#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 2.35 0.05 1.61 1.48 -1.26 -5.14 118.94 118.04 2k8p s TRP 2 Ca 0.00 -0.41 0.00 0.00 -1.06 0.00 0.00 56.10 54.64 2k8p s TRP 2 Cb 0.00 -1.45 -0.03 0.00 -1.16 0.00 0.00 33.47 30.83 2k8p s TRP 2 CO 0.00 0.07 -0.04 -0.65 -4.06 0.00 0.00 176.95 172.26 2k8p s GLN 3 N -0.97 0.59 0.53 3.25 -0.21 -1.26 -5.17 119.66 116.41 2k8p s GLN 3 Ca 0.11 -1.07 0.02 0.00 0.02 0.00 0.00 55.36 54.44 2k8p s GLN 3 Cb -0.10 0.06 0.01 0.00 1.00 0.00 0.00 33.01 33.97 2k8p s GLN 3 CO 0.01 -0.06 0.14 0.00 -2.12 0.00 0.00 175.29 173.26 2k8p s ALA 4 N -3.11 4.27 -0.08 6.09 0.00 -1.26 -5.16 121.76 122.51 2k8p s ALA 4 Ca 0.02 -0.61 -0.04 0.00 0.00 0.00 0.00 51.96 51.33 2k8p s ALA 4 Cb 0.02 -0.24 0.04 0.00 0.00 0.00 0.00 23.12 22.93 2k8p s ALA 4 CO -0.06 -0.17 0.19 -0.06 0.00 0.00 0.00 175.76 175.66 2k8p s PHE 5 N -2.85 -0.23 -0.26 0.00 0.40 -1.26 -5.13 117.98 108.65 2k8p s PHE 5 Ca 0.14 0.60 -0.01 0.00 -0.60 0.00 0.00 56.93 57.06 2k8p s PHE 5 Cb -0.00 -0.01 0.14 0.00 0.51 0.00 0.00 43.02 43.65 2k8p s PHE 5 CO 0.09 -0.18 0.36 -1.59 0.70 0.00 0.00 175.22 174.59 2k8p s LYS 6 N 1.06 0.34 -0.10 0.44 0.00 -1.26 -5.13 119.74 115.09 2k8p s LYS 6 Ca -0.08 0.32 -0.00 0.00 0.00 0.00 0.00 55.97 56.21 2k8p s LYS 6 Cb -0.10 -0.54 0.02 0.00 0.00 0.00 0.00 37.83 37.22 2k8p s LYS 6 CO -0.06 -0.78 -0.06 0.54 0.00 0.00 0.00 175.35 174.98 2k8p s ASN 7 N 2.50 1.95 -0.33 0.03 4.22 -1.26 -5.07 114.94 116.98 2k8p s ASN 7 Ca 0.11 -0.25 -0.07 0.00 -2.14 0.00 0.00 52.86 50.52 2k8p s ASN 7 Cb -0.15 -0.73 0.19 0.00 1.28 0.00 0.00 41.25 41.84 2k8p s ASN 7 CO -0.21 -0.12 0.97 -1.81 -2.04 0.00 0.00 177.10 173.90 2k8p s ASP 8 N 1.63 -0.55 -1.13 3.54 1.01 -1.26 -5.06 116.67 114.85 2k8p s ASP 8 Ca 0.02 -0.20 -0.04 0.00 0.71 0.00 0.00 52.55 53.05 2k8p s ASP 8 Cb -0.13 0.85 0.26 0.00 1.01 0.00 0.00 42.92 44.91 2k8p s ASP 8 CO -0.06 -0.07 1.85 0.00 0.21 0.00 0.00 175.17 177.10 2k8p n ALA 9 N 4.12 5.90 -3.82 5.23 0.00 -1.26 -4.86 120.51 125.83 2k8p n ALA 9 Ca 0.07 -4.53 -0.29 0.00 0.00 0.00 0.00 53.44 48.69 2k8p n ALA 9 Cb 0.61 -2.43 -0.13 0.00 0.00 0.00 0.00 19.45 17.50 2k8p n ALA 9 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2k8p s THR 10 N -2.82 2.13 0.36 0.00 -4.23 -1.26 -5.10 115.64 104.72 2k8p s THR 10 Ca 0.40 -3.29 0.05 0.00 -1.18 0.00 0.00 61.69 57.66 2k8p s THR 10 Cb 0.14 -2.45 0.05 0.00 1.34 0.00 0.00 72.50 71.58 2k8p s THR 10 CO -0.04 -0.92 0.39 -0.62 -0.54 0.00 0.00 174.62 172.89 2k8p n GLU 11 N 2.91 0.86 -3.45 3.99 1.02 -1.26 -5.08 120.64 119.62 2k8p n GLU 11 Ca 0.12 -2.10 -0.43 0.00 -0.02 0.00 0.00 57.16 54.73 2k8p n GLU 11 Cb 0.35 0.03 -0.06 0.00 -0.02 0.00 0.00 31.44 31.74 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 -1.52 4.79 -0.58 -3.67 1.09 -1.26 -4.96 121.20 115.10 2k8p s ILE 12 Ca 0.30 -2.08 0.06 0.00 -1.10 0.00 0.00 60.65 57.83 2k8p s ILE 12 Cb -0.02 -4.06 0.23 0.00 -1.06 0.00 0.00 42.46 37.55 2k8p s ILE 12 CO 0.19 -0.89 0.64 -0.38 -0.10 0.00 0.00 174.94 174.40 2k8p n ILE 13 N 4.52 1.36 -2.18 2.92 -0.00 -1.26 -5.09 119.36 119.64 2k8p n ILE 13 Ca -0.01 -4.80 -0.42 0.00 -0.00 0.00 0.00 62.75 57.52 2k8p n ILE 13 Cb 0.42 -2.05 -0.03 0.00 -0.00 0.00 0.00 39.64 37.98 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 -1.91 4.28 0.00 0.38 0.04 -1.26 -5.01 135.00 131.53 2k8p s PRO 14 Ca 0.36 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2k8p s PRO 14 Cb 0.12 -3.51 0.00 0.00 0.04 0.00 0.00 34.50 31.16 2k8p s PRO 14 CO -0.07 -0.56 0.00 0.39 0.04 0.00 0.00 177.00 176.80 2k8p n GLU 15 N 5.09 2.80 -1.70 4.56 1.02 -1.26 -5.10 120.64 126.05 2k8p n GLU 15 Ca 0.13 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.84 2k8p n GLU 15 Cb 0.43 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.83 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 0.00 3.62 -2.74 -4.62 0.00 -1.26 -4.93 117.00 107.06 2k8p n LEU 16 Ca 0.00 1.14 -0.09 0.00 0.00 0.00 0.00 56.01 57.06 2k8p n LEU 16 Cb 0.00 -1.50 0.08 0.00 0.00 0.00 0.00 43.42 42.01 2k8p n LEU 16 CO 0.00 -0.22 0.28 0.61 0.00 0.00 0.00 177.39 178.06 2k8p n GLY 17 N 2.22 1.41 3.20 -3.96 0.00 -1.26 -5.12 105.19 101.68 2k8p n GLY 17 Ca 0.11 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 2k8p n GLY 17 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k8p s GLU 18 N -0.67 1.22 -0.64 1.61 -1.05 -1.26 -5.09 118.70 112.82 2k8p s GLU 18 Ca 0.25 -0.83 0.06 0.00 -0.15 0.00 0.00 54.97 54.29 2k8p s GLU 18 Cb 0.38 -1.27 0.23 0.00 -0.44 0.00 0.00 34.13 33.02 2k8p s GLU 18 CO -0.05 0.33 0.66 0.66 0.95 0.00 0.00 175.26 177.80 2k8p n TYR 19 N 1.97 3.22 -2.06 4.83 4.02 -1.26 -5.02 117.16 122.85 2k8p n TYR 19 Ca -0.17 -4.15 -0.28 0.00 -0.01 0.00 0.00 57.90 53.29 2k8p n TYR 19 Cb 0.54 -0.55 -0.06 0.00 -0.02 0.00 0.00 39.34 39.25 2k8p n TYR 19 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2k8p s PRO 20 N -2.08 2.49 -0.60 -0.72 0.04 -1.26 -4.80 135.00 128.08 2k8p s PRO 20 Ca 0.35 -1.09 0.06 0.00 0.04 0.00 0.00 61.00 60.37 2k8p s PRO 20 Cb 0.10 -5.23 0.23 0.00 0.04 0.00 0.00 34.50 29.64 2k8p s PRO 20 CO -0.06 -3.94 0.63 0.39 0.04 0.00 0.00 177.00 174.05 2k8p n GLU 21 N 8.33 1.92 -1.18 4.56 1.02 -1.26 -5.10 120.64 128.93 2k8p n GLU 21 Ca 0.44 -4.29 -0.29 0.00 -0.02 0.00 0.00 57.16 53.01 2k8p n GLU 21 Cb 0.47 -2.04 0.16 0.00 -0.02 0.00 0.00 31.44 30.00 2k8p n GLU 21 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2k8p s PRO 22 N -1.89 0.74 0.96 3.49 0.04 -1.26 -5.04 135.00 132.05 2k8p s PRO 22 Ca 0.36 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.91 2k8p s PRO 22 Cb 0.11 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.05 2k8p s PRO 22 CO -0.07 -2.55 1.09 -1.25 0.04 0.00 0.00 177.00 174.26 2k8p s PRO 23 N -4.95 0.74 1.14 0.56 0.04 -1.26 -5.04 135.00 126.23 2k8p s PRO 23 Ca 0.65 0.64 -0.17 0.00 0.04 0.00 0.00 61.00 62.15 2k8p s PRO 23 Cb -0.18 -1.76 0.26 0.00 0.04 0.00 0.00 34.50 32.85 2k8p s PRO 23 CO 0.57 -2.55 1.10 -1.25 0.04 0.00 0.00 177.00 174.92 2k8p s PRO 24 N -4.95 -0.71 -0.30 0.56 0.04 -1.26 -5.03 135.00 123.35 2k8p s PRO 24 Ca 0.65 0.12 0.16 0.00 0.04 0.00 0.00 61.00 61.97 2k8p s PRO 24 Cb -0.18 -1.64 0.43 0.00 0.04 0.00 0.00 34.50 33.15 2k8p s PRO 24 CO 0.57 -3.41 1.39 -0.85 0.04 0.00 0.00 177.00 174.74 2k8p n GLU 25 N -4.58 1.42 -2.19 4.56 0.28 -1.26 -4.94 120.64 113.93 2k8p n GLU 25 Ca 0.10 -1.94 -0.23 0.00 -0.16 0.00 0.00 57.16 54.93 2k8p n GLU 25 Cb 0.59 -0.22 0.02 0.00 1.43 0.00 0.00 31.44 33.25 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 -1.17 4.57 -4.84 -1.84 4.32 -1.26 -5.06 117.00 111.71 2k8p n LEU 26 Ca -0.10 -4.70 -0.33 0.00 -0.02 0.00 0.00 56.01 50.86 2k8p n LEU 26 Cb 0.85 -0.29 -0.06 0.00 -1.62 0.00 0.00 43.42 42.30 2k8p n LEU 26 CO -0.08 2.05 0.43 -1.61 -1.22 0.00 0.00 177.39 176.95 2k8p s GLU 27 N -3.59 4.06 -0.30 3.23 2.02 -1.26 -5.06 118.70 117.79 2k8p s GLU 27 Ca 0.48 0.73 -0.08 0.00 0.02 0.00 0.00 54.97 56.12 2k8p s GLU 27 Cb 0.40 -2.49 0.18 0.00 0.10 0.00 0.00 34.13 32.32 2k8p s GLU 27 CO -0.01 0.19 0.90 1.21 0.02 0.00 0.00 175.26 177.56 2k8p s ASN 28 N -2.16 -0.78 -0.48 -0.19 2.47 -1.26 -5.12 114.94 107.41 2k8p s ASN 28 Ca 0.53 0.37 -0.23 0.00 0.42 0.00 0.00 52.86 53.95 2k8p s ASN 28 Cb -0.11 1.61 0.03 0.00 -1.45 0.00 0.00 41.25 41.33 2k8p s ASN 28 CO 0.18 -0.14 0.82 0.20 -3.72 0.00 0.00 177.10 174.43 2k8p s ASN 29 N 2.92 6.38 -0.03 -4.21 0.01 -1.26 -5.00 114.94 113.74 2k8p s ASN 29 Ca 0.10 -0.24 -0.25 0.00 -0.71 0.00 0.00 52.86 51.76 2k8p s ASN 29 Cb -0.10 -2.39 0.05 0.00 0.41 0.00 0.00 41.25 39.22 2k8p s ASN 29 CO -0.17 -1.00 0.55 -0.54 -1.51 0.00 0.00 177.10 174.43 2k8p s LYS 30 N 3.42 0.93 -0.30 -0.60 3.01 -1.26 -5.14 119.74 119.80 2k8p s LYS 30 Ca 0.29 0.09 -0.10 0.00 -1.01 0.00 0.00 55.97 55.24 2k8p s LYS 30 Cb -0.13 0.43 0.18 0.00 -1.01 0.00 0.00 37.83 37.31 2k8p s LYS 30 CO 0.21 -0.28 0.99 0.95 0.51 0.00 0.00 175.35 177.73 2k8p s THR 31 N -1.28 -0.35 -0.08 2.17 -4.23 -1.26 -5.15 115.64 105.46 2k8p s THR 31 Ca -0.12 0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.36 2k8p s THR 31 Cb -0.02 -0.49 0.04 0.00 1.34 0.00 0.00 72.50 73.37 2k8p s THR 31 CO 0.08 0.00 0.14 -0.04 -0.54 0.00 0.00 174.62 174.26 2k8p s MET 32 N 2.94 0.02 0.03 3.99 -1.94 -1.26 -5.14 119.30 117.94 2k8p s MET 32 Ca 0.20 0.51 -0.29 0.00 -1.71 0.00 0.00 55.69 54.40 2k8p s MET 32 Cb -0.05 -0.30 0.10 0.00 2.01 0.00 0.00 34.83 36.60 2k8p s MET 32 CO -0.21 -0.29 1.10 0.54 -0.01 0.00 0.00 175.02 176.15 2k8p s ASN 33 N 2.14 -0.15 -0.02 3.03 4.22 -1.26 -5.19 114.94 117.72 2k8p s ASN 33 Ca 0.02 -0.21 -0.27 0.00 -2.14 0.00 0.00 52.86 50.27 2k8p s ASN 33 Cb -0.12 0.31 0.06 0.00 1.28 0.00 0.00 41.25 42.78 2k8p s ASN 33 CO -0.05 -0.56 0.59 0.00 -2.04 0.00 0.00 177.10 175.03 2k8p s ARG 34 N -2.84 1.00 0.02 3.55 1.70 -1.26 -5.18 118.95 115.94 2k8p s ARG 34 Ca 0.12 0.07 0.00 0.00 -0.47 0.00 0.00 55.73 55.45 2k8p s ARG 34 Cb 0.01 0.46 -0.02 0.00 -0.57 0.00 0.00 34.95 34.83 2k8p s ARG 34 CO -0.02 -0.32 -0.03 0.00 -1.08 0.00 0.00 175.30 173.84 2k8p s ALA 35 N -1.51 0.14 0.21 7.88 0.00 -1.26 -5.17 121.76 122.04 2k8p s ALA 35 Ca -0.10 -0.60 -0.05 0.00 0.00 0.00 0.00 51.96 51.21 2k8p s ALA 35 Cb -0.01 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 2k8p s ALA 35 CO 0.06 -0.15 0.24 -2.00 0.00 0.00 0.00 175.76 173.91 2k8p s GLU 36 N -1.46 1.28 0.11 0.00 2.12 -1.26 -5.18 118.70 114.31 2k8p s GLU 36 Ca -0.16 -1.46 -0.01 0.00 0.36 0.00 0.00 54.97 53.70 2k8p s GLU 36 Cb -0.10 0.34 -0.04 0.00 0.26 0.00 0.00 34.13 34.59 2k8p s GLU 36 CO -0.01 -0.46 0.04 1.21 -0.54 0.00 0.00 175.26 175.50 2k8p s ASN 37 N -3.09 0.36 -0.32 -1.70 2.47 -1.26 -5.13 114.94 106.27 2k8p s ASN 37 Ca 0.31 -1.16 -0.09 0.00 0.42 0.00 0.00 52.86 52.34 2k8p s ASN 37 Cb 0.04 0.27 0.20 0.00 -1.45 0.00 0.00 41.25 40.31 2k8p s ASN 37 CO 0.09 -0.70 1.09 -0.83 -3.72 0.00 0.00 177.10 173.03 2k8p s GLY 38 N -3.02 -1.70 -0.38 1.21 0.00 -1.26 -5.12 107.32 97.05 2k8p s GLY 38 Ca 0.20 1.09 0.05 0.00 0.00 0.00 0.00 44.72 46.06 2k8p s GLY 38 CO -0.01 4.34 0.45 -0.32 0.00 0.00 0.00 173.10 177.57 2k8p s GLY 39 N 1.62 -0.39 -0.42 0.20 0.00 -1.26 -5.05 107.32 102.03 2k8p s GLY 39 Ca 0.18 -0.63 0.07 0.00 0.00 0.00 0.00 44.72 44.33 2k8p s GLY 39 CO -0.14 3.02 0.58 -2.13 0.00 0.00 0.00 173.10 174.43 2k8p n ARG 40 N 4.27 0.63 -1.18 2.90 3.00 -1.26 -5.14 116.66 119.89 2k8p n ARG 40 Ca 0.11 -2.86 -0.29 0.00 -0.00 0.00 0.00 57.85 54.81 2k8p n ARG 40 Cb 0.49 -1.34 0.16 0.00 0.00 0.00 0.00 32.46 31.76 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 -0.52 0.74 0.21 -0.14 0.04 -1.26 -4.99 135.00 129.08 2k8p s PRO 41 Ca 0.34 0.64 -0.30 0.00 0.04 0.00 0.00 61.00 61.71 2k8p s PRO 41 Cb 0.15 -1.76 -0.09 0.00 0.04 0.00 0.00 34.50 32.84 2k8p s PRO 41 CO -0.15 -2.55 1.30 -1.25 0.04 0.00 0.00 177.00 174.39 2k8p s PRO 42 N -4.95 4.40 -0.21 0.56 0.04 -1.26 -5.03 135.00 128.55 2k8p s PRO 42 Ca 0.65 2.05 0.02 0.00 0.04 0.00 0.00 61.00 63.75 2k8p s PRO 42 Cb -0.18 -3.19 0.04 0.00 0.04 0.00 0.00 34.50 31.21 2k8p s PRO 42 CO 0.57 -0.22 -0.14 -1.58 0.04 0.00 0.00 177.00 175.67 2k8p s HIS 43 N -0.03 2.79 0.08 0.56 2.46 -1.26 -5.11 115.29 114.78 2k8p s HIS 43 Ca 0.55 -1.83 0.01 0.00 0.47 0.00 0.00 55.06 54.27 2k8p s HIS 43 Cb -0.36 -1.82 -0.04 0.00 -0.13 0.00 0.00 32.58 30.23 2k8p s HIS 43 CO 0.39 -0.81 -0.06 -3.38 -2.47 0.00 0.00 174.74 168.42 2k8p s HIS 44 N 1.27 0.77 1.02 3.88 -3.43 -1.26 -5.16 115.29 112.38 2k8p s HIS 44 Ca -0.02 -0.83 -0.13 0.00 -0.80 0.00 0.00 55.06 53.29 2k8p s HIS 44 Cb -0.16 -0.46 0.20 0.00 -1.43 0.00 0.00 32.58 30.73 2k8p s HIS 44 CO -0.09 -0.17 1.09 -1.25 -2.00 0.00 0.00 174.74 172.33 2k8p s PRO 45 N -3.24 0.24 -0.07 -0.38 0.04 -1.26 -5.09 135.00 125.23 2k8p s PRO 45 Ca 0.05 0.45 -0.12 0.00 0.04 0.00 0.00 61.00 61.42 2k8p s PRO 45 Cb 0.02 -1.72 0.03 0.00 0.04 0.00 0.00 34.50 32.86 2k8p s PRO 45 CO -0.04 -2.85 0.30 -0.59 0.04 0.00 0.00 177.00 173.86 2k8p s PHE 46 N -2.97 -0.26 -0.16 0.56 -0.12 -1.26 -5.17 117.98 108.61 2k8p s PHE 46 Ca 0.66 0.57 -0.32 0.00 -0.05 0.00 0.00 56.93 57.78 2k8p s PHE 46 Cb -0.18 0.10 0.13 0.00 -0.63 0.00 0.00 43.02 42.44 2k8p s PHE 46 CO 0.58 -0.25 1.12 -1.83 -0.05 0.00 0.00 175.22 174.79 2k8p s GLU 47 N -0.44 0.44 -0.45 1.99 -1.05 -1.26 -5.10 118.70 112.83 2k8p s GLU 47 Ca -0.06 -0.10 0.08 0.00 -0.15 0.00 0.00 54.97 54.75 2k8p s GLU 47 Cb -0.04 0.20 0.26 0.00 -0.44 0.00 0.00 34.13 34.12 2k8p s GLU 47 CO 0.02 -0.18 0.61 2.41 0.95 0.00 0.00 175.26 179.07 2k8p n THR 48 N 0.08 0.16 -3.02 1.83 -1.04 -1.26 -5.11 114.28 105.92 2k8p n THR 48 Ca -0.03 -4.39 -0.37 0.00 -2.04 0.00 0.00 64.05 57.22 2k8p n THR 48 Cb 0.59 -1.78 -0.06 0.00 -1.82 0.00 0.00 70.33 67.26 2k8p n THR 48 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2k8p s LYS 49 N -1.68 4.35 -0.23 -2.82 -2.85 -1.26 -5.06 119.74 110.19 2k8p s LYS 49 Ca 0.37 0.99 -0.32 0.00 -1.00 0.00 0.00 55.97 56.01 2k8p s LYS 49 Cb 0.19 -2.89 0.16 0.00 -2.06 0.00 0.00 37.83 33.23 2k8p s LYS 49 CO -0.09 0.38 1.24 0.34 0.10 0.00 0.00 175.35 177.33 2k8p s ASP 50 N -1.60 -0.13 -0.53 0.03 -1.08 -1.26 -5.11 116.67 106.99 2k8p s ASP 50 Ca 0.44 0.08 0.04 0.00 -0.52 0.00 0.00 52.55 52.59 2k8p s ASP 50 Cb -0.18 0.12 0.16 0.00 -1.46 0.00 0.00 42.92 41.56 2k8p s ASP 50 CO 0.22 -0.16 0.38 -0.69 0.52 0.00 0.00 175.17 175.44 2k8p s VAL 51 N -1.62 1.48 -0.28 1.11 1.01 -1.26 -5.09 120.40 115.75 2k8p s VAL 51 Ca 0.07 -3.23 -0.16 0.00 0.00 0.00 0.00 61.98 58.67 2k8p s VAL 51 Cb -0.01 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 2k8p s VAL 51 CO -0.05 -1.09 0.41 -0.94 0.00 0.00 0.00 175.10 173.43 2k8p s SER 52 N -0.44 6.28 0.57 3.32 1.04 -1.26 -5.07 113.70 118.14 2k8p s SER 52 Ca 0.27 0.25 0.08 0.00 0.48 0.00 0.00 55.95 57.03 2k8p s SER 52 Cb -0.05 -2.23 0.08 0.00 0.10 0.00 0.00 66.02 63.93 2k8p s SER 52 CO -0.15 -0.24 0.78 -0.70 0.98 0.00 0.00 173.24 173.91 2k8p s GLU 53 N 2.13 2.32 -0.12 4.02 2.56 -1.26 -5.05 118.70 123.31 2k8p s GLU 53 Ca 0.16 -1.50 0.19 0.00 0.00 0.00 0.00 54.97 53.81 2k8p s GLU 53 Cb -0.16 -2.63 -0.27 0.00 2.00 0.00 0.00 34.13 33.07 2k8p s GLU 53 CO 0.10 -0.83 0.24 0.66 -0.56 0.00 0.00 175.26 174.86 2k8p n TYR 54 N -2.25 0.00 -3.23 5.30 4.01 -1.26 -4.73 117.16 114.99 2k8p n TYR 54 Ca 0.14 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.88 2k8p n TYR 54 Cb 0.61 -0.73 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 2k8p n TYR 54 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2k8p n SER 55 N -2.49 0.48 -4.38 7.72 7.64 -1.26 -3.36 113.62 117.98 2k8p n SER 55 Ca -0.19 -1.02 -0.45 0.00 1.01 0.00 0.00 58.87 58.23 2k8p n SER 55 Cb 0.86 -0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 64.01 2k8p n SER 55 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8p s ARG 57 N 2.70 2.58 -0.24 0.00 1.04 0.97 -4.69 118.95 121.31 2k8p s ARG 57 Ca 0.12 1.88 -0.24 0.00 -1.04 0.00 0.00 55.73 56.45 2k8p s ARG 57 Cb -0.24 -1.87 -0.01 0.00 -2.04 0.00 0.00 34.95 30.79 2k8p s ARG 57 CO 0.07 -1.53 0.81 -1.21 -0.04 0.00 0.00 175.30 173.40 2k8p s GLU 58 N -3.53 4.18 -0.45 3.89 8.01 -1.26 -3.14 118.70 126.40 2k8p s GLU 58 Ca 0.78 0.90 -0.16 0.00 0.01 0.00 0.00 54.97 56.51 2k8p s GLU 58 Cb -0.32 -3.64 0.05 0.00 -4.31 0.00 0.00 34.13 25.91 2k8p s GLU 58 CO 0.39 -0.50 0.38 -1.17 0.01 0.00 0.00 175.26 174.37 2k8p s LEU 59 N 2.80 5.38 -0.34 1.80 2.96 -0.81 -4.96 118.68 125.51 2k8p s LEU 59 Ca 0.34 -1.13 -0.25 0.00 -0.22 0.00 0.00 54.13 52.87 2k8p s LEU 59 Cb -0.15 -2.21 0.01 0.00 0.50 0.00 0.00 46.19 44.34 2k8p s LEU 59 CO 0.07 -0.60 0.90 -1.00 -1.32 0.00 0.00 176.35 174.41 2k8p s HIS 60 N 1.75 3.13 -0.32 5.38 3.76 -1.26 -0.96 115.29 126.77 2k8p s HIS 60 Ca 0.06 0.84 -0.08 0.00 -0.15 0.00 0.00 55.06 55.72 2k8p s HIS 60 Cb -0.22 -3.51 0.01 0.00 1.11 0.00 0.00 32.58 29.97 2k8p s HIS 60 CO 0.08 -0.74 0.12 -0.06 -0.85 0.00 0.00 174.74 173.30 2k8p s PHE 61 N 3.33 3.19 -0.21 1.40 0.08 -0.27 -4.99 117.98 120.51 2k8p s PHE 61 Ca 0.37 -0.98 -0.05 0.00 0.12 0.00 0.00 56.93 56.39 2k8p s PHE 61 Cb -0.13 -2.31 -0.02 0.00 -0.57 0.00 0.00 43.02 39.99 2k8p s PHE 61 CO 0.16 -0.59 0.00 0.99 -0.10 0.00 0.00 175.22 175.68 2k8p s THR 62 N 1.51 3.92 0.21 0.64 2.01 -1.26 -1.93 115.64 120.75 2k8p s THR 62 Ca 0.02 -0.32 -0.18 0.00 0.31 0.00 0.00 61.69 61.52 2k8p s THR 62 Cb -0.18 -2.78 0.03 0.00 0.01 0.00 0.00 72.50 69.58 2k8p s THR 62 CO 0.04 0.42 0.55 -0.13 -0.69 0.00 0.00 174.62 174.81 2k8p s ARG 63 N 1.10 1.44 -0.32 4.92 0.52 -1.19 -4.97 118.95 120.45 2k8p s ARG 63 Ca 0.02 -0.88 -0.20 0.00 -0.52 0.00 0.00 55.73 54.15 2k8p s ARG 63 Cb -0.14 0.53 -0.01 0.00 0.52 0.00 0.00 34.95 35.85 2k8p s ARG 63 CO 0.01 -0.62 0.60 0.71 0.02 0.00 0.00 175.30 176.02 2k8p s TYR 64 N -3.88 3.19 0.29 -0.53 1.51 -1.26 -0.73 117.35 115.94 2k8p s TYR 64 Ca 0.10 0.45 -0.19 0.00 -1.01 0.00 0.00 57.07 56.42 2k8p s TYR 64 Cb -0.02 -3.00 -0.09 0.00 -0.11 0.00 0.00 41.96 38.74 2k8p s TYR 64 CO -0.01 -0.51 0.78 0.54 -1.11 0.00 0.00 175.55 175.24 2k8p s VAL 65 N 2.58 4.53 -0.17 0.71 0.11 -1.26 -4.96 120.40 121.94 2k8p s VAL 65 Ca 0.23 1.29 -0.08 0.00 -2.93 0.00 0.00 61.98 60.49 2k8p s VAL 65 Cb -0.15 -3.78 0.07 0.00 -1.53 0.00 0.00 36.38 30.99 2k8p s VAL 65 CO 0.13 0.03 0.38 0.42 -3.33 0.00 0.00 175.10 172.73 2k8p s THR 66 N -1.73 -0.25 -0.30 5.04 -4.23 -1.26 -1.51 115.64 111.40 2k8p s THR 66 Ca 0.49 0.14 -0.00 0.00 -1.18 0.00 0.00 61.69 61.14 2k8p s THR 66 Cb -0.14 -0.59 0.09 0.00 1.34 0.00 0.00 72.50 73.21 2k8p s THR 66 CO 0.20 0.06 0.08 -0.62 -0.54 0.00 0.00 174.62 173.79 2k8p s ASP 67 N 1.85 4.03 0.00 3.99 -1.08 -1.23 -5.03 116.67 119.21 2k8p s ASP 67 Ca -0.06 -1.62 0.00 0.00 -0.52 0.00 0.00 52.55 50.35 2k8p s ASP 67 Cb -0.10 -0.96 0.00 0.00 -1.46 0.00 0.00 42.92 40.40 2k8p s ASP 67 CO -0.12 -0.39 0.00 0.61 0.52 0.00 0.00 175.17 175.79 2k8p n GLY 68 N 4.78 -1.25 0.00 2.66 0.00 -1.26 -4.19 105.19 105.93 2k8p n GLY 68 Ca -0.02 -1.75 0.07 0.00 0.00 0.00 0.00 46.02 44.32 2k8p n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k8p n PRO 69 N 0.00 0.17 -4.05 1.61 -0.04 -1.26 -4.74 135.00 126.69 2k8p n PRO 69 Ca 0.00 0.17 -0.22 0.00 -0.04 0.00 0.00 63.50 63.41 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 -3.89 0.33 0.28 0.00 3.00 0.65 -3.51 118.95 115.80 2k8p s ARG 71 Ca 0.33 -0.30 -0.30 0.00 0.00 0.00 0.00 55.73 55.46 2k8p s ARG 71 Cb -0.08 -0.23 -0.12 0.00 0.00 0.00 0.00 34.95 34.52 2k8p s ARG 71 CO 0.27 0.06 1.59 -1.13 0.00 0.00 0.00 175.30 176.09 2k8p n SER 72 N 2.55 3.77 0.22 0.23 3.41 -0.57 -0.08 113.62 123.14 2k8p n SER 72 Ca -0.16 1.14 0.10 0.00 -0.26 0.00 0.00 58.87 59.69 2k8p n SER 72 Cb 0.58 -1.58 0.40 0.00 -0.26 0.00 0.00 64.21 63.35 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 4.97 0.97 -2.26 7.33 0.00 -1.72 -3.46 119.26 125.09 2k8p h ALA 73 Ca -0.46 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.09 2k8p h ALA 73 Cb 1.23 -0.04 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 2k8p h ALA 73 CO 0.81 0.28 -0.68 0.15 0.00 0.00 0.00 179.25 179.80 2k8p s LYS 74 N -3.52 0.71 0.63 0.00 1.02 -1.26 -5.13 119.74 112.19 2k8p s LYS 74 Ca 0.02 -1.28 -0.16 0.00 0.02 0.00 0.00 55.97 54.57 2k8p s LYS 74 Cb 0.09 0.11 -0.02 0.00 -0.52 0.00 0.00 37.83 37.50 2k8p s LYS 74 CO 0.64 -0.11 1.12 -1.25 -0.92 0.00 0.00 175.35 174.83 2k8p s PRO 75 N -3.92 2.95 -0.19 -1.68 0.04 -1.26 -4.62 135.00 126.33 2k8p s PRO 75 Ca 0.10 1.45 -0.03 0.00 0.04 0.00 0.00 61.00 62.56 2k8p s PRO 75 Cb 0.07 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.63 2k8p s PRO 75 CO -0.07 -1.14 -0.05 0.54 0.04 0.00 0.00 177.00 176.32 2k8p s VAL 76 N -2.19 3.58 -0.48 -0.36 0.11 0.09 -4.93 120.40 116.22 2k8p s VAL 76 Ca 0.68 -0.44 -0.22 0.00 -2.93 0.00 0.00 61.98 59.07 2k8p s VAL 76 Cb -0.21 -2.59 0.04 0.00 -1.53 0.00 0.00 36.38 32.08 2k8p s VAL 76 CO 0.38 0.46 0.74 -0.89 -3.33 0.00 0.00 175.10 172.45 2k8p s THR 77 N 0.91 4.70 -0.10 5.04 2.01 -1.26 -3.18 115.64 123.75 2k8p s THR 77 Ca -0.00 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.10 2k8p s THR 77 Cb -0.15 -4.33 -0.02 0.00 0.01 0.00 0.00 72.50 68.02 2k8p s THR 77 CO 0.01 -0.78 -0.10 -1.83 -0.69 0.00 0.00 174.62 171.23 2k8p s GLU 78 N 3.14 3.11 -0.13 4.92 -1.05 -0.81 -4.99 118.70 122.89 2k8p s GLU 78 Ca 0.25 -0.62 -0.17 0.00 -0.15 0.00 0.00 54.97 54.27 2k8p s GLU 78 Cb -0.14 -2.63 -0.04 0.00 -0.44 0.00 0.00 34.13 30.88 2k8p s GLU 78 CO 0.18 0.41 0.44 -1.17 0.95 0.00 0.00 175.26 176.08 2k8p s LEU 79 N -0.15 4.26 0.14 1.83 0.20 -1.26 -1.11 118.68 122.59 2k8p s LEU 79 Ca 0.01 0.73 0.09 0.00 0.69 0.00 0.00 54.13 55.65 2k8p s LEU 79 Cb -0.13 -2.62 -0.04 0.00 -0.43 0.00 0.00 46.19 42.96 2k8p s LEU 79 CO 0.03 0.01 -0.16 -0.69 -0.29 0.00 0.00 176.35 175.25 2k8p s VAL 80 N 0.68 2.94 -0.26 1.68 1.01 -0.13 -3.42 120.40 122.90 2k8p s VAL 80 Ca 0.24 -1.57 -0.12 0.00 0.00 0.00 0.00 61.98 60.53 2k8p s VAL 80 Cb -0.15 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 2k8p s VAL 80 CO 0.09 0.03 0.23 0.00 0.00 0.00 0.00 175.10 175.45 2k8p s SER 82 N 1.46 -0.19 0.00 0.00 0.01 -1.19 -4.98 113.70 108.81 2k8p s SER 82 Ca 0.10 -0.71 0.00 0.00 1.31 0.00 0.00 55.95 56.64 2k8p s SER 82 Cb -0.15 0.73 0.00 0.00 0.21 0.00 0.00 66.02 66.81 2k8p s SER 82 CO 0.08 -1.38 0.00 0.61 0.41 0.00 0.00 173.24 172.96 2k8p n GLY 83 N -0.48 3.62 3.64 3.44 0.00 -1.26 -0.02 105.19 114.12 2k8p n GLY 83 Ca -0.05 -0.96 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 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 -4.69 3.83 -0.22 1.61 -0.21 -1.26 -4.43 119.66 114.29 2k8p s GLN 84 Ca 0.00 1.91 -0.10 0.00 0.02 0.00 0.00 55.36 57.18 2k8p s GLN 84 Cb 0.00 -4.08 -0.05 0.00 1.00 0.00 0.00 33.01 29.88 2k8p s GLN 84 CO 0.00 -1.26 0.15 0.00 -2.12 0.00 0.00 175.29 172.06 2k8p s GLY 86 N 0.70 1.19 0.11 0.00 0.00 -1.21 -4.92 107.32 103.19 2k8p s GLY 86 Ca 0.08 -1.51 -0.31 0.00 0.00 0.00 0.00 44.72 42.99 2k8p s GLY 86 CO 0.01 -1.26 1.36 2.56 0.00 0.00 0.00 173.10 175.77 2k8p s PRO 87 N -4.11 4.34 -0.32 2.90 0.04 -1.26 -4.92 135.00 131.67 2k8p s PRO 87 Ca 0.33 2.03 -0.04 0.00 0.04 0.00 0.00 61.00 63.36 2k8p s PRO 87 Cb 0.06 -3.26 0.26 0.00 0.04 0.00 0.00 34.50 31.60 2k8p s PRO 87 CO 0.09 -0.40 1.23 0.00 0.04 0.00 0.00 177.00 177.97 2k8p n ALA 88 N 3.83 -3.79 -2.40 8.56 0.00 -1.26 -5.16 120.51 120.29 2k8p n ALA 88 Ca 0.11 -0.13 -0.20 0.00 0.00 0.00 0.00 53.44 53.22 2k8p n ALA 88 Cb 0.43 -3.40 -0.10 0.00 0.00 0.00 0.00 19.45 16.38 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 0.29 1.52 -0.28 0.00 1.81 -1.26 -5.10 118.95 115.92 2k8p s ARG 89 Ca 0.25 -1.80 -0.03 0.00 -1.72 0.00 0.00 55.73 52.43 2k8p s ARG 89 Cb 0.19 -0.85 0.17 0.00 -0.45 0.00 0.00 34.95 34.00 2k8p s ARG 89 CO -0.08 -0.10 0.55 -1.17 -0.68 0.00 0.00 175.30 173.82 2k8p s LEU 90 N -3.42 -1.16 0.30 2.53 2.96 -1.26 -5.17 118.68 113.47 2k8p s LEU 90 Ca 0.32 0.83 0.03 0.00 -0.22 0.00 0.00 54.13 55.10 2k8p s LEU 90 Cb 0.06 1.92 -0.03 0.00 0.50 0.00 0.00 46.19 48.65 2k8p s LEU 90 CO 0.12 -0.26 0.45 -0.76 -1.32 0.00 0.00 176.35 174.58 2k8p s LEU 91 N 2.79 4.15 0.13 -0.68 1.02 -1.26 -5.03 118.68 119.79 2k8p s LEU 91 Ca 0.15 0.19 -0.12 0.00 0.02 0.00 0.00 54.13 54.37 2k8p s LEU 91 Cb -0.15 -3.03 -0.06 0.00 0.02 0.00 0.00 46.19 42.98 2k8p s LEU 91 CO -0.19 -0.21 1.46 1.55 0.02 0.00 0.00 176.35 178.97 2k8p h PRO 92 N 0.96 0.87 0.00 1.29 0.13 -2.09 -3.44 132.00 129.72 2k8p h PRO 92 Ca -0.50 -0.46 0.00 0.00 -0.87 0.00 0.00 66.00 64.17 2k8p h PRO 92 Cb 1.23 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2k8p h PRO 92 CO 0.60 1.10 0.00 0.09 -0.23 0.00 0.00 178.00 179.57 2k8p n ASN 93 N -4.12 0.06 -2.63 1.44 3.02 -1.26 -5.12 115.26 106.65 2k8p n ASN 93 Ca -0.03 0.05 -0.04 0.00 -0.03 0.00 0.00 54.58 54.53 2k8p n ASN 93 Cb 0.52 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 2k8p n ASN 93 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k8p n ALA 94 N -2.64 -3.22 -0.09 5.41 0.00 -1.26 -4.99 120.51 113.72 2k8p n ALA 94 Ca 0.00 0.76 -0.09 0.00 0.00 0.00 0.00 53.44 54.11 2k8p n ALA 94 Cb 0.00 -2.18 -0.16 0.00 0.00 0.00 0.00 19.45 17.12 2k8p n ALA 94 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k8p n ILE 95 N 0.12 1.27 -3.43 0.00 -5.35 -1.26 -4.60 119.36 106.12 2k8p n ILE 95 Ca 0.06 -0.81 -0.43 0.00 -0.27 0.00 0.00 62.75 61.29 2k8p n ILE 95 Cb 0.21 -0.45 -0.09 0.00 -1.74 0.00 0.00 39.64 37.57 2k8p n ILE 95 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2k8p s GLY 96 N -5.35 2.02 -0.50 3.28 0.00 -1.26 -4.68 107.32 100.83 2k8p s GLY 96 Ca -0.10 -1.85 -0.21 0.00 0.00 0.00 0.00 44.72 42.57 2k8p s GLY 96 CO 0.81 0.98 0.63 -2.13 0.00 0.00 0.00 173.10 173.39 2k8p n ARG 97 N 5.20 -2.06 0.00 2.90 3.00 -1.26 -5.02 116.66 119.42 2k8p n ARG 97 Ca -0.11 1.73 0.00 0.00 -0.00 0.00 0.00 57.85 59.47 2k8p n ARG 97 Cb 0.46 -4.27 0.00 0.00 0.00 0.00 0.00 32.46 28.65 2k8p n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k8p n GLY 98 N -0.52 0.66 1.95 5.14 0.00 -1.26 -5.04 105.19 106.12 2k8p n GLY 98 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 -3.30 -1.96 1.61 4.76 -1.26 -5.08 118.16 112.93 2k8p n LYS 99 Ca 0.00 -0.92 -0.00 0.00 -2.87 0.00 0.00 58.31 54.51 2k8p n LYS 99 Cb 0.00 -1.08 -0.00 0.00 -1.84 0.00 0.00 35.03 32.10 2k8p n LYS 99 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 2k8p n TRP 100 N -4.46 -0.16 0.00 2.13 8.01 -1.26 -5.09 117.44 116.61 2k8p n TRP 100 Ca 0.08 -0.02 0.00 0.00 -1.31 0.00 0.00 57.50 56.26 2k8p n TRP 100 Cb 0.36 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.65 2k8p n TRP 100 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.69 177.59 2k8p n TRP 101 N -0.06 -0.35 -1.59 -5.99 8.01 -1.26 -5.12 117.44 111.08 2k8p n TRP 101 Ca -0.00 0.01 -0.31 0.00 -1.31 0.00 0.00 57.50 55.89 2k8p n TRP 101 Cb 0.00 0.51 0.05 0.00 -2.01 0.00 0.00 31.31 29.87 2k8p n TRP 101 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 2k8p s ARG 102 N -2.00 2.87 1.19 -0.99 3.00 -1.26 -5.05 118.95 116.71 2k8p s ARG 102 Ca 0.00 0.90 -0.19 0.00 0.00 0.00 0.00 55.73 56.45 2k8p s ARG 102 Cb 0.00 -1.99 0.28 0.00 0.00 0.00 0.00 34.95 33.25 2k8p s ARG 102 CO 0.00 -1.13 1.11 -1.25 0.00 0.00 0.00 175.30 174.03 2k8p s PRO 103 N -5.07 -1.16 0.38 3.54 0.04 -1.26 -4.90 135.00 126.58 2k8p s PRO 103 Ca 0.58 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.58 2k8p s PRO 103 Cb -0.14 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 32.80 2k8p s PRO 103 CO 0.55 -3.67 0.00 0.43 0.04 0.00 0.00 177.00 174.35 2k8p n SER 104 N -4.74 -8.03 0.00 6.66 7.64 -1.26 -5.04 113.62 108.85 2k8p n SER 104 Ca 0.13 0.75 0.00 0.00 1.01 0.00 0.00 58.87 60.76 2k8p n SER 104 Cb 0.59 -4.21 0.00 0.00 -1.01 0.00 0.00 64.21 59.58 2k8p n SER 104 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k8p n GLY 105 N -4.10 -1.37 3.77 0.23 0.00 -1.26 -5.06 105.19 97.40 2k8p n GLY 105 Ca -0.01 0.36 -0.35 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.44 3.30 -0.07 1.61 0.04 -1.26 -5.01 135.00 133.17 2k8p s PRO 106 Ca 0.00 1.59 -0.03 0.00 0.04 0.00 0.00 61.00 62.60 2k8p s PRO 106 Cb 0.00 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 2k8p s PRO 106 CO 0.00 -0.89 -0.06 -0.44 0.04 0.00 0.00 177.00 175.66 2k8p h ASP 107 N 1.08 0.00 0.00 6.66 5.19 -1.90 -3.48 116.42 123.98 2k8p h ASP 107 Ca -0.50 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.91 2k8p h ASP 107 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 2k8p h ASP 107 CO 0.57 0.38 0.00 0.49 -3.12 0.00 0.00 179.24 177.55 2k8p n PHE 108 N -3.65 0.00 0.00 4.55 3.72 -1.26 -5.06 117.46 115.76 2k8p n PHE 108 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2k8p n PHE 108 Cb 0.08 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 2k8p n PHE 108 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 2k8p n ARG 109 N -2.04 0.00 -3.69 -1.08 0.63 -1.26 -5.03 116.66 104.20 2k8p n ARG 109 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 2k8p n ARG 109 Cb 0.00 0.00 -0.09 0.00 0.45 0.00 0.00 32.46 32.82 2k8p n ARG 109 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2k8p s ILE 111 N 0.47 4.39 1.17 0.00 -4.36 0.16 -4.89 121.20 118.14 2k8p s ILE 111 Ca -0.01 1.52 -0.18 0.00 -0.26 0.00 0.00 60.65 61.72 2k8p s ILE 111 Cb -0.04 -3.86 0.27 0.00 1.25 0.00 0.00 42.46 40.08 2k8p s ILE 111 CO -0.02 0.06 1.11 -2.16 0.24 0.00 0.00 174.94 174.17 2k8p s PRO 112 N -2.29 -0.96 0.02 0.37 0.04 -1.26 -1.40 135.00 129.52 2k8p s PRO 112 Ca 0.50 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.58 2k8p s PRO 112 Cb -0.16 -1.62 -0.00 0.00 0.04 0.00 0.00 34.50 32.76 2k8p s PRO 112 CO 0.21 -3.56 0.03 -3.47 0.04 0.00 0.00 177.00 170.25 2k8p n ASP 113 N -4.67 -0.08 -4.55 6.66 2.03 -1.20 -4.47 116.55 110.27 2k8p n ASP 113 Ca 0.12 -1.13 -0.42 0.00 0.52 0.00 0.00 54.79 53.87 2k8p n ASP 113 Cb 0.59 0.15 0.01 0.00 -0.72 0.00 0.00 41.12 41.15 2k8p n ASP 113 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2k8p n ARG 114 N -0.04 1.06 -4.10 -0.67 0.63 -1.26 -4.62 116.66 107.66 2k8p n ARG 114 Ca 0.00 0.38 -0.31 0.00 -0.92 0.00 0.00 57.85 57.00 2k8p n ARG 114 Cb 0.04 -1.83 -0.07 0.00 0.45 0.00 0.00 32.46 31.05 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 -1.30 3.20 -0.18 -0.14 1.51 -1.26 -0.66 117.35 118.52 2k8p s TYR 115 Ca 0.63 0.11 -0.01 0.00 -1.01 0.00 0.00 57.07 56.80 2k8p s TYR 115 Cb -0.60 -1.66 0.05 0.00 -0.11 0.00 0.00 41.96 39.64 2k8p s TYR 115 CO 0.57 0.52 -0.03 0.50 -1.11 0.00 0.00 175.55 176.00 2k8p s ARG 116 N -2.08 1.28 0.31 -0.62 3.52 0.99 -4.66 118.95 117.69 2k8p s ARG 116 Ca 0.26 -0.56 -0.10 0.00 -0.13 0.00 0.00 55.73 55.20 2k8p s ARG 116 Cb -0.12 -2.10 -0.07 0.00 -1.56 0.00 0.00 34.95 31.10 2k8p s ARG 116 CO 0.18 -0.50 0.65 0.00 -0.81 0.00 0.00 175.30 174.82 2k8p s ALA 117 N 1.65 3.46 -0.01 6.12 0.00 -1.26 -2.22 121.76 129.50 2k8p s ALA 117 Ca -0.01 -0.25 0.02 0.00 0.00 0.00 0.00 51.96 51.72 2k8p s ALA 117 Cb -0.16 -2.55 0.00 0.00 0.00 0.00 0.00 23.12 20.41 2k8p s ALA 117 CO -0.07 0.27 -0.06 -1.14 0.00 0.00 0.00 175.76 174.75 2k8p s GLN 118 N -3.30 0.60 -0.16 0.00 0.74 0.80 -4.93 119.66 113.42 2k8p s GLN 118 Ca 0.49 -0.21 -0.15 0.00 0.05 0.00 0.00 55.36 55.53 2k8p s GLN 118 Cb -0.11 -0.59 -0.04 0.00 1.10 0.00 0.00 33.01 33.37 2k8p s GLN 118 CO 0.25 0.10 0.36 1.03 -0.55 0.00 0.00 175.29 176.48 2k8p s ARG 119 N 0.06 4.27 0.15 1.67 0.52 -1.26 -1.41 118.95 122.95 2k8p s ARG 119 Ca -0.00 0.22 0.10 0.00 -0.52 0.00 0.00 55.73 55.52 2k8p s ARG 119 Cb -0.05 -3.45 -0.04 0.00 0.52 0.00 0.00 34.95 31.93 2k8p s ARG 119 CO -0.00 0.16 -0.17 0.54 0.02 0.00 0.00 175.30 175.85 2k8p s VAL 120 N 0.67 2.81 -0.27 3.52 0.11 0.46 -4.97 120.40 122.73 2k8p s VAL 120 Ca 0.20 -1.67 -0.07 0.00 -2.93 0.00 0.00 61.98 57.51 2k8p s VAL 120 Cb -0.14 -2.33 -0.01 0.00 -1.53 0.00 0.00 36.38 32.38 2k8p s VAL 120 CO 0.06 -0.00 0.07 -1.58 -3.33 0.00 0.00 175.10 170.32 2k8p s GLN 121 N -2.44 3.31 -0.16 1.54 0.74 -1.26 -0.74 119.66 120.65 2k8p s GLN 121 Ca 0.20 -0.71 -0.09 0.00 0.05 0.00 0.00 55.36 54.82 2k8p s GLN 121 Cb -0.09 -3.34 -0.05 0.00 1.10 0.00 0.00 33.01 30.63 2k8p s GLN 121 CO 0.11 -0.34 0.13 -0.51 -0.55 0.00 0.00 175.29 174.13 2k8p s LEU 122 N 1.54 4.27 0.00 3.68 1.43 0.85 -1.94 118.68 128.52 2k8p s LEU 122 Ca 0.04 0.33 -0.03 0.00 -1.03 0.00 0.00 54.13 53.44 2k8p s LEU 122 Cb -0.16 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 2k8p s LEU 122 CO 0.02 0.28 0.21 -0.76 0.23 0.00 0.00 176.35 176.34 2k8p s LEU 123 N -0.27 4.37 -0.36 1.79 2.01 0.88 -0.07 118.68 127.02 2k8p s LEU 123 Ca 0.11 0.40 -0.01 0.00 0.01 0.00 0.00 54.13 54.64 2k8p s LEU 123 Cb -0.11 -2.67 0.09 0.00 0.01 0.00 0.00 46.19 43.51 2k8p s LEU 123 CO 0.01 0.25 0.11 0.00 1.01 0.00 0.00 176.35 177.72 2k8p h PRO 125 N 7.92 0.00 0.82 0.00 0.13 -1.88 -3.28 132.00 135.71 2k8p h PRO 125 Ca -0.13 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.96 2k8p h PRO 125 Cb 1.04 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.17 2k8p h PRO 125 CO 0.61 0.00 -0.49 0.78 -0.23 0.00 0.00 178.00 178.66 2k8p h GLY 126 N 2.15 -1.36 0.00 1.56 0.00 -1.93 -3.46 103.07 100.03 2k8p h GLY 126 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 47.33 47.88 2k8p h GLY 126 CO 0.00 -0.46 0.00 0.61 0.00 0.00 0.00 176.54 176.69 2k8p n GLY 127 N -1.63 0.00 3.45 4.60 0.00 -1.24 -5.18 105.19 105.20 2k8p n GLY 127 Ca -0.15 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 2k8p n GLY 127 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k8p s GLU 128 N 0.00 1.73 0.71 1.61 2.02 -1.25 -5.16 118.70 118.36 2k8p s GLU 128 Ca 0.00 -1.66 -0.11 0.00 0.02 0.00 0.00 54.97 53.22 2k8p s GLU 128 Cb 0.00 0.42 0.02 0.00 0.10 0.00 0.00 34.13 34.66 2k8p s GLU 128 CO 0.00 -0.70 1.07 0.00 0.02 0.00 0.00 175.26 175.65 2k8p s ALA 129 N -3.43 2.60 0.47 5.21 0.00 -1.26 -4.41 121.76 120.94 2k8p s ALA 129 Ca 0.31 0.08 -0.23 0.00 0.00 0.00 0.00 51.96 52.12 2k8p s ALA 129 Cb 0.01 -3.18 -0.07 0.00 0.00 0.00 0.00 23.12 19.88 2k8p s ALA 129 CO 0.17 -1.32 1.16 -1.25 0.00 0.00 0.00 175.76 174.52 2k8p s PRO 130 N -5.04 3.73 -0.08 0.00 0.04 -1.26 -4.51 135.00 127.87 2k8p s PRO 130 Ca 0.59 1.76 -0.00 0.00 0.04 0.00 0.00 61.00 63.38 2k8p s PRO 130 Cb -0.14 -2.38 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 2k8p s PRO 130 CO 0.55 -0.57 -0.05 0.50 0.04 0.00 0.00 177.00 177.46 2k8p s ARG 131 N -2.74 2.93 -0.11 4.56 3.52 0.90 -4.89 118.95 123.12 2k8p s ARG 131 Ca 0.64 -0.52 -0.18 0.00 -0.13 0.00 0.00 55.73 55.53 2k8p s ARG 131 Cb -0.28 -2.67 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 2k8p s ARG 131 CO 0.34 0.60 0.49 0.00 -0.81 0.00 0.00 175.30 175.92 2k8p s ALA 132 N -0.63 3.48 -0.12 6.12 0.00 -1.26 -0.10 121.76 129.25 2k8p s ALA 132 Ca 0.10 -0.16 0.03 0.00 0.00 0.00 0.00 51.96 51.92 2k8p s ALA 132 Cb -0.12 -2.66 0.01 0.00 0.00 0.00 0.00 23.12 20.36 2k8p s ALA 132 CO 0.02 0.02 -0.20 0.50 0.00 0.00 0.00 175.76 176.10 2k8p s ARG 133 N 0.53 2.68 -0.20 0.00 6.06 0.08 -4.97 118.95 123.15 2k8p s ARG 133 Ca 0.27 -0.74 -0.10 0.00 -2.50 0.00 0.00 55.73 52.66 2k8p s ARG 133 Cb -0.15 -2.16 -0.05 0.00 0.06 0.00 0.00 34.95 32.65 2k8p s ARG 133 CO 0.11 0.02 0.13 0.21 -2.50 0.00 0.00 175.30 173.26 2k8p s LYS 134 N 0.75 4.15 -0.05 5.12 2.20 -1.26 -0.40 119.74 130.25 2k8p s LYS 134 Ca -0.10 -0.22 0.05 0.00 -0.36 0.00 0.00 55.97 55.34 2k8p s LYS 134 Cb -0.16 -3.40 -0.01 0.00 -1.51 0.00 0.00 37.83 32.75 2k8p s LYS 134 CO 0.01 0.32 -0.20 0.14 -0.36 0.00 0.00 175.35 175.25 2k8p s VAL 135 N 0.31 1.69 -0.49 4.02 -7.23 -0.50 -4.97 120.40 113.23 2k8p s VAL 135 Ca 0.08 -0.86 -0.16 0.00 -1.81 0.00 0.00 61.98 59.23 2k8p s VAL 135 Cb -0.11 -1.44 0.09 0.00 0.56 0.00 0.00 36.38 35.47 2k8p s VAL 135 CO -0.02 0.48 0.44 -0.60 -0.31 0.00 0.00 175.10 175.09 2k8p s ARG 136 N -0.04 2.99 -0.02 4.82 3.52 -1.26 -0.14 118.95 128.82 2k8p s ARG 136 Ca -0.04 -1.41 0.03 0.00 -0.13 0.00 0.00 55.73 54.18 2k8p s ARG 136 Cb -0.12 -4.17 -0.03 0.00 -1.56 0.00 0.00 34.95 29.06 2k8p s ARG 136 CO 0.03 -1.12 -0.09 -0.51 -0.81 0.00 0.00 175.30 172.80 2k8p s LEU 137 N 1.71 3.07 0.31 -0.88 2.01 -0.94 -4.93 118.68 119.03 2k8p s LEU 137 Ca 0.05 -0.14 -0.28 0.00 0.01 0.00 0.00 54.13 53.76 2k8p s LEU 137 Cb -0.25 -1.73 -0.13 0.00 0.01 0.00 0.00 46.19 44.08 2k8p s LEU 137 CO 0.06 0.31 1.09 0.52 1.01 0.00 0.00 176.35 179.33 2k8p n VAL 138 N 1.80 2.01 -0.11 -1.59 0.31 -1.22 -0.01 118.33 119.52 2k8p n VAL 138 Ca -0.16 -0.50 -0.20 0.00 -0.01 0.00 0.00 64.34 63.46 2k8p n VAL 138 Cb 0.53 -1.16 -0.12 0.00 -0.91 0.00 0.00 33.84 32.18 2k8p n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k8p n ALA 139 N 0.23 1.31 -2.30 3.52 0.00 0.17 -4.00 120.51 119.44 2k8p n ALA 139 Ca 0.08 -1.02 -0.20 0.00 0.00 0.00 0.00 53.44 52.30 2k8p n ALA 139 Cb 0.33 -0.16 -0.08 0.00 0.00 0.00 0.00 19.45 19.54 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 -6.75 1.85 -0.29 0.00 0.01 -0.65 -4.96 113.70 102.92 2k8p s SER 140 Ca -0.34 -1.78 -0.24 0.00 1.31 0.00 0.00 55.95 54.90 2k8p s SER 140 Cb 0.09 0.57 0.15 0.00 0.21 0.00 0.00 66.02 67.04 2k8p s SER 140 CO 0.61 -1.07 1.17 0.00 0.41 0.00 0.00 173.24 174.36 2k8p s LYS 142 N 0.23 1.05 -0.37 0.00 0.00 -0.49 -4.96 119.74 115.20 2k8p s LYS 142 Ca 0.04 -1.21 -0.06 0.00 0.00 0.00 0.00 55.97 54.73 2k8p s LYS 142 Cb -0.05 -1.03 0.06 0.00 0.00 0.00 0.00 37.83 36.81 2k8p s LYS 142 CO -0.10 0.21 0.15 0.00 0.00 0.00 0.00 175.35 175.61 2k8p s LYS 144 N 1.37 0.79 0.20 0.00 2.20 -1.26 -4.91 119.74 118.13 2k8p s LYS 144 Ca 0.01 -0.72 -0.15 0.00 -0.36 0.00 0.00 55.97 54.74 2k8p s LYS 144 Cb -0.21 0.33 -0.08 0.00 -1.51 0.00 0.00 37.83 36.37 2k8p s LYS 144 CO 0.01 -0.25 0.62 0.50 -0.36 0.00 0.00 175.35 175.87 2k8p s ARG 145 N -3.09 4.03 -0.16 4.03 3.52 -1.26 -4.35 118.95 121.66 2k8p s ARG 145 Ca -0.01 0.58 -0.29 0.00 -0.13 0.00 0.00 55.73 55.88 2k8p s ARG 145 Cb 0.01 -2.82 0.10 0.00 -1.56 0.00 0.00 34.95 30.69 2k8p s ARG 145 CO -0.07 0.40 0.87 -1.17 -0.81 0.00 0.00 175.30 174.52 2k8p s LEU 146 N -2.21 -0.52 0.11 -0.88 2.96 -1.26 -5.01 118.68 111.88 2k8p s LEU 146 Ca 0.42 0.72 0.04 0.00 -0.22 0.00 0.00 54.13 55.09 2k8p s LEU 146 Cb -0.14 2.15 -0.04 0.00 0.50 0.00 0.00 46.19 48.66 2k8p s LEU 146 CO 0.20 -0.38 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.85 2k8p s THR 147 N -0.69 1.04 -0.00 3.68 2.01 -1.26 -4.65 115.64 115.76 2k8p s THR 147 Ca -0.03 -1.71 -0.17 0.00 0.31 0.00 0.00 61.69 60.08 2k8p s THR 147 Cb -0.02 -1.46 0.03 0.00 0.01 0.00 0.00 72.50 71.07 2k8p s THR 147 CO 0.03 -0.56 0.37 -0.13 -0.69 0.00 0.00 174.62 173.64 2k8p s ARG 148 N -2.90 0.78 0.40 4.92 1.81 -1.26 -5.18 118.95 117.52 2k8p s ARG 148 Ca 0.08 -0.20 0.03 0.00 -1.72 0.00 0.00 55.73 53.91 2k8p s ARG 148 Cb -0.02 0.35 -0.01 0.00 -0.45 0.00 0.00 34.95 34.81 2k8p s ARG 148 CO 0.01 -0.23 0.09 1.19 -0.68 0.00 0.00 175.30 175.67 2k8p n PHE 149 N 1.02 0.43 -3.62 -0.53 3.72 -1.26 -5.17 117.46 112.05 2k8p n PHE 149 Ca -0.20 -2.36 -0.05 0.00 -0.05 0.00 0.00 57.45 54.79 2k8p n PHE 149 Cb 0.57 -0.10 -0.04 0.00 -0.94 0.00 0.00 39.48 38.97 2k8p n PHE 149 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 2k8p s HIS 150 N -2.86 -0.14 0.31 1.38 2.46 -1.26 -5.19 115.29 109.99 2k8p s HIS 150 Ca 0.13 0.23 -0.19 0.00 0.47 0.00 0.00 55.06 55.70 2k8p s HIS 150 Cb 0.01 0.48 0.03 0.00 -0.13 0.00 0.00 32.58 32.97 2k8p s HIS 150 CO 0.09 -0.13 0.72 1.21 -2.47 0.00 0.00 174.74 174.17 2k8p s ASN 151 N -1.09 -0.14 0.38 9.88 2.47 -1.26 -5.19 114.94 119.99 2k8p s ASN 151 Ca 0.06 -0.81 -0.16 0.00 0.42 0.00 0.00 52.86 52.37 2k8p s ASN 151 Cb -0.01 0.76 0.05 0.00 -1.45 0.00 0.00 41.25 40.60 2k8p s ASN 151 CO -0.05 -1.45 0.78 -1.10 -3.72 0.00 0.00 177.10 171.57 2k8p s GLN 152 N -3.40 2.22 0.27 0.43 -0.21 -1.26 -5.19 119.66 112.51 2k8p s GLN 152 Ca 0.13 -1.42 0.06 0.00 0.02 0.00 0.00 55.36 54.15 2k8p s GLN 152 Cb -0.05 0.62 -0.02 0.00 1.00 0.00 0.00 33.01 34.56 2k8p s GLN 152 CO 0.09 -1.04 0.24 0.43 -2.12 0.00 0.00 175.29 172.89 2k8p n SER 153 N -1.37 -0.61 -3.62 5.90 7.64 -1.26 -5.18 113.62 115.12 2k8p n SER 153 Ca -0.08 -2.75 -0.05 0.00 1.01 0.00 0.00 58.87 57.01 2k8p n SER 153 Cb 0.60 1.40 -0.05 0.00 -1.01 0.00 0.00 64.21 65.15 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 -3.06 0.22 0.10 1.43 0.41 -1.26 -5.18 118.70 111.35 2k8p s GLU 154 Ca 0.32 0.06 0.06 0.00 -0.41 0.00 0.00 54.97 54.99 2k8p s GLU 154 Cb 0.01 0.10 -0.03 0.00 -1.78 0.00 0.00 34.13 32.43 2k8p s GLU 154 CO 0.22 -0.06 -0.14 -1.17 -0.49 0.00 0.00 175.26 173.62 2k8p s LEU 155 N -0.96 2.34 0.32 1.80 2.96 -1.26 -5.16 118.68 118.72 2k8p s LEU 155 Ca 0.06 -0.72 0.06 0.00 -0.22 0.00 0.00 54.13 53.31 2k8p s LEU 155 Cb -0.01 -0.53 -0.03 0.00 0.50 0.00 0.00 46.19 46.11 2k8p s LEU 155 CO -0.06 -0.11 0.25 -1.59 -1.32 0.00 0.00 176.35 173.52 2k8p s LYS 156 N -2.23 1.69 -0.28 1.98 -2.85 -1.26 -5.18 119.74 111.61 2k8p s LYS 156 Ca 0.04 -1.98 -0.24 0.00 -1.00 0.00 0.00 55.97 52.79 2k8p s LYS 156 Cb -0.07 0.28 0.13 0.00 -2.06 0.00 0.00 37.83 36.11 2k8p s LYS 156 CO 0.03 -0.61 1.07 0.34 0.10 0.00 0.00 175.35 176.28 2k8p s ASP 157 N -3.35 -0.41 -0.06 0.03 2.15 -1.26 -5.16 116.67 108.61 2k8p s ASP 157 Ca 0.40 0.77 -0.02 0.00 0.43 0.00 0.00 52.55 54.13 2k8p s ASP 157 Cb 0.03 0.83 0.04 0.00 -0.30 0.00 0.00 42.92 43.52 2k8p s ASP 157 CO 0.25 -0.13 0.07 -0.36 -0.17 0.00 0.00 175.17 174.83 2k8p s PHE 158 N 0.34 0.05 -0.30 -5.34 0.40 -1.26 -5.11 117.98 106.77 2k8p s PHE 158 Ca 0.02 0.22 -0.06 0.00 -0.60 0.00 0.00 56.93 56.52 2k8p s PHE 158 Cb -0.05 -0.49 0.19 0.00 0.51 0.00 0.00 43.02 43.18 2k8p s PHE 158 CO -0.08 -0.24 0.82 0.20 0.70 0.00 0.00 175.22 176.62 2k8p s GLY 159 N 2.18 -0.79 -0.19 4.36 0.00 -1.26 -5.15 107.32 106.46 2k8p s GLY 159 Ca 0.05 2.11 -0.12 0.00 0.00 0.00 0.00 44.72 46.76 2k8p s GLY 159 CO -0.04 3.66 0.47 -0.51 0.00 0.00 0.00 173.10 176.69 2k8p s THR 160 N 2.90 -0.02 -0.28 0.90 -4.23 -1.26 -5.16 115.64 108.50 2k8p s THR 160 Ca 0.12 0.06 -0.20 0.00 -1.18 0.00 0.00 61.69 60.49 2k8p s THR 160 Cb -0.11 -0.69 0.11 0.00 1.34 0.00 0.00 72.50 73.15 2k8p s THR 160 CO -0.18 0.02 0.89 -1.83 -0.54 0.00 0.00 174.62 172.98 2k8p s GLU 161 N 1.25 0.56 -0.02 3.99 -1.05 -1.26 -5.18 118.70 117.00 2k8p s GLU 161 Ca -0.08 0.82 -0.06 0.00 -0.15 0.00 0.00 54.97 55.50 2k8p s GLU 161 Cb -0.07 0.20 0.00 0.00 -0.44 0.00 0.00 34.13 33.82 2k8p s GLU 161 CO -0.12 -0.09 0.12 0.00 0.95 0.00 0.00 175.26 176.12 2k8p s ALA 162 N 0.90 -0.28 0.09 -0.84 0.00 -1.26 -5.17 121.76 115.20 2k8p s ALA 162 Ca -0.04 0.01 0.01 0.00 0.00 0.00 0.00 51.96 51.94 2k8p s ALA 162 Cb -0.05 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.08 2k8p s ALA 162 CO -0.11 -0.15 0.11 0.00 0.00 0.00 0.00 175.76 175.62 2k8p n ALA 163 N 2.04 0.18 -2.69 0.00 0.00 -1.26 -5.11 120.51 113.68 2k8p n ALA 163 Ca -0.19 -0.32 -0.05 0.00 0.00 0.00 0.00 53.44 52.87 2k8p n ALA 163 Cb 0.57 0.09 0.07 0.00 0.00 0.00 0.00 19.45 20.18 2k8p n ALA 163 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k8p n ARG 164 N -1.13 0.31 -1.14 0.00 3.00 -1.26 -5.17 116.66 111.27 2k8p n ARG 164 Ca 0.02 -0.98 -0.29 0.00 -0.00 0.00 0.00 57.85 56.60 2k8p n ARG 164 Cb 0.09 -0.55 0.20 0.00 0.00 0.00 0.00 32.46 32.20 2k8p n ARG 164 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k8p s PRO 165 N 0.25 -0.08 -0.11 -0.14 0.04 -1.26 -5.09 135.00 128.61 2k8p s PRO 165 Ca 0.27 0.34 -0.33 0.00 0.04 0.00 0.00 61.00 61.32 2k8p s PRO 165 Cb 0.22 -1.69 0.13 0.00 0.04 0.00 0.00 34.50 33.19 2k8p s PRO 165 CO -0.13 -3.04 1.14 1.14 0.04 0.00 0.00 177.00 176.15 2k8p s GLN 166 N -5.08 0.47 0.36 4.56 -2.07 -1.26 -5.19 119.66 111.45 2k8p s GLN 166 Ca 0.67 -0.19 0.04 0.00 -1.82 0.00 0.00 55.36 54.06 2k8p s GLN 166 Cb -0.16 0.20 -0.03 0.00 -1.09 0.00 0.00 33.01 31.93 2k8p s GLN 166 CO 0.57 -0.21 0.16 0.21 -1.32 0.00 0.00 175.29 174.71 2k8p s LYS 167 N -2.61 1.78 -0.24 9.60 2.20 -1.26 -5.17 119.74 124.04 2k8p s LYS 167 Ca 0.09 -2.05 -0.27 0.00 -0.36 0.00 0.00 55.97 53.38 2k8p s LYS 167 Cb -0.00 -0.29 0.14 0.00 -1.51 0.00 0.00 37.83 36.17 2k8p s LYS 167 CO -0.05 -0.49 1.11 0.20 -0.36 0.00 0.00 175.35 175.76 2k8p s GLY 168 N -3.48 -0.10 -0.30 5.54 0.00 -1.26 -5.17 107.32 102.55 2k8p s GLY 168 Ca 0.31 2.57 -0.20 0.00 0.00 0.00 0.00 44.72 47.40 2k8p s GLY 168 CO 0.18 1.47 1.26 1.09 0.00 0.00 0.00 173.10 177.09 2k8p s ARG 169 N -0.44 0.14 -0.46 2.90 1.70 -1.26 -5.11 118.95 116.42 2k8p s ARG 169 Ca 0.02 0.20 0.04 0.00 -0.47 0.00 0.00 55.73 55.52 2k8p s ARG 169 Cb -0.03 0.04 0.23 0.00 -0.57 0.00 0.00 34.95 34.63 2k8p s ARG 169 CO -0.05 -0.02 0.93 1.17 -1.08 0.00 0.00 175.30 176.25 2k8p n LYS 170 N 2.62 0.54 -2.25 3.89 0.00 -1.26 -5.15 118.16 116.54 2k8p n LYS 170 Ca -0.15 -1.54 -0.39 0.00 0.00 0.00 0.00 58.31 56.23 2k8p n LYS 170 Cb 0.57 -1.10 -0.02 0.00 0.00 0.00 0.00 35.03 34.48 2k8p n LYS 170 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2k8p s PRO 171 N 0.67 4.19 -0.45 1.64 0.04 -1.26 -5.01 135.00 134.83 2k8p s PRO 171 Ca 0.30 1.95 0.07 0.00 0.04 0.00 0.00 61.00 63.35 2k8p s PRO 171 Cb 0.15 -2.84 0.24 0.00 0.04 0.00 0.00 34.50 32.09 2k8p s PRO 171 CO -0.15 -0.23 0.73 2.89 0.04 0.00 0.00 177.00 180.27 2k8p n ARG 172 N 0.39 0.72 -1.15 4.56 1.85 -1.26 -5.15 116.66 116.62 2k8p n ARG 172 Ca 0.03 -2.32 -0.29 0.00 -1.00 0.00 0.00 57.85 54.27 2k8p n ARG 172 Cb 0.45 -1.39 0.19 0.00 -1.05 0.00 0.00 32.46 30.66 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2k8p s PRO 173 N 0.04 0.11 -0.10 2.89 0.04 -1.26 -5.08 135.00 131.63 2k8p s PRO 173 Ca 0.33 0.41 -0.06 0.00 0.04 0.00 0.00 61.00 61.72 2k8p s PRO 173 Cb 0.19 -1.71 0.04 0.00 0.04 0.00 0.00 34.50 33.06 2k8p s PRO 173 CO -0.19 -2.92 0.25 1.03 0.04 0.00 0.00 177.00 175.21 2k8p s ARG 174 N -5.02 0.24 0.04 4.56 0.52 -1.26 -5.16 118.95 112.86 2k8p s ARG 174 Ca 0.66 0.48 -0.01 0.00 -0.52 0.00 0.00 55.73 56.35 2k8p s ARG 174 Cb -0.18 -0.04 -0.03 0.00 0.52 0.00 0.00 34.95 35.22 2k8p s ARG 174 CO 0.58 -0.12 -0.03 0.00 0.02 0.00 0.00 175.30 175.74 2k8p s ALA 175 N 0.92 0.35 -0.30 2.13 0.00 -1.26 -5.15 121.76 118.44 2k8p s ALA 175 Ca -0.06 -0.95 -0.12 0.00 0.00 0.00 0.00 51.96 50.82 2k8p s ALA 175 Cb -0.08 0.22 0.17 0.00 0.00 0.00 0.00 23.12 23.43 2k8p s ALA 175 CO -0.06 -0.28 0.92 1.03 0.00 0.00 0.00 175.76 177.37 2k8p s ARG 176 N -2.88 0.34 -0.10 0.00 0.52 -1.26 -5.16 118.95 110.40 2k8p s ARG 176 Ca -0.03 0.77 -0.06 0.00 -0.52 0.00 0.00 55.73 55.90 2k8p s ARG 176 Cb 0.00 0.45 0.04 0.00 0.52 0.00 0.00 34.95 35.97 2k8p s ARG 176 CO -0.06 -0.19 0.25 -1.54 0.02 0.00 0.00 175.30 173.77 2k8p s SER 177 N 2.65 -0.26 -0.28 0.23 1.04 -1.26 -5.15 113.70 110.66 2k8p s SER 177 Ca 0.00 0.52 -0.24 0.00 0.48 0.00 0.00 55.95 56.72 2k8p s SER 177 Cb -0.09 0.42 0.13 0.00 0.10 0.00 0.00 66.02 66.59 2k8p s SER 177 CO -0.17 -0.16 1.06 0.00 0.98 0.00 0.00 173.24 174.96 2k8p s ALA 178 N 1.13 -2.04 -0.27 5.32 0.00 -1.26 -5.17 121.76 119.46 2k8p s ALA 178 Ca -0.08 1.91 -0.21 0.00 0.00 0.00 0.00 51.96 53.57 2k8p s ALA 178 Cb -0.09 -1.51 0.07 0.00 0.00 0.00 0.00 23.12 21.59 2k8p s ALA 178 CO -0.08 -0.24 0.70 0.21 0.00 0.00 0.00 175.76 176.36 2k8p s LYS 179 N 0.37 0.78 0.17 0.00 2.20 -1.26 -5.18 119.74 116.83 2k8p s LYS 179 Ca 0.02 1.09 -0.14 0.00 -0.36 0.00 0.00 55.97 56.58 2k8p s LYS 179 Cb -0.05 0.29 0.01 0.00 -1.51 0.00 0.00 37.83 36.58 2k8p s LYS 179 CO -0.08 -0.12 0.41 0.00 -0.36 0.00 0.00 175.35 175.19 2k8p s ALA 180 N 0.92 -0.54 -0.15 3.13 0.00 -1.26 -5.18 121.76 118.67 2k8p s ALA 180 Ca -0.04 -0.49 -0.34 0.00 0.00 0.00 0.00 51.96 51.09 2k8p s ALA 180 Cb -0.05 0.83 0.15 0.00 0.00 0.00 0.00 23.12 24.04 2k8p s ALA 180 CO -0.08 -0.72 1.37 0.54 0.00 0.00 0.00 175.76 176.87 2k8p s ASN 181 N -2.90 -0.03 -0.32 0.00 2.20 -1.26 -5.14 114.94 107.48 2k8p s ASN 181 Ca 0.12 -0.03 0.06 0.00 -0.94 0.00 0.00 52.86 52.07 2k8p s ASN 181 Cb 0.01 0.06 0.19 0.00 -2.00 0.00 0.00 41.25 39.51 2k8p s ASN 181 CO -0.03 -0.10 0.57 -1.58 -2.94 0.00 0.00 177.10 173.03 2k8p s GLN 182 N -2.15 0.61 -0.03 3.55 0.74 -1.26 -5.14 119.66 115.97 2k8p s GLN 182 Ca 0.13 0.25 -0.01 0.00 0.05 0.00 0.00 55.36 55.78 2k8p s GLN 182 Cb 0.03 0.12 0.03 0.00 1.10 0.00 0.00 33.01 34.29 2k8p s GLN 182 CO -0.05 -1.09 0.06 0.00 -0.55 0.00 0.00 175.29 173.67 2k8p s ALA 183 N 2.50 -0.01 0.05 1.58 0.00 -1.26 -5.15 121.76 119.47 2k8p s ALA 183 Ca 0.12 0.41 0.04 0.00 0.00 0.00 0.00 51.96 52.52 2k8p s ALA 183 Cb -0.09 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 2k8p s ALA 183 CO -0.21 -0.15 -0.11 -1.83 0.00 0.00 0.00 175.76 173.46 2k8p s GLU 184 N 1.18 0.67 -0.89 0.00 -1.05 -1.26 -5.10 118.70 112.26 2k8p s GLU 184 Ca -0.08 -0.81 -0.08 0.00 -0.15 0.00 0.00 54.97 53.85 2k8p s GLU 184 Cb -0.13 -0.56 0.23 0.00 -0.44 0.00 0.00 34.13 33.23 2k8p s GLU 184 CO -0.04 0.12 0.81 -0.51 0.95 0.00 0.00 175.26 176.59 2k8p s LEU 185 N -1.53 6.12 -0.13 1.83 2.01 -1.26 -5.02 118.68 120.70 2k8p s LEU 185 Ca -0.05 -3.20 0.02 0.00 0.01 0.00 0.00 54.13 50.90 2k8p s LEU 185 Cb -0.09 -2.08 0.02 0.00 0.01 0.00 0.00 46.19 44.04 2k8p s LEU 185 CO 0.01 -0.37 -0.17 -0.70 1.01 0.00 0.00 176.35 176.13 2k8p s GLU 186 N -0.61 2.43 -0.17 1.70 2.56 -1.26 -5.10 118.70 118.25 2k8p s GLU 186 Ca 0.23 -0.63 -0.04 0.00 0.00 0.00 0.00 54.97 54.53 2k8p s GLU 186 Cb -0.11 -2.07 0.08 0.00 2.00 0.00 0.00 34.13 34.03 2k8p s GLU 186 CO -0.08 -0.09 0.22 1.21 -0.56 0.00 0.00 175.26 175.96 2k8p s ASN 187 N 1.06 1.07 -0.53 -1.70 3.84 -1.26 -5.11 114.94 112.30 2k8p s ASN 187 Ca -0.04 0.03 -0.17 0.00 0.21 0.00 0.00 52.86 52.88 2k8p s ASN 187 Cb -0.15 0.43 0.09 0.00 -0.55 0.00 0.00 41.25 41.08 2k8p s ASN 187 CO -0.04 -0.30 0.56 0.00 -2.79 0.00 0.00 177.10 174.54 2k8p s ALA 188 N 2.34 3.50 0.00 1.71 0.00 -1.26 -5.36 121.76 122.69 2k8p s ALA 188 Ca 0.05 -2.17 0.00 0.00 0.00 0.00 0.00 51.96 49.85 2k8p s ALA 188 Cb -0.14 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.66 2k8p s ALA 188 CO -0.10 -2.05 0.00 0.66 0.00 0.00 0.00 175.76 174.27