#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8q s ILE 2 N 0.00 0.58 0.00 -0.61 1.01 0.99 -4.97 121.20 118.20 2k8q s ILE 2 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.41 2k8q s ILE 2 Cb 0.00 -0.84 0.00 0.00 0.01 0.00 0.00 42.46 41.63 2k8q s ILE 2 CO 0.00 0.10 0.00 1.07 0.00 0.00 0.00 174.94 176.11 2k8q n THR 3 N 5.06 0.00 0.02 2.92 5.66 -1.26 -4.06 114.28 122.62 2k8q n THR 3 Ca -0.09 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.78 2k8q n THR 3 Cb 0.49 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.17 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 0.00 -0.08 -2.09 1.09 0.13 -2.00 -3.47 132.00 125.58 2k8q h PRO 4 Ca 0.00 0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 2k8q h PRO 4 Cb 0.00 0.02 -0.19 0.00 0.13 0.00 0.00 31.00 30.95 2k8q h PRO 4 CO 0.00 0.38 0.14 1.03 -0.23 0.00 0.00 178.00 179.32 2k8q s ARG 5 N -4.20 0.99 -0.28 0.86 3.00 -1.25 -5.09 118.95 112.98 2k8q s ARG 5 Ca -0.15 0.33 -0.24 0.00 0.00 0.00 0.00 55.73 55.67 2k8q s ARG 5 Cb 0.02 0.47 0.10 0.00 0.00 0.00 0.00 34.95 35.53 2k8q s ARG 5 CO 0.63 -0.28 0.86 -0.59 0.00 0.00 0.00 175.30 175.92 2k8q s PHE 6 N -0.97 -0.67 0.03 -0.53 -0.12 -1.26 -1.05 117.98 113.41 2k8q s PHE 6 Ca -0.10 1.58 0.07 0.00 -0.05 0.00 0.00 56.93 58.44 2k8q s PHE 6 Cb -0.01 0.34 -0.02 0.00 -0.63 0.00 0.00 43.02 42.70 2k8q s PHE 6 CO 0.08 -0.32 -0.21 -1.12 -0.05 0.00 0.00 175.22 173.60 2k8q s SER 7 N 0.48 2.53 -0.01 1.98 0.01 0.22 -4.96 113.70 113.95 2k8q s SER 7 Ca -0.00 -0.50 0.03 0.00 1.31 0.00 0.00 55.95 56.79 2k8q s SER 7 Cb -0.05 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.93 2k8q s SER 7 CO -0.05 0.18 -0.10 -0.63 0.41 0.00 0.00 173.24 173.06 2k8q s ILE 8 N -0.75 3.41 0.05 1.44 1.01 -1.26 -0.13 121.20 124.97 2k8q s ILE 8 Ca 0.08 -0.78 0.06 0.00 0.00 0.00 0.00 60.65 60.01 2k8q s ILE 8 Cb -0.09 -2.43 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 2k8q s ILE 8 CO 0.01 0.46 -0.16 -0.89 0.00 0.00 0.00 174.94 174.36 2k8q s THR 9 N -0.90 1.30 0.02 2.92 2.01 0.76 -4.84 115.64 116.91 2k8q s THR 9 Ca 0.15 -1.10 0.05 0.00 0.31 0.00 0.00 61.69 61.10 2k8q s THR 9 Cb -0.11 -1.17 -0.03 0.00 0.01 0.00 0.00 72.50 71.20 2k8q s THR 9 CO 0.05 0.04 -0.12 0.00 -0.69 0.00 0.00 174.62 173.90 2k8q s GLN 10 N -1.22 2.33 0.34 4.92 0.00 -1.26 -0.79 119.66 123.98 2k8q s GLN 10 Ca 0.03 -0.85 0.03 0.00 -0.00 0.00 0.00 55.36 54.58 2k8q s GLN 10 Cb -0.08 -2.35 -0.04 0.00 0.00 0.00 0.00 33.01 30.53 2k8q s GLN 10 CO 0.02 0.57 0.12 -0.51 0.00 0.00 0.00 175.29 175.49 2k8q s ASP 11 N -1.45 2.15 0.00 12.60 1.01 -0.61 -4.93 116.67 125.44 2k8q s ASP 11 Ca 0.16 -1.56 0.14 0.00 0.71 0.00 0.00 52.55 52.00 2k8q s ASP 11 Cb -0.11 0.32 0.45 0.00 1.01 0.00 0.00 42.92 44.59 2k8q s ASP 11 CO 0.07 -0.84 1.35 -1.84 0.21 0.00 0.00 175.17 174.12 2k8q n GLU 12 N -0.72 1.79 0.00 8.23 0.00 -1.26 -4.10 120.64 124.58 2k8q n GLU 12 Ca -0.02 -1.21 0.00 0.00 0.00 0.00 0.00 57.16 55.93 2k8q n GLU 12 Cb 0.65 -1.31 0.00 0.00 0.00 0.00 0.00 31.44 30.78 2k8q n GLU 12 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 2k8q n GLU 13 N 0.46 0.51 -2.63 3.44 0.28 -1.26 -0.10 120.64 121.34 2k8q n GLU 13 Ca 0.13 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 57.10 2k8q n GLU 13 Cb 0.31 -0.75 0.01 0.00 1.43 0.00 0.00 31.44 32.44 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 -1.81 -1.32 -4.22 -1.84 -1.74 -1.26 -4.24 117.46 101.03 2k8q n PHE 14 Ca 0.00 -0.82 -0.35 0.00 -0.56 0.00 0.00 57.45 55.72 2k8q n PHE 14 Cb 0.25 0.41 -0.08 0.00 1.52 0.00 0.00 39.48 41.57 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 -2.39 4.62 -0.32 1.97 -1.09 -0.49 -1.57 121.20 121.93 2k8q s ILE 15 Ca 0.11 -0.21 0.02 0.00 -2.23 0.00 0.00 60.65 58.34 2k8q s ILE 15 Cb -0.02 -3.00 0.09 0.00 -1.58 0.00 0.00 42.46 37.95 2k8q s ILE 15 CO 0.04 0.55 0.04 0.12 -1.23 0.00 0.00 174.94 174.46 2k8q s PHE 16 N -0.99 3.07 -0.25 3.97 5.36 0.03 -2.60 117.98 126.58 2k8q s PHE 16 Ca 0.16 -2.52 -0.11 0.00 -0.96 0.00 0.00 56.93 53.50 2k8q s PHE 16 Cb -0.12 -2.43 -0.05 0.00 -0.34 0.00 0.00 43.02 40.09 2k8q s PHE 16 CO 0.05 -0.91 0.19 -1.17 -1.46 0.00 0.00 175.22 171.92 2k8q s LEU 17 N 1.15 4.09 -0.05 6.12 1.98 -0.33 -0.17 118.68 131.47 2k8q s LEU 17 Ca 0.08 0.11 0.01 0.00 -2.89 0.00 0.00 54.13 51.44 2k8q s LEU 17 Cb -0.19 -2.14 -0.03 0.00 0.66 0.00 0.00 46.19 44.49 2k8q s LEU 17 CO -0.12 0.02 -0.06 -1.59 -1.89 0.00 0.00 176.35 172.71 2k8q s LYS 18 N 1.28 2.73 -0.09 1.98 -2.85 0.82 -0.08 119.74 123.51 2k8q s LYS 18 Ca 0.08 -0.58 0.03 0.00 -1.00 0.00 0.00 55.97 54.50 2k8q s LYS 18 Cb -0.14 -2.60 0.01 0.00 -2.06 0.00 0.00 37.83 33.04 2k8q s LYS 18 CO 0.06 0.65 -0.18 0.42 0.10 0.00 0.00 175.35 176.40 2k8q s ILE 19 N -0.89 1.66 -0.28 3.79 1.09 0.22 -0.61 121.20 126.19 2k8q s ILE 19 Ca 0.14 -0.77 -0.19 0.00 -1.10 0.00 0.00 60.65 58.72 2k8q s ILE 19 Cb -0.11 -1.47 -0.02 0.00 -1.06 0.00 0.00 42.46 39.80 2k8q s ILE 19 CO 0.04 0.47 0.59 -0.36 -0.10 0.00 0.00 174.94 175.58 2k8q s PHE 20 N 0.62 3.25 0.29 3.97 0.08 -0.21 -1.41 117.98 124.56 2k8q s PHE 20 Ca -0.14 0.66 -0.09 0.00 0.12 0.00 0.00 56.93 57.48 2k8q s PHE 20 Cb -0.16 -2.86 0.00 0.00 -0.57 0.00 0.00 43.02 39.43 2k8q s PHE 20 CO 0.04 -0.37 0.49 0.96 -0.10 0.00 0.00 175.22 176.25 2k8q s ILE 21 N 2.48 0.00 0.36 0.64 -4.36 -1.25 -3.92 121.20 115.14 2k8q s ILE 21 Ca 0.24 -1.45 0.00 0.00 -0.26 0.00 0.00 60.65 59.18 2k8q s ILE 21 Cb -0.15 -2.42 0.00 0.00 1.25 0.00 0.00 42.46 41.14 2k8q s ILE 21 CO 0.10 0.00 0.03 -1.20 0.24 0.00 0.00 174.94 174.11 2k8q n SER 22 N -0.80 2.89 -0.32 4.36 7.64 -1.26 -4.34 113.62 121.80 2k8q n SER 22 Ca -0.01 -2.52 0.07 0.00 1.01 0.00 0.00 58.87 57.42 2k8q n SER 22 Cb 0.62 0.22 0.31 0.00 -1.01 0.00 0.00 64.21 64.35 2k8q n SER 22 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2k8q n ASN 23 N -1.29 0.94 -0.30 6.43 0.23 -1.26 -4.13 115.26 115.87 2k8q n ASN 23 Ca -0.13 -1.74 0.09 0.00 -0.53 0.00 0.00 54.58 52.27 2k8q n ASN 23 Cb 0.45 -0.08 0.24 0.00 -2.08 0.00 0.00 39.78 38.31 2k8q n ASN 23 CO 0.00 0.00 0.00 0.16 -0.93 0.00 0.00 177.26 176.49 2k8q h ILE 24 N 1.16 0.68 -2.69 1.53 3.07 -2.00 -3.36 117.51 115.90 2k8q h ILE 24 Ca 0.00 -0.20 -0.50 0.00 1.55 0.00 0.00 64.86 65.71 2k8q h ILE 24 Cb 0.26 0.04 -0.39 0.00 -0.27 0.00 0.00 36.82 36.46 2k8q h ILE 24 CO 0.00 0.11 -0.76 -0.13 -1.05 0.00 0.00 178.15 176.32 2k8q s ARG 25 N -5.95 0.21 -0.36 0.16 1.81 -1.26 -5.07 118.95 108.49 2k8q s ARG 25 Ca -0.12 -0.45 0.05 0.00 -1.72 0.00 0.00 55.73 53.49 2k8q s ARG 25 Cb 0.22 -1.10 0.17 0.00 -0.45 0.00 0.00 34.95 33.80 2k8q s ARG 25 CO 0.78 -1.01 0.52 0.12 -0.68 0.00 0.00 175.30 175.03 2k8q s PHE 26 N 2.14 -1.28 -0.38 -0.53 5.36 -1.26 -4.70 117.98 117.34 2k8q s PHE 26 Ca 0.09 0.15 0.22 0.00 -0.96 0.00 0.00 56.93 56.43 2k8q s PHE 26 Cb -0.16 0.06 -0.10 0.00 -0.34 0.00 0.00 43.02 42.48 2k8q s PHE 26 CO -0.35 -1.08 0.86 0.43 -1.46 0.00 0.00 175.22 173.61 2k8q n SER 27 N 4.72 0.50 -2.01 6.13 7.64 -1.26 -4.96 113.62 124.38 2k8q n SER 27 Ca 0.08 -0.08 -0.21 0.00 1.01 0.00 0.00 58.87 59.67 2k8q n SER 27 Cb 0.52 1.10 -0.05 0.00 -1.01 0.00 0.00 64.21 64.77 2k8q n SER 27 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8q n ALA 28 N -2.02 -0.47 0.04 -0.43 0.00 -1.26 -4.81 120.51 111.55 2k8q n ALA 28 Ca -0.00 0.25 0.01 0.00 0.00 0.00 0.00 53.44 53.70 2k8q n ALA 28 Cb 0.50 -2.13 0.03 0.00 0.00 0.00 0.00 19.45 17.84 2k8q n ALA 28 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2k8q n VAL 29 N -3.21 0.51 -0.83 0.00 0.24 -1.26 -4.62 118.33 109.16 2k8q n VAL 29 Ca -0.23 -0.75 0.00 0.00 -2.04 0.00 0.00 64.34 61.32 2k8q n VAL 29 Cb 0.69 0.78 0.00 0.00 -1.47 0.00 0.00 33.84 33.83 2k8q n VAL 29 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k8q n GLY 30 N -0.04 -0.99 3.63 7.63 0.00 -1.26 -5.06 105.19 109.10 2k8q n GLY 30 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.10 3.87 -0.41 0.99 1.43 -1.26 -4.52 118.68 118.67 2k8q s LEU 31 Ca 0.00 1.61 0.02 0.00 -1.03 0.00 0.00 54.13 54.73 2k8q s LEU 31 Cb 0.00 -3.53 0.19 0.00 0.03 0.00 0.00 46.19 42.88 2k8q s LEU 31 CO 0.00 -1.29 0.82 -0.70 0.23 0.00 0.00 176.35 175.41 2k8q s GLU 32 N 4.75 0.66 -0.09 1.70 2.12 -1.26 -4.98 118.70 121.60 2k8q s GLU 32 Ca 0.72 -0.44 -0.19 0.00 0.36 0.00 0.00 54.97 55.42 2k8q s GLU 32 Cb -0.25 0.02 -0.04 0.00 0.26 0.00 0.00 34.13 34.12 2k8q s GLU 32 CO 0.30 -0.88 0.53 0.42 -0.54 0.00 0.00 175.26 175.09 2k8q s ILE 33 N 1.45 5.13 0.13 -3.70 1.01 -1.26 -4.28 121.20 119.68 2k8q s ILE 33 Ca 0.21 1.07 0.08 0.00 0.00 0.00 0.00 60.65 62.01 2k8q s ILE 33 Cb 0.01 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 2k8q s ILE 33 CO -0.09 0.33 -0.18 0.27 0.00 0.00 0.00 174.94 175.27 2k8q s ILE 34 N 0.53 1.62 -0.17 2.92 -5.25 -1.05 -4.92 121.20 114.88 2k8q s ILE 34 Ca 0.29 -1.70 -0.06 0.00 -0.99 0.00 0.00 60.65 58.19 2k8q s ILE 34 Cb -0.16 -1.62 -0.03 0.00 2.95 0.00 0.00 42.46 43.60 2k8q s ILE 34 CO 0.13 -0.24 0.02 -0.63 -1.79 0.00 0.00 174.94 172.42 2k8q s ILE 35 N -1.70 4.37 0.22 8.37 1.09 -1.26 -0.71 121.20 131.58 2k8q s ILE 35 Ca 0.10 -0.19 -0.04 0.00 -1.10 0.00 0.00 60.65 59.42 2k8q s ILE 35 Cb -0.07 -2.94 0.05 0.00 -1.06 0.00 0.00 42.46 38.44 2k8q s ILE 35 CO 0.05 0.48 0.25 0.00 -0.10 0.00 0.00 174.94 175.62 2k8q n GLN 36 N 3.47 -0.71 -0.29 2.79 1.13 0.13 -4.58 117.38 119.31 2k8q n GLN 36 Ca -0.17 -0.40 0.23 0.00 -1.94 0.00 0.00 57.00 54.72 2k8q n GLN 36 Cb 0.52 -0.30 0.54 0.00 0.11 0.00 0.00 30.24 31.11 2k8q n GLN 36 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 2k8q h GLU 37 N 0.00 0.34 0.00 -1.09 4.11 -2.00 -3.38 114.58 112.56 2k8q h GLU 37 Ca -0.09 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.32 2k8q h GLU 37 Cb 0.25 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2k8q h GLU 37 CO 0.06 0.23 0.00 0.27 0.07 0.00 0.00 179.01 179.64 2k8q n ASN 38 N -4.54 -0.05 -4.40 3.06 6.94 -1.26 -4.19 115.26 110.83 2k8q n ASN 38 Ca 0.23 0.07 -0.29 0.00 -0.02 0.00 0.00 54.58 54.56 2k8q n ASN 38 Cb 0.85 0.10 0.17 0.00 -2.36 0.00 0.00 39.78 38.53 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 0.54 -0.03 -3.83 0.23 -1.26 -2.39 119.30 110.55 2k8q s MET 39 Ca 0.00 0.01 0.07 0.00 -1.03 0.00 0.00 55.69 54.74 2k8q s MET 39 Cb 0.00 -1.79 -0.02 0.00 -1.53 0.00 0.00 34.83 31.49 2k8q s MET 39 CO 0.00 -2.55 -0.25 0.42 -2.03 0.00 0.00 175.02 170.61 2k8q s ILE 40 N -3.40 2.11 -0.24 3.16 1.01 -0.17 0.19 121.20 123.85 2k8q s ILE 40 Ca 0.68 -1.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.19 2k8q s ILE 40 Cb -0.10 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.60 2k8q s ILE 40 CO 0.54 0.58 0.04 -0.63 0.00 0.00 0.00 174.94 175.46 2k8q s ILE 41 N -0.47 4.05 -0.50 2.92 -1.09 0.12 -1.57 121.20 124.66 2k8q s ILE 41 Ca 0.06 -0.28 -0.16 0.00 -2.23 0.00 0.00 60.65 58.03 2k8q s ILE 41 Cb -0.11 -2.90 0.08 0.00 -1.58 0.00 0.00 42.46 37.95 2k8q s ILE 41 CO 0.01 0.35 0.48 0.12 -1.23 0.00 0.00 174.94 174.66 2k8q s PHE 42 N 1.57 3.19 -0.20 3.97 5.36 -0.01 -2.52 117.98 129.34 2k8q s PHE 42 Ca 0.06 -0.93 0.20 0.00 -0.96 0.00 0.00 56.93 55.31 2k8q s PHE 42 Cb -0.15 -3.41 -0.30 0.00 -0.34 0.00 0.00 43.02 38.82 2k8q s PHE 42 CO 0.02 -0.91 0.52 1.58 -1.46 0.00 0.00 175.22 174.96 2k8q n HIS 43 N 5.46 0.00 -1.31 10.12 -0.00 -1.26 -1.50 115.22 126.73 2k8q n HIS 43 Ca -0.11 0.00 -0.37 0.00 0.46 0.00 0.00 57.72 57.70 2k8q n HIS 43 Cb 0.43 -0.38 0.06 0.00 -0.12 0.00 0.00 29.99 29.98 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 -2.06 0.45 -1.35 0.27 0.00 -1.26 -4.70 117.00 108.34 2k8q n LEU 44 Ca -0.02 0.62 0.17 0.00 0.00 0.00 0.00 56.01 56.78 2k8q n LEU 44 Cb 0.49 -1.18 -0.07 0.00 0.00 0.00 0.00 43.42 42.66 2k8q n LEU 44 CO 0.42 -3.24 -0.47 -1.54 0.00 0.00 0.00 177.39 172.56 2k8q n SER 45 N 0.14 -7.94 0.00 1.96 3.41 -1.26 -4.14 113.62 105.79 2k8q n SER 45 Ca 0.10 1.07 0.07 0.00 -0.26 0.00 0.00 58.87 59.85 2k8q n SER 45 Cb 0.49 -4.45 0.39 0.00 -0.26 0.00 0.00 64.21 60.39 2k8q n SER 45 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2k8q n PRO 46 N -4.20 0.27 -4.31 4.33 -0.04 -1.26 -4.63 135.00 125.16 2k8q n PRO 46 Ca -0.05 0.11 -0.34 0.00 -0.04 0.00 0.00 63.50 63.19 2k8q n PRO 46 Cb 0.63 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.47 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 -2.45 3.03 -0.16 0.54 2.02 -1.26 -5.10 117.35 113.98 2k8q s TYR 47 Ca 0.16 -0.34 -0.15 0.00 -0.37 0.00 0.00 57.07 56.37 2k8q s TYR 47 Cb 0.10 -1.99 -0.05 0.00 -0.40 0.00 0.00 41.96 39.63 2k8q s TYR 47 CO 0.22 -0.09 0.33 -0.47 -1.57 0.00 0.00 175.55 173.96 2k8q s TYR 48 N 0.53 3.46 0.06 2.71 6.14 -1.26 -4.62 117.35 124.37 2k8q s TYR 48 Ca -0.03 0.64 0.06 0.00 0.64 0.00 0.00 57.07 58.38 2k8q s TYR 48 Cb -0.14 -2.39 -0.03 0.00 0.42 0.00 0.00 41.96 39.83 2k8q s TYR 48 CO 0.03 0.21 -0.16 -1.17 0.64 0.00 0.00 175.55 175.10 2k8q s LEU 49 N 0.54 2.23 -0.09 6.97 2.96 -0.56 -0.01 118.68 130.73 2k8q s LEU 49 Ca 0.18 -0.57 0.04 0.00 -0.22 0.00 0.00 54.13 53.56 2k8q s LEU 49 Cb -0.13 -0.67 0.00 0.00 0.50 0.00 0.00 46.19 45.89 2k8q s LEU 49 CO 0.05 0.01 -0.22 -0.60 -1.32 0.00 0.00 176.35 174.28 2k8q s ARG 50 N -1.51 2.70 -0.28 1.98 3.52 -1.26 -0.83 118.95 123.27 2k8q s ARG 50 Ca 0.02 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.83 2k8q s ARG 50 Cb -0.09 -2.09 0.05 0.00 -1.56 0.00 0.00 34.95 31.26 2k8q s ARG 50 CO 0.02 0.18 -0.05 -0.51 -0.81 0.00 0.00 175.30 174.13 2k8q s LEU 51 N 0.33 3.64 -0.43 -0.88 1.43 -0.61 -4.29 118.68 117.87 2k8q s LEU 51 Ca -0.16 -1.28 -0.10 0.00 -1.03 0.00 0.00 54.13 51.56 2k8q s LEU 51 Cb -0.17 -1.64 0.08 0.00 0.03 0.00 0.00 46.19 44.49 2k8q s LEU 51 CO 0.07 -0.22 0.29 -0.60 0.23 0.00 0.00 176.35 176.12 2k8q s ARG 52 N 1.20 2.68 0.23 1.70 3.00 -1.25 -1.00 118.95 125.51 2k8q s ARG 52 Ca -0.06 -1.45 -0.01 0.00 -1.00 0.00 0.00 55.73 53.21 2k8q s ARG 52 Cb -0.20 -3.86 -0.04 0.00 0.00 0.00 0.00 34.95 30.85 2k8q s ARG 52 CO -0.03 -0.98 0.42 -0.06 0.00 0.00 0.00 175.30 174.66 2k8q s PHE 53 N 1.47 3.48 -1.18 5.12 0.08 -1.26 -4.50 117.98 121.19 2k8q s PHE 53 Ca 0.03 0.37 0.14 0.00 0.12 0.00 0.00 56.93 57.60 2k8q s PHE 53 Cb -0.23 -1.88 0.66 0.00 -0.57 0.00 0.00 43.02 41.00 2k8q s PHE 53 CO 0.03 0.33 1.44 -0.35 -0.10 0.00 0.00 175.22 176.57 2k8q n PRO 54 N -0.82 0.09 -2.74 0.24 -0.04 -1.26 -4.76 135.00 125.70 2k8q n PRO 54 Ca -0.04 0.21 -0.12 0.00 -0.04 0.00 0.00 63.50 63.50 2k8q n PRO 54 Cb 0.54 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.41 -0.46 -4.00 0.54 8.25 -1.26 -5.14 115.22 111.73 2k8q n HIS 55 Ca 0.05 -1.01 -0.30 0.00 -0.26 0.00 0.00 57.72 56.20 2k8q n HIS 55 Cb 0.15 -0.17 -0.16 0.00 1.12 0.00 0.00 29.99 30.92 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 -2.88 2.16 0.37 -0.41 -1.05 -1.26 -4.57 118.70 111.06 2k8q s GLU 56 Ca 0.08 -0.64 0.02 0.00 -0.15 0.00 0.00 54.97 54.28 2k8q s GLU 56 Cb -0.01 -2.18 0.07 0.00 -0.44 0.00 0.00 34.13 31.57 2k8q s GLU 56 CO 0.05 -0.30 0.51 1.28 0.95 0.00 0.00 175.26 177.75 2k8q n LEU 57 N 4.75 0.00 -3.84 1.83 4.77 -1.01 -3.83 117.00 119.68 2k8q n LEU 57 Ca -0.16 -1.24 -0.12 0.00 -0.03 0.00 0.00 56.01 54.46 2k8q n LEU 57 Cb 0.49 -0.31 -0.12 0.00 -2.33 0.00 0.00 43.42 41.15 2k8q n LEU 57 CO 0.21 -0.71 -0.20 -0.51 -1.33 0.00 0.00 177.39 174.84 2k8q s ILE 58 N -1.37 0.03 -0.48 -0.08 2.07 -0.92 -4.38 121.20 116.08 2k8q s ILE 58 Ca 0.35 -0.23 -0.14 0.00 -1.41 0.00 0.00 60.65 59.23 2k8q s ILE 58 Cb -0.02 -0.28 0.09 0.00 0.13 0.00 0.00 42.46 42.38 2k8q s ILE 58 CO 0.23 -0.13 0.39 -0.62 -1.91 0.00 0.00 174.94 172.90 2k8q s ASP 59 N -0.39 6.01 0.00 4.50 2.15 -1.26 -3.62 116.67 124.05 2k8q s ASP 59 Ca -0.05 -1.54 0.00 0.00 0.43 0.00 0.00 52.55 51.40 2k8q s ASP 59 Cb -0.03 -2.13 0.00 0.00 -0.30 0.00 0.00 42.92 40.46 2k8q s ASP 59 CO 0.01 -0.68 0.00 -0.67 -0.17 0.00 0.00 175.17 173.65 2k8q n ASP 60 N 5.13 1.73 0.11 -0.34 -0.08 -1.26 -5.00 116.55 116.83 2k8q n ASP 60 Ca -0.12 -0.75 -0.01 0.00 -1.51 0.00 0.00 54.79 52.40 2k8q n ASP 60 Cb 0.42 0.00 0.25 0.00 2.34 0.00 0.00 41.12 44.13 2k8q n ASP 60 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2k8q h GLU 61 N 0.00 0.20 -0.27 -0.67 5.08 -2.03 -2.90 114.58 113.99 2k8q h GLU 61 Ca 0.00 -0.09 -0.12 0.00 -1.00 0.00 0.00 59.36 58.15 2k8q h GLU 61 Cb 0.00 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2k8q h GLU 61 CO 0.00 0.57 -0.34 0.07 -1.00 0.00 0.00 179.01 178.31 2k8q h ARG 62 N 0.17 0.59 -6.67 2.33 -0.00 -1.98 -3.43 114.38 105.39 2k8q h ARG 62 Ca 0.02 -0.27 -0.53 0.00 -0.00 0.00 0.00 59.98 59.20 2k8q h ARG 62 Cb 0.77 -0.01 0.05 0.00 -0.00 0.00 0.00 29.97 30.78 2k8q h ARG 62 CO 0.06 0.85 0.84 -1.12 -0.00 0.00 0.00 179.97 180.60 2k8q s SER 63 N -6.82 6.59 -0.19 0.08 0.01 -1.10 -4.90 113.70 107.37 2k8q s SER 63 Ca -0.08 2.66 -0.36 0.00 1.31 0.00 0.00 55.95 59.49 2k8q s SER 63 Cb 0.13 -2.61 0.15 0.00 0.21 0.00 0.00 66.02 63.90 2k8q s SER 63 CO 0.82 -0.79 1.36 0.28 0.41 0.00 0.00 173.24 175.31 2k8q s THR 64 N 0.69 0.00 0.01 1.44 -1.32 -0.66 -4.79 115.64 111.00 2k8q s THR 64 Ca 0.66 -0.03 0.06 0.00 -1.21 0.00 0.00 61.69 61.17 2k8q s THR 64 Cb -0.44 -1.37 -0.02 0.00 -1.51 0.00 0.00 72.50 69.17 2k8q s THR 64 CO 0.36 0.00 -0.18 0.00 -2.21 0.00 0.00 174.62 172.60 2k8q s ALA 65 N -2.14 1.48 0.10 11.08 0.00 -1.26 -0.03 121.76 131.00 2k8q s ALA 65 Ca 0.12 -0.84 0.09 0.00 0.00 0.00 0.00 51.96 51.34 2k8q s ALA 65 Cb 0.02 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 2k8q s ALA 65 CO -0.04 0.35 -0.23 -0.65 0.00 0.00 0.00 175.76 175.19 2k8q s GLN 66 N -0.70 1.24 -0.12 0.00 -1.52 0.14 -4.97 119.66 113.72 2k8q s GLN 66 Ca 0.06 -1.20 -0.22 0.00 -1.95 0.00 0.00 55.36 52.05 2k8q s GLN 66 Cb -0.07 -1.56 -0.03 0.00 -0.22 0.00 0.00 33.01 31.13 2k8q s GLN 66 CO 0.00 0.37 0.66 -0.47 -0.25 0.00 0.00 175.29 175.60 2k8q s TYR 67 N -1.10 3.49 -0.29 0.91 5.04 -1.26 -1.53 117.35 122.61 2k8q s TYR 67 Ca 0.09 1.10 -0.10 0.00 -2.44 0.00 0.00 57.07 55.71 2k8q s TYR 67 Cb -0.10 -2.79 -0.03 0.00 0.35 0.00 0.00 41.96 39.39 2k8q s TYR 67 CO 0.05 -0.01 0.16 -0.51 -1.34 0.00 0.00 175.55 173.90 2k8q s ASP 68 N 0.93 5.73 -0.02 4.32 1.01 0.96 -4.95 116.67 124.64 2k8q s ASP 68 Ca 0.33 -0.24 0.06 0.00 0.71 0.00 0.00 52.55 53.42 2k8q s ASP 68 Cb -0.17 -2.05 -0.24 0.00 1.01 0.00 0.00 42.92 41.47 2k8q s ASP 68 CO 0.14 -0.11 0.74 0.77 0.21 0.00 0.00 175.17 176.92 2k8q h SER 69 N 8.36 0.13 -0.63 0.27 4.64 -1.93 0.12 113.55 124.51 2k8q h SER 69 Ca -0.34 -0.24 0.18 0.00 -0.47 0.00 0.00 61.79 60.92 2k8q h SER 69 Cb 1.17 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 63.19 2k8q h SER 69 CO 0.58 1.21 0.49 0.07 -0.87 0.00 0.00 176.83 178.31 2k8q h LYS 70 N 0.02 0.00 0.00 4.77 5.09 -1.95 -2.25 116.57 122.26 2k8q h LYS 70 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.48 2k8q h LYS 70 Cb 1.98 0.00 0.00 0.00 0.10 0.00 0.00 32.23 34.31 2k8q h LYS 70 CO 0.10 0.00 0.00 -3.47 -2.09 0.00 0.00 179.45 173.99 2k8q n ASP 71 N -4.15 0.64 -2.29 7.07 2.03 -1.25 -5.00 116.55 113.60 2k8q n ASP 71 Ca 0.12 -1.26 -0.14 0.00 0.52 0.00 0.00 54.79 54.03 2k8q n ASP 71 Cb 0.74 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 41.12 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 -0.13 -2.01 -3.82 -0.67 1.02 0.25 -4.81 120.64 110.47 2k8q n GLU 72 Ca 0.00 0.70 -0.22 0.00 -0.02 0.00 0.00 57.16 57.62 2k8q n GLU 72 Cb 0.32 -5.26 -0.05 0.00 -0.02 0.00 0.00 31.44 26.43 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 -2.46 2.74 -0.19 0.00 -1.09 -0.50 -0.03 121.20 119.67 2k8q s ILE 74 Ca 0.44 -0.79 -0.04 0.00 -2.23 0.00 0.00 60.65 58.03 2k8q s ILE 74 Cb -0.02 -2.10 -0.02 0.00 -1.58 0.00 0.00 42.46 38.74 2k8q s ILE 74 CO 0.26 0.55 -0.04 0.54 -1.23 0.00 0.00 174.94 175.02 2k8q s ASN 75 N 0.08 4.54 -0.16 3.58 2.20 -0.58 -0.61 114.94 123.99 2k8q s ASN 75 Ca -0.07 -0.26 -0.01 0.00 -0.94 0.00 0.00 52.86 51.57 2k8q s ASN 75 Cb -0.15 -1.76 -0.01 0.00 -2.00 0.00 0.00 41.25 37.33 2k8q s ASN 75 CO 0.05 0.07 -0.12 -0.69 -2.94 0.00 0.00 177.10 173.48 2k8q s VAL 76 N 0.93 2.99 -0.06 3.54 1.01 0.88 -0.68 120.40 129.01 2k8q s VAL 76 Ca -0.00 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.33 2k8q s VAL 76 Cb -0.15 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 2k8q s VAL 76 CO 0.01 0.50 -0.08 -0.75 0.00 0.00 0.00 175.10 174.78 2k8q s LYS 77 N 0.78 2.70 -0.15 2.72 2.36 0.95 -1.18 119.74 127.92 2k8q s LYS 77 Ca -0.05 -0.58 -0.07 0.00 -2.55 0.00 0.00 55.97 52.72 2k8q s LYS 77 Cb -0.15 -2.56 0.06 0.00 -1.05 0.00 0.00 37.83 34.13 2k8q s LYS 77 CO 0.01 0.66 0.35 0.54 1.55 0.00 0.00 175.35 178.45 2k8q s VAL 78 N -0.82 -0.14 0.51 4.02 0.11 -1.07 -1.65 120.40 121.36 2k8q s VAL 78 Ca 0.13 0.14 -0.20 0.00 -2.93 0.00 0.00 61.98 59.11 2k8q s VAL 78 Cb -0.11 -0.53 -0.07 0.00 -1.53 0.00 0.00 36.38 34.15 2k8q s VAL 78 CO 0.02 0.06 1.12 0.00 -3.33 0.00 0.00 175.10 172.96 2k8q s ALA 79 N 1.60 2.79 -0.07 1.54 0.00 -1.24 -1.40 121.76 124.98 2k8q s ALA 79 Ca -0.08 0.81 -0.01 0.00 0.00 0.00 0.00 51.96 52.68 2k8q s ALA 79 Cb -0.10 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 2k8q s ALA 79 CO -0.11 -0.66 -0.01 0.21 0.00 0.00 0.00 175.76 175.20 2k8q s LYS 80 N -3.14 2.93 0.20 0.00 2.47 -1.26 -2.16 119.74 118.77 2k8q s LYS 80 Ca 0.70 -0.45 -0.12 0.00 -1.56 0.00 0.00 55.97 54.54 2k8q s LYS 80 Cb -0.23 -2.75 0.23 0.00 -1.46 0.00 0.00 37.83 33.61 2k8q s LYS 80 CO 0.27 0.69 1.69 -0.07 0.16 0.00 0.00 175.35 178.09 2k8q h LEU 81 N 5.06 -0.15 -8.42 5.43 3.38 -1.87 -3.38 115.31 115.37 2k8q h LEU 81 Ca -0.50 0.12 -0.66 0.00 0.09 0.00 0.00 57.88 56.92 2k8q h LEU 81 Cb 1.19 0.19 -0.27 0.00 0.09 0.00 0.00 40.66 41.86 2k8q h LEU 81 CO 0.54 -0.05 -0.69 0.20 0.09 0.00 0.00 178.44 178.54 2k8q s ASN 82 N -5.27 4.59 0.79 -0.43 0.01 -1.26 -5.10 114.94 108.27 2k8q s ASN 82 Ca -0.13 -0.46 -0.12 0.00 -0.71 0.00 0.00 52.86 51.44 2k8q s ASN 82 Cb 0.17 -1.79 0.07 0.00 0.41 0.00 0.00 41.25 40.11 2k8q s ASN 82 CO 0.73 -0.06 1.12 -0.75 -1.51 0.00 0.00 177.10 176.63 2k8q s LYS 83 N 1.49 1.97 -1.17 -0.60 2.20 -1.26 -2.93 119.74 119.45 2k8q s LYS 83 Ca 0.05 1.38 0.00 0.00 -0.36 0.00 0.00 55.97 57.04 2k8q s LYS 83 Cb -0.15 -1.85 0.00 0.00 -1.51 0.00 0.00 37.83 34.32 2k8q s LYS 83 CO -0.01 -1.89 0.00 0.09 -0.36 0.00 0.00 175.35 173.18 2k8q n ASN 84 N -3.47 -5.26 -4.82 1.43 5.03 0.85 -4.96 115.26 104.07 2k8q n ASN 84 Ca 0.11 0.27 -0.38 0.00 0.87 0.00 0.00 54.58 55.45 2k8q n ASN 84 Cb 0.52 -3.73 -0.06 0.00 -1.02 0.00 0.00 39.78 35.49 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 -2.81 4.03 0.27 3.52 2.56 -1.15 -4.89 118.70 120.24 2k8q s GLU 85 Ca 0.00 0.51 0.02 0.00 0.00 0.00 0.00 54.97 55.49 2k8q s GLU 85 Cb 0.00 -3.24 0.02 0.00 2.00 0.00 0.00 34.13 32.90 2k8q s GLU 85 CO 0.00 0.63 0.13 2.48 -0.56 0.00 0.00 175.26 177.94 2k8q n TYR 86 N 1.95 -0.42 -4.22 5.30 4.11 -1.26 -4.58 117.16 118.05 2k8q n TYR 86 Ca -0.12 -1.23 -0.13 0.00 -0.00 0.00 0.00 57.90 56.42 2k8q n TYR 86 Cb 0.52 -0.21 -0.10 0.00 -0.00 0.00 0.00 39.34 39.55 2k8q n TYR 86 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.86 176.80 2k8q s PHE 87 N -1.60 1.10 -0.00 -3.48 0.40 -1.26 -5.03 117.98 108.11 2k8q s PHE 87 Ca 0.10 -0.89 0.00 0.00 -0.60 0.00 0.00 56.93 55.55 2k8q s PHE 87 Cb -0.01 -0.61 0.01 0.00 0.51 0.00 0.00 43.02 42.92 2k8q s PHE 87 CO 0.06 -0.08 0.80 0.39 0.70 0.00 0.00 175.22 177.09 2k8q n GLU 88 N -0.15 1.68 -0.01 0.44 1.02 -1.26 -4.73 120.64 117.63 2k8q n GLU 88 Ca -0.10 -1.11 -0.00 0.00 -0.02 0.00 0.00 57.16 55.92 2k8q n GLU 88 Cb 0.61 -0.80 -0.02 0.00 -0.02 0.00 0.00 31.44 31.21 2k8q n GLU 88 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2k8q n ASP 89 N -0.31 4.26 0.26 1.62 9.92 -1.26 -4.60 116.55 126.44 2k8q n ASP 89 Ca 0.00 0.00 0.18 0.00 -0.53 0.00 0.00 54.79 54.44 2k8q n ASP 89 Cb 0.37 0.79 0.92 0.00 -0.64 0.00 0.00 41.12 42.55 2k8q n ASP 89 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2k8q h LEU 90 N 0.00 0.00 -2.00 0.64 3.38 -1.94 0.11 115.31 115.50 2k8q h LEU 90 Ca -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2k8q h LEU 90 Cb 0.80 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 2k8q h LEU 90 CO 0.00 0.00 -0.07 0.44 0.09 0.00 0.00 178.44 178.90 2k8q h ASP 91 N 0.00 0.00 -3.59 -0.43 3.32 -1.88 -3.40 116.42 110.44 2k8q h ASP 91 Ca 0.05 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.42 2k8q h ASP 91 Cb 0.36 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 39.59 2k8q h ASP 91 CO -0.00 0.07 -0.73 -0.76 -1.72 0.00 0.00 179.24 176.10 2k8q s LEU 92 N -6.79 3.41 0.00 1.55 2.01 0.38 -4.85 118.68 114.39 2k8q s LEU 92 Ca -0.02 -0.98 0.14 0.00 0.01 0.00 0.00 54.13 53.28 2k8q s LEU 92 Cb 0.12 -1.68 0.63 0.00 0.01 0.00 0.00 46.19 45.26 2k8q s LEU 92 CO 0.54 -0.17 1.44 -0.81 1.01 0.00 0.00 176.35 178.37 2k8q n PRO 93 N 4.66 0.04 0.06 1.29 -0.04 -1.26 -2.12 135.00 137.63 2k8q n PRO 93 Ca -0.15 0.24 0.11 0.00 -0.04 0.00 0.00 63.50 63.66 2k8q n PRO 93 Cb 0.46 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.41 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 -1.46 0.36 0.25 0.52 -2.24 -1.26 -3.90 114.28 106.54 2k8q n THR 94 Ca 0.04 -0.43 0.13 0.00 -2.27 0.00 0.00 64.05 61.52 2k8q n THR 94 Cb 0.16 -0.11 0.54 0.00 -2.10 0.00 0.00 70.33 68.82 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 0.00 0.00 0.03 -0.78 6.56 -1.71 0.36 116.57 121.03 2k8q h LYS 95 Ca 0.00 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.43 2k8q h LYS 95 Cb 0.90 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.55 2k8q h LYS 95 CO 0.00 0.12 -0.86 -0.07 -2.06 0.00 0.00 179.45 176.58 2k8q h LEU 96 N 0.00 0.09 0.33 2.94 -0.00 -1.70 -3.41 115.31 113.56 2k8q h LEU 96 Ca -0.00 -0.75 -0.02 0.00 -0.00 0.00 0.00 57.88 57.11 2k8q h LEU 96 Cb 0.66 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.29 2k8q h LEU 96 CO 0.02 1.35 -0.16 -0.07 -0.00 0.00 0.00 178.44 179.58 2k8q h LEU 97 N -0.84 -0.38 -2.57 1.67 3.38 -1.67 -3.33 115.31 111.58 2k8q h LEU 97 Ca -0.22 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.47 2k8q h LEU 97 Cb 1.31 0.10 0.12 0.00 0.09 0.00 0.00 40.66 42.27 2k8q h LEU 97 CO -0.08 0.09 -0.53 0.00 0.09 0.00 0.00 178.44 178.01 2k8q n ALA 98 N -2.65 -2.08 -3.53 1.53 0.00 0.11 -5.05 120.51 108.84 2k8q n ALA 98 Ca -0.08 0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.34 2k8q n ALA 98 Cb 0.24 -3.88 0.01 0.00 0.00 0.00 0.00 19.45 15.82 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 -3.85 2.17 -0.16 0.00 1.70 -1.26 -5.13 118.95 112.42 2k8q s ARG 99 Ca 0.28 -1.56 0.01 0.00 -0.47 0.00 0.00 55.73 53.99 2k8q s ARG 99 Cb -0.04 0.57 0.01 0.00 -0.57 0.00 0.00 34.95 34.93 2k8q s ARG 99 CO 0.57 -0.98 -0.18 1.14 -1.08 0.00 0.00 175.30 174.77 2k8q s GLN 100 N -2.46 3.10 0.00 3.89 -2.07 -1.26 -4.95 119.66 115.91 2k8q s GLN 100 Ca 0.20 -0.79 0.00 0.00 -1.82 0.00 0.00 55.36 52.95 2k8q s GLN 100 Cb -0.04 -2.58 0.00 0.00 -1.09 0.00 0.00 33.01 29.30 2k8q s GLN 100 CO 0.14 -0.07 0.50 0.41 -1.32 0.00 0.00 175.29 174.95 2k8q n GLY 101 N 4.28 -2.73 3.00 2.60 0.00 -1.26 -5.03 105.19 106.05 2k8q n GLY 101 Ca -0.20 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 2k8q n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k8q n ASP 102 N 0.00 -3.74 0.00 1.61 8.00 -1.26 -4.94 116.55 116.22 2k8q n ASP 102 Ca 0.00 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 54.95 2k8q n ASP 102 Cb 0.51 -4.39 0.00 0.00 -0.02 0.00 0.00 41.12 37.22 2k8q n ASP 102 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8q n LEU 103 N -3.31 0.68 -4.75 0.64 -0.00 -1.26 -5.06 117.00 103.95 2k8q n LEU 103 Ca -0.16 -0.73 -0.42 0.00 -0.00 0.00 0.00 56.01 54.71 2k8q n LEU 103 Cb 0.62 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 44.03 2k8q n LEU 103 CO 0.50 0.17 1.13 0.00 -0.00 0.00 0.00 177.39 179.19 2k8q n ALA 104 N -0.08 2.19 0.00 1.47 0.00 -1.26 -4.61 120.51 118.21 2k8q n ALA 104 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2k8q n ALA 104 Cb 0.05 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.10 2k8q n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k8q n GLY 105 N 1.26 -0.50 3.57 0.00 0.00 -1.26 -5.07 105.19 103.18 2k8q n GLY 105 Ca 0.05 0.15 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.00 2.21 0.45 4.61 0.00 -1.26 -4.96 121.76 121.81 2k8q s ALA 106 Ca 0.00 0.01 0.08 0.00 0.00 0.00 0.00 51.96 52.04 2k8q s ALA 106 Cb 0.00 -4.22 0.00 0.00 0.00 0.00 0.00 23.12 18.90 2k8q s ALA 106 CO 0.00 -3.67 0.45 0.16 0.00 0.00 0.00 175.76 172.70 2k8q s ASP 107 N 9.20 5.07 0.60 0.00 -4.77 -1.26 -5.14 116.67 120.38 2k8q s ASP 107 Ca 0.86 -0.79 0.04 0.00 -3.30 0.00 0.00 52.55 49.36 2k8q s ASP 107 Cb -0.20 -0.34 0.08 0.00 -1.09 0.00 0.00 42.92 41.37 2k8q s ASP 107 CO 0.28 -0.81 0.83 0.00 0.70 0.00 0.00 175.17 176.17 2k8q s ALA 108 N -2.52 4.15 0.20 2.11 0.00 -1.26 -5.13 121.76 119.31 2k8q s ALA 108 Ca 0.48 -1.76 -0.23 0.00 0.00 0.00 0.00 51.96 50.45 2k8q s ALA 108 Cb -0.04 -1.81 0.05 0.00 0.00 0.00 0.00 23.12 21.32 2k8q s ALA 108 CO 0.29 -0.98 0.85 -0.48 0.00 0.00 0.00 175.76 175.43 2k8q s LEU 109 N -4.82 -0.23 -0.24 0.00 0.05 -1.26 -5.10 118.68 107.08 2k8q s LEU 109 Ca 0.62 -0.46 -0.04 0.00 0.05 0.00 0.00 54.13 54.30 2k8q s LEU 109 Cb -0.07 2.40 0.09 0.00 -2.05 0.00 0.00 46.19 46.56 2k8q s LEU 109 CO 0.40 -1.08 0.15 0.42 -0.55 0.00 0.00 176.35 175.70 2k8q s THR 110 N -3.55 -0.16 0.41 5.48 -4.23 -1.26 -5.14 115.64 107.19 2k8q s THR 110 Ca 0.11 -0.45 0.04 0.00 -1.18 0.00 0.00 61.69 60.21 2k8q s THR 110 Cb -0.03 -0.81 -0.03 0.00 1.34 0.00 0.00 72.50 72.97 2k8q s THR 110 CO 0.03 -0.48 0.12 -1.83 -0.54 0.00 0.00 174.62 171.92 2k8q s GLU 111 N 2.18 1.93 1.08 3.99 -1.05 -1.26 -5.14 118.70 120.43 2k8q s GLU 111 Ca 0.07 -2.17 -0.16 0.00 -0.15 0.00 0.00 54.97 52.55 2k8q s GLU 111 Cb -0.16 -0.68 0.11 0.00 -0.44 0.00 0.00 34.13 32.96 2k8q s GLU 111 CO -0.24 -0.45 0.24 0.09 0.95 0.00 0.00 175.26 175.84 2k8q n ASN 112 N -1.26 -2.17 -4.72 0.83 3.02 -1.26 -4.86 115.26 104.84 2k8q n ASN 112 Ca -0.06 -0.01 -0.42 0.00 -0.03 0.00 0.00 54.58 54.06 2k8q n ASN 112 Cb 0.65 -1.06 -0.01 0.00 -0.61 0.00 0.00 39.78 38.75 2k8q n ASN 112 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 2k8q n THR 113 N -4.29 1.74 -3.81 3.41 5.66 -1.26 -4.98 114.28 110.76 2k8q n THR 113 Ca 0.03 -0.44 -0.03 0.00 -3.05 0.00 0.00 64.05 60.56 2k8q n THR 113 Cb 0.59 -1.72 0.00 0.00 -1.55 0.00 0.00 70.33 67.65 2k8q n THR 113 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 2k8q s ASP 114 N -0.08 -0.08 0.42 1.09 -4.77 -1.26 -5.15 116.67 106.85 2k8q s ASP 114 Ca 0.57 -0.52 -0.24 0.00 -3.30 0.00 0.00 52.55 49.06 2k8q s ASP 114 Cb -0.54 0.47 -0.10 0.00 -1.09 0.00 0.00 42.92 41.66 2k8q s ASP 114 CO 0.59 -0.91 1.04 0.00 0.70 0.00 0.00 175.17 176.59 2k8q n ALA 115 N -0.58 0.31 -2.76 2.11 0.00 -1.26 -5.00 120.51 113.33 2k8q n ALA 115 Ca -0.05 0.23 -0.26 0.00 0.00 0.00 0.00 53.44 53.36 2k8q n ALA 115 Cb 0.60 -2.10 -0.06 0.00 0.00 0.00 0.00 19.45 17.89 2k8q n ALA 115 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2k8q s LYS 116 N -2.05 2.75 1.08 0.00 2.47 -1.26 -5.10 119.74 117.63 2k8q s LYS 116 Ca 0.63 -0.95 -0.16 0.00 -1.56 0.00 0.00 55.97 53.93 2k8q s LYS 116 Cb -0.55 -2.55 0.13 0.00 -1.46 0.00 0.00 37.83 33.40 2k8q s LYS 116 CO 0.57 0.47 0.38 1.63 0.16 0.00 0.00 175.35 178.56 2k8q n LYS 117 N -0.32 -1.44 -3.44 4.03 5.02 -1.26 -4.95 118.16 115.81 2k8q n LYS 117 Ca -0.09 -0.39 -0.42 0.00 -2.02 0.00 0.00 58.31 55.39 2k8q n LYS 117 Cb 0.55 -1.88 -0.10 0.00 -0.02 0.00 0.00 35.03 33.58 2k8q n LYS 117 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k8q s THR 118 N -2.33 5.22 -0.19 -0.18 -4.23 -1.26 -5.03 115.64 107.63 2k8q s THR 118 Ca 0.60 -0.35 -0.04 0.00 -1.18 0.00 0.00 61.69 60.72 2k8q s THR 118 Cb -0.18 -3.87 0.06 0.00 1.34 0.00 0.00 72.50 69.85 2k8q s THR 118 CO 0.66 -0.21 0.07 0.00 -0.54 0.00 0.00 174.62 174.60 2k8q s GLN 119 N 1.85 0.28 -0.49 3.99 -2.07 -1.26 -5.05 119.66 116.90 2k8q s GLN 119 Ca 0.08 -0.24 0.07 0.00 -1.82 0.00 0.00 55.36 53.46 2k8q s GLN 119 Cb -0.18 -1.89 0.27 0.00 -1.09 0.00 0.00 33.01 30.11 2k8q s GLN 119 CO 0.11 -0.68 0.65 1.17 -1.32 0.00 0.00 175.29 175.22 2k8q n LYS 120 N 5.19 1.57 -0.25 9.60 3.00 -1.26 -5.11 118.16 130.90 2k8q n LYS 120 Ca -0.08 -3.87 -0.07 0.00 -0.00 0.00 0.00 58.31 54.29 2k8q n LYS 120 Cb 0.48 -1.71 0.06 0.00 0.00 0.00 0.00 35.03 33.86 2k8q n LYS 120 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2k8q n PRO 121 N 0.98 -1.53 -3.91 1.64 -0.04 -1.26 -5.07 135.00 125.81 2k8q n PRO 121 Ca 0.25 -0.42 -0.25 0.00 -0.04 0.00 0.00 63.50 63.04 2k8q n PRO 121 Cb 0.49 -0.39 -0.17 0.00 -0.04 0.00 0.00 33.50 33.39 2k8q n PRO 121 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2k8q s LEU 122 N 0.00 1.03 -0.20 1.53 2.34 -1.26 -5.12 118.68 117.00 2k8q s LEU 122 Ca 0.17 -0.23 -0.04 0.00 0.06 0.00 0.00 54.13 54.09 2k8q s LEU 122 Cb -0.02 -0.70 -0.02 0.00 -0.56 0.00 0.00 46.19 44.90 2k8q s LEU 122 CO 0.13 -0.13 -0.03 -0.63 -1.06 0.00 0.00 176.35 174.63 2k8q s ILE 123 N 1.70 3.64 1.35 1.48 1.01 -1.26 -5.11 121.20 124.00 2k8q s ILE 123 Ca 0.03 -0.42 -0.21 0.00 0.00 0.00 0.00 60.65 60.06 2k8q s ILE 123 Cb -0.13 -2.64 0.34 0.00 0.01 0.00 0.00 42.46 40.04 2k8q s ILE 123 CO -0.06 0.44 0.98 0.00 0.00 0.00 0.00 174.94 176.29 2k8q s GLN 124 N 1.10 -2.34 -0.06 2.79 0.00 -1.26 -5.05 119.66 114.84 2k8q s GLN 124 Ca 0.02 0.17 0.04 0.00 -0.00 0.00 0.00 55.36 55.59 2k8q s GLN 124 Cb -0.15 -1.44 0.00 0.00 0.00 0.00 0.00 33.01 31.42 2k8q s GLN 124 CO 0.00 -4.50 -0.17 -2.00 0.00 0.00 0.00 175.29 168.63 2k8q s GLU 125 N -5.07 1.98 -0.00 9.60 2.12 -1.26 -5.13 118.70 120.93 2k8q s GLU 125 Ca 0.69 -0.60 -0.01 0.00 0.36 0.00 0.00 54.97 55.41 2k8q s GLU 125 Cb -0.14 -1.64 -0.00 0.00 0.26 0.00 0.00 34.13 32.61 2k8q s GLU 125 CO 0.58 0.18 0.01 0.54 -0.54 0.00 0.00 175.26 176.03 2k8q s VAL 126 N 0.26 0.02 -0.33 3.70 0.11 -1.26 -5.12 120.40 117.77 2k8q s VAL 126 Ca -0.09 -0.19 -0.26 0.00 -2.93 0.00 0.00 61.98 58.51 2k8q s VAL 126 Cb -0.14 -0.09 0.01 0.00 -1.53 0.00 0.00 36.38 34.63 2k8q s VAL 126 CO 0.04 -0.10 0.92 -1.61 -3.33 0.00 0.00 175.10 171.02 2k8q s GLU 127 N -0.30 3.95 0.18 1.54 0.41 -1.26 -5.03 118.70 118.19 2k8q s GLU 127 Ca -0.03 0.72 -0.28 0.00 -0.41 0.00 0.00 54.97 54.97 2k8q s GLU 127 Cb -0.02 -3.76 -0.08 0.00 -1.78 0.00 0.00 34.13 28.49 2k8q s GLU 127 CO -0.00 -0.84 0.87 0.99 -0.49 0.00 0.00 175.26 175.78 2k8q s THR 128 N 3.35 4.29 0.16 3.63 2.01 -1.26 -5.06 115.64 122.76 2k8q s THR 128 Ca 0.38 1.91 -0.05 0.00 0.31 0.00 0.00 61.69 64.23 2k8q s THR 128 Cb -0.13 -4.24 -0.06 0.00 0.01 0.00 0.00 72.50 68.08 2k8q s THR 128 CO 0.16 0.48 0.41 -0.62 -0.69 0.00 0.00 174.62 174.35 2k8q s ASP 129 N -0.93 6.51 -0.31 3.53 2.15 -1.26 -5.08 116.67 121.28 2k8q s ASP 129 Ca 0.40 0.64 -0.03 0.00 0.43 0.00 0.00 52.55 53.99 2k8q s ASP 129 Cb -0.24 -2.11 0.11 0.00 -0.30 0.00 0.00 42.92 40.38 2k8q s ASP 129 CO 0.29 0.02 0.15 -0.83 -0.17 0.00 0.00 175.17 174.63 2k8q s GLY 130 N -2.45 0.59 -0.44 2.66 0.00 -1.26 -5.10 107.32 101.32 2k8q s GLY 130 Ca 0.42 -1.29 -0.14 0.00 0.00 0.00 0.00 44.72 43.71 2k8q s GLY 130 CO 0.24 2.07 0.33 0.14 0.00 0.00 0.00 173.10 175.89 2k8q s VAL 131 N 1.83 4.95 0.24 1.40 1.01 -1.26 -5.06 120.40 123.50 2k8q s VAL 131 Ca 0.11 -1.06 0.11 0.00 0.00 0.00 0.00 61.98 61.15 2k8q s VAL 131 Cb -0.18 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 2k8q s VAL 131 CO -0.27 -0.49 -0.20 -0.94 0.00 0.00 0.00 175.10 173.21 2k8q s SER 132 N 2.25 3.64 0.35 3.32 1.04 -1.26 -5.15 113.70 117.88 2k8q s SER 132 Ca 0.04 -0.90 0.03 0.00 0.48 0.00 0.00 55.95 55.60 2k8q s SER 132 Cb -0.23 -0.35 -0.04 0.00 0.10 0.00 0.00 66.02 65.51 2k8q s SER 132 CO 0.06 0.08 0.12 0.20 0.98 0.00 0.00 173.24 174.68 2k8q s ASN 133 N -3.12 2.17 0.00 7.02 0.01 -1.26 -5.36 114.94 114.40 2k8q s ASN 133 Ca 0.26 -1.55 0.30 0.00 -0.71 0.00 0.00 52.86 51.15 2k8q s ASN 133 Cb -0.07 0.32 1.38 0.00 0.41 0.00 0.00 41.25 43.29 2k8q s ASN 133 CO 0.13 -0.83 1.93 -3.20 -1.51 0.00 0.00 177.10 173.62