#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8q h ILE 2 N 0.00 1.08 -2.91 -0.61 2.04 -1.93 -3.47 117.51 111.71 2k8q h ILE 2 Ca 0.00 -2.83 -0.59 0.00 1.00 0.00 0.00 64.86 62.44 2k8q h ILE 2 Cb 0.00 2.62 0.15 0.00 -0.74 0.00 0.00 36.82 38.85 2k8q h ILE 2 CO 0.00 0.72 -0.15 1.07 0.00 0.00 0.00 178.15 179.80 2k8q n THR 3 N -3.28 2.40 0.01 -0.27 5.66 -1.26 -4.93 114.28 112.61 2k8q n THR 3 Ca -0.15 -0.50 -0.13 0.00 -3.05 0.00 0.00 64.05 60.22 2k8q n THR 3 Cb 1.03 -0.86 -0.10 0.00 -1.55 0.00 0.00 70.33 68.86 2k8q n THR 3 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2k8q h PRO 4 N 0.82 -0.06 -2.98 1.09 0.13 -1.92 -3.48 132.00 125.61 2k8q h PRO 4 Ca -0.44 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2k8q h PRO 4 Cb 1.38 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.41 2k8q h PRO 4 CO 0.52 0.41 0.22 1.03 -0.23 0.00 0.00 178.00 179.94 2k8q s ARG 5 N -4.20 1.36 -0.22 0.86 3.00 -1.26 -5.10 118.95 113.39 2k8q s ARG 5 Ca -0.15 -0.56 -0.29 0.00 0.00 0.00 0.00 55.73 54.73 2k8q s ARG 5 Cb 0.02 0.59 0.15 0.00 0.00 0.00 0.00 34.95 35.70 2k8q s ARG 5 CO 0.64 -0.60 1.12 -0.59 0.00 0.00 0.00 175.30 175.87 2k8q s PHE 6 N -3.76 -0.29 -0.02 -0.53 -0.12 -1.26 -1.63 117.98 110.36 2k8q s PHE 6 Ca 0.03 0.55 0.06 0.00 -0.05 0.00 0.00 56.93 57.52 2k8q s PHE 6 Cb -0.02 0.45 -0.01 0.00 -0.63 0.00 0.00 43.02 42.81 2k8q s PHE 6 CO -0.09 -0.23 -0.20 -1.12 -0.05 0.00 0.00 175.22 173.52 2k8q s SER 7 N -0.77 2.43 -0.02 1.98 0.01 0.78 -4.89 113.70 113.21 2k8q s SER 7 Ca 0.02 -0.38 0.03 0.00 1.31 0.00 0.00 55.95 56.93 2k8q s SER 7 Cb -0.02 -0.36 -0.03 0.00 0.21 0.00 0.00 66.02 65.82 2k8q s SER 7 CO -0.03 0.24 -0.08 -0.63 0.41 0.00 0.00 173.24 173.15 2k8q s ILE 8 N -0.39 3.60 0.05 1.44 1.01 -1.26 0.36 121.20 126.02 2k8q s ILE 8 Ca 0.05 -0.70 0.06 0.00 0.00 0.00 0.00 60.65 60.07 2k8q s ILE 8 Cb -0.09 -2.53 -0.02 0.00 0.01 0.00 0.00 42.46 39.83 2k8q s ILE 8 CO -0.00 0.47 -0.16 -0.89 0.00 0.00 0.00 174.94 174.35 2k8q s THR 9 N -0.92 1.31 0.00 2.92 2.01 0.30 -4.83 115.64 116.44 2k8q s THR 9 Ca 0.15 -1.15 0.03 0.00 0.31 0.00 0.00 61.69 61.03 2k8q s THR 9 Cb -0.11 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 2k8q s THR 9 CO 0.05 0.01 -0.07 -1.10 -0.69 0.00 0.00 174.62 172.82 2k8q s GLN 10 N -1.32 2.54 0.26 4.92 1.11 -1.26 -1.28 119.66 124.62 2k8q s GLN 10 Ca 0.03 -0.73 0.02 0.00 0.01 0.00 0.00 55.36 54.70 2k8q s GLN 10 Cb -0.09 -2.50 -0.05 0.00 -1.01 0.00 0.00 33.01 29.36 2k8q s GLN 10 CO 0.02 0.60 0.06 -0.51 0.01 0.00 0.00 175.29 175.47 2k8q s ASP 11 N -1.42 1.55 0.00 5.90 1.01 -0.65 -4.94 116.67 118.13 2k8q s ASP 11 Ca 0.17 -1.32 0.13 0.00 0.71 0.00 0.00 52.55 52.24 2k8q s ASP 11 Cb -0.11 0.08 0.49 0.00 1.01 0.00 0.00 42.92 44.38 2k8q s ASP 11 CO 0.07 -0.64 1.36 -1.84 0.21 0.00 0.00 175.17 174.33 2k8q n GLU 12 N -0.47 1.56 0.00 8.23 0.28 -1.26 -3.91 120.64 125.06 2k8q n GLU 12 Ca -0.02 -0.85 0.00 0.00 -0.16 0.00 0.00 57.16 56.13 2k8q n GLU 12 Cb 0.65 -1.27 0.00 0.00 1.43 0.00 0.00 31.44 32.26 2k8q n GLU 12 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2k8q n GLU 13 N 0.14 1.40 -2.55 3.44 0.28 -1.26 -2.66 120.64 119.43 2k8q n GLU 13 Ca 0.11 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.10 2k8q n GLU 13 Cb 0.23 -0.80 0.01 0.00 1.43 0.00 0.00 31.44 32.31 2k8q n GLU 13 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 2k8q n PHE 14 N -1.70 -0.90 -4.25 -1.84 -1.74 -1.25 -4.51 117.46 101.25 2k8q n PHE 14 Ca 0.00 -0.57 -0.34 0.00 -0.56 0.00 0.00 57.45 55.98 2k8q n PHE 14 Cb 0.30 0.28 -0.08 0.00 1.52 0.00 0.00 39.48 41.50 2k8q n PHE 14 CO 0.00 0.00 0.00 0.42 -0.56 0.00 0.00 176.76 176.62 2k8q s ILE 15 N -2.33 4.44 -0.33 1.97 -1.09 -0.16 -1.63 121.20 122.06 2k8q s ILE 15 Ca 0.11 -0.36 0.02 0.00 -2.23 0.00 0.00 60.65 58.19 2k8q s ILE 15 Cb -0.01 -2.94 0.10 0.00 -1.58 0.00 0.00 42.46 38.02 2k8q s ILE 15 CO 0.02 0.48 0.07 0.12 -1.23 0.00 0.00 174.94 174.40 2k8q s PHE 16 N -1.03 2.98 -0.22 3.97 5.36 -0.40 -1.85 117.98 126.79 2k8q s PHE 16 Ca 0.18 -2.53 -0.16 0.00 -0.96 0.00 0.00 56.93 53.46 2k8q s PHE 16 Cb -0.12 -2.47 -0.04 0.00 -0.34 0.00 0.00 43.02 40.06 2k8q s PHE 16 CO 0.08 -0.92 0.41 -1.17 -1.46 0.00 0.00 175.22 172.15 2k8q s LEU 17 N 1.16 4.12 -0.10 6.12 2.96 0.12 -0.54 118.68 132.53 2k8q s LEU 17 Ca 0.11 0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 54.48 2k8q s LEU 17 Cb -0.18 -2.51 -0.03 0.00 0.50 0.00 0.00 46.19 43.96 2k8q s LEU 17 CO -0.14 -0.12 -0.06 -0.75 -1.32 0.00 0.00 176.35 173.96 2k8q s LYS 18 N 1.55 3.07 0.05 1.98 2.20 0.16 0.07 119.74 128.82 2k8q s LYS 18 Ca 0.18 -0.54 0.08 0.00 -0.36 0.00 0.00 55.97 55.33 2k8q s LYS 18 Cb -0.15 -2.70 -0.03 0.00 -1.51 0.00 0.00 37.83 33.45 2k8q s LYS 18 CO 0.08 0.51 -0.23 0.42 -0.36 0.00 0.00 175.35 175.78 2k8q s ILE 19 N -0.40 1.82 -0.16 5.43 1.09 -0.23 -0.16 121.20 128.60 2k8q s ILE 19 Ca 0.06 -1.28 -0.06 0.00 -1.10 0.00 0.00 60.65 58.27 2k8q s ILE 19 Cb -0.12 -1.58 -0.04 0.00 -1.06 0.00 0.00 42.46 39.66 2k8q s ILE 19 CO 0.02 0.24 0.04 -0.36 -0.10 0.00 0.00 174.94 174.79 2k8q s PHE 20 N -0.82 3.23 0.25 3.97 0.08 -0.65 -1.19 117.98 122.85 2k8q s PHE 20 Ca 0.09 0.06 0.01 0.00 0.12 0.00 0.00 56.93 57.21 2k8q s PHE 20 Cb -0.09 -2.01 -0.03 0.00 -0.57 0.00 0.00 43.02 40.31 2k8q s PHE 20 CO 0.02 0.21 0.20 0.96 -0.10 0.00 0.00 175.22 176.51 2k8q s ILE 21 N 0.11 0.00 -0.16 0.64 -4.36 -1.23 -4.34 121.20 111.85 2k8q s ILE 21 Ca 0.04 -1.96 0.17 0.00 -0.26 0.00 0.00 60.65 58.63 2k8q s ILE 21 Cb -0.12 -2.49 0.36 0.00 1.25 0.00 0.00 42.46 41.46 2k8q s ILE 21 CO 0.01 0.00 1.22 -1.20 0.24 0.00 0.00 174.94 175.21 2k8q n SER 22 N -0.72 2.47 -3.78 4.36 7.64 -1.26 -4.78 113.62 117.55 2k8q n SER 22 Ca 0.04 -3.28 -0.23 0.00 1.01 0.00 0.00 58.87 56.40 2k8q n SER 22 Cb 0.65 -0.48 0.01 0.00 -1.01 0.00 0.00 64.21 63.38 2k8q n SER 22 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2k8q n ASN 23 N -1.22 -1.24 -4.37 6.43 3.02 -1.26 -4.95 115.26 111.67 2k8q n ASN 23 Ca 0.18 -0.90 -0.38 0.00 -0.03 0.00 0.00 54.58 53.46 2k8q n ASN 23 Cb 0.71 -3.65 -0.12 0.00 -0.61 0.00 0.00 39.78 36.11 2k8q n ASN 23 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2k8q s ILE 24 N -3.76 4.14 -1.66 2.41 -0.00 -1.26 -4.49 121.20 116.57 2k8q s ILE 24 Ca 0.05 -0.65 -0.02 0.00 -0.00 0.00 0.00 60.65 60.03 2k8q s ILE 24 Cb -0.01 -3.14 0.00 0.00 -0.00 0.00 0.00 42.46 39.31 2k8q s ILE 24 CO 0.84 0.06 0.30 -1.14 -0.00 0.00 0.00 174.94 174.99 2k8q n ARG 25 N 4.90 -3.23 -2.25 0.37 3.00 -1.26 -4.76 116.66 113.43 2k8q n ARG 25 Ca -0.14 0.96 -0.40 0.00 -0.00 0.00 0.00 57.85 58.26 2k8q n ARG 25 Cb 0.48 -5.70 -0.03 0.00 0.00 0.00 0.00 32.46 27.21 2k8q n ARG 25 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 2k8q s PHE 26 N -3.10 2.00 0.50 -0.14 2.19 -1.26 -4.67 117.98 113.48 2k8q s PHE 26 Ca 0.15 0.52 0.08 0.00 0.33 0.00 0.00 56.93 58.01 2k8q s PHE 26 Cb -0.06 -4.29 0.05 0.00 -1.31 0.00 0.00 43.02 37.40 2k8q s PHE 26 CO 0.18 -2.21 0.68 -1.54 1.83 0.00 0.00 175.22 174.16 2k8q s SER 27 N 5.89 5.38 -0.16 6.13 1.04 -1.26 -5.04 113.70 125.68 2k8q s SER 27 Ca 0.58 -0.58 0.16 0.00 0.48 0.00 0.00 55.95 56.59 2k8q s SER 27 Cb -0.12 -0.26 0.34 0.00 0.10 0.00 0.00 66.02 66.08 2k8q s SER 27 CO 0.22 -1.04 1.18 0.00 0.98 0.00 0.00 173.24 174.59 2k8q n ALA 28 N -2.06 2.81 0.00 5.32 0.00 -1.26 -4.52 120.51 120.80 2k8q n ALA 28 Ca 0.11 -2.88 0.00 0.00 0.00 0.00 0.00 53.44 50.68 2k8q n ALA 28 Cb 0.60 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.67 2k8q n ALA 28 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2k8q n VAL 29 N -1.31 0.00 0.31 0.00 3.14 -1.26 -4.67 118.33 114.55 2k8q n VAL 29 Ca 0.17 -0.47 0.03 0.00 -2.96 0.00 0.00 64.34 61.12 2k8q n VAL 29 Cb 0.67 0.98 -0.01 0.00 -1.06 0.00 0.00 33.84 34.42 2k8q n VAL 29 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2k8q n GLY 30 N 1.02 -0.02 3.64 7.55 0.00 -1.26 -4.98 105.19 111.15 2k8q n GLY 30 Ca 0.00 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 2k8q n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k8q s LEU 31 N -1.70 4.02 -0.34 0.99 1.43 -1.26 -4.34 118.68 117.48 2k8q s LEU 31 Ca 0.05 1.53 -0.08 0.00 -1.03 0.00 0.00 54.13 54.60 2k8q s LEU 31 Cb 0.05 -3.54 0.21 0.00 0.03 0.00 0.00 46.19 42.94 2k8q s LEU 31 CO 0.21 -0.99 1.09 -0.70 0.23 0.00 0.00 176.35 176.19 2k8q s GLU 32 N 4.02 0.19 0.04 1.70 2.56 -1.26 -4.97 118.70 120.97 2k8q s GLU 32 Ca 0.60 -0.16 -0.30 0.00 0.00 0.00 0.00 54.97 55.11 2k8q s GLU 32 Cb -0.21 -0.00 -0.04 0.00 2.00 0.00 0.00 34.13 35.88 2k8q s GLU 32 CO 0.22 -0.24 0.98 0.42 -0.56 0.00 0.00 175.26 176.08 2k8q s ILE 33 N 1.24 4.73 0.13 -3.70 1.01 -1.26 -4.45 121.20 118.89 2k8q s ILE 33 Ca 0.21 2.04 0.08 0.00 0.00 0.00 0.00 60.65 62.98 2k8q s ILE 33 Cb 0.10 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 2k8q s ILE 33 CO -0.12 0.20 -0.18 0.27 0.00 0.00 0.00 174.94 175.11 2k8q s ILE 34 N 0.71 1.65 -0.16 2.92 -5.25 -1.05 -4.88 121.20 115.14 2k8q s ILE 34 Ca 0.51 -1.70 -0.03 0.00 -0.99 0.00 0.00 60.65 58.44 2k8q s ILE 34 Cb -0.22 -1.63 -0.02 0.00 2.95 0.00 0.00 42.46 43.54 2k8q s ILE 34 CO 0.29 -0.23 -0.05 -0.63 -1.79 0.00 0.00 174.94 172.53 2k8q s ILE 35 N -1.66 3.70 0.00 8.37 1.09 -1.26 -0.79 121.20 130.65 2k8q s ILE 35 Ca 0.10 -0.42 -0.00 0.00 -1.10 0.00 0.00 60.65 59.22 2k8q s ILE 35 Cb -0.08 -2.62 0.00 0.00 -1.06 0.00 0.00 42.46 38.71 2k8q s ILE 35 CO 0.05 0.49 0.00 1.67 -0.10 0.00 0.00 174.94 177.05 2k8q n GLN 36 N 3.64 -0.64 -0.23 2.79 0.00 0.95 -4.54 117.38 119.36 2k8q n GLN 36 Ca -0.18 -0.00 0.21 0.00 -0.00 0.00 0.00 57.00 57.03 2k8q n GLN 36 Cb 0.52 -0.00 0.56 0.00 0.00 0.00 0.00 30.24 31.32 2k8q n GLN 36 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 2k8q h GLU 37 N 0.00 0.31 0.00 3.69 4.11 -2.00 -3.39 114.58 117.30 2k8q h GLU 37 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.41 2k8q h GLU 37 Cb 0.00 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.18 2k8q h GLU 37 CO 0.00 0.20 0.00 0.27 0.07 0.00 0.00 179.01 179.55 2k8q n ASN 38 N -4.47 -0.02 -4.42 3.06 6.94 -1.26 -4.17 115.26 110.93 2k8q n ASN 38 Ca 0.19 0.01 -0.29 0.00 -0.02 0.00 0.00 54.58 54.47 2k8q n ASN 38 Cb 0.75 0.08 0.17 0.00 -2.36 0.00 0.00 39.78 38.43 2k8q n ASN 38 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2k8q s MET 39 N -2.00 0.46 -0.05 -3.83 0.23 -1.26 -2.39 119.30 110.45 2k8q s MET 39 Ca 0.00 0.07 0.06 0.00 -1.03 0.00 0.00 55.69 54.79 2k8q s MET 39 Cb 0.00 -1.78 -0.01 0.00 -1.53 0.00 0.00 34.83 31.51 2k8q s MET 39 CO 0.00 -2.62 -0.24 0.42 -2.03 0.00 0.00 175.02 170.55 2k8q s ILE 40 N -3.33 2.15 -0.23 3.16 1.01 -0.27 -0.03 121.20 123.66 2k8q s ILE 40 Ca 0.68 -1.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.23 2k8q s ILE 40 Cb -0.11 -1.78 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 2k8q s ILE 40 CO 0.54 0.57 0.03 -0.63 0.00 0.00 0.00 174.94 175.45 2k8q s ILE 41 N -0.27 3.97 -0.47 2.92 -1.09 0.03 -1.53 121.20 124.77 2k8q s ILE 41 Ca -0.00 -0.29 -0.16 0.00 -2.23 0.00 0.00 60.65 57.96 2k8q s ILE 41 Cb -0.13 -2.84 0.06 0.00 -1.58 0.00 0.00 42.46 37.97 2k8q s ILE 41 CO 0.03 0.38 0.44 0.12 -1.23 0.00 0.00 174.94 174.68 2k8q s PHE 42 N 1.48 3.19 -0.14 3.97 5.36 0.08 -2.54 117.98 129.38 2k8q s PHE 42 Ca 0.06 -0.75 0.17 0.00 -0.96 0.00 0.00 56.93 55.44 2k8q s PHE 42 Cb -0.15 -3.16 -0.24 0.00 -0.34 0.00 0.00 43.02 39.13 2k8q s PHE 42 CO 0.01 -0.82 0.41 1.58 -1.46 0.00 0.00 175.22 174.95 2k8q n HIS 43 N 5.46 0.00 -1.02 10.12 -0.00 -1.26 -1.53 115.22 126.98 2k8q n HIS 43 Ca -0.10 0.00 -0.34 0.00 0.46 0.00 0.00 57.72 57.74 2k8q n HIS 43 Cb 0.45 -0.32 0.11 0.00 -0.12 0.00 0.00 29.99 30.11 2k8q n HIS 43 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 2k8q n LEU 44 N -1.96 1.46 -1.24 0.27 0.00 -1.26 -4.75 117.00 109.52 2k8q n LEU 44 Ca -0.02 0.48 0.16 0.00 0.00 0.00 0.00 56.01 56.63 2k8q n LEU 44 Cb 0.40 -1.30 -0.07 0.00 0.00 0.00 0.00 43.42 42.46 2k8q n LEU 44 CO 0.34 -2.91 -0.45 -1.20 0.00 0.00 0.00 177.39 173.17 2k8q n SER 45 N -1.61 -7.18 0.00 1.96 7.64 -1.26 -4.20 113.62 108.97 2k8q n SER 45 Ca 0.10 1.02 0.07 0.00 1.01 0.00 0.00 58.87 61.07 2k8q n SER 45 Cb 0.51 -4.11 0.37 0.00 -1.01 0.00 0.00 64.21 59.98 2k8q n SER 45 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2k8q n PRO 46 N -4.04 0.22 -4.50 1.43 -0.04 -1.26 -4.62 135.00 122.18 2k8q n PRO 46 Ca -0.05 0.14 -0.34 0.00 -0.04 0.00 0.00 63.50 63.22 2k8q n PRO 46 Cb 0.58 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.41 2k8q n PRO 46 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2k8q s TYR 47 N -2.56 2.92 -0.13 0.54 2.02 -1.26 -5.10 117.35 113.78 2k8q s TYR 47 Ca 0.14 -0.55 -0.15 0.00 -0.37 0.00 0.00 57.07 56.14 2k8q s TYR 47 Cb 0.10 -1.93 -0.05 0.00 -0.40 0.00 0.00 41.96 39.69 2k8q s TYR 47 CO 0.22 -0.19 0.36 -0.47 -1.57 0.00 0.00 175.55 173.90 2k8q s TYR 48 N 0.52 3.51 0.05 2.71 6.14 -1.26 -4.66 117.35 124.36 2k8q s TYR 48 Ca -0.06 0.73 0.05 0.00 0.64 0.00 0.00 57.07 58.44 2k8q s TYR 48 Cb -0.15 -2.39 -0.02 0.00 0.42 0.00 0.00 41.96 39.82 2k8q s TYR 48 CO 0.03 0.28 -0.15 -1.17 0.64 0.00 0.00 175.55 175.18 2k8q s LEU 49 N 0.28 2.20 -0.13 6.97 2.96 -0.58 -2.58 118.68 127.80 2k8q s LEU 49 Ca 0.20 -0.51 0.02 0.00 -0.22 0.00 0.00 54.13 53.63 2k8q s LEU 49 Cb -0.14 -0.65 0.01 0.00 0.50 0.00 0.00 46.19 45.91 2k8q s LEU 49 CO 0.07 0.03 -0.21 -0.60 -1.32 0.00 0.00 176.35 174.32 2k8q s ARG 50 N -1.30 2.85 -0.17 1.98 3.52 -1.26 -0.75 118.95 123.82 2k8q s ARG 50 Ca 0.02 -0.79 -0.02 0.00 -0.13 0.00 0.00 55.73 54.81 2k8q s ARG 50 Cb -0.08 -2.31 -0.01 0.00 -1.56 0.00 0.00 34.95 30.98 2k8q s ARG 50 CO 0.02 -0.02 -0.10 -0.51 -0.81 0.00 0.00 175.30 173.88 2k8q s LEU 51 N 0.83 2.75 -0.31 -0.88 1.43 -0.58 -4.40 118.68 117.52 2k8q s LEU 51 Ca -0.07 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 2k8q s LEU 51 Cb -0.15 -1.65 0.07 0.00 0.03 0.00 0.00 46.19 44.49 2k8q s LEU 51 CO -0.01 0.08 -0.01 -0.60 0.23 0.00 0.00 176.35 176.04 2k8q s ARG 52 N 0.85 2.05 0.24 1.70 3.00 -1.26 -1.11 118.95 124.42 2k8q s ARG 52 Ca -0.03 -1.52 -0.01 0.00 -1.00 0.00 0.00 55.73 53.16 2k8q s ARG 52 Cb -0.15 -3.11 -0.04 0.00 0.00 0.00 0.00 34.95 31.65 2k8q s ARG 52 CO 0.01 -0.73 0.45 -0.06 0.00 0.00 0.00 175.30 174.96 2k8q s PHE 53 N 1.08 3.48 -0.75 5.12 0.08 -1.26 -4.64 117.98 121.10 2k8q s PHE 53 Ca -0.01 0.39 0.19 0.00 0.12 0.00 0.00 56.93 57.62 2k8q s PHE 53 Cb -0.20 -1.90 0.79 0.00 -0.57 0.00 0.00 43.02 41.14 2k8q s PHE 53 CO -0.05 0.30 1.58 -0.35 -0.10 0.00 0.00 175.22 176.60 2k8q n PRO 54 N -0.93 0.09 -1.99 0.24 -0.04 -1.26 -4.77 135.00 126.35 2k8q n PRO 54 Ca -0.04 0.34 -0.05 0.00 -0.04 0.00 0.00 63.50 63.70 2k8q n PRO 54 Cb 0.54 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 2k8q n PRO 54 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2k8q n HIS 55 N -1.86 -1.31 -4.10 0.54 8.25 -1.26 -5.13 115.22 110.35 2k8q n HIS 55 Ca 0.03 -0.49 -0.29 0.00 -0.26 0.00 0.00 57.72 56.70 2k8q n HIS 55 Cb 0.20 -0.09 -0.17 0.00 1.12 0.00 0.00 29.99 31.05 2k8q n HIS 55 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 2k8q s GLU 56 N -2.47 2.19 0.54 -0.41 -1.05 -1.26 -4.59 118.70 111.64 2k8q s GLU 56 Ca 0.06 -0.52 0.09 0.00 -0.15 0.00 0.00 54.97 54.45 2k8q s GLU 56 Cb -0.01 -2.00 0.09 0.00 -0.44 0.00 0.00 34.13 31.77 2k8q s GLU 56 CO 0.04 -0.20 0.74 1.28 0.95 0.00 0.00 175.26 178.07 2k8q n LEU 57 N 4.67 0.00 -3.90 1.83 4.77 -1.01 -3.78 117.00 119.58 2k8q n LEU 57 Ca -0.17 -2.31 -0.11 0.00 -0.03 0.00 0.00 56.01 53.39 2k8q n LEU 57 Cb 0.50 -0.39 -0.12 0.00 -2.33 0.00 0.00 43.42 41.08 2k8q n LEU 57 CO 0.21 -0.70 -0.31 -0.51 -1.33 0.00 0.00 177.39 174.76 2k8q s ILE 58 N -2.32 0.05 -0.43 -0.08 2.07 -0.66 -4.28 121.20 115.55 2k8q s ILE 58 Ca 0.56 -0.41 -0.09 0.00 -1.41 0.00 0.00 60.65 59.30 2k8q s ILE 58 Cb -0.04 -0.19 0.09 0.00 0.13 0.00 0.00 42.46 42.45 2k8q s ILE 58 CO 0.36 -0.23 0.27 -0.62 -1.91 0.00 0.00 174.94 172.81 2k8q s ASP 59 N -0.69 5.62 0.00 4.50 2.15 -1.26 -3.56 116.67 123.43 2k8q s ASP 59 Ca -0.08 -1.62 0.00 0.00 0.43 0.00 0.00 52.55 51.28 2k8q s ASP 59 Cb -0.05 -1.98 0.00 0.00 -0.30 0.00 0.00 42.92 40.59 2k8q s ASP 59 CO -0.00 -0.57 0.00 -0.67 -0.17 0.00 0.00 175.17 173.76 2k8q n ASP 60 N 4.90 1.51 0.28 -0.34 2.03 -1.26 -4.96 116.55 118.71 2k8q n ASP 60 Ca -0.09 -0.79 0.14 0.00 0.52 0.00 0.00 54.79 54.57 2k8q n ASP 60 Cb 0.42 0.00 0.84 0.00 -0.72 0.00 0.00 41.12 41.66 2k8q n ASP 60 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2k8q h GLU 61 N 0.00 0.00 -0.14 -0.67 4.11 -2.04 -1.79 114.58 114.05 2k8q h GLU 61 Ca 0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.27 2k8q h GLU 61 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2k8q h GLU 61 CO 0.00 0.05 -0.60 0.07 0.07 0.00 0.00 179.01 178.60 2k8q h ARG 62 N 0.00 0.46 -6.39 1.06 -0.00 -1.98 -3.44 114.38 104.09 2k8q h ARG 62 Ca -0.00 -0.31 -0.64 0.00 -0.00 0.00 0.00 59.98 59.03 2k8q h ARG 62 Cb 0.15 0.05 0.06 0.00 -0.00 0.00 0.00 29.97 30.23 2k8q h ARG 62 CO 0.01 0.92 0.52 0.45 -0.00 0.00 0.00 179.97 181.87 2k8q n SER 63 N -3.92 2.08 -3.58 0.08 2.88 -0.67 -4.93 113.62 105.56 2k8q n SER 63 Ca -0.03 1.12 0.02 0.00 -1.33 0.00 0.00 58.87 58.65 2k8q n SER 63 Cb 0.63 -1.29 -0.01 0.00 -0.75 0.00 0.00 64.21 62.80 2k8q n SER 63 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2k8q s THR 64 N 0.36 0.00 0.01 2.46 -1.32 -1.21 -4.91 115.64 111.03 2k8q s THR 64 Ca 0.78 -0.01 0.02 0.00 -1.21 0.00 0.00 61.69 61.28 2k8q s THR 64 Cb -0.82 -1.72 -0.01 0.00 -1.51 0.00 0.00 72.50 68.44 2k8q s THR 64 CO 0.46 0.00 -0.08 0.00 -2.21 0.00 0.00 174.62 172.80 2k8q s ALA 65 N -2.02 0.62 -0.08 11.08 0.00 -1.26 -1.39 121.76 128.71 2k8q s ALA 65 Ca 0.14 -0.45 0.04 0.00 0.00 0.00 0.00 51.96 51.70 2k8q s ALA 65 Cb 0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.07 2k8q s ALA 65 CO -0.06 0.11 -0.22 -0.65 0.00 0.00 0.00 175.76 174.95 2k8q s GLN 66 N -0.57 2.58 -0.12 0.00 -0.21 0.76 -4.96 119.66 117.14 2k8q s GLN 66 Ca -0.00 -0.79 -0.23 0.00 0.02 0.00 0.00 55.36 54.35 2k8q s GLN 66 Cb -0.05 -2.05 -0.03 0.00 1.00 0.00 0.00 33.01 31.88 2k8q s GLN 66 CO 0.00 0.22 0.71 -0.47 -2.12 0.00 0.00 175.29 173.64 2k8q s TYR 67 N 0.21 3.49 -0.24 0.91 5.04 -1.26 -0.87 117.35 124.63 2k8q s TYR 67 Ca -0.12 1.17 -0.07 0.00 -2.44 0.00 0.00 57.07 55.61 2k8q s TYR 67 Cb -0.16 -2.85 -0.03 0.00 0.35 0.00 0.00 41.96 39.27 2k8q s TYR 67 CO 0.06 -0.05 0.07 -0.51 -1.34 0.00 0.00 175.55 173.78 2k8q s ASP 68 N 0.98 5.21 -0.02 4.32 1.11 0.32 -4.97 116.67 123.62 2k8q s ASP 68 Ca 0.36 -0.16 0.02 0.00 0.18 0.00 0.00 52.55 52.95 2k8q s ASP 68 Cb -0.17 -1.93 -0.25 0.00 1.07 0.00 0.00 42.92 41.64 2k8q s ASP 68 CO 0.15 0.00 0.75 -1.28 1.18 0.00 0.00 175.17 175.98 2k8q h SER 69 N 7.95 0.23 -0.83 0.27 0.87 -1.93 0.16 113.55 120.26 2k8q h SER 69 Ca -0.38 -0.38 0.22 0.00 -1.23 0.00 0.00 61.79 60.03 2k8q h SER 69 Cb 1.18 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 63.02 2k8q h SER 69 CO 0.59 1.33 0.58 0.07 -0.53 0.00 0.00 176.83 178.88 2k8q h LYS 70 N 0.04 0.13 0.00 2.24 5.09 -1.95 -2.08 116.57 120.04 2k8q h LYS 70 Ca -0.26 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.47 2k8q h LYS 70 Cb 1.99 -0.03 0.00 0.00 0.10 0.00 0.00 32.23 34.29 2k8q h LYS 70 CO 0.12 0.09 0.00 -3.47 -2.09 0.00 0.00 179.45 174.10 2k8q n ASP 71 N -4.37 0.71 -2.28 7.07 2.03 -1.25 -5.00 116.55 113.46 2k8q n ASP 71 Ca 0.17 -0.99 -0.18 0.00 0.52 0.00 0.00 54.79 54.32 2k8q n ASP 71 Cb 0.81 0.02 -0.02 0.00 -0.72 0.00 0.00 41.12 41.21 2k8q n ASP 71 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2k8q n GLU 72 N -0.02 -1.81 -4.24 -0.67 1.02 0.44 -4.91 120.64 110.45 2k8q n GLU 72 Ca 0.00 0.89 -0.25 0.00 -0.02 0.00 0.00 57.16 57.78 2k8q n GLU 72 Cb 0.07 -5.48 -0.07 0.00 -0.02 0.00 0.00 31.44 25.93 2k8q n GLU 72 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k8q s ILE 74 N -1.96 4.56 -0.22 0.00 -1.09 -0.33 -0.52 121.20 121.65 2k8q s ILE 74 Ca 0.29 -0.13 -0.05 0.00 -2.23 0.00 0.00 60.65 58.53 2k8q s ILE 74 Cb -0.08 -3.00 -0.02 0.00 -1.58 0.00 0.00 42.46 37.78 2k8q s ILE 74 CO 0.19 0.53 0.01 0.20 -1.23 0.00 0.00 174.94 174.64 2k8q s ASN 75 N -0.17 4.77 -0.14 3.58 0.01 -0.05 -1.06 114.94 121.89 2k8q s ASN 75 Ca 0.06 -0.26 0.02 0.00 -0.71 0.00 0.00 52.86 51.97 2k8q s ASN 75 Cb -0.12 -1.83 -0.00 0.00 0.41 0.00 0.00 41.25 39.71 2k8q s ASN 75 CO 0.02 0.01 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.74 2k8q s VAL 76 N 1.32 2.44 -0.06 1.60 1.01 0.11 -0.17 120.40 126.66 2k8q s VAL 76 Ca 0.04 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.18 2k8q s VAL 76 Cb -0.15 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 2k8q s VAL 76 CO 0.01 0.53 -0.08 -1.59 0.00 0.00 0.00 175.10 173.97 2k8q s LYS 77 N 0.64 2.68 -0.01 2.72 0.00 -0.49 0.11 119.74 125.39 2k8q s LYS 77 Ca -0.10 -0.59 -0.00 0.00 0.00 0.00 0.00 55.97 55.29 2k8q s LYS 77 Cb -0.16 -2.54 0.02 0.00 0.00 0.00 0.00 37.83 35.15 2k8q s LYS 77 CO 0.02 0.65 0.02 0.08 0.00 0.00 0.00 175.35 176.13 2k8q s VAL 78 N -0.80 -0.04 0.08 1.79 1.01 -0.77 -3.30 120.40 118.36 2k8q s VAL 78 Ca 0.12 0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 2k8q s VAL 78 Cb -0.11 -0.06 -0.05 0.00 0.00 0.00 0.00 36.38 36.16 2k8q s VAL 78 CO 0.02 0.06 0.97 0.00 0.00 0.00 0.00 175.10 176.15 2k8q s ALA 79 N 0.73 3.22 0.29 5.51 0.00 -1.23 -0.99 121.76 129.29 2k8q s ALA 79 Ca -0.06 0.57 -0.11 0.00 0.00 0.00 0.00 51.96 52.36 2k8q s ALA 79 Cb -0.09 -3.30 -0.08 0.00 0.00 0.00 0.00 23.12 19.66 2k8q s ALA 79 CO -0.02 -0.09 0.64 0.15 0.00 0.00 0.00 175.76 176.45 2k8q s LYS 80 N 0.28 3.86 0.43 0.00 -0.14 -1.26 -1.65 119.74 121.26 2k8q s LYS 80 Ca 0.48 0.42 0.19 0.00 -1.36 0.00 0.00 55.97 55.71 2k8q s LYS 80 Cb -0.23 -2.54 0.98 0.00 -1.68 0.00 0.00 37.83 34.36 2k8q s LYS 80 CO 0.29 0.21 1.90 -0.07 -0.76 0.00 0.00 175.35 176.92 2k8q h LEU 81 N 2.21 0.00 -7.63 3.17 3.38 -1.88 -3.42 115.31 111.14 2k8q h LEU 81 Ca -0.47 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.14 2k8q h LEU 81 Cb 1.17 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 41.58 2k8q h LEU 81 CO 0.67 0.27 -0.75 0.20 0.09 0.00 0.00 178.44 178.92 2k8q s ASN 82 N -6.57 0.58 0.89 -0.43 0.01 -1.26 -5.12 114.94 103.04 2k8q s ASN 82 Ca -0.02 -0.05 -0.11 0.00 -0.71 0.00 0.00 52.86 51.97 2k8q s ASN 82 Cb 0.13 -0.27 0.12 0.00 0.41 0.00 0.00 41.25 41.64 2k8q s ASN 82 CO 0.67 -0.10 1.10 -0.75 -1.51 0.00 0.00 177.10 176.51 2k8q s LYS 83 N 1.04 1.31 -2.19 -0.60 2.20 -1.26 -3.16 119.74 117.08 2k8q s LYS 83 Ca -0.09 1.09 0.00 0.00 -0.36 0.00 0.00 55.97 56.60 2k8q s LYS 83 Cb -0.14 -1.79 0.00 0.00 -1.51 0.00 0.00 37.83 34.39 2k8q s LYS 83 CO -0.01 -2.28 0.00 0.09 -0.36 0.00 0.00 175.35 172.79 2k8q n ASN 84 N -3.94 -5.54 -4.70 1.43 5.03 -1.09 -4.94 115.26 101.51 2k8q n ASN 84 Ca 0.08 0.49 -0.38 0.00 0.87 0.00 0.00 54.58 55.64 2k8q n ASN 84 Cb 0.54 -4.86 -0.06 0.00 -1.02 0.00 0.00 39.78 34.37 2k8q n ASN 84 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2k8q s GLU 85 N -3.84 4.29 0.48 3.52 2.56 -1.19 -5.00 118.70 119.52 2k8q s GLU 85 Ca 0.00 0.45 0.07 0.00 0.00 0.00 0.00 54.97 55.48 2k8q s GLU 85 Cb 0.00 -3.48 0.01 0.00 2.00 0.00 0.00 34.13 32.65 2k8q s GLU 85 CO 0.00 0.04 0.39 1.52 -0.56 0.00 0.00 175.26 176.65 2k8q s TYR 86 N 1.02 2.13 0.26 5.30 1.13 -1.26 -4.68 117.35 121.25 2k8q s TYR 86 Ca 0.26 -0.67 0.02 0.00 -1.41 0.00 0.00 57.07 55.26 2k8q s TYR 86 Cb -0.15 -2.03 -0.05 0.00 -1.10 0.00 0.00 41.96 38.62 2k8q s TYR 86 CO 0.10 -0.31 0.08 -0.06 -2.51 0.00 0.00 175.55 172.85 2k8q s PHE 87 N -2.63 1.59 0.00 -3.49 0.40 -1.26 -5.03 117.98 107.56 2k8q s PHE 87 Ca 0.42 -1.11 0.00 0.00 -0.60 0.00 0.00 56.93 55.63 2k8q s PHE 87 Cb -0.02 -0.95 0.00 0.00 0.51 0.00 0.00 43.02 42.56 2k8q s PHE 87 CO 0.25 -0.25 0.00 0.39 0.70 0.00 0.00 175.22 176.31 2k8q n GLU 88 N -0.48 0.30 0.27 0.44 -0.58 -1.26 -4.75 120.64 114.57 2k8q n GLU 88 Ca -0.01 0.00 0.16 0.00 -0.42 0.00 0.00 57.16 56.89 2k8q n GLU 88 Cb 0.66 -0.77 0.63 0.00 -0.57 0.00 0.00 31.44 31.39 2k8q n GLU 88 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2k8q h ASP 89 N 0.00 0.00 0.19 1.62 3.32 -1.97 -2.73 116.42 116.84 2k8q h ASP 89 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2k8q h ASP 89 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2k8q h ASP 89 CO 0.00 0.05 0.00 -0.07 -1.72 0.00 0.00 179.24 177.50 2k8q h LEU 90 N 0.00 0.00 -1.70 1.55 3.38 -1.95 -0.07 115.31 116.52 2k8q h LEU 90 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k8q h LEU 90 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2k8q h LEU 90 CO 0.01 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.01 2k8q n ASP 91 N -2.48 2.49 -3.53 -0.43 9.92 -1.03 -4.39 116.55 117.10 2k8q n ASP 91 Ca -0.01 -2.17 -0.26 0.00 -0.53 0.00 0.00 54.79 51.82 2k8q n ASP 91 Cb 0.09 -0.37 -0.14 0.00 -0.64 0.00 0.00 41.12 40.06 2k8q n ASP 91 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2k8q s LEU 92 N -1.14 0.33 0.00 0.64 1.43 -0.04 -4.99 118.68 114.91 2k8q s LEU 92 Ca 0.26 -1.00 0.15 0.00 -1.03 0.00 0.00 54.13 52.51 2k8q s LEU 92 Cb 0.16 -0.13 0.72 0.00 0.03 0.00 0.00 46.19 46.97 2k8q s LEU 92 CO 0.14 -0.41 1.41 -0.81 0.23 0.00 0.00 176.35 176.91 2k8q n PRO 93 N 5.27 0.18 0.00 1.29 -0.04 -1.26 -1.91 135.00 138.53 2k8q n PRO 93 Ca -0.06 0.16 0.11 0.00 -0.04 0.00 0.00 63.50 63.68 2k8q n PRO 93 Cb 0.45 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.42 2k8q n PRO 93 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2k8q n THR 94 N -1.32 0.00 0.03 0.52 -2.24 -1.26 -3.95 114.28 106.06 2k8q n THR 94 Ca 0.06 -0.13 -0.17 0.00 -2.27 0.00 0.00 64.05 61.55 2k8q n THR 94 Cb 0.12 0.98 -0.14 0.00 -2.10 0.00 0.00 70.33 69.20 2k8q n THR 94 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2k8q h LYS 95 N 1.18 0.21 -0.05 -0.78 6.56 -1.69 -3.16 116.57 118.83 2k8q h LYS 95 Ca 0.00 -0.36 -0.19 0.00 -1.06 0.00 0.00 60.65 59.04 2k8q h LYS 95 Cb 0.61 0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.40 2k8q h LYS 95 CO 0.00 1.03 -0.77 -0.07 -2.06 0.00 0.00 179.45 177.58 2k8q h LEU 96 N 0.06 0.42 0.21 2.94 -0.00 -1.74 -3.35 115.31 113.85 2k8q h LEU 96 Ca -0.31 -0.29 -0.01 0.00 -0.00 0.00 0.00 57.88 57.27 2k8q h LEU 96 Cb 2.02 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 42.56 2k8q h LEU 96 CO 0.13 1.04 -0.10 -0.07 -0.00 0.00 0.00 178.44 179.44 2k8q h LEU 97 N 0.23 -0.24 2.37 1.67 4.07 -1.71 -3.37 115.31 118.33 2k8q h LEU 97 Ca -0.04 0.01 -0.26 0.00 0.08 0.00 0.00 57.88 57.67 2k8q h LEU 97 Cb 1.35 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 43.14 2k8q h LEU 97 CO 0.13 -0.09 -0.34 0.00 -1.08 0.00 0.00 178.44 177.06 2k8q n ALA 98 N -2.27 -0.81 -0.45 1.53 0.00 -1.19 -4.92 120.51 112.39 2k8q n ALA 98 Ca -0.03 0.10 -0.29 0.00 0.00 0.00 0.00 53.44 53.21 2k8q n ALA 98 Cb 0.11 -1.65 0.27 0.00 0.00 0.00 0.00 19.45 18.18 2k8q n ALA 98 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2k8q s ARG 99 N -5.13 -2.01 -0.30 0.00 3.03 -1.26 -4.95 118.95 108.34 2k8q s ARG 99 Ca 0.04 0.48 0.09 0.00 2.03 0.00 0.00 55.73 58.37 2k8q s ARG 99 Cb -0.02 -1.46 0.54 0.00 -1.03 0.00 0.00 34.95 32.99 2k8q s ARG 99 CO 0.05 -4.35 1.53 0.00 -1.13 0.00 0.00 175.30 171.40 2k8q n GLN 100 N -5.31 2.14 -2.56 3.89 0.00 -1.26 -4.98 117.38 109.29 2k8q n GLN 100 Ca 0.07 -3.11 -0.05 0.00 0.00 0.00 0.00 57.00 53.92 2k8q n GLN 100 Cb 0.57 -1.89 0.01 0.00 0.00 0.00 0.00 30.24 28.93 2k8q n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2k8q n GLY 101 N -0.99 -1.14 3.41 2.61 0.00 -1.26 -4.95 105.19 102.87 2k8q n GLY 101 Ca 0.35 0.81 -0.44 0.00 0.00 0.00 0.00 46.02 46.75 2k8q n GLY 101 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k8q s ASP 102 N -2.34 6.20 0.59 1.61 2.15 -1.26 -4.90 116.67 118.72 2k8q s ASP 102 Ca 0.15 -1.15 0.29 0.00 0.43 0.00 0.00 52.55 52.28 2k8q s ASP 102 Cb -0.04 -2.31 1.81 0.00 -0.30 0.00 0.00 42.92 42.08 2k8q s ASP 102 CO 0.59 -1.06 2.25 0.17 -0.17 0.00 0.00 175.17 176.95 2k8q h LEU 103 N 10.02 0.00-10.07 -1.34 -0.00 -2.06 -3.43 115.31 108.43 2k8q h LEU 103 Ca -0.28 0.00 -0.47 0.00 -0.00 0.00 0.00 57.88 57.12 2k8q h LEU 103 Cb 1.09 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 41.78 2k8q h LEU 103 CO 1.05 0.00 0.39 0.00 -0.00 0.00 0.00 178.44 179.88 2k8q s ALA 104 N -4.64 2.87 0.00 0.17 0.00 -1.26 -4.04 121.76 114.86 2k8q s ALA 104 Ca -0.05 0.62 0.00 0.00 0.00 0.00 0.00 51.96 52.53 2k8q s ALA 104 Cb 0.15 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 20.01 2k8q s ALA 104 CO 0.55 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.39 2k8q n GLY 105 N -0.22 0.88 3.55 0.00 0.00 -1.26 -5.00 105.19 103.14 2k8q n GLY 105 Ca 0.09 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 2k8q n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k8q s ALA 106 N -2.83 2.99 -0.07 4.61 0.00 -1.26 -5.00 121.76 120.21 2k8q s ALA 106 Ca 0.00 -1.13 0.03 0.00 0.00 0.00 0.00 51.96 50.86 2k8q s ALA 106 Cb 0.00 -4.00 0.01 0.00 0.00 0.00 0.00 23.12 19.13 2k8q s ALA 106 CO 0.00 -2.75 -0.16 0.34 0.00 0.00 0.00 175.76 173.19 2k8q s ASP 107 N 3.17 2.13 -0.14 0.00 2.15 -1.26 -5.13 116.67 117.59 2k8q s ASP 107 Ca 0.36 -0.37 -0.04 0.00 0.43 0.00 0.00 52.55 52.94 2k8q s ASP 107 Cb -0.10 -0.93 -0.03 0.00 -0.30 0.00 0.00 42.92 41.57 2k8q s ASP 107 CO 0.20 0.08 -0.02 0.00 -0.17 0.00 0.00 175.17 175.27 2k8q s ALA 108 N 0.50 3.11 -0.25 3.66 0.00 -1.26 -5.08 121.76 122.44 2k8q s ALA 108 Ca -0.14 -0.81 -0.04 0.00 0.00 0.00 0.00 51.96 50.97 2k8q s ALA 108 Cb -0.16 -1.59 0.13 0.00 0.00 0.00 0.00 23.12 21.51 2k8q s ALA 108 CO 0.05 0.29 0.45 -0.48 0.00 0.00 0.00 175.76 176.06 2k8q s LEU 109 N 0.11 -0.81 -0.22 0.00 2.34 -1.26 -5.13 118.68 113.70 2k8q s LEU 109 Ca 0.00 0.63 -0.05 0.00 0.06 0.00 0.00 54.13 54.78 2k8q s LEU 109 Cb -0.13 1.45 0.11 0.00 -0.56 0.00 0.00 46.19 47.06 2k8q s LEU 109 CO 0.02 -0.27 0.42 0.28 -1.06 0.00 0.00 176.35 175.74 2k8q s THR 110 N 2.64 -0.66 0.40 5.48 -1.32 -1.26 -5.13 115.64 115.79 2k8q s THR 110 Ca 0.09 0.06 -0.25 0.00 -1.21 0.00 0.00 61.69 60.39 2k8q s THR 110 Cb -0.14 -0.75 -0.08 0.00 -1.51 0.00 0.00 72.50 70.01 2k8q s THR 110 CO -0.16 -0.01 1.16 -0.70 -2.21 0.00 0.00 174.62 172.70 2k8q s GLU 111 N 2.61 4.08 -0.46 7.08 2.12 -1.26 -4.89 118.70 127.99 2k8q s GLU 111 Ca 0.05 1.81 -0.29 0.00 0.36 0.00 0.00 54.97 56.90 2k8q s GLU 111 Cb -0.13 -2.68 -0.09 0.00 0.26 0.00 0.00 34.13 31.48 2k8q s GLU 111 CO -0.15 -0.29 2.36 0.27 -0.54 0.00 0.00 175.26 176.92 2k8q n ASN 112 N 0.10 2.25 -3.51 -1.70 6.94 -1.26 -4.86 115.26 113.22 2k8q n ASN 112 Ca 0.04 -0.08 -0.09 0.00 -0.02 0.00 0.00 54.58 54.42 2k8q n ASN 112 Cb 0.47 -1.44 -0.03 0.00 -2.36 0.00 0.00 39.78 36.42 2k8q n ASN 112 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2k8q s THR 113 N 10.00 0.00 -0.34 5.53 -1.32 -1.26 -5.11 115.64 123.14 2k8q s THR 113 Ca 1.06 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 61.26 2k8q s THR 113 Cb -0.48 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.46 2k8q s THR 113 CO 0.35 0.00 2.21 -0.62 -2.21 0.00 0.00 174.62 174.36 2k8q s ASP 114 N -2.28 5.17 0.33 8.08 -1.08 -1.26 -4.89 116.67 120.74 2k8q s ASP 114 Ca 0.03 1.49 -0.14 0.00 -0.52 0.00 0.00 52.55 53.41 2k8q s ASP 114 Cb -0.01 -2.51 0.03 0.00 -1.46 0.00 0.00 42.92 38.97 2k8q s ASP 114 CO -0.07 -2.24 0.66 0.00 0.52 0.00 0.00 175.17 174.03 2k8q s ALA 115 N 9.41 -0.49 0.09 3.66 0.00 -1.26 -5.18 121.76 127.99 2k8q s ALA 115 Ca 0.96 -0.81 0.09 0.00 0.00 0.00 0.00 51.96 52.20 2k8q s ALA 115 Cb -0.26 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.71 2k8q s ALA 115 CO 0.31 -0.94 -0.22 -1.59 0.00 0.00 0.00 175.76 173.32 2k8q s LYS 116 N -3.15 1.75 0.03 0.00 0.00 -1.26 -5.14 119.74 111.97 2k8q s LYS 116 Ca 0.18 -1.17 -0.14 0.00 0.00 0.00 0.00 55.97 54.84 2k8q s LYS 116 Cb -0.04 -2.05 0.02 0.00 0.00 0.00 0.00 37.83 35.77 2k8q s LYS 116 CO 0.12 0.49 0.32 0.21 0.00 0.00 0.00 175.35 176.49 2k8q s LYS 117 N -1.78 0.79 1.15 1.78 2.20 -1.26 -5.16 119.74 117.46 2k8q s LYS 117 Ca 0.15 -0.42 -0.18 0.00 -0.36 0.00 0.00 55.97 55.16 2k8q s LYS 117 Cb -0.10 0.35 0.17 0.00 -1.51 0.00 0.00 37.83 36.73 2k8q s LYS 117 CO 0.06 -0.25 0.24 0.25 -0.36 0.00 0.00 175.35 175.30 2k8q n THR 118 N 0.71 0.00 -1.55 3.43 -2.24 -1.26 -4.71 114.28 108.67 2k8q n THR 118 Ca -0.19 -0.28 -0.37 0.00 -2.27 0.00 0.00 64.05 60.94 2k8q n THR 118 Cb 0.59 -0.67 -0.04 0.00 -2.10 0.00 0.00 70.33 68.11 2k8q n THR 118 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2k8q n GLN 119 N -2.74 1.05 -2.73 -0.78 7.27 -1.26 -4.75 117.38 113.44 2k8q n GLN 119 Ca 0.02 0.04 -0.07 0.00 0.07 0.00 0.00 57.00 57.07 2k8q n GLN 119 Cb 0.58 -3.30 0.05 0.00 2.41 0.00 0.00 30.24 29.98 2k8q n GLN 119 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 2k8q n LYS 120 N 8.94 0.61 -1.16 3.69 0.00 -1.26 -5.16 118.16 123.83 2k8q n LYS 120 Ca 0.38 -1.53 -0.29 0.00 0.00 0.00 0.00 58.31 56.88 2k8q n LYS 120 Cb 0.50 -1.18 0.18 0.00 0.00 0.00 0.00 35.03 34.53 2k8q n LYS 120 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2k8q s PRO 121 N 0.60 0.31 -0.06 1.64 0.04 -1.26 -5.08 135.00 131.20 2k8q s PRO 121 Ca 0.30 0.49 -0.02 0.00 0.04 0.00 0.00 61.00 61.81 2k8q s PRO 121 Cb 0.20 -1.73 0.04 0.00 0.04 0.00 0.00 34.50 33.06 2k8q s PRO 121 CO -0.20 -2.80 0.12 -0.51 0.04 0.00 0.00 177.00 173.65 2k8q s LEU 122 N -6.50 0.55 -0.13 -3.56 1.43 -1.26 -5.14 118.68 104.07 2k8q s LEU 122 Ca 0.66 0.24 0.03 0.00 -1.03 0.00 0.00 54.13 54.02 2k8q s LEU 122 Cb -0.19 0.22 0.00 0.00 0.03 0.00 0.00 46.19 46.25 2k8q s LEU 122 CO 0.58 -0.18 -0.21 -0.63 0.23 0.00 0.00 176.35 176.14 2k8q s ILE 123 N 1.50 2.21 0.17 -0.59 1.01 -1.26 -5.11 121.20 119.12 2k8q s ILE 123 Ca -0.05 -0.94 -0.22 0.00 0.00 0.00 0.00 60.65 59.44 2k8q s ILE 123 Cb -0.12 -1.88 0.06 0.00 0.01 0.00 0.00 42.46 40.53 2k8q s ILE 123 CO -0.05 0.55 0.58 0.00 0.00 0.00 0.00 174.94 176.01 2k8q s GLN 124 N 0.63 1.30 -0.23 2.79 -2.07 -1.26 -5.15 119.66 115.66 2k8q s GLN 124 Ca -0.11 -0.56 -0.10 0.00 -1.82 0.00 0.00 55.36 52.77 2k8q s GLN 124 Cb -0.16 0.57 -0.05 0.00 -1.09 0.00 0.00 33.01 32.28 2k8q s GLN 124 CO 0.02 -0.56 0.14 -1.21 -1.32 0.00 0.00 175.29 172.36 2k8q s GLU 125 N -3.78 4.00 0.36 9.60 2.02 -1.26 -5.09 118.70 124.55 2k8q s GLU 125 Ca 0.02 -0.31 0.08 0.00 0.02 0.00 0.00 54.97 54.78 2k8q s GLU 125 Cb -0.01 -3.47 -0.07 0.00 0.10 0.00 0.00 34.13 30.68 2k8q s GLU 125 CO -0.11 0.05 -0.04 0.14 0.02 0.00 0.00 175.26 175.32 2k8q s VAL 126 N 1.06 1.98 0.20 2.63 -7.23 -1.26 -5.16 120.40 112.62 2k8q s VAL 126 Ca 0.07 -2.10 0.10 0.00 -1.81 0.00 0.00 61.98 58.23 2k8q s VAL 126 Cb -0.14 -2.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.00 2k8q s VAL 126 CO 0.04 -0.12 -0.15 -0.70 -0.31 0.00 0.00 175.10 173.86 2k8q s GLU 127 N -3.69 1.85 0.75 4.82 -6.30 -1.26 -5.15 118.70 109.73 2k8q s GLU 127 Ca 0.33 -1.40 -0.03 0.00 -2.50 0.00 0.00 54.97 51.37 2k8q s GLU 127 Cb 0.06 -2.02 0.13 0.00 0.00 0.00 0.00 34.13 32.30 2k8q s GLU 127 CO 0.16 0.41 1.03 0.95 0.02 0.00 0.00 175.26 177.84 2k8q s THR 128 N -1.79 2.15 0.24 -1.70 -4.23 -1.26 -5.12 115.64 103.93 2k8q s THR 128 Ca 0.24 -0.49 -0.22 0.00 -1.18 0.00 0.00 61.69 60.04 2k8q s THR 128 Cb -0.08 -2.66 0.04 0.00 1.34 0.00 0.00 72.50 71.14 2k8q s THR 128 CO 0.14 0.00 0.81 -0.62 -0.54 0.00 0.00 174.62 174.40 2k8q s ASP 129 N -4.73 -0.22 0.00 3.99 2.15 -1.26 -5.19 116.67 111.42 2k8q s ASP 129 Ca 0.67 -0.56 0.00 0.00 0.43 0.00 0.00 52.55 53.09 2k8q s ASP 129 Cb -0.06 0.65 0.00 0.00 -0.30 0.00 0.00 42.92 43.21 2k8q s ASP 129 CO 0.45 -1.20 0.00 0.61 -0.17 0.00 0.00 175.17 174.86 2k8q n GLY 130 N -0.47 2.68 3.89 2.66 0.00 -1.26 -5.17 105.19 107.53 2k8q n GLY 130 Ca -0.05 -0.46 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 2k8q n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k8q s VAL 131 N -2.00 4.75 -0.14 1.61 -7.23 -1.26 -5.06 120.40 111.07 2k8q s VAL 131 Ca 0.00 -1.21 -0.11 0.00 -1.81 0.00 0.00 61.98 58.85 2k8q s VAL 131 Cb 0.00 -3.59 -0.08 0.00 0.56 0.00 0.00 36.38 33.26 2k8q s VAL 131 CO 0.00 -0.33 0.10 0.28 -0.31 0.00 0.00 175.10 174.84 2k8q h SER 132 N 1.32 0.00 -5.13 4.85 0.02 -2.10 -3.50 113.55 109.02 2k8q h SER 132 Ca -0.50 -0.24 0.05 0.00 -0.84 0.00 0.00 61.79 60.25 2k8q h SER 132 Cb 1.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 2k8q h SER 132 CO 0.60 0.84 0.37 0.54 -1.14 0.00 0.00 176.83 178.04 2k8q s ASN 133 N -5.94 -0.02 0.00 3.07 2.20 -1.26 -5.38 114.94 107.60 2k8q s ASN 133 Ca -0.13 -0.95 0.18 0.00 -0.94 0.00 0.00 52.86 51.03 2k8q s ASN 133 Cb 0.01 0.73 1.09 0.00 -2.00 0.00 0.00 41.25 41.09 2k8q s ASN 133 CO 0.28 -1.44 1.49 -0.46 -2.94 0.00 0.00 177.10 174.03