#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8p n TRP 2 N 0.00 -3.56 -4.12 1.61 7.02 -1.26 -5.06 117.44 112.07 2k8p n TRP 2 Ca 0.00 1.55 -0.05 0.00 -1.02 0.00 0.00 57.50 57.98 2k8p n TRP 2 Cb 0.00 -3.75 -0.01 0.00 -2.42 0.00 0.00 31.31 25.13 2k8p n TRP 2 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 2k8p n GLN 3 N 0.52 1.79 -2.37 -0.99 6.02 -1.26 -5.17 117.38 115.92 2k8p n GLN 3 Ca 0.02 -0.58 -0.03 0.00 -0.01 0.00 0.00 57.00 56.41 2k8p n GLN 3 Cb 0.16 0.16 0.01 0.00 1.02 0.00 0.00 30.24 31.59 2k8p n GLN 3 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k8p n ALA 4 N -2.75 -0.99 -3.58 -1.58 0.00 -1.26 -5.20 120.51 105.16 2k8p n ALA 4 Ca -0.03 -0.50 -0.10 0.00 0.00 0.00 0.00 53.44 52.80 2k8p n ALA 4 Cb 0.10 0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2k8p n ALA 4 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2k8p s PHE 5 N -5.11 0.31 0.17 0.00 -0.71 -1.26 -5.19 117.98 106.18 2k8p s PHE 5 Ca 0.09 -0.84 -0.01 0.00 -1.04 0.00 0.00 56.93 55.12 2k8p s PHE 5 Cb -0.02 0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 42.34 2k8p s PHE 5 CO 0.04 -1.41 0.09 0.15 -1.34 0.00 0.00 175.22 172.75 2k8p s LYS 6 N -2.75 1.06 0.13 1.99 3.01 -1.26 -5.18 119.74 116.74 2k8p s LYS 6 Ca 0.19 -1.54 -0.02 0.00 -1.01 0.00 0.00 55.97 53.59 2k8p s LYS 6 Cb -0.04 0.25 -0.04 0.00 -1.01 0.00 0.00 37.83 36.99 2k8p s LYS 6 CO 0.13 -0.32 0.07 0.54 0.51 0.00 0.00 175.35 176.27 2k8p s ASN 7 N -3.11 0.29 0.35 2.83 4.22 -1.26 -5.18 114.94 113.09 2k8p s ASN 7 Ca 0.32 -1.17 0.03 0.00 -2.14 0.00 0.00 52.86 49.90 2k8p s ASN 7 Cb 0.07 0.30 -0.05 0.00 1.28 0.00 0.00 41.25 42.86 2k8p s ASN 7 CO 0.07 -0.74 0.09 -1.81 -2.04 0.00 0.00 177.10 172.68 2k8p s ASP 8 N -3.04 2.35 -0.15 3.54 1.01 -1.26 -5.17 116.67 113.95 2k8p s ASP 8 Ca 0.23 -1.50 -0.21 0.00 0.71 0.00 0.00 52.55 51.78 2k8p s ASP 8 Cb 0.07 0.19 0.05 0.00 1.01 0.00 0.00 42.92 44.24 2k8p s ASP 8 CO 0.01 -0.75 0.55 0.00 0.21 0.00 0.00 175.17 175.19 2k8p s ALA 9 N -3.34 -1.39 -0.89 5.23 0.00 -1.26 -5.10 121.76 115.02 2k8p s ALA 9 Ca 0.32 1.36 -0.04 0.00 0.00 0.00 0.00 51.96 53.60 2k8p s ALA 9 Cb 0.06 -0.60 0.22 0.00 0.00 0.00 0.00 23.12 22.80 2k8p s ALA 9 CO 0.15 -0.29 0.78 0.95 0.00 0.00 0.00 175.76 177.36 2k8p s THR 10 N -0.23 4.59 -1.52 0.00 -4.23 -1.26 -4.78 115.64 108.21 2k8p s THR 10 Ca -0.04 -3.61 0.18 0.00 -1.18 0.00 0.00 61.69 57.04 2k8p s THR 10 Cb -0.03 -3.84 -0.03 0.00 1.34 0.00 0.00 72.50 69.94 2k8p s THR 10 CO 0.03 -1.07 0.89 -0.62 -0.54 0.00 0.00 174.62 173.31 2k8p n GLU 11 N 2.62 1.55 -3.42 3.99 -0.58 -1.26 -4.82 120.64 118.74 2k8p n GLU 11 Ca 0.20 -0.76 -0.44 0.00 -0.42 0.00 0.00 57.16 55.74 2k8p n GLU 11 Cb 0.38 -1.32 -0.05 0.00 -0.57 0.00 0.00 31.44 29.87 2k8p n GLU 11 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2k8p s ILE 12 N -2.11 4.94 -0.59 -3.67 1.09 -1.26 -4.96 121.20 114.64 2k8p s ILE 12 Ca 0.14 -2.00 0.06 0.00 -1.10 0.00 0.00 60.65 57.75 2k8p s ILE 12 Cb 0.14 -4.15 0.23 0.00 -1.06 0.00 0.00 42.46 37.62 2k8p s ILE 12 CO 0.47 -0.89 0.62 -0.38 -0.10 0.00 0.00 174.94 174.66 2k8p n ILE 13 N 4.62 1.36 -2.07 2.92 -0.00 -1.26 -5.07 119.36 119.85 2k8p n ILE 13 Ca -0.02 -4.78 -0.42 0.00 -0.00 0.00 0.00 62.75 57.53 2k8p n ILE 13 Cb 0.42 -2.06 -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 -1.83 3.22 -1.22 0.38 0.04 -1.26 -4.92 135.00 129.40 2k8p s PRO 14 Ca 0.35 1.15 -0.08 0.00 0.04 0.00 0.00 61.00 62.46 2k8p s PRO 14 Cb 0.11 -4.21 0.21 0.00 0.04 0.00 0.00 34.50 30.64 2k8p s PRO 14 CO -0.08 -2.00 1.74 -1.91 0.04 0.00 0.00 177.00 174.80 2k8p n GLU 15 N 8.54 3.83 -2.42 4.56 2.13 -1.26 -5.00 120.64 131.01 2k8p n GLU 15 Ca 0.21 -3.82 -0.33 0.00 0.66 0.00 0.00 57.16 53.89 2k8p n GLU 15 Cb 0.48 -2.82 -0.03 0.00 0.27 0.00 0.00 31.44 29.34 2k8p n GLU 15 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2k8p s LEU 16 N -0.75 3.68 -0.45 4.31 1.43 -1.26 -5.02 118.68 120.61 2k8p s LEU 16 Ca 0.37 1.68 0.07 0.00 -1.03 0.00 0.00 54.13 55.22 2k8p s LEU 16 Cb 0.07 -4.52 0.32 0.00 0.03 0.00 0.00 46.19 42.09 2k8p s LEU 16 CO 0.03 -0.68 1.06 0.61 0.23 0.00 0.00 176.35 177.60 2k8p n GLY 17 N -1.15 0.94 3.68 -3.19 0.00 -1.26 -5.12 105.19 99.09 2k8p n GLY 17 Ca 0.07 -0.18 -0.47 0.00 0.00 0.00 0.00 46.02 45.44 2k8p n GLY 17 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2k8p n GLU 18 N 0.42 2.29 -3.51 1.61 0.28 -1.26 -4.92 120.64 115.54 2k8p n GLU 18 Ca 0.08 0.84 -0.27 0.00 -0.16 0.00 0.00 57.16 57.65 2k8p n GLU 18 Cb 0.69 -2.70 -0.09 0.00 1.43 0.00 0.00 31.44 30.78 2k8p n GLU 18 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 2k8p n TYR 19 N 6.57 3.03 -1.92 -1.84 9.36 -1.26 -5.10 117.16 126.00 2k8p n TYR 19 Ca 0.22 -4.11 -0.34 0.00 3.32 0.00 0.00 57.90 56.99 2k8p n TYR 19 Cb 0.31 -0.53 0.03 0.00 -0.63 0.00 0.00 39.34 38.53 2k8p n TYR 19 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2k8p s PRO 20 N -2.03 2.98 -0.41 2.98 0.04 -1.26 -5.02 135.00 132.28 2k8p s PRO 20 Ca 0.36 1.46 0.02 0.00 0.04 0.00 0.00 61.00 62.87 2k8p s PRO 20 Cb 0.10 -1.97 0.26 0.00 0.04 0.00 0.00 34.50 32.93 2k8p s PRO 20 CO -0.06 -1.12 1.06 -1.91 0.04 0.00 0.00 177.00 175.01 2k8p n GLU 21 N -2.06 0.43 -1.18 4.56 2.13 -1.26 -5.17 120.64 118.09 2k8p n GLU 21 Ca 0.11 -1.20 -0.29 0.00 0.66 0.00 0.00 57.16 56.44 2k8p n GLU 21 Cb 0.52 -0.82 0.16 0.00 0.27 0.00 0.00 31.44 31.57 2k8p n GLU 21 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2k8p s PRO 22 N 0.41 0.73 0.96 5.31 0.04 -1.26 -5.04 135.00 136.16 2k8p s PRO 22 Ca 0.29 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.84 2k8p s PRO 22 Cb 0.21 -1.76 0.17 0.00 0.04 0.00 0.00 34.50 33.15 2k8p s PRO 22 CO -0.16 -2.55 1.09 -1.25 0.04 0.00 0.00 177.00 174.17 2k8p s PRO 23 N -4.95 0.75 1.18 0.56 0.04 -1.26 -5.05 135.00 126.27 2k8p s PRO 23 Ca 0.65 0.63 -0.18 0.00 0.04 0.00 0.00 61.00 62.14 2k8p s PRO 23 Cb -0.18 -1.76 0.28 0.00 0.04 0.00 0.00 34.50 32.87 2k8p s PRO 23 CO 0.57 -2.54 1.11 -1.25 0.04 0.00 0.00 177.00 174.93 2k8p s PRO 24 N -4.95 -1.05 -0.30 0.56 0.04 -1.26 -5.08 135.00 122.96 2k8p s PRO 24 Ca 0.65 -0.01 -0.12 0.00 0.04 0.00 0.00 61.00 61.56 2k8p s PRO 24 Cb -0.18 -1.61 0.18 0.00 0.04 0.00 0.00 34.50 32.93 2k8p s PRO 24 CO 0.57 -3.61 1.08 -1.83 0.04 0.00 0.00 177.00 173.25 2k8p s GLU 25 N -5.36 0.11 0.00 4.56 -1.05 -1.26 -5.18 118.70 110.53 2k8p s GLU 25 Ca 0.70 0.12 0.00 0.00 -0.15 0.00 0.00 54.97 55.64 2k8p s GLU 25 Cb -0.11 0.05 0.00 0.00 -0.44 0.00 0.00 34.13 33.64 2k8p s GLU 25 CO 0.56 -0.21 0.00 1.28 0.95 0.00 0.00 175.26 177.84 2k8p n LEU 26 N 5.11 0.00 -3.73 1.83 4.77 -1.26 -5.19 117.00 118.53 2k8p n LEU 26 Ca 0.09 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.04 2k8p n LEU 26 Cb 0.58 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.66 2k8p n LEU 26 CO -0.17 0.00 0.79 -0.70 -1.33 0.00 0.00 177.39 175.98 2k8p s GLU 27 N 0.02 1.03 -0.26 3.23 2.12 -1.26 -5.18 118.70 118.40 2k8p s GLU 27 Ca 0.00 -0.57 -0.20 0.00 0.36 0.00 0.00 54.97 54.56 2k8p s GLU 27 Cb 0.00 0.35 0.07 0.00 0.26 0.00 0.00 34.13 34.81 2k8p s GLU 27 CO 0.00 -0.47 0.66 1.21 -0.54 0.00 0.00 175.26 176.12 2k8p s ASN 28 N -2.94 -0.76 -0.29 -1.70 2.47 -1.26 -5.17 114.94 105.29 2k8p s ASN 28 Ca 0.13 1.38 -0.23 0.00 0.42 0.00 0.00 52.86 54.56 2k8p s ASN 28 Cb -0.00 1.34 0.14 0.00 -1.45 0.00 0.00 41.25 41.28 2k8p s ASN 28 CO 0.01 -0.23 1.08 0.21 -3.72 0.00 0.00 177.10 174.45 2k8p s ASN 29 N 0.79 -0.40 -0.08 -4.21 3.84 -1.26 -5.17 114.94 108.44 2k8p s ASN 29 Ca -0.03 0.73 -0.08 0.00 0.21 0.00 0.00 52.86 53.68 2k8p s ASN 29 Cb -0.05 0.85 0.02 0.00 -0.55 0.00 0.00 41.25 41.53 2k8p s ASN 29 CO -0.06 -0.12 0.23 -1.59 -2.79 0.00 0.00 177.10 172.77 2k8p s LYS 30 N 0.49 0.29 -0.29 0.43 -2.85 -1.26 -5.15 119.74 111.40 2k8p s LYS 30 Ca 0.00 0.29 -0.16 0.00 -1.00 0.00 0.00 55.97 55.11 2k8p s LYS 30 Cb -0.05 0.14 0.17 0.00 -2.06 0.00 0.00 37.83 36.03 2k8p s LYS 30 CO -0.10 -0.04 1.09 0.95 0.10 0.00 0.00 175.35 177.36 2k8p s THR 31 N 0.05 -0.00 -0.28 3.79 -4.23 -1.26 -5.17 115.64 108.53 2k8p s THR 31 Ca -0.01 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.30 2k8p s THR 31 Cb -0.02 -1.00 0.13 0.00 1.34 0.00 0.00 72.50 72.95 2k8p s THR 31 CO 0.00 0.00 0.98 -0.04 -0.54 0.00 0.00 174.62 175.02 2k8p s MET 32 N 1.23 0.47 -0.30 3.99 -1.94 -1.26 -5.15 119.30 116.34 2k8p s MET 32 Ca -0.09 0.67 -0.14 0.00 -1.71 0.00 0.00 55.69 54.42 2k8p s MET 32 Cb -0.03 0.17 0.18 0.00 2.01 0.00 0.00 34.83 37.16 2k8p s MET 32 CO -0.13 -0.08 1.09 1.21 -0.01 0.00 0.00 175.02 177.10 2k8p s ASN 33 N 0.79 -0.39 0.10 3.03 3.84 -1.26 -5.18 114.94 115.87 2k8p s ASN 33 Ca -0.03 0.27 0.01 0.00 0.21 0.00 0.00 52.86 53.32 2k8p s ASN 33 Cb -0.04 1.34 -0.04 0.00 -0.55 0.00 0.00 41.25 41.95 2k8p s ASN 33 CO -0.11 -0.07 -0.03 0.00 -2.79 0.00 0.00 177.10 174.10 2k8p s ARG 34 N 2.87 0.83 -0.11 0.43 1.70 -1.26 -5.17 118.95 118.25 2k8p s ARG 34 Ca -0.02 -1.35 -0.33 0.00 -0.47 0.00 0.00 55.73 53.56 2k8p s ARG 34 Cb -0.09 -0.07 0.13 0.00 -0.57 0.00 0.00 34.95 34.35 2k8p s ARG 34 CO -0.11 -0.08 1.17 0.00 -1.08 0.00 0.00 175.30 175.19 2k8p s ALA 35 N -3.75 -2.05 -0.23 7.88 0.00 -1.26 -5.19 121.76 117.17 2k8p s ALA 35 Ca 0.14 1.25 -0.30 0.00 0.00 0.00 0.00 51.96 53.05 2k8p s ALA 35 Cb 0.06 0.10 0.16 0.00 0.00 0.00 0.00 23.12 23.45 2k8p s ALA 35 CO -0.04 -0.73 1.19 -1.83 0.00 0.00 0.00 175.76 174.35 2k8p s GLU 36 N -2.57 0.31 -0.14 0.00 -1.05 -1.26 -5.19 118.70 108.80 2k8p s GLU 36 Ca 0.10 0.08 -0.34 0.00 -0.15 0.00 0.00 54.97 54.66 2k8p s GLU 36 Cb 0.00 0.15 0.13 0.00 -0.44 0.00 0.00 34.13 33.97 2k8p s GLU 36 CO -0.05 -0.10 1.18 1.21 0.95 0.00 0.00 175.26 178.46 2k8p s ASN 37 N -1.04 -0.15 0.00 0.83 3.04 -1.26 -5.19 114.94 111.17 2k8p s ASN 37 Ca 0.04 -0.03 0.00 0.00 0.04 0.00 0.00 52.86 52.91 2k8p s ASN 37 Cb -0.01 0.18 0.00 0.00 -1.54 0.00 0.00 41.25 39.88 2k8p s ASN 37 CO -0.03 -0.29 0.00 0.61 -3.04 0.00 0.00 177.10 174.34 2k8p n GLY 38 N -0.17 3.67 0.00 1.21 0.00 -1.26 -5.17 105.19 103.48 2k8p n GLY 38 Ca -0.02 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.40 2k8p n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k8p n GLY 39 N -1.95 3.64 2.68 -0.02 0.00 -1.26 -5.12 105.19 103.15 2k8p n GLY 39 Ca 0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 46.02 45.70 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 0.22 -2.10 1.61 3.00 -1.26 -5.13 116.66 113.00 2k8p n ARG 40 Ca 0.00 -0.90 -0.43 0.00 -0.00 0.00 0.00 57.85 56.52 2k8p n ARG 40 Cb 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 32.46 32.09 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 0.43 3.58 0.42 -0.14 0.04 -1.26 -5.00 135.00 133.07 2k8p s PRO 41 Ca 0.26 1.47 -0.07 0.00 0.04 0.00 0.00 61.00 62.70 2k8p s PRO 41 Cb 0.18 -4.10 0.10 0.00 0.04 0.00 0.00 34.50 30.73 2k8p s PRO 41 CO -0.11 -1.56 0.37 -0.35 0.04 0.00 0.00 177.00 175.40 2k8p n PRO 42 N 8.03 -1.75 -3.61 0.56 -0.04 -1.26 -5.10 135.00 131.83 2k8p n PRO 42 Ca 0.20 -0.59 -0.07 0.00 -0.04 0.00 0.00 63.50 63.00 2k8p n PRO 42 Cb 0.46 -0.55 -0.05 0.00 -0.04 0.00 0.00 33.50 33.32 2k8p n PRO 42 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 2k8p s HIS 43 N -1.67 -0.23 0.08 0.54 -3.43 -1.26 -5.19 115.29 104.14 2k8p s HIS 43 Ca 0.24 0.39 0.00 0.00 -0.80 0.00 0.00 55.06 54.89 2k8p s HIS 43 Cb -0.02 0.47 -0.04 0.00 -1.43 0.00 0.00 32.58 31.55 2k8p s HIS 43 CO 0.18 -0.21 -0.04 -1.01 -2.00 0.00 0.00 174.74 171.67 2k8p s HIS 44 N -1.05 0.73 0.17 0.38 3.76 -1.26 -5.17 115.29 112.86 2k8p s HIS 44 Ca 0.03 -1.01 -0.03 0.00 -0.15 0.00 0.00 55.06 53.90 2k8p s HIS 44 Cb -0.01 -0.46 0.04 0.00 1.11 0.00 0.00 32.58 33.26 2k8p s HIS 44 CO -0.03 -0.28 0.15 -0.35 -0.85 0.00 0.00 174.74 173.39 2k8p n PRO 45 N 0.01 -1.33 -4.00 8.40 -0.04 -1.26 -5.10 135.00 131.69 2k8p n PRO 45 Ca -0.12 -0.25 -0.09 0.00 -0.04 0.00 0.00 63.50 63.00 2k8p n PRO 45 Cb 0.61 -0.23 -0.11 0.00 -0.04 0.00 0.00 33.50 33.73 2k8p n PRO 45 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2k8p s PHE 46 N -1.28 0.32 0.18 0.54 -0.71 -1.26 -5.17 117.98 110.59 2k8p s PHE 46 Ca 0.10 -0.65 -0.00 0.00 -1.04 0.00 0.00 56.93 55.34 2k8p s PHE 46 Cb -0.01 -0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.52 2k8p s PHE 46 CO 0.08 -0.25 0.07 -1.83 -1.34 0.00 0.00 175.22 171.95 2k8p s GLU 47 N -2.11 1.12 -0.20 1.99 -1.05 -1.26 -5.16 118.70 112.03 2k8p s GLU 47 Ca -0.10 -1.57 -0.08 0.00 -0.15 0.00 0.00 54.97 53.07 2k8p s GLU 47 Cb -0.05 0.05 0.08 0.00 -0.44 0.00 0.00 34.13 33.77 2k8p s GLU 47 CO -0.03 -0.27 0.44 0.99 0.95 0.00 0.00 175.26 177.34 2k8p s THR 48 N -3.94 -0.47 0.38 1.83 2.01 -1.26 -5.17 115.64 109.03 2k8p s THR 48 Ca 0.30 0.13 0.04 0.00 0.31 0.00 0.00 61.69 62.47 2k8p s THR 48 Cb 0.07 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.85 2k8p s THR 48 CO 0.07 0.05 0.08 -0.54 -0.69 0.00 0.00 174.62 173.59 2k8p s LYS 49 N 2.25 1.84 0.09 4.92 1.02 -1.26 -5.17 119.74 123.42 2k8p s LYS 49 Ca -0.04 -2.08 -0.13 0.00 0.02 0.00 0.00 55.97 53.74 2k8p s LYS 49 Cb -0.11 -0.89 0.02 0.00 -0.52 0.00 0.00 37.83 36.33 2k8p s LYS 49 CO -0.13 -0.31 0.29 0.16 -0.92 0.00 0.00 175.35 174.43 2k8p s ASP 50 N -3.59 -0.06 -0.04 2.83 1.47 -1.26 -5.18 116.67 110.84 2k8p s ASP 50 Ca 0.28 -0.41 -0.09 0.00 1.18 0.00 0.00 52.55 53.51 2k8p s ASP 50 Cb 0.06 0.39 0.02 0.00 -0.34 0.00 0.00 42.92 43.04 2k8p s ASP 50 CO 0.14 -0.74 0.21 -0.69 0.68 0.00 0.00 175.17 174.77 2k8p s VAL 51 N -3.47 0.04 -0.30 2.11 1.01 -1.26 -5.16 120.40 113.38 2k8p s VAL 51 Ca 0.01 -0.30 -0.24 0.00 0.00 0.00 0.00 61.98 61.46 2k8p s VAL 51 Cb 0.02 -0.40 0.18 0.00 0.00 0.00 0.00 36.38 36.19 2k8p s VAL 51 CO -0.09 -0.16 1.35 -0.94 0.00 0.00 0.00 175.10 175.25 2k8p s SER 52 N -0.59 -0.13 -0.03 3.32 1.04 -1.26 -5.19 113.70 110.86 2k8p s SER 52 Ca -0.07 0.24 -0.29 0.00 0.48 0.00 0.00 55.95 56.31 2k8p s SER 52 Cb -0.04 0.34 0.11 0.00 0.10 0.00 0.00 66.02 66.53 2k8p s SER 52 CO 0.01 -0.04 1.31 -0.70 0.98 0.00 0.00 173.24 174.80 2k8p s GLU 53 N 0.19 0.32 0.46 4.02 2.12 -1.26 -5.19 118.70 119.36 2k8p s GLU 53 Ca 0.05 -0.20 0.06 0.00 0.36 0.00 0.00 54.97 55.24 2k8p s GLU 53 Cb -0.05 0.09 -0.03 0.00 0.26 0.00 0.00 34.13 34.41 2k8p s GLU 53 CO -0.14 -0.15 0.18 1.52 -0.54 0.00 0.00 175.26 176.14 2k8p s TYR 54 N -2.11 2.23 0.24 5.30 -0.85 -1.26 -4.98 117.35 115.92 2k8p s TYR 54 Ca 0.25 -0.73 0.00 0.00 -0.52 0.00 0.00 57.07 56.07 2k8p s TYR 54 Cb 0.02 -1.87 0.00 0.00 0.38 0.00 0.00 41.96 40.49 2k8p s TYR 54 CO -0.02 0.06 0.00 0.43 -1.52 0.00 0.00 175.55 174.50 2k8p n SER 55 N -1.35 -7.43 -4.55 -0.18 7.64 -1.23 -4.32 113.62 102.20 2k8p n SER 55 Ca -0.05 1.10 -0.37 0.00 1.01 0.00 0.00 58.87 60.56 2k8p n SER 55 Cb 0.65 -3.13 -0.03 0.00 -1.01 0.00 0.00 64.21 60.68 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 6.36 2.93 -0.35 0.00 1.70 -0.06 -4.79 118.95 124.73 2k8p s ARG 57 Ca 0.56 1.86 -0.21 0.00 -0.47 0.00 0.00 55.73 57.47 2k8p s ARG 57 Cb -0.08 -1.92 0.00 0.00 -0.57 0.00 0.00 34.95 32.38 2k8p s ARG 57 CO 0.10 -1.25 0.65 -1.21 -1.08 0.00 0.00 175.30 172.51 2k8p s GLU 58 N -3.33 3.71 -0.07 3.89 8.01 -1.26 -3.70 118.70 125.95 2k8p s GLU 58 Ca 0.78 0.11 -0.11 0.00 0.01 0.00 0.00 54.97 55.76 2k8p s GLU 58 Cb -0.31 -3.80 -0.05 0.00 -4.31 0.00 0.00 34.13 25.66 2k8p s GLU 58 CO 0.34 -0.73 0.27 -0.51 0.01 0.00 0.00 175.26 174.64 2k8p s LEU 59 N 2.74 4.41 -0.12 1.80 1.43 -1.13 -4.93 118.68 122.89 2k8p s LEU 59 Ca 0.25 0.69 0.03 0.00 -1.03 0.00 0.00 54.13 54.07 2k8p s LEU 59 Cb -0.14 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.75 2k8p s LEU 59 CO 0.15 0.34 -0.22 -1.00 0.23 0.00 0.00 176.35 175.85 2k8p s HIS 60 N -0.90 2.63 -0.10 0.29 3.76 -1.26 -0.13 115.29 119.57 2k8p s HIS 60 Ca 0.19 -1.07 0.04 0.00 -0.15 0.00 0.00 55.06 54.07 2k8p s HIS 60 Cb -0.14 -1.76 -0.00 0.00 1.11 0.00 0.00 32.58 31.79 2k8p s HIS 60 CO 0.08 -0.44 -0.23 -0.06 -0.85 0.00 0.00 174.74 173.23 2k8p s PHE 61 N 0.48 2.56 -0.01 1.40 0.40 0.17 -4.93 117.98 118.05 2k8p s PHE 61 Ca -0.15 -0.99 0.03 0.00 -0.60 0.00 0.00 56.93 55.22 2k8p s PHE 61 Cb -0.17 -1.71 -0.03 0.00 0.51 0.00 0.00 43.02 41.62 2k8p s PHE 61 CO 0.06 -0.38 -0.06 0.99 0.70 0.00 0.00 175.22 176.52 2k8p s THR 62 N 0.28 3.72 -0.04 0.64 2.01 -1.26 -0.69 115.64 120.30 2k8p s THR 62 Ca -0.17 -0.71 -0.29 0.00 0.31 0.00 0.00 61.69 60.83 2k8p s THR 62 Cb -0.17 -2.61 0.11 0.00 0.01 0.00 0.00 72.50 69.83 2k8p s THR 62 CO 0.08 0.42 0.89 -0.60 -0.69 0.00 0.00 174.62 174.72 2k8p s ARG 63 N -1.36 0.79 -0.14 4.92 3.52 -1.12 -4.95 118.95 120.61 2k8p s ARG 63 Ca 0.17 -0.17 -0.19 0.00 -0.13 0.00 0.00 55.73 55.41 2k8p s ARG 63 Cb -0.11 0.37 -0.04 0.00 -1.56 0.00 0.00 34.95 33.61 2k8p s ARG 63 CO 0.07 -0.32 0.51 0.71 -0.81 0.00 0.00 175.30 175.46 2k8p s TYR 64 N -2.55 3.47 -0.08 5.12 1.51 -1.26 -0.49 117.35 123.07 2k8p s TYR 64 Ca 0.02 0.89 -0.06 0.00 -1.01 0.00 0.00 57.07 56.91 2k8p s TYR 64 Cb -0.01 -2.61 -0.04 0.00 -0.11 0.00 0.00 41.96 39.19 2k8p s TYR 64 CO -0.06 0.08 0.17 0.54 -1.11 0.00 0.00 175.55 175.17 2k8p s VAL 65 N 0.96 5.45 -0.06 0.71 0.11 -1.26 -5.00 120.40 121.31 2k8p s VAL 65 Ca 0.26 0.15 -0.02 0.00 -2.93 0.00 0.00 61.98 59.44 2k8p s VAL 65 Cb -0.15 -3.46 0.04 0.00 -1.53 0.00 0.00 36.38 31.27 2k8p s VAL 65 CO 0.11 0.53 0.12 0.42 -3.33 0.00 0.00 175.10 172.95 2k8p s THR 66 N -1.12 -0.07 -0.30 5.04 -4.23 -1.26 -1.82 115.64 111.87 2k8p s THR 66 Ca 0.19 0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 60.90 2k8p s THR 66 Cb -0.12 -0.21 0.10 0.00 1.34 0.00 0.00 72.50 73.60 2k8p s THR 66 CO 0.09 0.08 0.10 -0.62 -0.54 0.00 0.00 174.62 173.73 2k8p s ASP 67 N 1.26 3.95 0.00 3.99 -1.08 -1.23 -5.03 116.67 118.53 2k8p s ASP 67 Ca -0.08 -1.58 0.00 0.00 -0.52 0.00 0.00 52.55 50.37 2k8p s ASP 67 Cb -0.12 -0.82 0.00 0.00 -1.46 0.00 0.00 42.92 40.52 2k8p s ASP 67 CO -0.05 -0.41 0.00 0.61 0.52 0.00 0.00 175.17 175.84 2k8p n GLY 68 N 4.88 -1.26 0.00 2.66 0.00 -1.26 -4.12 105.19 106.09 2k8p n GLY 68 Ca -0.03 -1.66 0.07 0.00 0.00 0.00 0.00 46.02 44.41 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 0.15 -3.98 1.61 -0.04 -1.26 -4.74 135.00 126.74 2k8p n PRO 69 Ca 0.00 0.18 -0.21 0.00 -0.04 0.00 0.00 63.50 63.43 2k8p n PRO 69 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2k8p n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k8p s ARG 71 N -3.93 0.46 0.38 0.00 3.00 -0.21 -3.47 118.95 115.18 2k8p s ARG 71 Ca 0.35 -0.20 -0.26 0.00 0.00 0.00 0.00 55.73 55.62 2k8p s ARG 71 Cb -0.08 -0.45 -0.11 0.00 0.00 0.00 0.00 34.95 34.31 2k8p s ARG 71 CO 0.27 0.12 1.20 0.45 0.00 0.00 0.00 175.30 177.34 2k8p n SER 72 N 2.96 2.25 0.05 0.23 2.88 -0.76 -0.72 113.62 120.52 2k8p n SER 72 Ca -0.13 1.14 -0.07 0.00 -1.33 0.00 0.00 58.87 58.47 2k8p n SER 72 Cb 0.58 -1.44 0.09 0.00 -0.75 0.00 0.00 64.21 62.68 2k8p n SER 72 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k8p h ALA 73 N 2.13 0.76 -2.24 -1.46 0.00 -1.58 -3.46 119.26 113.42 2k8p h ALA 73 Ca -0.46 -0.54 -0.22 0.00 0.00 0.00 0.00 54.91 53.69 2k8p h ALA 73 Cb 1.30 -0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.87 2k8p h ALA 73 CO 0.60 0.72 -0.69 0.15 0.00 0.00 0.00 179.25 180.03 2k8p s LYS 74 N -3.81 0.84 1.02 0.00 1.02 -1.26 -5.12 119.74 112.43 2k8p s LYS 74 Ca -0.05 -1.34 -0.13 0.00 0.02 0.00 0.00 55.97 54.46 2k8p s LYS 74 Cb 0.11 -0.19 0.20 0.00 -0.52 0.00 0.00 37.83 37.44 2k8p s LYS 74 CO 0.82 -0.03 1.09 -1.25 -0.92 0.00 0.00 175.35 175.06 2k8p s PRO 75 N -3.84 0.22 -0.11 -1.68 0.04 -1.26 -4.65 135.00 123.71 2k8p s PRO 75 Ca 0.13 0.46 0.01 0.00 0.04 0.00 0.00 61.00 61.64 2k8p s PRO 75 Cb 0.05 -1.72 0.02 0.00 0.04 0.00 0.00 34.50 32.89 2k8p s PRO 75 CO -0.04 -2.86 -0.14 0.54 0.04 0.00 0.00 177.00 174.53 2k8p s VAL 76 N -2.96 1.42 -0.19 -0.36 0.11 0.35 -4.92 120.40 113.85 2k8p s VAL 76 Ca 0.66 -0.59 -0.16 0.00 -2.93 0.00 0.00 61.98 58.95 2k8p s VAL 76 Cb -0.18 -1.31 -0.04 0.00 -1.53 0.00 0.00 36.38 33.31 2k8p s VAL 76 CO 0.58 0.43 0.42 -0.89 -3.33 0.00 0.00 175.10 172.30 2k8p s THR 77 N 1.06 5.19 0.11 5.04 2.01 -1.26 -2.81 115.64 124.99 2k8p s THR 77 Ca -0.05 0.76 0.10 0.00 0.31 0.00 0.00 61.69 62.80 2k8p s THR 77 Cb -0.15 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 2k8p s THR 77 CO -0.02 0.25 -0.25 -1.83 -0.69 0.00 0.00 174.62 172.08 2k8p s GLU 78 N 1.28 1.55 0.27 4.92 -1.05 0.14 -4.92 118.70 120.89 2k8p s GLU 78 Ca 0.20 -1.27 -0.05 0.00 -0.15 0.00 0.00 54.97 53.70 2k8p s GLU 78 Cb -0.15 -1.96 -0.05 0.00 -0.44 0.00 0.00 34.13 31.53 2k8p s GLU 78 CO 0.08 0.47 0.54 -1.17 0.95 0.00 0.00 175.26 176.13 2k8p s LEU 79 N -1.93 4.08 0.05 1.83 0.20 -1.25 -0.66 118.68 121.00 2k8p s LEU 79 Ca 0.14 0.72 0.02 0.00 0.69 0.00 0.00 54.13 55.70 2k8p s LEU 79 Cb -0.10 -3.52 -0.03 0.00 -0.43 0.00 0.00 46.19 42.11 2k8p s LEU 79 CO 0.06 -0.17 -0.08 -0.69 -0.29 0.00 0.00 176.35 175.18 2k8p s VAL 80 N -2.03 0.61 -0.31 1.68 1.01 0.82 -4.50 120.40 117.67 2k8p s VAL 80 Ca 0.44 -1.17 -0.13 0.00 0.00 0.00 0.00 61.98 61.12 2k8p s VAL 80 Cb -0.11 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2k8p s VAL 80 CO 0.29 -0.40 0.26 0.00 0.00 0.00 0.00 175.10 175.25 2k8p s SER 82 N 1.73 -0.22 0.00 0.00 0.15 -1.24 -5.04 113.70 109.07 2k8p s SER 82 Ca 0.09 -0.63 0.00 0.00 0.70 0.00 0.00 55.95 56.11 2k8p s SER 82 Cb -0.16 0.70 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 2k8p s SER 82 CO 0.11 -1.30 0.00 0.61 1.20 0.00 0.00 173.24 173.85 2k8p n GLY 83 N -0.47 2.92 3.69 9.45 0.00 -1.26 -0.88 105.19 118.64 2k8p n GLY 83 Ca -0.05 -1.59 -0.36 0.00 0.00 0.00 0.00 46.02 44.02 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 -4.78 4.15 0.63 1.61 -0.21 -1.26 -4.33 119.66 115.47 2k8p s GLN 84 Ca 0.00 -0.11 0.04 0.00 0.02 0.00 0.00 55.36 55.30 2k8p s GLN 84 Cb 0.00 -3.49 0.12 0.00 1.00 0.00 0.00 33.01 30.64 2k8p s GLN 84 CO 0.00 0.13 0.87 0.00 -2.12 0.00 0.00 175.29 174.17 2k8p n GLY 86 N -2.01 -1.82 3.77 0.00 0.00 -1.26 -4.34 105.19 99.53 2k8p n GLY 86 Ca 0.16 0.45 -0.36 0.00 0.00 0.00 0.00 46.02 46.26 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 -0.96 3.59 -0.18 1.61 0.04 -1.26 -2.70 135.00 135.13 2k8p s PRO 87 Ca 0.00 1.71 0.07 0.00 0.04 0.00 0.00 61.00 62.82 2k8p s PRO 87 Cb 0.00 -2.24 0.22 0.00 0.04 0.00 0.00 34.50 32.52 2k8p s PRO 87 CO 0.00 -0.68 1.07 0.00 0.04 0.00 0.00 177.00 177.43 2k8p n ALA 88 N -0.83 0.93 -1.28 8.56 0.00 -1.26 -4.86 120.51 121.78 2k8p n ALA 88 Ca 0.09 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.96 2k8p n ALA 88 Cb 0.49 -0.65 0.22 0.00 0.00 0.00 0.00 19.45 19.51 2k8p n ALA 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k8p n ARG 89 N -0.83 2.19 -3.88 0.00 1.74 -1.26 -4.85 116.66 109.76 2k8p n ARG 89 Ca -0.11 -3.04 -0.30 0.00 -0.77 0.00 0.00 57.85 53.63 2k8p n ARG 89 Cb 0.70 -1.82 -0.14 0.00 -1.02 0.00 0.00 32.46 30.19 2k8p n ARG 89 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2k8p s LEU 90 N -3.09 3.94 0.26 0.55 1.43 -1.26 -5.09 118.68 115.42 2k8p s LEU 90 Ca 0.44 -3.00 0.07 0.00 -1.03 0.00 0.00 54.13 50.60 2k8p s LEU 90 Cb 0.38 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 45.08 2k8p s LEU 90 CO 0.03 -0.22 0.23 -0.76 0.23 0.00 0.00 176.35 175.86 2k8p s LEU 91 N -0.25 3.86 0.26 1.79 1.02 -1.26 -5.03 118.68 119.07 2k8p s LEU 91 Ca 0.18 -0.24 0.04 0.00 0.02 0.00 0.00 54.13 54.13 2k8p s LEU 91 Cb -0.23 -2.40 0.34 0.00 0.02 0.00 0.00 46.19 43.91 2k8p s LEU 91 CO -0.02 -0.08 1.64 1.55 0.02 0.00 0.00 176.35 179.46 2k8p h PRO 92 N 1.42 0.34 -2.07 1.29 0.13 -2.03 -3.34 132.00 127.73 2k8p h PRO 92 Ca -0.48 -0.18 -0.51 0.00 -0.87 0.00 0.00 66.00 63.96 2k8p h PRO 92 Cb 1.24 0.01 -0.41 0.00 0.13 0.00 0.00 31.00 31.97 2k8p h PRO 92 CO 0.60 0.73 -1.04 0.09 -0.23 0.00 0.00 178.00 178.15 2k8p n ASN 93 N -3.99 1.90 -3.05 1.44 3.02 -1.26 -4.94 115.26 108.37 2k8p n ASN 93 Ca -0.02 -3.20 -0.18 0.00 -0.03 0.00 0.00 54.58 51.14 2k8p n ASN 93 Cb 0.52 -0.60 -0.03 0.00 -0.61 0.00 0.00 39.78 39.06 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 0.12 1.24 -2.32 5.41 0.00 -1.26 -5.12 120.51 118.58 2k8p n ALA 94 Ca 0.27 -2.79 -0.17 0.00 0.00 0.00 0.00 53.44 50.75 2k8p n ALA 94 Cb 0.58 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.79 0.81 0.00 0.00 -5.25 -1.26 -4.69 121.20 110.01 2k8p s ILE 95 Ca 0.34 -2.01 0.00 0.00 -0.99 0.00 0.00 60.65 57.99 2k8p s ILE 95 Cb 0.21 -2.45 0.00 0.00 2.95 0.00 0.00 42.46 43.17 2k8p s ILE 95 CO -0.14 -0.20 0.00 0.61 -1.79 0.00 0.00 174.94 173.42 2k8p n GLY 96 N -0.43 0.73 3.08 6.27 0.00 -1.26 -4.55 105.19 109.03 2k8p n GLY 96 Ca -0.03 -0.46 -0.18 0.00 0.00 0.00 0.00 46.02 45.35 2k8p n GLY 96 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k8p n ARG 97 N -2.43 -2.20 -0.64 1.61 0.63 -1.26 -4.88 116.66 107.49 2k8p n ARG 97 Ca 0.00 1.87 -0.01 0.00 -0.92 0.00 0.00 57.85 58.79 2k8p n ARG 97 Cb 0.00 -4.52 0.23 0.00 0.45 0.00 0.00 32.46 28.61 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 -0.35 2.77 1.24 5.14 0.00 -1.26 -5.04 105.19 107.70 2k8p n GLY 98 Ca 0.04 -0.63 0.17 0.00 0.00 0.00 0.00 46.02 45.60 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 0.15 -2.56 -3.71 1.61 5.02 -1.26 -4.60 118.16 112.81 2k8p n LYS 99 Ca 0.24 1.77 -0.34 0.00 -2.02 0.00 0.00 58.31 57.95 2k8p n LYS 99 Cb 0.97 -3.10 -0.08 0.00 -0.02 0.00 0.00 35.03 32.80 2k8p n LYS 99 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2k8p s TRP 100 N -2.40 3.78 0.12 2.13 0.23 -1.26 -4.87 118.94 116.66 2k8p s TRP 100 Ca 0.00 -3.09 -0.02 0.00 -2.03 0.00 0.00 56.10 50.96 2k8p s TRP 100 Cb 0.00 -3.10 -0.15 0.00 0.03 0.00 0.00 33.47 30.24 2k8p s TRP 100 CO 0.00 -0.70 1.26 2.35 0.96 0.00 0.00 176.95 180.82 2k8p h TRP 101 N 5.93 0.44 -4.35 -1.98 -0.00 -2.05 -3.46 115.95 110.47 2k8p h TRP 101 Ca 0.14 -0.27 -0.51 0.00 -0.00 0.00 0.00 58.89 58.25 2k8p h TRP 101 Cb 0.81 -0.03 0.08 0.00 -0.00 0.00 0.00 29.16 30.01 2k8p h TRP 101 CO 0.71 1.14 0.39 1.03 -0.00 0.00 0.00 178.44 181.72 2k8p s ARG 102 N -2.97 3.20 0.52 2.65 0.52 -1.26 -4.96 118.95 116.65 2k8p s ARG 102 Ca -0.04 0.81 0.33 0.00 -0.52 0.00 0.00 55.73 56.31 2k8p s ARG 102 Cb 0.09 -2.03 1.37 0.00 0.52 0.00 0.00 34.95 34.89 2k8p s ARG 102 CO 0.86 -0.88 1.97 -1.00 0.02 0.00 0.00 175.30 176.27 2k8p h PRO 103 N -0.55 0.00 -2.96 3.54 0.13 -2.04 -3.49 132.00 126.63 2k8p h PRO 103 Ca -0.44 0.00 0.34 0.00 -0.87 0.00 0.00 66.00 65.03 2k8p h PRO 103 Cb 1.21 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.23 2k8p h PRO 103 CO 0.60 0.00 -0.65 0.43 -0.23 0.00 0.00 178.00 178.15 2k8p n SER 104 N -2.98 -7.77 0.00 1.44 7.64 -1.26 -5.03 113.62 105.66 2k8p n SER 104 Ca 0.01 0.73 0.00 0.00 1.01 0.00 0.00 58.87 60.62 2k8p n SER 104 Cb 0.29 -4.07 0.00 0.00 -1.01 0.00 0.00 64.21 59.41 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 -4.03 -1.67 3.77 0.23 0.00 -1.26 -5.17 105.19 97.06 2k8p n GLY 105 Ca -0.01 0.71 -0.32 0.00 0.00 0.00 0.00 46.02 46.40 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 2.46 -0.22 1.61 0.04 -1.26 -4.61 135.00 133.02 2k8p s PRO 106 Ca 0.00 1.25 -0.07 0.00 0.04 0.00 0.00 61.00 62.22 2k8p s PRO 106 Cb 0.00 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.65 2k8p s PRO 106 CO 0.00 -1.49 0.14 -3.47 0.04 0.00 0.00 177.00 172.21 2k8p n ASP 107 N -3.11 -3.80 -1.42 6.66 -0.08 -1.10 -4.95 116.55 108.75 2k8p n ASP 107 Ca 0.10 1.35 -0.03 0.00 -1.51 0.00 0.00 54.79 54.69 2k8p n ASP 107 Cb 0.53 -5.06 -0.01 0.00 2.34 0.00 0.00 41.12 38.91 2k8p n ASP 107 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 2k8p n PHE 108 N 1.35 -0.50 -0.26 -0.67 7.35 -1.26 -4.97 117.46 118.51 2k8p n PHE 108 Ca -0.23 -0.51 -0.00 0.00 -0.76 0.00 0.00 57.45 55.95 2k8p n PHE 108 Cb 0.38 0.10 0.00 0.00 0.35 0.00 0.00 39.48 40.31 2k8p n PHE 108 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2k8p n ARG 109 N -0.12 -1.50 -4.17 -4.13 3.00 -1.26 -4.52 116.66 103.96 2k8p n ARG 109 Ca 0.01 -0.01 -0.21 0.00 -0.00 0.00 0.00 57.85 57.64 2k8p n ARG 109 Cb 0.12 -0.01 -0.16 0.00 0.00 0.00 0.00 32.46 32.41 2k8p n ARG 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k8p s ILE 111 N 1.00 4.62 1.05 0.00 -4.36 0.90 -4.85 121.20 119.57 2k8p s ILE 111 Ca -0.10 1.01 -0.14 0.00 -0.26 0.00 0.00 60.65 61.17 2k8p s ILE 111 Cb -0.14 -3.67 0.21 0.00 1.25 0.00 0.00 42.46 40.11 2k8p s ILE 111 CO -0.00 -0.44 1.10 -2.16 0.24 0.00 0.00 174.94 173.67 2k8p s PRO 112 N -3.57 0.04 0.02 0.37 0.04 -1.26 -1.27 135.00 129.37 2k8p s PRO 112 Ca 0.56 0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.98 2k8p s PRO 112 Cb -0.10 -1.70 -0.00 0.00 0.04 0.00 0.00 34.50 32.74 2k8p s PRO 112 CO 0.25 -2.96 0.02 -3.47 0.04 0.00 0.00 177.00 170.87 2k8p n ASP 113 N -4.31 -0.05 -4.58 6.66 -0.08 -1.17 -4.40 116.55 108.62 2k8p n ASP 113 Ca 0.06 -1.11 -0.44 0.00 -1.51 0.00 0.00 54.79 51.80 2k8p n ASP 113 Cb 0.58 0.10 -0.01 0.00 2.34 0.00 0.00 41.12 44.13 2k8p n ASP 113 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 2k8p n ARG 114 N -0.03 1.26 -3.04 -0.67 0.63 -1.26 -4.64 116.66 108.90 2k8p n ARG 114 Ca 0.00 0.44 -0.19 0.00 -0.92 0.00 0.00 57.85 57.19 2k8p n ARG 114 Cb 0.03 -1.83 0.04 0.00 0.45 0.00 0.00 32.46 31.15 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 -1.13 1.97 -0.13 -0.14 1.51 -1.26 -1.15 117.35 117.02 2k8p s TYR 115 Ca 0.60 -0.60 -0.05 0.00 -1.01 0.00 0.00 57.07 56.01 2k8p s TYR 115 Cb -0.67 -2.27 0.06 0.00 -0.11 0.00 0.00 41.96 38.97 2k8p s TYR 115 CO 0.59 -0.85 0.27 1.03 -1.11 0.00 0.00 175.55 175.48 2k8p s ARG 116 N -4.53 0.18 -0.35 -0.62 0.52 0.87 -4.46 118.95 110.55 2k8p s ARG 116 Ca 0.59 0.69 -0.19 0.00 -0.52 0.00 0.00 55.73 56.30 2k8p s ARG 116 Cb -0.07 -0.05 -0.00 0.00 0.52 0.00 0.00 34.95 35.35 2k8p s ARG 116 CO 0.36 -0.24 0.59 0.00 0.02 0.00 0.00 175.30 176.03 2k8p s ALA 117 N 2.04 3.47 -0.17 2.13 0.00 -1.26 -1.24 121.76 126.73 2k8p s ALA 117 Ca -0.02 -0.88 -0.10 0.00 0.00 0.00 0.00 51.96 50.95 2k8p s ALA 117 Cb -0.11 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 2k8p s ALA 117 CO -0.09 -1.25 0.17 -1.14 0.00 0.00 0.00 175.76 173.45 2k8p s GLN 118 N 2.57 4.03 -0.11 0.00 0.74 0.72 -4.87 119.66 122.74 2k8p s GLN 118 Ca 0.22 -0.12 -0.05 0.00 0.05 0.00 0.00 55.36 55.47 2k8p s GLN 118 Cb -0.15 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.56 2k8p s GLN 118 CO 0.14 0.41 0.07 1.03 -0.55 0.00 0.00 175.29 176.39 2k8p s ARG 119 N 0.03 3.23 0.29 1.67 0.52 -1.26 -0.14 118.95 123.29 2k8p s ARG 119 Ca 0.12 -0.27 0.08 0.00 -0.52 0.00 0.00 55.73 55.13 2k8p s ARG 119 Cb -0.12 -3.00 -0.06 0.00 0.52 0.00 0.00 34.95 32.30 2k8p s ARG 119 CO 0.01 0.73 -0.08 0.14 0.02 0.00 0.00 175.30 176.12 2k8p s VAL 120 N -0.92 1.84 -0.31 3.52 -7.23 0.97 -4.95 120.40 113.32 2k8p s VAL 120 Ca 0.14 -2.17 0.03 0.00 -1.81 0.00 0.00 61.98 58.17 2k8p s VAL 120 Cb -0.12 -2.46 0.09 0.00 0.56 0.00 0.00 36.38 34.45 2k8p s VAL 120 CO 0.03 -0.30 0.01 -1.58 -0.31 0.00 0.00 175.10 172.95 2k8p s GLN 121 N -3.68 1.61 -0.16 4.82 0.74 -1.26 -1.29 119.66 120.44 2k8p s GLN 121 Ca 0.30 -1.66 -0.22 0.00 0.05 0.00 0.00 55.36 53.82 2k8p s GLN 121 Cb 0.03 -3.03 -0.03 0.00 1.10 0.00 0.00 33.01 31.08 2k8p s GLN 121 CO 0.13 -0.84 0.67 -0.51 -0.55 0.00 0.00 175.29 174.19 2k8p s LEU 122 N 1.02 4.19 0.08 3.68 1.43 0.86 -1.43 118.68 128.51 2k8p s LEU 122 Ca 0.06 0.96 -0.02 0.00 -1.03 0.00 0.00 54.13 54.09 2k8p s LEU 122 Cb -0.19 -2.98 -0.05 0.00 0.03 0.00 0.00 46.19 43.01 2k8p s LEU 122 CO -0.08 -0.25 0.27 -0.76 0.23 0.00 0.00 176.35 175.76 2k8p s LEU 123 N 1.67 4.33 0.27 1.79 2.01 0.10 -0.10 118.68 128.75 2k8p s LEU 123 Ca 0.32 0.41 0.10 0.00 0.01 0.00 0.00 54.13 54.97 2k8p s LEU 123 Cb -0.16 -3.05 -0.05 0.00 0.01 0.00 0.00 46.19 42.94 2k8p s LEU 123 CO 0.12 0.14 -0.08 0.00 1.01 0.00 0.00 176.35 177.54 2k8p n PRO 125 N -0.75 -1.21 -1.93 0.00 -0.04 -1.26 -4.83 135.00 124.98 2k8p n PRO 125 Ca -0.06 -0.16 -0.41 0.00 -0.04 0.00 0.00 63.50 62.84 2k8p n PRO 125 Cb 0.59 -0.15 -0.03 0.00 -0.04 0.00 0.00 33.50 33.88 2k8p n PRO 125 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k8p s GLY 126 N -2.66 0.42 0.00 0.55 0.00 -1.26 -2.98 107.32 101.38 2k8p s GLY 126 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.75 2k8p s GLY 126 CO 0.05 3.47 0.00 0.61 0.00 0.00 0.00 173.10 177.23 2k8p n GLY 127 N 5.61 4.14 4.00 0.20 0.00 -1.26 -5.12 105.19 112.76 2k8p n GLY 127 Ca 0.24 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 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 1.61 0.28 1.61 0.41 -1.16 -5.13 118.70 116.33 2k8p s GLU 128 Ca 0.00 -1.25 0.11 0.00 -0.41 0.00 0.00 54.97 53.42 2k8p s GLU 128 Cb 0.00 -2.35 -0.05 0.00 -1.78 0.00 0.00 34.13 29.95 2k8p s GLU 128 CO 0.00 -1.49 -0.16 0.00 -0.49 0.00 0.00 175.26 173.12 2k8p s ALA 129 N -3.14 2.84 0.47 5.21 0.00 -1.26 -4.75 121.76 121.13 2k8p s ALA 129 Ca 0.67 -1.85 -0.22 0.00 0.00 0.00 0.00 51.96 50.56 2k8p s ALA 129 Cb -0.04 -0.34 -0.07 0.00 0.00 0.00 0.00 23.12 22.66 2k8p s ALA 129 CO 0.45 0.26 1.16 -1.25 0.00 0.00 0.00 175.76 176.38 2k8p s PRO 130 N -3.55 3.69 -0.02 0.00 0.04 -1.26 -4.36 135.00 129.54 2k8p s PRO 130 Ca 0.30 1.74 -0.01 0.00 0.04 0.00 0.00 61.00 63.08 2k8p s PRO 130 Cb -0.05 -2.34 0.02 0.00 0.04 0.00 0.00 34.50 32.18 2k8p s PRO 130 CO 0.16 -0.60 0.05 0.50 0.04 0.00 0.00 177.00 177.15 2k8p s ARG 131 N -2.80 0.01 0.22 4.56 3.52 0.86 -4.99 118.95 120.34 2k8p s ARG 131 Ca 0.65 0.16 -0.06 0.00 -0.13 0.00 0.00 55.73 56.36 2k8p s ARG 131 Cb -0.28 -0.13 -0.06 0.00 -1.56 0.00 0.00 34.95 32.93 2k8p s ARG 131 CO 0.33 -0.10 0.48 0.00 -0.81 0.00 0.00 175.30 175.20 2k8p s ALA 132 N 0.66 3.68 0.08 6.12 0.00 -1.26 -0.10 121.76 130.94 2k8p s ALA 132 Ca -0.05 -0.52 0.04 0.00 0.00 0.00 0.00 51.96 51.43 2k8p s ALA 132 Cb -0.08 -2.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.77 2k8p s ALA 132 CO -0.02 0.46 -0.12 0.50 0.00 0.00 0.00 175.76 176.57 2k8p s ARG 133 N -3.08 0.78 -0.11 0.00 3.00 -0.41 -4.92 118.95 114.21 2k8p s ARG 133 Ca 0.43 -0.98 0.02 0.00 -1.00 0.00 0.00 55.73 54.20 2k8p s ARG 133 Cb -0.11 -0.66 -0.01 0.00 0.00 0.00 0.00 34.95 34.17 2k8p s ARG 133 CO 0.26 0.13 -0.17 0.21 0.00 0.00 0.00 175.30 175.74 2k8p s LYS 134 N -2.02 3.16 -0.12 5.12 2.20 -1.26 -0.02 119.74 126.80 2k8p s LYS 134 Ca -0.01 -0.75 0.02 0.00 -0.36 0.00 0.00 55.97 54.87 2k8p s LYS 134 Cb -0.08 -2.49 0.01 0.00 -1.51 0.00 0.00 37.83 33.76 2k8p s LYS 134 CO 0.01 0.26 -0.19 0.14 -0.36 0.00 0.00 175.35 175.21 2k8p s VAL 135 N 0.21 1.76 -0.55 4.02 -7.23 0.80 -4.96 120.40 114.46 2k8p s VAL 135 Ca -0.10 -0.81 -0.22 0.00 -1.81 0.00 0.00 61.98 59.04 2k8p s VAL 135 Cb -0.16 -1.58 0.05 0.00 0.56 0.00 0.00 36.38 35.26 2k8p s VAL 135 CO 0.06 0.49 0.80 -0.60 -0.31 0.00 0.00 175.10 175.54 2k8p s ARG 136 N 0.84 3.20 0.01 4.82 6.06 -1.26 -0.20 118.95 132.42 2k8p s ARG 136 Ca -0.08 -0.65 0.08 0.00 -2.50 0.00 0.00 55.73 52.58 2k8p s ARG 136 Cb -0.15 -4.10 -0.02 0.00 0.06 0.00 0.00 34.95 30.73 2k8p s ARG 136 CO -0.00 -1.42 -0.24 -0.48 -2.50 0.00 0.00 175.30 170.66 2k8p s LEU 137 N 3.35 2.10 0.33 -0.88 2.34 -0.37 -4.96 118.68 120.58 2k8p s LEU 137 Ca 0.22 -0.48 -0.27 0.00 0.06 0.00 0.00 54.13 53.66 2k8p s LEU 137 Cb -0.16 -1.19 -0.13 0.00 -0.56 0.00 0.00 46.19 44.15 2k8p s LEU 137 CO 0.14 0.26 1.03 0.52 -1.06 0.00 0.00 176.35 177.24 2k8p n VAL 138 N 2.21 2.08 -0.08 1.48 0.31 -1.26 -0.09 118.33 122.98 2k8p n VAL 138 Ca -0.16 -0.50 -0.09 0.00 -0.01 0.00 0.00 64.34 63.58 2k8p n VAL 138 Cb 0.52 -1.09 -0.11 0.00 -0.91 0.00 0.00 33.84 32.26 2k8p n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k8p n ALA 139 N 0.03 1.63 -2.43 3.52 0.00 -0.30 -3.87 120.51 119.10 2k8p n ALA 139 Ca 0.09 -0.92 -0.11 0.00 0.00 0.00 0.00 53.44 52.50 2k8p n ALA 139 Cb 0.34 -0.03 -0.09 0.00 0.00 0.00 0.00 19.45 19.68 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 -5.05 0.11 -0.15 0.00 0.01 -0.43 -4.99 113.70 103.20 2k8p s SER 140 Ca -0.12 -1.24 -0.18 0.00 1.31 0.00 0.00 55.95 55.72 2k8p s SER 140 Cb 0.05 0.42 0.05 0.00 0.21 0.00 0.00 66.02 66.74 2k8p s SER 140 CO 0.55 -0.89 0.49 0.00 0.41 0.00 0.00 173.24 173.80 2k8p s LYS 142 N -0.12 1.38 -0.37 0.00 1.02 -0.39 -4.93 119.74 116.33 2k8p s LYS 142 Ca -0.03 -1.42 -0.07 0.00 0.02 0.00 0.00 55.97 54.47 2k8p s LYS 142 Cb -0.03 -1.66 0.05 0.00 -0.52 0.00 0.00 37.83 35.67 2k8p s LYS 142 CO 0.02 0.37 0.16 0.00 -0.92 0.00 0.00 175.35 174.98 2k8p s LYS 144 N 1.40 0.83 0.71 0.00 2.20 -1.08 -4.88 119.74 118.93 2k8p s LYS 144 Ca 0.01 -0.69 -0.07 0.00 -0.36 0.00 0.00 55.97 54.86 2k8p s LYS 144 Cb -0.21 0.35 0.07 0.00 -1.51 0.00 0.00 37.83 36.53 2k8p s LYS 144 CO 0.02 -0.27 1.02 -0.98 -0.36 0.00 0.00 175.35 174.79 2k8p s ARG 145 N -3.10 2.11 0.14 4.03 1.70 -1.26 -3.81 118.95 118.76 2k8p s ARG 145 Ca -0.01 -0.30 -0.17 0.00 -0.47 0.00 0.00 55.73 54.77 2k8p s ARG 145 Cb 0.01 -2.17 0.04 0.00 -0.57 0.00 0.00 34.95 32.27 2k8p s ARG 145 CO -0.07 -1.29 0.45 -0.48 -1.08 0.00 0.00 175.30 172.83 2k8p s LEU 146 N -5.26 0.19 -0.22 -1.89 2.34 -1.26 -5.00 118.68 107.58 2k8p s LEU 146 Ca 0.61 -0.27 0.12 0.00 0.06 0.00 0.00 54.13 54.65 2k8p s LEU 146 Cb -0.10 2.01 0.32 0.00 -0.56 0.00 0.00 46.19 47.86 2k8p s LEU 146 CO 0.45 -0.89 1.33 0.41 -1.06 0.00 0.00 176.35 176.58 2k8p n THR 147 N -0.26 0.18 -3.53 5.48 -1.04 -1.26 -5.06 114.28 108.78 2k8p n THR 147 Ca -0.16 -1.01 -0.20 0.00 -2.04 0.00 0.00 64.05 60.64 2k8p n THR 147 Cb 0.64 0.92 -0.02 0.00 -1.82 0.00 0.00 70.33 70.04 2k8p n THR 147 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k8p s ARG 148 N -0.46 2.64 0.06 -2.82 1.70 -1.26 -5.14 118.95 113.68 2k8p s ARG 148 Ca 0.11 -1.42 -0.01 0.00 -0.47 0.00 0.00 55.73 53.94 2k8p s ARG 148 Cb 0.31 -2.47 0.01 0.00 -0.57 0.00 0.00 34.95 32.23 2k8p s ARG 148 CO -0.09 -0.13 0.10 0.34 -1.08 0.00 0.00 175.30 174.44 2k8p n PHE 149 N -1.56 -0.88 -3.84 5.89 7.35 -1.26 -5.19 117.46 117.97 2k8p n PHE 149 Ca 0.03 -0.35 -0.07 0.00 -0.76 0.00 0.00 57.45 56.31 2k8p n PHE 149 Cb 0.61 0.12 0.02 0.00 0.35 0.00 0.00 39.48 40.58 2k8p n PHE 149 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2k8p s HIS 150 N -6.14 0.12 0.16 -5.13 2.46 -1.26 -5.19 115.29 100.30 2k8p s HIS 150 Ca 0.04 -0.70 -0.07 0.00 0.47 0.00 0.00 55.06 54.80 2k8p s HIS 150 Cb -0.00 0.79 0.03 0.00 -0.13 0.00 0.00 32.58 33.27 2k8p s HIS 150 CO 0.03 -1.34 0.37 0.09 -2.47 0.00 0.00 174.74 171.42 2k8p n ASN 151 N -1.39 -0.98 -4.09 9.88 4.13 -1.26 -5.19 115.26 116.36 2k8p n ASN 151 Ca -0.06 -1.66 -0.09 0.00 1.68 0.00 0.00 54.58 54.45 2k8p n ASN 151 Cb 0.60 1.63 -0.09 0.00 -1.54 0.00 0.00 39.78 40.38 2k8p n ASN 151 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k8p s GLN 152 N -2.04 0.96 -0.29 3.52 -2.07 -1.26 -5.17 119.66 113.31 2k8p s GLN 152 Ca 0.08 -1.34 -0.33 0.00 -1.82 0.00 0.00 55.36 51.95 2k8p s GLN 152 Cb -0.02 0.28 0.18 0.00 -1.09 0.00 0.00 33.01 32.36 2k8p s GLN 152 CO 0.05 -0.29 1.37 0.45 -1.32 0.00 0.00 175.29 175.55 2k8p s SER 153 N -3.01 -0.02 0.00 12.60 0.15 -1.26 -5.19 113.70 116.96 2k8p s SER 153 Ca 0.20 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.87 2k8p s SER 153 Cb 0.06 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 2k8p s SER 153 CO -0.00 -0.03 0.00 -1.84 1.20 0.00 0.00 173.24 172.57 2k8p n GLU 154 N 0.31 0.00 -4.15 5.44 -0.00 -1.26 -5.19 120.64 115.79 2k8p n GLU 154 Ca 0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 57.16 57.07 2k8p n GLU 154 Cb 0.58 0.00 -0.09 0.00 -0.00 0.00 0.00 31.44 31.93 2k8p n GLU 154 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2k8p s LEU 155 N 0.00 1.20 -0.13 -1.84 0.20 -1.26 -5.17 118.68 111.68 2k8p s LEU 155 Ca 0.00 -1.26 -0.07 0.00 0.69 0.00 0.00 54.13 53.50 2k8p s LEU 155 Cb 0.00 0.57 0.05 0.00 -0.43 0.00 0.00 46.19 46.38 2k8p s LEU 155 CO 0.00 -0.85 0.30 -0.54 -0.29 0.00 0.00 176.35 174.97 2k8p s LYS 156 N -4.10 0.27 -0.31 1.98 1.02 -1.26 -5.11 119.74 112.23 2k8p s LYS 156 Ca 0.32 0.61 -0.12 0.00 0.02 0.00 0.00 55.97 56.80 2k8p s LYS 156 Cb 0.06 -0.08 0.19 0.00 -0.52 0.00 0.00 37.83 37.47 2k8p s LYS 156 CO 0.08 -0.16 1.07 0.34 -0.92 0.00 0.00 175.35 175.77 2k8p s ASP 157 N 1.27 -0.31 0.00 2.83 2.15 -1.26 -5.18 116.67 116.18 2k8p s ASP 157 Ca -0.09 -0.03 0.00 0.00 0.43 0.00 0.00 52.55 52.86 2k8p s ASP 157 Cb -0.09 0.90 0.00 0.00 -0.30 0.00 0.00 42.92 43.43 2k8p s ASP 157 CO -0.10 -0.05 0.00 0.49 -0.17 0.00 0.00 175.17 175.35 2k8p n PHE 158 N 4.58 -0.24 0.00 -5.34 3.72 -1.26 -5.18 117.46 113.74 2k8p n PHE 158 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 2k8p n PHE 158 Cb 0.60 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.14 2k8p n PHE 158 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k8p n GLY 159 N 0.00 2.22 2.65 1.37 0.00 -1.26 -5.14 105.19 105.04 2k8p n GLY 159 Ca 0.00 0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 2k8p n GLY 159 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k8p s THR 160 N -0.18 -0.22 0.01 2.61 -4.23 -1.26 -5.13 115.64 107.23 2k8p s THR 160 Ca 0.00 -0.51 0.00 0.00 -1.18 0.00 0.00 61.69 60.01 2k8p s THR 160 Cb 0.00 -0.89 -0.01 0.00 1.34 0.00 0.00 72.50 72.94 2k8p s THR 160 CO 0.00 -0.52 -0.02 -1.83 -0.54 0.00 0.00 174.62 171.72 2k8p s GLU 161 N 2.23 0.15 0.43 3.99 -1.05 -1.26 -5.17 118.70 118.02 2k8p s GLU 161 Ca 0.08 -0.19 0.02 0.00 -0.15 0.00 0.00 54.97 54.73 2k8p s GLU 161 Cb -0.15 -0.05 0.02 0.00 -0.44 0.00 0.00 34.13 33.51 2k8p s GLU 161 CO -0.29 0.01 0.20 0.00 0.95 0.00 0.00 175.26 176.12 2k8p n ALA 162 N 2.67 0.55 -2.50 -0.84 0.00 -1.26 -5.15 120.51 113.98 2k8p n ALA 162 Ca -0.15 -1.80 -0.22 0.00 0.00 0.00 0.00 53.44 51.27 2k8p n ALA 162 Cb 0.58 0.84 -0.00 0.00 0.00 0.00 0.00 19.45 20.87 2k8p n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k8p s ALA 163 N -2.66 3.83 -0.54 0.00 0.00 -1.26 -5.07 121.76 116.06 2k8p s ALA 163 Ca 0.15 -1.09 0.07 0.00 0.00 0.00 0.00 51.96 51.09 2k8p s ALA 163 Cb -0.01 -2.03 0.25 0.00 0.00 0.00 0.00 23.12 21.33 2k8p s ALA 163 CO 0.09 -0.16 0.65 0.54 0.00 0.00 0.00 175.76 176.88 2k8p n ARG 164 N -1.87 1.78 -2.26 0.00 5.12 -1.26 -5.10 116.66 113.07 2k8p n ARG 164 Ca -0.02 -4.09 -0.39 0.00 -1.93 0.00 0.00 57.85 51.42 2k8p n ARG 164 Cb 0.57 -1.84 -0.02 0.00 -1.16 0.00 0.00 32.46 30.00 2k8p n ARG 164 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2k8p s PRO 165 N -1.93 4.24 -0.22 5.56 0.04 -1.26 -5.03 135.00 136.40 2k8p s PRO 165 Ca 0.38 1.96 0.02 0.00 0.04 0.00 0.00 61.00 63.40 2k8p s PRO 165 Cb 0.15 -2.89 0.04 0.00 0.04 0.00 0.00 34.50 31.85 2k8p s PRO 165 CO -0.05 -0.19 -0.13 -0.65 0.04 0.00 0.00 177.00 176.01 2k8p s GLN 166 N -1.99 2.39 -0.09 4.56 -0.21 -1.26 -5.11 119.66 117.95 2k8p s GLN 166 Ca 0.52 -1.08 0.02 0.00 0.02 0.00 0.00 55.36 54.84 2k8p s GLN 166 Cb -0.34 -2.69 -0.02 0.00 1.00 0.00 0.00 33.01 30.96 2k8p s GLN 166 CO 0.44 -0.44 -0.13 0.21 -2.12 0.00 0.00 175.29 173.25 2k8p s LYS 167 N 1.23 2.94 -0.07 2.91 2.20 -1.26 -5.11 119.74 122.57 2k8p s LYS 167 Ca -0.03 -0.67 -0.03 0.00 -0.36 0.00 0.00 55.97 54.88 2k8p s LYS 167 Cb -0.17 -2.52 0.04 0.00 -1.51 0.00 0.00 37.83 33.67 2k8p s LYS 167 CO -0.08 0.44 0.14 0.20 -0.36 0.00 0.00 175.35 175.69 2k8p s GLY 168 N -0.24 0.05 0.26 5.54 0.00 -1.26 -5.15 107.32 106.53 2k8p s GLY 168 Ca 0.01 0.53 -0.21 0.00 0.00 0.00 0.00 44.72 45.06 2k8p s GLY 168 CO 0.03 1.44 0.69 1.09 0.00 0.00 0.00 173.10 176.35 2k8p s ARG 169 N 1.97 1.70 -0.29 2.90 1.70 -1.26 -5.18 118.95 120.50 2k8p s ARG 169 Ca 0.00 -0.94 -0.22 0.00 -0.47 0.00 0.00 55.73 54.10 2k8p s ARG 169 Cb -0.12 0.60 0.14 0.00 -0.57 0.00 0.00 34.95 35.00 2k8p s ARG 169 CO -0.05 -0.77 1.07 0.21 -1.08 0.00 0.00 175.30 174.67 2k8p s LYS 170 N -3.90 0.39 0.56 3.89 2.47 -1.26 -5.17 119.74 116.73 2k8p s LYS 170 Ca 0.10 0.54 -0.19 0.00 -1.56 0.00 0.00 55.97 54.87 2k8p s LYS 170 Cb -0.05 0.15 -0.05 0.00 -1.46 0.00 0.00 37.83 36.42 2k8p s LYS 170 CO 0.04 -0.06 1.12 -1.25 0.16 0.00 0.00 175.35 175.37 2k8p s PRO 171 N 0.62 3.27 -0.76 4.03 0.04 -1.26 -5.00 135.00 135.94 2k8p s PRO 171 Ca -0.01 1.57 0.03 0.00 0.04 0.00 0.00 61.00 62.63 2k8p s PRO 171 Cb -0.04 -2.00 0.24 0.00 0.04 0.00 0.00 34.50 32.74 2k8p s PRO 171 CO -0.10 -0.91 0.82 0.54 0.04 0.00 0.00 177.00 177.39 2k8p n ARG 172 N -1.48 2.72 -2.05 4.56 1.74 -1.26 -5.02 116.66 115.87 2k8p n ARG 172 Ca 0.11 -4.60 -0.27 0.00 -0.77 0.00 0.00 57.85 52.32 2k8p n ARG 172 Cb 0.51 -2.32 -0.05 0.00 -1.02 0.00 0.00 32.46 29.57 2k8p n ARG 172 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2k8p s PRO 173 N -2.20 2.54 -0.05 5.56 0.04 -1.26 -4.91 135.00 134.72 2k8p s PRO 173 Ca 0.34 -0.52 0.01 0.00 0.04 0.00 0.00 61.00 60.87 2k8p s PRO 173 Cb 0.07 -5.11 0.02 0.00 0.04 0.00 0.00 34.50 29.52 2k8p s PRO 173 CO -0.04 -3.54 -0.05 0.50 0.04 0.00 0.00 177.00 173.91 2k8p s ARG 174 N 6.86 0.94 0.25 4.56 3.52 -1.26 -5.15 118.95 128.68 2k8p s ARG 174 Ca 0.70 -0.13 0.05 0.00 -0.13 0.00 0.00 55.73 56.21 2k8p s ARG 174 Cb -0.05 -0.94 -0.05 0.00 -1.56 0.00 0.00 34.95 32.34 2k8p s ARG 174 CO 0.03 -0.09 -0.04 0.00 -0.81 0.00 0.00 175.30 174.39 2k8p s ALA 175 N 0.98 2.08 0.59 6.12 0.00 -1.26 -5.16 121.76 125.11 2k8p s ALA 175 Ca -0.10 -1.83 -0.02 0.00 0.00 0.00 0.00 51.96 50.02 2k8p s ALA 175 Cb -0.14 0.31 0.04 0.00 0.00 0.00 0.00 23.12 23.33 2k8p s ALA 175 CO -0.00 -0.15 0.84 0.50 0.00 0.00 0.00 175.76 176.95 2k8p s ARG 176 N -3.79 2.51 -0.02 0.00 3.52 -1.26 -5.11 118.95 114.80 2k8p s ARG 176 Ca 0.28 -0.55 0.03 0.00 -0.13 0.00 0.00 55.73 55.36 2k8p s ARG 176 Cb 0.05 -2.39 -0.00 0.00 -1.56 0.00 0.00 34.95 31.05 2k8p s ARG 176 CO 0.10 -0.83 -0.09 -1.54 -0.81 0.00 0.00 175.30 172.13 2k8p s SER 177 N -4.43 1.19 -0.06 -2.12 1.04 -1.26 -5.14 113.70 102.92 2k8p s SER 177 Ca 0.57 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.83 2k8p s SER 177 Cb -0.10 -0.25 0.02 0.00 0.10 0.00 0.00 66.02 65.78 2k8p s SER 177 CO 0.41 0.08 -0.06 0.00 0.98 0.00 0.00 173.24 174.65 2k8p s ALA 178 N 0.04 0.88 0.20 5.32 0.00 -1.26 -5.15 121.76 121.79 2k8p s ALA 178 Ca -0.01 -0.20 0.08 0.00 0.00 0.00 0.00 51.96 51.84 2k8p s ALA 178 Cb -0.07 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 2k8p s ALA 178 CO 0.00 -0.07 -0.00 -1.59 0.00 0.00 0.00 175.76 174.10 2k8p s LYS 179 N 1.04 2.37 -0.05 0.00 -2.85 -1.26 -5.14 119.74 113.86 2k8p s LYS 179 Ca -0.09 -1.18 -0.21 0.00 -1.00 0.00 0.00 55.97 53.50 2k8p s LYS 179 Cb -0.14 -2.31 0.04 0.00 -2.06 0.00 0.00 37.83 33.36 2k8p s LYS 179 CO -0.00 0.43 0.46 0.00 0.10 0.00 0.00 175.35 176.34 2k8p s ALA 180 N -1.86 -1.19 -0.10 0.59 0.00 -1.26 -5.18 121.76 112.77 2k8p s ALA 180 Ca 0.28 0.82 -0.32 0.00 0.00 0.00 0.00 51.96 52.73 2k8p s ALA 180 Cb -0.09 -0.07 0.12 0.00 0.00 0.00 0.00 23.12 23.09 2k8p s ALA 180 CO 0.19 -0.29 1.13 1.21 0.00 0.00 0.00 175.76 178.00 2k8p s ASN 181 N -1.06 -0.18 -0.20 0.00 3.84 -1.26 -5.19 114.94 110.89 2k8p s ASN 181 Ca -0.11 -0.04 -0.32 0.00 0.21 0.00 0.00 52.86 52.60 2k8p s ASN 181 Cb -0.03 0.22 0.15 0.00 -0.55 0.00 0.00 41.25 41.04 2k8p s ASN 181 CO 0.06 -0.37 1.19 -1.58 -2.79 0.00 0.00 177.10 173.61 2k8p s GLN 182 N -2.63 0.32 0.29 0.43 0.74 -1.26 -5.19 119.66 112.36 2k8p s GLN 182 Ca 0.09 -0.02 -0.20 0.00 0.05 0.00 0.00 55.36 55.27 2k8p s GLN 182 Cb -0.00 0.15 0.03 0.00 1.10 0.00 0.00 33.01 34.28 2k8p s GLN 182 CO -0.05 -0.12 0.73 0.00 -0.55 0.00 0.00 175.29 175.30 2k8p s ALA 183 N -1.74 -1.16 0.30 1.58 0.00 -1.26 -5.19 121.76 114.30 2k8p s ALA 183 Ca 0.07 -0.37 -0.18 0.00 0.00 0.00 0.00 51.96 51.47 2k8p s ALA 183 Cb -0.01 0.82 0.02 0.00 0.00 0.00 0.00 23.12 23.96 2k8p s ALA 183 CO -0.04 -1.03 0.70 -2.00 0.00 0.00 0.00 175.76 173.38 2k8p s GLU 184 N -3.69 1.86 -0.12 0.00 2.12 -1.26 -5.09 118.70 112.52 2k8p s GLU 184 Ca 0.12 -1.15 -0.05 0.00 0.36 0.00 0.00 54.97 54.24 2k8p s GLU 184 Cb -0.06 0.59 -0.06 0.00 0.26 0.00 0.00 34.13 34.87 2k8p s GLU 184 CO 0.08 -0.85 -0.15 1.28 -0.54 0.00 0.00 175.26 175.08 2k8p n LEU 185 N -0.47 1.08 -2.85 2.70 4.32 -1.26 -5.09 117.00 115.43 2k8p n LEU 185 Ca -0.05 0.13 -0.08 0.00 -0.02 0.00 0.00 56.01 55.99 2k8p n LEU 185 Cb 0.60 -0.37 0.01 0.00 -1.62 0.00 0.00 43.42 42.04 2k8p n LEU 185 CO 0.19 0.30 0.01 1.21 -1.22 0.00 0.00 177.39 177.88 2k8p n GLU 186 N -3.48 -2.45 -2.61 3.23 2.13 -1.26 -4.92 120.64 111.28 2k8p n GLU 186 Ca -0.24 2.16 -0.43 0.00 0.66 0.00 0.00 57.16 59.31 2k8p n GLU 186 Cb 0.68 -5.62 -0.02 0.00 0.27 0.00 0.00 31.44 26.74 2k8p n GLU 186 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 2k8p s ASN 187 N -2.54 7.07 0.28 4.31 0.01 -1.26 -5.03 114.94 117.78 2k8p s ASN 187 Ca 0.24 1.45 0.08 0.00 -0.71 0.00 0.00 52.86 53.92 2k8p s ASN 187 Cb -0.07 -2.54 -0.06 0.00 0.41 0.00 0.00 41.25 39.00 2k8p s ASN 187 CO 0.77 -0.68 -0.10 0.00 -1.51 0.00 0.00 177.10 175.58 2k8p s ALA 188 N 3.24 2.46 -1.54 0.60 0.00 -1.26 -5.35 121.76 119.90 2k8p s ALA 188 Ca 0.46 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.53 2k8p s ALA 188 Cb -0.16 0.03 0.00 0.00 0.00 0.00 0.00 23.12 22.99 2k8p s ALA 188 CO 0.08 0.03 0.38 2.48 0.00 0.00 0.00 175.76 178.73