#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8p s TRP 2 N 0.00 0.88 -0.07 1.61 0.52 -1.26 -5.08 118.94 115.55 2k8p s TRP 2 Ca 0.00 0.29 0.05 0.00 0.02 0.00 0.00 56.10 56.46 2k8p s TRP 2 Cb 0.00 -3.98 -0.00 0.00 -1.15 0.00 0.00 33.47 28.34 2k8p s TRP 2 CO 0.00 -3.29 -0.22 1.14 0.02 0.00 0.00 176.95 174.60 2k8p s GLN 3 N -5.79 2.47 0.66 4.98 0.00 -1.26 -5.14 119.66 115.58 2k8p s GLN 3 Ca 0.75 -0.81 0.01 0.00 -0.00 0.00 0.00 55.36 55.32 2k8p s GLN 3 Cb -0.04 -2.02 0.10 0.00 0.00 0.00 0.00 33.01 31.04 2k8p s GLN 3 CO 0.54 0.28 0.91 0.00 0.00 0.00 0.00 175.29 177.02 2k8p s ALA 4 N 0.07 3.90 0.33 2.60 0.00 -1.26 -5.13 121.76 122.27 2k8p s ALA 4 Ca -0.09 -1.71 0.02 0.00 0.00 0.00 0.00 51.96 50.18 2k8p s ALA 4 Cb -0.15 -1.93 -0.01 0.00 0.00 0.00 0.00 23.12 21.03 2k8p s ALA 4 CO 0.05 -1.22 0.08 1.19 0.00 0.00 0.00 175.76 175.86 2k8p n PHE 5 N -2.64 0.32 -3.06 0.00 3.01 -1.26 -4.81 117.46 109.03 2k8p n PHE 5 Ca 0.14 -1.96 -0.21 0.00 1.01 0.00 0.00 57.45 56.43 2k8p n PHE 5 Cb 0.61 -0.07 0.01 0.00 -0.01 0.00 0.00 39.48 40.01 2k8p n PHE 5 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2k8p n LYS 6 N -0.77 -3.49 -1.49 -1.08 4.81 -1.26 -4.96 118.16 109.93 2k8p n LYS 6 Ca -0.08 0.63 -0.06 0.00 -0.87 0.00 0.00 58.31 57.93 2k8p n LYS 6 Cb 0.47 -5.35 0.03 0.00 0.02 0.00 0.00 35.03 30.20 2k8p n LYS 6 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2k8p n ASN 7 N -2.24 0.58 -3.21 3.14 6.94 -1.26 -5.15 115.26 114.07 2k8p n ASN 7 Ca -0.07 -1.44 -0.16 0.00 -0.02 0.00 0.00 54.58 52.89 2k8p n ASN 7 Cb 0.58 -0.16 -0.03 0.00 -2.36 0.00 0.00 39.78 37.81 2k8p n ASN 7 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2k8p n ASP 8 N -2.85 2.40 -2.80 0.53 9.92 -1.26 -5.16 116.55 117.32 2k8p n ASP 8 Ca 0.05 -2.10 0.00 0.00 -0.53 0.00 0.00 54.79 52.21 2k8p n ASP 8 Cb 0.19 0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.91 2k8p n ASP 8 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k8p n ALA 9 N -2.17 0.00 -3.07 2.24 0.00 -1.26 -4.79 120.51 111.46 2k8p n ALA 9 Ca -0.10 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.28 2k8p n ALA 9 Cb 0.32 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.77 2k8p n ALA 9 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2k8p n THR 10 N -0.59 -9.68 -1.79 0.00 -1.04 -1.26 -4.92 114.28 95.01 2k8p n THR 10 Ca 0.00 0.16 -0.39 0.00 -2.04 0.00 0.00 64.05 61.78 2k8p n THR 10 Cb 0.00 -6.60 0.04 0.00 -1.82 0.00 0.00 70.33 61.95 2k8p n THR 10 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2k8p s GLU 11 N -3.00 3.25 -0.41 -2.82 -1.05 -1.26 -5.00 118.70 108.41 2k8p s GLU 11 Ca 0.10 2.27 0.01 0.00 -0.15 0.00 0.00 54.97 57.20 2k8p s GLU 11 Cb -0.02 -2.34 0.13 0.00 -0.44 0.00 0.00 34.13 31.46 2k8p s GLU 11 CO 0.77 -1.12 0.22 0.42 0.95 0.00 0.00 175.26 176.51 2k8p s ILE 12 N -1.28 1.01 -0.59 1.83 1.01 -1.26 -5.02 121.20 116.88 2k8p s ILE 12 Ca 0.69 -2.24 0.06 0.00 0.00 0.00 0.00 60.65 59.17 2k8p s ILE 12 Cb -0.41 -1.71 0.22 0.00 0.01 0.00 0.00 42.46 40.57 2k8p s ILE 12 CO 0.49 -0.91 0.61 -0.38 0.00 0.00 0.00 174.94 174.75 2k8p n ILE 13 N 3.77 1.34 -2.10 2.92 -0.00 -1.26 -5.07 119.36 118.96 2k8p n ILE 13 Ca 0.09 -4.76 -0.43 0.00 -0.00 0.00 0.00 62.75 57.64 2k8p n ILE 13 Cb 0.36 -2.06 -0.03 0.00 -0.00 0.00 0.00 39.64 37.91 2k8p n ILE 13 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2k8p s PRO 14 N -1.77 3.52 0.00 0.38 0.04 -1.26 -4.23 135.00 131.68 2k8p s PRO 14 Ca 0.35 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.80 2k8p s PRO 14 Cb 0.09 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.52 2k8p s PRO 14 CO -0.09 -1.63 0.00 -1.91 0.04 0.00 0.00 177.00 173.42 2k8p n GLU 15 N 8.13 0.00 -3.20 4.56 4.07 -1.26 -5.14 120.64 127.80 2k8p n GLU 15 Ca 0.20 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.92 2k8p n GLU 15 Cb 0.46 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.79 2k8p n GLU 15 CO 0.00 0.00 0.00 -0.48 -0.06 0.00 0.00 177.13 176.59 2k8p s LEU 16 N -0.54 4.53 -0.12 4.31 0.05 -1.26 -4.99 118.68 120.65 2k8p s LEU 16 Ca 0.00 1.33 -0.08 0.00 0.05 0.00 0.00 54.13 55.43 2k8p s LEU 16 Cb 0.00 -2.99 -0.06 0.00 -2.05 0.00 0.00 46.19 41.09 2k8p s LEU 16 CO 0.00 0.23 -0.19 0.61 -0.55 0.00 0.00 176.35 176.45 2k8p n GLY 17 N 1.81 -0.26 3.73 -3.48 0.00 -1.26 -5.00 105.19 100.73 2k8p n GLY 17 Ca -0.09 -0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 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 -3.77 -4.16 -3.41 1.61 1.02 -1.26 -4.90 120.64 105.77 2k8p n GLU 18 Ca -0.24 0.52 -0.27 0.00 -0.02 0.00 0.00 57.16 57.15 2k8p n GLU 18 Cb 0.59 -5.30 -0.08 0.00 -0.02 0.00 0.00 31.44 26.63 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 -4.33 3.27 -2.26 -0.32 9.36 -1.26 -5.09 117.16 116.53 2k8p n TYR 19 Ca 0.02 -4.11 -0.36 0.00 3.32 0.00 0.00 57.90 56.78 2k8p n TYR 19 Cb 0.53 -0.54 -0.00 0.00 -0.63 0.00 0.00 39.34 38.70 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 -2.34 3.45 0.07 2.98 0.04 -1.26 -5.06 135.00 132.88 2k8p s PRO 20 Ca 0.39 1.65 -0.04 0.00 0.04 0.00 0.00 61.00 63.05 2k8p s PRO 20 Cb 0.15 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 2k8p s PRO 20 CO -0.02 -0.78 0.05 -1.21 0.04 0.00 0.00 177.00 175.08 2k8p s GLU 21 N -3.15 0.72 0.96 4.56 2.02 -1.26 -5.17 118.70 117.39 2k8p s GLU 21 Ca 0.71 -1.15 -0.12 0.00 0.02 0.00 0.00 54.97 54.43 2k8p s GLU 21 Cb -0.25 0.26 0.17 0.00 0.10 0.00 0.00 34.13 34.40 2k8p s GLU 21 CO 0.29 -0.18 1.09 -1.25 0.02 0.00 0.00 175.26 175.23 2k8p s PRO 22 N -3.91 0.75 0.96 0.39 0.04 -1.26 -5.04 135.00 126.93 2k8p s PRO 22 Ca 0.08 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.63 2k8p s PRO 22 Cb 0.07 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.01 2k8p s PRO 22 CO -0.09 -2.54 1.09 -1.25 0.04 0.00 0.00 177.00 174.25 2k8p s PRO 23 N -4.95 0.72 1.10 0.56 0.04 -1.26 -5.04 135.00 126.17 2k8p s PRO 23 Ca 0.65 0.63 -0.16 0.00 0.04 0.00 0.00 61.00 62.16 2k8p s PRO 23 Cb -0.18 -1.76 0.24 0.00 0.04 0.00 0.00 34.50 32.83 2k8p s PRO 23 CO 0.57 -2.56 1.10 -1.25 0.04 0.00 0.00 177.00 174.91 2k8p s PRO 24 N -4.95 -0.42 -0.45 0.56 0.04 -1.26 -5.05 135.00 123.47 2k8p s PRO 24 Ca 0.65 0.22 0.07 0.00 0.04 0.00 0.00 61.00 61.98 2k8p s PRO 24 Cb -0.18 -1.66 0.28 0.00 0.04 0.00 0.00 34.50 32.97 2k8p s PRO 24 CO 0.57 -3.24 0.87 -0.85 0.04 0.00 0.00 177.00 174.39 2k8p n GLU 25 N -4.48 0.86 -3.47 4.56 0.28 -1.26 -5.05 120.64 112.09 2k8p n GLU 25 Ca 0.09 -2.27 -0.34 0.00 -0.16 0.00 0.00 57.16 54.47 2k8p n GLU 25 Cb 0.58 -1.33 -0.06 0.00 1.43 0.00 0.00 31.44 32.07 2k8p n GLU 25 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2k8p n LEU 26 N 1.05 4.44 -4.31 -1.84 4.77 -1.26 -5.04 117.00 114.82 2k8p n LEU 26 Ca 0.12 -5.25 -0.31 0.00 -0.03 0.00 0.00 56.01 50.55 2k8p n LEU 26 Cb 0.64 -0.99 -0.16 0.00 -2.33 0.00 0.00 43.42 40.58 2k8p n LEU 26 CO 0.09 1.74 -0.57 -0.70 -1.33 0.00 0.00 177.39 176.62 2k8p s GLU 27 N -1.98 2.12 0.27 3.23 2.12 -1.26 -5.14 118.70 118.06 2k8p s GLU 27 Ca 0.32 -0.92 0.02 0.00 0.36 0.00 0.00 54.97 54.74 2k8p s GLU 27 Cb 0.02 -2.04 -0.04 0.00 0.26 0.00 0.00 34.13 32.33 2k8p s GLU 27 CO -0.05 0.55 0.13 -0.80 -0.54 0.00 0.00 175.26 174.55 2k8p s ASN 28 N -0.59 1.21 -0.30 -1.70 -0.87 -1.26 -5.16 114.94 106.27 2k8p s ASN 28 Ca 0.09 -1.47 -0.15 0.00 -1.57 0.00 0.00 52.86 49.76 2k8p s ASN 28 Cb -0.10 0.31 0.18 0.00 -0.02 0.00 0.00 41.25 41.61 2k8p s ASN 28 CO -0.01 -0.83 1.09 0.21 -2.57 0.00 0.00 177.10 174.99 2k8p s ASN 29 N -3.32 -0.40 0.10 -1.22 3.84 -1.26 -5.18 114.94 107.50 2k8p s ASN 29 Ca 0.37 0.38 0.03 0.00 0.21 0.00 0.00 52.86 53.85 2k8p s ASN 29 Cb 0.06 1.39 -0.04 0.00 -0.55 0.00 0.00 41.25 42.11 2k8p s ASN 29 CO 0.15 -0.08 -0.08 -1.59 -2.79 0.00 0.00 177.10 172.72 2k8p s LYS 30 N 2.63 0.82 -0.21 0.43 0.00 -1.26 -5.15 119.74 117.00 2k8p s LYS 30 Ca -0.01 -1.23 -0.06 0.00 0.00 0.00 0.00 55.97 54.66 2k8p s LYS 30 Cb -0.07 -0.33 0.10 0.00 0.00 0.00 0.00 37.83 37.53 2k8p s LYS 30 CO -0.14 0.02 0.43 0.95 0.00 0.00 0.00 175.35 176.61 2k8p s THR 31 N -3.05 -0.67 -0.27 3.79 -4.23 -1.26 -5.12 115.64 104.84 2k8p s THR 31 Ca 0.08 0.13 -0.01 0.00 -1.18 0.00 0.00 61.69 60.70 2k8p s THR 31 Cb 0.01 -0.71 0.13 0.00 1.34 0.00 0.00 72.50 73.27 2k8p s THR 31 CO -0.02 0.04 0.29 -0.04 -0.54 0.00 0.00 174.62 174.34 2k8p s MET 32 N 2.62 0.30 0.06 3.99 -1.94 -1.26 -5.14 119.30 117.93 2k8p s MET 32 Ca 0.01 -0.02 0.01 0.00 -1.71 0.00 0.00 55.69 53.98 2k8p s MET 32 Cb -0.13 -0.75 -0.03 0.00 2.01 0.00 0.00 34.83 35.93 2k8p s MET 32 CO -0.14 -0.92 -0.06 -0.80 -0.01 0.00 0.00 175.02 173.09 2k8p s ASN 33 N 2.37 0.77 -0.09 3.03 0.01 -1.26 -5.15 114.94 114.62 2k8p s ASN 33 Ca 0.09 -0.79 -0.03 0.00 -0.71 0.00 0.00 52.86 51.42 2k8p s ASN 33 Cb -0.14 0.10 0.05 0.00 0.41 0.00 0.00 41.25 41.67 2k8p s ASN 33 CO -0.28 -0.39 0.15 -0.13 -1.51 0.00 0.00 177.10 174.94 2k8p s ARG 34 N -2.82 0.03 -0.35 -0.60 0.52 -1.26 -5.08 118.95 109.39 2k8p s ARG 34 Ca -0.00 0.51 -0.05 0.00 -0.52 0.00 0.00 55.73 55.67 2k8p s ARG 34 Cb -0.01 -0.39 0.19 0.00 0.52 0.00 0.00 34.95 35.26 2k8p s ARG 34 CO -0.04 -0.34 0.95 0.00 0.02 0.00 0.00 175.30 175.89 2k8p s ALA 35 N 2.28 -3.93 -0.07 2.13 0.00 -1.26 -5.05 121.76 115.85 2k8p s ALA 35 Ca 0.03 0.99 -0.26 0.00 0.00 0.00 0.00 51.96 52.73 2k8p s ALA 35 Cb -0.12 -2.95 -0.24 0.00 0.00 0.00 0.00 23.12 19.81 2k8p s ALA 35 CO -0.06 -2.43 0.99 1.49 0.00 0.00 0.00 175.76 175.75 2k8p h GLU 36 N 5.76 0.09 -1.68 0.00 4.22 -2.10 -3.47 114.58 117.40 2k8p h GLU 36 Ca -0.01 -0.10 0.07 0.00 0.08 0.00 0.00 59.36 59.39 2k8p h GLU 36 Cb 1.22 0.03 -0.25 0.00 0.50 0.00 0.00 28.75 30.25 2k8p h GLU 36 CO -0.03 0.88 0.32 0.54 -2.18 0.00 0.00 179.01 178.53 2k8p s ASN 37 N -6.19 -0.59 -0.30 1.04 2.20 -1.26 -5.09 114.94 104.74 2k8p s ASN 37 Ca -0.17 1.02 0.03 0.00 -0.94 0.00 0.00 52.86 52.80 2k8p s ASN 37 Cb -0.00 1.16 0.32 0.00 -2.00 0.00 0.00 41.25 40.73 2k8p s ASN 37 CO 0.72 -0.17 1.42 0.61 -2.94 0.00 0.00 177.10 176.74 2k8p n GLY 38 N 3.27 -1.85 0.00 0.45 0.00 -1.26 -5.04 105.19 100.75 2k8p n GLY 38 Ca -0.17 1.02 0.00 0.00 0.00 0.00 0.00 46.02 46.87 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 0.69 0.00 2.25 -0.02 0.00 -1.26 -5.08 105.19 101.77 2k8p n GLY 39 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 2k8p n GLY 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k8p n ARG 40 N 0.00 0.73 -1.17 1.61 3.00 -1.26 -5.13 116.66 114.44 2k8p n ARG 40 Ca 0.00 -3.31 -0.29 0.00 -0.00 0.00 0.00 57.85 54.25 2k8p n ARG 40 Cb 0.00 -1.38 0.16 0.00 0.00 0.00 0.00 32.46 31.25 2k8p n ARG 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k8p s PRO 41 N -1.02 0.73 0.15 -0.14 0.04 -1.26 -4.98 135.00 128.52 2k8p s PRO 41 Ca 0.35 0.64 -0.31 0.00 0.04 0.00 0.00 61.00 61.72 2k8p s PRO 41 Cb 0.14 -1.76 -0.08 0.00 0.04 0.00 0.00 34.50 32.84 2k8p s PRO 41 CO -0.12 -2.56 1.34 -1.25 0.04 0.00 0.00 177.00 174.45 2k8p s PRO 42 N -4.94 4.36 0.03 0.56 0.04 -1.26 -5.03 135.00 128.75 2k8p s PRO 42 Ca 0.65 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.80 2k8p s PRO 42 Cb -0.18 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.09 2k8p s PRO 42 CO 0.57 -0.34 -0.19 -3.38 0.04 0.00 0.00 177.00 173.70 2k8p s HIS 43 N 0.68 2.54 -0.38 0.56 -3.43 -1.26 -5.06 115.29 108.95 2k8p s HIS 43 Ca 0.61 -0.27 0.00 0.00 -0.80 0.00 0.00 55.06 54.60 2k8p s HIS 43 Cb -0.36 -1.48 0.27 0.00 -1.43 0.00 0.00 32.58 29.58 2k8p s HIS 43 CO 0.33 0.22 1.14 -2.39 -2.00 0.00 0.00 174.74 172.04 2k8p n HIS 44 N 1.68 -1.41 -1.62 0.38 1.44 -1.26 -5.16 115.22 109.27 2k8p n HIS 44 Ca -0.16 -1.03 -0.32 0.00 -2.01 0.00 0.00 57.72 54.19 2k8p n HIS 44 Cb 0.52 1.24 0.06 0.00 0.12 0.00 0.00 29.99 31.93 2k8p n HIS 44 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 2k8p s PRO 45 N 0.29 2.65 -0.19 -1.40 0.04 -1.26 -5.06 135.00 130.07 2k8p s PRO 45 Ca 0.28 1.33 -0.03 0.00 0.04 0.00 0.00 61.00 62.62 2k8p s PRO 45 Cb 0.22 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.88 2k8p s PRO 45 CO -0.14 -1.36 0.04 -0.06 0.04 0.00 0.00 177.00 175.52 2k8p s PHE 46 N -2.49 0.94 -0.02 0.56 0.08 -1.26 -5.13 117.98 110.66 2k8p s PHE 46 Ca 0.65 -0.78 0.05 0.00 0.12 0.00 0.00 56.93 56.97 2k8p s PHE 46 Cb -0.20 -0.99 -0.01 0.00 -0.57 0.00 0.00 43.02 41.25 2k8p s PHE 46 CO 0.45 -0.59 -0.17 -1.83 -0.10 0.00 0.00 175.22 172.98 2k8p s GLU 47 N 1.89 1.48 -0.30 0.44 1.03 -1.26 -5.11 118.70 116.87 2k8p s GLU 47 Ca -0.00 -0.61 -0.00 0.00 0.03 0.00 0.00 54.97 54.39 2k8p s GLU 47 Cb -0.17 -1.39 0.19 0.00 -0.80 0.00 0.00 34.13 31.96 2k8p s GLU 47 CO -0.08 0.33 0.60 0.99 -1.33 0.00 0.00 175.26 175.78 2k8p s THR 48 N -0.28 -0.99 -0.34 1.83 2.01 -1.26 -5.13 115.64 111.47 2k8p s THR 48 Ca 0.04 0.00 -0.19 0.00 0.31 0.00 0.00 61.69 61.85 2k8p s THR 48 Cb -0.08 -1.00 -0.00 0.00 0.01 0.00 0.00 72.50 71.43 2k8p s THR 48 CO 0.00 0.00 0.58 -0.54 -0.69 0.00 0.00 174.62 173.97 2k8p s LYS 49 N 2.86 3.70 -0.09 4.92 1.02 -1.26 -5.03 119.74 125.86 2k8p s LYS 49 Ca 0.19 0.01 -0.03 0.00 0.02 0.00 0.00 55.97 56.16 2k8p s LYS 49 Cb -0.14 -3.79 0.05 0.00 -0.52 0.00 0.00 37.83 33.43 2k8p s LYS 49 CO -0.22 -0.66 0.17 0.16 -0.92 0.00 0.00 175.35 173.88 2k8p s ASP 50 N 1.75 0.56 0.00 2.83 -4.77 -1.26 -5.00 116.67 110.78 2k8p s ASP 50 Ca 0.22 0.35 0.04 0.00 -3.30 0.00 0.00 52.55 49.86 2k8p s ASP 50 Cb -0.15 0.30 0.06 0.00 -1.09 0.00 0.00 42.92 42.04 2k8p s ASP 50 CO 0.14 -0.23 0.83 0.55 0.70 0.00 0.00 175.17 177.16 2k8p n VAL 51 N 5.13 0.00 -2.89 2.11 3.14 -1.26 -5.06 118.33 119.50 2k8p n VAL 51 Ca -0.09 -0.14 -0.09 0.00 -2.96 0.00 0.00 64.34 61.06 2k8p n VAL 51 Cb 0.50 0.38 0.01 0.00 -1.06 0.00 0.00 33.84 33.67 2k8p n VAL 51 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2k8p n SER 52 N 0.07 -7.86 -1.27 6.55 7.64 -1.26 -4.82 113.62 112.67 2k8p n SER 52 Ca -0.05 0.47 0.16 0.00 1.01 0.00 0.00 58.87 60.46 2k8p n SER 52 Cb 0.69 -5.26 -0.08 0.00 -1.01 0.00 0.00 64.21 58.55 2k8p n SER 52 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k8p n GLU 53 N -0.39 -2.89 -2.55 1.43 4.71 -1.26 -4.81 120.64 114.87 2k8p n GLU 53 Ca 0.10 2.31 -0.13 0.00 -0.01 0.00 0.00 57.16 59.44 2k8p n GLU 53 Cb 0.47 -3.40 0.03 0.00 -1.01 0.00 0.00 31.44 27.53 2k8p n GLU 53 CO 0.00 0.00 0.00 2.48 0.09 0.00 0.00 177.13 179.70 2k8p n TYR 54 N -4.08 1.96 -3.60 -0.32 4.11 -1.26 -4.85 117.16 109.12 2k8p n TYR 54 Ca -0.07 -2.56 -0.00 0.00 -0.00 0.00 0.00 57.90 55.27 2k8p n TYR 54 Cb 0.60 -0.27 0.00 0.00 -0.00 0.00 0.00 39.34 39.68 2k8p n TYR 54 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 2k8p n SER 55 N -0.43 -0.25 -4.68 9.48 3.41 -1.26 -4.94 113.62 114.95 2k8p n SER 55 Ca 0.21 -1.12 -0.40 0.00 -0.26 0.00 0.00 58.87 57.31 2k8p n SER 55 Cb 0.81 0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 65.11 2k8p n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p s ARG 57 N 1.57 4.22 -0.35 0.00 3.52 0.06 -4.86 118.95 123.11 2k8p s ARG 57 Ca 0.30 2.41 -0.26 0.00 -0.13 0.00 0.00 55.73 58.05 2k8p s ARG 57 Cb -0.16 -3.06 0.01 0.00 -1.56 0.00 0.00 34.95 30.18 2k8p s ARG 57 CO 0.11 -0.46 0.90 -1.21 -0.81 0.00 0.00 175.30 173.84 2k8p s GLU 58 N -0.85 3.88 -0.08 5.12 8.01 -1.26 -3.32 118.70 130.19 2k8p s GLU 58 Ca 0.58 0.61 -0.08 0.00 0.01 0.00 0.00 54.97 56.09 2k8p s GLU 58 Cb -0.44 -3.78 -0.04 0.00 -4.31 0.00 0.00 34.13 25.56 2k8p s GLU 58 CO 0.49 -0.88 0.21 -1.17 0.01 0.00 0.00 175.26 173.91 2k8p s LEU 59 N 3.36 4.41 0.00 1.80 2.96 -0.94 -4.96 118.68 125.31 2k8p s LEU 59 Ca 0.37 0.58 0.07 0.00 -0.22 0.00 0.00 54.13 54.93 2k8p s LEU 59 Cb -0.12 -2.23 -0.03 0.00 0.50 0.00 0.00 46.19 44.31 2k8p s LEU 59 CO 0.17 0.38 -0.22 -1.00 -1.32 0.00 0.00 176.35 174.35 2k8p s HIS 60 N -1.07 2.44 -0.05 5.38 3.76 -1.26 -0.25 115.29 124.25 2k8p s HIS 60 Ca 0.18 -0.34 -0.02 0.00 -0.15 0.00 0.00 55.06 54.73 2k8p s HIS 60 Cb -0.13 -1.49 0.03 0.00 1.11 0.00 0.00 32.58 32.10 2k8p s HIS 60 CO 0.07 0.10 0.04 -0.06 -0.85 0.00 0.00 174.74 174.04 2k8p s PHE 61 N -0.74 0.22 0.37 1.40 0.08 0.77 -4.97 117.98 115.11 2k8p s PHE 61 Ca 0.12 0.14 -0.02 0.00 0.12 0.00 0.00 56.93 57.29 2k8p s PHE 61 Cb -0.10 -0.55 -0.04 0.00 -0.57 0.00 0.00 43.02 41.76 2k8p s PHE 61 CO 0.01 -0.22 0.60 0.99 -0.10 0.00 0.00 175.22 176.51 2k8p s THR 62 N 2.06 5.05 -0.27 0.64 2.01 -1.26 -1.05 115.64 122.82 2k8p s THR 62 Ca 0.04 -0.24 -0.27 0.00 0.31 0.00 0.00 61.69 61.53 2k8p s THR 62 Cb -0.12 -3.85 0.18 0.00 0.01 0.00 0.00 72.50 68.72 2k8p s THR 62 CO -0.04 -0.60 1.30 -0.60 -0.69 0.00 0.00 174.62 174.00 2k8p s ARG 63 N -4.31 0.18 -0.26 4.92 3.52 -1.09 -4.95 118.95 116.95 2k8p s ARG 63 Ca 0.42 0.11 -0.19 0.00 -0.13 0.00 0.00 55.73 55.94 2k8p s ARG 63 Cb -0.10 0.09 -0.02 0.00 -1.56 0.00 0.00 34.95 33.35 2k8p s ARG 63 CO 0.37 -0.04 0.57 0.71 -0.81 0.00 0.00 175.30 176.10 2k8p s TYR 64 N -0.56 3.27 0.07 5.12 1.51 -1.26 -0.48 117.35 125.03 2k8p s TYR 64 Ca 0.06 0.72 -0.16 0.00 -1.01 0.00 0.00 57.07 56.69 2k8p s TYR 64 Cb -0.03 -2.78 -0.06 0.00 -0.11 0.00 0.00 41.96 38.98 2k8p s TYR 64 CO -0.09 -0.30 0.50 0.54 -1.11 0.00 0.00 175.55 175.09 2k8p s VAL 65 N 2.40 4.89 -0.16 0.71 0.11 -1.26 -5.00 120.40 122.09 2k8p s VAL 65 Ca 0.24 0.92 -0.08 0.00 -2.93 0.00 0.00 61.98 60.12 2k8p s VAL 65 Cb -0.16 -3.77 0.06 0.00 -1.53 0.00 0.00 36.38 30.98 2k8p s VAL 65 CO 0.09 0.45 0.38 0.42 -3.33 0.00 0.00 175.10 173.10 2k8p s THR 66 N -1.23 -0.08 -0.24 5.04 -4.23 -1.26 -1.77 115.64 111.88 2k8p s THR 66 Ca 0.30 0.11 -0.03 0.00 -1.18 0.00 0.00 61.69 60.89 2k8p s THR 66 Cb -0.17 -0.57 0.08 0.00 1.34 0.00 0.00 72.50 73.18 2k8p s THR 66 CO 0.17 0.05 0.08 -0.62 -0.54 0.00 0.00 174.62 173.76 2k8p s ASP 67 N 1.48 3.21 0.00 3.99 2.15 -1.23 -5.03 116.67 121.24 2k8p s ASP 67 Ca -0.09 -1.08 0.00 0.00 0.43 0.00 0.00 52.55 51.81 2k8p s ASP 67 Cb -0.09 -0.53 0.00 0.00 -0.30 0.00 0.00 42.92 42.00 2k8p s ASP 67 CO -0.12 -0.37 0.00 0.61 -0.17 0.00 0.00 175.17 175.12 2k8p n GLY 68 N 5.10 -1.46 0.00 2.66 0.00 -1.26 -4.18 105.19 106.06 2k8p n GLY 68 Ca -0.06 -1.73 0.07 0.00 0.00 0.00 0.00 46.02 44.30 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 0.14 -4.03 1.61 -0.04 -1.26 -4.74 135.00 126.68 2k8p n PRO 69 Ca 0.00 0.18 -0.21 0.00 -0.04 0.00 0.00 63.50 63.43 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 -3.91 0.11 0.31 0.00 3.00 0.58 -3.54 118.95 115.50 2k8p s ARG 71 Ca 0.34 -0.16 -0.29 0.00 0.00 0.00 0.00 55.73 55.62 2k8p s ARG 71 Cb -0.08 -0.01 -0.12 0.00 0.00 0.00 0.00 34.95 34.73 2k8p s ARG 71 CO 0.27 -0.00 1.35 -1.13 0.00 0.00 0.00 175.30 175.79 2k8p n SER 72 N 2.72 2.89 0.18 0.23 3.41 -0.73 0.05 113.62 122.37 2k8p n SER 72 Ca -0.15 1.19 0.06 0.00 -0.26 0.00 0.00 58.87 59.70 2k8p n SER 72 Cb 0.59 -1.48 0.28 0.00 -0.26 0.00 0.00 64.21 63.33 2k8p n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p h ALA 73 N 3.17 0.91 -2.33 7.33 0.00 -1.68 -3.45 119.26 123.21 2k8p h ALA 73 Ca -0.46 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 53.98 2k8p h ALA 73 Cb 1.27 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.86 2k8p h ALA 73 CO 0.67 0.48 -0.59 0.15 0.00 0.00 0.00 179.25 179.96 2k8p s LYS 74 N -3.44 0.71 0.89 0.00 1.02 -1.26 -5.12 119.74 112.54 2k8p s LYS 74 Ca 0.01 -1.18 -0.11 0.00 0.02 0.00 0.00 55.97 54.71 2k8p s LYS 74 Cb 0.10 0.25 0.13 0.00 -0.52 0.00 0.00 37.83 37.79 2k8p s LYS 74 CO 0.69 -0.17 1.09 -1.25 -0.92 0.00 0.00 175.35 174.79 2k8p s PRO 75 N -3.92 1.27 -0.09 -1.68 0.04 -1.26 -4.66 135.00 124.71 2k8p s PRO 75 Ca 0.08 0.83 0.01 0.00 0.04 0.00 0.00 61.00 61.97 2k8p s PRO 75 Cb 0.07 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.78 2k8p s PRO 75 CO -0.09 -2.23 -0.12 0.54 0.04 0.00 0.00 177.00 175.14 2k8p s VAL 76 N -2.93 3.20 -0.29 -0.36 0.11 0.37 -4.91 120.40 115.59 2k8p s VAL 76 Ca 0.63 -0.65 -0.21 0.00 -2.93 0.00 0.00 61.98 58.83 2k8p s VAL 76 Cb -0.18 -2.30 -0.01 0.00 -1.53 0.00 0.00 36.38 32.36 2k8p s VAL 76 CO 0.57 0.56 0.66 -0.89 -3.33 0.00 0.00 175.10 172.68 2k8p s THR 77 N -0.30 4.93 0.06 5.04 2.01 -1.26 -2.68 115.64 123.43 2k8p s THR 77 Ca 0.03 1.03 0.06 0.00 0.31 0.00 0.00 61.69 63.12 2k8p s THR 77 Cb -0.13 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 2k8p s THR 77 CO 0.03 -0.10 -0.12 -0.70 -0.69 0.00 0.00 174.62 173.04 2k8p s GLU 78 N 2.64 2.21 0.19 4.92 2.12 -0.21 -4.96 118.70 125.60 2k8p s GLU 78 Ca 0.27 -0.94 0.06 0.00 0.36 0.00 0.00 54.97 54.72 2k8p s GLU 78 Cb -0.15 -2.31 -0.04 0.00 0.26 0.00 0.00 34.13 31.89 2k8p s GLU 78 CO 0.11 0.54 0.10 -1.17 -0.54 0.00 0.00 175.26 174.30 2k8p s LEU 79 N -1.79 3.63 0.01 2.70 0.20 -1.26 -0.16 118.68 122.01 2k8p s LEU 79 Ca 0.18 -0.26 -0.07 0.00 0.69 0.00 0.00 54.13 54.66 2k8p s LEU 79 Cb -0.11 -2.23 0.00 0.00 -0.43 0.00 0.00 46.19 43.42 2k8p s LEU 79 CO 0.10 0.05 0.14 -0.69 -0.29 0.00 0.00 176.35 175.66 2k8p s VAL 80 N -1.86 0.09 -0.29 1.68 1.01 0.65 -4.62 120.40 117.06 2k8p s VAL 80 Ca 0.30 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.40 2k8p s VAL 80 Cb -0.09 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 2k8p s VAL 80 CO 0.22 -0.42 0.25 0.00 0.00 0.00 0.00 175.10 175.16 2k8p s SER 82 N 1.72 -0.71 0.00 0.00 0.01 -1.21 -4.79 113.70 108.72 2k8p s SER 82 Ca 0.09 1.15 0.00 0.00 1.31 0.00 0.00 55.95 58.50 2k8p s SER 82 Cb -0.16 1.09 0.00 0.00 0.21 0.00 0.00 66.02 67.16 2k8p s SER 82 CO 0.11 -0.39 0.00 0.61 0.41 0.00 0.00 173.24 173.97 2k8p n GLY 83 N 1.97 1.22 3.19 3.44 0.00 -1.26 -0.76 105.19 112.99 2k8p n GLY 83 Ca -0.16 -1.73 -0.24 0.00 0.00 0.00 0.00 46.02 43.89 2k8p n GLY 83 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k8p s GLN 84 N -1.47 1.29 0.32 1.61 -0.21 -1.26 -4.86 119.66 115.08 2k8p s GLN 84 Ca 0.00 -0.77 0.07 0.00 0.02 0.00 0.00 55.36 54.69 2k8p s GLN 84 Cb 0.00 -1.32 -0.03 0.00 1.00 0.00 0.00 33.01 32.66 2k8p s GLN 84 CO 0.00 0.35 0.26 0.00 -2.12 0.00 0.00 175.29 173.78 2k8p n GLY 86 N -1.32 -2.27 3.63 0.00 0.00 -1.26 -4.59 105.19 99.38 2k8p n GLY 86 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 2k8p n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k8p s PRO 87 N -2.71 3.77 -0.41 1.61 0.04 -1.26 -4.84 135.00 131.20 2k8p s PRO 87 Ca 0.00 1.64 0.08 0.00 0.04 0.00 0.00 61.00 62.75 2k8p s PRO 87 Cb 0.00 -4.04 0.35 0.00 0.04 0.00 0.00 34.50 30.84 2k8p s PRO 87 CO 0.00 -1.33 1.28 0.00 0.04 0.00 0.00 177.00 176.99 2k8p n ALA 88 N 8.54 0.32 -2.02 8.56 0.00 -1.26 -5.03 120.51 129.62 2k8p n ALA 88 Ca 0.19 -1.25 -0.25 0.00 0.00 0.00 0.00 53.44 52.13 2k8p n ALA 88 Cb 0.45 -1.10 0.05 0.00 0.00 0.00 0.00 19.45 18.85 2k8p n ALA 88 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k8p s ARG 89 N 0.20 2.57 0.15 0.00 1.81 -1.26 -5.11 118.95 117.31 2k8p s ARG 89 Ca 0.21 -0.25 0.11 0.00 -1.72 0.00 0.00 55.73 54.08 2k8p s ARG 89 Cb 0.34 -2.27 -0.04 0.00 -0.45 0.00 0.00 34.95 32.53 2k8p s ARG 89 CO -0.08 -0.91 -0.25 -0.51 -0.68 0.00 0.00 175.30 172.88 2k8p s LEU 90 N -5.04 2.37 0.27 2.53 2.01 -1.26 -5.15 118.68 114.40 2k8p s LEU 90 Ca 0.57 -0.79 0.09 0.00 0.01 0.00 0.00 54.13 54.00 2k8p s LEU 90 Cb -0.11 -1.13 -0.04 0.00 0.01 0.00 0.00 46.19 44.92 2k8p s LEU 90 CO 0.44 0.13 0.06 -0.76 1.01 0.00 0.00 176.35 177.22 2k8p s LEU 91 N -2.31 3.34 0.17 1.79 1.02 -1.26 -5.05 118.68 116.38 2k8p s LEU 91 Ca 0.16 -0.58 -0.08 0.00 0.02 0.00 0.00 54.13 53.66 2k8p s LEU 91 Cb -0.09 -1.85 0.04 0.00 0.02 0.00 0.00 46.19 44.31 2k8p s LEU 91 CO 0.07 -0.04 1.51 1.55 0.02 0.00 0.00 176.35 179.46 2k8p h PRO 92 N 1.76 0.80 0.00 1.29 0.13 -2.07 -3.38 132.00 130.54 2k8p h PRO 92 Ca -0.45 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.25 2k8p h PRO 92 Cb 1.25 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2k8p h PRO 92 CO 0.61 1.06 0.00 0.09 -0.23 0.00 0.00 178.00 179.53 2k8p n ASN 93 N -4.04 0.00 -2.52 1.44 5.03 -1.26 -5.06 115.26 108.86 2k8p n ASN 93 Ca -0.02 0.26 -0.02 0.00 0.87 0.00 0.00 54.58 55.67 2k8p n ASN 93 Cb 0.54 -0.27 0.00 0.00 -1.02 0.00 0.00 39.78 39.04 2k8p n ASN 93 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k8p n ALA 94 N -1.34 -3.28 -2.26 5.41 0.00 -1.26 -5.08 120.51 112.70 2k8p n ALA 94 Ca 0.00 0.58 -0.14 0.00 0.00 0.00 0.00 53.44 53.88 2k8p n ALA 94 Cb 0.00 -1.54 -0.10 0.00 0.00 0.00 0.00 19.45 17.80 2k8p n ALA 94 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2k8p s ILE 95 N -1.64 0.35 0.18 0.00 -0.00 -1.26 -5.09 121.20 113.74 2k8p s ILE 95 Ca 0.07 -1.99 0.00 0.00 -0.00 0.00 0.00 60.65 58.72 2k8p s ILE 95 Cb -0.02 -2.52 0.00 0.00 -0.00 0.00 0.00 42.46 39.93 2k8p s ILE 95 CO 0.63 -0.06 0.00 0.61 -0.00 0.00 0.00 174.94 176.12 2k8p n GLY 96 N -0.36 -0.98 2.91 6.27 0.00 -1.26 -4.93 105.19 106.85 2k8p n GLY 96 Ca -0.00 0.19 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.95 -2.33 0.00 1.61 0.63 -1.26 -4.75 116.66 107.61 2k8p n ARG 97 Ca 0.00 2.05 0.00 0.00 -0.92 0.00 0.00 57.85 58.98 2k8p n ARG 97 Cb 0.00 -5.38 0.00 0.00 0.45 0.00 0.00 32.46 27.53 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 -0.32 0.43 3.00 5.14 0.00 -1.26 -5.11 105.19 107.06 2k8p n GLY 98 Ca 0.10 0.03 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 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 0.47 -0.26 1.61 3.01 -1.26 -4.97 119.74 118.34 2k8p s LYS 99 Ca 0.00 -0.39 -0.09 0.00 -1.01 0.00 0.00 55.97 54.48 2k8p s LYS 99 Cb 0.00 -0.38 0.01 0.00 -1.01 0.00 0.00 37.83 36.45 2k8p s LYS 99 CO 0.00 0.09 0.22 0.91 0.51 0.00 0.00 175.35 177.08 2k8p n TRP 100 N 2.43 -2.48 0.01 3.18 8.01 -1.26 -4.92 117.44 122.41 2k8p n TRP 100 Ca -0.16 1.06 -0.12 0.00 -1.31 0.00 0.00 57.50 56.98 2k8p n TRP 100 Cb 0.57 -2.75 -0.09 0.00 -2.01 0.00 0.00 31.31 27.03 2k8p n TRP 100 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 177.69 179.03 2k8p h TRP 101 N 2.88 -0.11 -3.74 -5.99 7.01 -1.93 -3.45 115.95 110.62 2k8p h TRP 101 Ca -0.09 -0.00 -0.49 0.00 2.11 0.00 0.00 58.89 60.41 2k8p h TRP 101 Cb 0.72 0.04 0.04 0.00 -2.10 0.00 0.00 29.16 27.86 2k8p h TRP 101 CO 0.02 0.42 0.18 1.03 -2.79 0.00 0.00 178.44 177.30 2k8p s ARG 102 N -3.37 3.49 0.44 2.65 0.52 -1.26 -4.72 118.95 116.71 2k8p s ARG 102 Ca -0.14 0.29 0.23 0.00 -0.52 0.00 0.00 55.73 55.59 2k8p s ARG 102 Cb 0.00 -2.31 1.00 0.00 0.52 0.00 0.00 34.95 34.16 2k8p s ARG 102 CO 0.55 -0.33 1.87 -1.00 0.02 0.00 0.00 175.30 176.41 2k8p h PRO 103 N 0.07 0.00 -5.85 3.54 0.13 -2.00 -3.45 132.00 124.45 2k8p h PRO 103 Ca -0.46 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.08 2k8p h PRO 103 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 2k8p h PRO 103 CO 0.62 0.24 -0.33 -1.54 -0.23 0.00 0.00 178.00 176.75 2k8p s SER 104 N -6.27 4.58 0.00 1.44 1.04 -1.26 -4.98 113.70 108.24 2k8p s SER 104 Ca -0.01 -1.28 0.00 0.00 0.48 0.00 0.00 55.95 55.15 2k8p s SER 104 Cb 0.11 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2k8p s SER 104 CO 0.64 -1.05 0.00 0.61 0.98 0.00 0.00 173.24 174.42 2k8p n GLY 105 N -1.69 -0.59 3.56 7.32 0.00 -1.25 -4.95 105.19 107.59 2k8p n GLY 105 Ca -0.04 0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.92 2k8p n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k8p s PRO 106 N 0.00 2.79 0.00 1.61 0.04 -1.26 -4.39 135.00 133.80 2k8p s PRO 106 Ca 0.00 0.76 0.00 0.00 0.04 0.00 0.00 61.00 61.80 2k8p s PRO 106 Cb 0.00 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.20 2k8p s PRO 106 CO 0.00 -2.53 0.00 -0.25 0.04 0.00 0.00 177.00 174.26 2k8p n ASP 107 N 12.14 0.00 0.11 6.66 8.00 -1.26 -3.63 116.55 138.56 2k8p n ASP 107 Ca 0.21 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.71 2k8p n ASP 107 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 2k8p n ASP 107 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2k8p n PHE 108 N 0.00 -3.25 -2.20 1.24 -0.00 -1.26 -5.00 117.46 106.99 2k8p n PHE 108 Ca 0.00 0.73 -0.01 0.00 -0.00 0.00 0.00 57.45 58.17 2k8p n PHE 108 Cb 0.00 2.05 -0.02 0.00 -0.00 0.00 0.00 39.48 41.51 2k8p n PHE 108 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2k8p n ARG 109 N -2.89 0.00 -3.77 -4.13 3.00 -1.25 -3.96 116.66 103.65 2k8p n ARG 109 Ca 0.00 -1.27 -0.13 0.00 -0.00 0.00 0.00 57.85 56.45 2k8p n ARG 109 Cb 0.00 0.12 -0.12 0.00 0.00 0.00 0.00 32.46 32.46 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 0.44 4.52 1.20 0.00 -4.36 -0.71 -4.48 121.20 117.81 2k8p s ILE 111 Ca -0.03 1.24 -0.19 0.00 -0.26 0.00 0.00 60.65 61.41 2k8p s ILE 111 Cb -0.04 -3.64 0.29 0.00 1.25 0.00 0.00 42.46 40.32 2k8p s ILE 111 CO -0.02 -0.38 1.11 -2.16 0.24 0.00 0.00 174.94 173.73 2k8p s PRO 112 N -3.36 -1.22 0.03 0.37 0.04 -1.26 -1.57 135.00 128.03 2k8p s PRO 112 Ca 0.59 -0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.56 2k8p s PRO 112 Cb -0.10 -1.60 -0.00 0.00 0.04 0.00 0.00 34.50 32.85 2k8p s PRO 112 CO 0.19 -3.71 0.04 -3.47 0.04 0.00 0.00 177.00 170.09 2k8p n ASP 113 N -4.76 -0.10 -4.56 6.66 -0.08 -1.23 -4.15 116.55 108.33 2k8p n ASP 113 Ca 0.13 -1.16 -0.42 0.00 -1.51 0.00 0.00 54.79 51.83 2k8p n ASP 113 Cb 0.59 0.19 0.00 0.00 2.34 0.00 0.00 41.12 44.25 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 -0.05 1.12 -3.41 -0.67 0.63 -1.26 -4.63 116.66 108.39 2k8p n ARG 114 Ca 0.00 0.40 -0.21 0.00 -0.92 0.00 0.00 57.85 57.12 2k8p n ARG 114 Cb 0.05 -1.85 0.01 0.00 0.45 0.00 0.00 32.46 31.12 2k8p n ARG 114 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2k8p s TYR 115 N -1.27 1.99 -0.15 -0.14 1.51 -1.26 -1.26 117.35 116.77 2k8p s TYR 115 Ca 0.62 -0.65 -0.04 0.00 -1.01 0.00 0.00 57.07 55.99 2k8p s TYR 115 Cb -0.61 -2.14 0.07 0.00 -0.11 0.00 0.00 41.96 39.18 2k8p s TYR 115 CO 0.58 -0.60 0.22 0.50 -1.11 0.00 0.00 175.55 175.13 2k8p s ARG 116 N -4.38 0.13 -0.24 -0.62 3.52 0.80 -4.53 118.95 113.64 2k8p s ARG 116 Ca 0.50 0.46 -0.18 0.00 -0.13 0.00 0.00 55.73 56.38 2k8p s ARG 116 Cb -0.05 -0.62 -0.03 0.00 -1.56 0.00 0.00 34.95 32.69 2k8p s ARG 116 CO 0.30 -0.46 0.49 0.00 -0.81 0.00 0.00 175.30 174.83 2k8p s ALA 117 N 2.34 3.57 0.09 6.12 0.00 -1.26 -1.88 121.76 130.75 2k8p s ALA 117 Ca 0.04 -0.56 0.09 0.00 0.00 0.00 0.00 51.96 51.52 2k8p s ALA 117 Cb -0.14 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 2k8p s ALA 117 CO -0.09 -0.61 -0.19 -1.14 0.00 0.00 0.00 175.76 173.73 2k8p s GLN 118 N 2.01 1.84 -0.27 0.00 0.74 -0.07 -4.90 119.66 119.01 2k8p s GLN 118 Ca 0.21 -1.13 -0.11 0.00 0.05 0.00 0.00 55.36 54.38 2k8p s GLN 118 Cb -0.15 -2.12 -0.05 0.00 1.10 0.00 0.00 33.01 31.79 2k8p s GLN 118 CO 0.09 0.50 0.18 1.03 -0.55 0.00 0.00 175.29 176.54 2k8p s ARG 119 N -1.89 3.98 0.05 1.67 0.52 -1.26 -0.12 118.95 121.90 2k8p s ARG 119 Ca 0.16 -0.31 -0.04 0.00 -0.52 0.00 0.00 55.73 55.02 2k8p s ARG 119 Cb -0.10 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.70 2k8p s ARG 119 CO 0.08 -0.11 0.28 0.54 0.02 0.00 0.00 175.30 176.11 2k8p s VAL 120 N 1.56 5.30 -0.30 3.52 0.11 0.62 -4.89 120.40 126.31 2k8p s VAL 120 Ca 0.07 -0.02 -0.08 0.00 -2.93 0.00 0.00 61.98 59.02 2k8p s VAL 120 Cb -0.15 -3.59 0.00 0.00 -1.53 0.00 0.00 36.38 31.11 2k8p s VAL 120 CO 0.09 0.22 0.10 -1.58 -3.33 0.00 0.00 175.10 170.61 2k8p s GLN 121 N -2.18 3.18 -0.18 1.54 0.74 -1.26 -0.79 119.66 120.71 2k8p s GLN 121 Ca 0.33 -0.81 -0.09 0.00 0.05 0.00 0.00 55.36 54.84 2k8p s GLN 121 Cb -0.13 -3.43 -0.05 0.00 1.10 0.00 0.00 33.01 30.50 2k8p s GLN 121 CO 0.21 -0.43 0.14 -0.51 -0.55 0.00 0.00 175.29 174.15 2k8p s LEU 122 N 1.54 4.26 0.02 3.68 1.43 -0.91 -1.75 118.68 126.95 2k8p s LEU 122 Ca 0.03 0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 53.37 2k8p s LEU 122 Cb -0.17 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.90 2k8p s LEU 122 CO 0.04 0.23 0.29 -0.76 0.23 0.00 0.00 176.35 176.38 2k8p s LEU 123 N 0.03 4.36 0.18 1.79 2.01 0.11 -0.10 118.68 127.05 2k8p s LEU 123 Ca 0.10 0.58 0.09 0.00 0.01 0.00 0.00 54.13 54.92 2k8p s LEU 123 Cb -0.11 -2.74 -0.04 0.00 0.01 0.00 0.00 46.19 43.30 2k8p s LEU 123 CO -0.00 0.23 -0.12 0.00 1.01 0.00 0.00 176.35 177.47 2k8p n PRO 125 N 0.14 -1.22 0.00 0.00 -0.04 -1.26 -4.64 135.00 127.98 2k8p n PRO 125 Ca -0.11 -0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.19 2k8p n PRO 125 Cb 0.55 -0.14 0.00 0.00 -0.04 0.00 0.00 33.50 33.87 2k8p n PRO 125 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k8p n GLY 126 N 1.79 3.68 0.23 0.55 0.00 -1.26 -3.16 105.19 107.02 2k8p n GLY 126 Ca 0.01 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 3.01 3.76 -0.02 0.00 -1.26 -5.08 105.19 105.60 2k8p n GLY 127 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.68 -0.52 0.25 1.61 8.01 -1.19 -5.08 118.70 120.12 2k8p s GLU 128 Ca 0.18 -0.32 0.06 0.00 0.01 0.00 0.00 54.97 54.90 2k8p s GLU 128 Cb 0.16 -1.70 -0.03 0.00 -4.31 0.00 0.00 34.13 28.24 2k8p s GLU 128 CO 0.02 -3.20 0.25 0.00 0.01 0.00 0.00 175.26 172.34 2k8p s ALA 129 N -3.48 3.71 1.13 5.21 0.00 -1.26 -4.80 121.76 122.27 2k8p s ALA 129 Ca 0.74 -1.38 -0.16 0.00 0.00 0.00 0.00 51.96 51.15 2k8p s ALA 129 Cb -0.05 -1.42 0.25 0.00 0.00 0.00 0.00 23.12 21.89 2k8p s ALA 129 CO 0.55 0.23 1.10 -1.25 0.00 0.00 0.00 175.76 176.39 2k8p s PRO 130 N -3.90 -0.60 0.45 0.00 0.04 -1.26 -4.47 135.00 125.26 2k8p s PRO 130 Ca 0.34 0.15 0.03 0.00 0.04 0.00 0.00 61.00 61.56 2k8p s PRO 130 Cb -0.08 -1.65 -0.01 0.00 0.04 0.00 0.00 34.50 32.80 2k8p s PRO 130 CO 0.26 -3.34 0.11 0.50 0.04 0.00 0.00 177.00 174.57 2k8p s ARG 131 N -5.23 2.05 -0.11 4.56 6.06 0.86 -4.94 118.95 122.20 2k8p s ARG 131 Ca 0.69 -2.29 -0.01 0.00 -2.50 0.00 0.00 55.73 51.62 2k8p s ARG 131 Cb -0.13 -0.79 0.04 0.00 0.06 0.00 0.00 34.95 34.12 2k8p s ARG 131 CO 0.57 -0.51 -0.01 0.00 -2.50 0.00 0.00 175.30 172.85 2k8p s ALA 132 N -3.10 0.92 -0.20 6.12 0.00 -1.26 -2.14 121.76 122.09 2k8p s ALA 132 Ca 0.17 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.77 2k8p s ALA 132 Cb 0.01 -0.89 0.02 0.00 0.00 0.00 0.00 23.12 22.26 2k8p s ALA 132 CO 0.12 -0.63 -0.17 1.03 0.00 0.00 0.00 175.76 176.10 2k8p s ARG 133 N 1.88 2.94 0.11 0.00 1.81 0.03 -4.92 118.95 120.81 2k8p s ARG 133 Ca 0.03 -0.87 -0.28 0.00 -1.72 0.00 0.00 55.73 52.89 2k8p s ARG 133 Cb -0.14 -2.66 -0.06 0.00 -0.45 0.00 0.00 34.95 31.64 2k8p s ARG 133 CO -0.06 -0.26 0.88 0.21 -0.68 0.00 0.00 175.30 175.39 2k8p s LYS 134 N 1.29 4.64 -0.08 3.54 2.20 -1.26 -0.28 119.74 129.79 2k8p s LYS 134 Ca 0.03 1.31 0.01 0.00 -0.36 0.00 0.00 55.97 56.96 2k8p s LYS 134 Cb -0.14 -3.35 0.02 0.00 -1.51 0.00 0.00 37.83 32.85 2k8p s LYS 134 CO -0.11 0.31 -0.08 0.14 -0.36 0.00 0.00 175.35 175.24 2k8p s VAL 135 N -0.27 0.95 -0.52 4.02 -7.23 0.83 -4.96 120.40 113.22 2k8p s VAL 135 Ca 0.43 -0.30 -0.19 0.00 -1.81 0.00 0.00 61.98 60.10 2k8p s VAL 135 Cb -0.23 -0.94 0.06 0.00 0.56 0.00 0.00 36.38 35.83 2k8p s VAL 135 CO 0.28 0.34 0.64 -0.60 -0.31 0.00 0.00 175.10 175.44 2k8p s ARG 136 N 1.26 3.11 0.10 4.82 6.06 -1.26 -0.89 118.95 132.15 2k8p s ARG 136 Ca -0.04 -0.94 0.09 0.00 -2.50 0.00 0.00 55.73 52.35 2k8p s ARG 136 Cb -0.14 -4.12 -0.04 0.00 0.06 0.00 0.00 34.95 30.72 2k8p s ARG 136 CO -0.03 -1.26 -0.22 -0.51 -2.50 0.00 0.00 175.30 170.78 2k8p s LEU 137 N 2.64 2.49 0.32 -0.88 1.02 -0.79 -4.94 118.68 118.55 2k8p s LEU 137 Ca 0.15 -0.61 -0.27 0.00 0.02 0.00 0.00 54.13 53.41 2k8p s LEU 137 Cb -0.20 -1.40 -0.13 0.00 0.02 0.00 0.00 46.19 44.48 2k8p s LEU 137 CO 0.11 0.20 1.07 0.52 0.02 0.00 0.00 176.35 178.27 2k8p n VAL 138 N 1.06 2.05 -0.06 -1.59 0.31 -1.26 -0.14 118.33 118.70 2k8p n VAL 138 Ca -0.17 -0.50 -0.07 0.00 -0.01 0.00 0.00 64.34 63.60 2k8p n VAL 138 Cb 0.53 -1.15 -0.09 0.00 -0.91 0.00 0.00 33.84 32.22 2k8p n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k8p n ALA 139 N 0.14 1.71 -4.22 3.52 0.00 -0.42 -4.18 120.51 117.07 2k8p n ALA 139 Ca 0.08 -0.73 -0.21 0.00 0.00 0.00 0.00 53.44 52.58 2k8p n ALA 139 Cb 0.34 0.04 -0.07 0.00 0.00 0.00 0.00 19.45 19.76 2k8p n ALA 139 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2k8p n SER 140 N -2.55 -0.85 -3.64 0.00 3.41 -0.39 -4.99 113.62 104.61 2k8p n SER 140 Ca -0.21 -3.14 -0.14 0.00 -0.26 0.00 0.00 58.87 55.13 2k8p n SER 140 Cb 0.85 1.86 -0.07 0.00 -0.26 0.00 0.00 64.21 66.59 2k8p n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p s LYS 142 N 0.31 1.67 -0.22 0.00 1.02 -0.61 -4.86 119.74 117.06 2k8p s LYS 142 Ca -0.00 -1.61 -0.09 0.00 0.02 0.00 0.00 55.97 54.28 2k8p s LYS 142 Cb -0.05 -1.85 -0.04 0.00 -0.52 0.00 0.00 37.83 35.37 2k8p s LYS 142 CO 0.01 0.37 0.12 0.00 -0.92 0.00 0.00 175.35 174.93 2k8p n LYS 144 N 4.18 0.60 -3.27 0.00 0.00 -1.25 -4.80 118.16 113.62 2k8p n LYS 144 Ca -0.16 0.11 -0.06 0.00 0.00 0.00 0.00 58.31 58.20 2k8p n LYS 144 Cb 0.52 -2.24 -0.04 0.00 0.00 0.00 0.00 35.03 33.26 2k8p n LYS 144 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 2k8p s ARG 145 N 7.42 0.51 -0.00 1.64 3.00 -1.26 -5.01 118.95 125.25 2k8p s ARG 145 Ca 1.17 0.06 -0.27 0.00 -1.00 0.00 0.00 55.73 55.69 2k8p s ARG 145 Cb -0.93 -0.19 0.06 0.00 0.00 0.00 0.00 34.95 33.89 2k8p s ARG 145 CO 0.47 -1.07 0.61 -1.17 0.00 0.00 0.00 175.30 174.13 2k8p s LEU 146 N 2.41 -0.42 0.28 -0.88 2.96 -1.26 -5.14 118.68 116.63 2k8p s LEU 146 Ca 0.11 0.47 -0.29 0.00 -0.22 0.00 0.00 54.13 54.21 2k8p s LEU 146 Cb -0.11 2.37 -0.14 0.00 0.50 0.00 0.00 46.19 48.81 2k8p s LEU 146 CO -0.24 -0.66 1.15 0.35 -1.32 0.00 0.00 176.35 175.63 2k8p n THR 147 N 0.68 1.71 -3.71 3.68 -2.24 -1.26 -5.00 114.28 108.14 2k8p n THR 147 Ca -0.19 -0.43 -0.13 0.00 -2.27 0.00 0.00 64.05 61.04 2k8p n THR 147 Cb 0.59 -1.18 -0.10 0.00 -2.10 0.00 0.00 70.33 67.54 2k8p n THR 147 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k8p s ARG 148 N -1.32 0.51 -0.22 -0.78 1.70 -1.26 -5.17 118.95 112.42 2k8p s ARG 148 Ca 0.61 0.68 -0.30 0.00 -0.47 0.00 0.00 55.73 56.25 2k8p s ARG 148 Cb -0.68 0.20 0.16 0.00 -0.57 0.00 0.00 34.95 34.06 2k8p s ARG 148 CO 0.58 -0.08 1.20 -0.59 -1.08 0.00 0.00 175.30 175.32 2k8p s PHE 149 N 0.51 -0.17 0.29 5.89 -0.71 -1.26 -5.19 117.98 117.34 2k8p s PHE 149 Ca -0.02 0.27 0.01 0.00 -1.04 0.00 0.00 56.93 56.14 2k8p s PHE 149 Cb -0.04 0.48 -0.02 0.00 -1.21 0.00 0.00 43.02 42.23 2k8p s PHE 149 CO -0.03 -0.18 0.31 -1.01 -1.34 0.00 0.00 175.22 172.98 2k8p s HIS 150 N -1.32 1.28 -0.30 3.49 3.76 -1.26 -5.13 115.29 115.81 2k8p s HIS 150 Ca 0.05 -1.40 -0.09 0.00 -0.15 0.00 0.00 55.06 53.47 2k8p s HIS 150 Cb -0.01 -0.41 0.19 0.00 1.11 0.00 0.00 32.58 33.46 2k8p s HIS 150 CO -0.04 -0.90 0.99 0.54 -0.85 0.00 0.00 174.74 174.48 2k8p s ASN 151 N -3.25 -0.56 0.20 1.40 2.20 -1.26 -5.07 114.94 108.60 2k8p s ASN 151 Ca 0.36 0.06 0.00 0.00 -0.94 0.00 0.00 52.86 52.34 2k8p s ASN 151 Cb 0.02 1.35 0.00 0.00 -2.00 0.00 0.00 41.25 40.63 2k8p s ASN 151 CO 0.20 -0.10 0.00 0.00 -2.94 0.00 0.00 177.10 174.26 2k8p n GLN 152 N 5.14 0.00 -0.15 3.55 1.13 -1.26 -5.15 117.38 120.64 2k8p n GLN 152 Ca 0.09 0.00 0.02 0.00 -1.94 0.00 0.00 57.00 55.17 2k8p n GLN 152 Cb 0.57 -0.19 -0.01 0.00 0.11 0.00 0.00 30.24 30.73 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 -3.40 -5.65 -3.64 1.08 7.64 -1.26 -4.96 113.62 103.43 2k8p n SER 153 Ca 0.00 0.16 -0.14 0.00 1.01 0.00 0.00 58.87 59.90 2k8p n SER 153 Cb 0.00 -0.46 -0.07 0.00 -1.01 0.00 0.00 64.21 62.67 2k8p n SER 153 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2k8p s GLU 154 N -0.25 0.81 0.04 1.43 2.02 -1.26 -5.17 118.70 116.33 2k8p s GLU 154 Ca 0.00 0.95 0.04 0.00 0.02 0.00 0.00 54.97 55.99 2k8p s GLU 154 Cb 0.00 0.40 -0.04 0.00 0.10 0.00 0.00 34.13 34.59 2k8p s GLU 154 CO 0.00 -0.10 -0.07 -0.48 0.02 0.00 0.00 175.26 174.63 2k8p s LEU 155 N 0.34 3.16 0.22 1.80 2.34 -1.26 -5.13 118.68 120.14 2k8p s LEU 155 Ca -0.00 -0.21 0.09 0.00 0.06 0.00 0.00 54.13 54.07 2k8p s LEU 155 Cb -0.05 -1.86 -0.05 0.00 -0.56 0.00 0.00 46.19 43.68 2k8p s LEU 155 CO 0.01 0.24 -0.17 -0.54 -1.06 0.00 0.00 176.35 174.83 2k8p s LYS 156 N -1.71 1.43 -0.30 1.48 1.02 -1.26 -5.14 119.74 115.26 2k8p s LYS 156 Ca 0.19 -1.60 -0.15 0.00 0.02 0.00 0.00 55.97 54.43 2k8p s LYS 156 Cb -0.11 -1.38 0.17 0.00 -0.52 0.00 0.00 37.83 35.99 2k8p s LYS 156 CO 0.10 0.25 1.02 0.34 -0.92 0.00 0.00 175.35 176.14 2k8p s ASP 157 N -3.21 -0.53 -0.22 2.83 2.15 -1.26 -5.16 116.67 111.27 2k8p s ASP 157 Ca 0.23 0.68 -0.09 0.00 0.43 0.00 0.00 52.55 53.79 2k8p s ASP 157 Cb -0.03 1.58 0.09 0.00 -0.30 0.00 0.00 42.92 44.26 2k8p s ASP 157 CO 0.09 -0.10 0.50 -0.36 -0.17 0.00 0.00 175.17 175.13 2k8p s PHE 158 N 2.46 -0.88 -0.28 -5.34 0.08 -1.26 -5.16 117.98 107.61 2k8p s PHE 158 Ca -0.02 1.69 -0.23 0.00 0.12 0.00 0.00 56.93 58.49 2k8p s PHE 158 Cb -0.06 0.43 0.13 0.00 -0.57 0.00 0.00 43.02 42.95 2k8p s PHE 158 CO -0.17 -0.48 1.03 0.20 -0.10 0.00 0.00 175.22 175.70 2k8p s GLY 159 N 2.17 -0.11 -0.28 4.36 0.00 -1.26 -5.17 107.32 107.03 2k8p s GLY 159 Ca -0.06 2.79 -0.26 0.00 0.00 0.00 0.00 44.72 47.19 2k8p s GLY 159 CO -0.15 1.98 1.28 -1.08 0.00 0.00 0.00 173.10 175.13 2k8p s THR 160 N 0.44 0.00 0.13 0.90 -1.32 -1.26 -5.19 115.64 109.35 2k8p s THR 160 Ca 0.01 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.38 2k8p s THR 160 Cb -0.05 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 69.95 2k8p s THR 160 CO -0.08 0.00 0.29 -1.83 -2.21 0.00 0.00 174.62 170.79 2k8p s GLU 161 N -0.18 1.03 -0.01 7.08 -1.05 -1.26 -5.18 118.70 119.14 2k8p s GLU 161 Ca 0.06 -0.97 -0.16 0.00 -0.15 0.00 0.00 54.97 53.74 2k8p s GLU 161 Cb -0.04 0.39 0.03 0.00 -0.44 0.00 0.00 34.13 34.07 2k8p s GLU 161 CO -0.10 -0.37 0.34 0.00 0.95 0.00 0.00 175.26 176.08 2k8p s ALA 162 N -3.89 -0.86 0.06 -0.84 0.00 -1.26 -5.18 121.76 109.79 2k8p s ALA 162 Ca 0.09 0.36 0.01 0.00 0.00 0.00 0.00 51.96 52.42 2k8p s ALA 162 Cb 0.03 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 2k8p s ALA 162 CO -0.07 -0.30 -0.05 0.00 0.00 0.00 0.00 175.76 175.34 2k8p s ALA 163 N -1.54 0.58 0.46 0.00 0.00 -1.26 -5.16 121.76 114.83 2k8p s ALA 163 Ca -0.12 -1.01 -0.04 0.00 0.00 0.00 0.00 51.96 50.80 2k8p s ALA 163 Cb -0.04 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 2k8p s ALA 163 CO 0.03 -0.19 0.73 1.03 0.00 0.00 0.00 175.76 177.36 2k8p s ARG 164 N -2.77 3.45 1.06 0.00 0.52 -1.26 -5.09 118.95 114.87 2k8p s ARG 164 Ca -0.01 0.02 -0.14 0.00 -0.52 0.00 0.00 55.73 55.08 2k8p s ARG 164 Cb -0.01 -2.45 0.22 0.00 0.52 0.00 0.00 34.95 33.23 2k8p s ARG 164 CO -0.04 -0.16 1.10 -1.25 0.02 0.00 0.00 175.30 174.97 2k8p s PRO 165 N -4.65 -0.09 0.39 3.54 0.04 -1.26 -5.08 135.00 127.89 2k8p s PRO 165 Ca 0.46 0.35 0.08 0.00 0.04 0.00 0.00 61.00 61.93 2k8p s PRO 165 Cb -0.10 -1.69 -0.06 0.00 0.04 0.00 0.00 34.50 32.69 2k8p s PRO 165 CO 0.42 -3.04 0.08 -0.65 0.04 0.00 0.00 177.00 173.85 2k8p s GLN 166 N -5.07 2.10 0.23 4.56 -0.21 -1.26 -5.16 119.66 114.85 2k8p s GLN 166 Ca 0.67 -1.90 -0.13 0.00 0.02 0.00 0.00 55.36 54.02 2k8p s GLN 166 Cb -0.17 -1.86 -0.00 0.00 1.00 0.00 0.00 33.01 31.98 2k8p s GLN 166 CO 0.57 -0.02 0.46 0.21 -2.12 0.00 0.00 175.29 174.39 2k8p s LYS 167 N -3.79 1.47 -0.29 2.91 2.20 -1.26 -5.17 119.74 115.81 2k8p s LYS 167 Ca 0.37 -1.18 -0.15 0.00 -0.36 0.00 0.00 55.97 54.65 2k8p s LYS 167 Cb 0.05 0.47 0.12 0.00 -1.51 0.00 0.00 37.83 36.95 2k8p s LYS 167 CO 0.20 -0.61 0.83 0.20 -0.36 0.00 0.00 175.35 175.62 2k8p s GLY 168 N -2.99 -0.34 0.07 5.54 0.00 -1.26 -5.17 107.32 103.17 2k8p s GLY 168 Ca 0.20 2.78 0.01 0.00 0.00 0.00 0.00 44.72 47.71 2k8p s GLY 168 CO 0.06 2.67 0.17 0.50 0.00 0.00 0.00 173.10 176.50 2k8p s ARG 169 N 1.79 3.25 -0.48 2.90 0.52 -1.26 -5.07 118.95 120.60 2k8p s ARG 169 Ca -0.08 -0.54 0.07 0.00 -0.52 0.00 0.00 55.73 54.66 2k8p s ARG 169 Cb -0.05 -2.93 0.23 0.00 0.52 0.00 0.00 34.95 32.72 2k8p s ARG 169 CO -0.18 0.59 0.54 1.63 0.02 0.00 0.00 175.30 177.90 2k8p n LYS 170 N 0.29 1.16 -1.09 3.54 4.76 -1.26 -5.12 118.16 120.44 2k8p n LYS 170 Ca -0.06 -3.68 -0.30 0.00 -2.87 0.00 0.00 58.31 51.39 2k8p n LYS 170 Cb 0.51 -1.65 0.24 0.00 -1.84 0.00 0.00 35.03 32.29 2k8p n LYS 170 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2k8p s PRO 171 N -1.30 -1.11 -0.06 1.97 0.04 -1.26 -5.10 135.00 128.19 2k8p s PRO 171 Ca 0.35 -0.03 -0.31 0.00 0.04 0.00 0.00 61.00 61.05 2k8p s PRO 171 Cb 0.12 -1.61 0.11 0.00 0.04 0.00 0.00 34.50 33.17 2k8p s PRO 171 CO -0.11 -3.65 1.00 1.03 0.04 0.00 0.00 177.00 175.31 2k8p s ARG 172 N -5.37 0.67 0.76 4.56 0.52 -1.26 -5.17 118.95 113.66 2k8p s ARG 172 Ca 0.71 -0.25 -0.11 0.00 -0.52 0.00 0.00 55.73 55.55 2k8p s ARG 172 Cb -0.10 0.30 0.05 0.00 0.52 0.00 0.00 34.95 35.72 2k8p s ARG 172 CO 0.56 -0.29 1.09 -1.25 0.02 0.00 0.00 175.30 175.43 2k8p s PRO 173 N -2.90 2.30 0.69 3.54 0.04 -1.26 -4.98 135.00 132.43 2k8p s PRO 173 Ca 0.07 1.19 -0.16 0.00 0.04 0.00 0.00 61.00 62.13 2k8p s PRO 173 Cb -0.01 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 2k8p s PRO 173 CO -0.07 -1.62 0.87 2.89 0.04 0.00 0.00 177.00 179.11 2k8p n ARG 174 N -3.44 0.54 -1.58 4.56 1.85 -1.26 -4.98 116.66 112.36 2k8p n ARG 174 Ca 0.09 0.23 -0.29 0.00 -1.00 0.00 0.00 57.85 56.88 2k8p n ARG 174 Cb 0.53 -2.12 0.11 0.00 -1.05 0.00 0.00 32.46 29.92 2k8p n ARG 174 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2k8p s ALA 175 N -1.77 2.09 0.73 2.89 0.00 -1.26 -5.07 121.76 119.37 2k8p s ALA 175 Ca 0.72 -0.38 -0.06 0.00 0.00 0.00 0.00 51.96 52.25 2k8p s ALA 175 Cb -0.36 -3.06 0.09 0.00 0.00 0.00 0.00 23.12 19.79 2k8p s ALA 175 CO 0.51 -1.95 1.03 1.03 0.00 0.00 0.00 175.76 176.38 2k8p s ARG 176 N -5.24 1.87 0.32 0.00 0.52 -1.26 -5.12 118.95 110.04 2k8p s ARG 176 Ca 0.62 -0.54 0.06 0.00 -0.52 0.00 0.00 55.73 55.35 2k8p s ARG 176 Cb -0.14 -2.19 -0.03 0.00 0.52 0.00 0.00 34.95 33.11 2k8p s ARG 176 CO 0.53 -1.41 0.28 -1.12 0.02 0.00 0.00 175.30 173.60 2k8p s SER 177 N -4.62 1.55 0.22 0.23 0.01 -1.26 -5.18 113.70 104.64 2k8p s SER 177 Ca 0.63 -1.72 0.00 0.00 1.31 0.00 0.00 55.95 56.17 2k8p s SER 177 Cb -0.08 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.70 2k8p s SER 177 CO 0.45 -1.06 0.03 0.00 0.41 0.00 0.00 173.24 173.06 2k8p n ALA 178 N -0.60 0.21 -2.74 1.44 0.00 -1.26 -5.12 120.51 112.44 2k8p n ALA 178 Ca 0.07 -0.97 -0.37 0.00 0.00 0.00 0.00 53.44 52.17 2k8p n ALA 178 Cb 0.62 0.51 -0.11 0.00 0.00 0.00 0.00 19.45 20.47 2k8p n ALA 178 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2k8p s LYS 179 N -2.81 3.87 0.15 0.00 2.47 -1.26 -5.06 119.74 117.11 2k8p s LYS 179 Ca 0.02 -0.36 -0.31 0.00 -1.56 0.00 0.00 55.97 53.75 2k8p s LYS 179 Cb -0.00 -3.54 -0.09 0.00 -1.46 0.00 0.00 37.83 32.74 2k8p s LYS 179 CO 0.01 -0.15 1.52 0.00 0.16 0.00 0.00 175.35 176.89 2k8p s ALA 180 N 1.62 3.72 -0.60 3.13 0.00 -1.26 -4.93 121.76 123.44 2k8p s ALA 180 Ca 0.07 1.29 0.03 0.00 0.00 0.00 0.00 51.96 53.35 2k8p s ALA 180 Cb -0.15 -3.60 0.38 0.00 0.00 0.00 0.00 23.12 19.75 2k8p s ALA 180 CO 0.08 -0.75 1.36 -1.71 0.00 0.00 0.00 175.76 174.75 2k8p n ASN 181 N 4.03 5.56 -4.73 0.00 5.15 -1.26 -5.03 115.26 118.98 2k8p n ASN 181 Ca 0.13 -3.74 -0.28 0.00 -0.60 0.00 0.00 54.58 50.09 2k8p n ASN 181 Cb 0.40 -0.68 -0.07 0.00 -0.53 0.00 0.00 39.78 38.90 2k8p n ASN 181 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k8p s GLN 182 N -3.72 2.69 -0.01 1.20 -2.07 -1.26 -5.11 119.66 111.37 2k8p s GLN 182 Ca 0.48 -0.88 -0.30 0.00 -1.82 0.00 0.00 55.36 52.84 2k8p s GLN 182 Cb 0.38 -2.56 0.12 0.00 -1.09 0.00 0.00 33.01 29.85 2k8p s GLN 182 CO -0.23 0.51 1.28 0.00 -1.32 0.00 0.00 175.29 175.53 2k8p s ALA 183 N -1.56 -2.28 0.59 2.60 0.00 -1.26 -5.18 121.76 114.67 2k8p s ALA 183 Ca 0.28 0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.80 2k8p s ALA 183 Cb -0.11 0.48 0.06 0.00 0.00 0.00 0.00 23.12 23.56 2k8p s ALA 183 CO 0.21 -1.08 0.82 -1.83 0.00 0.00 0.00 175.76 173.88 2k8p s GLU 184 N -2.33 2.30 -0.16 0.00 -1.05 -1.26 -5.05 118.70 111.15 2k8p s GLU 184 Ca 0.18 -1.03 0.01 0.00 -0.15 0.00 0.00 54.97 53.98 2k8p s GLU 184 Cb 0.04 -2.49 -0.10 0.00 -0.44 0.00 0.00 34.13 31.13 2k8p s GLU 184 CO -0.03 -0.89 -0.14 1.28 0.95 0.00 0.00 175.26 176.43 2k8p n LEU 185 N -2.41 2.94 0.00 1.83 7.99 -1.26 -5.11 117.00 120.97 2k8p n LEU 185 Ca 0.11 -0.08 0.09 0.00 -0.01 0.00 0.00 56.01 56.11 2k8p n LEU 185 Cb 0.60 -0.54 -0.02 0.00 -0.11 0.00 0.00 43.42 43.35 2k8p n LEU 185 CO 0.43 0.76 -0.12 1.21 -1.51 0.00 0.00 177.39 178.16 2k8p n GLU 186 N -2.95 -1.31 0.14 3.23 2.13 -1.26 -4.99 120.64 115.63 2k8p n GLU 186 Ca -0.28 0.86 0.00 0.00 0.66 0.00 0.00 57.16 58.41 2k8p n GLU 186 Cb 0.80 -1.60 0.00 0.00 0.27 0.00 0.00 31.44 30.91 2k8p n GLU 186 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2k8p n ASN 187 N -3.78 -1.92 -3.33 4.31 5.15 -1.26 -5.14 115.26 109.30 2k8p n ASN 187 Ca 0.00 0.54 0.02 0.00 -0.60 0.00 0.00 54.58 54.54 2k8p n ASN 187 Cb 0.30 1.93 -0.04 0.00 -0.53 0.00 0.00 39.78 41.44 2k8p n ASN 187 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k8p s ALA 188 N -1.81 -2.88 0.00 5.20 0.00 -1.26 -5.36 121.76 115.65 2k8p s ALA 188 Ca 0.00 1.94 0.00 0.00 0.00 0.00 0.00 51.96 53.90 2k8p s ALA 188 Cb 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.98 2k8p s ALA 188 CO 0.00 -1.01 0.00 0.98 0.00 0.00 0.00 175.76 175.73