#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8p n TRP 2 N 0.00 -0.77 -4.32 1.61 7.02 -1.26 -5.16 117.44 114.57 2k8p n TRP 2 Ca 0.00 -0.61 -0.31 0.00 -1.02 0.00 0.00 57.50 55.57 2k8p n TRP 2 Cb 0.00 0.16 -0.16 0.00 -2.42 0.00 0.00 31.31 28.88 2k8p n TRP 2 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 2k8p s GLN 3 N -2.19 2.55 1.45 -0.99 -0.21 -1.26 -5.13 119.66 113.87 2k8p s GLN 3 Ca 0.07 -0.67 -0.24 0.00 0.02 0.00 0.00 55.36 54.54 2k8p s GLN 3 Cb -0.00 -2.19 0.37 0.00 1.00 0.00 0.00 33.01 32.19 2k8p s GLN 3 CO 0.05 -0.13 0.93 0.00 -2.12 0.00 0.00 175.29 174.02 2k8p n ALA 4 N 4.41 -4.96 -3.08 6.09 0.00 -1.26 -5.05 120.51 116.66 2k8p n ALA 4 Ca -0.19 -1.58 -0.25 0.00 0.00 0.00 0.00 53.44 51.43 2k8p n ALA 4 Cb 0.51 -0.13 -0.16 0.00 0.00 0.00 0.00 19.45 19.66 2k8p n ALA 4 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2k8p s PHE 5 N -2.30 1.53 0.32 0.00 -0.71 -1.26 -5.15 117.98 110.42 2k8p s PHE 5 Ca 0.69 -0.47 0.09 0.00 -1.04 0.00 0.00 56.93 56.19 2k8p s PHE 5 Cb -0.11 -1.06 -0.06 0.00 -1.21 0.00 0.00 43.02 40.58 2k8p s PHE 5 CO 0.57 -0.19 -0.09 0.15 -1.34 0.00 0.00 175.22 174.32 2k8p s LYS 6 N 0.24 1.72 -0.30 1.99 1.02 -1.26 -5.15 119.74 118.01 2k8p s LYS 6 Ca -0.07 -1.88 -0.19 0.00 0.02 0.00 0.00 55.97 53.85 2k8p s LYS 6 Cb -0.12 -1.52 0.19 0.00 -0.52 0.00 0.00 37.83 35.85 2k8p s LYS 6 CO 0.02 0.11 1.24 0.54 -0.92 0.00 0.00 175.35 176.35 2k8p s ASN 7 N -3.55 -0.17 0.64 2.83 2.20 -1.26 -5.18 114.94 110.44 2k8p s ASN 7 Ca 0.31 0.29 0.01 0.00 -0.94 0.00 0.00 52.86 52.54 2k8p s ASN 7 Cb 0.03 0.78 0.11 0.00 -2.00 0.00 0.00 41.25 40.17 2k8p s ASN 7 CO 0.15 -0.05 0.78 0.47 -2.94 0.00 0.00 177.10 175.51 2k8p n ASP 8 N 2.69 1.19 -3.50 3.54 8.00 -1.26 -5.12 116.55 122.09 2k8p n ASP 8 Ca -0.15 -1.97 -0.16 0.00 0.71 0.00 0.00 54.79 53.22 2k8p n ASP 8 Cb 0.57 -0.49 -0.12 0.00 -0.02 0.00 0.00 41.12 41.05 2k8p n ASP 8 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8p s ALA 9 N -3.01 -0.45 -0.26 2.24 0.00 -1.26 -5.11 121.76 113.91 2k8p s ALA 9 Ca 0.53 0.48 -0.03 0.00 0.00 0.00 0.00 51.96 52.94 2k8p s ALA 9 Cb -0.03 -1.32 0.10 0.00 0.00 0.00 0.00 23.12 21.87 2k8p s ALA 9 CO 0.35 -1.11 0.16 0.95 0.00 0.00 0.00 175.76 176.11 2k8p s THR 10 N 2.38 -0.16 0.37 0.00 -4.23 -1.26 -5.14 115.64 107.59 2k8p s THR 10 Ca 0.07 -0.54 0.00 0.00 -1.18 0.00 0.00 61.69 60.04 2k8p s THR 10 Cb -0.15 -0.88 0.00 0.00 1.34 0.00 0.00 72.50 72.81 2k8p s THR 10 CO -0.12 -0.55 0.03 -0.62 -0.54 0.00 0.00 174.62 172.82 2k8p n GLU 11 N 5.27 1.10 -3.47 3.99 1.02 -1.26 -5.14 120.64 122.16 2k8p n GLU 11 Ca -0.05 -2.62 -0.24 0.00 -0.02 0.00 0.00 57.16 54.23 2k8p n GLU 11 Cb 0.45 0.65 -0.12 0.00 -0.02 0.00 0.00 31.44 32.40 2k8p n GLU 11 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2k8p s ILE 12 N -2.26 -0.20 -0.50 -3.67 1.01 -1.26 -5.05 121.20 109.27 2k8p s ILE 12 Ca 0.03 -0.76 0.06 0.00 0.00 0.00 0.00 60.65 59.98 2k8p s ILE 12 Cb -0.00 -0.97 0.23 0.00 0.01 0.00 0.00 42.46 41.72 2k8p s ILE 12 CO 0.02 -0.64 0.55 -0.38 0.00 0.00 0.00 174.94 174.48 2k8p n ILE 13 N 5.09 0.36 -0.59 2.92 -0.00 -1.26 -5.11 119.36 120.77 2k8p n ILE 13 Ca -0.02 -4.36 -0.05 0.00 -0.00 0.00 0.00 62.75 58.32 2k8p n ILE 13 Cb 0.43 -1.97 0.05 0.00 -0.00 0.00 0.00 39.64 38.15 2k8p n ILE 13 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 2k8p n PRO 14 N 1.56 -1.40 -3.20 0.38 -0.04 -1.26 -5.09 135.00 125.95 2k8p n PRO 14 Ca 0.25 -0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2k8p n PRO 14 Cb 0.47 -0.29 -0.02 0.00 -0.04 0.00 0.00 33.50 33.61 2k8p n PRO 14 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2k8p s GLU 15 N -3.45 0.51 1.35 0.54 2.12 -1.26 -5.16 118.70 113.35 2k8p s GLU 15 Ca 0.13 0.57 -0.20 0.00 0.36 0.00 0.00 54.97 55.82 2k8p s GLU 15 Cb -0.01 0.14 0.33 0.00 0.26 0.00 0.00 34.13 34.85 2k8p s GLU 15 CO 0.10 -0.91 0.83 1.47 -0.54 0.00 0.00 175.26 176.21 2k8p n LEU 16 N 5.40 -0.97 -2.93 2.70 -0.00 -1.26 -5.04 117.00 114.90 2k8p n LEU 16 Ca 0.02 -0.61 -0.02 0.00 -0.00 0.00 0.00 56.01 55.40 2k8p n LEU 16 Cb 0.52 -1.06 0.00 0.00 -0.00 0.00 0.00 43.42 42.89 2k8p n LEU 16 CO -0.02 -4.09 0.15 -0.83 -0.00 0.00 0.00 177.39 172.60 2k8p s GLY 17 N -2.73 -1.32 -0.42 1.47 0.00 -1.26 -5.12 107.32 97.94 2k8p s GLY 17 Ca 0.65 -0.00 -0.22 0.00 0.00 0.00 0.00 44.72 45.14 2k8p s GLY 17 CO 0.58 3.74 0.74 -0.54 0.00 0.00 0.00 173.10 177.62 2k8p s GLU 18 N 1.32 3.49 -0.65 2.90 2.02 -1.26 -4.97 118.70 121.56 2k8p s GLU 18 Ca 0.23 -0.05 0.05 0.00 0.02 0.00 0.00 54.97 55.23 2k8p s GLU 18 Cb -0.01 -3.90 0.27 0.00 0.10 0.00 0.00 34.13 30.59 2k8p s GLU 18 CO -0.07 -0.99 0.82 2.48 0.02 0.00 0.00 175.26 177.52 2k8p n TYR 19 N 6.49 3.67 -1.09 1.61 4.11 -1.26 -5.08 117.16 125.61 2k8p n TYR 19 Ca 0.01 -4.06 -0.30 0.00 -0.00 0.00 0.00 57.90 53.55 2k8p n TYR 19 Cb 0.48 -0.58 0.24 0.00 -0.00 0.00 0.00 39.34 39.48 2k8p n TYR 19 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 2k8p s PRO 20 N -2.68 -1.12 0.21 -3.48 0.04 -1.26 -5.09 135.00 121.62 2k8p s PRO 20 Ca 0.41 -0.03 0.07 0.00 0.04 0.00 0.00 61.00 61.49 2k8p s PRO 20 Cb 0.17 -1.60 -0.05 0.00 0.04 0.00 0.00 34.50 33.06 2k8p s PRO 20 CO -0.03 -3.65 -0.13 -1.21 0.04 0.00 0.00 177.00 172.02 2k8p s GLU 21 N -5.37 1.32 0.96 4.56 2.02 -1.26 -5.15 118.70 115.77 2k8p s GLU 21 Ca 0.71 -1.59 -0.12 0.00 0.02 0.00 0.00 54.97 53.98 2k8p s GLU 21 Cb -0.10 -1.05 0.17 0.00 0.10 0.00 0.00 34.13 33.24 2k8p s GLU 21 CO 0.56 0.15 1.09 -1.25 0.02 0.00 0.00 175.26 175.84 2k8p s PRO 22 N -3.67 0.74 0.96 0.39 0.04 -1.26 -5.04 135.00 127.17 2k8p s PRO 22 Ca 0.23 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.78 2k8p s PRO 22 Cb 0.00 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 32.94 2k8p s PRO 22 CO 0.07 -2.55 1.09 -1.25 0.04 0.00 0.00 177.00 174.40 2k8p s PRO 23 N -4.95 0.72 0.28 0.56 0.04 -1.26 -5.06 135.00 125.33 2k8p s PRO 23 Ca 0.65 0.63 -0.05 0.00 0.04 0.00 0.00 61.00 62.27 2k8p s PRO 23 Cb -0.18 -1.76 0.07 0.00 0.04 0.00 0.00 34.50 32.66 2k8p s PRO 23 CO 0.57 -2.56 0.25 -0.35 0.04 0.00 0.00 177.00 174.95 2k8p n PRO 24 N -4.08 -1.49 -3.13 0.56 -0.04 -1.26 -5.09 135.00 120.47 2k8p n PRO 24 Ca 0.06 -0.39 0.05 0.00 -0.04 0.00 0.00 63.50 63.17 2k8p n PRO 24 Cb 0.56 -0.37 0.00 0.00 -0.04 0.00 0.00 33.50 33.66 2k8p n PRO 24 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2k8p s GLU 25 N -3.56 0.20 -0.31 0.54 2.12 -1.26 -5.13 118.70 111.31 2k8p s GLU 25 Ca 0.16 0.17 -0.03 0.00 0.36 0.00 0.00 54.97 55.63 2k8p s GLU 25 Cb -0.02 0.08 0.11 0.00 0.26 0.00 0.00 34.13 34.57 2k8p s GLU 25 CO 0.12 -0.37 0.15 -0.51 -0.54 0.00 0.00 175.26 174.11 2k8p s LEU 26 N 2.87 0.70 0.67 2.70 1.02 -1.26 -5.14 118.68 120.24 2k8p s LEU 26 Ca 0.25 -1.51 -0.04 0.00 0.02 0.00 0.00 54.13 52.85 2k8p s LEU 26 Cb -0.03 -0.38 0.07 0.00 0.02 0.00 0.00 46.19 45.88 2k8p s LEU 26 CO -0.23 -0.41 0.95 -1.83 0.02 0.00 0.00 176.35 174.85 2k8p s GLU 27 N 1.85 2.14 0.16 1.70 -1.05 -1.26 -5.12 118.70 117.13 2k8p s GLU 27 Ca 0.11 -0.57 0.04 0.00 -0.15 0.00 0.00 54.97 54.39 2k8p s GLU 27 Cb -0.18 -2.28 -0.05 0.00 -0.44 0.00 0.00 34.13 31.18 2k8p s GLU 27 CO -0.28 -1.16 -0.07 1.21 0.95 0.00 0.00 175.26 175.91 2k8p s ASN 28 N -4.54 1.70 0.10 0.83 3.84 -1.26 -5.17 114.94 110.44 2k8p s ASN 28 Ca 0.61 -1.07 0.00 0.00 0.21 0.00 0.00 52.86 52.61 2k8p s ASN 28 Cb -0.09 0.01 0.00 0.00 -0.55 0.00 0.00 41.25 40.62 2k8p s ASN 28 CO 0.43 -0.40 0.04 -3.20 -2.79 0.00 0.00 177.10 171.18 2k8p n ASN 29 N -0.24 1.80 -3.85 -4.21 5.15 -1.26 -5.17 115.26 107.48 2k8p n ASN 29 Ca -0.09 -1.40 -0.11 0.00 -0.60 0.00 0.00 54.58 52.38 2k8p n ASN 29 Cb 0.62 0.03 -0.06 0.00 -0.53 0.00 0.00 39.78 39.84 2k8p n ASN 29 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 2k8p s LYS 30 N -2.40 1.57 0.19 1.20 -2.85 -1.26 -5.19 119.74 111.00 2k8p s LYS 30 Ca 0.03 -1.46 -0.11 0.00 -1.00 0.00 0.00 55.97 53.43 2k8p s LYS 30 Cb -0.00 0.42 -0.00 0.00 -2.06 0.00 0.00 37.83 36.19 2k8p s LYS 30 CO 0.02 -0.63 0.36 0.95 0.10 0.00 0.00 175.35 176.15 2k8p s THR 31 N -3.80 0.04 0.08 3.79 -4.23 -1.26 -5.18 115.64 105.07 2k8p s THR 31 Ca 0.28 -1.29 0.01 0.00 -1.18 0.00 0.00 61.69 59.51 2k8p s THR 31 Cb 0.01 -1.87 -0.00 0.00 1.34 0.00 0.00 72.50 71.98 2k8p s THR 31 CO 0.12 -0.20 0.08 0.80 -0.54 0.00 0.00 174.62 174.88 2k8p n MET 32 N -0.27 0.12 -2.86 3.99 1.56 -1.26 -5.19 117.12 113.21 2k8p n MET 32 Ca -0.07 -0.69 -0.08 0.00 -0.27 0.00 0.00 57.70 56.59 2k8p n MET 32 Cb 0.63 0.61 -0.03 0.00 2.15 0.00 0.00 33.22 36.58 2k8p n MET 32 CO 0.00 0.00 0.00 0.27 -0.73 0.00 0.00 175.97 175.51 2k8p n ASN 33 N -2.41 0.32 -1.59 6.12 6.94 -1.26 -5.19 115.26 118.19 2k8p n ASN 33 Ca 0.01 -1.82 -0.05 0.00 -0.02 0.00 0.00 54.58 52.71 2k8p n ASN 33 Cb 0.13 0.52 -0.01 0.00 -2.36 0.00 0.00 39.78 38.06 2k8p n ASN 33 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2k8p n ARG 34 N -0.28 0.16 -2.18 -3.83 1.74 -1.26 -5.19 116.66 105.82 2k8p n ARG 34 Ca 0.01 -0.85 -0.02 0.00 -0.77 0.00 0.00 57.85 56.22 2k8p n ARG 34 Cb 0.23 0.76 -0.01 0.00 -1.02 0.00 0.00 32.46 32.42 2k8p n ARG 34 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k8p n ALA 35 N -2.35 0.05 -3.15 7.54 0.00 -1.26 -5.19 120.51 116.15 2k8p n ALA 35 Ca -0.04 -0.16 -0.11 0.00 0.00 0.00 0.00 53.44 53.14 2k8p n ALA 35 Cb 0.17 0.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.70 2k8p n ALA 35 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2k8p s GLU 36 N -2.11 1.76 0.18 0.00 4.04 -1.26 -5.19 118.70 116.13 2k8p s GLU 36 Ca 0.03 -1.46 -0.13 0.00 0.04 0.00 0.00 54.97 53.45 2k8p s GLU 36 Cb 0.00 0.48 0.01 0.00 0.02 0.00 0.00 34.13 34.64 2k8p s GLU 36 CO 0.02 -0.75 0.39 -0.80 -1.84 0.00 0.00 175.26 172.29 2k8p s ASN 37 N -3.10 -0.09 0.02 0.83 -0.87 -1.26 -5.18 114.94 105.29 2k8p s ASN 37 Ca 0.24 -0.71 -0.11 0.00 -1.57 0.00 0.00 52.86 50.72 2k8p s ASN 37 Cb -0.01 0.50 0.04 0.00 -0.02 0.00 0.00 41.25 41.76 2k8p s ASN 37 CO 0.13 -0.97 0.49 0.61 -2.57 0.00 0.00 177.10 174.79 2k8p n GLY 38 N -0.27 0.65 0.00 0.66 0.00 -1.26 -5.19 105.19 99.77 2k8p n GLY 38 Ca -0.08 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.35 0.87 3.32 -0.02 0.00 -1.26 -5.18 105.19 102.58 2k8p n GLY 39 Ca 0.01 -0.98 -0.17 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.00 1.26 0.96 1.61 3.00 -1.26 -5.15 118.95 117.37 2k8p s ARG 40 Ca 0.00 -1.56 -0.12 0.00 0.00 0.00 0.00 55.73 54.05 2k8p s ARG 40 Cb 0.00 -0.94 0.17 0.00 0.00 0.00 0.00 34.95 34.17 2k8p s ARG 40 CO 0.00 0.13 1.09 -1.25 0.00 0.00 0.00 175.30 175.27 2k8p s PRO 41 N -3.69 0.73 0.44 3.54 0.04 -1.26 -5.06 135.00 129.74 2k8p s PRO 41 Ca 0.21 0.64 -0.07 0.00 0.04 0.00 0.00 61.00 61.82 2k8p s PRO 41 Cb 0.01 -1.76 0.11 0.00 0.04 0.00 0.00 34.50 32.89 2k8p s PRO 41 CO 0.05 -2.56 0.39 -0.35 0.04 0.00 0.00 177.00 174.57 2k8p n PRO 42 N -4.07 -1.79 -3.96 0.56 -0.04 -1.26 -5.10 135.00 119.33 2k8p n PRO 42 Ca 0.06 -0.62 -0.10 0.00 -0.04 0.00 0.00 63.50 62.79 2k8p n PRO 42 Cb 0.56 -0.58 -0.02 0.00 -0.04 0.00 0.00 33.50 33.42 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 -1.70 0.45 0.10 0.54 3.76 -1.26 -5.19 115.29 111.99 2k8p s HIS 43 Ca 0.25 -0.87 0.01 0.00 -0.15 0.00 0.00 55.06 54.31 2k8p s HIS 43 Cb -0.02 0.34 -0.04 0.00 1.11 0.00 0.00 32.58 33.96 2k8p s HIS 43 CO 0.19 -1.22 -0.05 -1.01 -0.85 0.00 0.00 174.74 171.80 2k8p s HIS 44 N -3.24 0.89 0.96 1.40 3.76 -1.26 -5.16 115.29 112.64 2k8p s HIS 44 Ca 0.22 -0.94 -0.12 0.00 -0.15 0.00 0.00 55.06 54.06 2k8p s HIS 44 Cb -0.02 -0.52 0.17 0.00 1.11 0.00 0.00 32.58 33.31 2k8p s HIS 44 CO 0.13 -0.18 1.09 -1.25 -0.85 0.00 0.00 174.74 173.68 2k8p s PRO 45 N -3.85 0.73 -0.28 8.40 0.04 -1.26 -5.07 135.00 133.70 2k8p s PRO 45 Ca 0.13 0.63 0.02 0.00 0.04 0.00 0.00 61.00 61.82 2k8p s PRO 45 Cb 0.06 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.01 2k8p s PRO 45 CO -0.04 -2.55 0.51 -0.06 0.04 0.00 0.00 177.00 174.89 2k8p s PHE 46 N -2.95 -1.38 -0.70 0.56 0.08 -1.26 -5.00 117.98 107.33 2k8p s PHE 46 Ca 0.65 1.00 0.11 0.00 0.12 0.00 0.00 56.93 58.80 2k8p s PHE 46 Cb -0.18 0.20 0.56 0.00 -0.57 0.00 0.00 43.02 43.03 2k8p s PHE 46 CO 0.57 -0.94 1.38 0.39 -0.10 0.00 0.00 175.22 176.52 2k8p n GLU 47 N 5.39 3.52 -2.95 0.44 -0.58 -1.26 -4.97 120.64 120.23 2k8p n GLU 47 Ca 0.01 -2.16 -0.04 0.00 -0.42 0.00 0.00 57.16 54.54 2k8p n GLU 47 Cb 0.51 -1.95 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 2k8p n GLU 47 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2k8p n THR 48 N 0.53 -8.03 -3.99 2.62 -1.04 -1.26 -4.99 114.28 98.11 2k8p n THR 48 Ca 0.19 1.16 -0.32 0.00 -2.04 0.00 0.00 64.05 63.04 2k8p n THR 48 Cb 0.85 -5.43 -0.06 0.00 -1.82 0.00 0.00 70.33 63.87 2k8p n THR 48 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2k8p s LYS 49 N -1.61 3.24 0.13 -2.82 0.00 -1.26 -5.11 119.74 112.31 2k8p s LYS 49 Ca 0.06 -0.45 -0.25 0.00 0.00 0.00 0.00 55.97 55.34 2k8p s LYS 49 Cb -0.01 -2.96 0.07 0.00 0.00 0.00 0.00 37.83 34.93 2k8p s LYS 49 CO 0.54 0.64 0.77 0.16 0.00 0.00 0.00 175.35 177.45 2k8p s ASP 50 N -2.03 -0.39 -0.27 0.03 1.47 -1.26 -5.18 116.67 109.04 2k8p s ASP 50 Ca 0.27 -0.17 -0.27 0.00 1.18 0.00 0.00 52.55 53.56 2k8p s ASP 50 Cb -0.12 0.54 0.17 0.00 -0.34 0.00 0.00 42.92 43.16 2k8p s ASP 50 CO 0.19 -0.92 1.26 0.54 0.68 0.00 0.00 175.17 176.92 2k8p s VAL 51 N -3.51 0.00 -0.40 2.11 0.11 -1.26 -5.13 120.40 112.32 2k8p s VAL 51 Ca 0.06 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.09 2k8p s VAL 51 Cb -0.02 -1.00 0.20 0.00 -1.53 0.00 0.00 36.38 34.03 2k8p s VAL 51 CO -0.06 0.00 0.94 -0.94 -3.33 0.00 0.00 175.10 171.71 2k8p s SER 52 N -0.42 -0.77 0.61 3.54 1.04 -1.26 -5.10 113.70 111.34 2k8p s SER 52 Ca 0.05 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.68 2k8p s SER 52 Cb -0.03 1.00 0.00 0.00 0.10 0.00 0.00 66.02 67.09 2k8p s SER 52 CO -0.09 -0.04 0.00 1.21 0.98 0.00 0.00 173.24 175.30 2k8p n GLU 53 N 3.00 -0.09 0.00 4.02 2.13 -1.26 -4.44 120.64 123.99 2k8p n GLU 53 Ca 0.13 0.06 0.00 0.00 0.66 0.00 0.00 57.16 58.01 2k8p n GLU 53 Cb 0.61 -0.11 0.00 0.00 0.27 0.00 0.00 31.44 32.21 2k8p n GLU 53 CO 0.00 0.00 0.00 2.48 -0.41 0.00 0.00 177.13 179.20 2k8p n TYR 54 N -1.35 0.00 0.00 4.31 4.11 -1.26 -4.93 117.16 118.04 2k8p n TYR 54 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 2k8p n TYR 54 Cb 0.02 0.10 0.00 0.00 -0.00 0.00 0.00 39.34 39.46 2k8p n TYR 54 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 2k8p n SER 55 N -2.44 0.00 -4.05 9.48 7.64 -1.26 -4.81 113.62 118.18 2k8p n SER 55 Ca 0.00 0.75 -0.25 0.00 1.01 0.00 0.00 58.87 60.38 2k8p n SER 55 Cb 0.30 -0.27 -0.16 0.00 -1.01 0.00 0.00 64.21 63.06 2k8p n SER 55 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8p s ARG 57 N 0.52 4.02 0.03 0.00 3.00 0.75 -4.79 118.95 122.48 2k8p s ARG 57 Ca -0.12 2.35 -0.27 0.00 -1.00 0.00 0.00 55.73 56.68 2k8p s ARG 57 Cb -0.15 -4.12 -0.05 0.00 0.00 0.00 0.00 34.95 30.64 2k8p s ARG 57 CO 0.04 -1.07 0.84 -1.21 0.00 0.00 0.00 175.30 173.90 2k8p s GLU 58 N 4.55 4.54 0.07 5.12 2.02 -1.26 -2.22 118.70 131.52 2k8p s GLU 58 Ca 0.84 1.19 0.08 0.00 0.02 0.00 0.00 54.97 57.10 2k8p s GLU 58 Cb -0.37 -3.40 -0.03 0.00 0.10 0.00 0.00 34.13 30.42 2k8p s GLU 58 CO 0.36 0.15 -0.20 -0.51 0.02 0.00 0.00 175.26 175.08 2k8p s LEU 59 N 0.37 2.55 -0.16 1.80 1.43 0.74 -4.98 118.68 120.44 2k8p s LEU 59 Ca 0.43 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 53.02 2k8p s LEU 59 Cb -0.21 -1.47 -0.01 0.00 0.03 0.00 0.00 46.19 44.53 2k8p s LEU 59 CO 0.25 0.23 -0.11 -1.00 0.23 0.00 0.00 176.35 175.95 2k8p s HIS 60 N -0.97 2.86 0.18 0.29 3.76 -1.26 -0.16 115.29 119.99 2k8p s HIS 60 Ca 0.15 -0.82 0.10 0.00 -0.15 0.00 0.00 55.06 54.34 2k8p s HIS 60 Cb -0.10 -1.94 -0.04 0.00 1.11 0.00 0.00 32.58 31.61 2k8p s HIS 60 CO 0.06 -0.37 -0.22 -0.06 -0.85 0.00 0.00 174.74 173.30 2k8p s PHE 61 N 0.79 2.13 0.12 1.40 0.40 0.53 -4.96 117.98 118.39 2k8p s PHE 61 Ca -0.04 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 55.96 2k8p s PHE 61 Cb -0.15 -1.06 -0.04 0.00 0.51 0.00 0.00 43.02 42.28 2k8p s PHE 61 CO 0.01 0.44 -0.15 0.99 0.70 0.00 0.00 175.22 177.21 2k8p s THR 62 N -1.76 1.39 -0.25 0.64 2.01 -1.26 -0.19 115.64 116.21 2k8p s THR 62 Ca 0.19 -1.69 -0.28 0.00 0.31 0.00 0.00 61.69 60.21 2k8p s THR 62 Cb -0.07 -1.53 0.17 0.00 0.01 0.00 0.00 72.50 71.07 2k8p s THR 62 CO 0.09 -0.36 1.24 -0.13 -0.69 0.00 0.00 174.62 174.76 2k8p s ARG 63 N -2.55 0.26 -0.33 4.92 0.52 -1.02 -4.97 118.95 115.77 2k8p s ARG 63 Ca 0.09 0.12 -0.20 0.00 -0.52 0.00 0.00 55.73 55.22 2k8p s ARG 63 Cb -0.06 0.12 -0.00 0.00 0.52 0.00 0.00 34.95 35.53 2k8p s ARG 63 CO 0.03 -0.07 0.61 0.71 0.02 0.00 0.00 175.30 176.61 2k8p s TYR 64 N -0.72 3.18 0.11 -0.53 2.02 -1.26 -0.33 117.35 119.82 2k8p s TYR 64 Ca 0.05 0.43 -0.18 0.00 -0.37 0.00 0.00 57.07 56.99 2k8p s TYR 64 Cb -0.02 -3.04 -0.07 0.00 -0.40 0.00 0.00 41.96 38.43 2k8p s TYR 64 CO -0.06 -0.55 0.59 0.54 -1.57 0.00 0.00 175.55 174.50 2k8p s VAL 65 N 2.62 4.73 -0.17 0.71 0.11 -1.26 -4.98 120.40 122.16 2k8p s VAL 65 Ca 0.24 1.14 -0.08 0.00 -2.93 0.00 0.00 61.98 60.35 2k8p s VAL 65 Cb -0.15 -3.86 0.07 0.00 -1.53 0.00 0.00 36.38 30.91 2k8p s VAL 65 CO 0.13 0.43 0.38 0.42 -3.33 0.00 0.00 175.10 173.13 2k8p s THR 66 N -1.25 -0.24 -0.26 5.04 -4.23 -1.26 -1.64 115.64 111.79 2k8p s THR 66 Ca 0.33 0.14 -0.00 0.00 -1.18 0.00 0.00 61.69 60.98 2k8p s THR 66 Cb -0.18 -0.58 0.08 0.00 1.34 0.00 0.00 72.50 73.16 2k8p s THR 66 CO 0.20 0.06 0.04 -0.62 -0.54 0.00 0.00 174.62 173.75 2k8p s ASP 67 N 1.84 3.79 0.00 3.99 -1.08 -1.23 -5.03 116.67 118.95 2k8p s ASP 67 Ca -0.06 -1.37 0.00 0.00 -0.52 0.00 0.00 52.55 50.60 2k8p s ASP 67 Cb -0.10 -0.96 0.00 0.00 -1.46 0.00 0.00 42.92 40.40 2k8p s ASP 67 CO -0.12 -0.34 0.00 0.61 0.52 0.00 0.00 175.17 175.85 2k8p n GLY 68 N 4.79 -1.23 0.00 2.66 0.00 -1.26 -4.12 105.19 106.03 2k8p n GLY 68 Ca -0.06 -1.65 0.07 0.00 0.00 0.00 0.00 46.02 44.38 2k8p n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k8p n PRO 69 N 0.00 0.19 -4.04 1.61 -0.04 -1.26 -4.74 135.00 126.72 2k8p n PRO 69 Ca 0.00 0.16 -0.22 0.00 -0.04 0.00 0.00 63.50 63.40 2k8p n PRO 69 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2k8p n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k8p s ARG 71 N -3.87 0.12 0.47 0.00 3.00 0.18 -3.51 118.95 115.33 2k8p s ARG 71 Ca 0.33 -0.21 -0.23 0.00 0.00 0.00 0.00 55.73 55.61 2k8p s ARG 71 Cb -0.09 0.03 -0.08 0.00 0.00 0.00 0.00 34.95 34.81 2k8p s ARG 71 CO 0.27 -0.01 1.17 0.45 0.00 0.00 0.00 175.30 177.17 2k8p n SER 72 N 2.57 1.96 0.15 0.23 2.88 -0.65 -0.13 113.62 120.62 2k8p n SER 72 Ca -0.16 1.02 0.03 0.00 -1.33 0.00 0.00 58.87 58.43 2k8p n SER 72 Cb 0.58 -1.46 0.10 0.00 -0.75 0.00 0.00 64.21 62.69 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 1.60 0.74 -2.46 -1.46 0.00 -1.27 -3.45 119.26 112.96 2k8p h ALA 73 Ca -0.47 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 53.91 2k8p h ALA 73 Cb 1.32 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.89 2k8p h ALA 73 CO 0.57 0.60 -0.44 0.15 0.00 0.00 0.00 179.25 180.13 2k8p s LYS 74 N -3.11 0.82 0.30 0.00 1.02 -1.26 -5.13 119.74 112.38 2k8p s LYS 74 Ca 0.03 -1.04 -0.29 0.00 0.02 0.00 0.00 55.97 54.69 2k8p s LYS 74 Cb 0.08 0.32 -0.10 0.00 -0.52 0.00 0.00 37.83 37.61 2k8p s LYS 74 CO 0.73 -0.25 1.24 -1.25 -0.92 0.00 0.00 175.35 174.90 2k8p s PRO 75 N -3.89 4.46 0.08 -1.68 0.04 -1.26 -4.68 135.00 128.07 2k8p s PRO 75 Ca 0.07 2.06 -0.20 0.00 0.04 0.00 0.00 61.00 62.97 2k8p s PRO 75 Cb 0.05 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.40 2k8p s PRO 75 CO -0.10 -0.06 0.58 0.54 0.04 0.00 0.00 177.00 178.01 2k8p s VAL 76 N -0.99 4.72 -0.13 -0.36 0.11 0.55 -4.83 120.40 119.47 2k8p s VAL 76 Ca 0.48 1.25 -0.15 0.00 -2.93 0.00 0.00 61.98 60.63 2k8p s VAL 76 Cb -0.37 -3.91 -0.05 0.00 -1.53 0.00 0.00 36.38 30.52 2k8p s VAL 76 CO 0.47 0.55 0.36 -0.89 -3.33 0.00 0.00 175.10 172.26 2k8p s THR 77 N -1.08 5.24 0.03 5.04 2.01 -1.26 -2.44 115.64 123.19 2k8p s THR 77 Ca 0.29 0.70 0.08 0.00 0.31 0.00 0.00 61.69 63.07 2k8p s THR 77 Cb -0.20 -3.69 -0.02 0.00 0.01 0.00 0.00 72.50 68.60 2k8p s THR 77 CO 0.19 0.40 -0.23 -0.70 -0.69 0.00 0.00 174.62 173.59 2k8p s GLU 78 N 0.28 1.64 -0.32 4.92 2.12 0.73 -4.97 118.70 123.10 2k8p s GLU 78 Ca 0.20 -0.96 -0.09 0.00 0.36 0.00 0.00 54.97 54.48 2k8p s GLU 78 Cb -0.14 -1.73 -0.00 0.00 0.26 0.00 0.00 34.13 32.52 2k8p s GLU 78 CO 0.07 0.45 0.15 -1.17 -0.54 0.00 0.00 175.26 174.22 2k8p s LEU 79 N -1.03 4.13 -0.11 2.70 0.20 -1.26 -0.35 118.68 122.97 2k8p s LEU 79 Ca 0.09 -0.61 -0.05 0.00 0.69 0.00 0.00 54.13 54.25 2k8p s LEU 79 Cb -0.09 -1.98 -0.04 0.00 -0.43 0.00 0.00 46.19 43.65 2k8p s LEU 79 CO 0.01 -0.22 0.08 -0.69 -0.29 0.00 0.00 176.35 175.25 2k8p s VAL 80 N 1.59 5.03 -0.11 1.68 1.01 0.77 -4.33 120.40 126.04 2k8p s VAL 80 Ca 0.04 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.96 2k8p s VAL 80 Cb -0.17 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2k8p s VAL 80 CO 0.06 0.61 0.18 0.00 0.00 0.00 0.00 175.10 175.95 2k8p s SER 82 N -0.91 -0.97 0.00 0.00 0.15 -0.94 -4.97 113.70 106.05 2k8p s SER 82 Ca 0.16 1.46 0.00 0.00 0.70 0.00 0.00 55.95 58.27 2k8p s SER 82 Cb -0.13 1.70 0.00 0.00 -1.71 0.00 0.00 66.02 65.89 2k8p s SER 82 CO 0.05 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.88 2k8p n GLY 83 N 4.69 2.34 3.03 9.45 0.00 -1.26 -0.17 105.19 123.26 2k8p n GLY 83 Ca -0.17 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.00 0.30 0.37 1.61 0.74 -1.26 -4.68 119.66 114.75 2k8p s GLN 84 Ca 0.00 0.70 0.05 0.00 0.05 0.00 0.00 55.36 56.16 2k8p s GLN 84 Cb 0.00 -0.21 -0.07 0.00 1.10 0.00 0.00 33.01 33.84 2k8p s GLN 84 CO 0.00 -0.47 0.04 0.00 -0.55 0.00 0.00 175.29 174.30 2k8p n GLY 86 N -0.85 -1.66 0.00 0.00 0.00 -1.26 -4.84 105.19 96.58 2k8p n GLY 86 Ca -0.04 0.67 0.07 0.00 0.00 0.00 0.00 46.02 46.72 2k8p n GLY 86 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k8p n PRO 87 N 0.00 0.12 -3.09 1.61 -0.04 -1.26 -4.91 135.00 127.42 2k8p n PRO 87 Ca 0.00 0.19 -0.02 0.00 -0.04 0.00 0.00 63.50 63.64 2k8p n PRO 87 Cb 0.00 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 31.97 2k8p n PRO 87 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k8p n ALA 88 N -1.38 -2.50 -4.10 0.55 0.00 -1.26 -5.01 120.51 106.80 2k8p n ALA 88 Ca 0.05 0.01 -0.33 0.00 0.00 0.00 0.00 53.44 53.18 2k8p n ALA 88 Cb 0.14 -1.88 -0.16 0.00 0.00 0.00 0.00 19.45 17.55 2k8p n ALA 88 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2k8p s ARG 89 N -3.16 2.70 -0.01 0.00 1.04 -1.26 -5.11 118.95 113.14 2k8p s ARG 89 Ca 0.04 -1.02 0.03 0.00 -1.04 0.00 0.00 55.73 53.74 2k8p s ARG 89 Cb -0.01 -2.69 -0.03 0.00 -2.04 0.00 0.00 34.95 30.18 2k8p s ARG 89 CO 0.75 -0.35 -0.09 -0.48 -0.04 0.00 0.00 175.30 175.09 2k8p s LEU 90 N 1.22 3.05 0.28 -1.89 2.34 -1.26 -5.13 118.68 117.28 2k8p s LEU 90 Ca -0.00 -0.17 0.10 0.00 0.06 0.00 0.00 54.13 54.12 2k8p s LEU 90 Cb -0.16 -1.73 -0.05 0.00 -0.56 0.00 0.00 46.19 43.70 2k8p s LEU 90 CO -0.10 0.30 -0.08 -0.76 -1.06 0.00 0.00 176.35 174.64 2k8p s LEU 91 N -1.26 2.92 0.48 1.48 1.02 -1.26 -5.03 118.68 117.03 2k8p s LEU 91 Ca 0.15 -0.85 0.27 0.00 0.02 0.00 0.00 54.13 53.73 2k8p s LEU 91 Cb -0.11 -1.41 1.15 0.00 0.02 0.00 0.00 46.19 45.84 2k8p s LEU 91 CO 0.06 -0.01 1.92 1.55 0.02 0.00 0.00 176.35 179.88 2k8p h PRO 92 N 2.04 0.00 -0.51 1.29 0.13 -2.03 -3.41 132.00 129.51 2k8p h PRO 92 Ca -0.42 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.76 2k8p h PRO 92 Cb 1.25 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.20 2k8p h PRO 92 CO 0.61 0.15 -0.24 -0.80 -0.23 0.00 0.00 178.00 177.49 2k8p s ASN 93 N -6.05 -0.79 0.00 1.44 0.02 -1.26 -5.01 114.94 103.29 2k8p s ASN 93 Ca -0.00 -0.41 0.00 0.00 -1.02 0.00 0.00 52.86 51.43 2k8p s ASN 93 Cb 0.11 1.01 0.00 0.00 0.02 0.00 0.00 41.25 42.38 2k8p s ASN 93 CO 0.60 -0.09 0.54 0.00 0.02 0.00 0.00 177.10 178.17 2k8p n ALA 94 N 3.95 1.08 -1.27 0.60 0.00 -1.26 -5.14 120.51 118.47 2k8p n ALA 94 Ca 0.08 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2k8p n ALA 94 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 2k8p n ALA 94 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2k8p n ILE 95 N -0.05 -2.73 -3.14 0.00 5.41 -1.26 -5.03 119.36 112.57 2k8p n ILE 95 Ca 0.00 1.31 0.04 0.00 1.00 0.00 0.00 62.75 65.10 2k8p n ILE 95 Cb 0.47 -2.09 -0.00 0.00 -0.71 0.00 0.00 39.64 37.32 2k8p n ILE 95 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2k8p s GLY 96 N -4.62 -1.23 0.77 7.39 0.00 -1.26 -5.09 107.32 103.28 2k8p s GLY 96 Ca 0.00 1.10 -0.10 0.00 0.00 0.00 0.00 44.72 45.72 2k8p s GLY 96 CO 0.00 3.79 1.12 -1.60 0.00 0.00 0.00 173.10 176.41 2k8p s ARG 97 N 2.63 2.07 0.00 2.90 3.52 -1.26 -5.03 118.95 123.78 2k8p s ARG 97 Ca 0.14 -0.00 0.00 0.00 -0.13 0.00 0.00 55.73 55.74 2k8p s ARG 97 Cb -0.07 -2.03 0.00 0.00 -1.56 0.00 0.00 34.95 31.29 2k8p s ARG 97 CO -0.22 -1.46 0.00 0.41 -0.81 0.00 0.00 175.30 173.23 2k8p n GLY 98 N -3.17 -1.66 2.68 8.12 0.00 -1.26 -4.66 105.19 105.24 2k8p n GLY 98 Ca 0.08 0.97 -0.21 0.00 0.00 0.00 0.00 46.02 46.86 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 -0.00 -0.69 1.61 1.02 -1.26 -4.97 119.74 115.44 2k8p s LYS 99 Ca 0.00 0.27 -0.27 0.00 0.02 0.00 0.00 55.97 55.98 2k8p s LYS 99 Cb 0.00 -0.89 0.03 0.00 -0.52 0.00 0.00 37.83 36.44 2k8p s LYS 99 CO 0.00 -0.44 1.27 -1.58 -0.92 0.00 0.00 175.35 173.67 2k8p s TRP 100 N 2.19 2.36 0.12 3.18 0.51 -1.26 -4.90 118.94 121.14 2k8p s TRP 100 Ca 0.04 0.09 -0.27 0.00 -2.12 0.00 0.00 56.10 53.84 2k8p s TRP 100 Cb -0.13 -4.59 -0.06 0.00 -0.81 0.00 0.00 33.47 27.88 2k8p s TRP 100 CO -0.06 -1.95 1.62 2.35 -0.51 0.00 0.00 176.95 178.40 2k8p h TRP 101 N 9.99 -0.80 -2.93 -1.98 -0.00 -1.99 -3.43 115.95 114.82 2k8p h TRP 101 Ca -0.27 0.02 -0.48 0.00 -0.00 0.00 0.00 58.89 58.17 2k8p h TRP 101 Cb 1.05 0.35 0.02 0.00 -0.00 0.00 0.00 29.16 30.58 2k8p h TRP 101 CO 1.10 -0.39 -0.13 1.03 -0.00 0.00 0.00 178.44 180.06 2k8p s ARG 102 N -6.03 3.44 0.49 2.65 0.52 -1.26 -5.00 118.95 113.77 2k8p s ARG 102 Ca -0.16 -0.26 0.28 0.00 -0.52 0.00 0.00 55.73 55.07 2k8p s ARG 102 Cb 0.09 -2.60 1.18 0.00 0.52 0.00 0.00 34.95 34.14 2k8p s ARG 102 CO 0.65 0.03 1.93 -1.00 0.02 0.00 0.00 175.30 176.93 2k8p h PRO 103 N 0.61 0.00 -6.21 3.54 0.13 -2.04 -3.43 132.00 124.60 2k8p h PRO 103 Ca -0.49 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.09 2k8p h PRO 103 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2k8p h PRO 103 CO 0.61 0.13 0.20 0.45 -0.23 0.00 0.00 178.00 179.16 2k8p s SER 104 N -6.00 7.16 0.00 1.44 0.15 -1.26 -4.81 113.70 110.38 2k8p s SER 104 Ca 0.00 1.40 0.00 0.00 0.70 0.00 0.00 55.95 58.05 2k8p s SER 104 Cb 0.10 -2.48 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 2k8p s SER 104 CO 0.59 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.50 2k8p n GLY 105 N 2.90 -0.28 0.17 9.45 0.00 -1.26 -4.99 105.19 111.18 2k8p n GLY 105 Ca 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 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 0.09 -2.41 1.61 0.13 -1.99 -3.46 132.00 125.96 2k8p h PRO 106 Ca 0.00 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.12 2k8p h PRO 106 Cb 0.00 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 30.98 2k8p h PRO 106 CO 0.00 0.55 0.35 0.16 -0.23 0.00 0.00 178.00 178.83 2k8p s ASP 107 N -6.89 -0.49 -0.20 1.44 -4.77 -1.26 -5.07 116.67 99.43 2k8p s ASP 107 Ca -0.03 0.16 -0.27 0.00 -3.30 0.00 0.00 52.55 49.12 2k8p s ASP 107 Cb 0.13 0.48 0.07 0.00 -1.09 0.00 0.00 42.92 42.51 2k8p s ASP 107 CO 0.76 -0.71 0.71 -0.36 0.70 0.00 0.00 175.17 176.27 2k8p s PHE 108 N -2.80 -0.75 -0.09 2.11 0.08 -1.26 -5.05 117.98 110.23 2k8p s PHE 108 Ca 0.00 1.67 0.15 0.00 0.12 0.00 0.00 56.93 58.87 2k8p s PHE 108 Cb -0.01 0.31 0.31 0.00 -0.57 0.00 0.00 43.02 43.06 2k8p s PHE 108 CO -0.06 -0.45 1.14 2.89 -0.10 0.00 0.00 175.22 178.64 2k8p n ARG 109 N 2.13 0.73 -3.65 0.44 0.00 -1.26 -4.79 116.66 110.27 2k8p n ARG 109 Ca -0.16 -2.29 -0.02 0.00 -0.00 0.00 0.00 57.85 55.38 2k8p n ARG 109 Cb 0.56 -0.89 -0.07 0.00 -0.00 0.00 0.00 32.46 32.05 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 0.19 4.09 1.17 0.00 -4.36 0.10 -4.90 121.20 117.49 2k8p s ILE 111 Ca 0.05 -1.28 -0.18 0.00 -0.26 0.00 0.00 60.65 58.98 2k8p s ILE 111 Cb -0.05 -3.08 0.27 0.00 1.25 0.00 0.00 42.46 40.85 2k8p s ILE 111 CO -0.14 -0.12 1.11 -2.16 0.24 0.00 0.00 174.94 173.86 2k8p s PRO 112 N -3.06 -0.95 0.02 0.37 0.04 -1.26 -1.19 135.00 128.97 2k8p s PRO 112 Ca 0.29 0.04 -0.00 0.00 0.04 0.00 0.00 61.00 61.37 2k8p s PRO 112 Cb -0.10 -1.62 0.00 0.00 0.04 0.00 0.00 34.50 32.83 2k8p s PRO 112 CO 0.21 -3.55 0.03 -3.47 0.04 0.00 0.00 177.00 170.26 2k8p n ASP 113 N -4.67 -0.08 -4.55 6.66 -0.08 -1.23 -4.12 116.55 108.48 2k8p n ASP 113 Ca 0.12 -1.11 -0.42 0.00 -1.51 0.00 0.00 54.79 51.87 2k8p n ASP 113 Cb 0.59 0.15 0.01 0.00 2.34 0.00 0.00 41.12 44.21 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 1.04 -3.44 -0.67 0.63 -1.26 -4.63 116.66 108.30 2k8p n ARG 114 Ca 0.00 0.37 -0.22 0.00 -0.92 0.00 0.00 57.85 57.09 2k8p n ARG 114 Cb 0.03 -1.81 0.01 0.00 0.45 0.00 0.00 32.46 31.14 2k8p n ARG 114 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2k8p s TYR 115 N -1.31 2.00 -0.13 -0.14 1.51 -1.26 -1.23 117.35 116.80 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 -2.13 0.05 0.00 -0.11 0.00 0.00 41.96 39.17 2k8p s TYR 115 CO 0.57 -0.57 0.09 1.03 -1.11 0.00 0.00 175.55 175.56 2k8p s ARG 116 N -4.36 0.02 -0.45 -0.62 0.52 0.83 -4.53 118.95 110.35 2k8p s ARG 116 Ca 0.49 0.11 -0.24 0.00 -0.52 0.00 0.00 55.73 55.57 2k8p s ARG 116 Cb -0.04 -1.31 0.03 0.00 0.52 0.00 0.00 34.95 34.15 2k8p s ARG 116 CO 0.30 -0.54 0.82 0.00 0.02 0.00 0.00 175.30 175.89 2k8p s ALA 117 N 2.17 3.28 0.12 2.13 0.00 -1.26 -2.28 121.76 125.92 2k8p s ALA 117 Ca 0.03 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.05 2k8p s ALA 117 Cb -0.15 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 2k8p s ALA 117 CO -0.07 -1.96 0.28 -1.14 0.00 0.00 0.00 175.76 172.87 2k8p s GLN 118 N 3.41 3.46 -0.22 0.00 0.74 -0.12 -4.87 119.66 122.06 2k8p s GLN 118 Ca 0.32 -0.49 -0.05 0.00 0.05 0.00 0.00 55.36 55.19 2k8p s GLN 118 Cb -0.12 -2.97 -0.02 0.00 1.10 0.00 0.00 33.01 31.01 2k8p s GLN 118 CO 0.24 0.53 -0.01 1.03 -0.55 0.00 0.00 175.29 176.53 2k8p s ARG 119 N -2.97 3.50 0.07 1.67 0.52 -1.26 -0.15 118.95 120.33 2k8p s ARG 119 Ca 0.35 -0.57 0.01 0.00 -0.52 0.00 0.00 55.73 55.00 2k8p s ARG 119 Cb -0.12 -3.09 -0.04 0.00 0.52 0.00 0.00 34.95 32.23 2k8p s ARG 119 CO 0.28 -0.13 0.19 0.54 0.02 0.00 0.00 175.30 176.20 2k8p s VAL 120 N 1.36 5.24 -0.23 3.52 0.11 0.65 -4.93 120.40 126.10 2k8p s VAL 120 Ca 0.04 -0.47 -0.03 0.00 -2.93 0.00 0.00 61.98 58.60 2k8p s VAL 120 Cb -0.15 -3.56 0.01 0.00 -1.53 0.00 0.00 36.38 31.16 2k8p s VAL 120 CO -0.00 0.13 -0.05 -1.58 -3.33 0.00 0.00 175.10 170.26 2k8p s GLN 121 N -2.52 3.13 -0.17 1.54 0.74 -1.26 -1.18 119.66 119.94 2k8p s GLN 121 Ca 0.34 -0.78 -0.07 0.00 0.05 0.00 0.00 55.36 54.90 2k8p s GLN 121 Cb -0.13 -2.99 -0.04 0.00 1.10 0.00 0.00 33.01 30.95 2k8p s GLN 121 CO 0.27 -0.29 0.05 -0.51 -0.55 0.00 0.00 175.29 174.26 2k8p s LEU 122 N 1.41 3.73 0.05 3.68 1.43 -0.25 -0.74 118.68 127.99 2k8p s LEU 122 Ca 0.04 0.06 -0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2k8p s LEU 122 Cb -0.15 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 2k8p s LEU 122 CO -0.04 0.18 0.20 -0.76 0.23 0.00 0.00 176.35 176.16 2k8p s LEU 123 N 0.30 4.33 0.16 1.79 2.01 0.81 -1.08 118.68 127.01 2k8p s LEU 123 Ca 0.02 0.27 0.09 0.00 0.01 0.00 0.00 54.13 54.52 2k8p s LEU 123 Cb -0.13 -2.88 -0.04 0.00 0.01 0.00 0.00 46.19 43.15 2k8p s LEU 123 CO 0.01 0.19 -0.19 0.00 1.01 0.00 0.00 176.35 177.36 2k8p s PRO 125 N -2.72 -1.48 -0.20 0.00 0.04 -1.26 -4.77 135.00 124.61 2k8p s PRO 125 Ca 0.16 -0.15 -0.37 0.00 0.04 0.00 0.00 61.00 60.67 2k8p s PRO 125 Cb -0.06 -1.57 -0.13 0.00 0.04 0.00 0.00 34.50 32.77 2k8p s PRO 125 CO 0.07 -3.87 1.85 0.41 0.04 0.00 0.00 177.00 175.51 2k8p n GLY 126 N -0.92 1.11 0.00 0.56 0.00 -1.26 -2.53 105.19 102.15 2k8p n GLY 126 Ca 0.14 0.90 0.00 0.00 0.00 0.00 0.00 46.02 47.07 2k8p n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k8p n GLY 127 N 4.52 1.62 3.60 -0.02 0.00 -1.26 -5.11 105.19 108.53 2k8p n GLY 127 Ca 0.26 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.01 0.54 0.26 1.61 2.02 -1.05 -5.17 118.70 116.91 2k8p s GLU 128 Ca 0.00 0.27 0.05 0.00 0.02 0.00 0.00 54.97 55.31 2k8p s GLU 128 Cb 0.00 0.26 -0.03 0.00 0.10 0.00 0.00 34.13 34.46 2k8p s GLU 128 CO 0.00 -0.14 0.39 0.00 0.02 0.00 0.00 175.26 175.53 2k8p s ALA 129 N -0.70 3.97 0.46 5.21 0.00 -1.26 -4.55 121.76 124.89 2k8p s ALA 129 Ca 0.00 -1.25 -0.23 0.00 0.00 0.00 0.00 51.96 50.48 2k8p s ALA 129 Cb -0.02 -1.74 -0.07 0.00 0.00 0.00 0.00 23.12 21.28 2k8p s ALA 129 CO -0.01 0.17 1.17 -1.25 0.00 0.00 0.00 175.76 175.83 2k8p s PRO 130 N -4.04 3.77 0.41 0.00 0.04 -1.26 -4.53 135.00 129.40 2k8p s PRO 130 Ca 0.36 1.78 0.06 0.00 0.04 0.00 0.00 61.00 63.24 2k8p s PRO 130 Cb -0.09 -2.42 -0.07 0.00 0.04 0.00 0.00 34.50 31.96 2k8p s PRO 130 CO 0.30 -0.54 0.02 1.03 0.04 0.00 0.00 177.00 177.84 2k8p s ARG 131 N -2.68 1.95 -0.10 4.56 0.52 -0.24 -4.96 118.95 118.01 2k8p s ARG 131 Ca 0.63 -2.13 0.02 0.00 -0.52 0.00 0.00 55.73 53.73 2k8p s ARG 131 Cb -0.29 -1.48 0.01 0.00 0.52 0.00 0.00 34.95 33.71 2k8p s ARG 131 CO 0.35 -0.13 -0.17 0.00 0.02 0.00 0.00 175.30 175.37 2k8p s ALA 132 N -2.83 1.72 -0.10 2.13 0.00 -1.26 -1.09 121.76 120.32 2k8p s ALA 132 Ca 0.30 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.58 2k8p s ALA 132 Cb 0.08 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.44 2k8p s ALA 132 CO 0.15 0.06 -0.24 0.50 0.00 0.00 0.00 175.76 176.23 2k8p s ARG 133 N 0.75 3.06 0.12 0.00 3.00 -0.32 -4.94 118.95 120.61 2k8p s ARG 133 Ca -0.11 -0.87 -0.20 0.00 -1.00 0.00 0.00 55.73 53.54 2k8p s ARG 133 Cb -0.16 -2.31 -0.07 0.00 0.00 0.00 0.00 34.95 32.41 2k8p s ARG 133 CO 0.02 0.17 0.63 0.21 0.00 0.00 0.00 175.30 176.34 2k8p s LYS 134 N 0.36 4.27 -0.10 5.12 2.20 -1.26 -0.25 119.74 130.08 2k8p s LYS 134 Ca -0.18 0.83 0.00 0.00 -0.36 0.00 0.00 55.97 56.26 2k8p s LYS 134 Cb -0.18 -3.18 0.02 0.00 -1.51 0.00 0.00 37.83 32.98 2k8p s LYS 134 CO 0.08 0.59 -0.08 0.14 -0.36 0.00 0.00 175.35 175.72 2k8p s VAL 135 N -1.19 0.97 -0.53 4.02 -7.23 0.79 -4.97 120.40 112.26 2k8p s VAL 135 Ca 0.33 -0.28 -0.20 0.00 -1.81 0.00 0.00 61.98 60.01 2k8p s VAL 135 Cb -0.20 -0.98 0.06 0.00 0.56 0.00 0.00 36.38 35.83 2k8p s VAL 135 CO 0.21 0.35 0.72 -0.60 -0.31 0.00 0.00 175.10 175.47 2k8p s ARG 136 N 1.50 3.16 0.06 4.82 6.06 -1.26 -0.95 118.95 132.34 2k8p s ARG 136 Ca 0.01 -0.78 0.09 0.00 -2.50 0.00 0.00 55.73 52.54 2k8p s ARG 136 Cb -0.13 -4.11 -0.03 0.00 0.06 0.00 0.00 34.95 30.74 2k8p s ARG 136 CO -0.05 -1.34 -0.24 -0.51 -2.50 0.00 0.00 175.30 170.66 2k8p s LEU 137 N 3.00 2.19 0.30 -0.88 1.02 -0.96 -4.96 118.68 118.39 2k8p s LEU 137 Ca 0.19 -0.59 -0.28 0.00 0.02 0.00 0.00 54.13 53.46 2k8p s LEU 137 Cb -0.18 -1.15 -0.14 0.00 0.02 0.00 0.00 46.19 44.75 2k8p s LEU 137 CO 0.13 0.20 1.07 0.52 0.02 0.00 0.00 176.35 178.29 2k8p n VAL 138 N 1.65 2.00 -0.06 -1.59 0.31 -1.26 -0.12 118.33 119.27 2k8p n VAL 138 Ca -0.17 -0.50 -0.06 0.00 -0.01 0.00 0.00 64.34 63.60 2k8p n VAL 138 Cb 0.53 -1.13 -0.08 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 0.23 1.73 -4.14 3.52 0.00 -0.41 -4.11 120.51 117.33 2k8p n ALA 139 Ca 0.08 -0.69 -0.20 0.00 0.00 0.00 0.00 53.44 52.63 2k8p n ALA 139 Cb 0.33 0.05 -0.06 0.00 0.00 0.00 0.00 19.45 19.77 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 -2.49 -0.80 -3.62 0.00 7.64 -0.37 -4.99 113.62 108.99 2k8p n SER 140 Ca -0.19 -3.00 -0.14 0.00 1.01 0.00 0.00 58.87 56.55 2k8p n SER 140 Cb 0.84 1.75 -0.07 0.00 -1.01 0.00 0.00 64.21 65.72 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 0.27 1.43 -0.29 0.00 1.02 -0.33 -4.54 119.74 117.31 2k8p s LYS 142 Ca -0.00 -1.45 0.02 0.00 0.02 0.00 0.00 55.97 54.55 2k8p s LYS 142 Cb -0.05 -1.75 0.07 0.00 -0.52 0.00 0.00 37.83 35.58 2k8p s LYS 142 CO 0.01 0.38 -0.05 0.00 -0.92 0.00 0.00 175.35 174.78 2k8p s LYS 144 N 1.11 0.17 0.46 0.00 2.20 -1.26 -4.93 119.74 117.48 2k8p s LYS 144 Ca -0.05 0.41 -0.07 0.00 -0.36 0.00 0.00 55.97 55.90 2k8p s LYS 144 Cb -0.20 -0.09 -0.05 0.00 -1.51 0.00 0.00 37.83 35.99 2k8p s LYS 144 CO -0.05 -0.13 0.78 0.50 -0.36 0.00 0.00 175.35 176.10 2k8p s ARG 145 N 0.95 3.62 0.21 4.03 3.52 -1.26 -4.37 118.95 125.64 2k8p s ARG 145 Ca -0.07 0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 55.82 2k8p s ARG 145 Cb -0.09 -2.38 -0.04 0.00 -1.56 0.00 0.00 34.95 30.89 2k8p s ARG 145 CO -0.05 -0.15 0.16 -0.48 -0.81 0.00 0.00 175.30 173.96 2k8p s LEU 146 N -4.44 1.13 0.14 -0.88 0.05 -1.26 -5.07 118.68 108.35 2k8p s LEU 146 Ca 0.49 -1.38 -0.13 0.00 0.05 0.00 0.00 54.13 53.16 2k8p s LEU 146 Cb -0.10 0.47 -0.07 0.00 -2.05 0.00 0.00 46.19 44.44 2k8p s LEU 146 CO 0.40 -0.87 0.53 0.42 -0.55 0.00 0.00 176.35 176.29 2k8p s THR 147 N -4.12 4.90 0.27 5.48 -4.23 -1.26 -5.09 115.64 111.59 2k8p s THR 147 Ca 0.38 0.75 0.03 0.00 -1.18 0.00 0.00 61.69 61.66 2k8p s THR 147 Cb 0.06 -3.71 -0.06 0.00 1.34 0.00 0.00 72.50 70.14 2k8p s THR 147 CO 0.12 0.23 0.06 0.00 -0.54 0.00 0.00 174.62 174.49 2k8p s ARG 148 N -2.02 1.47 0.00 3.99 1.70 -1.26 -4.91 118.95 117.93 2k8p s ARG 148 Ca 0.38 -1.79 0.03 0.00 -0.47 0.00 0.00 55.73 53.88 2k8p s ARG 148 Cb -0.15 -0.54 -0.01 0.00 -0.57 0.00 0.00 34.95 33.69 2k8p s ARG 148 CO 0.19 -0.21 -0.10 0.12 -1.08 0.00 0.00 175.30 174.22 2k8p s PHE 149 N -3.53 0.86 0.19 5.89 5.36 -1.26 -5.16 117.98 120.33 2k8p s PHE 149 Ca 0.35 -0.21 0.08 0.00 -0.96 0.00 0.00 56.93 56.19 2k8p s PHE 149 Cb 0.08 -0.54 -0.04 0.00 -0.34 0.00 0.00 43.02 42.18 2k8p s PHE 149 CO 0.13 -0.01 -0.01 -1.58 -1.46 0.00 0.00 175.22 172.29 2k8p s HIS 150 N -0.41 2.80 0.49 10.12 2.46 -1.26 -5.14 115.29 124.35 2k8p s HIS 150 Ca 0.02 -0.16 0.05 0.00 0.47 0.00 0.00 55.06 55.44 2k8p s HIS 150 Cb -0.05 -1.33 0.03 0.00 -0.13 0.00 0.00 32.58 31.10 2k8p s HIS 150 CO -0.00 0.54 0.68 -0.80 -2.47 0.00 0.00 174.74 172.68 2k8p s ASN 151 N -3.09 5.42 0.00 9.88 0.01 -1.26 -5.08 114.94 120.82 2k8p s ASN 151 Ca 0.28 -0.29 0.00 0.00 -0.71 0.00 0.00 52.86 52.14 2k8p s ASN 151 Cb -0.09 -0.66 0.00 0.00 0.41 0.00 0.00 41.25 40.92 2k8p s ASN 151 CO 0.19 -0.99 0.00 0.00 -1.51 0.00 0.00 177.10 174.79 2k8p n GLN 152 N -2.10 0.00 -1.36 -0.60 1.13 -1.26 -5.13 117.38 108.05 2k8p n GLN 152 Ca 0.09 0.00 0.19 0.00 -1.94 0.00 0.00 57.00 55.33 2k8p n GLN 152 Cb 0.59 -0.13 -0.05 0.00 0.11 0.00 0.00 30.24 30.77 2k8p n GLN 152 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2k8p n SER 153 N -2.17 -8.08 -0.98 1.08 7.64 -1.26 -5.04 113.62 104.80 2k8p n SER 153 Ca 0.00 0.54 0.00 0.00 1.01 0.00 0.00 58.87 60.42 2k8p n SER 153 Cb 0.00 -4.12 0.00 0.00 -1.01 0.00 0.00 64.21 59.08 2k8p n SER 153 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2k8p n GLU 154 N -4.06 0.00 -4.17 1.43 -0.00 -1.26 -5.19 120.64 107.39 2k8p n GLU 154 Ca 0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 57.16 57.05 2k8p n GLU 154 Cb 0.62 0.00 -0.09 0.00 -0.00 0.00 0.00 31.44 31.97 2k8p n GLU 154 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2k8p s LEU 155 N 0.00 1.05 0.37 -1.84 2.96 -1.26 -5.18 118.68 114.77 2k8p s LEU 155 Ca 0.00 -1.35 0.05 0.00 -0.22 0.00 0.00 54.13 52.62 2k8p s LEU 155 Cb 0.00 0.68 -0.03 0.00 0.50 0.00 0.00 46.19 47.34 2k8p s LEU 155 CO 0.00 -0.93 0.20 -0.54 -1.32 0.00 0.00 176.35 173.76 2k8p s LYS 156 N -4.03 1.82 -0.03 1.98 1.02 -1.26 -5.18 119.74 114.07 2k8p s LYS 156 Ca 0.36 -2.09 -0.29 0.00 0.02 0.00 0.00 55.97 53.97 2k8p s LYS 156 Cb 0.05 -0.14 0.08 0.00 -0.52 0.00 0.00 37.83 37.30 2k8p s LYS 156 CO 0.13 -0.56 0.73 0.34 -0.92 0.00 0.00 175.35 175.08 2k8p s ASP 157 N -3.48 -0.58 0.00 2.83 2.15 -1.26 -5.19 116.67 111.15 2k8p s ASP 157 Ca 0.32 0.49 0.00 0.00 0.43 0.00 0.00 52.55 53.79 2k8p s ASP 157 Cb 0.03 0.50 0.00 0.00 -0.30 0.00 0.00 42.92 43.15 2k8p s ASP 157 CO 0.20 -0.63 0.00 0.49 -0.17 0.00 0.00 175.17 175.06 2k8p n PHE 158 N 0.57 -0.21 0.00 -5.34 3.72 -1.26 -5.18 117.46 109.75 2k8p n PHE 158 Ca -0.16 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 2k8p n PHE 158 Cb 0.59 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.13 2k8p n PHE 158 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k8p n GLY 159 N 0.00 4.37 3.62 1.37 0.00 -1.26 -5.17 105.19 108.11 2k8p n GLY 159 Ca 0.00 -1.14 -0.11 0.00 0.00 0.00 0.00 46.02 44.77 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 -2.00 0.00 0.02 2.61 -1.32 -1.26 -5.18 115.64 108.51 2k8p s THR 160 Ca 0.00 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.51 2k8p s THR 160 Cb 0.00 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.98 2k8p s THR 160 CO 0.00 0.00 -0.09 -1.61 -2.21 0.00 0.00 174.62 170.71 2k8p s GLU 161 N -0.11 0.68 0.11 7.08 0.41 -1.26 -5.16 118.70 120.45 2k8p s GLU 161 Ca 0.01 -0.52 -0.09 0.00 -0.41 0.00 0.00 54.97 53.96 2k8p s GLU 161 Cb -0.04 -0.62 -0.00 0.00 -1.78 0.00 0.00 34.13 31.69 2k8p s GLU 161 CO -0.03 0.16 0.22 0.00 -0.49 0.00 0.00 175.26 175.12 2k8p s ALA 162 N -0.64 -0.20 0.32 5.21 0.00 -1.26 -5.18 121.76 120.02 2k8p s ALA 162 Ca -0.00 -0.66 0.07 0.00 0.00 0.00 0.00 51.96 51.37 2k8p s ALA 162 Cb -0.06 0.58 -0.03 0.00 0.00 0.00 0.00 23.12 23.61 2k8p s ALA 162 CO 0.00 -0.54 0.26 0.00 0.00 0.00 0.00 175.76 175.47 2k8p n ALA 163 N -0.10 0.67 -2.69 0.00 0.00 -1.26 -5.12 120.51 112.01 2k8p n ALA 163 Ca -0.13 -1.85 -0.05 0.00 0.00 0.00 0.00 53.44 51.40 2k8p n ALA 163 Cb 0.63 1.48 0.07 0.00 0.00 0.00 0.00 19.45 21.63 2k8p n ALA 163 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2k8p n ARG 164 N -0.62 0.29 -1.03 0.00 1.85 -1.26 -5.17 116.66 110.72 2k8p n ARG 164 Ca 0.06 -0.95 -0.30 0.00 -1.00 0.00 0.00 57.85 55.66 2k8p n ARG 164 Cb 0.57 -0.51 0.25 0.00 -1.05 0.00 0.00 32.46 31.72 2k8p n ARG 164 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2k8p n PRO 165 N 1.42 -3.18 -3.85 2.89 -0.04 -1.26 -5.09 135.00 125.89 2k8p n PRO 165 Ca 0.03 -1.75 -0.04 0.00 -0.04 0.00 0.00 63.50 61.70 2k8p n PRO 165 Cb 0.69 -1.65 0.01 0.00 -0.04 0.00 0.00 33.50 32.52 2k8p n PRO 165 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2k8p s GLN 166 N -5.48 1.40 0.37 0.54 0.74 -1.26 -5.19 119.66 110.78 2k8p s GLN 166 Ca 0.71 -0.88 0.04 0.00 0.05 0.00 0.00 55.36 55.27 2k8p s GLN 166 Cb -0.07 0.40 -0.04 0.00 1.10 0.00 0.00 33.01 34.40 2k8p s GLN 166 CO 0.55 -0.65 0.09 0.15 -0.55 0.00 0.00 175.29 174.87 2k8p s LYS 167 N -2.37 1.79 0.25 1.67 -0.14 -1.26 -5.17 119.74 114.51 2k8p s LYS 167 Ca 0.20 -2.05 0.01 0.00 -1.36 0.00 0.00 55.97 52.77 2k8p s LYS 167 Cb -0.03 -0.78 -0.05 0.00 -1.68 0.00 0.00 37.83 35.29 2k8p s LYS 167 CO 0.05 -0.32 0.09 0.20 -0.76 0.00 0.00 175.35 174.62 2k8p s GLY 168 N -3.55 1.67 -0.20 -3.33 0.00 -1.26 -5.15 107.32 95.50 2k8p s GLY 168 Ca 0.30 -1.83 -0.04 0.00 0.00 0.00 0.00 44.72 43.15 2k8p s GLY 168 CO 0.14 -1.57 -0.05 1.09 0.00 0.00 0.00 173.10 172.72 2k8p s ARG 169 N -4.04 3.45 -0.44 2.90 3.03 -1.26 -5.00 118.95 117.58 2k8p s ARG 169 Ca 0.37 -0.61 0.03 0.00 2.03 0.00 0.00 55.73 57.56 2k8p s ARG 169 Cb 0.08 -2.96 0.25 0.00 -1.03 0.00 0.00 34.95 31.28 2k8p s ARG 169 CO 0.13 -0.07 0.99 1.17 -1.13 0.00 0.00 175.30 176.39 2k8p n LYS 170 N 4.41 0.57 -1.13 3.89 0.00 -1.26 -5.16 118.16 119.48 2k8p n LYS 170 Ca -0.18 -1.42 -0.29 0.00 0.00 0.00 0.00 58.31 56.42 2k8p n LYS 170 Cb 0.51 -1.08 0.21 0.00 0.00 0.00 0.00 35.03 34.67 2k8p n LYS 170 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2k8p s PRO 171 N 0.54 -0.34 -0.49 1.64 0.04 -1.26 -5.03 135.00 130.10 2k8p s PRO 171 Ca 0.30 0.25 0.07 0.00 0.04 0.00 0.00 61.00 61.66 2k8p s PRO 171 Cb 0.21 -1.67 0.25 0.00 0.04 0.00 0.00 34.50 33.33 2k8p s PRO 171 CO -0.19 -3.19 0.61 0.54 0.04 0.00 0.00 177.00 174.81 2k8p n ARG 172 N -4.45 1.41 -1.97 4.56 1.74 -1.26 -5.11 116.66 111.57 2k8p n ARG 172 Ca 0.08 -3.78 -0.34 0.00 -0.77 0.00 0.00 57.85 53.04 2k8p n ARG 172 Cb 0.58 -1.62 0.03 0.00 -1.02 0.00 0.00 32.46 30.43 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2k8p s PRO 173 N -1.67 3.04 -0.10 5.56 0.04 -1.26 -5.06 135.00 135.55 2k8p s PRO 173 Ca 0.37 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.90 2k8p s PRO 173 Cb 0.16 -1.97 0.02 0.00 0.04 0.00 0.00 34.50 32.75 2k8p s PRO 173 CO -0.07 -1.08 -0.09 0.50 0.04 0.00 0.00 177.00 176.30 2k8p s ARG 174 N -3.74 1.57 -0.12 4.56 3.52 -1.26 -5.13 118.95 118.35 2k8p s ARG 174 Ca 0.69 -0.30 -0.08 0.00 -0.13 0.00 0.00 55.73 55.91 2k8p s ARG 174 Cb -0.22 -1.53 -0.04 0.00 -1.56 0.00 0.00 34.95 31.60 2k8p s ARG 174 CO 0.35 -0.18 0.17 0.00 -0.81 0.00 0.00 175.30 174.83 2k8p s ALA 175 N 1.39 3.84 -0.14 6.12 0.00 -1.26 -5.09 121.76 126.62 2k8p s ALA 175 Ca -0.01 -0.60 0.01 0.00 0.00 0.00 0.00 51.96 51.36 2k8p s ALA 175 Cb -0.13 -2.04 0.02 0.00 0.00 0.00 0.00 23.12 20.97 2k8p s ALA 175 CO -0.05 0.55 -0.14 0.50 0.00 0.00 0.00 175.76 176.63 2k8p s ARG 176 N -0.88 2.22 0.56 0.00 3.52 -1.26 -5.13 118.95 117.98 2k8p s ARG 176 Ca 0.15 -0.54 0.06 0.00 -0.13 0.00 0.00 55.73 55.28 2k8p s ARG 176 Cb -0.12 -2.01 0.07 0.00 -1.56 0.00 0.00 34.95 31.32 2k8p s ARG 176 CO 0.04 -0.19 0.77 -1.12 -0.81 0.00 0.00 175.30 173.99 2k8p s SER 177 N 1.37 5.13 0.37 -2.12 0.01 -1.26 -5.14 113.70 112.06 2k8p s SER 177 Ca 0.02 -0.56 0.06 0.00 1.31 0.00 0.00 55.95 56.78 2k8p s SER 177 Cb -0.13 -0.14 -0.07 0.00 0.21 0.00 0.00 66.02 65.89 2k8p s SER 177 CO -0.08 -1.26 0.01 0.00 0.41 0.00 0.00 173.24 172.31 2k8p s ALA 178 N -2.68 2.86 0.36 1.44 0.00 -1.26 -5.17 121.76 117.31 2k8p s ALA 178 Ca 0.60 -2.19 0.06 0.00 0.00 0.00 0.00 51.96 50.43 2k8p s ALA 178 Cb -0.07 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 2k8p s ALA 178 CO 0.38 -0.15 0.23 -1.59 0.00 0.00 0.00 175.76 174.63 2k8p s LYS 179 N -3.75 1.81 0.23 0.00 -2.85 -1.26 -5.18 119.74 108.74 2k8p s LYS 179 Ca 0.35 -2.07 0.01 0.00 -1.00 0.00 0.00 55.97 53.25 2k8p s LYS 179 Cb 0.08 0.01 -0.00 0.00 -2.06 0.00 0.00 37.83 35.86 2k8p s LYS 179 CO 0.17 -0.59 0.03 0.00 0.10 0.00 0.00 175.35 175.05 2k8p n ALA 180 N -0.72 0.25 -2.86 0.59 0.00 -1.26 -5.17 120.51 111.33 2k8p n ALA 180 Ca 0.03 -1.10 -0.10 0.00 0.00 0.00 0.00 53.44 52.27 2k8p n ALA 180 Cb 0.63 0.66 -0.10 0.00 0.00 0.00 0.00 19.45 20.64 2k8p n ALA 180 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2k8p s ASN 181 N -2.34 0.13 0.67 0.00 3.84 -1.26 -5.16 114.94 110.81 2k8p s ASN 181 Ca 0.04 -0.42 -0.11 0.00 0.21 0.00 0.00 52.86 52.58 2k8p s ASN 181 Cb 0.00 0.22 -0.01 0.00 -0.55 0.00 0.00 41.25 40.91 2k8p s ASN 181 CO 0.03 -0.46 1.06 -1.10 -2.79 0.00 0.00 177.10 173.85 2k8p s GLN 182 N -2.17 3.17 -0.07 0.43 -0.21 -1.26 -5.08 119.66 114.47 2k8p s GLN 182 Ca -0.09 0.64 0.05 0.00 0.02 0.00 0.00 55.36 55.98 2k8p s GLN 182 Cb -0.04 -2.04 -0.01 0.00 1.00 0.00 0.00 33.01 31.92 2k8p s GLN 182 CO -0.02 -0.85 -0.23 0.00 -2.12 0.00 0.00 175.29 172.06 2k8p s ALA 183 N -3.24 2.25 0.35 6.09 0.00 -1.26 -5.13 121.76 120.81 2k8p s ALA 183 Ca 0.57 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 51.57 2k8p s ALA 183 Cb -0.11 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 2k8p s ALA 183 CO 0.53 0.39 0.51 -1.21 0.00 0.00 0.00 175.76 175.97 2k8p s GLU 184 N -0.06 3.12 0.00 0.00 2.02 -1.26 -5.03 118.70 117.49 2k8p s GLU 184 Ca -0.06 -0.89 0.05 0.00 0.02 0.00 0.00 54.97 54.08 2k8p s GLU 184 Cb -0.15 -2.77 0.08 0.00 0.10 0.00 0.00 34.13 31.39 2k8p s GLU 184 CO 0.05 0.01 1.02 1.47 0.02 0.00 0.00 175.26 177.83 2k8p n LEU 185 N -1.72 -0.63 -4.70 1.80 -0.00 -1.26 -5.11 117.00 105.38 2k8p n LEU 185 Ca -0.00 -1.98 -0.42 0.00 -0.00 0.00 0.00 56.01 53.60 2k8p n LEU 185 Cb 0.58 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.97 2k8p n LEU 185 CO 0.43 1.31 0.95 -0.70 -0.00 0.00 0.00 177.39 179.38 2k8p s GLU 186 N 0.00 4.37 0.12 1.47 2.56 -1.26 -4.89 118.70 121.07 2k8p s GLU 186 Ca 0.06 1.74 0.00 0.00 0.00 0.00 0.00 54.97 56.77 2k8p s GLU 186 Cb 0.07 -3.49 0.00 0.00 2.00 0.00 0.00 34.13 32.71 2k8p s GLU 186 CO -0.03 -0.40 0.00 0.09 -0.56 0.00 0.00 175.26 174.36 2k8p n ASN 187 N 4.80 0.68 0.00 -1.70 4.13 -1.26 -5.03 115.26 116.88 2k8p n ASN 187 Ca 0.11 0.18 0.00 0.00 1.68 0.00 0.00 54.58 56.55 2k8p n ASN 187 Cb 0.46 -0.14 0.00 0.00 -1.54 0.00 0.00 39.78 38.56 2k8p n ASN 187 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k8p n ALA 188 N -3.39 0.00 1.74 5.41 0.00 -1.26 -5.37 120.51 117.63 2k8p n ALA 188 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 2k8p n ALA 188 Cb 0.07 0.00 0.83 0.00 0.00 0.00 0.00 19.45 20.34 2k8p n ALA 188 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48