#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 0.36 -0.05 1.61 1.48 -1.26 -5.18 118.94 115.90 2k8p s TRP 2 Ca 0.00 -0.73 -0.13 0.00 -1.06 0.00 0.00 56.10 54.18 2k8p s TRP 2 Cb 0.00 -0.05 0.03 0.00 -1.16 0.00 0.00 33.47 32.29 2k8p s TRP 2 CO 0.00 -0.71 0.31 1.14 -4.06 0.00 0.00 176.95 173.63 2k8p s GLN 3 N -3.95 0.56 0.15 3.25 0.00 -1.26 -5.17 119.66 113.23 2k8p s GLN 3 Ca 0.16 0.04 0.02 0.00 -0.00 0.00 0.00 55.36 55.58 2k8p s GLN 3 Cb 0.03 0.25 -0.01 0.00 0.00 0.00 0.00 33.01 33.29 2k8p s GLN 3 CO -0.01 -0.13 0.15 0.00 0.00 0.00 0.00 175.29 175.30 2k8p n ALA 4 N 1.88 0.18 -3.29 2.60 0.00 -1.26 -5.18 120.51 115.44 2k8p n ALA 4 Ca -0.18 -0.81 -0.13 0.00 0.00 0.00 0.00 53.44 52.31 2k8p n ALA 4 Cb 0.57 0.66 -0.14 0.00 0.00 0.00 0.00 19.45 20.53 2k8p n ALA 4 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2k8p s PHE 5 N -3.03 -0.04 -0.53 0.00 0.40 -1.26 -5.08 117.98 108.45 2k8p s PHE 5 Ca 0.16 0.17 0.07 0.00 -0.60 0.00 0.00 56.93 56.74 2k8p s PHE 5 Cb 0.00 -0.07 0.31 0.00 0.51 0.00 0.00 43.02 43.77 2k8p s PHE 5 CO 0.11 -0.06 0.81 1.63 0.70 0.00 0.00 175.22 178.41 2k8p n LYS 6 N 3.57 2.32 -3.58 0.44 4.01 -1.26 -5.05 118.16 118.61 2k8p n LYS 6 Ca -0.19 -4.33 -0.10 0.00 -0.51 0.00 0.00 58.31 53.18 2k8p n LYS 6 Cb 0.56 -2.02 -0.05 0.00 -0.51 0.00 0.00 35.03 33.01 2k8p n LYS 6 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 2k8p s ASN 7 N -2.76 -0.36 -0.05 4.39 2.20 -1.26 -5.19 114.94 111.91 2k8p s ASN 7 Ca 0.43 0.41 -0.30 0.00 -0.94 0.00 0.00 52.86 52.46 2k8p s ASN 7 Cb 0.25 0.32 0.12 0.00 -2.00 0.00 0.00 41.25 39.94 2k8p s ASN 7 CO -0.09 -0.32 1.33 -0.62 -2.94 0.00 0.00 177.10 174.46 2k8p s ASP 8 N -1.04 -0.02 -0.19 3.54 -1.08 -1.26 -5.16 116.67 111.46 2k8p s ASP 8 Ca -0.01 -0.11 -0.07 0.00 -0.52 0.00 0.00 52.55 51.83 2k8p s ASP 8 Cb -0.01 0.10 0.08 0.00 -1.46 0.00 0.00 42.92 41.63 2k8p s ASP 8 CO 0.01 -0.19 0.41 0.00 0.52 0.00 0.00 175.17 175.92 2k8p s ALA 9 N -2.14 -1.10 -0.18 3.66 0.00 -1.26 -5.03 121.76 115.72 2k8p s ALA 9 Ca 0.22 1.49 0.14 0.00 0.00 0.00 0.00 51.96 53.81 2k8p s ALA 9 Cb 0.03 -1.20 0.36 0.00 0.00 0.00 0.00 23.12 22.31 2k8p s ALA 9 CO -0.03 -0.62 1.19 -2.37 0.00 0.00 0.00 175.76 173.93 2k8p n THR 10 N 5.08 2.07 -2.30 0.00 5.66 -1.26 -5.11 114.28 118.42 2k8p n THR 10 Ca -0.12 -2.82 0.05 0.00 -3.05 0.00 0.00 64.05 58.10 2k8p n THR 10 Cb 0.51 -0.24 -0.01 0.00 -1.55 0.00 0.00 70.33 69.04 2k8p n THR 10 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2k8p n GLU 11 N -1.25 -0.79 -3.87 1.09 1.02 -1.26 -4.64 120.64 110.93 2k8p n GLU 11 Ca 0.18 0.52 -0.30 0.00 -0.02 0.00 0.00 57.16 57.54 2k8p n GLU 11 Cb 0.67 -0.97 -0.14 0.00 -0.02 0.00 0.00 31.44 30.98 2k8p n GLU 11 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2k8p s ILE 12 N -0.74 1.80 -0.41 -3.67 1.09 -1.26 -5.07 121.20 112.94 2k8p s ILE 12 Ca 0.00 -2.33 -0.35 0.00 -1.10 0.00 0.00 60.65 56.87 2k8p s ILE 12 Cb 0.00 -2.31 -0.12 0.00 -1.06 0.00 0.00 42.46 38.97 2k8p s ILE 12 CO 0.00 -0.72 2.24 -0.38 -0.10 0.00 0.00 174.94 175.98 2k8p n ILE 13 N 4.05 0.15 -1.71 2.92 -0.00 -1.26 -4.91 119.36 118.59 2k8p n ILE 13 Ca 0.04 -0.27 -0.33 0.00 -0.00 0.00 0.00 62.75 62.19 2k8p n ILE 13 Cb 0.39 -1.60 0.05 0.00 -0.00 0.00 0.00 39.64 38.48 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 6.54 2.75 -0.11 0.38 0.04 -1.26 -4.99 135.00 138.34 2k8p s PRO 14 Ca 1.11 1.37 0.11 0.00 0.04 0.00 0.00 61.00 63.62 2k8p s PRO 14 Cb -0.87 -1.95 -0.15 0.00 0.04 0.00 0.00 34.50 31.58 2k8p s PRO 14 CO 0.48 -1.28 0.05 0.39 0.04 0.00 0.00 177.00 176.67 2k8p n GLU 15 N -2.51 2.04 0.00 4.56 1.02 -1.26 -5.10 120.64 119.38 2k8p n GLU 15 Ca 0.10 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 2k8p n GLU 15 Cb 0.52 -1.30 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 2k8p n GLU 15 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2k8p n LEU 16 N -2.43 0.00 -3.14 -4.62 7.94 -1.26 -4.76 117.00 108.73 2k8p n LEU 16 Ca -0.19 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.56 2k8p n LEU 16 Cb 0.87 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.77 2k8p n LEU 16 CO 0.25 -0.79 -0.10 -0.83 -1.11 0.00 0.00 177.39 174.81 2k8p s GLY 17 N -3.24 -0.12 -0.44 -3.96 0.00 -1.26 -5.10 107.32 93.20 2k8p s GLY 17 Ca 0.00 -1.23 -0.13 0.00 0.00 0.00 0.00 44.72 43.36 2k8p s GLY 17 CO 0.00 2.91 0.33 -0.54 0.00 0.00 0.00 173.10 175.80 2k8p s GLU 18 N 0.77 2.87 -0.63 2.90 0.41 -1.26 -4.98 118.70 118.77 2k8p s GLU 18 Ca 0.27 -1.30 0.06 0.00 -0.41 0.00 0.00 54.97 53.59 2k8p s GLU 18 Cb -0.02 -3.98 0.27 0.00 -1.78 0.00 0.00 34.13 28.61 2k8p s GLU 18 CO -0.10 -0.93 0.78 2.48 -0.49 0.00 0.00 175.26 177.00 2k8p n TYR 19 N 5.10 3.71 -2.23 1.61 4.11 -1.26 -5.08 117.16 123.13 2k8p n TYR 19 Ca -0.12 -4.13 -0.41 0.00 -0.00 0.00 0.00 57.90 53.24 2k8p n TYR 19 Cb 0.44 -0.55 -0.03 0.00 -0.00 0.00 0.00 39.34 39.21 2k8p n TYR 19 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 2k8p s PRO 20 N -2.65 4.40 0.25 -3.48 0.04 -1.26 -5.04 135.00 127.26 2k8p s PRO 20 Ca 0.42 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.56 2k8p s PRO 20 Cb 0.17 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.50 2k8p s PRO 20 CO -0.03 -0.22 0.32 -1.21 0.04 0.00 0.00 177.00 175.90 2k8p s GLU 21 N -0.30 3.26 0.96 4.56 2.02 -1.26 -5.11 118.70 122.83 2k8p s GLU 21 Ca 0.55 -0.87 -0.12 0.00 0.02 0.00 0.00 54.97 54.55 2k8p s GLU 21 Cb -0.36 -2.79 0.17 0.00 0.10 0.00 0.00 34.13 31.24 2k8p s GLU 21 CO 0.39 0.39 1.09 -1.25 0.02 0.00 0.00 175.26 175.90 2k8p s PRO 22 N -3.96 0.73 0.96 0.39 0.04 -1.26 -5.04 135.00 126.87 2k8p s PRO 22 Ca 0.35 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.90 2k8p s PRO 22 Cb -0.09 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 32.86 2k8p s PRO 22 CO 0.28 -2.55 1.09 -1.25 0.04 0.00 0.00 177.00 174.61 2k8p s PRO 23 N -4.95 0.73 0.99 0.56 0.04 -1.26 -5.04 135.00 126.08 2k8p s PRO 23 Ca 0.65 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 62.20 2k8p s PRO 23 Cb -0.18 -1.76 0.18 0.00 0.04 0.00 0.00 34.50 32.78 2k8p s PRO 23 CO 0.57 -2.55 1.09 -1.25 0.04 0.00 0.00 177.00 174.90 2k8p s PRO 24 N -4.95 0.48 -0.44 0.56 0.04 -1.26 -5.04 135.00 124.39 2k8p s PRO 24 Ca 0.65 0.55 0.07 0.00 0.04 0.00 0.00 61.00 62.31 2k8p s PRO 24 Cb -0.18 -1.74 0.23 0.00 0.04 0.00 0.00 34.50 32.85 2k8p s PRO 24 CO 0.57 -2.70 0.52 0.39 0.04 0.00 0.00 177.00 175.82 2k8p n GLU 25 N -4.16 0.95 -3.84 4.56 1.02 -1.26 -5.03 120.64 112.87 2k8p n GLU 25 Ca 0.05 -3.49 -0.30 0.00 -0.02 0.00 0.00 57.16 53.41 2k8p n GLU 25 Cb 0.57 -1.49 -0.14 0.00 -0.02 0.00 0.00 31.44 30.36 2k8p n GLU 25 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k8p s LEU 26 N -1.18 3.54 0.22 -4.62 1.43 -1.26 -5.09 118.68 111.72 2k8p s LEU 26 Ca 0.35 -2.80 0.00 0.00 -1.03 0.00 0.00 54.13 50.65 2k8p s LEU 26 Cb 0.14 -1.35 -0.05 0.00 0.03 0.00 0.00 46.19 44.96 2k8p s LEU 26 CO -0.11 -0.25 0.10 -1.61 0.23 0.00 0.00 176.35 174.71 2k8p s GLU 27 N 0.05 1.27 0.27 1.70 0.41 -1.26 -5.18 118.70 115.96 2k8p s GLU 27 Ca 0.17 -1.67 0.02 0.00 -0.41 0.00 0.00 54.97 53.08 2k8p s GLU 27 Cb -0.25 0.01 -0.03 0.00 -1.78 0.00 0.00 34.13 32.07 2k8p s GLU 27 CO -0.00 -0.32 0.23 -0.80 -0.49 0.00 0.00 175.26 173.88 2k8p s ASN 28 N -3.22 0.84 0.05 -0.19 0.01 -1.26 -5.10 114.94 106.08 2k8p s ASN 28 Ca 0.37 -1.53 0.00 0.00 -0.71 0.00 0.00 52.86 50.98 2k8p s ASN 28 Cb 0.07 0.49 0.00 0.00 0.41 0.00 0.00 41.25 42.22 2k8p s ASN 28 CO 0.11 -0.98 0.00 0.59 -1.51 0.00 0.00 177.10 175.31 2k8p n ASN 29 N -0.90 0.35 -1.33 -1.22 4.13 -1.26 -5.14 115.26 109.89 2k8p n ASN 29 Ca 0.04 0.07 0.18 0.00 1.68 0.00 0.00 54.58 56.55 2k8p n ASN 29 Cb 0.64 -0.09 -0.04 0.00 -1.54 0.00 0.00 39.78 38.75 2k8p n ASN 29 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2k8p n LYS 30 N -3.15 -2.64 -3.51 3.52 4.76 -1.26 -5.02 118.16 110.87 2k8p n LYS 30 Ca 0.00 1.74 -0.11 0.00 -2.87 0.00 0.00 58.31 57.07 2k8p n LYS 30 Cb 0.26 -3.22 -0.02 0.00 -1.84 0.00 0.00 35.03 30.22 2k8p n LYS 30 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2k8p s THR 31 N -2.08 0.00 -0.16 -0.18 -4.23 -1.26 -5.18 115.64 102.55 2k8p s THR 31 Ca 0.00 -0.20 -0.29 0.00 -1.18 0.00 0.00 61.69 60.02 2k8p s THR 31 Cb 0.00 -1.20 0.10 0.00 1.34 0.00 0.00 72.50 72.74 2k8p s THR 31 CO 0.00 0.00 0.87 -0.32 -0.54 0.00 0.00 174.62 174.63 2k8p s MET 32 N -3.73 0.76 -0.29 3.99 1.75 -1.26 -5.17 119.30 115.35 2k8p s MET 32 Ca 0.03 0.37 -0.18 0.00 -1.25 0.00 0.00 55.69 54.67 2k8p s MET 32 Cb -0.02 0.36 0.14 0.00 2.84 0.00 0.00 34.83 38.15 2k8p s MET 32 CO -0.09 -0.20 0.97 0.54 -0.65 0.00 0.00 175.02 175.60 2k8p s ASN 33 N -0.71 -0.52 0.17 1.11 4.22 -1.26 -5.18 114.94 112.77 2k8p s ASN 33 Ca -0.04 0.87 0.07 0.00 -2.14 0.00 0.00 52.86 51.62 2k8p s ASN 33 Cb -0.02 1.14 -0.04 0.00 1.28 0.00 0.00 41.25 43.61 2k8p s ASN 33 CO 0.03 -0.14 -0.14 -0.60 -2.04 0.00 0.00 177.10 174.21 2k8p s ARG 34 N 1.12 1.19 0.47 3.55 3.52 -1.26 -5.16 118.95 122.38 2k8p s ARG 34 Ca -0.06 -1.44 0.05 0.00 -0.13 0.00 0.00 55.73 54.15 2k8p s ARG 34 Cb -0.04 -1.02 -0.03 0.00 -1.56 0.00 0.00 34.95 32.31 2k8p s ARG 34 CO -0.13 0.18 0.13 0.00 -0.81 0.00 0.00 175.30 174.67 2k8p s ALA 35 N -2.63 3.86 0.03 6.12 0.00 -1.26 -5.15 121.76 122.73 2k8p s ALA 35 Ca 0.17 -1.38 -0.03 0.00 0.00 0.00 0.00 51.96 50.71 2k8p s ALA 35 Cb -0.02 -0.21 0.01 0.00 0.00 0.00 0.00 23.12 22.89 2k8p s ALA 35 CO 0.05 -0.16 0.14 -0.85 0.00 0.00 0.00 175.76 174.94 2k8p n GLU 36 N -1.30 0.11 -3.74 0.00 0.28 -1.26 -5.20 120.64 109.53 2k8p n GLU 36 Ca -0.08 -0.24 -0.09 0.00 -0.16 0.00 0.00 57.16 56.58 2k8p n GLU 36 Cb 0.66 0.32 0.02 0.00 1.43 0.00 0.00 31.44 33.87 2k8p n GLU 36 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 2k8p n ASN 37 N -0.77 -2.15 0.00 -1.84 0.23 -1.26 -5.16 115.26 104.32 2k8p n ASN 37 Ca -0.01 -2.60 0.00 0.00 -0.53 0.00 0.00 54.58 51.44 2k8p n ASN 37 Cb 0.09 3.61 0.00 0.00 -2.08 0.00 0.00 39.78 41.40 2k8p n ASN 37 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2k8p n GLY 38 N -0.53 1.76 0.00 4.83 0.00 -1.26 -5.18 105.19 104.81 2k8p n GLY 38 Ca -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 3.84 2.70 -0.02 0.00 -1.26 -5.12 105.19 105.32 2k8p n GLY 39 Ca 0.00 -0.70 -0.06 0.00 0.00 0.00 0.00 46.02 45.26 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 0.34 -1.18 1.61 3.00 -1.26 -5.17 116.66 114.01 2k8p n ARG 40 Ca 0.00 -1.08 -0.29 0.00 -0.00 0.00 0.00 57.85 56.48 2k8p n ARG 40 Cb 0.00 -0.64 0.16 0.00 0.00 0.00 0.00 32.46 31.98 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 0.39 0.75 0.74 -0.14 0.04 -1.26 -5.02 135.00 130.49 2k8p s PRO 41 Ca 0.28 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.84 2k8p s PRO 41 Cb 0.20 -1.76 0.04 0.00 0.04 0.00 0.00 34.50 33.01 2k8p s PRO 41 CO -0.14 -2.54 1.10 -1.25 0.04 0.00 0.00 177.00 174.21 2k8p s PRO 42 N -4.95 2.42 0.36 0.56 0.04 -1.26 -5.07 135.00 127.10 2k8p s PRO 42 Ca 0.65 1.24 0.09 0.00 0.04 0.00 0.00 61.00 63.01 2k8p s PRO 42 Cb -0.18 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.38 2k8p s PRO 42 CO 0.57 -1.53 -0.02 -3.38 0.04 0.00 0.00 177.00 172.69 2k8p s HIS 43 N -2.72 2.49 0.28 0.56 -3.43 -1.26 -5.16 115.29 106.05 2k8p s HIS 43 Ca 0.63 -0.53 0.10 0.00 -0.80 0.00 0.00 55.06 54.47 2k8p s HIS 43 Cb -0.18 -1.55 -0.05 0.00 -1.43 0.00 0.00 32.58 29.37 2k8p s HIS 43 CO 0.51 0.49 -0.07 -1.01 -2.00 0.00 0.00 174.74 172.67 2k8p s HIS 44 N -2.61 2.54 0.74 0.38 3.76 -1.26 -5.13 115.29 113.71 2k8p s HIS 44 Ca 0.34 -0.29 -0.12 0.00 -0.15 0.00 0.00 55.06 54.85 2k8p s HIS 44 Cb 0.04 -1.16 0.04 0.00 1.11 0.00 0.00 32.58 32.61 2k8p s HIS 44 CO 0.18 0.64 1.10 -1.25 -0.85 0.00 0.00 174.74 174.56 2k8p s PRO 45 N -3.62 2.41 0.12 8.40 0.04 -1.26 -5.06 135.00 136.03 2k8p s PRO 45 Ca 0.31 1.23 0.04 0.00 0.04 0.00 0.00 61.00 62.63 2k8p s PRO 45 Cb -0.05 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 2k8p s PRO 45 CO 0.18 -1.53 0.12 0.12 0.04 0.00 0.00 177.00 175.93 2k8p s PHE 46 N -2.74 3.20 0.82 0.56 5.36 -1.26 -5.10 117.98 118.82 2k8p s PHE 46 Ca 0.63 0.04 -0.13 0.00 -0.96 0.00 0.00 56.93 56.52 2k8p s PHE 46 Cb -0.18 -1.58 0.09 0.00 -0.34 0.00 0.00 43.02 41.01 2k8p s PHE 46 CO 0.52 0.52 1.19 -1.21 -1.46 0.00 0.00 175.22 174.78 2k8p s GLU 47 N -2.75 1.61 -0.20 10.12 2.02 -1.26 -5.04 118.70 123.19 2k8p s GLU 47 Ca 0.30 1.69 -0.07 0.00 0.02 0.00 0.00 54.97 56.91 2k8p s GLU 47 Cb -0.11 -1.78 0.09 0.00 0.10 0.00 0.00 34.13 32.43 2k8p s GLU 47 CO 0.23 -2.22 0.43 0.99 0.02 0.00 0.00 175.26 174.71 2k8p s THR 48 N -2.26 -0.66 0.90 3.63 2.01 -1.26 -5.16 115.64 112.83 2k8p s THR 48 Ca 0.71 0.16 -0.14 0.00 0.31 0.00 0.00 61.69 62.73 2k8p s THR 48 Cb -0.27 -0.68 0.15 0.00 0.01 0.00 0.00 72.50 71.71 2k8p s THR 48 CO 0.51 0.07 1.24 -0.54 -0.69 0.00 0.00 174.62 175.21 2k8p s LYS 49 N 2.62 1.16 0.32 4.92 3.01 -1.26 -5.10 119.74 125.41 2k8p s LYS 49 Ca -0.02 -0.11 0.03 0.00 -1.01 0.00 0.00 55.97 54.87 2k8p s LYS 49 Cb -0.12 -1.88 -0.01 0.00 -1.01 0.00 0.00 37.83 34.81 2k8p s LYS 49 CO -0.13 -2.11 0.36 -0.40 0.51 0.00 0.00 175.35 173.58 2k8p n ASP 50 N -3.62 -0.97 -3.88 2.83 5.75 -1.26 -5.18 116.55 110.22 2k8p n ASP 50 Ca 0.11 -2.93 -0.11 0.00 -0.01 0.00 0.00 54.79 51.85 2k8p n ASP 50 Cb 0.60 1.97 -0.13 0.00 -1.03 0.00 0.00 41.12 42.54 2k8p n ASP 50 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2k8p s VAL 51 N -3.04 0.03 -0.43 2.12 1.01 -1.26 -5.08 120.40 113.75 2k8p s VAL 51 Ca 0.33 -0.25 0.10 0.00 0.00 0.00 0.00 61.98 62.16 2k8p s VAL 51 Cb 0.00 -0.15 0.35 0.00 0.00 0.00 0.00 36.38 36.58 2k8p s VAL 51 CO 0.23 -0.14 0.81 -0.24 0.00 0.00 0.00 175.10 175.76 2k8p n SER 52 N 2.61 1.97 -4.29 3.32 2.88 -1.26 -5.10 113.62 113.74 2k8p n SER 52 Ca -0.16 -3.21 -0.21 0.00 -1.33 0.00 0.00 58.87 53.97 2k8p n SER 52 Cb 0.58 -0.60 0.11 0.00 -0.75 0.00 0.00 64.21 63.55 2k8p n SER 52 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2k8p n GLU 53 N 0.10 -0.02 -0.06 -1.46 4.07 -1.26 -5.05 120.64 116.96 2k8p n GLU 53 Ca 0.26 -2.45 -0.07 0.00 -0.06 0.00 0.00 57.16 54.85 2k8p n GLU 53 Cb 0.59 -0.59 -0.08 0.00 -0.06 0.00 0.00 31.44 31.30 2k8p n GLU 53 CO 0.00 0.00 0.00 2.48 -0.06 0.00 0.00 177.13 179.55 2k8p n TYR 54 N -2.69 0.00 -0.39 4.31 4.11 -1.26 -5.03 117.16 116.21 2k8p n TYR 54 Ca 0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 57.90 58.03 2k8p n TYR 54 Cb 0.53 -0.52 0.01 0.00 -0.00 0.00 0.00 39.34 39.36 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 -2.58 -1.33 -4.68 9.48 3.41 -1.26 -4.36 113.62 112.30 2k8p n SER 55 Ca -0.20 -0.40 -0.42 0.00 -0.26 0.00 0.00 58.87 57.58 2k8p n SER 55 Cb 0.81 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.69 2k8p n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8p s ARG 57 N 2.52 3.68 -0.11 0.00 0.52 0.56 -4.83 118.95 121.29 2k8p s ARG 57 Ca 0.56 1.67 -0.29 0.00 -0.52 0.00 0.00 55.73 57.16 2k8p s ARG 57 Cb -0.25 -4.09 -0.06 0.00 0.52 0.00 0.00 34.95 31.07 2k8p s ARG 57 CO 0.21 -1.43 2.01 -1.21 0.02 0.00 0.00 175.30 174.89 2k8p s GLU 58 N 4.95 3.66 0.28 3.54 2.02 -1.26 -3.51 118.70 128.38 2k8p s GLU 58 Ca 0.75 2.20 0.05 0.00 0.02 0.00 0.00 54.97 57.99 2k8p s GLU 58 Cb -0.26 -4.23 -0.02 0.00 0.10 0.00 0.00 34.13 29.72 2k8p s GLU 58 CO 0.31 -1.49 0.42 -0.51 0.02 0.00 0.00 175.26 174.01 2k8p s LEU 59 N 6.17 4.19 -0.14 1.80 2.01 0.28 -4.97 118.68 128.02 2k8p s LEU 59 Ca 0.90 0.06 -0.05 0.00 0.01 0.00 0.00 54.13 55.05 2k8p s LEU 59 Cb -0.35 -2.90 0.07 0.00 0.01 0.00 0.00 46.19 43.02 2k8p s LEU 59 CO 0.37 -0.20 0.30 -1.00 1.01 0.00 0.00 176.35 176.83 2k8p s HIS 60 N -2.08 -0.51 -0.02 0.29 3.76 -1.26 -0.17 115.29 115.31 2k8p s HIS 60 Ca 0.38 1.10 0.07 0.00 -0.15 0.00 0.00 55.06 56.45 2k8p s HIS 60 Cb -0.09 0.06 -0.02 0.00 1.11 0.00 0.00 32.58 33.63 2k8p s HIS 60 CO 0.31 -0.37 -0.23 -0.06 -0.85 0.00 0.00 174.74 173.54 2k8p s PHE 61 N 2.35 2.44 0.07 1.40 0.40 -0.05 -4.95 117.98 119.63 2k8p s PHE 61 Ca -0.01 -0.35 0.10 0.00 -0.60 0.00 0.00 56.93 56.07 2k8p s PHE 61 Cb -0.12 -1.52 -0.03 0.00 0.51 0.00 0.00 43.02 41.86 2k8p s PHE 61 CO -0.10 0.06 -0.26 0.99 0.70 0.00 0.00 175.22 176.61 2k8p s THR 62 N -0.69 2.16 0.04 0.64 2.01 -1.26 -1.02 115.64 117.52 2k8p s THR 62 Ca 0.11 -1.51 -0.28 0.00 0.31 0.00 0.00 61.69 60.32 2k8p s THR 62 Cb -0.10 -1.87 0.09 0.00 0.01 0.00 0.00 72.50 70.63 2k8p s THR 62 CO 0.00 0.27 0.97 -0.60 -0.69 0.00 0.00 174.62 174.56 2k8p s ARG 63 N -1.51 0.89 -0.29 4.92 3.52 -1.13 -4.95 118.95 120.40 2k8p s ARG 63 Ca 0.12 -0.41 -0.20 0.00 -0.13 0.00 0.00 55.73 55.11 2k8p s ARG 63 Cb -0.10 0.36 -0.01 0.00 -1.56 0.00 0.00 34.95 33.63 2k8p s ARG 63 CO 0.03 -0.40 0.60 0.71 -0.81 0.00 0.00 175.30 175.43 2k8p s TYR 64 N -3.08 3.24 0.28 5.12 1.51 -1.26 -0.21 117.35 122.94 2k8p s TYR 64 Ca 0.09 0.62 -0.16 0.00 -1.01 0.00 0.00 57.07 56.61 2k8p s TYR 64 Cb -0.01 -2.90 -0.09 0.00 -0.11 0.00 0.00 41.96 38.86 2k8p s TYR 64 CO -0.04 -0.41 0.72 0.54 -1.11 0.00 0.00 175.55 175.25 2k8p s VAL 65 N 2.51 4.66 -0.17 0.71 0.11 -1.26 -4.97 120.40 121.99 2k8p s VAL 65 Ca 0.24 1.03 -0.08 0.00 -2.93 0.00 0.00 61.98 60.24 2k8p s VAL 65 Cb -0.15 -3.69 0.07 0.00 -1.53 0.00 0.00 36.38 31.07 2k8p s VAL 65 CO 0.11 -0.04 0.39 0.42 -3.33 0.00 0.00 175.10 172.64 2k8p s THR 66 N -1.81 -0.25 -0.30 5.04 -4.23 -1.26 -1.59 115.64 111.23 2k8p s THR 66 Ca 0.50 0.14 -0.01 0.00 -1.18 0.00 0.00 61.69 61.14 2k8p s THR 66 Cb -0.12 -0.60 0.10 0.00 1.34 0.00 0.00 72.50 73.21 2k8p s THR 66 CO 0.19 0.06 0.09 -0.62 -0.54 0.00 0.00 174.62 173.79 2k8p s ASP 67 N 1.86 3.97 0.00 3.99 2.15 -1.24 -5.03 116.67 122.37 2k8p s ASP 67 Ca -0.06 -1.58 0.00 0.00 0.43 0.00 0.00 52.55 51.34 2k8p s ASP 67 Cb -0.10 -0.87 0.00 0.00 -0.30 0.00 0.00 42.92 41.65 2k8p s ASP 67 CO -0.12 -0.40 0.00 0.61 -0.17 0.00 0.00 175.17 175.09 2k8p n GLY 68 N 4.85 -1.40 0.00 2.66 0.00 -1.26 -4.22 105.19 105.82 2k8p n GLY 68 Ca -0.03 -1.79 0.07 0.00 0.00 0.00 0.00 46.02 44.27 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 0.20 -3.83 1.61 -0.04 -1.26 -4.74 135.00 126.93 2k8p n PRO 69 Ca 0.00 0.15 -0.21 0.00 -0.04 0.00 0.00 63.50 63.40 2k8p n PRO 69 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2k8p n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k8p s ARG 71 N -4.00 0.05 0.42 0.00 3.00 0.42 -3.66 118.95 115.18 2k8p s ARG 71 Ca 0.38 -0.03 -0.25 0.00 0.00 0.00 0.00 55.73 55.83 2k8p s ARG 71 Cb -0.08 -0.04 -0.10 0.00 0.00 0.00 0.00 34.95 34.74 2k8p s ARG 71 CO 0.28 0.01 1.25 -1.13 0.00 0.00 0.00 175.30 175.71 2k8p n SER 72 N 3.03 2.43 0.13 0.23 3.41 -0.62 -0.14 113.62 122.09 2k8p n SER 72 Ca -0.12 1.10 0.02 0.00 -0.26 0.00 0.00 58.87 59.60 2k8p n SER 72 Cb 0.60 -1.49 0.01 0.00 -0.26 0.00 0.00 64.21 63.06 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 2.01 0.64 -2.25 7.33 0.00 -1.68 -3.45 119.26 121.87 2k8p h ALA 73 Ca -0.48 -0.52 -0.18 0.00 0.00 0.00 0.00 54.91 53.74 2k8p h ALA 73 Cb 1.30 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.88 2k8p h ALA 73 CO 0.59 0.70 -0.68 0.15 0.00 0.00 0.00 179.25 180.01 2k8p s LYS 74 N -2.94 0.75 0.76 0.00 1.02 -1.26 -5.13 119.74 112.93 2k8p s LYS 74 Ca 0.03 -1.30 -0.11 0.00 0.02 0.00 0.00 55.97 54.61 2k8p s LYS 74 Cb 0.08 0.02 0.05 0.00 -0.52 0.00 0.00 37.83 37.45 2k8p s LYS 74 CO 0.76 -0.08 1.09 -1.25 -0.92 0.00 0.00 175.35 174.95 2k8p s PRO 75 N -3.89 2.33 -0.16 -1.68 0.04 -1.26 -4.60 135.00 125.78 2k8p s PRO 75 Ca 0.11 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.35 2k8p s PRO 75 Cb 0.07 -1.90 -0.00 0.00 0.04 0.00 0.00 34.50 32.70 2k8p s PRO 75 CO -0.06 -1.59 -0.15 0.54 0.04 0.00 0.00 177.00 175.78 2k8p s VAL 76 N -2.82 2.67 -0.41 -0.36 0.11 0.70 -4.91 120.40 115.38 2k8p s VAL 76 Ca 0.62 -0.77 -0.23 0.00 -2.93 0.00 0.00 61.98 58.68 2k8p s VAL 76 Cb -0.18 -2.13 0.02 0.00 -1.53 0.00 0.00 36.38 32.56 2k8p s VAL 76 CO 0.54 0.51 0.76 -0.89 -3.33 0.00 0.00 175.10 172.69 2k8p s THR 77 N 0.87 4.72 -0.10 5.04 2.01 -1.26 -2.86 115.64 124.06 2k8p s THR 77 Ca -0.04 0.57 0.01 0.00 0.31 0.00 0.00 61.69 62.54 2k8p s THR 77 Cb -0.15 -4.25 -0.02 0.00 0.01 0.00 0.00 72.50 68.09 2k8p s THR 77 CO -0.01 -0.57 -0.13 -1.83 -0.69 0.00 0.00 174.62 171.39 2k8p s GLU 78 N 3.13 3.02 0.10 4.92 -1.05 -0.19 -4.98 118.70 123.65 2k8p s GLU 78 Ca 0.29 -0.68 -0.26 0.00 -0.15 0.00 0.00 54.97 54.16 2k8p s GLU 78 Cb -0.13 -2.53 -0.06 0.00 -0.44 0.00 0.00 34.13 30.97 2k8p s GLU 78 CO 0.20 0.39 0.82 -1.17 0.95 0.00 0.00 175.26 176.44 2k8p s LEU 79 N -0.11 4.50 0.13 1.83 0.20 -1.25 -0.87 118.68 123.11 2k8p s LEU 79 Ca -0.01 1.59 0.11 0.00 0.69 0.00 0.00 54.13 56.50 2k8p s LEU 79 Cb -0.14 -3.34 -0.04 0.00 -0.43 0.00 0.00 46.19 42.24 2k8p s LEU 79 CO 0.04 0.05 -0.26 -0.69 -0.29 0.00 0.00 176.35 175.20 2k8p s VAL 80 N -0.36 2.16 -0.14 1.68 1.01 0.76 -4.06 120.40 121.46 2k8p s VAL 80 Ca 0.40 -1.74 -0.09 0.00 0.00 0.00 0.00 61.98 60.54 2k8p s VAL 80 Cb -0.22 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 2k8p s VAL 80 CO 0.26 0.05 0.17 0.00 0.00 0.00 0.00 175.10 175.58 2k8p s SER 82 N -0.43 -0.22 0.00 0.00 0.01 -1.23 -4.93 113.70 106.91 2k8p s SER 82 Ca 0.14 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.76 2k8p s SER 82 Cb -0.12 0.71 0.00 0.00 0.21 0.00 0.00 66.02 66.82 2k8p s SER 82 CO 0.03 -1.32 0.00 0.61 0.41 0.00 0.00 173.24 172.97 2k8p n GLY 83 N -0.47 1.57 3.24 3.44 0.00 -1.26 -0.32 105.19 111.39 2k8p n GLY 83 Ca -0.05 -2.10 -0.14 0.00 0.00 0.00 0.00 46.02 43.74 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 -1.77 1.05 0.15 1.61 -0.21 -1.26 -4.86 119.66 114.37 2k8p s GLN 84 Ca 0.00 -1.46 0.03 0.00 0.02 0.00 0.00 55.36 53.96 2k8p s GLN 84 Cb 0.00 -0.55 -0.04 0.00 1.00 0.00 0.00 33.01 33.42 2k8p s GLN 84 CO 0.00 0.04 -0.06 0.00 -2.12 0.00 0.00 175.29 173.14 2k8p n GLY 86 N -0.20 -0.36 3.72 0.00 0.00 -1.26 -4.95 105.19 102.14 2k8p n GLY 86 Ca -0.09 0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.53 4.34 -0.39 1.61 0.04 -1.26 -4.84 135.00 133.97 2k8p s PRO 87 Ca 0.00 2.03 0.05 0.00 0.04 0.00 0.00 61.00 63.13 2k8p s PRO 87 Cb 0.00 -3.25 0.32 0.00 0.04 0.00 0.00 34.50 31.61 2k8p s PRO 87 CO 0.00 -0.40 1.25 0.00 0.04 0.00 0.00 177.00 177.90 2k8p n ALA 88 N 3.82 -1.81 -1.72 8.56 0.00 -1.26 -5.10 120.51 122.99 2k8p n ALA 88 Ca 0.11 -0.96 -0.29 0.00 0.00 0.00 0.00 53.44 52.29 2k8p n ALA 88 Cb 0.43 -2.02 0.09 0.00 0.00 0.00 0.00 19.45 17.95 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 0.16 1.97 0.53 0.00 0.52 -1.26 -5.03 118.95 115.84 2k8p s ARG 89 Ca 0.21 0.35 -0.19 0.00 -0.52 0.00 0.00 55.73 55.58 2k8p s ARG 89 Cb 0.29 -1.93 -0.06 0.00 0.52 0.00 0.00 34.95 33.77 2k8p s ARG 89 CO -0.12 -1.64 1.06 -0.51 0.02 0.00 0.00 175.30 174.12 2k8p s LEU 90 N -5.69 3.73 0.69 2.53 2.01 -1.26 -5.03 118.68 115.65 2k8p s LEU 90 Ca 0.61 1.96 -0.11 0.00 0.01 0.00 0.00 54.13 56.60 2k8p s LEU 90 Cb -0.13 -4.56 0.00 0.00 0.01 0.00 0.00 46.19 41.52 2k8p s LEU 90 CO 0.52 -0.99 1.06 -0.76 1.01 0.00 0.00 176.35 177.19 2k8p s LEU 91 N -3.83 3.09 0.51 1.79 1.02 -1.26 -4.95 118.68 115.04 2k8p s LEU 91 Ca 0.68 1.52 0.33 0.00 0.02 0.00 0.00 54.13 56.67 2k8p s LEU 91 Cb -0.18 -4.41 1.35 0.00 0.02 0.00 0.00 46.19 42.97 2k8p s LEU 91 CO 0.26 -1.36 1.96 1.55 0.02 0.00 0.00 176.35 178.78 2k8p h PRO 92 N -0.66 0.00 -0.51 1.29 0.13 -2.05 -3.05 132.00 127.15 2k8p h PRO 92 Ca -0.44 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.32 2k8p h PRO 92 Cb 1.21 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.01 2k8p h PRO 92 CO 0.59 0.00 -0.81 0.09 -0.23 0.00 0.00 178.00 177.64 2k8p n ASN 93 N -2.96 3.56 -3.13 1.44 3.02 -1.26 -4.84 115.26 111.10 2k8p n ASN 93 Ca 0.01 -3.45 -0.23 0.00 -0.03 0.00 0.00 54.58 50.88 2k8p n ASN 93 Cb 0.29 -0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 39.01 2k8p n ASN 93 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k8p n ALA 94 N -0.72 3.30 -2.47 5.41 0.00 -1.15 -5.08 120.51 119.80 2k8p n ALA 94 Ca 0.31 -4.05 -0.22 0.00 0.00 0.00 0.00 53.44 49.48 2k8p n ALA 94 Cb 0.90 -0.84 -0.10 0.00 0.00 0.00 0.00 19.45 19.41 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 -3.04 1.10 0.00 0.00 -5.25 -1.26 -4.69 121.20 108.06 2k8p s ILE 95 Ca 0.43 -2.00 0.00 0.00 -0.99 0.00 0.00 60.65 58.09 2k8p s ILE 95 Cb 0.28 -2.72 0.00 0.00 2.95 0.00 0.00 42.46 42.97 2k8p s ILE 95 CO -0.10 0.00 0.00 0.61 -1.79 0.00 0.00 174.94 173.66 2k8p n GLY 96 N -0.73 -1.82 3.50 6.27 0.00 -1.26 -5.00 105.19 106.15 2k8p n GLY 96 Ca -0.03 0.87 -0.21 0.00 0.00 0.00 0.00 46.02 46.65 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 -3.59 0.00 1.61 0.63 -1.26 -4.94 116.66 109.11 2k8p n ARG 97 Ca 0.00 0.71 0.00 0.00 -0.92 0.00 0.00 57.85 57.64 2k8p n ARG 97 Cb 0.00 -5.30 0.00 0.00 0.45 0.00 0.00 32.46 27.61 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 -1.41 0.04 1.46 5.14 0.00 -1.26 -5.16 105.19 104.01 2k8p n GLY 98 Ca -0.18 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.03 2k8p n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k8p n LYS 99 N -1.02 -3.09 -3.56 1.61 4.76 -1.26 -4.92 118.16 110.67 2k8p n LYS 99 Ca 0.00 2.23 -0.17 0.00 -2.87 0.00 0.00 58.31 57.50 2k8p n LYS 99 Cb 0.00 -3.71 -0.13 0.00 -1.84 0.00 0.00 35.03 29.35 2k8p n LYS 99 CO 0.00 0.00 0.00 1.67 -1.37 0.00 0.00 177.40 177.70 2k8p s TRP 100 N -2.96 -0.30 0.00 2.13 1.48 -1.26 -5.08 118.94 112.95 2k8p s TRP 100 Ca 0.00 0.49 0.00 0.00 -1.06 0.00 0.00 56.10 55.53 2k8p s TRP 100 Cb 0.00 -0.26 0.00 0.00 -1.16 0.00 0.00 33.47 32.05 2k8p s TRP 100 CO 0.00 -0.48 0.77 0.91 -4.06 0.00 0.00 176.95 174.09 2k8p n TRP 101 N 5.33 0.00 -3.95 1.66 7.02 -1.26 -4.79 117.44 121.45 2k8p n TRP 101 Ca -0.05 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.22 2k8p n TRP 101 Cb 0.50 -0.27 -0.02 0.00 -2.42 0.00 0.00 31.31 29.10 2k8p n TRP 101 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2k8p s ARG 102 N -2.07 3.32 -0.39 -0.99 3.00 -1.26 -5.04 118.95 115.51 2k8p s ARG 102 Ca 0.00 -0.84 -0.28 0.00 0.00 0.00 0.00 55.73 54.61 2k8p s ARG 102 Cb 0.00 -2.82 -0.01 0.00 0.00 0.00 0.00 34.95 32.11 2k8p s ARG 102 CO 0.00 0.39 1.73 -1.25 0.00 0.00 0.00 175.30 176.17 2k8p s PRO 103 N -3.97 3.26 -0.35 3.54 0.04 -1.26 -4.93 135.00 131.32 2k8p s PRO 103 Ca 0.35 1.19 0.01 0.00 0.04 0.00 0.00 61.00 62.59 2k8p s PRO 103 Cb -0.09 -4.20 0.14 0.00 0.04 0.00 0.00 34.50 30.40 2k8p s PRO 103 CO 0.28 -1.95 0.26 -1.54 0.04 0.00 0.00 177.00 174.10 2k8p s SER 104 N 5.99 2.40 0.00 6.66 1.04 -1.26 -4.98 113.70 123.55 2k8p s SER 104 Ca 0.74 -1.96 0.00 0.00 0.48 0.00 0.00 55.95 55.21 2k8p s SER 104 Cb -0.19 -0.08 0.00 0.00 0.10 0.00 0.00 66.02 65.85 2k8p s SER 104 CO 0.31 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.85 2k8p n GLY 105 N 4.15 -1.45 3.77 7.32 0.00 -1.26 -5.08 105.19 112.64 2k8p n GLY 105 Ca 0.11 0.50 -0.33 0.00 0.00 0.00 0.00 46.02 46.31 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 2.68 -0.31 1.61 0.04 -1.26 -4.86 135.00 132.90 2k8p s PRO 106 Ca 0.00 1.35 -0.27 0.00 0.04 0.00 0.00 61.00 62.11 2k8p s PRO 106 Cb 0.00 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.55 2k8p s PRO 106 CO 0.00 -1.34 2.27 -0.51 0.04 0.00 0.00 177.00 177.47 2k8p s ASP 107 N -2.75 5.13 0.00 6.66 1.11 -1.26 -4.31 116.67 121.25 2k8p s ASP 107 Ca 0.66 1.63 0.00 0.00 0.18 0.00 0.00 52.55 55.01 2k8p s ASP 107 Cb -0.20 -2.51 0.00 0.00 1.07 0.00 0.00 42.92 41.28 2k8p s ASP 107 CO 0.45 -2.25 0.94 0.49 1.18 0.00 0.00 175.17 175.97 2k8p n PHE 108 N 13.02 0.00 0.00 4.23 3.01 -1.26 -4.98 117.46 131.48 2k8p n PHE 108 Ca 0.32 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.78 2k8p n PHE 108 Cb 0.48 -0.44 0.00 0.00 -0.01 0.00 0.00 39.48 39.51 2k8p n PHE 108 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2k8p n ARG 109 N -2.19 0.00 -3.40 -1.08 1.74 -1.26 -5.07 116.66 105.39 2k8p n ARG 109 Ca 0.00 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.11 2k8p n ARG 109 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 2k8p n ARG 109 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k8p s ILE 111 N 1.63 4.97 1.20 0.00 -4.36 0.85 -4.94 121.20 120.56 2k8p s ILE 111 Ca -0.04 0.25 -0.19 0.00 -0.26 0.00 0.00 60.65 60.41 2k8p s ILE 111 Cb -0.02 -3.70 0.29 0.00 1.25 0.00 0.00 42.46 40.28 2k8p s ILE 111 CO -0.14 -0.27 1.11 -2.16 0.24 0.00 0.00 174.94 173.72 2k8p s PRO 112 N -3.37 -1.24 0.00 0.37 0.04 -1.26 -1.18 135.00 128.35 2k8p s PRO 112 Ca 0.46 -0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.42 2k8p s PRO 112 Cb -0.11 -1.59 0.00 0.00 0.04 0.00 0.00 34.50 32.84 2k8p s PRO 112 CO 0.28 -3.72 0.00 -3.47 0.04 0.00 0.00 177.00 170.12 2k8p n ASP 113 N -4.77 0.00 -4.58 6.66 -0.08 -1.21 -4.09 116.55 108.48 2k8p n ASP 113 Ca 0.13 -0.91 -0.49 0.00 -1.51 0.00 0.00 54.79 52.01 2k8p n ASP 113 Cb 0.59 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 44.01 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 0.00 1.18 -3.94 -0.67 0.63 -1.26 -4.63 116.66 107.98 2k8p n ARG 114 Ca 0.00 0.42 -0.23 0.00 -0.92 0.00 0.00 57.85 57.12 2k8p n ARG 114 Cb 0.00 -1.93 -0.02 0.00 0.45 0.00 0.00 32.46 30.95 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 -0.14 3.47 -0.13 -0.14 1.51 -1.26 -1.14 117.35 119.51 2k8p s TYR 115 Ca 0.74 0.05 -0.04 0.00 -1.01 0.00 0.00 57.07 56.81 2k8p s TYR 115 Cb -0.85 -1.62 0.05 0.00 -0.11 0.00 0.00 41.96 39.43 2k8p s TYR 115 CO 0.52 0.46 0.08 1.03 -1.11 0.00 0.00 175.55 176.52 2k8p s ARG 116 N -3.69 0.07 0.28 -0.62 0.52 0.91 -4.62 118.95 111.79 2k8p s ARG 116 Ca 0.34 0.04 -0.08 0.00 -0.52 0.00 0.00 55.73 55.51 2k8p s ARG 116 Cb -0.10 -1.44 -0.06 0.00 0.52 0.00 0.00 34.95 33.87 2k8p s ARG 116 CO 0.29 -0.56 0.58 0.00 0.02 0.00 0.00 175.30 175.63 2k8p s ALA 117 N 2.13 3.55 -0.02 2.13 0.00 -1.26 -2.16 121.76 126.13 2k8p s ALA 117 Ca 0.03 -0.35 0.01 0.00 0.00 0.00 0.00 51.96 51.64 2k8p s ALA 117 Cb -0.15 -2.43 0.01 0.00 0.00 0.00 0.00 23.12 20.55 2k8p s ALA 117 CO -0.07 0.34 -0.01 -1.14 0.00 0.00 0.00 175.76 174.88 2k8p s GLN 118 N -3.21 0.26 0.02 0.00 0.74 0.62 -4.93 119.66 113.16 2k8p s GLN 118 Ca 0.47 -0.01 -0.21 0.00 0.05 0.00 0.00 55.36 55.66 2k8p s GLN 118 Cb -0.11 -0.35 -0.06 0.00 1.10 0.00 0.00 33.01 33.60 2k8p s GLN 118 CO 0.25 -0.04 0.62 1.03 -0.55 0.00 0.00 175.29 176.61 2k8p s ARG 119 N 0.47 4.33 0.14 1.67 0.52 -1.26 -1.38 118.95 123.43 2k8p s ARG 119 Ca -0.04 0.79 0.09 0.00 -0.52 0.00 0.00 55.73 56.05 2k8p s ARG 119 Cb -0.07 -3.32 -0.04 0.00 0.52 0.00 0.00 34.95 32.04 2k8p s ARG 119 CO -0.01 0.42 -0.21 0.54 0.02 0.00 0.00 175.30 176.06 2k8p s VAL 120 N -0.40 1.90 -0.18 3.52 0.11 -0.57 -4.96 120.40 119.82 2k8p s VAL 120 Ca 0.32 -1.78 -0.07 0.00 -2.93 0.00 0.00 61.98 57.52 2k8p s VAL 120 Cb -0.19 -1.79 -0.04 0.00 -1.53 0.00 0.00 36.38 32.83 2k8p s VAL 120 CO 0.19 -0.15 0.04 -1.58 -3.33 0.00 0.00 175.10 170.27 2k8p s GLN 121 N -2.37 3.90 -0.11 1.54 0.74 -1.26 -0.76 119.66 121.35 2k8p s GLN 121 Ca 0.13 -0.38 0.01 0.00 0.05 0.00 0.00 55.36 55.16 2k8p s GLN 121 Cb -0.08 -3.16 -0.02 0.00 1.10 0.00 0.00 33.01 30.85 2k8p s GLN 121 CO 0.06 0.25 -0.13 -0.51 -0.55 0.00 0.00 175.29 174.41 2k8p s LEU 122 N 0.41 2.75 0.02 3.68 1.43 -0.94 -1.76 118.68 124.28 2k8p s LEU 122 Ca 0.02 -0.28 -0.10 0.00 -1.03 0.00 0.00 54.13 52.74 2k8p s LEU 122 Cb -0.13 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 2k8p s LEU 122 CO 0.01 0.22 0.35 -0.76 0.23 0.00 0.00 176.35 176.40 2k8p s LEU 123 N 0.02 4.39 0.16 1.79 2.01 0.81 0.03 118.68 127.89 2k8p s LEU 123 Ca -0.04 0.75 0.09 0.00 0.01 0.00 0.00 54.13 54.94 2k8p s LEU 123 Cb -0.14 -2.72 -0.04 0.00 0.01 0.00 0.00 46.19 43.29 2k8p s LEU 123 CO 0.04 0.25 -0.13 0.00 1.01 0.00 0.00 176.35 177.52 2k8p n PRO 125 N 0.28 -2.90 0.00 0.00 -0.04 -1.26 -4.15 135.00 126.93 2k8p n PRO 125 Ca -0.12 -1.52 0.00 0.00 -0.04 0.00 0.00 63.50 61.82 2k8p n PRO 125 Cb 0.55 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 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 -3.86 1.32 0.00 0.55 0.00 -1.26 -3.60 105.19 98.34 2k8p n GLY 126 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 0.38 3.32 -0.02 0.00 -1.26 -5.15 105.19 102.46 2k8p n GLY 127 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2k8p n GLY 127 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k8p n GLU 128 N 0.00 -0.58 -1.49 1.61 -0.58 -1.24 -4.94 120.64 113.42 2k8p n GLU 128 Ca 0.00 -0.14 -0.32 0.00 -0.42 0.00 0.00 57.16 56.28 2k8p n GLU 128 Cb 0.00 -1.69 0.07 0.00 -0.57 0.00 0.00 31.44 29.24 2k8p n GLU 128 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k8p s ALA 129 N -2.30 2.43 1.09 0.62 0.00 -1.26 -4.54 121.76 117.80 2k8p s ALA 129 Ca 0.54 0.30 -0.08 0.00 0.00 0.00 0.00 51.96 52.72 2k8p s ALA 129 Cb -0.17 -3.26 0.11 0.00 0.00 0.00 0.00 23.12 19.80 2k8p s ALA 129 CO 0.69 -1.47 0.41 -0.35 0.00 0.00 0.00 175.76 175.04 2k8p n PRO 130 N -3.08 -1.82 -3.18 0.00 -0.04 -1.26 -4.56 135.00 121.05 2k8p n PRO 130 Ca 0.09 -0.66 -0.12 0.00 -0.04 0.00 0.00 63.50 62.77 2k8p n PRO 130 Cb 0.53 -0.61 -0.04 0.00 -0.04 0.00 0.00 33.50 33.34 2k8p n PRO 130 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k8p n ARG 131 N -2.76 0.65 -3.79 0.54 1.74 0.10 -4.93 116.66 108.21 2k8p n ARG 131 Ca 0.06 -1.71 -0.26 0.00 -0.77 0.00 0.00 57.85 55.17 2k8p n ARG 131 Cb 0.22 1.02 -0.17 0.00 -1.02 0.00 0.00 32.46 32.52 2k8p n ARG 131 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k8p s ALA 132 N -2.58 0.99 -0.29 7.54 0.00 -1.26 -2.21 121.76 123.95 2k8p s ALA 132 Ca 0.12 -0.47 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 2k8p s ALA 132 Cb 0.01 -0.97 0.04 0.00 0.00 0.00 0.00 23.12 22.20 2k8p s ALA 132 CO 0.09 -0.74 -0.01 0.50 0.00 0.00 0.00 175.76 175.59 2k8p s ARG 133 N 1.85 2.62 -0.12 0.00 6.06 0.07 -4.93 118.95 124.50 2k8p s ARG 133 Ca 0.02 -1.14 -0.25 0.00 -2.50 0.00 0.00 55.73 51.87 2k8p s ARG 133 Cb -0.14 -3.15 -0.03 0.00 0.06 0.00 0.00 34.95 31.70 2k8p s ARG 133 CO -0.07 -0.54 0.78 0.21 -2.50 0.00 0.00 175.30 173.19 2k8p s LYS 134 N 1.30 4.37 -0.08 5.12 2.20 -1.26 -1.51 119.74 129.88 2k8p s LYS 134 Ca -0.03 0.98 0.04 0.00 -0.36 0.00 0.00 55.97 56.60 2k8p s LYS 134 Cb -0.19 -3.52 -0.01 0.00 -1.51 0.00 0.00 37.83 32.61 2k8p s LYS 134 CO -0.02 -0.15 -0.20 0.14 -0.36 0.00 0.00 175.35 174.76 2k8p s VAL 135 N 1.52 2.47 -0.50 4.02 -7.23 -0.48 -4.96 120.40 115.23 2k8p s VAL 135 Ca 0.39 -0.90 -0.16 0.00 -1.81 0.00 0.00 61.98 59.49 2k8p s VAL 135 Cb -0.17 -1.95 0.08 0.00 0.56 0.00 0.00 36.38 34.90 2k8p s VAL 135 CO 0.16 0.56 0.47 -0.60 -0.31 0.00 0.00 175.10 175.39 2k8p s ARG 136 N -0.07 3.01 0.02 4.82 3.52 -1.26 -0.28 118.95 128.70 2k8p s ARG 136 Ca -0.05 -1.34 0.04 0.00 -0.13 0.00 0.00 55.73 54.26 2k8p s ARG 136 Cb -0.14 -4.17 -0.03 0.00 -1.56 0.00 0.00 34.95 29.05 2k8p s ARG 136 CO 0.04 -1.15 -0.10 -0.51 -0.81 0.00 0.00 175.30 172.77 2k8p s LEU 137 N 1.87 3.00 0.35 -0.88 2.01 -0.92 -4.94 118.68 119.17 2k8p s LEU 137 Ca 0.06 -0.24 -0.28 0.00 0.01 0.00 0.00 54.13 53.69 2k8p s LEU 137 Cb -0.24 -1.74 -0.12 0.00 0.01 0.00 0.00 46.19 44.10 2k8p s LEU 137 CO 0.07 0.27 1.33 0.52 1.01 0.00 0.00 176.35 179.55 2k8p n VAL 138 N 1.52 1.98 -0.10 -1.59 0.31 -1.26 -0.06 118.33 119.12 2k8p n VAL 138 Ca -0.15 -0.49 -0.13 0.00 -0.01 0.00 0.00 64.34 63.55 2k8p n VAL 138 Cb 0.52 -1.65 -0.12 0.00 -0.91 0.00 0.00 33.84 31.69 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 0.39 1.53 -2.48 3.52 0.00 -0.43 -3.87 120.51 119.17 2k8p n ALA 139 Ca 0.04 -1.04 -0.17 0.00 0.00 0.00 0.00 53.44 52.27 2k8p n ALA 139 Cb 0.36 -0.06 -0.07 0.00 0.00 0.00 0.00 19.45 19.69 2k8p n ALA 139 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2k8p s SER 140 N -5.84 1.33 -0.26 0.00 0.01 -0.29 -4.98 113.70 103.67 2k8p s SER 140 Ca -0.23 -1.65 -0.23 0.00 1.31 0.00 0.00 55.95 55.16 2k8p s SER 140 Cb 0.07 0.58 0.07 0.00 0.21 0.00 0.00 66.02 66.95 2k8p s SER 140 CO 0.59 -1.12 0.68 0.00 0.41 0.00 0.00 173.24 173.80 2k8p s LYS 142 N 0.48 1.50 -0.28 0.00 1.02 -0.33 -4.92 119.74 117.21 2k8p s LYS 142 Ca -0.01 -1.48 0.03 0.00 0.02 0.00 0.00 55.97 54.53 2k8p s LYS 142 Cb -0.05 -1.87 0.07 0.00 -0.52 0.00 0.00 37.83 35.46 2k8p s LYS 142 CO -0.01 0.41 -0.06 0.00 -0.92 0.00 0.00 175.35 174.77 2k8p s LYS 144 N 1.08 0.84 0.66 0.00 2.20 -1.26 -4.94 119.74 118.32 2k8p s LYS 144 Ca -0.04 -0.68 -0.02 0.00 -0.36 0.00 0.00 55.97 54.87 2k8p s LYS 144 Cb -0.20 0.36 0.08 0.00 -1.51 0.00 0.00 37.83 36.56 2k8p s LYS 144 CO -0.05 -0.27 0.93 -0.98 -0.36 0.00 0.00 175.35 174.61 2k8p s ARG 145 N -3.11 2.06 0.16 4.03 1.70 -1.26 -4.29 118.95 118.24 2k8p s ARG 145 Ca -0.01 -0.78 -0.20 0.00 -0.47 0.00 0.00 55.73 54.27 2k8p s ARG 145 Cb 0.01 -2.34 0.07 0.00 -0.57 0.00 0.00 34.95 32.12 2k8p s ARG 145 CO -0.07 -1.17 0.94 1.28 -1.08 0.00 0.00 175.30 175.20 2k8p n LEU 146 N -2.71 0.00 -3.53 -1.89 4.77 -1.26 -4.87 117.00 107.51 2k8p n LEU 146 Ca 0.11 -1.32 0.00 0.00 -0.03 0.00 0.00 56.01 54.77 2k8p n LEU 146 Cb 0.60 2.54 -0.04 0.00 -2.33 0.00 0.00 43.42 44.20 2k8p n LEU 146 CO 0.46 -0.44 0.42 0.28 -1.33 0.00 0.00 177.39 176.77 2k8p s THR 147 N -2.11 -0.77 0.03 -5.08 -1.32 -1.26 -4.75 115.64 100.38 2k8p s THR 147 Ca 0.21 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 60.64 2k8p s THR 147 Cb -0.03 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.98 2k8p s THR 147 CO 0.05 0.00 0.24 -2.11 -2.21 0.00 0.00 174.62 170.59 2k8p n ARG 148 N 5.24 0.13 -3.63 7.08 1.85 -1.26 -5.18 116.66 120.88 2k8p n ARG 148 Ca -0.11 -0.31 -0.12 0.00 -1.00 0.00 0.00 57.85 56.32 2k8p n ARG 148 Cb 0.51 0.43 -0.07 0.00 -1.05 0.00 0.00 32.46 32.28 2k8p n ARG 148 CO 0.00 0.00 0.00 -0.59 -0.01 0.00 0.00 177.63 177.03 2k8p s PHE 149 N -4.78 -0.70 0.22 2.89 -0.71 -1.26 -5.18 117.98 108.46 2k8p s PHE 149 Ca 0.05 1.68 -0.22 0.00 -1.04 0.00 0.00 56.93 57.40 2k8p s PHE 149 Cb -0.01 0.33 0.04 0.00 -1.21 0.00 0.00 43.02 42.17 2k8p s PHE 149 CO 0.01 -0.34 0.67 -1.58 -1.34 0.00 0.00 175.22 172.64 2k8p s HIS 150 N 0.45 -0.34 -0.29 3.49 2.46 -1.26 -5.17 115.29 114.62 2k8p s HIS 150 Ca 0.00 -0.00 -0.15 0.00 0.47 0.00 0.00 55.06 55.38 2k8p s HIS 150 Cb -0.05 0.64 0.13 0.00 -0.13 0.00 0.00 32.58 33.17 2k8p s HIS 150 CO -0.03 -1.05 0.86 1.21 -2.47 0.00 0.00 174.74 173.25 2k8p s ASN 151 N -2.84 -0.74 -0.04 9.88 2.47 -1.26 -5.17 114.94 117.24 2k8p s ASN 151 Ca 0.07 1.10 -0.09 0.00 0.42 0.00 0.00 52.86 54.35 2k8p s ASN 151 Cb -0.04 1.56 0.02 0.00 -1.45 0.00 0.00 41.25 41.34 2k8p s ASN 151 CO -0.02 -0.16 0.22 -1.58 -3.72 0.00 0.00 177.10 171.83 2k8p s GLN 152 N 1.96 0.43 -0.27 0.43 0.74 -1.26 -5.15 119.66 116.54 2k8p s GLN 152 Ca -0.07 -0.04 -0.05 0.00 0.05 0.00 0.00 55.36 55.25 2k8p s GLN 152 Cb -0.06 0.19 0.15 0.00 1.10 0.00 0.00 33.01 34.39 2k8p s GLN 152 CO -0.17 -0.09 0.54 0.45 -0.55 0.00 0.00 175.29 175.47 2k8p s SER 153 N -0.71 -0.83 -0.13 6.67 0.15 -1.26 -5.15 113.70 112.44 2k8p s SER 153 Ca -0.08 0.99 -0.08 0.00 0.70 0.00 0.00 55.95 57.48 2k8p s SER 153 Cb -0.04 1.88 0.05 0.00 -1.71 0.00 0.00 66.02 66.19 2k8p s SER 153 CO 0.02 -0.25 0.33 -1.61 1.20 0.00 0.00 173.24 172.92 2k8p s GLU 154 N 2.77 0.31 -0.27 5.44 2.02 -1.26 -5.14 118.70 122.58 2k8p s GLU 154 Ca 0.08 0.61 -0.03 0.00 0.02 0.00 0.00 54.97 55.65 2k8p s GLU 154 Cb -0.14 -0.02 0.15 0.00 0.10 0.00 0.00 34.13 34.23 2k8p s GLU 154 CO -0.18 -0.14 0.49 -1.17 0.02 0.00 0.00 175.26 174.28 2k8p s LEU 155 N 1.08 -0.98 0.10 1.80 0.20 -1.26 -5.16 118.68 114.46 2k8p s LEU 155 Ca -0.07 0.64 -0.04 0.00 0.69 0.00 0.00 54.13 55.35 2k8p s LEU 155 Cb -0.08 1.64 -0.05 0.00 -0.43 0.00 0.00 46.19 47.27 2k8p s LEU 155 CO -0.08 -0.27 0.31 -0.54 -0.29 0.00 0.00 176.35 175.48 2k8p s LYS 156 N 2.70 3.57 -0.27 1.98 1.02 -1.26 -5.09 119.74 122.39 2k8p s LYS 156 Ca 0.14 -0.18 -0.02 0.00 0.02 0.00 0.00 55.97 55.93 2k8p s LYS 156 Cb -0.15 -2.94 0.15 0.00 -0.52 0.00 0.00 37.83 34.37 2k8p s LYS 156 CO -0.18 0.54 0.48 0.34 -0.92 0.00 0.00 175.35 175.61 2k8p s ASP 157 N -2.32 -0.52 -0.17 2.83 -1.08 -1.26 -5.14 116.67 109.02 2k8p s ASP 157 Ca 0.37 0.59 -0.06 0.00 -0.52 0.00 0.00 52.55 52.93 2k8p s ASP 157 Cb -0.13 1.61 0.08 0.00 -1.46 0.00 0.00 42.92 43.02 2k8p s ASP 157 CO 0.24 -0.28 0.35 -0.36 0.52 0.00 0.00 175.17 175.64 2k8p s PHE 158 N 2.69 -0.62 -0.35 -5.34 0.08 -1.26 -5.08 117.98 108.10 2k8p s PHE 158 Ca 0.15 1.26 -0.05 0.00 0.12 0.00 0.00 56.93 58.41 2k8p s PHE 158 Cb -0.15 0.15 0.23 0.00 -0.57 0.00 0.00 43.02 42.68 2k8p s PHE 158 CO -0.18 -0.42 1.10 0.41 -0.10 0.00 0.00 175.22 176.04 2k8p n GLY 159 N 5.29 -1.60 2.72 4.36 0.00 -1.26 -5.12 105.19 109.58 2k8p n GLY 159 Ca -0.09 1.15 -0.29 0.00 0.00 0.00 0.00 46.02 46.79 2k8p n GLY 159 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k8p s THR 160 N 0.79 0.75 -0.01 2.61 2.01 -1.26 -5.11 115.64 115.42 2k8p s THR 160 Ca 0.25 -1.21 -0.02 0.00 0.31 0.00 0.00 61.69 61.02 2k8p s THR 160 Cb 0.14 -1.51 -0.00 0.00 0.01 0.00 0.00 72.50 71.13 2k8p s THR 160 CO -0.10 -0.60 0.04 -1.83 -0.69 0.00 0.00 174.62 171.44 2k8p s GLU 161 N 1.69 0.18 -0.23 4.92 -1.05 -1.26 -5.16 118.70 117.79 2k8p s GLU 161 Ca 0.08 -0.18 -0.26 0.00 -0.15 0.00 0.00 54.97 54.46 2k8p s GLU 161 Cb -0.17 0.07 0.10 0.00 -0.44 0.00 0.00 34.13 33.69 2k8p s GLU 161 CO -0.23 -0.03 0.86 0.00 0.95 0.00 0.00 175.26 176.80 2k8p s ALA 162 N -0.56 -1.87 -0.10 -0.84 0.00 -1.26 -5.18 121.76 111.96 2k8p s ALA 162 Ca -0.06 1.84 -0.19 0.00 0.00 0.00 0.00 51.96 53.54 2k8p s ALA 162 Cb -0.04 -1.08 0.04 0.00 0.00 0.00 0.00 23.12 22.05 2k8p s ALA 162 CO -0.00 -0.30 0.47 0.00 0.00 0.00 0.00 175.76 175.92 2k8p s ALA 163 N -0.03 -1.18 -0.46 0.00 0.00 -1.26 -5.10 121.76 113.74 2k8p s ALA 163 Ca -0.00 1.00 0.08 0.00 0.00 0.00 0.00 51.96 53.04 2k8p s ALA 163 Cb -0.04 -0.33 0.26 0.00 0.00 0.00 0.00 23.12 23.01 2k8p s ALA 163 CO -0.00 -0.27 0.61 -2.13 0.00 0.00 0.00 175.76 173.97 2k8p n ARG 164 N 1.88 1.28 -2.21 0.00 0.63 -1.26 -5.11 116.66 111.87 2k8p n ARG 164 Ca -0.17 -3.65 -0.42 0.00 -0.92 0.00 0.00 57.85 52.69 2k8p n ARG 164 Cb 0.56 -1.55 -0.03 0.00 0.45 0.00 0.00 32.46 31.89 2k8p n ARG 164 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2k8p s PRO 165 N -1.71 4.37 -0.30 -0.14 0.04 -1.26 -5.00 135.00 130.99 2k8p s PRO 165 Ca 0.37 2.04 -0.15 0.00 0.04 0.00 0.00 61.00 63.31 2k8p s PRO 165 Cb 0.19 -3.22 0.18 0.00 0.04 0.00 0.00 34.50 31.69 2k8p s PRO 165 CO -0.08 -0.31 1.07 -1.14 0.04 0.00 0.00 177.00 176.58 2k8p s GLN 166 N 0.31 0.20 -0.03 4.56 0.74 -1.26 -5.18 119.66 119.00 2k8p s GLN 166 Ca 0.59 0.46 -0.30 0.00 0.05 0.00 0.00 55.36 56.15 2k8p s GLN 166 Cb -0.36 0.27 0.11 0.00 1.10 0.00 0.00 33.01 34.13 2k8p s GLN 166 CO 0.35 -0.12 1.13 0.21 -0.55 0.00 0.00 175.29 176.31 2k8p s LYS 167 N 2.53 0.60 0.00 1.67 2.20 -1.26 -5.13 119.74 120.35 2k8p s LYS 167 Ca -0.01 -0.29 0.00 0.00 -0.36 0.00 0.00 55.97 55.31 2k8p s LYS 167 Cb -0.06 0.23 0.00 0.00 -1.51 0.00 0.00 37.83 36.49 2k8p s LYS 167 CO -0.15 -0.27 0.00 0.41 -0.36 0.00 0.00 175.35 174.98 2k8p n GLY 168 N -0.32 0.63 3.30 5.54 0.00 -1.26 -5.15 105.19 107.93 2k8p n GLY 168 Ca -0.05 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.11 2k8p n GLY 168 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8p s ARG 169 N -0.16 0.40 0.11 1.61 0.52 -1.26 -5.17 118.95 115.00 2k8p s ARG 169 Ca 0.00 0.90 0.02 0.00 -0.52 0.00 0.00 55.73 56.13 2k8p s ARG 169 Cb 0.00 0.10 -0.04 0.00 0.52 0.00 0.00 34.95 35.53 2k8p s ARG 169 CO 0.00 -0.19 -0.06 0.15 0.02 0.00 0.00 175.30 175.23 2k8p s LYS 170 N 1.79 0.89 1.23 3.54 1.02 -1.26 -5.17 119.74 121.78 2k8p s LYS 170 Ca -0.07 -1.37 -0.20 0.00 0.02 0.00 0.00 55.97 54.34 2k8p s LYS 170 Cb -0.09 -0.24 0.30 0.00 -0.52 0.00 0.00 37.83 37.28 2k8p s LYS 170 CO -0.13 -0.03 1.11 -1.25 -0.92 0.00 0.00 175.35 174.13 2k8p s PRO 171 N -3.84 -1.44 -0.42 -1.68 0.04 -1.26 -5.05 135.00 121.35 2k8p s PRO 171 Ca 0.14 -0.14 0.07 0.00 0.04 0.00 0.00 61.00 61.11 2k8p s PRO 171 Cb 0.05 -1.58 0.25 0.00 0.04 0.00 0.00 34.50 33.26 2k8p s PRO 171 CO -0.03 -3.84 0.63 -2.13 0.04 0.00 0.00 177.00 171.66 2k8p n ARG 172 N -4.84 0.73 -1.17 4.56 3.00 -1.26 -5.14 116.66 112.55 2k8p n ARG 172 Ca 0.14 -2.80 -0.29 0.00 -0.00 0.00 0.00 57.85 54.90 2k8p n ARG 172 Cb 0.60 -1.29 0.17 0.00 0.00 0.00 0.00 32.46 31.94 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k8p s PRO 173 N -0.66 0.55 0.04 -0.14 0.04 -1.26 -5.08 135.00 128.48 2k8p s PRO 173 Ca 0.34 0.58 0.01 0.00 0.04 0.00 0.00 61.00 61.97 2k8p s PRO 173 Cb 0.19 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.96 2k8p s PRO 173 CO -0.15 -2.66 -0.06 -0.98 0.04 0.00 0.00 177.00 173.19 2k8p s ARG 174 N -4.95 0.46 -0.28 4.56 1.70 -1.26 -5.13 118.95 114.04 2k8p s ARG 174 Ca 0.65 -0.72 -0.03 0.00 -0.47 0.00 0.00 55.73 55.16 2k8p s ARG 174 Cb -0.19 -0.14 0.11 0.00 -0.57 0.00 0.00 34.95 34.16 2k8p s ARG 174 CO 0.58 0.01 0.17 0.00 -1.08 0.00 0.00 175.30 174.98 2k8p s ALA 175 N -1.49 0.32 0.27 7.88 0.00 -1.26 -5.13 121.76 122.34 2k8p s ALA 175 Ca -0.12 -0.83 -0.09 0.00 0.00 0.00 0.00 51.96 50.93 2k8p s ALA 175 Cb -0.09 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.54 2k8p s ALA 175 CO -0.00 -1.63 0.44 -0.98 0.00 0.00 0.00 175.76 173.58 2k8p s ARG 176 N 2.17 1.60 -0.27 0.00 1.70 -1.26 -5.18 118.95 117.71 2k8p s ARG 176 Ca 0.09 -1.42 -0.27 0.00 -0.47 0.00 0.00 55.73 53.66 2k8p s ARG 176 Cb -0.15 0.44 0.17 0.00 -0.57 0.00 0.00 34.95 34.84 2k8p s ARG 176 CO -0.34 -0.65 1.29 0.45 -1.08 0.00 0.00 175.30 174.97 2k8p s SER 177 N -3.09 -0.16 0.29 -2.89 0.15 -1.26 -5.18 113.70 101.57 2k8p s SER 177 Ca 0.26 0.25 0.10 0.00 0.70 0.00 0.00 55.95 57.27 2k8p s SER 177 Cb 0.00 0.24 -0.05 0.00 -1.71 0.00 0.00 66.02 64.50 2k8p s SER 177 CO 0.12 -0.09 -0.15 0.00 1.20 0.00 0.00 173.24 174.32 2k8p s ALA 178 N -0.39 2.70 0.27 5.45 0.00 -1.26 -5.16 121.76 123.38 2k8p s ALA 178 Ca 0.06 -1.92 -0.04 0.00 0.00 0.00 0.00 51.96 50.05 2k8p s ALA 178 Cb -0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 2k8p s ALA 178 CO -0.10 0.17 0.35 0.21 0.00 0.00 0.00 175.76 176.39 2k8p s LYS 179 N -3.57 1.57 0.40 0.00 2.20 -1.26 -5.19 119.74 113.88 2k8p s LYS 179 Ca 0.30 -1.58 0.03 0.00 -0.36 0.00 0.00 55.97 54.36 2k8p s LYS 179 Cb -0.01 0.39 -0.03 0.00 -1.51 0.00 0.00 37.83 36.66 2k8p s LYS 179 CO 0.14 -0.61 0.09 0.00 -0.36 0.00 0.00 175.35 174.62 2k8p s ALA 180 N -3.73 2.90 0.00 3.13 0.00 -1.26 -5.08 121.76 117.73 2k8p s ALA 180 Ca 0.32 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.90 2k8p s ALA 180 Cb 0.02 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.78 2k8p s ALA 180 CO 0.15 -0.29 0.00 -1.71 0.00 0.00 0.00 175.76 173.91 2k8p n ASN 181 N -1.13 -0.00 -2.82 0.00 5.15 -1.26 -5.12 115.26 110.08 2k8p n ASN 181 Ca -0.06 0.01 -0.01 0.00 -0.60 0.00 0.00 54.58 53.91 2k8p n ASN 181 Cb 0.66 0.02 -0.01 0.00 -0.53 0.00 0.00 39.78 39.92 2k8p n ASN 181 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k8p n GLN 182 N -2.51 -2.88 -3.62 1.20 6.02 -1.26 -5.04 117.38 109.29 2k8p n GLN 182 Ca 0.00 2.40 -0.21 0.00 -0.01 0.00 0.00 57.00 59.18 2k8p n GLN 182 Cb 0.00 -4.28 -0.16 0.00 1.02 0.00 0.00 30.24 26.82 2k8p n GLN 182 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k8p s ALA 183 N -1.34 0.09 0.12 -1.58 0.00 -1.26 -5.15 121.76 112.64 2k8p s ALA 183 Ca -0.03 0.16 0.05 0.00 0.00 0.00 0.00 51.96 52.14 2k8p s ALA 183 Cb 0.00 -0.91 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 2k8p s ALA 183 CO 0.60 -0.83 -0.12 -1.83 0.00 0.00 0.00 175.76 173.58 2k8p s GLU 184 N 2.22 0.98 -0.39 0.00 1.03 -1.26 -5.08 118.70 116.21 2k8p s GLU 184 Ca 0.04 -1.28 0.11 0.00 0.03 0.00 0.00 54.97 53.87 2k8p s GLU 184 Cb -0.14 -0.71 0.37 0.00 -0.80 0.00 0.00 34.13 32.85 2k8p s GLU 184 CO -0.07 0.12 0.94 1.28 -1.33 0.00 0.00 175.26 176.20 2k8p n LEU 185 N 0.32 -0.15 -4.91 1.83 4.32 -1.26 -5.13 117.00 112.03 2k8p n LEU 185 Ca -0.14 -4.26 -0.28 0.00 -0.02 0.00 0.00 56.01 51.31 2k8p n LEU 185 Cb 0.58 0.64 -0.03 0.00 -1.62 0.00 0.00 43.42 43.00 2k8p n LEU 185 CO 0.28 2.05 0.24 -0.70 -1.22 0.00 0.00 177.39 178.05 2k8p s GLU 186 N -1.60 3.61 -0.30 3.23 2.12 -1.26 -5.09 118.70 119.41 2k8p s GLU 186 Ca 0.31 0.01 -0.17 0.00 0.36 0.00 0.00 54.97 55.48 2k8p s GLU 186 Cb 0.36 -2.60 0.19 0.00 0.26 0.00 0.00 34.13 32.35 2k8p s GLU 186 CO -0.05 0.14 1.20 1.21 -0.54 0.00 0.00 175.26 177.21 2k8p s ASN 187 N -3.40 -0.18 0.03 -1.70 2.47 -1.26 -5.19 114.94 105.71 2k8p s ASN 187 Ca 0.44 0.28 -0.12 0.00 0.42 0.00 0.00 52.86 53.88 2k8p s ASN 187 Cb -0.10 1.13 0.04 0.00 -1.45 0.00 0.00 41.25 40.86 2k8p s ASN 187 CO 0.33 -0.04 0.57 0.00 -3.72 0.00 0.00 177.10 174.24 2k8p n ALA 188 N 3.72 -1.57 1.94 1.71 0.00 -1.26 -5.37 120.51 119.67 2k8p n ALA 188 Ca -0.14 -0.44 0.15 0.00 0.00 0.00 0.00 53.44 53.02 2k8p n ALA 188 Cb 0.56 0.16 0.92 0.00 0.00 0.00 0.00 19.45 21.09 2k8p n ALA 188 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48