#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8p n TRP 2 N 0.00 -3.12 -3.87 1.61 7.02 -1.26 -5.04 117.44 112.78 2k8p n TRP 2 Ca 0.00 1.23 -0.08 0.00 -1.02 0.00 0.00 57.50 57.63 2k8p n TRP 2 Cb 0.00 -3.83 -0.03 0.00 -2.42 0.00 0.00 31.31 25.03 2k8p n TRP 2 CO 0.00 0.00 0.00 1.14 -2.02 0.00 0.00 177.69 176.81 2k8p s GLN 3 N -2.94 1.66 0.19 -0.99 -2.07 -1.26 -5.19 119.66 109.07 2k8p s GLN 3 Ca 0.14 -1.03 0.03 0.00 -1.82 0.00 0.00 55.36 52.68 2k8p s GLN 3 Cb -0.03 0.56 -0.01 0.00 -1.09 0.00 0.00 33.01 32.44 2k8p s GLN 3 CO 0.78 -0.74 0.19 0.00 -1.32 0.00 0.00 175.29 174.20 2k8p n ALA 4 N -0.42 0.25 -3.28 2.60 0.00 -1.26 -5.18 120.51 113.21 2k8p n ALA 4 Ca -0.04 -1.05 -0.13 0.00 0.00 0.00 0.00 53.44 52.21 2k8p n ALA 4 Cb 0.60 0.85 -0.10 0.00 0.00 0.00 0.00 19.45 20.80 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 -3.03 -0.41 -0.10 0.00 -0.71 -1.26 -5.16 117.98 107.32 2k8p s PHE 5 Ca 0.21 0.97 -0.10 0.00 -1.04 0.00 0.00 56.93 56.96 2k8p s PHE 5 Cb 0.01 0.15 -0.05 0.00 -1.21 0.00 0.00 43.02 41.92 2k8p s PHE 5 CO 0.15 -0.23 0.24 0.15 -1.34 0.00 0.00 175.22 174.18 2k8p s LYS 6 N 0.01 3.75 0.58 1.99 1.02 -1.26 -5.10 119.74 120.73 2k8p s LYS 6 Ca -0.02 0.05 -0.05 0.00 0.02 0.00 0.00 55.97 55.97 2k8p s LYS 6 Cb -0.03 -3.25 0.01 0.00 -0.52 0.00 0.00 37.83 34.04 2k8p s LYS 6 CO 0.01 0.64 0.87 1.21 -0.92 0.00 0.00 175.35 177.16 2k8p s ASN 7 N -0.72 5.52 0.71 2.83 2.47 -1.26 -5.09 114.94 119.41 2k8p s ASN 7 Ca 0.17 0.57 -0.10 0.00 0.42 0.00 0.00 52.86 53.92 2k8p s ASN 7 Cb -0.13 -1.56 0.03 0.00 -1.45 0.00 0.00 41.25 38.14 2k8p s ASN 7 CO 0.06 -1.07 1.08 -1.81 -3.72 0.00 0.00 177.10 171.64 2k8p s ASP 8 N -4.32 5.17 -0.21 -4.21 1.01 -1.26 -5.02 116.67 107.83 2k8p s ASP 8 Ca 0.54 0.91 0.17 0.00 0.71 0.00 0.00 52.55 54.87 2k8p s ASP 8 Cb -0.10 -1.65 0.46 0.00 1.01 0.00 0.00 42.92 42.64 2k8p s ASP 8 CO 0.44 -1.47 1.17 0.00 0.21 0.00 0.00 175.17 175.52 2k8p n ALA 9 N -3.01 3.46 -3.14 5.23 0.00 -1.26 -4.97 120.51 116.82 2k8p n ALA 9 Ca 0.07 -3.08 -0.44 0.00 0.00 0.00 0.00 53.44 49.98 2k8p n ALA 9 Cb 0.59 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.44 2k8p n ALA 9 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2k8p n THR 10 N -0.51 4.41 -3.65 0.00 -2.24 -1.26 -5.01 114.28 106.02 2k8p n THR 10 Ca 0.20 -5.05 -0.20 0.00 -2.27 0.00 0.00 64.05 56.73 2k8p n THR 10 Cb 0.90 -2.52 -0.02 0.00 -2.10 0.00 0.00 70.33 66.58 2k8p n THR 10 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2k8p s GLU 11 N 0.16 2.85 -0.32 -0.78 -1.05 -1.26 -5.10 118.70 113.20 2k8p s GLU 11 Ca 0.37 -1.21 0.03 0.00 -0.15 0.00 0.00 54.97 54.01 2k8p s GLU 11 Cb -0.06 -2.60 0.09 0.00 -0.44 0.00 0.00 34.13 31.12 2k8p s GLU 11 CO -0.04 0.06 0.03 0.42 0.95 0.00 0.00 175.26 176.67 2k8p s ILE 12 N -2.27 2.05 -0.77 1.83 1.01 -1.26 -5.03 121.20 116.76 2k8p s ILE 12 Ca 0.43 -2.06 0.03 0.00 0.00 0.00 0.00 60.65 59.05 2k8p s ILE 12 Cb -0.07 -2.45 0.24 0.00 0.01 0.00 0.00 42.46 40.19 2k8p s ILE 12 CO 0.28 -0.50 0.82 -0.38 0.00 0.00 0.00 174.94 175.17 2k8p n ILE 13 N 4.38 2.80 -1.12 2.92 2.08 -1.26 -5.08 119.36 124.07 2k8p n ILE 13 Ca -0.00 -5.25 -0.29 0.00 0.56 0.00 0.00 62.75 57.76 2k8p n ILE 13 Cb 0.42 -2.16 0.21 0.00 -0.75 0.00 0.00 39.64 37.36 2k8p n ILE 13 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2k8p s PRO 14 N -2.15 -0.52 0.00 0.38 0.04 -1.26 -5.09 135.00 126.39 2k8p s PRO 14 Ca 0.34 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.56 2k8p s PRO 14 Cb 0.06 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.94 2k8p s PRO 14 CO -0.04 -3.30 0.00 -1.91 0.04 0.00 0.00 177.00 171.79 2k8p n GLU 15 N -4.51 0.00 -2.84 4.56 2.13 -1.26 -5.16 120.64 113.56 2k8p n GLU 15 Ca 0.09 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.60 2k8p n GLU 15 Cb 0.59 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.25 2k8p n GLU 15 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 2k8p s LEU 16 N 0.00 3.88 0.00 4.31 2.34 -1.26 -4.98 118.68 122.96 2k8p s LEU 16 Ca 0.00 1.37 0.00 0.00 0.06 0.00 0.00 54.13 55.56 2k8p s LEU 16 Cb 0.00 -4.23 0.00 0.00 -0.56 0.00 0.00 46.19 41.40 2k8p s LEU 16 CO 0.00 -0.37 0.00 0.61 -1.06 0.00 0.00 176.35 175.53 2k8p n GLY 17 N -0.96 0.00 3.11 -3.48 0.00 -1.26 -5.10 105.19 97.50 2k8p n GLY 17 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.87 -2.17 -3.35 1.61 1.02 -1.26 -4.96 120.64 109.67 2k8p n GLU 18 Ca 0.00 1.83 -0.26 0.00 -0.02 0.00 0.00 57.16 58.71 2k8p n GLU 18 Cb 0.10 -3.93 -0.08 0.00 -0.02 0.00 0.00 31.44 27.51 2k8p n GLU 18 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2k8p n TYR 19 N -0.02 2.68 -1.20 -0.32 9.36 -1.26 -5.10 117.16 121.30 2k8p n TYR 19 Ca 0.02 -4.01 -0.29 0.00 3.32 0.00 0.00 57.90 56.94 2k8p n TYR 19 Cb 0.50 -0.51 0.15 0.00 -0.63 0.00 0.00 39.34 38.85 2k8p n TYR 19 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2k8p s PRO 20 N -2.21 1.07 -0.42 2.98 0.04 -1.26 -5.04 135.00 130.16 2k8p s PRO 20 Ca 0.39 0.75 0.07 0.00 0.04 0.00 0.00 61.00 62.26 2k8p s PRO 20 Cb 0.16 -1.79 0.24 0.00 0.04 0.00 0.00 34.50 33.15 2k8p s PRO 20 CO -0.04 -2.35 0.61 -0.85 0.04 0.00 0.00 177.00 174.41 2k8p n GLU 21 N -3.95 0.68 -1.18 4.56 0.28 -1.26 -5.14 120.64 114.63 2k8p n GLU 21 Ca 0.07 -2.78 -0.29 0.00 -0.16 0.00 0.00 57.16 53.99 2k8p n GLU 21 Cb 0.56 -1.32 0.16 0.00 1.43 0.00 0.00 31.44 32.27 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 -0.52 0.73 0.96 3.44 0.04 -1.26 -5.04 135.00 133.35 2k8p s PRO 22 Ca 0.34 0.62 -0.12 0.00 0.04 0.00 0.00 61.00 61.88 2k8p s PRO 22 Cb 0.17 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.11 2k8p s PRO 22 CO -0.15 -2.56 1.09 -1.25 0.04 0.00 0.00 177.00 174.17 2k8p s PRO 23 N -4.96 0.74 0.88 0.56 0.04 -1.26 -5.03 135.00 125.98 2k8p s PRO 23 Ca 0.65 0.63 -0.11 0.00 0.04 0.00 0.00 61.00 62.20 2k8p s PRO 23 Cb -0.18 -1.76 0.12 0.00 0.04 0.00 0.00 34.50 32.71 2k8p s PRO 23 CO 0.57 -2.55 1.09 -1.25 0.04 0.00 0.00 177.00 174.91 2k8p s PRO 24 N -4.96 1.38 -0.31 0.56 0.04 -1.26 -5.07 135.00 125.40 2k8p s PRO 24 Ca 0.65 0.86 0.06 0.00 0.04 0.00 0.00 61.00 62.60 2k8p s PRO 24 Cb -0.18 -1.82 0.20 0.00 0.04 0.00 0.00 34.50 32.73 2k8p s PRO 24 CO 0.57 -2.16 0.61 -1.83 0.04 0.00 0.00 177.00 174.23 2k8p s GLU 25 N -4.93 0.58 0.00 4.56 -1.05 -1.26 -5.16 118.70 111.44 2k8p s GLU 25 Ca 0.63 0.43 0.00 0.00 -0.15 0.00 0.00 54.97 55.88 2k8p s GLU 25 Cb -0.18 0.22 0.00 0.00 -0.44 0.00 0.00 34.13 33.74 2k8p s GLU 25 CO 0.57 -1.04 0.00 1.47 0.95 0.00 0.00 175.26 177.21 2k8p n LEU 26 N 5.28 0.00 -4.39 1.83 -0.00 -1.26 -5.19 117.00 113.27 2k8p n LEU 26 Ca 0.06 0.00 -0.21 0.00 -0.00 0.00 0.00 56.01 55.86 2k8p n LEU 26 Cb 0.55 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.88 2k8p n LEU 26 CO -0.05 0.00 -0.18 -1.83 -0.00 0.00 0.00 177.39 175.33 2k8p s GLU 27 N -0.19 1.75 0.52 1.47 -1.05 -1.26 -5.18 118.70 114.76 2k8p s GLU 27 Ca 0.00 -2.03 0.01 0.00 -0.15 0.00 0.00 54.97 52.80 2k8p s GLU 27 Cb 0.00 -0.18 -0.00 0.00 -0.44 0.00 0.00 34.13 33.51 2k8p s GLU 27 CO 0.00 -0.51 0.02 -0.80 0.95 0.00 0.00 175.26 174.92 2k8p s ASN 28 N -3.46 4.18 0.17 0.83 0.01 -1.26 -5.11 114.94 110.31 2k8p s ASN 28 Ca 0.33 -1.67 -0.30 0.00 -0.71 0.00 0.00 52.86 50.51 2k8p s ASN 28 Cb 0.04 0.63 -0.08 0.00 0.41 0.00 0.00 41.25 42.25 2k8p s ASN 28 CO 0.19 -0.91 1.15 0.54 -1.51 0.00 0.00 177.10 176.56 2k8p s ASN 29 N -3.92 7.17 -0.08 -1.22 4.22 -1.26 -5.03 114.94 114.82 2k8p s ASN 29 Ca 0.04 2.14 -0.29 0.00 -2.14 0.00 0.00 52.86 52.61 2k8p s ASN 29 Cb 0.00 -2.60 0.07 0.00 1.28 0.00 0.00 41.25 40.00 2k8p s ASN 29 CO 0.02 -0.31 0.66 -1.59 -2.04 0.00 0.00 177.10 173.84 2k8p s LYS 30 N -0.17 0.99 -0.27 3.55 -2.85 -1.26 -5.17 119.74 114.55 2k8p s LYS 30 Ca 0.52 0.35 -0.22 0.00 -1.00 0.00 0.00 55.97 55.61 2k8p s LYS 30 Cb -0.31 0.47 0.07 0.00 -2.06 0.00 0.00 37.83 36.01 2k8p s LYS 30 CO 0.35 -0.28 0.72 -0.08 0.10 0.00 0.00 175.35 176.16 2k8p s THR 31 N -0.93 0.00 -0.17 3.79 -1.32 -1.26 -5.17 115.64 110.57 2k8p s THR 31 Ca -0.09 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.08 2k8p s THR 31 Cb -0.01 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 70.12 2k8p s THR 31 CO 0.08 0.00 1.08 -0.32 -2.21 0.00 0.00 174.62 173.25 2k8p s MET 32 N 0.74 0.48 -0.00 7.08 0.00 -1.26 -5.19 119.30 121.15 2k8p s MET 32 Ca -0.03 0.05 -0.28 0.00 0.00 0.00 0.00 55.69 55.43 2k8p s MET 32 Cb -0.05 0.23 0.10 0.00 0.00 0.00 0.00 34.83 35.11 2k8p s MET 32 CO -0.05 -0.16 0.85 0.54 0.00 0.00 0.00 175.02 176.19 2k8p s ASN 33 N -1.34 -0.41 0.24 1.11 2.20 -1.26 -5.18 114.94 110.29 2k8p s ASN 33 Ca 0.02 0.09 0.07 0.00 -0.94 0.00 0.00 52.86 52.11 2k8p s ASN 33 Cb -0.01 0.42 -0.05 0.00 -2.00 0.00 0.00 41.25 39.61 2k8p s ASN 33 CO -0.02 -0.64 -0.11 -0.13 -2.94 0.00 0.00 177.10 173.26 2k8p s ARG 34 N -2.86 1.45 -0.15 3.55 0.52 -1.26 -5.16 118.95 115.04 2k8p s ARG 34 Ca 0.03 -1.69 -0.34 0.00 -0.52 0.00 0.00 55.73 53.21 2k8p s ARG 34 Cb -0.01 -1.17 0.13 0.00 0.52 0.00 0.00 34.95 34.43 2k8p s ARG 34 CO -0.07 0.12 1.18 0.00 0.02 0.00 0.00 175.30 176.55 2k8p s ALA 35 N -2.97 -2.06 0.05 2.13 0.00 -1.26 -5.19 121.76 112.46 2k8p s ALA 35 Ca 0.26 1.44 -0.02 0.00 0.00 0.00 0.00 51.96 53.64 2k8p s ALA 35 Cb 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.13 2k8p s ALA 35 CO 0.10 -0.65 0.09 -0.85 0.00 0.00 0.00 175.76 174.45 2k8p n GLU 36 N -0.15 0.14 -3.72 0.00 0.28 -1.26 -5.19 120.64 110.74 2k8p n GLU 36 Ca -0.01 -0.30 0.00 0.00 -0.16 0.00 0.00 57.16 56.69 2k8p n GLU 36 Cb 0.59 0.35 -0.00 0.00 1.43 0.00 0.00 31.44 33.81 2k8p n GLU 36 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 2k8p s ASN 37 N -1.27 -0.07 0.00 -1.84 3.84 -1.26 -5.19 114.94 109.15 2k8p s ASN 37 Ca 0.02 -0.26 0.00 0.00 0.21 0.00 0.00 52.86 52.83 2k8p s ASN 37 Cb -0.01 0.27 0.00 0.00 -0.55 0.00 0.00 41.25 40.97 2k8p s ASN 37 CO 0.02 -0.51 0.00 0.61 -2.79 0.00 0.00 177.10 174.43 2k8p n GLY 38 N -0.55 3.21 0.00 1.21 0.00 -1.26 -5.15 105.19 102.65 2k8p n GLY 38 Ca -0.06 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.78 1.74 2.43 -0.02 0.00 -1.26 -5.12 105.19 101.18 2k8p n GLY 39 Ca 0.00 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 2k8p n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8p n ARG 40 N 0.00 0.64 -1.18 1.61 1.74 -1.26 -5.14 116.66 113.06 2k8p n ARG 40 Ca 0.00 -2.68 -0.29 0.00 -0.77 0.00 0.00 57.85 54.11 2k8p n ARG 40 Cb 0.00 -1.38 0.16 0.00 -1.02 0.00 0.00 32.46 30.23 2k8p n ARG 40 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2k8p s PRO 41 N -0.28 0.73 1.12 5.56 0.04 -1.26 -5.04 135.00 135.86 2k8p s PRO 41 Ca 0.33 0.63 -0.16 0.00 0.04 0.00 0.00 61.00 61.85 2k8p s PRO 41 Cb 0.15 -1.76 0.25 0.00 0.04 0.00 0.00 34.50 33.18 2k8p s PRO 41 CO -0.16 -2.56 1.10 -1.25 0.04 0.00 0.00 177.00 174.18 2k8p s PRO 42 N -4.95 -0.52 -0.30 0.56 0.04 -1.26 -5.09 135.00 123.48 2k8p s PRO 42 Ca 0.65 0.18 -0.19 0.00 0.04 0.00 0.00 61.00 61.68 2k8p s PRO 42 Cb -0.18 -1.66 0.19 0.00 0.04 0.00 0.00 34.50 32.89 2k8p s PRO 42 CO 0.57 -3.29 1.25 -3.38 0.04 0.00 0.00 177.00 172.19 2k8p s HIS 43 N -2.99 -0.15 -0.36 0.56 -3.43 -1.26 -5.11 115.29 102.55 2k8p s HIS 43 Ca 0.68 0.27 -0.02 0.00 -0.80 0.00 0.00 55.06 55.19 2k8p s HIS 43 Cb -0.14 0.09 0.25 0.00 -1.43 0.00 0.00 32.58 31.35 2k8p s HIS 43 CO 0.57 -0.08 1.14 1.58 -2.00 0.00 0.00 174.74 175.95 2k8p n HIS 44 N 4.54 -1.02 -1.13 0.38 -0.00 -1.26 -5.17 115.22 111.55 2k8p n HIS 44 Ca -0.07 -0.82 -0.29 0.00 -0.00 0.00 0.00 57.72 56.53 2k8p n HIS 44 Cb 0.55 1.16 0.20 0.00 -0.00 0.00 0.00 29.99 31.90 2k8p n HIS 44 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 2k8p s PRO 45 N 0.45 -0.09 0.23 1.57 0.04 -1.26 -5.09 135.00 130.85 2k8p s PRO 45 Ca 0.26 0.34 -0.15 0.00 0.04 0.00 0.00 61.00 61.50 2k8p s PRO 45 Cb 0.18 -1.69 0.01 0.00 0.04 0.00 0.00 34.50 33.03 2k8p s PRO 45 CO -0.11 -3.04 0.50 -0.06 0.04 0.00 0.00 177.00 174.33 2k8p s PHE 46 N -2.97 0.18 0.08 0.56 0.08 -1.26 -5.18 117.98 109.46 2k8p s PHE 46 Ca 0.67 -0.55 -0.25 0.00 0.12 0.00 0.00 56.93 56.92 2k8p s PHE 46 Cb -0.16 0.28 0.09 0.00 -0.57 0.00 0.00 43.02 42.65 2k8p s PHE 46 CO 0.57 -0.97 1.17 -1.83 -0.10 0.00 0.00 175.22 174.07 2k8p s GLU 47 N -3.96 0.81 -0.26 0.44 -1.05 -1.26 -5.17 118.70 108.25 2k8p s GLU 47 Ca 0.17 -0.53 -0.10 0.00 -0.15 0.00 0.00 54.97 54.37 2k8p s GLU 47 Cb -0.01 0.22 0.11 0.00 -0.44 0.00 0.00 34.13 34.01 2k8p s GLU 47 CO 0.05 -0.38 0.57 0.99 0.95 0.00 0.00 175.26 177.44 2k8p s THR 48 N -2.05 -0.76 0.19 1.83 2.01 -1.26 -5.17 115.64 110.44 2k8p s THR 48 Ca 0.27 0.06 0.02 0.00 0.31 0.00 0.00 61.69 62.34 2k8p s THR 48 Cb -0.02 -0.88 -0.05 0.00 0.01 0.00 0.00 72.50 71.57 2k8p s THR 48 CO 0.02 0.02 0.03 -0.54 -0.69 0.00 0.00 174.62 173.47 2k8p s LYS 49 N 2.63 1.19 -0.24 4.92 -0.14 -1.26 -5.09 119.74 121.74 2k8p s LYS 49 Ca -0.05 -1.59 -0.12 0.00 -1.36 0.00 0.00 55.97 52.84 2k8p s LYS 49 Cb -0.11 -0.25 0.08 0.00 -1.68 0.00 0.00 37.83 35.87 2k8p s LYS 49 CO -0.17 -0.18 0.58 0.16 -0.76 0.00 0.00 175.35 174.98 2k8p s ASP 50 N -3.21 -0.79 0.30 2.83 1.47 -1.26 -4.41 116.67 111.60 2k8p s ASP 50 Ca 0.28 1.30 -0.09 0.00 1.18 0.00 0.00 52.55 55.22 2k8p s ASP 50 Cb 0.07 1.34 0.00 0.00 -0.34 0.00 0.00 42.92 43.99 2k8p s ASP 50 CO 0.07 -0.22 0.50 0.68 0.68 0.00 0.00 175.17 176.87 2k8p s VAL 51 N 1.85 0.00 -0.39 2.11 -7.23 -1.26 -5.02 120.40 110.46 2k8p s VAL 51 Ca -0.08 -1.45 0.07 0.00 -1.81 0.00 0.00 61.98 58.70 2k8p s VAL 51 Cb -0.08 -2.45 0.32 0.00 0.56 0.00 0.00 36.38 34.73 2k8p s VAL 51 CO -0.17 0.00 1.26 -1.54 -0.31 0.00 0.00 175.10 174.34 2k8p n SER 52 N -0.87 -1.83 -0.90 4.85 3.41 -1.26 -4.72 113.62 112.30 2k8p n SER 52 Ca -0.01 -2.56 0.07 0.00 -0.26 0.00 0.00 58.87 56.10 2k8p n SER 52 Cb 0.62 1.23 -0.02 0.00 -0.26 0.00 0.00 64.21 65.78 2k8p n SER 52 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2k8p n GLU 53 N -0.29 -0.99 0.00 4.33 4.71 -1.26 -4.68 120.64 122.46 2k8p n GLU 53 Ca -0.05 0.65 0.00 0.00 -0.01 0.00 0.00 57.16 57.75 2k8p n GLU 53 Cb 0.78 -1.20 0.00 0.00 -1.01 0.00 0.00 31.44 30.00 2k8p n GLU 53 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2k8p n TYR 54 N -2.30 0.00 0.00 -0.32 4.01 -1.26 -4.94 117.16 112.35 2k8p n TYR 54 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2k8p n TYR 54 Cb 0.22 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 2k8p n TYR 54 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2k8p n SER 55 N -1.35 0.00 -4.29 7.72 7.64 -1.26 -5.04 113.62 117.04 2k8p n SER 55 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.56 2k8p n SER 55 Cb 0.00 -0.19 -0.16 0.00 -1.01 0.00 0.00 64.21 62.85 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 -0.06 4.21 -0.25 0.00 3.52 0.84 -4.89 118.95 122.31 2k8p s ARG 57 Ca -0.06 2.43 -0.02 0.00 -0.13 0.00 0.00 55.73 57.95 2k8p s ARG 57 Cb -0.15 -3.02 0.03 0.00 -1.56 0.00 0.00 34.95 30.25 2k8p s ARG 57 CO 0.05 -0.41 -0.05 -1.21 -0.81 0.00 0.00 175.30 172.86 2k8p s GLU 58 N -1.76 2.81 -0.28 5.12 8.01 -1.26 -2.56 118.70 128.77 2k8p s GLU 58 Ca 0.53 -1.00 -0.24 0.00 0.01 0.00 0.00 54.97 54.26 2k8p s GLU 58 Cb -0.44 -3.01 -0.00 0.00 -4.31 0.00 0.00 34.13 26.37 2k8p s GLU 58 CO 0.57 -0.42 0.83 -1.17 0.01 0.00 0.00 175.26 175.08 2k8p s LEU 59 N 1.32 4.07 -0.35 1.80 0.20 -0.91 -4.89 118.68 119.92 2k8p s LEU 59 Ca -0.00 0.84 -0.14 0.00 0.69 0.00 0.00 54.13 55.52 2k8p s LEU 59 Cb -0.17 -3.16 -0.01 0.00 -0.43 0.00 0.00 46.19 42.42 2k8p s LEU 59 CO -0.04 -0.59 0.30 -1.00 -0.29 0.00 0.00 176.35 174.73 2k8p s HIS 60 N 2.96 3.22 -0.30 5.38 3.76 -1.26 -1.17 115.29 127.88 2k8p s HIS 60 Ca 0.34 -0.18 -0.04 0.00 -0.15 0.00 0.00 55.06 55.03 2k8p s HIS 60 Cb -0.14 -2.57 0.03 0.00 1.11 0.00 0.00 32.58 31.01 2k8p s HIS 60 CO 0.11 -0.42 0.04 -0.06 -0.85 0.00 0.00 174.74 173.56 2k8p s PHE 61 N 1.85 3.20 0.05 1.40 0.08 -0.66 -4.92 117.98 118.97 2k8p s PHE 61 Ca 0.08 -1.47 0.03 0.00 0.12 0.00 0.00 56.93 55.69 2k8p s PHE 61 Cb -0.17 -2.19 -0.04 0.00 -0.57 0.00 0.00 43.02 40.05 2k8p s PHE 61 CO 0.11 -0.72 -0.00 0.99 -0.10 0.00 0.00 175.22 175.50 2k8p s THR 62 N 1.37 4.07 0.00 0.64 2.01 -1.26 -0.48 115.64 121.98 2k8p s THR 62 Ca -0.01 -0.82 0.00 0.00 0.31 0.00 0.00 61.69 61.17 2k8p s THR 62 Cb -0.19 -2.88 0.00 0.00 0.01 0.00 0.00 72.50 69.44 2k8p s THR 62 CO 0.00 0.24 0.00 -1.14 -0.69 0.00 0.00 174.62 173.03 2k8p n ARG 63 N 0.94 0.00 -3.29 4.92 0.63 -1.26 -4.98 116.66 113.63 2k8p n ARG 63 Ca -0.12 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.42 2k8p n ARG 63 Cb 0.52 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.37 2k8p n ARG 63 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2k8p s TYR 64 N -2.00 3.48 0.08 -0.14 1.51 -1.26 -1.08 117.35 117.94 2k8p s TYR 64 Ca 0.00 0.87 -0.02 0.00 -1.01 0.00 0.00 57.07 56.91 2k8p s TYR 64 Cb 0.00 -2.59 -0.05 0.00 -0.11 0.00 0.00 41.96 39.21 2k8p s TYR 64 CO 0.00 0.09 0.27 0.54 -1.11 0.00 0.00 175.55 175.34 2k8p s VAL 65 N 0.90 5.32 -0.10 0.71 0.11 -1.26 -5.00 120.40 121.06 2k8p s VAL 65 Ca 0.26 -0.22 -0.05 0.00 -2.93 0.00 0.00 61.98 59.04 2k8p s VAL 65 Cb -0.15 -3.62 0.05 0.00 -1.53 0.00 0.00 36.38 31.12 2k8p s VAL 65 CO 0.10 0.12 0.24 0.42 -3.33 0.00 0.00 175.10 172.66 2k8p s THR 66 N -1.54 -0.07 -0.30 5.04 -4.23 -1.26 -1.97 115.64 111.30 2k8p s THR 66 Ca 0.36 0.16 -0.01 0.00 -1.18 0.00 0.00 61.69 61.03 2k8p s THR 66 Cb -0.13 -0.38 0.10 0.00 1.34 0.00 0.00 72.50 73.43 2k8p s THR 66 CO 0.26 0.07 0.09 -0.62 -0.54 0.00 0.00 174.62 173.88 2k8p s ASP 67 N 1.36 3.95 0.00 3.99 -1.08 -1.22 -5.02 116.67 118.66 2k8p s ASP 67 Ca -0.08 -1.57 0.00 0.00 -0.52 0.00 0.00 52.55 50.37 2k8p s ASP 67 Cb -0.11 -0.85 0.00 0.00 -1.46 0.00 0.00 42.92 40.51 2k8p s ASP 67 CO -0.08 -0.41 0.00 0.61 0.52 0.00 0.00 175.17 175.81 2k8p n GLY 68 N 4.86 -1.28 0.00 2.66 0.00 -1.26 -4.05 105.19 106.13 2k8p n GLY 68 Ca -0.03 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.49 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 0.18 -4.02 1.61 -0.04 -1.26 -4.73 135.00 126.74 2k8p n PRO 69 Ca 0.00 0.16 -0.26 0.00 -0.04 0.00 0.00 63.50 63.36 2k8p n PRO 69 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 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 -3.19 1.46 0.27 0.00 3.00 0.96 -3.37 118.95 118.08 2k8p s ARG 71 Ca 0.33 -0.63 -0.30 0.00 0.00 0.00 0.00 55.73 55.12 2k8p s ARG 71 Cb -0.10 -1.40 -0.13 0.00 0.00 0.00 0.00 34.95 33.32 2k8p s ARG 71 CO 0.26 0.37 1.43 0.45 0.00 0.00 0.00 175.30 177.80 2k8p n SER 72 N 2.69 2.99 0.25 0.23 2.88 -0.83 -0.68 113.62 121.16 2k8p n SER 72 Ca -0.15 1.16 0.16 0.00 -1.33 0.00 0.00 58.87 58.70 2k8p n SER 72 Cb 0.54 -1.47 0.57 0.00 -0.75 0.00 0.00 64.21 63.09 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 4.01 1.00 -2.61 -1.46 0.00 -1.73 -3.46 119.26 115.01 2k8p h ALA 73 Ca -0.46 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 2k8p h ALA 73 Cb 1.27 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.92 2k8p h ALA 73 CO 0.74 0.00 -0.26 0.15 0.00 0.00 0.00 179.25 179.88 2k8p s LYS 74 N -3.54 0.96 1.21 0.00 1.02 -1.26 -5.13 119.74 113.00 2k8p s LYS 74 Ca 0.03 -0.91 -0.19 0.00 0.02 0.00 0.00 55.97 54.92 2k8p s LYS 74 Cb 0.08 0.39 0.29 0.00 -0.52 0.00 0.00 37.83 38.07 2k8p s LYS 74 CO 0.56 -0.34 1.11 -1.25 -0.92 0.00 0.00 175.35 174.51 2k8p s PRO 75 N -3.86 -1.25 0.08 -1.68 0.04 -1.26 -4.57 135.00 122.49 2k8p s PRO 75 Ca 0.06 -0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.03 2k8p s PRO 75 Cb 0.04 -1.59 0.00 0.00 0.04 0.00 0.00 34.50 32.98 2k8p s PRO 75 CO -0.10 -3.73 0.02 1.33 0.04 0.00 0.00 177.00 174.56 2k8p n VAL 76 N -4.77 0.00 -3.53 -0.36 0.24 -0.24 -4.95 118.33 104.71 2k8p n VAL 76 Ca 0.13 -0.34 -0.21 0.00 -2.04 0.00 0.00 64.34 61.89 2k8p n VAL 76 Cb 0.59 -0.09 -0.14 0.00 -1.47 0.00 0.00 33.84 32.73 2k8p n VAL 76 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2k8p s THR 77 N -0.98 -0.25 0.07 3.34 2.01 -1.26 -4.07 115.64 114.50 2k8p s THR 77 Ca 0.01 -0.12 -0.01 0.00 0.31 0.00 0.00 61.69 61.88 2k8p s THR 77 Cb -0.00 -0.64 -0.04 0.00 0.01 0.00 0.00 72.50 71.83 2k8p s THR 77 CO 0.01 -0.23 0.23 -0.70 -0.69 0.00 0.00 174.62 173.24 2k8p s GLU 78 N 2.26 3.46 -0.13 4.92 2.12 0.36 -4.93 118.70 126.77 2k8p s GLU 78 Ca 0.05 -0.40 -0.02 0.00 0.36 0.00 0.00 54.97 54.96 2k8p s GLU 78 Cb -0.16 -3.02 0.04 0.00 0.26 0.00 0.00 34.13 31.25 2k8p s GLU 78 CO -0.11 0.60 0.01 -1.17 -0.54 0.00 0.00 175.26 174.05 2k8p s LEU 79 N -2.52 0.87 0.06 2.70 0.20 -1.25 -1.66 118.68 117.08 2k8p s LEU 79 Ca 0.36 -0.41 0.03 0.00 0.69 0.00 0.00 54.13 54.79 2k8p s LEU 79 Cb -0.13 -0.53 -0.04 0.00 -0.43 0.00 0.00 46.19 45.06 2k8p s LEU 79 CO 0.28 -0.24 0.06 -0.69 -0.29 0.00 0.00 176.35 175.47 2k8p s VAL 80 N 1.91 4.45 -0.31 1.68 1.01 -0.32 -4.23 120.40 124.60 2k8p s VAL 80 Ca 0.03 -0.73 -0.13 0.00 0.00 0.00 0.00 61.98 61.15 2k8p s VAL 80 Cb -0.14 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 2k8p s VAL 80 CO -0.07 0.18 0.26 0.00 0.00 0.00 0.00 175.10 175.48 2k8p s SER 82 N 1.73 -0.54 0.00 0.00 1.04 -1.06 -5.03 113.70 109.83 2k8p s SER 82 Ca 0.09 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.57 2k8p s SER 82 Cb -0.16 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2k8p s SER 82 CO 0.11 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 174.05 2k8p n GLY 83 N -0.25 2.27 2.96 7.32 0.00 -1.26 -0.11 105.19 116.11 2k8p n GLY 83 Ca -0.16 -2.00 -0.13 0.00 0.00 0.00 0.00 46.02 43.73 2k8p n GLY 83 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k8p s GLN 84 N -1.67 0.12 0.45 1.61 0.74 -1.26 -4.67 119.66 114.98 2k8p s GLN 84 Ca 0.00 0.35 0.05 0.00 0.05 0.00 0.00 55.36 55.80 2k8p s GLN 84 Cb 0.00 -0.11 -0.05 0.00 1.10 0.00 0.00 33.01 33.95 2k8p s GLN 84 CO 0.00 -0.13 0.01 0.00 -0.55 0.00 0.00 175.29 174.62 2k8p n GLY 86 N -1.11 2.11 2.64 0.00 0.00 -1.26 -4.80 105.19 102.77 2k8p n GLY 86 Ca -0.11 -0.97 -0.23 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.62 -2.76 1.61 -0.04 -1.26 -4.76 135.00 125.16 2k8p n PRO 87 Ca 0.00 -1.32 -0.01 0.00 -0.04 0.00 0.00 63.50 62.13 2k8p n PRO 87 Cb 0.00 -1.23 -0.01 0.00 -0.04 0.00 0.00 33.50 32.22 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 -4.41 -3.31 -0.64 0.55 0.00 -1.26 -4.94 120.51 106.50 2k8p n ALA 88 Ca -0.16 0.73 -0.31 0.00 0.00 0.00 0.00 53.44 53.70 2k8p n ALA 88 Cb 0.44 -1.50 0.19 0.00 0.00 0.00 0.00 19.45 18.58 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 0.96 -1.41 -0.85 0.00 5.12 -1.26 -4.92 116.66 114.30 2k8p n ARG 89 Ca -0.06 -0.38 -0.33 0.00 -1.93 0.00 0.00 57.85 55.15 2k8p n ARG 89 Cb 0.15 -1.99 0.14 0.00 -1.16 0.00 0.00 32.46 29.60 2k8p n ARG 89 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2k8p n LEU 90 N -3.02 2.12 -4.77 0.55 4.77 -1.26 -4.97 117.00 110.43 2k8p n LEU 90 Ca 0.04 0.44 -0.31 0.00 -0.03 0.00 0.00 56.01 56.15 2k8p n LEU 90 Cb 0.56 -1.37 0.09 0.00 -2.33 0.00 0.00 43.42 40.38 2k8p n LEU 90 CO 0.53 -2.65 0.70 -0.76 -1.33 0.00 0.00 177.39 173.87 2k8p s LEU 91 N -3.98 2.95 0.56 2.23 1.02 -1.26 -4.94 118.68 115.26 2k8p s LEU 91 Ca 0.65 1.76 0.34 0.00 0.02 0.00 0.00 54.13 56.90 2k8p s LEU 91 Cb -0.25 -4.44 1.41 0.00 0.02 0.00 0.00 46.19 42.93 2k8p s LEU 91 CO 0.60 -2.06 2.00 1.55 0.02 0.00 0.00 176.35 178.46 2k8p h PRO 92 N -1.14 0.00 -0.68 1.29 0.13 -2.05 -3.41 132.00 126.14 2k8p h PRO 92 Ca -0.44 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.77 2k8p h PRO 92 Cb 1.24 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.17 2k8p h PRO 92 CO 0.52 0.01 -0.25 1.21 -0.23 0.00 0.00 178.00 179.26 2k8p s ASN 93 N -5.68 -1.10 -0.23 1.44 3.04 -1.26 -5.03 114.94 106.12 2k8p s ASN 93 Ca 0.01 -0.06 0.13 0.00 0.04 0.00 0.00 52.86 52.98 2k8p s ASN 93 Cb 0.09 1.61 0.33 0.00 -1.54 0.00 0.00 41.25 41.74 2k8p s ASN 93 CO 0.54 -0.18 1.33 0.00 -3.04 0.00 0.00 177.10 175.75 2k8p n ALA 94 N 4.96 3.01 -2.03 1.71 0.00 -1.26 -5.14 120.51 121.76 2k8p n ALA 94 Ca 0.07 -1.30 -0.21 0.00 0.00 0.00 0.00 53.44 52.00 2k8p n ALA 94 Cb 0.57 -0.71 0.18 0.00 0.00 0.00 0.00 19.45 19.48 2k8p n ALA 94 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k8p n ILE 95 N -0.91 0.00 0.00 0.00 -6.64 -1.26 -4.90 119.36 105.65 2k8p n ILE 95 Ca -0.15 -1.06 0.00 0.00 -1.77 0.00 0.00 62.75 59.78 2k8p n ILE 95 Cb 0.84 -1.40 0.00 0.00 -1.44 0.00 0.00 39.64 37.65 2k8p n ILE 95 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2k8p n GLY 96 N -3.05 0.61 2.31 3.28 0.00 -1.26 -5.06 105.19 102.02 2k8p n GLY 96 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.15 2k8p n GLY 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k8p n ARG 97 N 0.00 -4.16 0.00 1.61 0.63 -1.26 -5.09 116.66 108.39 2k8p n ARG 97 Ca 0.00 3.15 0.00 0.00 -0.92 0.00 0.00 57.85 60.08 2k8p n ARG 97 Cb 0.00 -4.32 0.00 0.00 0.45 0.00 0.00 32.46 28.59 2k8p n ARG 97 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k8p n GLY 98 N 1.50 3.91 3.18 5.14 0.00 -1.26 -5.05 105.19 112.60 2k8p n GLY 98 Ca -0.21 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 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 3.26 0.93 0.00 1.61 1.02 -1.26 -5.04 119.74 120.27 2k8p s LYS 99 Ca 0.00 -1.43 0.01 0.00 0.02 0.00 0.00 55.97 54.57 2k8p s LYS 99 Cb 0.00 -0.02 -0.00 0.00 -0.52 0.00 0.00 37.83 37.28 2k8p s LYS 99 CO 0.00 -0.15 -0.02 1.67 -0.92 0.00 0.00 175.35 175.92 2k8p s TRP 100 N -3.82 0.21 0.00 3.18 -2.14 -1.26 -4.05 118.94 111.07 2k8p s TRP 100 Ca 0.20 -0.11 0.12 0.00 2.66 0.00 0.00 56.10 58.97 2k8p s TRP 100 Cb 0.07 -0.14 0.20 0.00 -3.10 0.00 0.00 33.47 30.50 2k8p s TRP 100 CO -0.00 -0.03 1.03 -2.67 -2.66 0.00 0.00 176.95 172.63 2k8p n TRP 101 N 2.80 0.00 -0.82 1.66 2.14 -1.26 -5.08 117.44 116.88 2k8p n TRP 101 Ca -0.14 -0.38 -0.31 0.00 2.07 0.00 0.00 57.50 58.74 2k8p n TRP 101 Cb 0.59 0.09 0.15 0.00 -0.81 0.00 0.00 31.31 31.33 2k8p n TRP 101 CO 0.00 0.00 0.00 1.03 2.07 0.00 0.00 177.69 180.79 2k8p s ARG 102 N 0.00 1.20 0.23 -2.67 0.52 -1.26 -5.03 118.95 111.94 2k8p s ARG 102 Ca 0.16 1.42 -0.04 0.00 -0.52 0.00 0.00 55.73 56.75 2k8p s ARG 102 Cb 0.18 -1.76 0.06 0.00 0.52 0.00 0.00 34.95 33.95 2k8p s ARG 102 CO -0.08 -2.46 0.20 -0.35 0.02 0.00 0.00 175.30 172.63 2k8p n PRO 103 N -4.11 -1.41 -3.17 3.54 -0.04 -1.26 -5.09 135.00 123.46 2k8p n PRO 103 Ca 0.11 -0.32 0.03 0.00 -0.04 0.00 0.00 63.50 63.28 2k8p n PRO 103 Cb 0.52 -0.30 -0.01 0.00 -0.04 0.00 0.00 33.50 33.67 2k8p n PRO 103 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2k8p s SER 104 N -2.05 -1.31 0.28 3.54 0.15 -1.26 -5.08 113.70 107.97 2k8p s SER 104 Ca 0.13 0.66 0.03 0.00 0.70 0.00 0.00 55.95 57.47 2k8p s SER 104 Cb -0.01 2.05 -0.04 0.00 -1.71 0.00 0.00 66.02 66.32 2k8p s SER 104 CO 0.10 -0.27 0.20 -0.83 1.20 0.00 0.00 173.24 173.64 2k8p s GLY 105 N 2.83 1.96 -0.26 9.45 0.00 -1.26 -5.11 107.32 114.92 2k8p s GLY 105 Ca 0.18 -1.87 -0.29 0.00 0.00 0.00 0.00 44.72 42.74 2k8p s GLY 105 CO -0.22 -1.47 1.63 2.56 0.00 0.00 0.00 173.10 175.60 2k8p s PRO 106 N -3.78 3.69 0.00 2.90 0.04 -1.26 -4.65 135.00 131.93 2k8p s PRO 106 Ca 0.39 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2k8p s PRO 106 Cb 0.05 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.52 2k8p s PRO 106 CO 0.20 -1.43 0.00 -0.25 0.04 0.00 0.00 177.00 175.56 2k8p n ASP 107 N 8.84 0.00 -3.69 6.66 8.00 -1.26 -5.16 116.55 129.93 2k8p n ASP 107 Ca 0.19 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.57 2k8p n ASP 107 Cb 0.46 0.23 0.06 0.00 -0.02 0.00 0.00 41.12 41.85 2k8p n ASP 107 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2k8p n PHE 108 N -1.86 -2.80 -3.79 1.24 3.01 -1.26 -5.04 117.46 106.96 2k8p n PHE 108 Ca 0.00 -1.20 -0.13 0.00 1.01 0.00 0.00 57.45 57.13 2k8p n PHE 108 Cb 0.00 -0.38 -0.09 0.00 -0.01 0.00 0.00 39.48 38.99 2k8p n PHE 108 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2k8p s ARG 109 N -3.80 0.58 -0.11 -1.08 6.06 -1.26 -5.01 118.95 114.33 2k8p s ARG 109 Ca 0.39 -0.16 -0.02 0.00 -2.50 0.00 0.00 55.73 53.44 2k8p s ARG 109 Cb -0.03 0.25 -0.03 0.00 0.06 0.00 0.00 34.95 35.21 2k8p s ARG 109 CO 0.25 -0.15 -0.04 0.00 -2.50 0.00 0.00 175.30 172.86 2k8p s ILE 111 N -0.35 5.25 0.58 0.00 -4.36 0.11 -4.85 121.20 117.59 2k8p s ILE 111 Ca 0.06 0.01 -0.18 0.00 -0.26 0.00 0.00 60.65 60.28 2k8p s ILE 111 Cb -0.12 -3.32 -0.04 0.00 1.25 0.00 0.00 42.46 40.22 2k8p s ILE 111 CO 0.02 0.53 1.12 -2.16 0.24 0.00 0.00 174.94 174.70 2k8p s PRO 112 N -1.25 3.17 0.11 0.37 0.04 -1.26 -1.70 135.00 134.48 2k8p s PRO 112 Ca 0.18 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2k8p s PRO 112 Cb -0.12 -1.99 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 2k8p s PRO 112 CO 0.08 -0.98 0.00 -3.47 0.04 0.00 0.00 177.00 172.67 2k8p n ASP 113 N -1.67 2.29 -4.52 6.66 2.03 -1.21 -4.75 116.55 115.38 2k8p n ASP 113 Ca 0.11 -1.47 -0.39 0.00 0.52 0.00 0.00 54.79 53.57 2k8p n ASP 113 Cb 0.51 0.08 0.04 0.00 -0.72 0.00 0.00 41.12 41.02 2k8p n ASP 113 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2k8p n ARG 114 N -0.27 0.71 -3.35 -0.67 0.63 -1.26 -4.62 116.66 107.84 2k8p n ARG 114 Ca -0.04 0.27 -0.21 0.00 -0.92 0.00 0.00 57.85 56.95 2k8p n ARG 114 Cb 0.14 -1.84 0.02 0.00 0.45 0.00 0.00 32.46 31.22 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 -1.59 1.98 -0.12 -0.14 1.51 -1.26 -1.30 117.35 116.43 2k8p s TYR 115 Ca 0.69 -0.65 -0.04 0.00 -1.01 0.00 0.00 57.07 56.07 2k8p s TYR 115 Cb -0.47 -2.16 0.05 0.00 -0.11 0.00 0.00 41.96 39.27 2k8p s TYR 115 CO 0.53 -0.64 0.08 0.50 -1.11 0.00 0.00 175.55 174.91 2k8p s ARG 116 N -4.40 0.03 -0.42 -0.62 3.52 0.96 -4.50 118.95 113.51 2k8p s ARG 116 Ca 0.51 0.08 -0.19 0.00 -0.13 0.00 0.00 55.73 56.01 2k8p s ARG 116 Cb -0.05 -1.34 0.02 0.00 -1.56 0.00 0.00 34.95 32.02 2k8p s ARG 116 CO 0.31 -0.54 0.52 0.00 -0.81 0.00 0.00 175.30 174.79 2k8p s ALA 117 N 2.14 3.40 0.06 6.12 0.00 -1.26 -1.80 121.76 130.41 2k8p s ALA 117 Ca 0.03 -1.37 0.04 0.00 0.00 0.00 0.00 51.96 50.66 2k8p s ALA 117 Cb -0.15 -3.15 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 2k8p s ALA 117 CO -0.07 -1.65 -0.04 -1.14 0.00 0.00 0.00 175.76 172.86 2k8p s GLN 118 N 2.42 2.49 -0.24 0.00 0.74 -0.98 -4.94 119.66 119.16 2k8p s GLN 118 Ca 0.17 -0.82 -0.07 0.00 0.05 0.00 0.00 55.36 54.69 2k8p s GLN 118 Cb -0.16 -2.50 -0.03 0.00 1.10 0.00 0.00 33.01 31.42 2k8p s GLN 118 CO 0.16 0.56 0.07 1.03 -0.55 0.00 0.00 175.29 176.56 2k8p s ARG 119 N -1.96 3.71 0.18 1.67 0.52 -1.26 -0.95 118.95 120.86 2k8p s ARG 119 Ca 0.22 -0.45 -0.06 0.00 -0.52 0.00 0.00 55.73 54.91 2k8p s ARG 119 Cb -0.11 -3.32 -0.06 0.00 0.52 0.00 0.00 34.95 31.97 2k8p s ARG 119 CO 0.14 -0.12 0.45 0.54 0.02 0.00 0.00 175.30 176.32 2k8p s VAL 120 N 1.45 5.08 -0.23 3.52 0.11 0.70 -4.92 120.40 126.12 2k8p s VAL 120 Ca 0.06 0.17 -0.01 0.00 -2.93 0.00 0.00 61.98 59.27 2k8p s VAL 120 Cb -0.15 -3.63 0.02 0.00 -1.53 0.00 0.00 36.38 31.09 2k8p s VAL 120 CO 0.04 -0.03 -0.11 -1.58 -3.33 0.00 0.00 175.10 170.09 2k8p s GLN 121 N -2.80 2.87 -0.15 1.54 0.74 -1.26 -1.24 119.66 119.36 2k8p s GLN 121 Ca 0.43 -0.94 -0.07 0.00 0.05 0.00 0.00 55.36 54.83 2k8p s GLN 121 Cb -0.12 -2.85 -0.04 0.00 1.10 0.00 0.00 33.01 31.10 2k8p s GLN 121 CO 0.24 -0.34 0.11 -0.51 -0.55 0.00 0.00 175.29 174.23 2k8p s LEU 122 N 1.31 4.13 0.07 3.68 1.43 0.39 -1.99 118.68 127.69 2k8p s LEU 122 Ca 0.01 0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 2k8p s LEU 122 Cb -0.16 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 2k8p s LEU 122 CO -0.07 0.29 0.09 -0.76 0.23 0.00 0.00 176.35 176.13 2k8p s LEU 123 N -0.31 3.84 0.27 1.79 2.01 0.15 -0.50 118.68 125.93 2k8p s LEU 123 Ca 0.10 0.03 0.10 0.00 0.01 0.00 0.00 54.13 54.37 2k8p s LEU 123 Cb -0.12 -2.48 -0.05 0.00 0.01 0.00 0.00 46.19 43.56 2k8p s LEU 123 CO 0.01 0.19 -0.06 0.00 1.01 0.00 0.00 176.35 177.49 2k8p n PRO 125 N -0.81 -2.98 -1.80 0.00 -0.04 -1.26 -4.80 135.00 123.31 2k8p n PRO 125 Ca -0.06 -1.60 -0.26 0.00 -0.04 0.00 0.00 63.50 61.54 2k8p n PRO 125 Cb 0.59 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.50 2k8p n PRO 125 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k8p s GLY 126 N -4.30 -0.26 0.00 0.55 0.00 -1.26 -2.25 107.32 99.80 2k8p s GLY 126 Ca 0.65 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 44.49 2k8p s GLY 126 CO 0.50 3.84 0.00 0.61 0.00 0.00 0.00 173.10 178.05 2k8p n GLY 127 N 6.52 0.41 3.61 0.20 0.00 -1.26 -5.15 105.19 109.52 2k8p n GLY 127 Ca 0.39 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 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 2.07 0.28 1.61 2.02 -0.95 -5.17 118.70 118.56 2k8p s GLU 128 Ca 0.00 -2.30 0.11 0.00 0.02 0.00 0.00 54.97 52.80 2k8p s GLU 128 Cb 0.00 -0.87 -0.05 0.00 0.10 0.00 0.00 34.13 33.31 2k8p s GLU 128 CO 0.00 -0.49 -0.14 0.00 0.02 0.00 0.00 175.26 174.64 2k8p s ALA 129 N -3.08 2.87 1.13 5.21 0.00 -1.26 -4.71 121.76 121.91 2k8p s ALA 129 Ca 0.15 -1.84 -0.17 0.00 0.00 0.00 0.00 51.96 50.10 2k8p s ALA 129 Cb 0.01 -0.37 0.25 0.00 0.00 0.00 0.00 23.12 23.02 2k8p s ALA 129 CO 0.10 0.26 1.10 -1.25 0.00 0.00 0.00 175.76 175.98 2k8p s PRO 130 N -3.56 -0.64 0.17 0.00 0.04 -1.26 -4.36 135.00 125.39 2k8p s PRO 130 Ca 0.31 0.15 -0.11 0.00 0.04 0.00 0.00 61.00 61.39 2k8p s PRO 130 Cb -0.05 -1.64 -0.00 0.00 0.04 0.00 0.00 34.50 32.85 2k8p s PRO 130 CO 0.16 -3.37 0.34 1.03 0.04 0.00 0.00 177.00 175.20 2k8p s ARG 131 N -5.23 1.21 -0.12 4.56 0.52 0.34 -4.97 118.95 115.26 2k8p s ARG 131 Ca 0.69 -1.11 0.03 0.00 -0.52 0.00 0.00 55.73 54.82 2k8p s ARG 131 Cb -0.13 0.41 0.01 0.00 0.52 0.00 0.00 34.95 35.75 2k8p s ARG 131 CO 0.57 -0.46 -0.21 0.00 0.02 0.00 0.00 175.30 175.22 2k8p s ALA 132 N -3.95 2.07 -0.13 2.13 0.00 -1.26 -0.46 121.76 120.17 2k8p s ALA 132 Ca 0.16 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.18 2k8p s ALA 132 Cb 0.02 -0.88 0.01 0.00 0.00 0.00 0.00 23.12 22.27 2k8p s ALA 132 CO -0.00 0.07 -0.19 0.50 0.00 0.00 0.00 175.76 176.14 2k8p s ARG 133 N 0.68 2.67 0.12 0.00 3.00 -0.37 -4.95 118.95 120.10 2k8p s ARG 133 Ca -0.11 -0.73 -0.22 0.00 -1.00 0.00 0.00 55.73 53.67 2k8p s ARG 133 Cb -0.16 -2.20 -0.07 0.00 0.00 0.00 0.00 34.95 32.52 2k8p s ARG 133 CO 0.02 -0.04 0.67 0.21 0.00 0.00 0.00 175.30 176.16 2k8p s LYS 134 N 0.90 4.38 -0.21 5.12 2.20 -1.26 -0.22 119.74 130.65 2k8p s LYS 134 Ca -0.07 0.95 -0.04 0.00 -0.36 0.00 0.00 55.97 56.45 2k8p s LYS 134 Cb -0.15 -3.25 0.07 0.00 -1.51 0.00 0.00 37.83 32.99 2k8p s LYS 134 CO -0.02 0.60 0.09 0.14 -0.36 0.00 0.00 175.35 175.80 2k8p s VAL 135 N -1.11 0.13 -0.55 4.02 -7.23 -0.13 -4.97 120.40 110.56 2k8p s VAL 135 Ca 0.32 -0.49 -0.23 0.00 -1.81 0.00 0.00 61.98 59.77 2k8p s VAL 135 Cb -0.21 -0.86 0.05 0.00 0.56 0.00 0.00 36.38 35.91 2k8p s VAL 135 CO 0.23 -0.40 0.88 -0.60 -0.31 0.00 0.00 175.10 174.90 2k8p s ARG 136 N 2.02 3.28 0.16 4.82 3.52 -1.26 -2.31 118.95 129.18 2k8p s ARG 136 Ca 0.04 -0.42 0.11 0.00 -0.13 0.00 0.00 55.73 55.32 2k8p s ARG 136 Cb -0.16 -4.07 -0.04 0.00 -1.56 0.00 0.00 34.95 29.11 2k8p s ARG 136 CO -0.17 -1.45 -0.23 -0.51 -0.81 0.00 0.00 175.30 172.13 2k8p s LEU 137 N 3.69 2.47 0.31 -0.88 1.02 -0.75 -4.93 118.68 119.62 2k8p s LEU 137 Ca 0.27 -0.77 -0.28 0.00 0.02 0.00 0.00 54.13 53.38 2k8p s LEU 137 Cb -0.14 -1.27 -0.13 0.00 0.02 0.00 0.00 46.19 44.67 2k8p s LEU 137 CO 0.17 0.15 1.05 0.52 0.02 0.00 0.00 176.35 178.26 2k8p n VAL 138 N 0.54 2.03 -0.09 -1.59 0.31 -1.26 -0.03 118.33 118.24 2k8p n VAL 138 Ca -0.15 -0.50 -0.12 0.00 -0.01 0.00 0.00 64.34 63.56 2k8p n VAL 138 Cb 0.54 -1.11 -0.10 0.00 -0.91 0.00 0.00 33.84 32.26 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 0.16 1.58 -3.93 3.52 0.00 -0.42 -4.42 120.51 117.00 2k8p n ALA 139 Ca 0.09 -0.88 -0.17 0.00 0.00 0.00 0.00 53.44 52.47 2k8p n ALA 139 Cb 0.34 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 19.75 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 -2.97 -0.22 -3.61 0.00 7.64 -0.67 -4.99 113.62 108.79 2k8p n SER 140 Ca -0.33 -2.54 -0.08 0.00 1.01 0.00 0.00 58.87 56.93 2k8p n SER 140 Cb 0.90 1.10 -0.06 0.00 -1.01 0.00 0.00 64.21 65.14 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 -0.51 0.78 -0.38 0.00 1.02 -0.69 -4.58 119.74 115.38 2k8p s LYS 142 Ca 0.02 -1.05 -0.10 0.00 0.02 0.00 0.00 55.97 54.86 2k8p s LYS 142 Cb -0.03 -0.53 0.05 0.00 -0.52 0.00 0.00 37.83 36.80 2k8p s LYS 142 CO -0.04 0.09 0.21 0.00 -0.92 0.00 0.00 175.35 174.69 2k8p s LYS 144 N 1.49 0.29 0.72 0.00 2.20 -0.48 -4.90 119.74 119.06 2k8p s LYS 144 Ca 0.02 0.55 -0.12 0.00 -0.36 0.00 0.00 55.97 56.06 2k8p s LYS 144 Cb -0.20 -0.01 0.03 0.00 -1.51 0.00 0.00 37.83 36.13 2k8p s LYS 144 CO 0.05 -0.13 1.09 0.50 -0.36 0.00 0.00 175.35 176.50 2k8p s ARG 145 N 0.97 2.55 0.01 4.03 3.00 -1.22 -4.14 118.95 124.15 2k8p s ARG 145 Ca -0.07 1.24 -0.02 0.00 -1.00 0.00 0.00 55.73 55.88 2k8p s ARG 145 Cb -0.07 -1.93 -0.04 0.00 0.00 0.00 0.00 34.95 32.91 2k8p s ARG 145 CO -0.07 -1.42 0.18 -1.17 0.00 0.00 0.00 175.30 172.82 2k8p s LEU 146 N -5.44 4.32 0.14 -0.88 2.96 -1.26 -4.97 118.68 113.54 2k8p s LEU 146 Ca 0.63 0.30 0.03 0.00 -0.22 0.00 0.00 54.13 54.87 2k8p s LEU 146 Cb -0.18 -2.68 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 2k8p s LEU 146 CO 0.50 0.23 -0.06 0.42 -1.32 0.00 0.00 176.35 176.13 2k8p s THR 147 N -1.37 0.83 0.23 3.68 -4.23 -1.26 -5.10 115.64 108.42 2k8p s THR 147 Ca 0.29 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.90 2k8p s THR 147 Cb -0.13 -1.86 -0.05 0.00 1.34 0.00 0.00 72.50 71.80 2k8p s THR 147 CO 0.21 -0.72 -0.14 0.00 -0.54 0.00 0.00 174.62 173.44 2k8p s ARG 148 N -3.83 1.42 0.25 3.99 1.70 -1.26 -5.16 118.95 116.06 2k8p s ARG 148 Ca 0.17 -1.65 -0.12 0.00 -0.47 0.00 0.00 55.73 53.66 2k8p s ARG 148 Cb 0.05 -1.23 -0.01 0.00 -0.57 0.00 0.00 34.95 33.20 2k8p s ARG 148 CO -0.01 0.18 0.46 0.12 -1.08 0.00 0.00 175.30 174.98 2k8p s PHE 149 N -2.91 0.45 0.02 5.89 5.36 -1.26 -5.18 117.98 120.34 2k8p s PHE 149 Ca 0.25 -0.80 -0.29 0.00 -0.96 0.00 0.00 56.93 55.13 2k8p s PHE 149 Cb -0.01 0.14 0.11 0.00 -0.34 0.00 0.00 43.02 42.92 2k8p s PHE 149 CO 0.09 -0.99 1.23 -3.38 -1.46 0.00 0.00 175.22 170.70 2k8p s HIS 150 N -3.94 -0.03 0.13 10.12 -3.43 -1.26 -5.19 115.29 111.68 2k8p s HIS 150 Ca 0.24 -0.12 -0.04 0.00 -0.80 0.00 0.00 55.06 54.34 2k8p s HIS 150 Cb -0.00 0.57 0.02 0.00 -1.43 0.00 0.00 32.58 31.74 2k8p s HIS 150 CO 0.10 -0.39 0.23 0.27 -2.00 0.00 0.00 174.74 172.95 2k8p n ASN 151 N -0.65 -0.68 -3.60 7.38 6.94 -1.26 -5.19 115.26 118.21 2k8p n ASN 151 Ca -0.06 -1.55 -0.10 0.00 -0.02 0.00 0.00 54.58 52.86 2k8p n ASN 151 Cb 0.62 1.15 -0.06 0.00 -2.36 0.00 0.00 39.78 39.13 2k8p n ASN 151 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 2k8p s GLN 152 N -2.09 0.53 -0.22 -3.83 0.74 -1.26 -5.18 119.66 108.35 2k8p s GLN 152 Ca 0.06 0.29 -0.33 0.00 0.05 0.00 0.00 55.36 55.44 2k8p s GLN 152 Cb -0.01 0.25 0.15 0.00 1.10 0.00 0.00 33.01 34.50 2k8p s GLN 152 CO 0.05 -0.13 1.23 -1.54 -0.55 0.00 0.00 175.29 174.34 2k8p s SER 153 N -0.61 -0.14 0.00 6.67 1.04 -1.26 -5.19 113.70 114.21 2k8p s SER 153 Ca 0.01 0.07 -0.00 0.00 0.48 0.00 0.00 55.95 56.51 2k8p s SER 153 Cb -0.02 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.23 2k8p s SER 153 CO -0.02 -0.18 0.00 -0.62 0.98 0.00 0.00 173.24 173.40 2k8p n GLU 154 N 0.21 0.01 -3.88 4.02 1.02 -1.26 -5.19 120.64 115.56 2k8p n GLU 154 Ca -0.01 -0.02 -0.09 0.00 -0.02 0.00 0.00 57.16 57.01 2k8p n GLU 154 Cb 0.58 0.02 -0.01 0.00 -0.02 0.00 0.00 31.44 32.02 2k8p n GLU 154 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 2k8p s LEU 155 N 0.00 0.10 0.00 -4.62 2.34 -1.26 -5.19 118.68 110.05 2k8p s LEU 155 Ca 0.00 -1.00 0.02 0.00 0.06 0.00 0.00 54.13 53.21 2k8p s LEU 155 Cb -0.00 2.49 -0.01 0.00 -0.56 0.00 0.00 46.19 48.12 2k8p s LEU 155 CO 0.00 -1.47 0.07 0.29 -1.06 0.00 0.00 176.35 174.19 2k8p n LYS 156 N -0.49 0.38 -3.58 1.48 5.02 -1.26 -5.18 118.16 114.52 2k8p n LYS 156 Ca -0.05 -1.08 -0.05 0.00 -2.02 0.00 0.00 58.31 55.11 2k8p n LYS 156 Cb 0.60 0.78 -0.02 0.00 -0.02 0.00 0.00 35.03 36.37 2k8p n LYS 156 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2k8p s ASP 157 N -1.77 -0.18 0.00 4.39 1.47 -1.26 -5.19 116.67 114.14 2k8p s ASP 157 Ca 0.11 -0.02 0.00 0.00 1.18 0.00 0.00 52.55 53.82 2k8p s ASP 157 Cb 0.01 0.20 0.00 0.00 -0.34 0.00 0.00 42.92 42.78 2k8p s ASP 157 CO 0.07 -0.33 0.00 0.49 0.68 0.00 0.00 175.17 176.09 2k8p n PHE 158 N -0.16 -0.17 -3.65 2.11 3.72 -1.26 -5.19 117.46 112.87 2k8p n PHE 158 Ca -0.02 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.36 2k8p n PHE 158 Cb 0.59 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.11 2k8p n PHE 158 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2k8p s GLY 159 N -0.68 -0.08 -0.24 1.37 0.00 -1.26 -5.18 107.32 101.25 2k8p s GLY 159 Ca 0.00 2.28 -0.27 0.00 0.00 0.00 0.00 44.72 46.74 2k8p s GLY 159 CO 0.00 0.81 1.04 -1.08 0.00 0.00 0.00 173.10 173.87 2k8p s THR 160 N -1.66 0.00 0.26 0.90 -1.32 -1.26 -5.19 115.64 107.37 2k8p s THR 160 Ca 0.11 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.61 2k8p s THR 160 Cb -0.01 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.97 2k8p s THR 160 CO -0.04 0.00 0.07 1.21 -2.21 0.00 0.00 174.62 173.64 2k8p n GLU 161 N 1.63 0.84 -3.84 7.08 2.13 -1.26 -5.18 120.64 122.05 2k8p n GLU 161 Ca -0.11 -2.10 -0.07 0.00 0.66 0.00 0.00 57.16 55.54 2k8p n GLU 161 Cb 0.57 1.01 -0.01 0.00 0.27 0.00 0.00 31.44 33.28 2k8p n GLU 161 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k8p s ALA 162 N -2.63 -1.20 -0.04 4.31 0.00 -1.26 -5.18 121.76 115.75 2k8p s ALA 162 Ca 0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 51.96 51.67 2k8p s ALA 162 Cb 0.00 0.78 0.01 0.00 0.00 0.00 0.00 23.12 23.92 2k8p s ALA 162 CO 0.07 -1.03 0.13 0.00 0.00 0.00 0.00 175.76 174.93 2k8p s ALA 163 N -3.44 -0.32 -0.02 0.00 0.00 -1.26 -5.16 121.76 111.56 2k8p s ALA 163 Ca 0.12 0.24 0.03 0.00 0.00 0.00 0.00 51.96 52.35 2k8p s ALA 163 Cb -0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 23.12 22.93 2k8p s ALA 163 CO 0.07 -0.10 -0.09 0.50 0.00 0.00 0.00 175.76 176.14 2k8p s ARG 164 N -0.29 0.85 1.02 0.00 3.52 -1.26 -5.15 118.95 117.64 2k8p s ARG 164 Ca -0.04 -0.31 -0.13 0.00 -0.13 0.00 0.00 55.73 55.13 2k8p s ARG 164 Cb -0.03 -0.81 0.20 0.00 -1.56 0.00 0.00 34.95 32.75 2k8p s ARG 164 CO 0.00 0.15 1.09 -1.25 -0.81 0.00 0.00 175.30 174.48 2k8p s PRO 165 N 0.03 0.29 -0.04 5.12 0.04 -1.26 -5.09 135.00 134.10 2k8p s PRO 165 Ca -0.00 0.47 -0.08 0.00 0.04 0.00 0.00 61.00 61.43 2k8p s PRO 165 Cb -0.06 -1.72 0.01 0.00 0.04 0.00 0.00 34.50 32.76 2k8p s PRO 165 CO 0.00 -2.81 0.19 -1.14 0.04 0.00 0.00 177.00 173.27 2k8p s GLN 166 N -4.97 0.40 -0.16 4.56 2.00 -1.26 -5.15 119.66 115.07 2k8p s GLN 166 Ca 0.66 -0.07 -0.05 0.00 -2.00 0.00 0.00 55.36 53.90 2k8p s GLN 166 Cb -0.19 0.17 -0.03 0.00 0.80 0.00 0.00 33.01 33.76 2k8p s GLN 166 CO 0.58 -0.08 0.01 0.21 -0.50 0.00 0.00 175.29 175.50 2k8p s LYS 167 N -0.70 3.74 0.25 1.67 2.20 -1.26 -5.10 119.74 120.54 2k8p s LYS 167 Ca -0.08 -0.43 0.03 0.00 -0.36 0.00 0.00 55.97 55.13 2k8p s LYS 167 Cb -0.05 -3.03 -0.01 0.00 -1.51 0.00 0.00 37.83 33.23 2k8p s LYS 167 CO 0.01 0.30 0.10 0.41 -0.36 0.00 0.00 175.35 175.81 2k8p n GLY 168 N 3.40 3.54 3.83 5.54 0.00 -1.26 -5.18 105.19 115.06 2k8p n GLY 168 Ca -0.17 -2.01 -0.07 0.00 0.00 0.00 0.00 46.02 43.77 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 -2.94 1.95 0.24 1.61 3.00 -1.26 -5.18 118.95 116.36 2k8p s ARG 169 Ca 0.14 -1.23 0.11 0.00 -1.00 0.00 0.00 55.73 53.76 2k8p s ARG 169 Cb 0.01 0.56 -0.05 0.00 0.00 0.00 0.00 34.95 35.47 2k8p s ARG 169 CO 0.10 -0.91 -0.21 -1.59 0.00 0.00 0.00 175.30 172.69 2k8p s LYS 170 N -2.50 1.59 1.04 5.12 -2.85 -1.26 -5.14 119.74 115.74 2k8p s LYS 170 Ca 0.16 -1.65 -0.13 0.00 -1.00 0.00 0.00 55.97 53.34 2k8p s LYS 170 Cb -0.05 -1.75 0.21 0.00 -2.06 0.00 0.00 37.83 34.18 2k8p s LYS 170 CO 0.09 0.35 1.10 -1.25 0.10 0.00 0.00 175.35 175.74 2k8p s PRO 171 N -3.16 0.07 -0.48 1.78 0.04 -1.26 -5.05 135.00 126.94 2k8p s PRO 171 Ca 0.25 0.40 0.05 0.00 0.04 0.00 0.00 61.00 61.75 2k8p s PRO 171 Cb -0.06 -1.71 0.24 0.00 0.04 0.00 0.00 34.50 33.01 2k8p s PRO 171 CO 0.12 -2.95 0.91 -2.13 0.04 0.00 0.00 177.00 172.99 2k8p n ARG 172 N -4.31 0.69 -2.22 4.56 0.63 -1.26 -5.14 116.66 109.61 2k8p n ARG 172 Ca 0.06 -1.65 -0.42 0.00 -0.92 0.00 0.00 57.85 54.92 2k8p n ARG 172 Cb 0.58 -1.34 -0.03 0.00 0.45 0.00 0.00 32.46 32.12 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2k8p s PRO 173 N 0.67 4.37 -0.12 -0.14 0.04 -1.26 -4.96 135.00 133.60 2k8p s PRO 173 Ca 0.31 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 63.10 2k8p s PRO 173 Cb 0.20 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.48 2k8p s PRO 173 CO -0.21 -0.31 1.55 0.50 0.04 0.00 0.00 177.00 178.57 2k8p s ARG 174 N 0.34 4.11 -0.90 4.56 3.52 -1.26 -4.95 118.95 124.37 2k8p s ARG 174 Ca 0.59 1.94 -0.15 0.00 -0.13 0.00 0.00 55.73 57.98 2k8p s ARG 174 Cb -0.36 -3.94 0.19 0.00 -1.56 0.00 0.00 34.95 29.28 2k8p s ARG 174 CO 0.35 -0.91 0.95 0.00 -0.81 0.00 0.00 175.30 174.88 2k8p s ALA 175 N 4.16 3.86 -0.21 6.12 0.00 -1.26 -5.02 121.76 129.40 2k8p s ALA 175 Ca 0.68 -3.16 -0.18 0.00 0.00 0.00 0.00 51.96 49.31 2k8p s ALA 175 Cb -0.29 -3.74 -0.03 0.00 0.00 0.00 0.00 23.12 19.06 2k8p s ALA 175 CO 0.26 -2.55 0.50 0.50 0.00 0.00 0.00 175.76 174.46 2k8p s ARG 176 N 1.06 4.16 -0.11 0.00 3.00 -1.26 -5.06 118.95 120.73 2k8p s ARG 176 Ca 0.25 0.36 0.03 0.00 -1.00 0.00 0.00 55.73 55.37 2k8p s ARG 176 Cb -0.08 -3.58 0.00 0.00 0.00 0.00 0.00 34.95 31.30 2k8p s ARG 176 CO -0.09 -0.17 -0.22 0.45 0.00 0.00 0.00 175.30 175.26 2k8p s SER 177 N 1.22 2.99 0.08 -2.12 0.15 -1.26 -4.95 113.70 109.81 2k8p s SER 177 Ca 0.23 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.32 2k8p s SER 177 Cb -0.15 -1.37 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 2k8p s SER 177 CO 0.09 0.12 0.00 0.00 1.20 0.00 0.00 173.24 174.65 2k8p n ALA 178 N 3.74 0.00 -1.33 5.45 0.00 -1.26 -5.17 120.51 121.94 2k8p n ALA 178 Ca -0.20 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.41 2k8p n ALA 178 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 2k8p n ALA 178 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2k8p n LYS 179 N -2.64 -2.41 -3.49 0.00 4.81 -1.26 -5.00 118.16 108.16 2k8p n LYS 179 Ca 0.00 1.59 0.02 0.00 -0.87 0.00 0.00 58.31 59.05 2k8p n LYS 179 Cb 0.00 -2.94 -0.05 0.00 0.02 0.00 0.00 35.03 32.06 2k8p n LYS 179 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k8p s ALA 180 N -2.14 -2.78 0.22 3.14 0.00 -1.26 -5.19 121.76 113.75 2k8p s ALA 180 Ca 0.00 1.97 -0.21 0.00 0.00 0.00 0.00 51.96 53.72 2k8p s ALA 180 Cb 0.00 -2.04 0.07 0.00 0.00 0.00 0.00 23.12 21.15 2k8p s ALA 180 CO 0.00 -0.58 0.97 1.21 0.00 0.00 0.00 175.76 177.36 2k8p s ASN 181 N 1.53 -0.03 0.00 0.00 2.47 -1.26 -5.08 114.94 112.57 2k8p s ASN 181 Ca -0.05 -0.73 0.00 0.00 0.42 0.00 0.00 52.86 52.50 2k8p s ASN 181 Cb -0.02 0.58 0.00 0.00 -1.45 0.00 0.00 41.25 40.35 2k8p s ASN 181 CO -0.13 -1.13 0.00 1.67 -3.72 0.00 0.00 177.10 173.78 2k8p n GLN 182 N -0.62 0.00 -1.26 0.43 -0.06 -1.26 -5.17 117.38 109.44 2k8p n GLN 182 Ca -0.05 0.00 0.17 0.00 -2.00 0.00 0.00 57.00 55.12 2k8p n GLN 182 Cb 0.60 -0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.73 2k8p n GLN 182 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2k8p n ALA 183 N -1.83 -3.25 -3.06 1.69 0.00 -1.26 -4.98 120.51 107.83 2k8p n ALA 183 Ca 0.00 0.45 -0.11 0.00 0.00 0.00 0.00 53.44 53.77 2k8p n ALA 183 Cb 0.00 -1.15 -0.11 0.00 0.00 0.00 0.00 19.45 18.19 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 -2.31 0.35 0.00 0.00 2.12 -1.26 -5.04 118.70 112.56 2k8p s GLU 184 Ca 0.00 -0.23 0.01 0.00 0.36 0.00 0.00 54.97 55.11 2k8p s GLU 184 Cb 0.00 0.15 0.02 0.00 0.26 0.00 0.00 34.13 34.55 2k8p s GLU 184 CO 0.00 -0.07 0.87 -0.11 -0.54 0.00 0.00 175.26 175.41 2k8p n LEU 185 N 2.00 -0.65 -4.21 2.70 7.94 -1.26 -5.08 117.00 118.44 2k8p n LEU 185 Ca -0.19 -1.72 -0.38 0.00 -1.11 0.00 0.00 56.01 52.60 2k8p n LEU 185 Cb 0.57 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.41 2k8p n LEU 185 CO 0.21 1.31 -0.17 -0.70 -1.11 0.00 0.00 177.39 176.94 2k8p s GLU 186 N 0.00 2.40 0.63 1.96 2.12 -1.26 -5.09 118.70 119.46 2k8p s GLU 186 Ca 0.01 -1.53 -0.01 0.00 0.36 0.00 0.00 54.97 53.80 2k8p s GLU 186 Cb 0.01 -3.62 0.06 0.00 0.26 0.00 0.00 34.13 30.85 2k8p s GLU 186 CO -0.01 -0.93 0.89 1.21 -0.54 0.00 0.00 175.26 175.88 2k8p s ASN 187 N 1.88 4.92 -0.12 -1.70 2.47 -1.26 -5.12 114.94 116.02 2k8p s ASN 187 Ca 0.03 0.00 -0.05 0.00 0.42 0.00 0.00 52.86 53.26 2k8p s ASN 187 Cb -0.22 -0.71 0.05 0.00 -1.45 0.00 0.00 41.25 38.92 2k8p s ASN 187 CO -0.00 -1.43 0.27 0.00 -3.72 0.00 0.00 177.10 172.21 2k8p s ALA 188 N -2.97 -0.61 0.00 1.71 0.00 -1.26 -5.34 121.76 113.30 2k8p s ALA 188 Ca 0.60 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2k8p s ALA 188 Cb -0.09 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.26 2k8p s ALA 188 CO 0.41 -0.33 0.40 0.98 0.00 0.00 0.00 175.76 177.23