#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 -0.29 0.00 -0.61 1.01 0.95 -4.98 121.20 117.28 2k8q s ILE 2 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.92 2k8q s ILE 2 Cb 0.00 -0.38 0.00 0.00 0.01 0.00 0.00 42.46 42.09 2k8q s ILE 2 CO 0.00 0.09 0.00 1.07 0.00 0.00 0.00 174.94 176.10 2k8q n THR 3 N 5.33 0.00 0.04 2.92 5.66 -1.26 -3.92 114.28 123.04 2k8q n THR 3 Ca -0.05 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.82 2k8q n THR 3 Cb 0.50 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.19 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 -0.13 -2.53 1.09 0.13 -2.01 -3.47 132.00 125.08 2k8q h PRO 4 Ca 0.00 0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.08 2k8q h PRO 4 Cb 0.00 0.03 -0.17 0.00 0.13 0.00 0.00 31.00 30.99 2k8q h PRO 4 CO 0.00 0.31 0.10 1.03 -0.23 0.00 0.00 178.00 179.21 2k8q s ARG 5 N -4.18 1.06 -0.29 0.86 3.00 -1.25 -5.08 118.95 113.07 2k8q s ARG 5 Ca -0.15 -0.08 -0.21 0.00 0.00 0.00 0.00 55.73 55.29 2k8q s ARG 5 Cb 0.02 0.49 0.14 0.00 0.00 0.00 0.00 34.95 35.60 2k8q s ARG 5 CO 0.61 -0.37 1.09 -0.59 0.00 0.00 0.00 175.30 176.03 2k8q s PHE 6 N -2.10 -0.42 0.05 -0.53 -0.12 -1.26 -1.23 117.98 112.36 2k8q s PHE 6 Ca -0.07 0.95 0.07 0.00 -0.05 0.00 0.00 56.93 57.83 2k8q s PHE 6 Cb -0.01 0.36 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 2k8q s PHE 6 CO 0.01 -0.21 -0.21 -1.12 -0.05 0.00 0.00 175.22 173.65 2k8q s SER 7 N 0.63 2.47 0.01 1.98 0.01 0.34 -4.97 113.70 114.16 2k8q s SER 7 Ca -0.01 -0.54 0.04 0.00 1.31 0.00 0.00 55.95 56.75 2k8q s SER 7 Cb -0.04 -0.20 -0.03 0.00 0.21 0.00 0.00 66.02 65.96 2k8q s SER 7 CO -0.11 0.15 -0.10 -0.63 0.41 0.00 0.00 173.24 172.96 2k8q s ILE 8 N -0.84 3.38 0.04 1.44 1.01 -1.26 -0.10 121.20 124.86 2k8q s ILE 8 Ca 0.07 -0.87 0.06 0.00 0.00 0.00 0.00 60.65 59.92 2k8q s ILE 8 Cb -0.09 -2.44 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 2k8q s ILE 8 CO 0.02 0.40 -0.17 -0.89 0.00 0.00 0.00 174.94 174.31 2k8q s THR 9 N -0.95 1.34 0.01 2.92 2.01 0.99 -4.87 115.64 117.10 2k8q s THR 9 Ca 0.16 -1.08 0.03 0.00 0.31 0.00 0.00 61.69 61.11 2k8q s THR 9 Cb -0.11 -1.19 -0.03 0.00 0.01 0.00 0.00 72.50 71.17 2k8q s THR 9 CO 0.06 0.09 -0.05 0.00 -0.69 0.00 0.00 174.62 174.03 2k8q s GLN 10 N -1.15 2.60 0.29 4.92 0.00 -1.26 -0.68 119.66 124.39 2k8q s GLN 10 Ca 0.04 -0.70 0.02 0.00 -0.00 0.00 0.00 55.36 54.72 2k8q s GLN 10 Cb -0.08 -2.54 -0.05 0.00 0.00 0.00 0.00 33.01 30.34 2k8q s GLN 10 CO 0.01 0.61 0.11 -0.51 0.00 0.00 0.00 175.29 175.51 2k8q s ASP 11 N -1.48 1.56 0.00 12.60 1.01 -0.60 -4.93 116.67 124.84 2k8q s ASP 11 Ca 0.18 -1.45 0.16 0.00 0.71 0.00 0.00 52.55 52.15 2k8q s ASP 11 Cb -0.11 0.21 0.60 0.00 1.01 0.00 0.00 42.92 44.63 2k8q s ASP 11 CO 0.08 -0.77 1.43 -1.84 0.21 0.00 0.00 175.17 174.29 2k8q n GLU 12 N -0.56 1.59 0.00 8.23 0.28 -1.26 -3.99 120.64 124.93 2k8q n GLU 12 Ca -0.01 -0.90 0.00 0.00 -0.16 0.00 0.00 57.16 56.09 2k8q n GLU 12 Cb 0.66 -1.31 0.00 0.00 1.43 0.00 0.00 31.44 32.22 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 0.16 1.01 -2.41 3.44 0.28 -1.26 -0.58 120.64 121.28 2k8q n GLU 13 Ca 0.13 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.12 2k8q n GLU 13 Cb 0.25 -0.82 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 -1.89 -0.93 -4.18 -1.84 -1.74 -1.26 -4.45 117.46 101.18 2k8q n PHE 14 Ca 0.00 -0.53 -0.35 0.00 -0.56 0.00 0.00 57.45 56.01 2k8q n PHE 14 Cb 0.32 0.26 -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 -2.38 4.73 -0.33 1.97 -1.09 -0.36 -1.55 121.20 122.20 2k8q s ILE 15 Ca 0.09 -0.16 0.03 0.00 -2.23 0.00 0.00 60.65 58.38 2k8q s ILE 15 Cb -0.01 -3.05 0.10 0.00 -1.58 0.00 0.00 42.46 37.92 2k8q s ILE 15 CO 0.02 0.55 0.05 0.12 -1.23 0.00 0.00 174.94 174.46 2k8q s PHE 16 N -0.99 3.16 -0.25 3.97 5.36 0.15 -2.32 117.98 127.06 2k8q s PHE 16 Ca 0.16 -2.61 -0.12 0.00 -0.96 0.00 0.00 56.93 53.40 2k8q s PHE 16 Cb -0.12 -2.53 -0.05 0.00 -0.34 0.00 0.00 43.02 39.98 2k8q s PHE 16 CO 0.05 -0.92 0.22 -1.17 -1.46 0.00 0.00 175.22 171.94 2k8q s LEU 17 N 1.11 4.08 -0.07 6.12 1.98 0.09 -0.00 118.68 131.99 2k8q s LEU 17 Ca 0.10 0.13 0.00 0.00 -2.89 0.00 0.00 54.13 51.47 2k8q s LEU 17 Cb -0.19 -2.19 -0.03 0.00 0.66 0.00 0.00 46.19 44.45 2k8q s LEU 17 CO -0.12 -0.01 -0.06 -1.59 -1.89 0.00 0.00 176.35 172.67 2k8q s LYS 18 N 1.43 2.79 -0.09 1.98 -2.85 0.85 -0.02 119.74 123.83 2k8q s LYS 18 Ca 0.09 -0.53 0.04 0.00 -1.00 0.00 0.00 55.97 54.57 2k8q s LYS 18 Cb -0.15 -2.62 0.00 0.00 -2.06 0.00 0.00 37.83 33.00 2k8q s LYS 18 CO 0.08 0.66 -0.22 0.42 0.10 0.00 0.00 175.35 176.39 2k8q s ILE 19 N -0.80 1.89 -0.20 3.79 1.09 0.32 -0.51 121.20 126.78 2k8q s ILE 19 Ca 0.12 -0.93 -0.18 0.00 -1.10 0.00 0.00 60.65 58.57 2k8q s ILE 19 Cb -0.11 -1.64 -0.03 0.00 -1.06 0.00 0.00 42.46 39.61 2k8q s ILE 19 CO 0.02 0.52 0.48 -0.36 -0.10 0.00 0.00 174.94 175.50 2k8q s PHE 20 N 0.36 3.37 -0.01 3.97 0.08 -0.36 -1.31 117.98 124.07 2k8q s PHE 20 Ca -0.17 0.73 -0.15 0.00 0.12 0.00 0.00 56.93 57.45 2k8q s PHE 20 Cb -0.17 -2.63 0.02 0.00 -0.57 0.00 0.00 43.02 39.68 2k8q s PHE 20 CO 0.08 -0.07 0.32 0.96 -0.10 0.00 0.00 175.22 176.41 2k8q s ILE 21 N 1.53 0.06 0.43 0.64 -4.36 -1.25 -3.87 121.20 114.38 2k8q s ILE 21 Ca 0.23 -0.49 -0.07 0.00 -0.26 0.00 0.00 60.65 60.06 2k8q s ILE 21 Cb -0.15 -0.67 0.10 0.00 1.25 0.00 0.00 42.46 42.99 2k8q s ILE 21 CO 0.09 -0.27 0.46 -1.20 0.24 0.00 0.00 174.94 174.27 2k8q n SER 22 N 1.16 -0.75 -1.45 4.36 7.64 -1.26 -4.36 113.62 118.96 2k8q n SER 22 Ca -0.21 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 58.72 2k8q n SER 22 Cb 0.56 -0.39 0.22 0.00 -1.01 0.00 0.00 64.21 63.60 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 -3.54 3.83 -3.26 6.43 0.23 -1.26 -4.93 115.26 112.77 2k8q n ASN 23 Ca 0.06 -2.67 -0.22 0.00 -0.53 0.00 0.00 54.58 51.23 2k8q n ASN 23 Cb 0.22 -0.64 0.21 0.00 -2.08 0.00 0.00 39.78 37.50 2k8q n ASN 23 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 2k8q n ILE 24 N 0.19 0.00 -1.52 1.53 -5.35 -1.26 -4.68 119.36 108.28 2k8q n ILE 24 Ca 0.21 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 62.28 2k8q n ILE 24 Cb 0.92 -0.70 -0.07 0.00 -1.74 0.00 0.00 39.64 38.06 2k8q n ILE 24 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 2k8q n ARG 25 N -3.98 0.84 -3.90 6.28 0.00 -1.26 -4.90 116.66 109.74 2k8q n ARG 25 Ca 0.10 0.09 -0.35 0.00 -0.00 0.00 0.00 57.85 57.69 2k8q n ARG 25 Cb 0.42 -2.73 -0.14 0.00 -0.00 0.00 0.00 32.46 30.02 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 10.13 3.33 0.51 2.89 5.36 -1.26 -4.88 117.98 134.05 2k8q s PHE 26 Ca 1.10 -2.00 0.00 0.00 -0.96 0.00 0.00 56.93 55.07 2k8q s PHE 26 Cb -0.61 -2.28 0.02 0.00 -0.34 0.00 0.00 43.02 39.81 2k8q s PHE 26 CO 0.37 -0.83 0.74 -1.12 -1.46 0.00 0.00 175.22 172.92 2k8q s SER 27 N 1.31 5.54 -0.16 6.13 0.01 -1.26 -5.03 113.70 120.25 2k8q s SER 27 Ca -0.03 0.17 0.16 0.00 1.31 0.00 0.00 55.95 57.57 2k8q s SER 27 Cb -0.20 -1.23 0.33 0.00 0.21 0.00 0.00 66.02 65.14 2k8q s SER 27 CO -0.02 -0.94 1.18 0.00 0.41 0.00 0.00 173.24 173.87 2k8q n ALA 28 N -2.24 2.71 -0.09 1.44 0.00 -1.26 -4.61 120.51 116.46 2k8q n ALA 28 Ca 0.05 -2.84 -0.11 0.00 0.00 0.00 0.00 53.44 50.54 2k8q n ALA 28 Cb 0.59 -0.38 -0.15 0.00 0.00 0.00 0.00 19.45 19.51 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 -1.33 1.44 0.25 0.00 0.24 -1.26 -4.39 118.33 113.28 2k8q n VAL 29 Ca 0.17 -0.81 0.12 0.00 -2.04 0.00 0.00 64.34 61.78 2k8q n VAL 29 Cb 0.66 -0.69 0.03 0.00 -1.47 0.00 0.00 33.84 32.37 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 1.81 -1.41 3.50 7.63 0.00 -1.26 -4.81 105.19 110.64 2k8q n GLY 30 Ca -0.33 -0.26 -0.44 0.00 0.00 0.00 0.00 46.02 44.99 2k8q n GLY 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k8q n LEU 31 N -2.47 1.85 -2.69 0.99 4.32 -1.26 -4.52 117.00 113.22 2k8q n LEU 31 Ca 0.01 0.05 -0.05 0.00 -0.02 0.00 0.00 56.01 56.00 2k8q n LEU 31 Cb 0.52 -1.31 0.09 0.00 -1.62 0.00 0.00 43.42 41.09 2k8q n LEU 31 CO 0.39 -1.00 0.54 1.21 -1.22 0.00 0.00 177.39 177.31 2k8q n GLU 32 N 8.55 0.38 -2.07 3.23 2.13 -1.26 -5.03 120.64 126.58 2k8q n GLU 32 Ca 0.45 -1.06 -0.42 0.00 0.66 0.00 0.00 57.16 56.79 2k8q n GLU 32 Cb 0.30 -0.54 -0.03 0.00 0.27 0.00 0.00 31.44 31.45 2k8q n GLU 32 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2k8q s ILE 33 N 0.21 2.88 0.12 6.31 1.01 -1.26 -4.70 121.20 125.77 2k8q s ILE 33 Ca 0.25 0.69 0.08 0.00 0.00 0.00 0.00 60.65 61.67 2k8q s ILE 33 Cb 0.25 -3.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 2k8q s ILE 33 CO -0.14 0.09 -0.20 0.27 0.00 0.00 0.00 174.94 174.95 2k8q s ILE 34 N 0.46 1.71 -0.13 2.92 -5.25 -1.09 -4.96 121.20 114.86 2k8q s ILE 34 Ca 0.62 -1.63 -0.01 0.00 -0.99 0.00 0.00 60.65 58.63 2k8q s ILE 34 Cb -0.40 -1.61 -0.02 0.00 2.95 0.00 0.00 42.46 43.38 2k8q s ILE 34 CO 0.37 -0.14 -0.08 -0.63 -1.79 0.00 0.00 174.94 172.67 2k8q s ILE 35 N -1.41 3.50 0.14 8.37 1.09 -1.26 -0.73 121.20 130.90 2k8q s ILE 35 Ca 0.08 -0.51 -0.02 0.00 -1.10 0.00 0.00 60.65 59.10 2k8q s ILE 35 Cb -0.09 -2.49 0.03 0.00 -1.06 0.00 0.00 42.46 38.86 2k8q s ILE 35 CO 0.05 0.52 0.16 0.00 -0.10 0.00 0.00 174.94 175.57 2k8q n GLN 36 N 3.30 -0.54 -0.24 2.79 1.13 0.11 -4.72 117.38 119.21 2k8q n GLN 36 Ca -0.18 -0.25 0.18 0.00 -1.94 0.00 0.00 57.00 54.81 2k8q n GLN 36 Cb 0.53 -0.19 0.49 0.00 0.11 0.00 0.00 30.24 31.18 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 0.43 0.00 -1.09 4.11 -2.00 -3.39 114.58 112.65 2k8q h GLU 37 Ca -0.05 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.35 2k8q h GLU 37 Cb 0.16 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2k8q h GLU 37 CO 0.04 0.29 -0.02 0.27 0.07 0.00 0.00 179.01 179.65 2k8q n ASN 38 N -4.52 -0.01 -4.63 3.06 6.94 -1.26 -4.17 115.26 110.66 2k8q n ASN 38 Ca 0.19 0.04 -0.29 0.00 -0.02 0.00 0.00 54.58 54.50 2k8q n ASN 38 Cb 0.66 0.03 0.15 0.00 -2.36 0.00 0.00 39.78 38.26 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 0.93 -0.03 -3.83 0.23 -1.26 -2.46 119.30 110.89 2k8q s MET 39 Ca 0.00 0.16 0.07 0.00 -1.03 0.00 0.00 55.69 54.89 2k8q s MET 39 Cb 0.00 -1.83 -0.02 0.00 -1.53 0.00 0.00 34.83 31.45 2k8q s MET 39 CO 0.00 -2.31 -0.25 0.42 -2.03 0.00 0.00 175.02 170.85 2k8q s ILE 40 N -3.35 2.11 -0.24 3.16 1.01 -0.42 0.10 121.20 123.56 2k8q s ILE 40 Ca 0.65 -1.08 -0.06 0.00 0.00 0.00 0.00 60.65 60.17 2k8q s ILE 40 Cb -0.13 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 2k8q s ILE 40 CO 0.53 0.58 0.03 -0.63 0.00 0.00 0.00 174.94 175.45 2k8q s ILE 41 N -0.53 3.95 -0.56 2.92 -1.09 0.09 -1.75 121.20 124.24 2k8q s ILE 41 Ca 0.08 -0.30 -0.17 0.00 -2.23 0.00 0.00 60.65 58.02 2k8q s ILE 41 Cb -0.11 -2.83 0.11 0.00 -1.58 0.00 0.00 42.46 38.05 2k8q s ILE 41 CO -0.00 0.37 0.59 0.12 -1.23 0.00 0.00 174.94 174.79 2k8q s PHE 42 N 1.56 3.13 -0.18 3.97 5.36 0.06 -2.68 117.98 129.21 2k8q s PHE 42 Ca 0.06 -1.12 0.22 0.00 -0.96 0.00 0.00 56.93 55.14 2k8q s PHE 42 Cb -0.15 -3.86 -0.26 0.00 -0.34 0.00 0.00 43.02 38.40 2k8q s PHE 42 CO 0.01 -1.13 0.62 1.58 -1.46 0.00 0.00 175.22 174.84 2k8q n HIS 43 N 5.74 0.13 -1.27 10.12 -0.00 -1.26 -1.38 115.22 127.31 2k8q n HIS 43 Ca -0.12 0.04 -0.36 0.00 0.46 0.00 0.00 57.72 57.74 2k8q n HIS 43 Cb 0.41 -0.50 0.07 0.00 -0.12 0.00 0.00 29.99 29.84 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 -2.22 0.71 -1.20 0.27 0.00 -1.26 -4.71 117.00 108.59 2k8q n LEU 44 Ca -0.02 0.59 0.15 0.00 0.00 0.00 0.00 56.01 56.73 2k8q n LEU 44 Cb 0.54 -1.21 -0.06 0.00 0.00 0.00 0.00 43.42 42.69 2k8q n LEU 44 CO 0.45 -3.15 -0.43 -1.20 0.00 0.00 0.00 177.39 173.05 2k8q n SER 45 N -0.19 -7.00 0.00 1.96 7.64 -1.26 -4.18 113.62 110.59 2k8q n SER 45 Ca 0.10 0.98 0.07 0.00 1.01 0.00 0.00 58.87 61.03 2k8q n SER 45 Cb 0.50 -3.97 0.38 0.00 -1.01 0.00 0.00 64.21 60.11 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 -3.99 0.25 -4.42 1.43 -0.04 -1.26 -4.62 135.00 122.35 2k8q n PRO 46 Ca -0.05 0.12 -0.34 0.00 -0.04 0.00 0.00 63.50 63.20 2k8q n PRO 46 Cb 0.56 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.40 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 -2.49 2.98 -0.15 0.54 2.02 -1.26 -5.10 117.35 113.89 2k8q s TYR 47 Ca 0.15 -0.43 -0.16 0.00 -0.37 0.00 0.00 57.07 56.27 2k8q s TYR 47 Cb 0.10 -1.96 -0.04 0.00 -0.40 0.00 0.00 41.96 39.66 2k8q s TYR 47 CO 0.22 -0.13 0.37 -0.47 -1.57 0.00 0.00 175.55 173.97 2k8q s TYR 48 N 0.50 3.47 0.04 2.71 6.14 -1.25 -4.64 117.35 124.31 2k8q s TYR 48 Ca -0.04 0.70 0.06 0.00 0.64 0.00 0.00 57.07 58.42 2k8q s TYR 48 Cb -0.15 -2.44 -0.02 0.00 0.42 0.00 0.00 41.96 39.78 2k8q s TYR 48 CO 0.03 0.18 -0.16 -1.17 0.64 0.00 0.00 175.55 175.07 2k8q s LEU 49 N 0.62 2.17 -0.09 6.97 2.96 -0.48 -0.03 118.68 130.79 2k8q s LEU 49 Ca 0.20 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 2k8q s LEU 49 Cb -0.14 -0.71 -0.00 0.00 0.50 0.00 0.00 46.19 45.84 2k8q s LEU 49 CO 0.06 0.07 -0.24 -0.60 -1.32 0.00 0.00 176.35 174.32 2k8q s ARG 50 N -1.15 2.96 -0.23 1.98 3.52 -1.26 -0.76 118.95 124.01 2k8q s ARG 50 Ca 0.03 -0.88 0.01 0.00 -0.13 0.00 0.00 55.73 54.75 2k8q s ARG 50 Cb -0.08 -2.28 0.03 0.00 -1.56 0.00 0.00 34.95 31.07 2k8q s ARG 50 CO 0.01 0.22 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.08 2k8q s LEU 51 N 0.25 2.86 -0.39 -0.88 1.43 -0.71 -4.18 118.68 117.06 2k8q s LEU 51 Ca -0.16 -0.92 -0.05 0.00 -1.03 0.00 0.00 54.13 51.96 2k8q s LEU 51 Cb -0.17 -1.57 0.08 0.00 0.03 0.00 0.00 46.19 44.56 2k8q s LEU 51 CO 0.08 -0.09 0.18 -0.60 0.23 0.00 0.00 176.35 176.15 2k8q s ARG 52 N 1.25 2.36 0.25 1.70 3.00 -1.09 -1.31 118.95 125.10 2k8q s ARG 52 Ca -0.00 -1.54 -0.02 0.00 -1.00 0.00 0.00 55.73 53.17 2k8q s ARG 52 Cb -0.16 -3.58 -0.04 0.00 0.00 0.00 0.00 34.95 31.16 2k8q s ARG 52 CO -0.08 -0.92 0.46 -0.06 0.00 0.00 0.00 175.30 174.71 2k8q s PHE 53 N 1.29 3.48 -1.23 5.12 0.08 -1.26 -4.39 117.98 121.07 2k8q s PHE 53 Ca 0.03 0.44 0.15 0.00 0.12 0.00 0.00 56.93 57.67 2k8q s PHE 53 Cb -0.22 -1.94 0.68 0.00 -0.57 0.00 0.00 43.02 40.97 2k8q s PHE 53 CO -0.01 0.28 1.43 -0.35 -0.10 0.00 0.00 175.22 176.48 2k8q n PRO 54 N -0.87 0.11 -2.27 0.24 -0.04 -1.26 -4.76 135.00 126.16 2k8q n PRO 54 Ca -0.04 0.20 -0.06 0.00 -0.04 0.00 0.00 63.50 63.56 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 -1.39 -0.63 -4.19 0.54 8.25 -1.26 -5.14 115.22 111.41 2k8q n HIS 55 Ca 0.05 -0.53 -0.28 0.00 -0.26 0.00 0.00 57.72 56.70 2k8q n HIS 55 Cb 0.14 -0.09 -0.17 0.00 1.12 0.00 0.00 29.99 31.00 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 -2.46 1.96 0.57 -0.41 -1.05 -1.26 -4.58 118.70 111.47 2k8q s GLU 56 Ca 0.04 -0.45 0.09 0.00 -0.15 0.00 0.00 54.97 54.50 2k8q s GLU 56 Cb -0.00 -1.79 0.08 0.00 -0.44 0.00 0.00 34.13 31.98 2k8q s GLU 56 CO 0.02 -0.16 0.79 -0.51 0.95 0.00 0.00 175.26 176.36 2k8q s LEU 57 N 1.30 3.14 0.00 1.83 1.43 -1.03 -3.81 118.68 121.54 2k8q s LEU 57 Ca -0.01 -0.78 0.02 0.00 -1.03 0.00 0.00 54.13 52.33 2k8q s LEU 57 Cb -0.14 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.34 2k8q s LEU 57 CO -0.05 -1.34 -0.06 -0.51 0.23 0.00 0.00 176.35 174.62 2k8q s ILE 58 N -2.68 0.45 -0.59 -0.59 2.07 -0.89 -4.35 121.20 114.61 2k8q s ILE 58 Ca 0.62 -0.32 -0.16 0.00 -1.41 0.00 0.00 60.65 59.38 2k8q s ILE 58 Cb -0.06 -0.40 0.14 0.00 0.13 0.00 0.00 42.46 42.28 2k8q s ILE 58 CO 0.39 0.08 0.56 -0.62 -1.91 0.00 0.00 174.94 173.43 2k8q s ASP 59 N -0.27 6.28 0.00 4.50 2.15 -1.26 -3.87 116.67 124.21 2k8q s ASP 59 Ca 0.01 -1.92 0.00 0.00 0.43 0.00 0.00 52.55 51.07 2k8q s ASP 59 Cb -0.03 -2.22 0.00 0.00 -0.30 0.00 0.00 42.92 40.38 2k8q s ASP 59 CO -0.00 -0.83 0.00 0.47 -0.17 0.00 0.00 175.17 174.64 2k8q n ASP 60 N 5.10 0.71 0.23 -0.34 9.92 -1.26 -4.98 116.55 125.94 2k8q n ASP 60 Ca -0.09 -0.95 0.09 0.00 -0.53 0.00 0.00 54.79 53.31 2k8q n ASP 60 Cb 0.41 0.00 0.55 0.00 -0.64 0.00 0.00 41.12 41.44 2k8q n ASP 60 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 2k8q h GLU 61 N 0.00 0.00 -0.17 -1.24 4.11 -2.04 -2.66 114.58 112.58 2k8q h GLU 61 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.29 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 0.22 -0.49 0.07 0.07 0.00 0.00 179.01 178.88 2k8q h ARG 62 N 0.00 0.46 -6.40 1.06 0.11 -1.98 -3.44 114.38 104.19 2k8q h ARG 62 Ca -0.00 -0.27 -0.63 0.00 0.10 0.00 0.00 59.98 59.18 2k8q h ARG 62 Cb 0.54 0.02 0.07 0.00 1.11 0.00 0.00 29.97 31.71 2k8q h ARG 62 CO 0.03 0.85 0.51 0.45 0.10 0.00 0.00 179.97 181.92 2k8q n SER 63 N -3.97 2.10 -3.59 0.08 2.88 -1.00 -4.93 113.62 105.18 2k8q n SER 63 Ca -0.02 1.12 0.02 0.00 -1.33 0.00 0.00 58.87 58.65 2k8q n SER 63 Cb 0.56 -1.30 -0.01 0.00 -0.75 0.00 0.00 64.21 62.72 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 0.30 0.00 0.01 2.46 -1.32 -1.09 -4.92 115.64 111.08 2k8q s THR 64 Ca 0.77 -0.00 0.05 0.00 -1.21 0.00 0.00 61.69 61.30 2k8q s THR 64 Cb -0.81 -1.63 -0.02 0.00 -1.51 0.00 0.00 72.50 68.54 2k8q s THR 64 CO 0.47 0.00 -0.15 0.00 -2.21 0.00 0.00 174.62 172.72 2k8q s ALA 65 N -2.01 1.29 -0.07 11.08 0.00 -1.26 -1.12 121.76 129.68 2k8q s ALA 65 Ca 0.14 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.38 2k8q s ALA 65 Cb 0.05 -0.27 -0.00 0.00 0.00 0.00 0.00 23.12 22.89 2k8q s ALA 65 CO -0.05 0.29 -0.23 -0.65 0.00 0.00 0.00 175.76 175.12 2k8q s GLN 66 N -0.76 2.51 -0.12 0.00 -0.21 0.87 -4.97 119.66 116.99 2k8q s GLN 66 Ca 0.05 -0.82 -0.23 0.00 0.02 0.00 0.00 55.36 54.38 2k8q s GLN 66 Cb -0.07 -2.05 -0.03 0.00 1.00 0.00 0.00 33.01 31.86 2k8q s GLN 66 CO 0.00 0.28 0.71 -0.47 -2.12 0.00 0.00 175.29 173.70 2k8q s TYR 67 N 0.06 3.49 -0.28 0.91 5.04 -1.26 -0.99 117.35 124.32 2k8q s TYR 67 Ca -0.09 1.17 -0.09 0.00 -2.44 0.00 0.00 57.07 55.62 2k8q s TYR 67 Cb -0.15 -2.85 -0.02 0.00 0.35 0.00 0.00 41.96 39.29 2k8q s TYR 67 CO 0.05 -0.06 0.12 -0.51 -1.34 0.00 0.00 175.55 173.81 2k8q s ASP 68 N 0.98 5.41 0.02 4.32 1.01 0.63 -4.96 116.67 124.09 2k8q s ASP 68 Ca 0.35 -0.30 0.06 0.00 0.71 0.00 0.00 52.55 53.37 2k8q s ASP 68 Cb -0.17 -1.98 -0.24 0.00 1.01 0.00 0.00 42.92 41.54 2k8q s ASP 68 CO 0.15 -0.10 0.91 0.28 0.21 0.00 0.00 175.17 176.61 2k8q h SER 69 N 8.30 0.11 -0.76 0.27 0.02 -1.93 0.29 113.55 119.85 2k8q h SER 69 Ca -0.35 -0.17 0.18 0.00 -0.84 0.00 0.00 61.79 60.61 2k8q h SER 69 Cb 1.17 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.62 2k8q h SER 69 CO 0.59 1.14 0.52 0.07 -1.14 0.00 0.00 176.83 178.01 2k8q h LYS 70 N 0.02 0.25 0.00 3.45 5.09 -1.95 -2.51 116.57 120.92 2k8q h LYS 70 Ca -0.19 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.54 2k8q h LYS 70 Cb 1.94 -0.06 0.00 0.00 0.10 0.00 0.00 32.23 34.21 2k8q h LYS 70 CO 0.12 0.16 0.00 -3.47 -2.09 0.00 0.00 179.45 174.17 2k8q n ASP 71 N -4.43 0.64 -2.10 7.07 2.03 -1.25 -5.00 116.55 113.51 2k8q n ASP 71 Ca 0.15 -0.92 -0.21 0.00 0.52 0.00 0.00 54.79 54.34 2k8q n ASP 71 Cb 0.66 0.10 -0.04 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 -0.10 -1.58 -4.13 -0.67 1.02 0.89 -4.81 120.64 111.26 2k8q n GLU 72 Ca 0.00 1.08 -0.22 0.00 -0.02 0.00 0.00 57.16 58.00 2k8q n GLU 72 Cb 0.06 -5.64 -0.05 0.00 -0.02 0.00 0.00 31.44 25.78 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 -2.24 3.70 -0.20 0.00 -1.09 -0.43 -0.26 121.20 120.68 2k8q s ILE 74 Ca 0.34 -0.44 -0.04 0.00 -2.23 0.00 0.00 60.65 58.27 2k8q s ILE 74 Cb -0.07 -2.58 -0.02 0.00 -1.58 0.00 0.00 42.46 38.22 2k8q s ILE 74 CO 0.23 0.54 -0.03 0.20 -1.23 0.00 0.00 174.94 174.65 2k8q s ASN 75 N -0.05 4.56 -0.16 3.58 0.01 -0.16 -0.52 114.94 122.20 2k8q s ASN 75 Ca 0.00 -0.28 0.00 0.00 -0.71 0.00 0.00 52.86 51.87 2k8q s ASN 75 Cb -0.13 -1.77 -0.00 0.00 0.41 0.00 0.00 41.25 39.75 2k8q s ASN 75 CO 0.03 0.04 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.82 2k8q s VAL 76 N 1.11 2.65 -0.05 1.60 1.01 0.97 -0.09 120.40 127.60 2k8q s VAL 76 Ca 0.02 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.25 2k8q s VAL 76 Cb -0.15 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 2k8q s VAL 76 CO 0.00 0.51 -0.09 -1.59 0.00 0.00 0.00 175.10 173.94 2k8q s LYS 77 N 0.88 2.65 -0.11 2.72 0.00 -0.27 -0.73 119.74 124.87 2k8q s LYS 77 Ca -0.04 -0.62 -0.06 0.00 0.00 0.00 0.00 55.97 55.25 2k8q s LYS 77 Cb -0.15 -2.52 0.05 0.00 0.00 0.00 0.00 37.83 35.21 2k8q s LYS 77 CO -0.01 0.64 0.27 0.54 0.00 0.00 0.00 175.35 176.79 2k8q s VAL 78 N -0.82 -0.04 0.37 1.79 0.11 -0.98 -2.68 120.40 118.17 2k8q s VAL 78 Ca 0.13 0.13 -0.25 0.00 -2.93 0.00 0.00 61.98 59.06 2k8q s VAL 78 Cb -0.11 -0.41 -0.09 0.00 -1.53 0.00 0.00 36.38 34.24 2k8q s VAL 78 CO 0.02 0.05 1.05 0.00 -3.33 0.00 0.00 175.10 172.90 2k8q s ALA 79 N 1.20 3.15 0.01 1.54 0.00 -1.25 -1.22 121.76 125.18 2k8q s ALA 79 Ca -0.09 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 52.58 2k8q s ALA 79 Cb -0.09 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 2k8q s ALA 79 CO -0.09 -0.19 0.18 0.21 0.00 0.00 0.00 175.76 175.88 2k8q s LYS 80 N -2.29 3.41 0.52 0.00 2.36 -1.26 -2.10 119.74 120.38 2k8q s LYS 80 Ca 0.55 -0.36 0.29 0.00 -2.55 0.00 0.00 55.97 53.89 2k8q s LYS 80 Cb -0.24 -3.07 1.42 0.00 -1.05 0.00 0.00 37.83 34.89 2k8q s LYS 80 CO 0.30 0.66 1.91 -0.07 1.55 0.00 0.00 175.35 179.70 2k8q h LEU 81 N 3.65 0.05 -8.00 5.43 3.38 -1.87 -3.40 115.31 114.55 2k8q h LEU 81 Ca -0.48 0.01 -0.43 0.00 0.09 0.00 0.00 57.88 57.06 2k8q h LEU 81 Cb 1.18 -0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.62 2k8q h LEU 81 CO 0.70 0.02 -0.79 0.20 0.09 0.00 0.00 178.44 178.66 2k8q s ASN 82 N -5.77 1.26 0.71 -0.43 0.01 -1.26 -5.10 114.94 104.36 2k8q s ASN 82 Ca -0.05 -0.20 -0.11 0.00 -0.71 0.00 0.00 52.86 51.79 2k8q s ASN 82 Cb 0.21 -0.31 0.02 0.00 0.41 0.00 0.00 41.25 41.58 2k8q s ASN 82 CO 0.76 0.08 1.07 -0.75 -1.51 0.00 0.00 177.10 176.75 2k8q s LYS 83 N 0.13 2.79 -1.99 -0.60 2.20 -1.26 -3.58 119.74 117.43 2k8q s LYS 83 Ca -0.02 0.76 0.00 0.00 -0.36 0.00 0.00 55.97 56.35 2k8q s LYS 83 Cb -0.08 -1.99 0.00 0.00 -1.51 0.00 0.00 37.83 34.25 2k8q s LYS 83 CO 0.00 -1.15 0.00 0.09 -0.36 0.00 0.00 175.35 173.93 2k8q n ASN 84 N -3.14 -5.43 -4.84 1.43 5.03 0.25 -4.96 115.26 103.60 2k8q n ASN 84 Ca 0.07 0.46 -0.38 0.00 0.87 0.00 0.00 54.58 55.61 2k8q n ASN 84 Cb 0.55 -4.59 -0.06 0.00 -1.02 0.00 0.00 39.78 34.66 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 -3.58 3.83 0.28 3.52 2.12 -1.23 -4.91 118.70 118.73 2k8q s GLU 85 Ca 0.00 0.32 0.00 0.00 0.36 0.00 0.00 54.97 55.65 2k8q s GLU 85 Cb 0.00 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.18 2k8q s GLU 85 CO 0.00 0.70 0.03 2.48 -0.54 0.00 0.00 175.26 177.94 2k8q n TYR 86 N 1.83 0.40 -4.14 5.30 4.11 -1.26 -4.52 117.16 118.87 2k8q n TYR 86 Ca -0.15 -1.36 -0.12 0.00 -0.00 0.00 0.00 57.90 56.27 2k8q n TYR 86 Cb 0.53 -0.19 -0.11 0.00 -0.00 0.00 0.00 39.34 39.57 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 -1.93 0.88 0.00 -3.48 0.40 -1.26 -5.04 117.98 107.56 2k8q s PHE 87 Ca 0.02 -0.73 0.00 0.00 -0.60 0.00 0.00 56.93 55.62 2k8q s PHE 87 Cb -0.00 -0.50 0.00 0.00 0.51 0.00 0.00 43.02 43.03 2k8q s PHE 87 CO 0.02 -0.09 0.90 0.39 0.70 0.00 0.00 175.22 177.14 2k8q n GLU 88 N 0.52 2.37 -0.00 0.44 1.02 -1.26 -4.63 120.64 119.11 2k8q n GLU 88 Ca -0.16 -1.30 0.01 0.00 -0.02 0.00 0.00 57.16 55.68 2k8q n GLU 88 Cb 0.58 -0.93 -0.01 0.00 -0.02 0.00 0.00 31.44 31.06 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 -0.40 2.10 0.16 1.62 9.92 -1.26 -4.58 116.55 124.10 2k8q n ASP 89 Ca 0.00 -0.30 0.12 0.00 -0.53 0.00 0.00 54.79 54.08 2k8q n ASP 89 Cb 0.27 1.04 0.57 0.00 -0.64 0.00 0.00 41.12 42.36 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 -0.33 0.64 4.07 -1.94 -1.24 115.31 116.52 2k8q h LEU 90 Ca 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.87 2k8q h LEU 90 Cb 0.06 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.79 2k8q h LEU 90 CO 0.00 0.00 -0.45 0.44 -1.08 0.00 0.00 178.44 177.35 2k8q h ASP 91 N 0.00 0.00 -3.51 -0.43 5.19 -1.90 -3.41 116.42 112.37 2k8q h ASP 91 Ca 0.00 0.00 -0.67 0.00 -0.62 0.00 0.00 57.03 55.74 2k8q h ASP 91 Cb 0.16 0.00 -0.28 0.00 0.18 0.00 0.00 39.33 39.40 2k8q h ASP 91 CO 0.00 0.45 -0.69 -0.76 -3.12 0.00 0.00 179.24 175.12 2k8q s LEU 92 N -6.63 3.31 0.21 1.55 2.01 -0.47 -4.99 118.68 113.67 2k8q s LEU 92 Ca 0.03 -0.57 -0.03 0.00 0.01 0.00 0.00 54.13 53.57 2k8q s LEU 92 Cb 0.09 -1.79 0.16 0.00 0.01 0.00 0.00 46.19 44.66 2k8q s LEU 92 CO 0.72 -0.10 1.56 1.55 1.01 0.00 0.00 176.35 181.10 2k8q h PRO 93 N 8.14 0.62 -0.35 1.29 0.13 -1.82 -3.10 132.00 136.90 2k8q h PRO 93 Ca -0.36 -0.33 -0.08 0.00 -0.87 0.00 0.00 66.00 64.36 2k8q h PRO 93 Cb 1.14 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 2k8q h PRO 93 CO 0.59 0.93 -0.10 1.79 -0.23 0.00 0.00 178.00 180.98 2k8q h THR 94 N 0.51 1.24 0.00 1.56 1.35 -1.94 -2.15 112.91 113.48 2k8q h THR 94 Ca 0.04 -1.05 -0.00 0.00 -0.55 0.00 0.00 66.41 64.85 2k8q h THR 94 Cb 0.94 1.08 -0.00 0.00 -1.73 0.00 0.00 68.15 68.44 2k8q h THR 94 CO 0.08 0.35 -0.00 0.11 -0.25 0.00 0.00 175.52 175.82 2k8q h LYS 95 N 0.56 0.00 0.10 4.72 6.56 -1.86 -2.19 116.57 124.46 2k8q h LYS 95 Ca 0.10 0.00 -0.28 0.00 -1.06 0.00 0.00 60.65 59.41 2k8q h LYS 95 Cb 0.51 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.16 2k8q h LYS 95 CO 0.03 0.00 -1.49 -0.07 -2.06 0.00 0.00 179.45 175.86 2k8q h LEU 96 N 0.00 0.33 -2.40 2.94 3.38 -1.48 -3.34 115.31 114.74 2k8q h LEU 96 Ca -0.00 -0.82 -0.00 0.00 0.09 0.00 0.00 57.88 57.15 2k8q h LEU 96 Cb 0.03 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2k8q h LEU 96 CO 0.00 1.64 -0.01 -0.07 0.09 0.00 0.00 178.44 180.09 2k8q h LEU 97 N -0.34 0.00 -1.52 1.67 -0.00 -1.20 -2.90 115.31 111.02 2k8q h LEU 97 Ca -0.33 0.00 -0.28 0.00 -0.00 0.00 0.00 57.88 57.26 2k8q h LEU 97 Cb 1.74 0.00 0.13 0.00 -0.00 0.00 0.00 40.66 42.53 2k8q h LEU 97 CO 0.02 0.01 -0.61 0.00 -0.00 0.00 0.00 178.44 177.86 2k8q n ALA 98 N -2.34 -1.52 -0.16 1.53 0.00 -0.88 -4.89 120.51 112.25 2k8q n ALA 98 Ca -0.03 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.57 2k8q n ALA 98 Cb 0.09 -2.68 0.45 0.00 0.00 0.00 0.00 19.45 17.32 2k8q n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k8q h ARG 99 N -1.72 0.51 -0.18 0.00 -0.00 -1.90 -2.30 114.38 108.79 2k8q h ARG 99 Ca -0.48 -0.03 0.05 0.00 -0.50 0.00 0.00 59.98 59.02 2k8q h ARG 99 Cb 1.28 -0.12 -0.06 0.00 0.00 0.00 0.00 29.97 31.07 2k8q h ARG 99 CO 0.42 0.34 -0.27 0.37 0.00 0.00 0.00 179.97 180.83 2k8q h GLN 100 N 0.53 -0.31 0.00 0.04 5.75 -1.90 -3.46 115.11 115.76 2k8q h GLN 100 Ca 0.34 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.86 2k8q h GLN 100 Cb 0.61 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.23 2k8q h GLN 100 CO -0.12 -0.20 0.00 0.41 -2.65 0.00 0.00 178.83 176.27 2k8q n GLY 101 N -1.39 2.25 3.16 2.39 0.00 -0.87 -5.12 105.19 105.61 2k8q n GLY 101 Ca -0.02 0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 2k8q n GLY 101 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k8q s ASP 102 N 0.00 5.08 -0.38 1.61 -4.77 -1.26 -4.95 116.67 112.01 2k8q s ASP 102 Ca 0.00 -1.59 0.07 0.00 -3.30 0.00 0.00 52.55 47.73 2k8q s ASP 102 Cb 0.00 -1.77 0.71 0.00 -1.09 0.00 0.00 42.92 40.76 2k8q s ASP 102 CO 0.00 -0.39 1.86 0.18 0.70 0.00 0.00 175.17 177.52 2k8q n LEU 103 N 4.62 6.39 0.27 2.11 4.77 -1.26 -4.44 117.00 129.46 2k8q n LEU 103 Ca -0.08 -3.37 0.15 0.00 -0.03 0.00 0.00 56.01 52.68 2k8q n LEU 103 Cb 0.43 -0.79 0.72 0.00 -2.33 0.00 0.00 43.42 41.44 2k8q n LEU 103 CO 0.29 0.91 0.97 0.00 -1.33 0.00 0.00 177.39 178.24 2k8q h ALA 104 N 1.93 1.07 -3.17 -1.18 0.00 -2.05 -3.49 119.26 112.39 2k8q h ALA 104 Ca 0.44 -0.07 0.36 0.00 0.00 0.00 0.00 54.91 55.63 2k8q h ALA 104 Cb 2.58 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 20.23 2k8q h ALA 104 CO 0.91 0.10 -0.75 0.41 0.00 0.00 0.00 179.25 179.92 2k8q n GLY 105 N -0.26 -2.39 3.00 0.00 0.00 -1.26 -4.76 105.19 99.51 2k8q n GLY 105 Ca -0.01 -1.14 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.89 2.82 -0.65 4.61 0.00 -1.26 -4.93 121.76 119.46 2k8q s ALA 106 Ca 0.00 -2.50 0.16 0.00 0.00 0.00 0.00 51.96 49.62 2k8q s ALA 106 Cb 0.00 -1.95 0.60 0.00 0.00 0.00 0.00 23.12 21.77 2k8q s ALA 106 CO 0.00 -1.70 1.52 -3.47 0.00 0.00 0.00 175.76 172.11 2k8q n ASP 107 N 4.26 4.31 -3.81 0.00 2.03 -1.26 -4.91 116.55 117.16 2k8q n ASP 107 Ca 0.04 -2.63 -0.18 0.00 0.52 0.00 0.00 54.79 52.54 2k8q n ASP 107 Cb 0.42 -0.52 -0.16 0.00 -0.72 0.00 0.00 41.12 40.13 2k8q n ASP 107 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k8q s ALA 108 N -2.16 0.36 0.01 -1.67 0.00 -1.26 -5.15 121.76 111.89 2k8q s ALA 108 Ca 0.44 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.55 2k8q s ALA 108 Cb 0.31 -0.37 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 2k8q s ALA 108 CO 0.17 -0.12 -0.05 -0.51 0.00 0.00 0.00 175.76 175.25 2k8q s LEU 109 N 1.14 2.06 -0.19 0.00 1.43 -1.26 -5.14 118.68 116.72 2k8q s LEU 109 Ca -0.08 -0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 2k8q s LEU 109 Cb -0.13 -0.21 0.09 0.00 0.03 0.00 0.00 46.19 45.97 2k8q s LEU 109 CO -0.02 -0.00 0.32 0.42 0.23 0.00 0.00 176.35 177.30 2k8q s THR 110 N -0.37 -0.50 -0.28 5.49 -4.23 -1.26 -5.12 115.64 109.38 2k8q s THR 110 Ca -0.01 0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 60.57 2k8q s THR 110 Cb -0.03 -0.63 0.09 0.00 1.34 0.00 0.00 72.50 73.27 2k8q s THR 110 CO -0.00 -0.02 0.09 -0.70 -0.54 0.00 0.00 174.62 173.45 2k8q s GLU 111 N 2.47 0.63 0.03 3.99 -6.30 -1.26 -5.12 118.70 113.14 2k8q s GLU 111 Ca 0.05 -0.85 0.05 0.00 -2.50 0.00 0.00 54.97 51.72 2k8q s GLU 111 Cb -0.14 -1.88 -0.02 0.00 0.00 0.00 0.00 34.13 32.09 2k8q s GLU 111 CO -0.12 -0.92 -0.14 -0.80 0.02 0.00 0.00 175.26 173.30 2k8q s ASN 112 N 1.74 1.65 -0.26 -1.70 -0.87 -1.26 -5.13 114.94 109.11 2k8q s ASN 112 Ca 0.07 -0.40 -0.11 0.00 -1.57 0.00 0.00 52.86 50.85 2k8q s ASN 112 Cb -0.17 -0.12 -0.05 0.00 -0.02 0.00 0.00 41.25 40.89 2k8q s ASN 112 CO -0.23 0.07 0.19 0.42 -2.57 0.00 0.00 177.10 174.98 2k8q s THR 113 N -0.71 5.32 -0.24 1.60 -4.23 -1.26 -5.05 115.64 111.07 2k8q s THR 113 Ca 0.03 0.21 -0.03 0.00 -1.18 0.00 0.00 61.69 60.72 2k8q s THR 113 Cb -0.07 -3.53 0.12 0.00 1.34 0.00 0.00 72.50 70.36 2k8q s THR 113 CO 0.01 0.28 0.32 -1.81 -0.54 0.00 0.00 174.62 172.88 2k8q s ASP 114 N 1.47 0.83 -0.18 3.99 1.11 -1.26 -5.12 116.67 117.50 2k8q s ASP 114 Ca 0.08 -0.10 -0.05 0.00 0.18 0.00 0.00 52.55 52.66 2k8q s ASP 114 Cb -0.15 0.79 0.09 0.00 1.07 0.00 0.00 42.92 44.71 2k8q s ASP 114 CO 0.08 -0.32 0.34 0.00 1.18 0.00 0.00 175.17 176.45 2k8q s ALA 115 N 2.45 -0.85 0.53 5.23 0.00 -1.26 -4.96 121.76 122.89 2k8q s ALA 115 Ca 0.10 1.09 0.09 0.00 0.00 0.00 0.00 51.96 53.24 2k8q s ALA 115 Cb -0.15 -1.27 0.06 0.00 0.00 0.00 0.00 23.12 21.76 2k8q s ALA 115 CO -0.18 -0.84 0.68 0.15 0.00 0.00 0.00 175.76 175.58 2k8q s LYS 116 N 2.51 2.42 0.27 0.00 -0.14 -1.26 -5.14 119.74 118.40 2k8q s LYS 116 Ca 0.03 -1.59 -0.14 0.00 -1.36 0.00 0.00 55.97 52.90 2k8q s LYS 116 Cb -0.13 -2.60 0.01 0.00 -1.68 0.00 0.00 37.83 33.43 2k8q s LYS 116 CO -0.12 -0.68 0.56 -1.59 -0.76 0.00 0.00 175.35 172.77 2k8q s LYS 117 N -4.53 1.69 -0.13 1.68 -2.85 -1.26 -5.18 119.74 109.16 2k8q s LYS 117 Ca 0.57 -1.25 -0.16 0.00 -1.00 0.00 0.00 55.97 54.12 2k8q s LYS 117 Cb -0.06 0.51 0.04 0.00 -2.06 0.00 0.00 37.83 36.26 2k8q s LYS 117 CO 0.35 -0.73 0.43 -0.08 0.10 0.00 0.00 175.35 175.43 2k8q s THR 118 N -3.77 0.01 0.22 3.79 -1.32 -1.26 -5.18 115.64 108.14 2k8q s THR 118 Ca 0.20 -0.10 0.01 0.00 -1.21 0.00 0.00 61.69 60.58 2k8q s THR 118 Cb -0.02 -0.65 -0.05 0.00 -1.51 0.00 0.00 72.50 70.27 2k8q s THR 118 CO 0.10 -0.06 0.09 0.00 -2.21 0.00 0.00 174.62 172.54 2k8q s GLN 119 N -0.21 1.28 -0.71 7.08 -2.07 -1.26 -4.96 119.66 118.82 2k8q s GLN 119 Ca -0.04 -1.68 -0.04 0.00 -1.82 0.00 0.00 55.36 51.79 2k8q s GLN 119 Cb -0.03 -0.08 0.01 0.00 -1.09 0.00 0.00 33.01 31.81 2k8q s GLN 119 CO 0.02 -0.30 0.66 1.63 -1.32 0.00 0.00 175.29 175.99 2k8q n LYS 120 N -0.36 -1.53 -1.03 9.60 5.02 -1.26 -4.99 118.16 123.62 2k8q n LYS 120 Ca -0.01 1.39 -0.30 0.00 -2.02 0.00 0.00 58.31 57.37 2k8q n LYS 120 Cb 0.66 -4.72 0.25 0.00 -0.02 0.00 0.00 35.03 31.19 2k8q n LYS 120 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2k8q n PRO 121 N -1.74 -3.13 -0.78 1.97 -0.04 -1.26 -4.98 135.00 125.04 2k8q n PRO 121 Ca -0.07 -1.73 -0.04 0.00 -0.04 0.00 0.00 63.50 61.63 2k8q n PRO 121 Cb 0.55 -1.62 0.21 0.00 -0.04 0.00 0.00 33.50 32.61 2k8q n PRO 121 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2k8q n LEU 122 N 0.00 4.45 -4.56 1.53 4.77 -1.26 -4.96 117.00 116.96 2k8q n LEU 122 Ca 0.15 -3.57 -0.41 0.00 -0.03 0.00 0.00 56.01 52.15 2k8q n LEU 122 Cb 0.58 -0.64 -0.08 0.00 -2.33 0.00 0.00 43.42 40.95 2k8q n LEU 122 CO 0.40 1.09 0.17 -0.63 -1.33 0.00 0.00 177.39 177.10 2k8q s ILE 123 N -3.15 5.06 -0.24 -0.08 1.01 -1.26 -5.05 121.20 117.49 2k8q s ILE 123 Ca 0.46 0.34 -0.03 0.00 0.00 0.00 0.00 60.65 61.42 2k8q s ILE 123 Cb 0.40 -3.90 0.01 0.00 0.01 0.00 0.00 42.46 38.98 2k8q s ILE 123 CO 0.04 -0.13 -0.04 -1.58 0.00 0.00 0.00 174.94 173.22 2k8q s GLN 124 N 2.28 3.14 -0.05 2.79 2.00 -1.26 -5.09 119.66 123.47 2k8q s GLN 124 Ca 0.17 -0.79 -0.00 0.00 -2.00 0.00 0.00 55.36 52.74 2k8q s GLN 124 Cb -0.16 -3.04 0.03 0.00 0.80 0.00 0.00 33.01 30.64 2k8q s GLN 124 CO 0.12 -0.30 -0.01 -2.00 -0.50 0.00 0.00 175.29 172.60 2k8q s GLU 125 N 1.42 0.60 0.26 1.67 2.12 -1.26 -5.12 118.70 118.39 2k8q s GLU 125 Ca 0.03 0.04 -0.30 0.00 0.36 0.00 0.00 54.97 55.10 2k8q s GLU 125 Cb -0.15 -0.81 -0.11 0.00 0.26 0.00 0.00 34.13 33.31 2k8q s GLU 125 CO -0.03 -0.20 1.56 0.08 -0.54 0.00 0.00 175.26 176.13 2k8q s VAL 126 N 1.43 2.27 0.11 3.70 1.01 -1.26 -4.97 120.40 122.69 2k8q s VAL 126 Ca -0.03 0.22 -0.27 0.00 0.00 0.00 0.00 61.98 61.89 2k8q s VAL 126 Cb -0.13 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.04 2k8q s VAL 126 CO -0.03 0.03 0.86 -0.70 0.00 0.00 0.00 175.10 175.26 2k8q s GLU 127 N -0.16 4.62 -0.21 2.72 2.12 -1.26 -5.05 118.70 121.49 2k8q s GLU 127 Ca 0.64 1.27 -0.04 0.00 0.36 0.00 0.00 54.97 57.20 2k8q s GLU 127 Cb -0.46 -3.34 0.07 0.00 0.26 0.00 0.00 34.13 30.65 2k8q s GLU 127 CO 0.44 0.32 0.07 0.95 -0.54 0.00 0.00 175.26 176.50 2k8q s THR 128 N -0.31 0.28 -0.25 -1.70 -4.23 -1.26 -5.10 115.64 103.07 2k8q s THR 128 Ca 0.42 -0.52 -0.34 0.00 -1.18 0.00 0.00 61.69 60.07 2k8q s THR 128 Cb -0.23 -0.92 -0.11 0.00 1.34 0.00 0.00 72.50 72.58 2k8q s THR 128 CO 0.27 -0.33 2.07 0.47 -0.54 0.00 0.00 174.62 176.56 2k8q n ASP 129 N 5.13 2.73 0.09 3.99 8.00 -1.26 -4.84 116.55 130.40 2k8q n ASP 129 Ca -0.07 0.59 -0.06 0.00 0.71 0.00 0.00 54.79 55.96 2k8q n ASP 129 Cb 0.47 -1.33 0.08 0.00 -0.02 0.00 0.00 41.12 40.31 2k8q n ASP 129 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2k8q h GLY 130 N 11.51 0.24 -6.83 0.44 0.00 -2.05 -3.42 103.07 102.97 2k8q h GLY 130 Ca -0.37 -0.33 -0.63 0.00 0.00 0.00 0.00 47.33 46.00 2k8q h GLY 130 CO 0.98 0.30 0.10 0.14 0.00 0.00 0.00 176.54 178.07 2k8q s VAL 131 N -3.57 4.94 0.27 4.60 1.01 -1.26 -5.03 120.40 121.36 2k8q s VAL 131 Ca -0.03 0.70 -0.30 0.00 0.00 0.00 0.00 61.98 62.34 2k8q s VAL 131 Cb 0.11 -4.00 -0.10 0.00 0.00 0.00 0.00 36.38 32.39 2k8q s VAL 131 CO 0.81 -0.19 1.48 -0.44 0.00 0.00 0.00 175.10 176.76 2k8q s SER 132 N 1.70 6.56 0.33 3.32 0.01 -1.26 -4.91 113.70 119.46 2k8q s SER 132 Ca 0.24 2.77 0.10 0.00 1.31 0.00 0.00 55.95 60.36 2k8q s SER 132 Cb -0.15 -2.63 0.59 0.00 0.21 0.00 0.00 66.02 64.04 2k8q s SER 132 CO 0.13 -0.76 1.77 -1.13 0.41 0.00 0.00 173.24 173.65 2k8q h ASN 133 N 4.83 0.13 0.00 2.44 -0.73 -1.96 -3.55 115.58 116.75 2k8q h ASN 133 Ca -0.47 -0.05 0.00 0.00 1.87 0.00 0.00 56.30 57.65 2k8q h ASN 133 Cb 1.22 -0.04 0.00 0.00 0.27 0.00 0.00 38.32 39.77 2k8q h ASN 133 CO 0.77 0.50 0.00 0.59 -0.37 0.00 0.00 177.43 178.92