#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 3.45 -1.04 1.61 0.51 -1.26 -4.50 118.94 117.71 2k8p s TRP 2 Ca 0.00 -1.61 0.00 0.00 -2.12 0.00 0.00 56.10 52.37 2k8p s TRP 2 Cb 0.00 -3.92 0.00 0.00 -0.81 0.00 0.00 33.47 28.74 2k8p s TRP 2 CO 0.00 -1.12 0.00 1.04 -0.51 0.00 0.00 176.95 176.36 2k8p n GLN 3 N 4.98 -2.21 -3.03 4.98 1.13 -1.26 -3.10 117.38 118.87 2k8p n GLN 3 Ca 0.07 0.59 -0.14 0.00 -1.94 0.00 0.00 57.00 55.58 2k8p n GLN 3 Cb 0.45 -5.17 0.01 0.00 0.11 0.00 0.00 30.24 25.64 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 -2.13 -2.82 -3.99 -1.58 0.00 -1.26 -4.99 120.51 103.74 2k8p n ALA 4 Ca -0.14 0.73 -0.31 0.00 0.00 0.00 0.00 53.44 53.72 2k8p n ALA 4 Cb 0.60 -2.59 -0.15 0.00 0.00 0.00 0.00 19.45 17.31 2k8p n ALA 4 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2k8p s PHE 5 N -1.98 2.83 -0.39 0.00 0.40 -1.18 -5.01 117.98 112.65 2k8p s PHE 5 Ca 0.22 -2.10 0.10 0.00 -0.60 0.00 0.00 56.93 54.54 2k8p s PHE 5 Cb -0.04 -1.87 0.31 0.00 0.51 0.00 0.00 43.02 41.93 2k8p s PHE 5 CO 0.73 -0.84 0.65 1.63 0.70 0.00 0.00 175.22 178.09 2k8p n LYS 6 N 4.55 0.94 -3.75 0.44 4.76 -1.26 -4.94 118.16 118.89 2k8p n LYS 6 Ca -0.10 -3.37 -0.13 0.00 -2.87 0.00 0.00 58.31 51.84 2k8p n LYS 6 Cb 0.43 -1.52 -0.11 0.00 -1.84 0.00 0.00 35.03 31.98 2k8p n LYS 6 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2k8p s ASN 7 N -1.93 -0.33 0.00 4.39 2.47 -1.26 -5.17 114.94 113.10 2k8p s ASN 7 Ca 0.38 0.64 0.00 0.00 0.42 0.00 0.00 52.86 54.30 2k8p s ASN 7 Cb 0.27 0.61 0.00 0.00 -1.45 0.00 0.00 41.25 40.68 2k8p s ASN 7 CO -0.09 -0.12 0.00 0.47 -3.72 0.00 0.00 177.10 173.63 2k8p n ASP 8 N 3.25 1.66 -2.67 -4.21 8.00 -1.26 -5.16 116.55 116.16 2k8p n ASP 8 Ca -0.16 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.57 2k8p n ASP 8 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 2k8p n ASP 8 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8p n ALA 9 N -3.00 0.00 -3.27 2.24 0.00 -1.26 -5.10 120.51 110.12 2k8p n ALA 9 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2k8p n ALA 9 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 2k8p n ALA 9 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2k8p s THR 10 N -0.33 -0.74 0.34 0.00 -1.32 -1.26 -5.15 115.64 107.18 2k8p s THR 10 Ca 0.00 -0.11 -0.27 0.00 -1.21 0.00 0.00 61.69 60.10 2k8p s THR 10 Cb 0.00 -0.92 -0.09 0.00 -1.51 0.00 0.00 72.50 69.97 2k8p s THR 10 CO 0.00 -0.13 1.07 -1.83 -2.21 0.00 0.00 174.62 171.51 2k8p s GLU 11 N 2.64 4.41 -0.47 7.08 -1.05 -1.26 -5.02 118.70 125.02 2k8p s GLU 11 Ca 0.13 1.64 0.01 0.00 -0.15 0.00 0.00 54.97 56.60 2k8p s GLU 11 Cb -0.14 -2.87 0.13 0.00 -0.44 0.00 0.00 34.13 30.81 2k8p s GLU 11 CO -0.22 0.05 0.24 0.42 0.95 0.00 0.00 175.26 176.70 2k8p s ILE 12 N -1.41 2.96 -0.63 1.83 -1.09 -1.26 -4.99 121.20 116.61 2k8p s ILE 12 Ca 0.51 -2.69 0.06 0.00 -2.23 0.00 0.00 60.65 56.30 2k8p s ILE 12 Cb -0.27 -3.04 0.25 0.00 -1.58 0.00 0.00 42.46 37.83 2k8p s ILE 12 CO 0.34 -0.74 0.75 -0.38 -1.23 0.00 0.00 174.94 173.67 2k8p n ILE 13 N 3.84 2.31 -0.63 2.92 2.08 -1.26 -5.09 119.36 123.52 2k8p n ILE 13 Ca 0.04 -5.20 -0.07 0.00 0.56 0.00 0.00 62.75 58.07 2k8p n ILE 13 Cb 0.38 -2.07 0.06 0.00 -0.75 0.00 0.00 39.64 37.27 2k8p n ILE 13 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 2k8p n PRO 14 N 0.82 -1.55 -0.60 0.38 -0.04 -1.26 -5.10 135.00 127.65 2k8p n PRO 14 Ca 0.30 -0.44 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2k8p n PRO 14 Cb 0.41 -0.41 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2k8p n PRO 14 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2k8p n GLU 15 N -2.34 0.00 -4.55 0.54 2.13 -1.26 -5.17 120.64 109.99 2k8p n GLU 15 Ca 0.04 0.00 -0.24 0.00 0.66 0.00 0.00 57.16 57.62 2k8p n GLU 15 Cb 0.15 0.00 -0.17 0.00 0.27 0.00 0.00 31.44 31.69 2k8p n GLU 15 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2k8p s LEU 16 N 0.00 1.63 -0.04 4.31 1.02 -1.26 -5.01 118.68 119.33 2k8p s LEU 16 Ca 0.00 -0.28 0.07 0.00 0.02 0.00 0.00 54.13 53.94 2k8p s LEU 16 Cb 0.00 -0.79 -0.11 0.00 0.02 0.00 0.00 46.19 45.31 2k8p s LEU 16 CO 0.00 0.03 0.10 0.61 0.02 0.00 0.00 176.35 177.11 2k8p n GLY 17 N 3.80 -0.36 1.33 -3.19 0.00 -1.26 -5.12 105.19 100.39 2k8p n GLY 17 Ca -0.23 -0.15 0.17 0.00 0.00 0.00 0.00 46.02 45.81 2k8p n GLY 17 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k8p n GLU 18 N -2.03 -2.72 -3.30 1.61 4.71 -1.26 -4.77 120.64 112.90 2k8p n GLU 18 Ca -0.07 1.89 -0.25 0.00 -0.01 0.00 0.00 57.16 58.72 2k8p n GLU 18 Cb 0.48 -3.30 -0.08 0.00 -1.01 0.00 0.00 31.44 27.52 2k8p n GLU 18 CO 0.00 0.00 0.00 0.98 0.09 0.00 0.00 177.13 178.20 2k8p n TYR 19 N -3.96 0.01 -2.11 -0.32 9.36 -1.26 -5.10 117.16 113.78 2k8p n TYR 19 Ca -0.01 -3.58 -0.43 0.00 3.32 0.00 0.00 57.90 57.20 2k8p n TYR 19 Cb 0.66 -0.22 -0.03 0.00 -0.63 0.00 0.00 39.34 39.13 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 -0.98 3.67 -0.34 2.98 0.04 -1.26 -4.83 135.00 134.27 2k8p s PRO 20 Ca 0.35 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 62.91 2k8p s PRO 20 Cb 0.12 -4.07 0.28 0.00 0.04 0.00 0.00 34.50 30.87 2k8p s PRO 20 CO -0.13 -1.45 1.24 -0.85 0.04 0.00 0.00 177.00 175.85 2k8p n GLU 21 N 7.88 0.16 -1.18 4.56 0.28 -1.26 -5.17 120.64 125.91 2k8p n GLU 21 Ca 0.20 -0.75 -0.29 0.00 -0.16 0.00 0.00 57.16 56.16 2k8p n GLU 21 Cb 0.46 -0.28 0.16 0.00 1.43 0.00 0.00 31.44 33.21 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 0.13 0.72 0.96 3.44 0.04 -1.26 -5.04 135.00 133.99 2k8p s PRO 22 Ca 0.26 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.81 2k8p s PRO 22 Cb 0.22 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.16 2k8p s PRO 22 CO -0.10 -2.56 1.09 -1.25 0.04 0.00 0.00 177.00 174.22 2k8p s PRO 23 N -4.95 0.73 1.23 0.56 0.04 -1.26 -5.05 135.00 126.30 2k8p s PRO 23 Ca 0.65 0.64 -0.20 0.00 0.04 0.00 0.00 61.00 62.12 2k8p s PRO 23 Cb -0.18 -1.76 0.30 0.00 0.04 0.00 0.00 34.50 32.89 2k8p s PRO 23 CO 0.57 -2.56 1.11 -1.25 0.04 0.00 0.00 177.00 174.92 2k8p s PRO 24 N -4.95 -1.42 -0.29 0.56 0.04 -1.26 -5.08 135.00 122.60 2k8p s PRO 24 Ca 0.65 -0.14 0.02 0.00 0.04 0.00 0.00 61.00 61.56 2k8p s PRO 24 Cb -0.18 -1.58 0.20 0.00 0.04 0.00 0.00 34.50 32.97 2k8p s PRO 24 CO 0.57 -3.83 0.71 -2.00 0.04 0.00 0.00 177.00 172.50 2k8p s GLU 25 N -5.46 0.45 0.16 4.56 -6.30 -1.26 -5.17 118.70 105.68 2k8p s GLU 25 Ca 0.72 0.43 -0.17 0.00 -2.50 0.00 0.00 54.97 53.44 2k8p s GLU 25 Cb -0.09 0.20 0.04 0.00 0.00 0.00 0.00 34.13 34.28 2k8p s GLU 25 CO 0.56 -0.85 0.47 -0.48 0.02 0.00 0.00 175.26 174.98 2k8p s LEU 26 N 2.85 0.15 0.31 2.70 -0.00 -1.26 -5.19 118.68 118.24 2k8p s LEU 26 Ca 0.15 -0.34 0.03 0.00 -0.00 0.00 0.00 54.13 53.97 2k8p s LEU 26 Cb -0.08 2.05 -0.04 0.00 -0.00 0.00 0.00 46.19 48.12 2k8p s LEU 26 CO -0.25 -0.94 0.13 -1.61 -0.00 0.00 0.00 176.35 173.68 2k8p s GLU 27 N -3.82 1.61 0.33 1.48 2.02 -1.26 -5.18 118.70 113.89 2k8p s GLU 27 Ca 0.05 -1.92 0.04 0.00 0.02 0.00 0.00 54.97 53.16 2k8p s GLU 27 Cb 0.00 -0.28 -0.03 0.00 0.10 0.00 0.00 34.13 33.92 2k8p s GLU 27 CO -0.09 -0.40 0.16 -0.80 0.02 0.00 0.00 175.26 174.16 2k8p s ASN 28 N -3.41 1.92 0.36 -0.19 0.01 -1.26 -5.18 114.94 107.19 2k8p s ASN 28 Ca 0.34 -1.60 -0.16 0.00 -0.71 0.00 0.00 52.86 50.74 2k8p s ASN 28 Cb 0.06 0.41 0.06 0.00 0.41 0.00 0.00 41.25 42.19 2k8p s ASN 28 CO 0.16 -0.90 0.83 -3.20 -1.51 0.00 0.00 177.10 172.48 2k8p n ASN 29 N -1.08 -2.19 -3.97 -1.22 5.15 -1.26 -5.19 115.26 105.50 2k8p n ASN 29 Ca -0.00 -2.46 -0.10 0.00 -0.60 0.00 0.00 54.58 51.42 2k8p n ASN 29 Cb 0.65 3.63 -0.07 0.00 -0.53 0.00 0.00 39.78 43.46 2k8p n ASN 29 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2k8p s LYS 30 N -2.08 1.14 0.08 1.20 2.47 -1.26 -5.18 119.74 116.11 2k8p s LYS 30 Ca 0.17 -1.18 -0.16 0.00 -1.56 0.00 0.00 55.97 53.25 2k8p s LYS 30 Cb -0.05 0.37 0.03 0.00 -1.46 0.00 0.00 37.83 36.72 2k8p s LYS 30 CO 0.11 -0.41 0.37 0.95 0.16 0.00 0.00 175.35 176.52 2k8p s THR 31 N -3.97 0.08 0.24 3.43 -4.23 -1.26 -5.18 115.64 104.74 2k8p s THR 31 Ca 0.17 -0.62 0.01 0.00 -1.18 0.00 0.00 61.69 60.07 2k8p s THR 31 Cb 0.04 -1.08 -0.05 0.00 1.34 0.00 0.00 72.50 72.74 2k8p s THR 31 CO -0.00 -0.34 0.10 -0.04 -0.54 0.00 0.00 174.62 173.80 2k8p s MET 32 N -3.20 1.33 -0.19 3.99 -1.94 -1.26 -5.17 119.30 112.86 2k8p s MET 32 Ca -0.01 -1.71 -0.31 0.00 -1.71 0.00 0.00 55.69 51.95 2k8p s MET 32 Cb 0.01 -0.09 0.15 0.00 2.01 0.00 0.00 34.83 36.90 2k8p s MET 32 CO -0.08 -0.32 1.14 0.54 -0.01 0.00 0.00 175.02 176.30 2k8p s ASN 33 N -3.26 -0.22 0.02 3.03 2.20 -1.26 -5.18 114.94 110.27 2k8p s ASN 33 Ca 0.38 0.18 0.02 0.00 -0.94 0.00 0.00 52.86 52.49 2k8p s ASN 33 Cb 0.08 0.20 -0.02 0.00 -2.00 0.00 0.00 41.25 39.50 2k8p s ASN 33 CO 0.13 -0.25 -0.06 -0.13 -2.94 0.00 0.00 177.10 173.85 2k8p s ARG 34 N -1.52 0.42 0.02 3.55 0.52 -1.26 -5.16 118.95 115.53 2k8p s ARG 34 Ca 0.04 -0.53 0.02 0.00 -0.52 0.00 0.00 55.73 54.74 2k8p s ARG 34 Cb -0.01 -0.23 -0.02 0.00 0.52 0.00 0.00 34.95 35.21 2k8p s ARG 34 CO -0.03 0.05 -0.06 0.00 0.02 0.00 0.00 175.30 175.27 2k8p s ALA 35 N -0.96 0.47 0.06 2.13 0.00 -1.26 -5.16 121.76 117.04 2k8p s ALA 35 Ca -0.07 -0.53 -0.12 0.00 0.00 0.00 0.00 51.96 51.24 2k8p s ALA 35 Cb -0.07 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.05 2k8p s ALA 35 CO -0.00 0.02 0.26 -1.83 0.00 0.00 0.00 175.76 174.20 2k8p s GLU 36 N -0.99 0.80 0.32 0.00 -1.05 -1.26 -5.18 118.70 111.34 2k8p s GLU 36 Ca -0.06 -0.64 0.03 0.00 -0.15 0.00 0.00 54.97 54.15 2k8p s GLU 36 Cb -0.07 0.34 -0.04 0.00 -0.44 0.00 0.00 34.13 33.92 2k8p s GLU 36 CO 0.00 -0.25 0.12 -0.80 0.95 0.00 0.00 175.26 175.28 2k8p s ASN 37 N -2.27 1.93 0.00 0.83 0.01 -1.26 -5.17 114.94 109.00 2k8p s ASN 37 Ca -0.03 -1.52 0.00 0.00 -0.71 0.00 0.00 52.86 50.60 2k8p s ASN 37 Cb 0.00 0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.95 2k8p s ASN 37 CO -0.06 -0.82 0.00 0.61 -1.51 0.00 0.00 177.10 175.33 2k8p n GLY 38 N -0.66 3.37 0.00 0.66 0.00 -1.26 -5.16 105.19 102.14 2k8p n GLY 38 Ca -0.01 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.24 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 5.00 4.16 3.59 -0.02 0.00 -1.26 -5.16 105.19 111.49 2k8p n GLY 39 Ca 0.00 -1.12 -0.23 0.00 0.00 0.00 0.00 46.02 44.66 2k8p n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8p s ARG 40 N -3.00 2.07 0.96 1.61 3.00 -1.26 -5.14 118.95 117.19 2k8p s ARG 40 Ca 0.00 -1.57 -0.12 0.00 0.00 0.00 0.00 55.73 54.04 2k8p s ARG 40 Cb 0.00 -2.01 0.17 0.00 0.00 0.00 0.00 34.95 33.11 2k8p s ARG 40 CO 0.00 0.32 1.09 -1.25 0.00 0.00 0.00 175.30 175.47 2k8p s PRO 41 N -3.63 0.74 0.75 3.54 0.04 -1.26 -5.05 135.00 130.12 2k8p s PRO 41 Ca 0.31 0.63 -0.13 0.00 0.04 0.00 0.00 61.00 61.86 2k8p s PRO 41 Cb -0.05 -1.76 0.19 0.00 0.04 0.00 0.00 34.50 32.91 2k8p s PRO 41 CO 0.18 -2.55 0.66 -0.35 0.04 0.00 0.00 177.00 174.99 2k8p n PRO 42 N -4.07 -2.31 -4.58 0.56 -0.04 -1.26 -5.07 135.00 118.23 2k8p n PRO 42 Ca 0.06 -1.06 -0.24 0.00 -0.04 0.00 0.00 63.50 62.22 2k8p n PRO 42 Cb 0.56 -0.99 -0.16 0.00 -0.04 0.00 0.00 33.50 32.87 2k8p n PRO 42 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2k8p s HIS 43 N -2.20 1.40 0.52 0.54 3.76 -1.26 -5.14 115.29 112.90 2k8p s HIS 43 Ca 0.43 -0.47 -0.07 0.00 -0.15 0.00 0.00 55.06 54.81 2k8p s HIS 43 Cb -0.04 -1.01 -0.03 0.00 1.11 0.00 0.00 32.58 32.61 2k8p s HIS 43 CO 0.33 -0.23 0.85 -1.01 -0.85 0.00 0.00 174.74 173.83 2k8p s HIS 44 N 0.50 3.54 0.88 1.40 3.76 -1.26 -5.09 115.29 119.02 2k8p s HIS 44 Ca -0.11 0.89 -0.15 0.00 -0.15 0.00 0.00 55.06 55.55 2k8p s HIS 44 Cb -0.14 -2.44 0.22 0.00 1.11 0.00 0.00 32.58 31.32 2k8p s HIS 44 CO 0.03 -0.43 0.78 -0.35 -0.85 0.00 0.00 174.74 173.92 2k8p n PRO 45 N -2.41 -2.54 -3.82 8.40 -0.04 -1.26 -5.08 135.00 128.25 2k8p n PRO 45 Ca 0.02 -1.25 -0.24 0.00 -0.04 0.00 0.00 63.50 61.99 2k8p n PRO 45 Cb 0.55 -1.17 -0.03 0.00 -0.04 0.00 0.00 33.50 32.81 2k8p n PRO 45 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2k8p s PHE 46 N -2.42 2.27 0.16 0.54 0.40 -1.26 -5.15 117.98 112.52 2k8p s PHE 46 Ca 0.51 -0.65 0.07 0.00 -0.60 0.00 0.00 56.93 56.25 2k8p s PHE 46 Cb -0.05 -2.02 -0.04 0.00 0.51 0.00 0.00 43.02 41.41 2k8p s PHE 46 CO 0.39 -0.19 -0.14 -1.21 0.70 0.00 0.00 175.22 174.78 2k8p s GLU 47 N -4.13 1.17 -0.30 0.44 2.02 -1.26 -5.13 118.70 111.51 2k8p s GLU 47 Ca 0.41 -1.43 -0.01 0.00 0.02 0.00 0.00 54.97 53.95 2k8p s GLU 47 Cb -0.01 -0.96 0.13 0.00 0.10 0.00 0.00 34.13 33.38 2k8p s GLU 47 CO 0.24 0.17 0.24 0.99 0.02 0.00 0.00 175.26 176.92 2k8p s THR 48 N -2.71 -0.26 -0.26 3.63 2.01 -1.26 -5.11 115.64 111.69 2k8p s THR 48 Ca 0.16 -0.69 0.02 0.00 0.31 0.00 0.00 61.69 61.49 2k8p s THR 48 Cb -0.02 -0.97 0.06 0.00 0.01 0.00 0.00 72.50 71.58 2k8p s THR 48 CO 0.04 -0.60 -0.10 -0.54 -0.69 0.00 0.00 174.62 172.74 2k8p s LYS 49 N 2.12 2.30 0.12 4.92 -0.14 -1.26 -5.09 119.74 122.71 2k8p s LYS 49 Ca 0.10 -1.31 -0.24 0.00 -1.36 0.00 0.00 55.97 53.16 2k8p s LYS 49 Cb -0.15 -2.91 0.07 0.00 -1.68 0.00 0.00 37.83 33.15 2k8p s LYS 49 CO -0.30 -0.56 0.59 0.34 -0.76 0.00 0.00 175.35 174.67 2k8p s ASP 50 N 1.13 -0.55 -0.30 2.83 -1.08 -1.26 -5.14 116.67 112.30 2k8p s ASP 50 Ca -0.08 0.10 -0.02 0.00 -0.52 0.00 0.00 52.55 52.03 2k8p s ASP 50 Cb -0.20 0.57 0.12 0.00 -1.46 0.00 0.00 42.92 41.95 2k8p s ASP 50 CO -0.05 -0.89 0.19 -0.69 0.52 0.00 0.00 175.17 174.26 2k8p s VAL 51 N -3.27 -0.14 -0.34 1.11 1.01 -1.26 -5.07 120.40 112.44 2k8p s VAL 51 Ca -0.01 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.21 2k8p s VAL 51 Cb -0.01 -0.98 0.19 0.00 0.00 0.00 0.00 36.38 35.58 2k8p s VAL 51 CO -0.09 -0.69 0.66 -0.44 0.00 0.00 0.00 175.10 174.54 2k8p s SER 52 N 2.02 -1.46 -0.03 3.32 0.01 -1.26 -5.01 113.70 111.29 2k8p s SER 52 Ca 0.10 -0.25 0.04 0.00 1.31 0.00 0.00 55.95 57.15 2k8p s SER 52 Cb -0.16 1.88 -0.05 0.00 0.21 0.00 0.00 66.02 67.90 2k8p s SER 52 CO -0.30 -0.22 0.03 -1.84 0.41 0.00 0.00 173.24 171.33 2k8p n GLU 53 N 4.89 2.53 -1.50 12.44 0.28 -1.26 -4.66 120.64 133.35 2k8p n GLU 53 Ca 0.08 -0.01 -0.33 0.00 -0.16 0.00 0.00 57.16 56.74 2k8p n GLU 53 Cb 0.56 -1.10 0.07 0.00 1.43 0.00 0.00 31.44 32.39 2k8p n GLU 53 CO 0.00 0.00 0.00 2.48 -0.16 0.00 0.00 177.13 179.45 2k8p n TYR 54 N -2.03 3.12 -3.85 -1.84 0.18 -1.26 -4.97 117.16 106.52 2k8p n TYR 54 Ca -0.05 -2.84 -0.01 0.00 1.88 0.00 0.00 57.90 56.88 2k8p n TYR 54 Cb 0.50 -1.19 0.01 0.00 -0.38 0.00 0.00 39.34 38.28 2k8p n TYR 54 CO 0.00 0.00 0.00 -1.12 -2.08 0.00 0.00 176.86 173.66 2k8p s SER 55 N -2.23 -0.03 0.76 9.48 0.01 -1.26 -4.74 113.70 115.69 2k8p s SER 55 Ca 0.61 -0.45 -0.11 0.00 1.31 0.00 0.00 55.95 57.31 2k8p s SER 55 Cb 0.49 0.37 0.05 0.00 0.21 0.00 0.00 66.02 67.13 2k8p s SER 55 CO -0.01 -0.72 1.08 0.00 0.41 0.00 0.00 173.24 174.00 2k8p s ARG 57 N -5.07 4.16 -0.17 0.00 3.52 0.87 -4.92 118.95 117.34 2k8p s ARG 57 Ca 0.60 2.44 -0.29 0.00 -0.13 0.00 0.00 55.73 58.34 2k8p s ARG 57 Cb -0.15 -3.92 -0.03 0.00 -1.56 0.00 0.00 34.95 29.29 2k8p s ARG 57 CO 0.55 -0.86 1.55 -1.21 -0.81 0.00 0.00 175.30 174.51 2k8p s GLU 58 N 3.74 3.98 -0.28 5.12 2.02 -1.26 -3.92 118.70 128.09 2k8p s GLU 58 Ca 0.80 1.77 0.02 0.00 0.02 0.00 0.00 54.97 57.59 2k8p s GLU 58 Cb -0.40 -3.97 0.07 0.00 0.10 0.00 0.00 34.13 29.94 2k8p s GLU 58 CO 0.36 -1.07 -0.03 -1.17 0.02 0.00 0.00 175.26 173.37 2k8p s LEU 59 N 4.56 3.35 -0.11 1.80 2.96 -1.23 -5.02 118.68 124.99 2k8p s LEU 59 Ca 0.68 -1.53 -0.19 0.00 -0.22 0.00 0.00 54.13 52.88 2k8p s LEU 59 Cb -0.26 -1.37 -0.04 0.00 0.50 0.00 0.00 46.19 45.02 2k8p s LEU 59 CO 0.26 -0.27 0.50 -1.00 -1.32 0.00 0.00 176.35 174.52 2k8p s HIS 60 N 1.20 3.53 -0.04 5.38 3.76 -1.26 -0.13 115.29 127.73 2k8p s HIS 60 Ca -0.01 0.93 0.06 0.00 -0.15 0.00 0.00 55.06 55.89 2k8p s HIS 60 Cb -0.19 -2.57 -0.02 0.00 1.11 0.00 0.00 32.58 30.91 2k8p s HIS 60 CO -0.08 0.17 -0.22 -0.06 -0.85 0.00 0.00 174.74 173.70 2k8p s PHE 61 N 0.59 2.46 0.06 1.40 0.08 0.58 -4.94 117.98 118.22 2k8p s PHE 61 Ca 0.27 -0.43 0.06 0.00 0.12 0.00 0.00 56.93 56.95 2k8p s PHE 61 Cb -0.15 -1.56 -0.04 0.00 -0.57 0.00 0.00 43.02 40.70 2k8p s PHE 61 CO 0.11 -0.02 -0.12 0.99 -0.10 0.00 0.00 175.22 176.08 2k8p s THR 62 N -0.52 3.26 -0.24 0.64 2.01 -1.26 -0.81 115.64 118.71 2k8p s THR 62 Ca 0.07 -1.12 -0.29 0.00 0.31 0.00 0.00 61.69 60.67 2k8p s THR 62 Cb -0.11 -2.45 0.17 0.00 0.01 0.00 0.00 72.50 70.12 2k8p s THR 62 CO 0.01 0.26 1.22 -0.60 -0.69 0.00 0.00 174.62 174.82 2k8p s ARG 63 N -1.76 0.27 -0.24 4.92 3.52 -1.18 -4.96 118.95 119.52 2k8p s ARG 63 Ca 0.18 0.10 -0.19 0.00 -0.13 0.00 0.00 55.73 55.69 2k8p s ARG 63 Cb -0.11 0.13 -0.03 0.00 -1.56 0.00 0.00 34.95 33.38 2k8p s ARG 63 CO 0.09 -0.08 0.56 0.71 -0.81 0.00 0.00 175.30 175.78 2k8p s TYR 64 N -0.85 3.30 0.20 5.12 1.51 -1.26 -1.25 117.35 124.12 2k8p s TYR 64 Ca 0.05 0.74 -0.09 0.00 -1.01 0.00 0.00 57.07 56.76 2k8p s TYR 64 Cb -0.01 -2.76 -0.07 0.00 -0.11 0.00 0.00 41.96 39.01 2k8p s TYR 64 CO -0.05 -0.25 0.51 0.54 -1.11 0.00 0.00 175.55 175.18 2k8p s VAL 65 N 2.21 4.98 -0.12 0.71 0.11 -1.26 -4.99 120.40 122.04 2k8p s VAL 65 Ca 0.24 0.42 -0.07 0.00 -2.93 0.00 0.00 61.98 59.63 2k8p s VAL 65 Cb -0.16 -3.63 0.04 0.00 -1.53 0.00 0.00 36.38 31.11 2k8p s VAL 65 CO 0.09 -0.01 0.28 0.42 -3.33 0.00 0.00 175.10 172.56 2k8p s THR 66 N -1.74 -0.03 -0.28 5.04 -4.23 -1.26 -1.67 115.64 111.47 2k8p s THR 66 Ca 0.45 0.09 -0.04 0.00 -1.18 0.00 0.00 61.69 61.01 2k8p s THR 66 Cb -0.12 -0.43 0.10 0.00 1.34 0.00 0.00 72.50 73.39 2k8p s THR 66 CO 0.21 0.04 0.12 -0.62 -0.54 0.00 0.00 174.62 173.84 2k8p s ASP 67 N 0.95 3.49 0.00 3.99 2.15 -1.25 -5.03 116.67 120.98 2k8p s ASP 67 Ca -0.07 -1.27 0.00 0.00 0.43 0.00 0.00 52.55 51.65 2k8p s ASP 67 Cb -0.08 -0.40 0.00 0.00 -0.30 0.00 0.00 42.92 42.15 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 -1.57 0.00 2.66 0.00 -1.26 -4.23 105.19 105.99 2k8p n GLY 68 Ca -0.06 -1.81 0.07 0.00 0.00 0.00 0.00 46.02 44.22 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 0.17 -3.27 1.61 -0.04 -1.26 -4.75 135.00 127.46 2k8p n PRO 69 Ca 0.00 0.17 -0.19 0.00 -0.04 0.00 0.00 63.50 63.44 2k8p n PRO 69 Cb 0.00 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 -4.28 0.32 0.35 0.00 3.00 0.24 -3.80 118.95 114.78 2k8p s ARG 71 Ca 0.52 -0.12 -0.28 0.00 0.00 0.00 0.00 55.73 55.85 2k8p s ARG 71 Cb -0.07 0.14 -0.12 0.00 0.00 0.00 0.00 34.95 34.90 2k8p s ARG 71 CO 0.31 -0.06 1.28 0.45 0.00 0.00 0.00 175.30 177.28 2k8p n SER 72 N 2.22 2.72 0.09 0.23 2.88 -0.67 -0.23 113.62 120.86 2k8p n SER 72 Ca -0.18 1.19 -0.04 0.00 -1.33 0.00 0.00 58.87 58.52 2k8p n SER 72 Cb 0.57 -1.48 -0.03 0.00 -0.75 0.00 0.00 64.21 62.52 2k8p n SER 72 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k8p h ALA 73 N 2.48 0.53 -2.25 -1.46 0.00 -1.83 -3.45 119.26 113.27 2k8p h ALA 73 Ca -0.46 -0.75 -0.18 0.00 0.00 0.00 0.00 54.91 53.53 2k8p h ALA 73 Cb 1.28 -0.13 -0.15 0.00 0.00 0.00 0.00 17.79 18.79 2k8p h ALA 73 CO 0.62 1.02 -0.68 0.15 0.00 0.00 0.00 179.25 180.36 2k8p s LYS 74 N -2.93 0.75 0.82 0.00 1.02 -1.26 -5.12 119.74 113.02 2k8p s LYS 74 Ca 0.01 -1.30 -0.11 0.00 0.02 0.00 0.00 55.97 54.59 2k8p s LYS 74 Cb 0.10 0.02 0.09 0.00 -0.52 0.00 0.00 37.83 37.51 2k8p s LYS 74 CO 0.79 -0.08 1.09 -1.25 -0.92 0.00 0.00 175.35 174.98 2k8p s PRO 75 N -3.89 1.83 -0.14 -1.68 0.04 -1.26 -4.69 135.00 125.21 2k8p s PRO 75 Ca 0.11 1.02 -0.00 0.00 0.04 0.00 0.00 61.00 62.17 2k8p s PRO 75 Cb 0.07 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.74 2k8p s PRO 75 CO -0.06 -1.90 -0.14 0.54 0.04 0.00 0.00 177.00 175.48 2k8p s VAL 76 N -2.92 2.93 -0.39 -0.36 0.11 -0.38 -4.92 120.40 114.47 2k8p s VAL 76 Ca 0.62 -0.70 -0.18 0.00 -2.93 0.00 0.00 61.98 58.79 2k8p s VAL 76 Cb -0.17 -2.23 0.01 0.00 -1.53 0.00 0.00 36.38 32.46 2k8p s VAL 76 CO 0.56 0.52 0.52 -0.89 -3.33 0.00 0.00 175.10 172.48 2k8p s THR 77 N 0.50 5.00 0.12 5.04 2.01 -1.26 -3.11 115.64 123.95 2k8p s THR 77 Ca -0.09 0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.02 2k8p s THR 77 Cb -0.16 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2k8p s THR 77 CO 0.04 -0.37 0.02 -1.83 -0.69 0.00 0.00 174.62 171.79 2k8p s GLU 78 N 2.41 2.58 -0.19 4.92 -1.05 0.00 -4.90 118.70 122.47 2k8p s GLU 78 Ca 0.17 -0.90 -0.08 0.00 -0.15 0.00 0.00 54.97 54.01 2k8p s GLU 78 Cb -0.16 -2.52 -0.04 0.00 -0.44 0.00 0.00 34.13 30.97 2k8p s GLU 78 CO 0.15 0.51 0.07 -1.17 0.95 0.00 0.00 175.26 175.77 2k8p s LEU 79 N -2.60 3.83 0.07 1.83 0.20 -1.26 -0.30 118.68 120.45 2k8p s LEU 79 Ca 0.27 0.07 0.04 0.00 0.69 0.00 0.00 54.13 55.20 2k8p s LEU 79 Cb -0.11 -1.98 -0.04 0.00 -0.43 0.00 0.00 46.19 43.63 2k8p s LEU 79 CO 0.19 0.15 0.00 -0.69 -0.29 0.00 0.00 176.35 175.71 2k8p s VAL 80 N 0.52 4.06 -0.31 1.68 1.01 0.81 -4.17 120.40 124.01 2k8p s VAL 80 Ca 0.04 -0.88 -0.13 0.00 0.00 0.00 0.00 61.98 61.01 2k8p s VAL 80 Cb -0.13 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 2k8p s VAL 80 CO 0.01 0.19 0.25 0.00 0.00 0.00 0.00 175.10 175.55 2k8p s SER 82 N 1.73 -0.19 0.00 0.00 0.01 -1.25 -5.05 113.70 108.95 2k8p s SER 82 Ca 0.08 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2k8p s SER 82 Cb -0.16 0.72 0.00 0.00 0.21 0.00 0.00 66.02 66.78 2k8p s SER 82 CO 0.11 -1.35 0.00 0.61 0.41 0.00 0.00 173.24 173.02 2k8p n GLY 83 N -0.48 0.37 3.62 3.44 0.00 -1.26 -0.09 105.19 110.78 2k8p n GLY 83 Ca -0.05 -1.64 -0.26 0.00 0.00 0.00 0.00 46.02 44.07 2k8p n GLY 83 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k8p s GLN 84 N -3.58 1.99 0.08 1.61 0.00 -1.26 -4.62 119.66 113.87 2k8p s GLN 84 Ca 0.00 -1.91 0.02 0.00 -0.00 0.00 0.00 55.36 53.47 2k8p s GLN 84 Cb 0.00 -1.80 -0.04 0.00 0.00 0.00 0.00 33.01 31.18 2k8p s GLN 84 CO 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 175.29 175.28 2k8p n GLY 86 N 0.41 -3.50 3.74 0.00 0.00 -1.26 -4.98 105.19 99.60 2k8p n GLY 86 Ca -0.15 -1.14 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 2k8p n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k8p s PRO 87 N -4.18 1.71 0.00 1.61 0.04 -1.26 -4.99 135.00 127.93 2k8p s PRO 87 Ca 0.44 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.46 2k8p s PRO 87 Cb -0.08 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.61 2k8p s PRO 87 CO 0.37 -1.97 0.62 0.00 0.04 0.00 0.00 177.00 176.06 2k8p n ALA 88 N -3.72 1.97 -1.00 8.56 0.00 -1.26 -5.15 120.51 119.90 2k8p n ALA 88 Ca 0.08 -0.38 -0.00 0.00 0.00 0.00 0.00 53.44 53.13 2k8p n ALA 88 Cb 0.54 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.74 2k8p n ALA 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k8p n ARG 89 N 0.00 -0.34 -0.82 0.00 1.74 -1.26 -5.05 116.66 110.92 2k8p n ARG 89 Ca -0.16 -0.01 -0.31 0.00 -0.77 0.00 0.00 57.85 56.61 2k8p n ARG 89 Cb 0.52 -0.01 0.27 0.00 -1.02 0.00 0.00 32.46 32.22 2k8p n ARG 89 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2k8p s LEU 90 N 0.00 -0.12 0.93 0.55 2.01 -1.26 -4.98 118.68 115.81 2k8p s LEU 90 Ca 0.00 0.59 -0.10 0.00 0.01 0.00 0.00 54.13 54.64 2k8p s LEU 90 Cb -0.00 -2.13 0.15 0.00 0.01 0.00 0.00 46.19 44.22 2k8p s LEU 90 CO 0.00 -4.75 1.14 -0.76 1.01 0.00 0.00 176.35 173.00 2k8p s LEU 91 N -7.35 2.71 0.55 1.79 1.02 -1.26 -4.90 118.68 111.24 2k8p s LEU 91 Ca 0.71 2.13 0.33 0.00 0.02 0.00 0.00 54.13 57.33 2k8p s LEU 91 Cb -0.09 -4.49 1.39 0.00 0.02 0.00 0.00 46.19 43.02 2k8p s LEU 91 CO 0.56 -3.15 1.99 1.55 0.02 0.00 0.00 176.35 177.32 2k8p h PRO 92 N -1.90 0.00 0.00 1.29 0.13 -2.06 -3.33 132.00 126.13 2k8p h PRO 92 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2k8p h PRO 92 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2k8p h PRO 92 CO 0.42 0.02 -0.20 0.09 -0.23 0.00 0.00 178.00 178.10 2k8p n ASN 93 N -3.12 0.68 -2.87 1.44 3.02 -1.26 -5.06 115.26 108.08 2k8p n ASN 93 Ca 0.00 0.38 -0.07 0.00 -0.03 0.00 0.00 54.58 54.86 2k8p n ASN 93 Cb 0.30 -0.64 0.01 0.00 -0.61 0.00 0.00 39.78 38.84 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 -2.79 -3.09 -2.08 5.41 0.00 -1.25 -5.03 120.51 111.67 2k8p n ALA 94 Ca -0.03 0.85 -0.18 0.00 0.00 0.00 0.00 53.44 54.09 2k8p n ALA 94 Cb 0.10 -2.64 -0.00 0.00 0.00 0.00 0.00 19.45 16.92 2k8p n ALA 94 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2k8p s ILE 95 N -2.14 2.97 0.00 0.00 -4.36 -1.26 -4.79 121.20 111.62 2k8p s ILE 95 Ca 0.17 -1.08 0.00 0.00 -0.26 0.00 0.00 60.65 59.47 2k8p s ILE 95 Cb -0.04 -3.02 0.00 0.00 1.25 0.00 0.00 42.46 40.65 2k8p s ILE 95 CO 0.75 -0.01 0.00 0.61 0.24 0.00 0.00 174.94 176.54 2k8p n GLY 96 N -1.77 1.55 1.51 6.27 0.00 -1.26 -4.94 105.19 106.54 2k8p n GLY 96 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2k8p n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8p n ARG 97 N -0.55 0.00 0.00 1.61 1.74 -1.26 -5.14 116.66 113.07 2k8p n ARG 97 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2k8p n ARG 97 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2k8p n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k8p n GLY 98 N -1.34 1.07 3.84 -0.13 0.00 -1.26 -5.00 105.19 102.38 2k8p n GLY 98 Ca 0.00 -0.98 -0.32 0.00 0.00 0.00 0.00 46.02 44.72 2k8p n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8p s LYS 99 N 0.00 3.93 0.01 1.61 1.02 -1.26 -5.09 119.74 119.96 2k8p s LYS 99 Ca 0.00 0.93 0.00 0.00 0.02 0.00 0.00 55.97 56.92 2k8p s LYS 99 Cb 0.00 -2.14 0.00 0.00 -0.52 0.00 0.00 37.83 35.17 2k8p s LYS 99 CO 0.00 -0.27 0.00 0.91 -0.92 0.00 0.00 175.35 175.07 2k8p n TRP 100 N -1.60 -0.27 0.01 3.18 8.01 -1.26 -5.11 117.44 120.40 2k8p n TRP 100 Ca 0.06 -0.03 0.00 0.00 -1.31 0.00 0.00 57.50 56.23 2k8p n TRP 100 Cb 0.54 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.84 2k8p n TRP 100 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.69 177.59 2k8p n TRP 101 N -0.11 -1.02 -1.73 -5.99 5.03 -1.26 -5.13 117.44 107.22 2k8p n TRP 101 Ca -0.00 0.03 -0.31 0.00 3.03 0.00 0.00 57.50 60.25 2k8p n TRP 101 Cb 0.01 0.55 0.03 0.00 -1.03 0.00 0.00 31.31 30.87 2k8p n TRP 101 CO 0.00 0.00 0.00 1.03 -0.03 0.00 0.00 177.69 178.69 2k8p s ARG 102 N -1.03 3.21 0.90 -0.99 3.00 -1.26 -5.05 118.95 117.73 2k8p s ARG 102 Ca 0.00 0.81 -0.12 0.00 0.00 0.00 0.00 55.73 56.42 2k8p s ARG 102 Cb 0.00 -2.03 0.13 0.00 0.00 0.00 0.00 34.95 33.05 2k8p s ARG 102 CO 0.00 -0.86 1.09 -1.25 0.00 0.00 0.00 175.30 174.28 2k8p s PRO 103 N -5.14 1.24 -0.32 3.54 0.04 -1.26 -4.97 135.00 128.14 2k8p s PRO 103 Ca 0.57 0.81 0.10 0.00 0.04 0.00 0.00 61.00 62.52 2k8p s PRO 103 Cb -0.12 -1.81 0.65 0.00 0.04 0.00 0.00 34.50 33.26 2k8p s PRO 103 CO 0.54 -2.25 1.70 0.45 0.04 0.00 0.00 177.00 177.48 2k8p n SER 104 N -3.89 4.03 -3.25 6.66 2.88 -1.26 -4.98 113.62 113.82 2k8p n SER 104 Ca 0.07 -3.37 -0.14 0.00 -1.33 0.00 0.00 58.87 54.09 2k8p n SER 104 Cb 0.55 -0.71 0.01 0.00 -0.75 0.00 0.00 64.21 63.31 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 -0.58 -1.04 0.17 0.46 0.00 -1.26 -4.86 105.19 98.08 2k8p n GLY 105 Ca 0.40 0.82 0.13 0.00 0.00 0.00 0.00 46.02 47.37 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 0.95 0.00 -5.27 1.61 0.13 -2.04 -3.42 132.00 123.96 2k8p h PRO 106 Ca -0.24 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.27 2k8p h PRO 106 Cb 1.16 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.16 2k8p h PRO 106 CO 0.28 0.00 -0.23 -0.51 -0.23 0.00 0.00 178.00 177.30 2k8p s ASP 107 N -4.59 6.32 0.95 1.44 1.01 -1.26 -5.08 116.67 115.46 2k8p s ASP 107 Ca 0.03 0.38 -0.01 0.00 0.71 0.00 0.00 52.55 53.66 2k8p s ASP 107 Cb 0.09 -2.21 0.01 0.00 1.01 0.00 0.00 42.92 41.82 2k8p s ASP 107 CO 0.42 -0.12 0.05 0.49 0.21 0.00 0.00 175.17 176.22 2k8p n PHE 108 N 4.90 -3.94 -3.90 4.23 3.72 -1.26 -4.50 117.46 116.70 2k8p n PHE 108 Ca -0.09 -0.04 0.01 0.00 -0.05 0.00 0.00 57.45 57.28 2k8p n PHE 108 Cb 0.51 -0.04 0.01 0.00 -0.94 0.00 0.00 39.48 39.02 2k8p n PHE 108 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2k8p n ARG 109 N -1.10 0.17 -4.75 -1.08 1.74 -1.17 -4.66 116.66 105.81 2k8p n ARG 109 Ca 0.01 -0.57 -0.26 0.00 -0.77 0.00 0.00 57.85 56.26 2k8p n ARG 109 Cb 0.02 0.89 -0.16 0.00 -1.02 0.00 0.00 32.46 32.18 2k8p n ARG 109 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k8p s ILE 111 N 0.38 3.74 1.10 0.00 -4.36 0.69 -4.89 121.20 117.86 2k8p s ILE 111 Ca -0.11 -0.74 -0.16 0.00 -0.26 0.00 0.00 60.65 59.38 2k8p s ILE 111 Cb -0.14 -2.63 0.24 0.00 1.25 0.00 0.00 42.46 41.17 2k8p s ILE 111 CO 0.04 0.39 1.10 -2.16 0.24 0.00 0.00 174.94 174.55 2k8p s PRO 112 N -1.44 -0.41 0.04 0.37 0.04 -1.26 -1.49 135.00 130.86 2k8p s PRO 112 Ca 0.17 0.22 0.01 0.00 0.04 0.00 0.00 61.00 61.44 2k8p s PRO 112 Cb -0.11 -1.67 -0.00 0.00 0.04 0.00 0.00 34.50 32.76 2k8p s PRO 112 CO 0.08 -3.23 0.04 -3.47 0.04 0.00 0.00 177.00 170.46 2k8p n ASP 113 N -4.47 -0.12 -4.54 6.66 -0.08 -1.19 -4.51 116.55 108.30 2k8p n ASP 113 Ca 0.09 -1.28 -0.40 0.00 -1.51 0.00 0.00 54.79 51.69 2k8p n ASP 113 Cb 0.58 0.25 0.03 0.00 2.34 0.00 0.00 41.12 44.32 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 -0.08 0.88 -3.44 -0.67 0.63 -1.26 -4.61 116.66 108.10 2k8p n ARG 114 Ca 0.01 0.33 -0.22 0.00 -0.92 0.00 0.00 57.85 57.05 2k8p n ARG 114 Cb 0.08 -1.88 0.01 0.00 0.45 0.00 0.00 32.46 31.12 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 -1.49 1.99 -0.15 -0.14 1.51 -1.26 -0.51 117.35 117.30 2k8p s TYR 115 Ca 0.68 -0.66 -0.04 0.00 -1.01 0.00 0.00 57.07 56.03 2k8p s TYR 115 Cb -0.50 -2.13 0.07 0.00 -0.11 0.00 0.00 41.96 39.29 2k8p s TYR 115 CO 0.54 -0.58 0.22 0.50 -1.11 0.00 0.00 175.55 175.12 2k8p s ARG 116 N -4.36 0.13 -0.26 -0.62 3.52 0.10 -4.51 118.95 112.95 2k8p s ARG 116 Ca 0.49 0.49 -0.23 0.00 -0.13 0.00 0.00 55.73 56.35 2k8p s ARG 116 Cb -0.04 -0.56 -0.01 0.00 -1.56 0.00 0.00 34.95 32.78 2k8p s ARG 116 CO 0.30 -0.44 0.75 0.00 -0.81 0.00 0.00 175.30 175.10 2k8p s ALA 117 N 2.35 3.61 -0.09 6.12 0.00 -1.26 -1.97 121.76 130.52 2k8p s ALA 117 Ca 0.04 -0.30 -0.00 0.00 0.00 0.00 0.00 51.96 51.69 2k8p s ALA 117 Cb -0.13 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 2k8p s ALA 117 CO -0.09 -0.94 -0.06 -1.14 0.00 0.00 0.00 175.76 173.53 2k8p s GLN 118 N 2.74 2.99 -0.26 0.00 0.74 -0.12 -4.88 119.66 120.88 2k8p s GLN 118 Ca 0.31 -0.53 -0.14 0.00 0.05 0.00 0.00 55.36 55.05 2k8p s GLN 118 Cb -0.15 -2.69 -0.04 0.00 1.10 0.00 0.00 33.01 31.23 2k8p s GLN 118 CO 0.09 0.57 0.33 1.03 -0.55 0.00 0.00 175.29 176.75 2k8p s ARG 119 N -0.54 4.04 0.10 1.67 0.52 -1.26 -0.27 118.95 123.22 2k8p s ARG 119 Ca 0.08 -0.01 0.01 0.00 -0.52 0.00 0.00 55.73 55.29 2k8p s ARG 119 Cb -0.12 -3.62 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 2k8p s ARG 119 CO 0.02 -0.19 0.25 0.54 0.02 0.00 0.00 175.30 175.95 2k8p s VAL 120 N 1.79 5.35 -0.34 3.52 0.11 0.64 -4.91 120.40 126.57 2k8p s VAL 120 Ca 0.14 -0.50 -0.04 0.00 -2.93 0.00 0.00 61.98 58.65 2k8p s VAL 120 Cb -0.15 -3.68 0.06 0.00 -1.53 0.00 0.00 36.38 31.07 2k8p s VAL 120 CO 0.09 0.03 0.08 -1.58 -3.33 0.00 0.00 175.10 170.39 2k8p s GLN 121 N -2.84 2.43 0.12 1.54 0.74 -1.26 -1.25 119.66 119.14 2k8p s GLN 121 Ca 0.35 -1.33 -0.13 0.00 0.05 0.00 0.00 55.36 54.30 2k8p s GLN 121 Cb -0.12 -3.36 -0.06 0.00 1.10 0.00 0.00 33.01 30.56 2k8p s GLN 121 CO 0.28 -0.72 0.49 -0.51 -0.55 0.00 0.00 175.29 174.28 2k8p s LEU 122 N 1.29 4.34 0.10 3.68 1.43 0.84 -2.58 118.68 127.78 2k8p s LEU 122 Ca -0.02 0.97 0.07 0.00 -1.03 0.00 0.00 54.13 54.13 2k8p s LEU 122 Cb -0.20 -3.15 -0.04 0.00 0.03 0.00 0.00 46.19 42.83 2k8p s LEU 122 CO -0.00 0.13 -0.12 -0.76 0.23 0.00 0.00 176.35 175.83 2k8p s LEU 123 N -1.93 2.94 0.27 1.79 2.01 0.68 -1.29 118.68 123.15 2k8p s LEU 123 Ca 0.36 -0.41 0.10 0.00 0.01 0.00 0.00 54.13 54.19 2k8p s LEU 123 Cb -0.15 -1.74 -0.05 0.00 0.01 0.00 0.00 46.19 44.26 2k8p s LEU 123 CO 0.19 0.19 -0.07 0.00 1.01 0.00 0.00 176.35 177.67 2k8p s PRO 125 N -3.62 -0.36 -0.55 0.00 0.04 -1.26 -4.78 135.00 124.47 2k8p s PRO 125 Ca 0.31 0.25 -0.27 0.00 0.04 0.00 0.00 61.00 61.33 2k8p s PRO 125 Cb -0.06 -1.67 -0.09 0.00 0.04 0.00 0.00 34.50 32.72 2k8p s PRO 125 CO 0.18 -3.20 2.45 0.41 0.04 0.00 0.00 177.00 176.88 2k8p n GLY 126 N -1.00 0.12 0.00 0.56 0.00 -1.26 -1.79 105.19 101.82 2k8p n GLY 126 Ca 0.08 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.83 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 6.08 0.92 3.71 -0.02 0.00 -1.26 -5.14 105.19 109.49 2k8p n GLY 127 Ca 0.41 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.11 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 2.16 0.28 1.61 0.41 -0.74 -5.17 118.70 117.26 2k8p s GLU 128 Ca 0.00 -2.38 0.12 0.00 -0.41 0.00 0.00 54.97 52.29 2k8p s GLU 128 Cb 0.00 -1.24 -0.05 0.00 -1.78 0.00 0.00 34.13 31.06 2k8p s GLU 128 CO 0.00 -0.44 -0.17 0.00 -0.49 0.00 0.00 175.26 174.16 2k8p s ALA 129 N -2.98 2.81 0.96 5.21 0.00 -1.26 -4.74 121.76 121.76 2k8p s ALA 129 Ca 0.07 -1.87 -0.12 0.00 0.00 0.00 0.00 51.96 50.04 2k8p s ALA 129 Cb 0.01 -0.30 0.16 0.00 0.00 0.00 0.00 23.12 22.99 2k8p s ALA 129 CO 0.05 0.26 1.09 -1.25 0.00 0.00 0.00 175.76 175.92 2k8p s PRO 130 N -3.53 0.77 0.06 0.00 0.04 -1.26 -4.35 135.00 126.73 2k8p s PRO 130 Ca 0.30 0.65 -0.10 0.00 0.04 0.00 0.00 61.00 61.89 2k8p s PRO 130 Cb -0.05 -1.77 0.01 0.00 0.04 0.00 0.00 34.50 32.73 2k8p s PRO 130 CO 0.16 -2.53 0.23 0.50 0.04 0.00 0.00 177.00 175.39 2k8p s ARG 131 N -4.95 0.78 -0.08 4.56 3.00 -0.41 -4.98 118.95 116.87 2k8p s ARG 131 Ca 0.64 -0.69 -0.04 0.00 -1.00 0.00 0.00 55.73 54.64 2k8p s ARG 131 Cb -0.18 0.32 -0.04 0.00 0.00 0.00 0.00 34.95 35.05 2k8p s ARG 131 CO 0.57 -0.24 0.08 0.00 0.00 0.00 0.00 175.30 175.71 2k8p s ALA 132 N -2.97 3.59 -0.06 6.12 0.00 -1.26 -0.11 121.76 127.07 2k8p s ALA 132 Ca -0.02 -0.75 -0.01 0.00 0.00 0.00 0.00 51.96 51.18 2k8p s ALA 132 Cb 0.01 -1.70 0.03 0.00 0.00 0.00 0.00 23.12 21.46 2k8p s ALA 132 CO -0.06 0.63 0.01 0.50 0.00 0.00 0.00 175.76 176.83 2k8p s ARG 133 N -1.14 0.47 0.20 0.00 3.00 -0.38 -4.95 118.95 116.16 2k8p s ARG 133 Ca 0.16 0.13 -0.24 0.00 -1.00 0.00 0.00 55.73 54.78 2k8p s ARG 133 Cb -0.12 -0.81 -0.08 0.00 0.00 0.00 0.00 34.95 33.94 2k8p s ARG 133 CO 0.06 -0.26 0.78 0.21 0.00 0.00 0.00 175.30 176.09 2k8p s LYS 134 N 1.76 4.48 -0.07 5.12 2.20 -1.26 -0.26 119.74 131.70 2k8p s LYS 134 Ca 0.01 1.09 0.00 0.00 -0.36 0.00 0.00 55.97 56.72 2k8p s LYS 134 Cb -0.13 -3.10 0.02 0.00 -1.51 0.00 0.00 37.83 33.12 2k8p s LYS 134 CO -0.04 0.49 -0.06 0.14 -0.36 0.00 0.00 175.35 175.51 2k8p s VAL 135 N -1.31 0.80 -0.56 4.02 -7.23 0.63 -4.96 120.40 111.80 2k8p s VAL 135 Ca 0.39 -0.21 -0.23 0.00 -1.81 0.00 0.00 61.98 60.12 2k8p s VAL 135 Cb -0.21 -0.81 0.05 0.00 0.56 0.00 0.00 36.38 35.97 2k8p s VAL 135 CO 0.24 0.30 0.87 -0.60 -0.31 0.00 0.00 175.10 175.61 2k8p s ARG 136 N 1.27 3.25 -0.03 4.82 3.52 -1.26 -0.94 118.95 129.58 2k8p s ARG 136 Ca -0.04 -0.50 0.07 0.00 -0.13 0.00 0.00 55.73 55.13 2k8p s ARG 136 Cb -0.14 -4.09 -0.02 0.00 -1.56 0.00 0.00 34.95 29.14 2k8p s ARG 136 CO -0.02 -1.48 -0.24 -0.51 -0.81 0.00 0.00 175.30 172.24 2k8p s LEU 137 N 3.66 2.15 0.30 -0.88 1.02 -0.83 -4.95 118.68 119.14 2k8p s LEU 137 Ca 0.26 -0.44 -0.28 0.00 0.02 0.00 0.00 54.13 53.69 2k8p s LEU 137 Cb -0.15 -1.37 -0.14 0.00 0.02 0.00 0.00 46.19 44.55 2k8p s LEU 137 CO 0.16 0.31 1.05 0.52 0.02 0.00 0.00 176.35 178.42 2k8p n VAL 138 N 2.49 1.98 -0.12 -1.59 0.31 -1.26 0.01 118.33 120.16 2k8p n VAL 138 Ca -0.16 -0.50 -0.16 0.00 -0.01 0.00 0.00 64.34 63.51 2k8p n VAL 138 Cb 0.51 -1.08 -0.12 0.00 -0.91 0.00 0.00 33.84 32.25 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 0.25 1.48 -4.14 3.52 0.00 0.33 -4.14 120.51 117.82 2k8p n ALA 139 Ca 0.09 -1.07 -0.20 0.00 0.00 0.00 0.00 53.44 52.26 2k8p n ALA 139 Cb 0.32 -0.07 -0.07 0.00 0.00 0.00 0.00 19.45 19.64 2k8p n ALA 139 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2k8p n SER 140 N -3.15 -0.76 -3.63 0.00 7.64 -0.67 -4.99 113.62 108.06 2k8p n SER 140 Ca -0.42 -2.99 -0.07 0.00 1.01 0.00 0.00 58.87 56.40 2k8p n SER 140 Cb 0.98 1.70 -0.07 0.00 -1.01 0.00 0.00 64.21 65.81 2k8p n SER 140 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8p s LYS 142 N -0.05 1.09 -0.33 0.00 0.00 -0.55 -2.71 119.74 117.19 2k8p s LYS 142 Ca 0.04 -1.24 -0.03 0.00 0.00 0.00 0.00 55.97 54.74 2k8p s LYS 142 Cb -0.04 -1.11 0.06 0.00 0.00 0.00 0.00 37.83 36.73 2k8p s LYS 142 CO -0.08 0.23 0.07 0.00 0.00 0.00 0.00 175.35 175.57 2k8p s LYS 144 N 1.26 0.83 -0.01 0.00 0.00 -0.08 -4.85 119.74 116.90 2k8p s LYS 144 Ca -0.01 -0.68 -0.30 0.00 0.00 0.00 0.00 55.97 54.98 2k8p s LYS 144 Cb -0.20 0.35 -0.08 0.00 0.00 0.00 0.00 37.83 37.90 2k8p s LYS 144 CO -0.01 -0.27 1.91 0.50 0.00 0.00 0.00 175.35 177.48 2k8p s ARG 145 N -3.10 4.07 -0.02 1.78 3.52 -1.26 -3.05 118.95 120.89 2k8p s ARG 145 Ca -0.01 2.46 -0.03 0.00 -0.13 0.00 0.00 55.73 58.02 2k8p s ARG 145 Cb 0.01 -4.14 -0.27 0.00 -1.56 0.00 0.00 34.95 28.99 2k8p s ARG 145 CO -0.07 -1.02 0.77 1.25 -0.81 0.00 0.00 175.30 175.42 2k8p h LEU 146 N 10.89 0.37 0.00 -0.88 5.85 -1.83 -3.46 115.31 126.25 2k8p h LEU 146 Ca -0.46 -0.57 0.12 0.00 0.84 0.00 0.00 57.88 57.81 2k8p h LEU 146 Cb 1.22 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 2k8p h LEU 146 CO 0.95 1.48 -0.16 0.41 -0.34 0.00 0.00 178.44 180.78 2k8p n THR 147 N -3.43 0.00 -3.59 1.05 -1.04 -1.26 -4.97 114.28 101.04 2k8p n THR 147 Ca -0.19 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.81 2k8p n THR 147 Cb 1.05 -0.15 -0.06 0.00 -1.82 0.00 0.00 70.33 69.35 2k8p n THR 147 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k8p s ARG 148 N -0.69 0.38 0.31 -2.82 1.70 -1.26 -5.16 118.95 111.40 2k8p s ARG 148 Ca 0.00 0.72 0.08 0.00 -0.47 0.00 0.00 55.73 56.06 2k8p s ARG 148 Cb 0.00 0.18 -0.03 0.00 -0.57 0.00 0.00 34.95 34.53 2k8p s ARG 148 CO 0.00 -0.09 0.22 -0.06 -1.08 0.00 0.00 175.30 174.29 2k8p s PHE 149 N 1.64 2.92 -0.23 5.89 0.40 -1.26 -5.08 117.98 122.26 2k8p s PHE 149 Ca -0.08 -0.25 -0.28 0.00 -0.60 0.00 0.00 56.93 55.72 2k8p s PHE 149 Cb -0.04 -1.62 0.14 0.00 0.51 0.00 0.00 43.02 42.01 2k8p s PHE 149 CO -0.16 0.33 1.11 -1.58 0.70 0.00 0.00 175.22 175.63 2k8p s HIS 150 N -2.28 -0.31 0.05 0.36 2.46 -1.26 -5.17 115.29 109.15 2k8p s HIS 150 Ca 0.38 0.61 0.06 0.00 0.47 0.00 0.00 55.06 56.57 2k8p s HIS 150 Cb -0.06 0.44 -0.04 0.00 -0.13 0.00 0.00 32.58 32.79 2k8p s HIS 150 CO 0.25 -0.23 -0.10 1.21 -2.47 0.00 0.00 174.74 173.40 2k8p s ASN 151 N -0.64 4.37 -0.28 9.88 2.47 -1.26 -5.12 114.94 124.36 2k8p s ASN 151 Ca 0.02 -0.30 -0.26 0.00 0.42 0.00 0.00 52.86 52.74 2k8p s ASN 151 Cb -0.02 -0.88 0.18 0.00 -1.45 0.00 0.00 41.25 39.07 2k8p s ASN 151 CO -0.04 0.23 1.33 0.00 -3.72 0.00 0.00 177.10 174.90 2k8p s GLN 152 N -1.76 0.17 0.01 0.43 -2.07 -1.26 -5.18 119.66 109.99 2k8p s GLN 152 Ca 0.18 0.15 -0.16 0.00 -1.82 0.00 0.00 55.36 53.71 2k8p s GLN 152 Cb -0.11 0.08 0.03 0.00 -1.09 0.00 0.00 33.01 31.92 2k8p s GLN 152 CO 0.10 -0.03 0.36 -1.12 -1.32 0.00 0.00 175.29 173.27 2k8p s SER 153 N -0.24 -0.23 -0.23 12.60 0.01 -1.26 -5.17 113.70 119.18 2k8p s SER 153 Ca 0.06 0.04 -0.36 0.00 1.31 0.00 0.00 55.95 57.00 2k8p s SER 153 Cb -0.04 0.36 0.15 0.00 0.21 0.00 0.00 66.02 66.70 2k8p s SER 153 CO -0.11 -0.55 1.28 -1.61 0.41 0.00 0.00 173.24 172.66 2k8p s GLU 154 N -1.88 0.19 -0.06 12.44 2.02 -1.26 -5.18 118.70 124.96 2k8p s GLU 154 Ca -0.09 -0.06 -0.22 0.00 0.02 0.00 0.00 54.97 54.61 2k8p s GLU 154 Cb -0.03 0.09 0.05 0.00 0.10 0.00 0.00 34.13 34.34 2k8p s GLU 154 CO 0.01 -0.08 0.50 -1.17 0.02 0.00 0.00 175.26 174.54 2k8p s LEU 155 N -2.00 0.08 0.28 1.80 2.96 -1.26 -5.18 118.68 115.35 2k8p s LEU 155 Ca 0.10 0.51 0.04 0.00 -0.22 0.00 0.00 54.13 54.56 2k8p s LEU 155 Cb -0.01 1.89 -0.06 0.00 0.50 0.00 0.00 46.19 48.51 2k8p s LEU 155 CO -0.04 -0.48 0.02 -0.54 -1.32 0.00 0.00 176.35 174.00 2k8p s LYS 156 N -1.02 1.50 -0.29 1.98 -0.14 -1.26 -5.14 119.74 115.37 2k8p s LYS 156 Ca -0.10 -1.79 0.03 0.00 -1.36 0.00 0.00 55.97 52.74 2k8p s LYS 156 Cb -0.03 -0.77 0.19 0.00 -1.68 0.00 0.00 37.83 35.54 2k8p s LYS 156 CO 0.06 -0.13 0.57 0.16 -0.76 0.00 0.00 175.35 175.25 2k8p s ASP 157 N -3.40 -1.27 -0.22 2.83 -4.77 -1.26 -5.13 116.67 103.45 2k8p s ASP 157 Ca 0.33 0.40 -0.04 0.00 -3.30 0.00 0.00 52.55 49.93 2k8p s ASP 157 Cb 0.07 1.96 0.09 0.00 -1.09 0.00 0.00 42.92 43.94 2k8p s ASP 157 CO 0.12 -0.29 0.17 -0.36 0.70 0.00 0.00 175.17 175.52 2k8p s PHE 158 N 2.80 -0.05 0.00 2.11 0.40 -1.26 -5.09 117.98 116.89 2k8p s PHE 158 Ca 0.14 -0.18 0.00 0.00 -0.60 0.00 0.00 56.93 56.30 2k8p s PHE 158 Cb -0.12 -0.57 0.00 0.00 0.51 0.00 0.00 43.02 42.84 2k8p s PHE 158 CO -0.24 -0.65 0.00 0.41 0.70 0.00 0.00 175.22 175.44 2k8p n GLY 159 N 5.29 0.59 3.64 4.36 0.00 -1.26 -5.18 105.19 112.63 2k8p n GLY 159 Ca -0.06 0.62 -0.07 0.00 0.00 0.00 0.00 46.02 46.51 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 0.13 2.61 -1.32 -1.26 -5.18 115.64 110.61 2k8p s THR 160 Ca 0.00 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 2k8p s THR 160 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 2k8p s THR 160 CO 0.00 0.00 0.03 -1.84 -2.21 0.00 0.00 174.62 170.60 2k8p n GLU 161 N 2.85 1.56 -3.88 7.08 0.28 -1.26 -5.17 120.64 122.11 2k8p n GLU 161 Ca -0.15 -0.86 -0.09 0.00 -0.16 0.00 0.00 57.16 55.90 2k8p n GLU 161 Cb 0.57 0.18 -0.08 0.00 1.43 0.00 0.00 31.44 33.54 2k8p n GLU 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k8p s ALA 162 N -2.20 -0.15 -0.07 -1.84 0.00 -1.26 -5.16 121.76 111.08 2k8p s ALA 162 Ca 0.03 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.33 2k8p s ALA 162 Cb -0.00 0.46 0.02 0.00 0.00 0.00 0.00 23.12 23.59 2k8p s ALA 162 CO 0.02 -0.49 -0.07 0.00 0.00 0.00 0.00 175.76 175.21 2k8p s ALA 163 N -3.82 1.01 0.26 0.00 0.00 -1.26 -5.15 121.76 112.80 2k8p s ALA 163 Ca 0.05 -0.28 0.07 0.00 0.00 0.00 0.00 51.96 51.80 2k8p s ALA 163 Cb 0.05 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 2k8p s ALA 163 CO -0.11 -0.08 0.23 1.03 0.00 0.00 0.00 175.76 176.83 2k8p s ARG 164 N 1.07 2.97 1.13 0.00 0.52 -1.26 -5.12 118.95 118.25 2k8p s ARG 164 Ca -0.08 -1.04 -0.17 0.00 -0.52 0.00 0.00 55.73 53.92 2k8p s ARG 164 Cb -0.14 -2.60 0.25 0.00 0.52 0.00 0.00 34.95 32.98 2k8p s ARG 164 CO -0.01 0.37 1.10 -1.25 0.02 0.00 0.00 175.30 175.54 2k8p s PRO 165 N -3.88 -0.63 -0.03 3.54 0.04 -1.26 -5.08 135.00 127.70 2k8p s PRO 165 Ca 0.34 0.14 -0.01 0.00 0.04 0.00 0.00 61.00 61.52 2k8p s PRO 165 Cb -0.08 -1.65 0.03 0.00 0.04 0.00 0.00 34.50 32.85 2k8p s PRO 165 CO 0.26 -3.36 0.03 -1.14 0.04 0.00 0.00 177.00 172.83 2k8p s GLN 166 N -5.24 0.05 0.08 4.56 0.74 -1.26 -5.15 119.66 113.44 2k8p s GLN 166 Ca 0.69 0.23 -0.10 0.00 0.05 0.00 0.00 55.36 56.23 2k8p s GLN 166 Cb -0.13 -0.43 0.00 0.00 1.10 0.00 0.00 33.01 33.55 2k8p s GLN 166 CO 0.57 -0.23 0.22 0.15 -0.55 0.00 0.00 175.29 175.44 2k8p s LYS 167 N 1.51 0.84 0.00 1.67 1.02 -1.26 -5.12 119.74 118.40 2k8p s LYS 167 Ca -0.03 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.10 2k8p s LYS 167 Cb -0.13 0.34 0.00 0.00 -0.52 0.00 0.00 37.83 37.53 2k8p s LYS 167 CO -0.03 -0.27 0.00 0.41 -0.92 0.00 0.00 175.35 174.54 2k8p n GLY 168 N 0.09 -2.05 3.11 -3.33 0.00 -1.26 -5.18 105.19 96.57 2k8p n GLY 168 Ca -0.16 0.98 -0.11 0.00 0.00 0.00 0.00 46.02 46.73 2k8p n GLY 168 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k8p s ARG 169 N 0.00 0.51 0.07 1.61 3.52 -1.26 -5.17 118.95 118.23 2k8p s ARG 169 Ca 0.00 -0.49 -0.04 0.00 -0.13 0.00 0.00 55.73 55.07 2k8p s ARG 169 Cb 0.00 0.21 -0.03 0.00 -1.56 0.00 0.00 34.95 33.57 2k8p s ARG 169 CO 0.00 -0.12 0.07 0.15 -0.81 0.00 0.00 175.30 174.58 2k8p s LYS 170 N -1.68 0.74 0.67 5.12 1.02 -1.26 -5.16 119.74 119.19 2k8p s LYS 170 Ca -0.13 -1.15 -0.14 0.00 0.02 0.00 0.00 55.97 54.57 2k8p s LYS 170 Cb -0.06 0.27 0.01 0.00 -0.52 0.00 0.00 37.83 37.52 2k8p s LYS 170 CO 0.00 -0.19 1.11 -1.25 -0.92 0.00 0.00 175.35 174.10 2k8p s PRO 171 N -3.91 2.74 -0.59 -1.68 0.04 -1.26 -5.02 135.00 125.33 2k8p s PRO 171 Ca 0.08 1.37 0.06 0.00 0.04 0.00 0.00 61.00 62.55 2k8p s PRO 171 Cb 0.07 -1.94 0.23 0.00 0.04 0.00 0.00 34.50 32.90 2k8p s PRO 171 CO -0.09 -1.29 0.64 -2.13 0.04 0.00 0.00 177.00 174.17 2k8p n ARG 172 N -2.53 1.94 -2.16 4.56 3.00 -1.26 -5.08 116.66 115.13 2k8p n ARG 172 Ca 0.10 -4.28 -0.42 0.00 -0.00 0.00 0.00 57.85 53.25 2k8p n ARG 172 Cb 0.52 -2.02 -0.03 0.00 0.00 0.00 0.00 32.46 30.94 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k8p s PRO 173 N -1.94 4.22 1.18 -0.14 0.04 -1.26 -5.01 135.00 132.09 2k8p s PRO 173 Ca 0.36 2.01 -0.19 0.00 0.04 0.00 0.00 61.00 63.23 2k8p s PRO 173 Cb 0.12 -3.81 0.28 0.00 0.04 0.00 0.00 34.50 31.13 2k8p s PRO 173 CO -0.06 -0.74 1.12 0.50 0.04 0.00 0.00 177.00 177.86 2k8p s ARG 174 N 3.41 -1.04 -0.29 4.56 3.52 -1.26 -5.09 118.95 122.76 2k8p s ARG 174 Ca 0.66 -0.04 -0.17 0.00 -0.13 0.00 0.00 55.73 56.06 2k8p s ARG 174 Cb -0.30 -1.62 0.18 0.00 -1.56 0.00 0.00 34.95 31.65 2k8p s ARG 174 CO 0.25 -3.60 1.12 0.00 -0.81 0.00 0.00 175.30 172.26 2k8p s ALA 175 N -3.04 -2.44 -0.16 6.12 0.00 -1.26 -5.18 121.76 115.79 2k8p s ALA 175 Ca 0.71 2.08 -0.35 0.00 0.00 0.00 0.00 51.96 54.40 2k8p s ALA 175 Cb -0.10 -1.83 0.14 0.00 0.00 0.00 0.00 23.12 21.33 2k8p s ALA 175 CO 0.56 -0.32 1.28 0.50 0.00 0.00 0.00 175.76 177.78 2k8p s ARG 176 N 1.14 0.24 0.36 0.00 3.52 -1.26 -5.19 118.95 117.75 2k8p s ARG 176 Ca -0.08 -0.11 -0.16 0.00 -0.13 0.00 0.00 55.73 55.25 2k8p s ARG 176 Cb -0.03 0.10 0.04 0.00 -1.56 0.00 0.00 34.95 33.50 2k8p s ARG 176 CO -0.12 -0.11 0.75 -1.54 -0.81 0.00 0.00 175.30 173.47 2k8p s SER 177 N -2.39 -0.01 0.14 -2.12 1.04 -1.26 -5.19 113.70 103.90 2k8p s SER 177 Ca 0.11 -1.03 -0.25 0.00 0.48 0.00 0.00 55.95 55.26 2k8p s SER 177 Cb 0.01 0.81 0.07 0.00 0.10 0.00 0.00 66.02 67.01 2k8p s SER 177 CO -0.04 -1.58 0.91 0.00 0.98 0.00 0.00 173.24 173.50 2k8p s ALA 178 N -2.76 -1.63 0.15 5.32 0.00 -1.26 -5.19 121.76 116.39 2k8p s ALA 178 Ca 0.15 0.24 -0.25 0.00 0.00 0.00 0.00 51.96 52.11 2k8p s ALA 178 Cb -0.05 0.64 0.07 0.00 0.00 0.00 0.00 23.12 23.77 2k8p s ALA 178 CO 0.11 -0.97 0.98 -1.59 0.00 0.00 0.00 175.76 174.29 2k8p s LYS 179 N -3.35 1.19 0.23 0.00 0.00 -1.26 -5.19 119.74 111.37 2k8p s LYS 179 Ca 0.10 -0.68 0.01 0.00 0.00 0.00 0.00 55.97 55.41 2k8p s LYS 179 Cb -0.02 0.39 -0.00 0.00 0.00 0.00 0.00 37.83 38.20 2k8p s LYS 179 CO 0.00 -0.55 0.28 0.00 0.00 0.00 0.00 175.35 175.08 2k8p n ALA 180 N -0.50 0.04 -3.91 0.59 0.00 -1.26 -5.19 120.51 110.28 2k8p n ALA 180 Ca -0.06 -1.18 -0.02 0.00 0.00 0.00 0.00 53.44 52.19 2k8p n ALA 180 Cb 0.61 0.95 0.02 0.00 0.00 0.00 0.00 19.45 21.02 2k8p n ALA 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k8p s ASN 181 N -2.50 0.01 0.37 0.00 2.20 -1.26 -5.19 114.94 108.56 2k8p s ASN 181 Ca 0.22 -0.55 -0.13 0.00 -0.94 0.00 0.00 52.86 51.47 2k8p s ASN 181 Cb 0.00 0.40 0.04 0.00 -2.00 0.00 0.00 41.25 39.69 2k8p s ASN 181 CO 0.16 -0.80 0.71 -1.10 -2.94 0.00 0.00 177.10 173.13 2k8p s GLN 182 N -2.12 2.15 0.34 3.55 1.11 -1.26 -5.19 119.66 118.23 2k8p s GLN 182 Ca 0.24 -1.50 0.04 0.00 0.01 0.00 0.00 55.36 54.15 2k8p s GLN 182 Cb -0.02 0.58 -0.02 0.00 -1.01 0.00 0.00 33.01 32.55 2k8p s GLN 182 CO 0.04 -0.98 0.36 0.00 0.01 0.00 0.00 175.29 174.71 2k8p n ALA 183 N -0.54 0.34 -3.99 6.09 0.00 -1.26 -5.15 120.51 116.00 2k8p n ALA 183 Ca -0.06 -1.82 -0.30 0.00 0.00 0.00 0.00 53.44 51.25 2k8p n ALA 183 Cb 0.60 1.47 -0.16 0.00 0.00 0.00 0.00 19.45 21.37 2k8p n ALA 183 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2k8p s GLU 184 N -3.15 1.97 -0.49 0.00 2.12 -1.26 -5.03 118.70 112.87 2k8p s GLU 184 Ca 0.36 -0.86 0.08 0.00 0.36 0.00 0.00 54.97 54.90 2k8p s GLU 184 Cb 0.01 -2.44 0.27 0.00 0.26 0.00 0.00 34.13 32.24 2k8p s GLU 184 CO 0.25 -0.45 0.66 1.28 -0.54 0.00 0.00 175.26 176.47 2k8p n LEU 185 N 4.68 1.85 -3.64 2.70 4.32 -1.26 -5.06 117.00 120.59 2k8p n LEU 185 Ca -0.14 -5.08 -0.12 0.00 -0.02 0.00 0.00 56.01 50.65 2k8p n LEU 185 Cb 0.46 0.11 -0.07 0.00 -1.62 0.00 0.00 43.42 42.30 2k8p n LEU 185 CO 0.20 2.12 0.38 -0.70 -1.22 0.00 0.00 177.39 178.17 2k8p s GLU 186 N -1.99 0.78 -0.11 3.23 2.12 -1.26 -5.17 118.70 116.30 2k8p s GLU 186 Ca 0.39 1.05 -0.31 0.00 0.36 0.00 0.00 54.97 56.46 2k8p s GLU 186 Cb 0.20 0.32 0.12 0.00 0.26 0.00 0.00 34.13 35.03 2k8p s GLU 186 CO -0.08 -0.11 1.01 1.21 -0.54 0.00 0.00 175.26 176.75 2k8p s ASN 187 N 0.75 -0.30 -0.35 -1.70 2.47 -1.26 -5.14 114.94 109.41 2k8p s ASN 187 Ca -0.03 0.14 -0.12 0.00 0.42 0.00 0.00 52.86 53.27 2k8p s ASN 187 Cb -0.05 0.29 -0.01 0.00 -1.45 0.00 0.00 41.25 40.03 2k8p s ASN 187 CO -0.05 -0.42 0.23 0.00 -3.72 0.00 0.00 177.10 173.14 2k8p s ALA 188 N -2.19 3.44 -2.00 1.71 0.00 -1.26 -5.36 121.76 116.11 2k8p s ALA 188 Ca 0.04 -1.46 0.18 0.00 0.00 0.00 0.00 51.96 50.72 2k8p s ALA 188 Cb -0.01 -2.64 1.07 0.00 0.00 0.00 0.00 23.12 21.54 2k8p s ALA 188 CO -0.04 -1.06 1.47 2.48 0.00 0.00 0.00 175.76 178.60