s LYS 170 N -1.56 0.60 -0.04 3.89 -2.85 -1.26 -5.13 119.74 113.39 2k8p s LYS 170 Ca 0.03 -1.11 -0.30 0.00 -1.00 0.00 0.00 55.97 53.59 2k8p s LYS 170 Cb -0.09 0.06 -0.05 0.00 -2.06 0.00 0.00 37.83 35.69 2k8p s LYS 170 CO 0.03 -0.07 1.49 -1.25 0.10 0.00 0.00 175.35 175.65 2k8p s PRO 171 N -3.30 4.23 -0.52 1.78 0.04 -1.26 -4.96 135.00 131.00 2k8p s PRO 171 Ca 0.03 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.16 2k8p s PRO 171 Cb 0.03 -3.76 0.24 0.00 0.04 0.00 0.00 34.50 31.05 2k8p s PRO 171 CO -0.07 -0.71 0.62 2.89 0.04 0.00 0.00 177.00 179.77 2k8p n ARG 172 N 6.27 1.60 -2.09 4.56 1.85 -1.26 -5.08 116.66 122.51 2k8p n ARG 172 Ca 0.15 -3.96 -0.43 0.00 -1.00 0.00 0.00 57.85 52.61 2k8p n ARG 172 Cb 0.43 -1.77 -0.03 0.00 -1.05 0.00 0.00 32.46 30.05 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2k8p s PRO 173 N -1.76 3.42 -0.43 2.89 0.04 -1.26 -4.89 135.00 133.01 2k8p s PRO 173 Ca 0.37 1.33 0.06 0.00 0.04 0.00 0.00 61.00 62.79 2k8p s PRO 173 Cb 0.15 -4.15 0.42 0.00 0.04 0.00 0.00 34.50 30.96 2k8p s PRO 173 CO -0.07 -1.75 1.09 -2.13 0.04 0.00 0.00 177.00 174.19 2k8p n ARG 174 N 8.30 3.24 -3.60 4.56 0.63 -1.26 -5.02 116.66 123.50 2k8p n ARG 174 Ca 0.21 -4.41 -0.09 0.00 -0.92 0.00 0.00 57.85 52.65 2k8p n ARG 174 Cb 0.47 -2.17 -0.06 0.00 0.45 0.00 0.00 32.46 31.16 2k8p n ARG 174 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2k8p s ALA 175 N -3.50 -1.99 0.29 5.13 0.00 -1.26 -5.19 121.76 115.24 2k8p s ALA 175 Ca 0.46 1.70 0.05 0.00 0.00 0.00 0.00 51.96 54.17 2k8p s ALA 175 Cb 0.40 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.44 2k8p s ALA 175 CO -0.17 -0.27 0.19 2.89 0.00 0.00 0.00 175.76 178.40 2k8p n ARG 176 N 1.11 0.44 -3.75 0.00 0.00 -1.26 -5.17 116.66 108.03 2k8p n ARG 176 Ca -0.09 -2.70 -0.12 0.00 -0.00 0.00 0.00 57.85 54.93 2k8p n ARG 176 Cb 0.57 1.93 -0.12 0.00 -0.00 0.00 0.00 32.46 34.85 2k8p n ARG 176 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2k8p s SER 177 N -2.92 -0.29 -0.42 2.89 1.04 -1.26 -5.11 113.70 107.64 2k8p s SER 177 Ca 0.26 0.55 0.04 0.00 0.48 0.00 0.00 55.95 57.29 2k8p s SER 177 Cb 0.01 0.50 0.17 0.00 0.10 0.00 0.00 66.02 66.80 2k8p s SER 177 CO 0.19 -0.13 0.45 0.00 0.98 0.00 0.00 173.24 174.73 2k8p s ALA 178 N 0.68 -0.20 -0.39 5.32 0.00 -1.26 -5.05 121.76 120.87 2k8p s ALA 178 Ca -0.04 -1.37 -0.01 0.00 0.00 0.00 0.00 51.96 50.53 2k8p s ALA 178 Cb -0.06 -2.06 0.19 0.00 0.00 0.00 0.00 23.12 21.20 2k8p s ALA 178 CO -0.04 -2.11 0.90 0.21 0.00 0.00 0.00 175.76 174.72 2k8p s LYS 179 N 0.80 0.52 -0.21 0.00 2.20 -1.26 -5.13 119.74 116.65 2k8p s LYS 179 Ca 0.26 -0.37 0.01 0.00 -0.36 0.00 0.00 55.97 55.51 2k8p s LYS 179 Cb -0.05 0.01 0.05 0.00 -1.51 0.00 0.00 37.83 36.33 2k8p s LYS 179 CO -0.09 -0.69 -0.10 0.00 -0.36 0.00 0.00 175.35 174.10 2k8p s ALA 180 N 1.42 2.11 0.03 3.13 0.00 -1.26 -5.11 121.76 122.08 2k8p s ALA 180 Ca 0.21 -1.32 -0.05 0.00 0.00 0.00 0.00 51.96 50.80 2k8p s ALA 180 Cb 0.04 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.80 2k8p s ALA 180 CO -0.10 -0.90 0.08 1.21 0.00 0.00 0.00 175.76 176.05 2k8p s ASN 181 N 1.34 0.16 0.11 0.00 3.84 -1.26 -5.17 114.94 113.96 2k8p s ASN 181 Ca -0.03 -0.47 -0.05 0.00 0.21 0.00 0.00 52.86 52.52 2k8p s ASN 181 Cb -0.17 0.20 -0.02 0.00 -0.55 0.00 0.00 41.25 40.71 2k8p s ASN 181 CO -0.08 -0.44 0.14 0.00 -2.79 0.00 0.00 177.10 173.93 2k8p s GLN 182 N -2.17 0.90 -0.07 0.43 -2.07 -1.26 -5.17 119.66 110.24 2k8p s GLN 182 Ca -0.09 -1.18 -0.13 0.00 -1.82 0.00 0.00 55.36 52.15 2k8p s GLN 182 Cb -0.04 0.30 0.03 0.00 -1.09 0.00 0.00 33.01 32.21 2k8p s GLN 182 CO -0.03 -0.27 0.31 0.00 -1.32 0.00 0.00 175.29 173.98 2k8p s ALA 183 N -3.94 -0.77 -0.07 2.60 0.00 -1.26 -5.17 121.76 113.15 2k8p s ALA 183 Ca 0.13 0.62 -0.11 0.00 0.00 0.00 0.00 51.96 52.60 2k8p s ALA 183 Cb 0.06 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.95 2k8p s ALA 183 CO -0.05 -0.20 0.27 -2.00 0.00 0.00 0.00 175.76 173.78 2k8p s GLU 184 N -0.53 0.43 -0.34 0.00 2.12 -1.26 -5.07 118.70 114.04 2k8p s GLU 184 Ca -0.06 0.16 0.15 0.00 0.36 0.00 0.00 54.97 55.58 2k8p s GLU 184 Cb -0.04 0.20 0.43 0.00 0.26 0.00 0.00 34.13 34.98 2k8p s GLU 184 CO 0.02 -0.08 1.02 -0.11 -0.54 0.00 0.00 175.26 175.57 2k8p n LEU 185 N 2.35 0.62 -4.31 2.70 7.94 -1.26 -5.13 117.00 119.91 2k8p n LEU 185 Ca -0.16 -3.77 -0.32 0.00 -1.11 0.00 0.00 56.01 50.65 2k8p n LEU 185 Cb 0.57 0.39 0.18 0.00 0.53 0.00 0.00 43.42 45.08 2k8p n LEU 185 CO 0.19 1.70 -0.37 -1.84 -1.11 0.00 0.00 177.39 175.96 2k8p n GLU 186 N -0.13 -1.55 -3.43 1.96 0.00 -1.26 -5.05 120.64 111.18 2k8p n GLU 186 Ca 0.08 -0.43 -0.13 0.00 0.00 0.00 0.00 57.16 56.68 2k8p n GLU 186 Cb 0.81 -1.77 -0.03 0.00 0.00 0.00 0.00 31.44 30.45 2k8p n GLU 186 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 2k8p s ASN 187 N -1.92 -0.58 0.29 -1.84 2.47 -1.26 -5.19 114.94 106.91 2k8p s ASN 187 Ca 0.58 0.09 -0.13 0.00 0.42 0.00 0.00 52.86 53.82 2k8p s ASN 187 Cb -0.14 0.59 0.01 0.00 -1.45 0.00 0.00 41.25 40.26 2k8p s ASN 187 CO 0.66 -0.92 0.57 0.00 -3.72 0.00 0.00 177.10 173.69 2k8p s ALA 188 N -3.42 -0.31 -1.36 1.71 0.00 -1.26 -5.37 121.76 111.76 2k8p s ALA 188 Ca -0.01 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.08 2k8p s ALA 188 Cb -0.01 0.99 0.00 0.00 0.00 0.00 0.00 23.12 24.10 2k8p s ALA 188 CO -0.10 -0.90 0.34 0.98 0.00 0.00 0.00 175.76 176.08