#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 -0.06 0.00 -0.61 1.01 0.10 -4.95 121.20 116.69 2k8q s ILE 2 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2k8q s ILE 2 Cb 0.00 -0.30 0.00 0.00 0.01 0.00 0.00 42.46 42.17 2k8q s ILE 2 CO 0.00 0.06 0.00 1.07 0.00 0.00 0.00 174.94 176.07 2k8q n THR 3 N 5.28 0.00 -0.00 2.92 5.66 -1.26 -4.14 114.28 122.74 2k8q n THR 3 Ca -0.04 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.83 2k8q n THR 3 Cb 0.50 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.18 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 -0.03 -2.23 1.09 0.13 -1.85 -3.44 132.00 125.67 2k8q h PRO 4 Ca 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.06 2k8q h PRO 4 Cb 0.00 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 30.93 2k8q h PRO 4 CO 0.00 0.45 0.05 1.03 -0.23 0.00 0.00 178.00 179.30 2k8q s ARG 5 N -4.23 0.84 -0.28 0.86 3.00 -1.26 -4.87 118.95 113.02 2k8q s ARG 5 Ca -0.16 0.54 -0.19 0.00 0.00 0.00 0.00 55.73 55.93 2k8q s ARG 5 Cb 0.02 0.40 0.08 0.00 0.00 0.00 0.00 34.95 35.45 2k8q s ARG 5 CO 0.66 -0.18 0.73 -0.59 0.00 0.00 0.00 175.30 175.92 2k8q s PHE 6 N -0.39 -0.93 -0.03 -0.53 -0.71 -1.26 -0.97 117.98 113.17 2k8q s PHE 6 Ca -0.05 1.97 0.06 0.00 -1.04 0.00 0.00 56.93 57.86 2k8q s PHE 6 Cb -0.03 0.50 -0.01 0.00 -1.21 0.00 0.00 43.02 42.27 2k8q s PHE 6 CO 0.04 -0.46 -0.20 -1.12 -1.34 0.00 0.00 175.22 172.15 2k8q s SER 7 N 1.21 2.38 -0.01 1.98 0.01 0.38 -4.98 113.70 114.67 2k8q s SER 7 Ca -0.07 -0.38 0.03 0.00 1.31 0.00 0.00 55.95 56.85 2k8q s SER 7 Cb -0.05 -0.42 -0.03 0.00 0.21 0.00 0.00 66.02 65.73 2k8q s SER 7 CO -0.13 0.22 -0.09 -0.63 0.41 0.00 0.00 173.24 173.02 2k8q s ILE 8 N -0.30 3.51 0.05 1.44 1.01 -1.26 0.27 121.20 125.92 2k8q s ILE 8 Ca 0.03 -0.77 0.06 0.00 0.00 0.00 0.00 60.65 59.98 2k8q s ILE 8 Cb -0.09 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.86 2k8q s ILE 8 CO 0.01 0.44 -0.17 -0.89 0.00 0.00 0.00 174.94 174.32 2k8q s THR 9 N -0.93 1.40 -0.01 2.92 2.01 0.89 -4.78 115.64 117.14 2k8q s THR 9 Ca 0.16 -1.18 0.02 0.00 0.31 0.00 0.00 61.69 60.99 2k8q s THR 9 Cb -0.11 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.11 2k8q s THR 9 CO 0.06 0.04 -0.03 0.00 -0.69 0.00 0.00 174.62 174.00 2k8q s GLN 10 N -1.33 2.72 0.28 4.92 0.00 -1.26 -1.26 119.66 123.74 2k8q s GLN 10 Ca 0.04 -0.63 0.03 0.00 -0.00 0.00 0.00 55.36 54.80 2k8q s GLN 10 Cb -0.09 -2.62 -0.06 0.00 0.00 0.00 0.00 33.01 30.25 2k8q s GLN 10 CO 0.02 0.63 0.07 -0.51 0.00 0.00 0.00 175.29 175.49 2k8q s ASP 11 N -1.41 1.79 0.00 12.60 1.01 -0.67 -4.95 116.67 125.04 2k8q s ASP 11 Ca 0.18 -1.36 0.14 0.00 0.71 0.00 0.00 52.55 52.22 2k8q s ASP 11 Cb -0.11 0.03 0.57 0.00 1.01 0.00 0.00 42.92 44.42 2k8q s ASP 11 CO 0.08 -0.65 1.41 -1.84 0.21 0.00 0.00 175.17 174.38 2k8q n GLU 12 N -0.56 1.51 0.00 8.23 0.28 -1.26 -3.93 120.64 124.91 2k8q n GLU 12 Ca -0.02 -0.77 0.00 0.00 -0.16 0.00 0.00 57.16 56.21 2k8q n GLU 12 Cb 0.66 -1.28 0.00 0.00 1.43 0.00 0.00 31.44 32.25 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 0.05 0.95 -3.02 3.44 0.28 -1.26 -0.41 120.64 120.67 2k8q n GLU 13 Ca 0.12 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 57.10 2k8q n GLU 13 Cb 0.22 -0.83 0.01 0.00 1.43 0.00 0.00 31.44 32.27 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 -1.93 -1.19 -4.21 -1.84 -1.74 -1.25 -4.48 117.46 100.82 2k8q n PHE 14 Ca 0.00 -0.89 -0.35 0.00 -0.56 0.00 0.00 57.45 55.66 2k8q n PHE 14 Cb 0.33 0.43 -0.08 0.00 1.52 0.00 0.00 39.48 41.68 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 -2.25 4.62 -0.23 1.97 -1.09 -0.17 -1.67 121.20 122.38 2k8q s ILE 15 Ca 0.15 -0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.34 2k8q s ILE 15 Cb -0.02 -3.01 0.06 0.00 -1.58 0.00 0.00 42.46 37.91 2k8q s ILE 15 CO 0.04 0.53 -0.07 0.12 -1.23 0.00 0.00 174.94 174.33 2k8q s PHE 16 N -1.01 2.51 -0.24 3.97 5.36 -0.39 -1.88 117.98 126.32 2k8q s PHE 16 Ca 0.17 -1.81 -0.10 0.00 -0.96 0.00 0.00 56.93 54.23 2k8q s PHE 16 Cb -0.12 -1.63 -0.05 0.00 -0.34 0.00 0.00 43.02 40.89 2k8q s PHE 16 CO 0.06 -0.78 0.13 -1.17 -1.46 0.00 0.00 175.22 172.00 2k8q s LEU 17 N 1.36 3.97 -0.08 6.12 2.96 0.18 -0.07 118.68 133.11 2k8q s LEU 17 Ca -0.06 0.05 -0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2k8q s LEU 17 Cb -0.19 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.41 2k8q s LEU 17 CO -0.06 0.06 -0.05 -0.75 -1.32 0.00 0.00 176.35 174.23 2k8q s LYS 18 N 1.08 2.88 -0.10 1.98 2.20 0.14 0.02 119.74 127.94 2k8q s LYS 18 Ca 0.06 -0.51 0.01 0.00 -0.36 0.00 0.00 55.97 55.17 2k8q s LYS 18 Cb -0.14 -2.66 0.02 0.00 -1.51 0.00 0.00 37.83 33.54 2k8q s LYS 18 CO 0.04 0.64 -0.11 0.42 -0.36 0.00 0.00 175.35 175.98 2k8q s ILE 19 N -0.73 1.22 0.00 5.43 1.09 -0.45 -0.47 121.20 127.29 2k8q s ILE 19 Ca 0.11 -0.46 -0.21 0.00 -1.10 0.00 0.00 60.65 58.99 2k8q s ILE 19 Cb -0.11 -1.16 -0.05 0.00 -1.06 0.00 0.00 42.46 40.07 2k8q s ILE 19 CO 0.02 0.39 0.61 -0.36 -0.10 0.00 0.00 174.94 175.50 2k8q s PHE 20 N 1.21 3.69 0.29 3.97 0.08 -0.14 -1.24 117.98 125.84 2k8q s PHE 20 Ca -0.03 1.22 -0.09 0.00 0.12 0.00 0.00 56.93 58.15 2k8q s PHE 20 Cb -0.14 -2.62 0.00 0.00 -0.57 0.00 0.00 43.02 39.69 2k8q s PHE 20 CO -0.04 0.35 0.49 0.96 -0.10 0.00 0.00 175.22 176.88 2k8q s ILE 21 N -0.20 0.00 -0.05 0.64 -4.36 -1.22 -4.09 121.20 111.91 2k8q s ILE 21 Ca 0.32 -1.46 0.07 0.00 -0.26 0.00 0.00 60.65 59.31 2k8q s ILE 21 Cb -0.18 -2.42 0.11 0.00 1.25 0.00 0.00 42.46 41.22 2k8q s ILE 21 CO 0.18 0.00 0.98 -1.20 0.24 0.00 0.00 174.94 175.14 2k8q n SER 22 N -0.79 1.37 -2.15 4.36 7.64 -1.26 -4.70 113.62 118.10 2k8q n SER 22 Ca -0.01 -2.25 -0.19 0.00 1.01 0.00 0.00 58.87 57.43 2k8q n SER 22 Cb 0.62 -0.20 -0.03 0.00 -1.01 0.00 0.00 64.21 63.58 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 -0.66 -5.34 -0.17 6.43 5.03 -1.26 -4.85 115.26 114.44 2k8q n ASN 23 Ca 0.06 0.16 -0.04 0.00 0.87 0.00 0.00 54.58 55.63 2k8q n ASN 23 Cb 0.53 -4.55 0.15 0.00 -1.02 0.00 0.00 39.78 34.90 2k8q n ASN 23 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.26 175.59 2k8q h ILE 24 N 0.00 1.24 -0.36 2.41 3.07 -2.01 -3.31 117.51 118.55 2k8q h ILE 24 Ca -0.43 -0.86 -0.23 0.00 1.55 0.00 0.00 64.86 64.89 2k8q h ILE 24 Cb 1.31 0.63 -0.38 0.00 -0.27 0.00 0.00 36.82 38.10 2k8q h ILE 24 CO 0.55 0.32 -1.06 0.54 -1.05 0.00 0.00 178.15 177.45 2k8q n ARG 25 N -4.26 1.53 -2.87 0.16 5.12 -1.26 -5.05 116.66 110.02 2k8q n ARG 25 Ca 0.04 -3.23 -0.43 0.00 -1.93 0.00 0.00 57.85 52.31 2k8q n ARG 25 Cb 0.23 -1.33 -0.04 0.00 -1.16 0.00 0.00 32.46 30.16 2k8q n ARG 25 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2k8q s PHE 26 N -3.20 2.71 -0.03 -1.55 5.36 -1.25 -4.28 117.98 115.74 2k8q s PHE 26 Ca 0.27 -0.47 0.11 0.00 -0.96 0.00 0.00 56.93 55.88 2k8q s PHE 26 Cb 0.33 -4.23 -0.08 0.00 -0.34 0.00 0.00 43.02 38.70 2k8q s PHE 26 CO -0.06 -1.58 1.30 0.77 -1.46 0.00 0.00 175.22 174.20 2k8q h SER 27 N 9.51 0.00 -2.58 6.13 0.02 -1.97 -3.48 113.55 121.19 2k8q h SER 27 Ca -0.28 0.00 -0.42 0.00 -0.84 0.00 0.00 61.79 60.25 2k8q h SER 27 Cb 1.07 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.56 2k8q h SER 27 CO 1.16 0.75 -0.50 0.00 -1.14 0.00 0.00 176.83 177.10 2k8q n ALA 28 N -2.30 -0.56 -0.00 3.77 0.00 -1.26 -4.81 120.51 115.35 2k8q n ALA 28 Ca -0.00 0.21 -0.00 0.00 0.00 0.00 0.00 53.44 53.64 2k8q n ALA 28 Cb 0.84 -2.15 -0.00 0.00 0.00 0.00 0.00 19.45 18.14 2k8q n ALA 28 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2k8q n VAL 29 N -3.63 0.00 -0.76 0.00 0.31 -1.26 -4.69 118.33 108.30 2k8q n VAL 29 Ca -0.24 -0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.17 2k8q n VAL 29 Cb 0.69 -0.54 0.27 0.00 -0.91 0.00 0.00 33.84 33.35 2k8q n VAL 29 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2k8q n GLY 30 N 2.84 3.48 3.67 2.92 0.00 -1.26 -4.99 105.19 111.85 2k8q n GLY 30 Ca -0.00 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.30 4.33 -0.33 0.99 1.43 -1.26 -4.57 118.68 116.97 2k8q s LEU 31 Ca 0.41 2.28 -0.08 0.00 -1.03 0.00 0.00 54.13 55.71 2k8q s LEU 31 Cb 0.30 -3.55 0.19 0.00 0.03 0.00 0.00 46.19 43.17 2k8q s LEU 31 CO 0.13 -0.87 1.02 -0.70 0.23 0.00 0.00 176.35 176.16 2k8q s GLU 32 N 3.33 0.23 -0.08 1.70 2.12 -1.26 -4.97 118.70 119.77 2k8q s GLU 32 Ca 0.72 -0.10 -0.20 0.00 0.36 0.00 0.00 54.97 55.74 2k8q s GLU 32 Cb -0.35 0.02 -0.04 0.00 0.26 0.00 0.00 34.13 34.02 2k8q s GLU 32 CO 0.30 -0.33 0.57 0.42 -0.54 0.00 0.00 175.26 175.67 2k8q s ILE 33 N 1.82 5.10 0.14 -3.70 1.01 -1.26 -4.22 121.20 120.08 2k8q s ILE 33 Ca 0.16 1.16 0.08 0.00 0.00 0.00 0.00 60.65 62.04 2k8q s ILE 33 Cb 0.04 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 2k8q s ILE 33 CO -0.14 0.32 -0.17 0.27 0.00 0.00 0.00 174.94 175.22 2k8q s ILE 34 N 0.52 1.64 -0.16 2.92 -5.25 -1.00 -4.96 121.20 114.92 2k8q s ILE 34 Ca 0.30 -1.79 -0.04 0.00 -0.99 0.00 0.00 60.65 58.13 2k8q s ILE 34 Cb -0.16 -1.69 -0.03 0.00 2.95 0.00 0.00 42.46 43.52 2k8q s ILE 34 CO 0.14 -0.30 -0.02 -0.63 -1.79 0.00 0.00 174.94 172.34 2k8q s ILE 35 N -1.92 4.08 0.02 8.37 1.09 -1.26 -0.67 121.20 130.91 2k8q s ILE 35 Ca 0.12 -0.29 -0.00 0.00 -1.10 0.00 0.00 60.65 59.37 2k8q s ILE 35 Cb -0.06 -2.80 0.00 0.00 -1.06 0.00 0.00 42.46 38.55 2k8q s ILE 35 CO 0.05 0.49 0.02 0.00 -0.10 0.00 0.00 174.94 175.40 2k8q n GLN 36 N 3.50 -0.53 -0.28 2.79 1.13 0.86 -4.52 117.38 120.33 2k8q n GLN 36 Ca -0.17 -0.04 0.19 0.00 -1.94 0.00 0.00 57.00 55.04 2k8q n GLN 36 Cb 0.52 -0.03 0.48 0.00 0.11 0.00 0.00 30.24 31.33 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 0.45 0.00 -1.09 4.11 -2.00 -3.39 114.58 112.66 2k8q h GLU 37 Ca -0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 2k8q h GLU 37 Cb 0.02 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2k8q h GLU 37 CO 0.01 0.30 0.00 0.27 0.07 0.00 0.00 179.01 179.65 2k8q n ASN 38 N -4.56 0.00 -4.38 3.06 6.94 -1.26 -4.14 115.26 110.91 2k8q n ASN 38 Ca 0.21 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.48 2k8q n ASN 38 Cb 0.72 0.03 0.17 0.00 -2.36 0.00 0.00 39.78 38.34 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 -1.90 0.51 -0.05 -3.83 0.23 -1.26 -2.45 119.30 110.54 2k8q s MET 39 Ca 0.00 -0.01 0.05 0.00 -1.03 0.00 0.00 55.69 54.71 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 -2.57 -0.21 0.42 -2.03 0.00 0.00 175.02 170.63 2k8q s ILE 40 N -3.41 2.43 -0.23 3.16 1.01 0.31 -0.10 121.20 124.36 2k8q s ILE 40 Ca 0.68 -0.94 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 2k8q s ILE 40 Cb -0.10 -1.91 -0.02 0.00 0.01 0.00 0.00 42.46 40.44 2k8q s ILE 40 CO 0.54 0.57 0.02 -0.63 0.00 0.00 0.00 174.94 175.44 2k8q s ILE 41 N -0.39 3.87 -0.52 2.92 -1.09 0.16 -1.60 121.20 124.55 2k8q s ILE 41 Ca 0.03 -0.32 -0.15 0.00 -2.23 0.00 0.00 60.65 57.98 2k8q s ILE 41 Cb -0.12 -2.79 0.12 0.00 -1.58 0.00 0.00 42.46 38.09 2k8q s ILE 41 CO 0.02 0.38 0.46 0.12 -1.23 0.00 0.00 174.94 174.69 2k8q s PHE 42 N 1.51 3.26 -0.31 3.97 5.36 0.07 -2.36 117.98 129.49 2k8q s PHE 42 Ca 0.06 -1.26 0.22 0.00 -0.96 0.00 0.00 56.93 54.99 2k8q s PHE 42 Cb -0.15 -3.63 -0.23 0.00 -0.34 0.00 0.00 43.02 38.66 2k8q s PHE 42 CO 0.00 -0.97 0.69 1.58 -1.46 0.00 0.00 175.22 175.06 2k8q n HIS 43 N 5.21 0.13 -1.40 10.12 -0.00 -1.26 -1.57 115.22 126.45 2k8q n HIS 43 Ca -0.13 0.04 -0.37 0.00 0.46 0.00 0.00 57.72 57.71 2k8q n HIS 43 Cb 0.41 -0.44 0.05 0.00 -0.12 0.00 0.00 29.99 29.89 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 -2.12 0.82 -1.31 0.27 0.00 -1.26 -4.69 117.00 108.71 2k8q n LEU 44 Ca -0.01 0.68 0.17 0.00 0.00 0.00 0.00 56.01 56.85 2k8q n LEU 44 Cb 0.51 -1.19 -0.07 0.00 0.00 0.00 0.00 43.42 42.67 2k8q n LEU 44 CO 0.44 -3.07 -0.46 -1.54 0.00 0.00 0.00 177.39 172.76 2k8q n SER 45 N 0.23 -7.70 0.00 1.96 3.41 -1.26 -4.16 113.62 106.10 2k8q n SER 45 Ca 0.11 1.03 0.07 0.00 -0.26 0.00 0.00 58.87 59.83 2k8q n SER 45 Cb 0.48 -4.31 0.37 0.00 -0.26 0.00 0.00 64.21 60.50 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 -4.14 0.22 -4.21 4.33 -0.04 -1.26 -4.63 135.00 125.26 2k8q n PRO 46 Ca -0.05 0.14 -0.34 0.00 -0.04 0.00 0.00 63.50 63.21 2k8q n PRO 46 Cb 0.61 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.46 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 -2.55 3.10 -0.15 0.54 2.02 -1.26 -5.09 117.35 113.95 2k8q s TYR 47 Ca 0.14 -0.20 -0.15 0.00 -0.37 0.00 0.00 57.07 56.49 2k8q s TYR 47 Cb 0.10 -2.02 -0.04 0.00 -0.40 0.00 0.00 41.96 39.59 2k8q s TYR 47 CO 0.22 -0.01 0.36 -0.47 -1.57 0.00 0.00 175.55 174.08 2k8q s TYR 48 N 0.48 3.46 0.02 2.71 6.14 -1.26 -4.63 117.35 124.28 2k8q s TYR 48 Ca -0.01 0.68 0.05 0.00 0.64 0.00 0.00 57.07 58.43 2k8q s TYR 48 Cb -0.14 -2.43 -0.02 0.00 0.42 0.00 0.00 41.96 39.80 2k8q s TYR 48 CO 0.02 0.18 -0.15 -1.17 0.64 0.00 0.00 175.55 175.07 2k8q s LEU 49 N 0.63 2.12 -0.06 6.97 1.98 -0.61 0.03 118.68 129.73 2k8q s LEU 49 Ca 0.19 -0.39 0.06 0.00 -2.89 0.00 0.00 54.13 51.10 2k8q s LEU 49 Cb -0.14 -0.71 -0.01 0.00 0.66 0.00 0.00 46.19 45.99 2k8q s LEU 49 CO 0.06 0.11 -0.25 -0.60 -1.89 0.00 0.00 176.35 173.78 2k8q s ARG 50 N -0.84 2.57 -0.19 1.98 3.52 -1.26 -0.75 118.95 123.98 2k8q s ARG 50 Ca 0.04 -0.90 0.01 0.00 -0.13 0.00 0.00 55.73 54.75 2k8q s ARG 50 Cb -0.07 -2.17 0.04 0.00 -1.56 0.00 0.00 34.95 31.19 2k8q s ARG 50 CO 0.01 0.38 -0.10 -0.51 -0.81 0.00 0.00 175.30 174.27 2k8q s LEU 51 N -0.16 2.14 -0.35 -0.88 1.43 -0.63 -4.30 118.68 115.94 2k8q s LEU 51 Ca -0.04 -0.82 -0.07 0.00 -1.03 0.00 0.00 54.13 52.16 2k8q s LEU 51 Cb -0.14 -1.18 0.04 0.00 0.03 0.00 0.00 46.19 44.94 2k8q s LEU 51 CO 0.04 -0.14 0.13 -0.60 0.23 0.00 0.00 176.35 176.01 2k8q s ARG 52 N 1.44 2.65 0.25 1.70 6.06 -1.21 -0.53 118.95 129.30 2k8q s ARG 52 Ca -0.00 -1.18 0.00 0.00 -2.50 0.00 0.00 55.73 52.05 2k8q s ARG 52 Cb -0.16 -3.53 -0.04 0.00 0.06 0.00 0.00 34.95 31.28 2k8q s ARG 52 CO -0.08 -0.69 0.43 -0.06 -2.50 0.00 0.00 175.30 172.40 2k8q s PHE 53 N 1.43 3.48 -1.38 5.12 0.08 -1.26 -4.52 117.98 120.93 2k8q s PHE 53 Ca -0.01 0.30 0.15 0.00 0.12 0.00 0.00 56.93 57.49 2k8q s PHE 53 Cb -0.20 -1.83 0.73 0.00 -0.57 0.00 0.00 43.02 41.15 2k8q s PHE 53 CO 0.04 0.32 1.41 -0.35 -0.10 0.00 0.00 175.22 176.53 2k8q n PRO 54 N -1.05 0.18 -2.32 0.24 -0.04 -1.26 -4.76 135.00 125.99 2k8q n PRO 54 Ca -0.05 0.16 -0.05 0.00 -0.04 0.00 0.00 63.50 63.52 2k8q n PRO 54 Cb 0.55 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.50 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 -1.31 -0.08 -4.38 0.54 8.25 -1.26 -5.14 115.22 111.84 2k8q n HIS 55 Ca 0.07 -0.39 -0.30 0.00 -0.26 0.00 0.00 57.72 56.84 2k8q n HIS 55 Cb 0.12 -0.06 -0.17 0.00 1.12 0.00 0.00 29.99 31.01 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 -2.30 2.38 0.33 -0.41 1.03 -1.26 -4.60 118.70 113.87 2k8q s GLU 56 Ca 0.01 -0.61 0.05 0.00 0.03 0.00 0.00 54.97 54.45 2k8q s GLU 56 Cb -0.00 -2.04 0.05 0.00 -0.80 0.00 0.00 34.13 31.34 2k8q s GLU 56 CO 0.01 -0.10 0.43 1.28 -1.33 0.00 0.00 175.26 175.55 2k8q n LEU 57 N 4.33 0.00 -3.85 1.83 4.77 -1.03 -3.86 117.00 119.20 2k8q n LEU 57 Ca -0.19 -1.45 -0.12 0.00 -0.03 0.00 0.00 56.01 54.23 2k8q n LEU 57 Cb 0.51 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.27 2k8q n LEU 57 CO 0.24 -0.60 -0.20 -0.51 -1.33 0.00 0.00 177.39 174.98 2k8q s ILE 58 N -1.10 0.03 -0.39 -0.08 2.07 -0.67 -4.38 121.20 116.67 2k8q s ILE 58 Ca 0.33 -0.28 -0.10 0.00 -1.41 0.00 0.00 60.65 59.19 2k8q s ILE 58 Cb -0.03 -0.28 0.05 0.00 0.13 0.00 0.00 42.46 42.33 2k8q s ILE 58 CO 0.21 -0.15 0.23 -0.62 -1.91 0.00 0.00 174.94 172.69 2k8q s ASP 59 N -0.49 5.67 0.14 4.50 2.15 -1.26 -3.64 116.67 123.74 2k8q s ASP 59 Ca -0.06 -1.23 0.01 0.00 0.43 0.00 0.00 52.55 51.70 2k8q s ASP 59 Cb -0.04 -2.00 -0.00 0.00 -0.30 0.00 0.00 42.92 40.58 2k8q s ASP 59 CO 0.01 -0.45 0.02 0.47 -0.17 0.00 0.00 175.17 175.05 2k8q n ASP 60 N 4.96 1.66 -0.11 -0.34 9.92 -1.26 -5.00 116.55 126.37 2k8q n ASP 60 Ca -0.11 -1.66 0.02 0.00 -0.53 0.00 0.00 54.79 52.51 2k8q n ASP 60 Cb 0.44 0.22 0.32 0.00 -0.64 0.00 0.00 41.12 41.46 2k8q n ASP 60 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2k8q h GLU 61 N 0.00 0.78 -0.74 -1.24 5.08 -2.04 -1.95 114.58 114.47 2k8q h GLU 61 Ca -0.11 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2k8q h GLU 61 Cb 0.37 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 2k8q h GLU 61 CO 0.18 0.53 0.45 0.07 -1.00 0.00 0.00 179.01 179.24 2k8q h ARG 62 N 0.80 0.99 -6.72 2.33 -0.00 -1.99 -3.42 114.38 106.37 2k8q h ARG 62 Ca 0.21 -0.08 -0.53 0.00 -0.00 0.00 0.00 59.98 59.59 2k8q h ARG 62 Cb -0.07 -0.21 0.07 0.00 -0.00 0.00 0.00 29.97 29.76 2k8q h ARG 62 CO -0.04 0.69 0.93 -1.12 -0.00 0.00 0.00 179.97 180.43 2k8q s SER 63 N -6.38 6.41 -0.06 0.08 0.01 -0.74 -4.93 113.70 108.09 2k8q s SER 63 Ca -0.11 2.87 -0.31 0.00 1.31 0.00 0.00 55.95 59.71 2k8q s SER 63 Cb 0.17 -2.62 0.12 0.00 0.21 0.00 0.00 66.02 63.91 2k8q s SER 63 CO 0.79 -0.92 1.17 0.28 0.41 0.00 0.00 173.24 174.97 2k8q s THR 64 N 0.60 0.00 0.02 1.44 -1.32 -1.17 -4.86 115.64 110.36 2k8q s THR 64 Ca 0.69 -0.16 0.04 0.00 -1.21 0.00 0.00 61.69 61.04 2k8q s THR 64 Cb -0.48 -1.50 -0.02 0.00 -1.51 0.00 0.00 72.50 69.00 2k8q s THR 64 CO 0.39 0.00 -0.12 0.00 -2.21 0.00 0.00 174.62 172.68 2k8q s ALA 65 N -2.60 1.01 -0.08 11.08 0.00 -1.26 -0.09 121.76 129.82 2k8q s ALA 65 Ca 0.11 -0.65 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2k8q s ALA 65 Cb 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 23.12 22.94 2k8q s ALA 65 CO -0.04 0.21 -0.21 -0.65 0.00 0.00 0.00 175.76 175.06 2k8q s GLN 66 N -0.74 2.53 -0.13 0.00 -0.21 0.50 -4.97 119.66 116.65 2k8q s GLN 66 Ca 0.02 -0.77 -0.22 0.00 0.02 0.00 0.00 55.36 54.41 2k8q s GLN 66 Cb -0.06 -2.01 -0.03 0.00 1.00 0.00 0.00 33.01 31.91 2k8q s GLN 66 CO 0.00 0.20 0.67 -0.47 -2.12 0.00 0.00 175.29 173.57 2k8q s TYR 67 N 0.25 3.48 -0.29 0.91 5.04 -1.26 -1.29 117.35 124.18 2k8q s TYR 67 Ca -0.13 1.10 -0.10 0.00 -2.44 0.00 0.00 57.07 55.50 2k8q s TYR 67 Cb -0.16 -2.80 -0.03 0.00 0.35 0.00 0.00 41.96 39.33 2k8q s TYR 67 CO 0.06 -0.03 0.16 -0.51 -1.34 0.00 0.00 175.55 173.89 2k8q s ASP 68 N 0.95 5.71 -0.09 4.32 1.01 0.88 -4.96 116.67 124.49 2k8q s ASP 68 Ca 0.33 -0.26 -0.14 0.00 0.71 0.00 0.00 52.55 53.20 2k8q s ASP 68 Cb -0.17 -2.05 -0.28 0.00 1.01 0.00 0.00 42.92 41.44 2k8q s ASP 68 CO 0.14 -0.12 0.55 0.77 0.21 0.00 0.00 175.17 176.72 2k8q h SER 69 N 8.36 0.44 0.00 0.27 4.64 -1.94 0.33 113.55 125.65 2k8q h SER 69 Ca -0.34 -0.88 0.00 0.00 -0.47 0.00 0.00 61.79 60.10 2k8q h SER 69 Cb 1.17 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2k8q h SER 69 CO 0.59 1.69 0.04 0.07 -0.87 0.00 0.00 176.83 178.34 2k8q h LYS 70 N -0.18 0.00 0.00 4.77 -0.00 -1.96 -1.92 116.57 117.29 2k8q h LYS 70 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.32 2k8q h LYS 70 Cb 1.87 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 34.10 2k8q h LYS 70 CO 0.08 0.00 0.00 -3.47 -0.00 0.00 0.00 179.45 176.06 2k8q n ASP 71 N -2.99 0.33 -2.08 7.07 2.03 -1.25 -5.00 116.55 114.66 2k8q n ASP 71 Ca -0.03 -0.65 -0.16 0.00 0.52 0.00 0.00 54.79 54.48 2k8q n ASP 71 Cb 0.10 0.47 -0.03 0.00 -0.72 0.00 0.00 41.12 40.94 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 -0.47 -1.78 -4.21 -0.67 1.02 0.11 -4.93 120.64 109.71 2k8q n GLU 72 Ca 0.00 0.82 -0.23 0.00 -0.02 0.00 0.00 57.16 57.73 2k8q n GLU 72 Cb 0.02 -5.33 -0.07 0.00 -0.02 0.00 0.00 31.44 26.05 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 -2.34 2.55 -0.20 0.00 -1.09 -0.37 -0.08 121.20 119.67 2k8q s ILE 74 Ca 0.34 -0.86 -0.04 0.00 -2.23 0.00 0.00 60.65 57.86 2k8q s ILE 74 Cb -0.05 -2.01 -0.02 0.00 -1.58 0.00 0.00 42.46 38.80 2k8q s ILE 74 CO 0.21 0.55 -0.03 0.20 -1.23 0.00 0.00 174.94 174.64 2k8q s ASN 75 N 0.12 4.56 -0.11 3.58 0.01 -0.41 -1.34 114.94 121.34 2k8q s ASN 75 Ca -0.09 -0.28 0.01 0.00 -0.71 0.00 0.00 52.86 51.79 2k8q s ASN 75 Cb -0.16 -1.77 -0.01 0.00 0.41 0.00 0.00 41.25 39.72 2k8q s ASN 75 CO 0.06 0.05 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.84 2k8q s VAL 76 N 1.05 2.73 -0.06 1.60 1.01 0.10 -0.37 120.40 126.47 2k8q s VAL 76 Ca 0.01 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2k8q s VAL 76 Cb -0.15 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2k8q s VAL 76 CO 0.01 0.54 -0.09 -0.75 0.00 0.00 0.00 175.10 174.81 2k8q s LYS 77 N 0.27 2.68 -0.10 2.72 2.36 0.87 -0.64 119.74 127.90 2k8q s LYS 77 Ca -0.12 -0.59 -0.04 0.00 -2.55 0.00 0.00 55.97 52.67 2k8q s LYS 77 Cb -0.16 -2.54 0.05 0.00 -1.05 0.00 0.00 37.83 34.13 2k8q s LYS 77 CO 0.06 0.65 0.21 0.08 1.55 0.00 0.00 175.35 177.90 2k8q s VAL 78 N -0.80 -0.19 0.12 4.02 1.01 -0.79 -3.02 120.40 120.75 2k8q s VAL 78 Ca 0.12 0.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 2k8q s VAL 78 Cb -0.11 -0.34 -0.06 0.00 0.00 0.00 0.00 36.38 35.87 2k8q s VAL 78 CO 0.01 0.10 1.02 0.00 0.00 0.00 0.00 175.10 176.23 2k8q s ALA 79 N 1.79 3.28 0.05 5.51 0.00 -1.24 -1.00 121.76 130.16 2k8q s ALA 79 Ca -0.04 0.66 -0.11 0.00 0.00 0.00 0.00 51.96 52.47 2k8q s ALA 79 Cb -0.11 -3.32 -0.06 0.00 0.00 0.00 0.00 23.12 19.63 2k8q s ALA 79 CO -0.07 -0.12 0.40 0.21 0.00 0.00 0.00 175.76 176.17 2k8q s LYS 80 N 0.05 3.79 0.26 0.00 2.36 -1.26 -1.68 119.74 123.26 2k8q s LYS 80 Ca 0.49 0.23 -0.02 0.00 -2.55 0.00 0.00 55.97 54.12 2k8q s LYS 80 Cb -0.25 -3.06 0.50 0.00 -1.05 0.00 0.00 37.83 33.97 2k8q s LYS 80 CO 0.31 0.60 1.76 -0.07 1.55 0.00 0.00 175.35 179.50 2k8q h LEU 81 N 4.01 0.50 -8.60 5.43 3.38 -1.87 -3.41 115.31 114.76 2k8q h LEU 81 Ca -0.50 0.09 -0.69 0.00 0.09 0.00 0.00 57.88 56.87 2k8q h LEU 81 Cb 1.20 0.01 -0.30 0.00 0.09 0.00 0.00 40.66 41.66 2k8q h LEU 81 CO 0.65 0.22 -0.88 0.20 0.09 0.00 0.00 178.44 178.71 2k8q s ASN 82 N -5.43 2.97 0.70 -0.43 0.01 -1.26 -5.11 114.94 106.38 2k8q s ASN 82 Ca -0.12 -0.47 -0.11 0.00 -0.71 0.00 0.00 52.86 51.45 2k8q s ASN 82 Cb 0.21 -0.33 0.01 0.00 0.41 0.00 0.00 41.25 41.55 2k8q s ASN 82 CO 0.78 0.30 1.07 -0.75 -1.51 0.00 0.00 177.10 176.99 2k8q s LYS 83 N -0.65 2.93 -1.58 -0.60 2.20 -1.26 -3.61 119.74 117.17 2k8q s LYS 83 Ca 0.10 0.71 0.00 0.00 -0.36 0.00 0.00 55.97 56.42 2k8q s LYS 83 Cb -0.10 -2.01 0.00 0.00 -1.51 0.00 0.00 37.83 34.21 2k8q s LYS 83 CO -0.01 -1.04 0.00 0.09 -0.36 0.00 0.00 175.35 174.03 2k8q n ASN 84 N -3.06 -5.42 -4.59 1.43 5.03 0.45 -4.94 115.26 104.17 2k8q n ASN 84 Ca 0.07 0.37 -0.41 0.00 0.87 0.00 0.00 54.58 55.47 2k8q n ASN 84 Cb 0.55 -4.24 -0.06 0.00 -1.02 0.00 0.00 39.78 35.01 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 -3.23 3.82 0.60 3.52 2.56 -1.24 -4.91 118.70 119.82 2k8q s GLU 85 Ca 0.00 0.24 0.02 0.00 0.00 0.00 0.00 54.97 55.24 2k8q s GLU 85 Cb 0.00 -3.76 0.07 0.00 2.00 0.00 0.00 34.13 32.44 2k8q s GLU 85 CO 0.00 -0.67 0.84 1.52 -0.56 0.00 0.00 175.26 176.39 2k8q s TYR 86 N 2.73 2.21 0.12 5.30 1.13 -1.26 -4.62 117.35 122.95 2k8q s TYR 86 Ca 0.26 -0.24 0.03 0.00 -1.41 0.00 0.00 57.07 55.71 2k8q s TYR 86 Cb -0.14 -2.73 -0.04 0.00 -1.10 0.00 0.00 41.96 37.94 2k8q s TYR 86 CO 0.13 -1.17 -0.08 -0.06 -2.51 0.00 0.00 175.55 171.87 2k8q s PHE 87 N -2.85 1.04 -0.02 -3.49 0.40 -1.26 -5.04 117.98 106.77 2k8q s PHE 87 Ca 0.61 -0.85 -0.00 0.00 -0.60 0.00 0.00 56.93 56.09 2k8q s PHE 87 Cb -0.08 -0.57 -0.01 0.00 0.51 0.00 0.00 43.02 42.87 2k8q s PHE 87 CO 0.40 -0.05 -0.02 -1.91 0.70 0.00 0.00 175.22 174.34 2k8q n GLU 88 N -0.09 0.04 0.24 0.44 2.13 -1.26 -4.64 120.64 117.50 2k8q n GLU 88 Ca -0.11 0.01 0.16 0.00 0.66 0.00 0.00 57.16 57.88 2k8q n GLU 88 Cb 0.61 -0.87 0.82 0.00 0.27 0.00 0.00 31.44 32.27 2k8q n GLU 88 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2k8q h ASP 89 N -0.02 0.00 0.31 4.31 5.19 -1.93 -1.47 116.42 122.81 2k8q h ASP 89 Ca -0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 2k8q h ASP 89 Cb 1.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.56 2k8q h ASP 89 CO -0.01 0.00 0.00 0.18 -3.12 0.00 0.00 179.24 176.29 2k8q n LEU 90 N -2.64 0.57 -1.16 1.55 4.32 -1.26 -0.88 117.00 117.50 2k8q n LEU 90 Ca -0.01 0.71 0.10 0.00 -0.02 0.00 0.00 56.01 56.79 2k8q n LEU 90 Cb 0.10 -0.71 0.28 0.00 -1.62 0.00 0.00 43.42 41.47 2k8q n LEU 90 CO 0.16 -0.76 0.74 0.47 -1.22 0.00 0.00 177.39 176.78 2k8q n ASP 91 N -2.20 3.38 -3.63 -1.43 8.00 -0.55 -4.41 116.55 115.71 2k8q n ASP 91 Ca 0.00 -1.99 -0.29 0.00 0.71 0.00 0.00 54.79 53.22 2k8q n ASP 91 Cb 0.12 -0.41 -0.15 0.00 -0.02 0.00 0.00 41.12 40.66 2k8q n ASP 91 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2k8q s LEU 92 N -1.05 1.06 0.00 0.64 1.43 -0.06 -4.98 118.68 115.71 2k8q s LEU 92 Ca 0.42 -1.22 0.15 0.00 -1.03 0.00 0.00 54.13 52.45 2k8q s LEU 92 Cb 0.22 -0.51 0.69 0.00 0.03 0.00 0.00 46.19 46.63 2k8q s LEU 92 CO 0.29 -0.40 1.42 -0.81 0.23 0.00 0.00 176.35 177.08 2k8q n PRO 93 N 5.12 0.13 0.01 1.29 -0.04 -1.26 -2.23 135.00 138.02 2k8q n PRO 93 Ca -0.06 0.19 0.04 0.00 -0.04 0.00 0.00 63.50 63.63 2k8q n PRO 93 Cb 0.44 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.36 0.73 0.10 0.52 -2.24 -1.26 -3.51 114.28 107.25 2k8q n THR 94 Ca 0.06 -0.63 -0.02 0.00 -2.27 0.00 0.00 64.05 61.18 2k8q n THR 94 Cb 0.13 -0.37 -0.05 0.00 -2.10 0.00 0.00 70.33 67.95 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 0.19 -0.78 1.79 -1.73 -2.78 116.57 113.26 2k8q h LYS 95 Ca -0.15 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.06 2k8q h LYS 95 Cb 1.40 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 32.08 2k8q h LYS 95 CO 0.02 0.72 -1.20 -0.07 -1.08 0.00 0.00 179.45 177.84 2k8q h LEU 96 N 0.00 0.62 0.15 2.94 3.38 -1.71 -3.37 115.31 117.33 2k8q h LEU 96 Ca -0.02 -0.93 -0.01 0.00 0.09 0.00 0.00 57.88 57.01 2k8q h LEU 96 Cb 1.59 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2k8q h LEU 96 CO 0.09 1.57 -0.07 -0.07 0.09 0.00 0.00 178.44 180.05 2k8q h LEU 97 N -0.13 -0.17 -8.64 1.67 3.38 -1.66 -3.21 115.31 106.56 2k8q h LEU 97 Ca -0.22 -0.20 -0.61 0.00 0.09 0.00 0.00 57.88 56.94 2k8q h LEU 97 Cb 1.90 0.04 -0.12 0.00 0.09 0.00 0.00 40.66 42.57 2k8q h LEU 97 CO 0.19 0.11 0.51 0.00 0.09 0.00 0.00 178.44 179.34 2k8q s ALA 98 N -5.14 3.25 -1.32 1.53 0.00 -1.05 -4.66 121.76 114.37 2k8q s ALA 98 Ca -0.15 -0.91 0.13 0.00 0.00 0.00 0.00 51.96 51.03 2k8q s ALA 98 Cb 0.03 -3.59 0.25 0.00 0.00 0.00 0.00 23.12 19.81 2k8q s ALA 98 CO 0.62 -2.05 1.14 2.89 0.00 0.00 0.00 175.76 178.36 2k8q n ARG 99 N 7.05 2.00 -3.77 0.00 0.00 -1.26 -4.71 116.66 115.96 2k8q n ARG 99 Ca 0.04 -1.78 -0.16 0.00 -0.00 0.00 0.00 57.85 55.95 2k8q n ARG 99 Cb 0.48 -1.29 -0.16 0.00 -0.00 0.00 0.00 32.46 31.49 2k8q n ARG 99 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 2k8q s GLN 100 N -1.04 0.00 0.00 2.89 2.00 -1.26 -5.08 119.66 117.18 2k8q s GLN 100 Ca 0.22 0.21 0.00 0.00 -2.00 0.00 0.00 55.36 53.79 2k8q s GLN 100 Cb 0.13 -0.33 0.00 0.00 0.80 0.00 0.00 33.01 33.60 2k8q s GLN 100 CO 0.18 -0.20 0.00 0.41 -0.50 0.00 0.00 175.29 175.18 2k8q n GLY 101 N 4.39 2.47 3.58 2.59 0.00 -1.26 -5.02 105.19 111.94 2k8q n GLY 101 Ca -0.23 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 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 0.00 6.33 -0.10 1.61 2.15 -1.26 -4.80 116.67 120.59 2k8q s ASP 102 Ca 0.00 0.22 0.13 0.00 0.43 0.00 0.00 52.55 53.33 2k8q s ASP 102 Cb 0.00 -2.55 -0.19 0.00 -0.30 0.00 0.00 42.92 39.88 2k8q s ASP 102 CO 0.00 -1.56 0.13 -0.11 -0.17 0.00 0.00 175.17 173.46 2k8q n LEU 103 N 8.87 0.00 -2.79 -1.34 7.94 -1.26 -5.01 117.00 123.42 2k8q n LEU 103 Ca 0.10 0.00 -0.20 0.00 -1.11 0.00 0.00 56.01 54.80 2k8q n LEU 103 Cb 0.49 0.25 0.04 0.00 0.53 0.00 0.00 43.42 44.72 2k8q n LEU 103 CO 0.71 0.25 0.03 0.00 -1.11 0.00 0.00 177.39 177.27 2k8q n ALA 104 N -2.38 -0.91 -2.13 1.96 0.00 -1.26 -4.92 120.51 110.87 2k8q n ALA 104 Ca -0.17 0.28 -0.31 0.00 0.00 0.00 0.00 53.44 53.23 2k8q n ALA 104 Cb 0.80 -3.74 0.02 0.00 0.00 0.00 0.00 19.45 16.53 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 -1.50 5.92 3.48 0.00 0.00 -1.26 -4.98 105.19 106.85 2k8q n GLY 105 Ca -0.09 -2.62 -0.43 0.00 0.00 0.00 0.00 46.02 42.88 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 -3.73 3.19 0.16 4.61 0.00 -1.26 -5.01 121.76 119.71 2k8q s ALA 106 Ca 0.51 -1.54 0.03 0.00 0.00 0.00 0.00 51.96 50.97 2k8q s ALA 106 Cb 0.42 -3.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 2k8q s ALA 106 CO -0.20 -2.44 0.24 -0.51 0.00 0.00 0.00 175.76 172.84 2k8q s ASP 107 N 3.10 6.09 -0.01 0.00 1.01 -1.26 -5.12 116.67 120.47 2k8q s ASP 107 Ca 0.25 0.08 -0.29 0.00 0.71 0.00 0.00 52.55 53.29 2k8q s ASP 107 Cb -0.15 -1.77 0.07 0.00 1.01 0.00 0.00 42.92 42.09 2k8q s ASP 107 CO 0.15 0.05 0.69 0.00 0.21 0.00 0.00 175.17 176.27 2k8q s ALA 108 N -1.75 -1.75 -0.02 5.23 0.00 -1.26 -4.87 121.76 117.35 2k8q s ALA 108 Ca 0.33 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.46 2k8q s ALA 108 Cb -0.11 0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2k8q s ALA 108 CO 0.27 -0.45 0.02 -0.51 0.00 0.00 0.00 175.76 175.09 2k8q s LEU 109 N -1.53 1.29 -0.28 0.00 1.43 -1.26 -5.13 118.68 113.20 2k8q s LEU 109 Ca -0.08 0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.03 2k8q s LEU 109 Cb -0.00 -0.07 0.16 0.00 0.03 0.00 0.00 46.19 46.32 2k8q s LEU 109 CO 0.04 -0.10 0.52 0.28 0.23 0.00 0.00 176.35 177.32 2k8q s THR 110 N 0.83 -0.85 -0.05 5.49 -1.32 -1.26 -5.15 115.64 113.34 2k8q s THR 110 Ca -0.07 -0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 2k8q s THR 110 Cb -0.10 -0.92 0.02 0.00 -1.51 0.00 0.00 72.50 69.99 2k8q s THR 110 CO -0.02 -0.04 -0.03 -0.70 -2.21 0.00 0.00 174.62 171.62 2k8q s GLU 111 N 2.75 0.69 0.38 7.08 2.56 -1.26 -5.14 118.70 125.76 2k8q s GLU 111 Ca 0.16 -0.03 -0.25 0.00 0.00 0.00 0.00 54.97 54.85 2k8q s GLU 111 Cb -0.15 -0.79 -0.09 0.00 2.00 0.00 0.00 34.13 35.10 2k8q s GLU 111 CO -0.19 -0.13 1.04 1.21 -0.56 0.00 0.00 175.26 176.63 2k8q s ASN 112 N 1.12 6.87 0.11 -1.70 2.47 -1.26 -5.06 114.94 117.48 2k8q s ASN 112 Ca -0.08 2.03 0.01 0.00 0.42 0.00 0.00 52.86 55.24 2k8q s ASN 112 Cb -0.14 -2.59 0.01 0.00 -1.45 0.00 0.00 41.25 37.08 2k8q s ASN 112 CO -0.01 -0.41 0.08 0.35 -3.72 0.00 0.00 177.10 173.38 2k8q n THR 113 N 0.09 0.00 -1.26 -5.21 -2.24 -1.26 -5.06 114.28 99.34 2k8q n THR 113 Ca 0.04 -0.43 0.15 0.00 -2.27 0.00 0.00 64.05 61.54 2k8q n THR 113 Cb 0.49 -0.39 -0.08 0.00 -2.10 0.00 0.00 70.33 68.25 2k8q n THR 113 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2k8q n ASP 114 N -1.94 -6.89 -2.83 3.42 5.75 -1.26 -4.92 116.55 107.89 2k8q n ASP 114 Ca -0.01 1.25 -0.13 0.00 -0.01 0.00 0.00 54.79 55.90 2k8q n ASP 114 Cb 0.12 -4.32 0.07 0.00 -1.03 0.00 0.00 41.12 35.96 2k8q n ASP 114 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k8q n ALA 115 N -3.98 -1.60 -3.17 2.12 0.00 -1.26 -5.03 120.51 107.58 2k8q n ALA 115 Ca -0.08 -0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.24 2k8q n ALA 115 Cb 0.60 -2.38 -0.04 0.00 0.00 0.00 0.00 19.45 17.62 2k8q n ALA 115 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2k8q s LYS 116 N -4.86 1.69 -0.11 0.00 -0.14 -1.26 -5.04 119.74 110.03 2k8q s LYS 116 Ca 0.06 -1.38 0.17 0.00 -1.36 0.00 0.00 55.97 53.46 2k8q s LYS 116 Cb -0.01 0.48 0.69 0.00 -1.68 0.00 0.00 37.83 37.31 2k8q s LYS 116 CO 0.55 -0.71 1.58 1.17 -0.76 0.00 0.00 175.35 177.18 2k8q n LYS 117 N -0.44 3.58 -4.07 1.68 4.81 -1.26 -4.94 118.16 117.52 2k8q n LYS 117 Ca -0.02 -2.71 -0.33 0.00 -0.87 0.00 0.00 58.31 54.39 2k8q n LYS 117 Cb 0.62 -1.86 -0.07 0.00 0.02 0.00 0.00 35.03 33.73 2k8q n LYS 117 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 2k8q n THR 118 N 1.08 -0.31 -3.99 3.15 5.66 -1.26 -4.88 114.28 113.73 2k8q n THR 118 Ca 0.24 -0.15 -0.34 0.00 -3.05 0.00 0.00 64.05 60.75 2k8q n THR 118 Cb 0.85 -0.58 -0.15 0.00 -1.55 0.00 0.00 70.33 68.90 2k8q n THR 118 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k8q s GLN 119 N -6.46 3.01 -0.38 1.09 -2.07 -1.26 -4.98 119.66 108.61 2k8q s GLN 119 Ca 0.45 -0.85 0.02 0.00 -1.82 0.00 0.00 55.36 53.16 2k8q s GLN 119 Cb -0.26 -2.87 0.28 0.00 -1.09 0.00 0.00 33.01 29.06 2k8q s GLN 119 CO 0.86 -0.30 1.17 0.36 -1.32 0.00 0.00 175.29 176.07 2k8q n LYS 120 N 4.68 0.39 -2.09 9.60 0.00 -1.26 -5.12 118.16 124.36 2k8q n LYS 120 Ca -0.18 -1.09 -0.43 0.00 -0.00 0.00 0.00 58.31 56.61 2k8q n LYS 120 Cb 0.49 -0.61 -0.03 0.00 -0.00 0.00 0.00 35.03 34.88 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 0.26 3.38 -0.28 -1.58 0.04 -1.26 -4.94 135.00 130.62 2k8q s PRO 121 Ca 0.26 1.28 0.01 0.00 0.04 0.00 0.00 61.00 62.59 2k8q s PRO 121 Cb 0.24 -4.16 0.16 0.00 0.04 0.00 0.00 34.50 30.78 2k8q s PRO 121 CO -0.14 -1.80 0.45 -1.17 0.04 0.00 0.00 177.00 174.37 2k8q s LEU 122 N 6.56 -0.92 -0.42 -3.56 1.98 -1.26 -5.12 118.68 115.94 2k8q s LEU 122 Ca 0.75 0.00 -0.27 0.00 -2.89 0.00 0.00 54.13 51.72 2k8q s LEU 122 Cb -0.20 1.35 0.02 0.00 0.66 0.00 0.00 46.19 48.02 2k8q s LEU 122 CO 0.33 -0.32 0.98 -0.63 -1.89 0.00 0.00 176.35 174.82 2k8q s ILE 123 N 2.62 4.47 -0.12 6.68 1.01 -1.26 -5.00 121.20 129.59 2k8q s ILE 123 Ca 0.12 1.09 -0.09 0.00 0.00 0.00 0.00 60.65 61.77 2k8q s ILE 123 Cb -0.13 -4.42 0.04 0.00 0.01 0.00 0.00 42.46 37.95 2k8q s ILE 123 CO -0.25 -0.72 0.31 -1.58 0.00 0.00 0.00 174.94 172.70 2k8q s GLN 124 N 3.77 0.33 -0.20 2.79 0.74 -1.26 -5.14 119.66 120.68 2k8q s GLN 124 Ca 0.40 0.52 -0.02 0.00 0.05 0.00 0.00 55.36 56.31 2k8q s GLN 124 Cb -0.10 0.06 0.00 0.00 1.10 0.00 0.00 33.01 34.07 2k8q s GLN 124 CO 0.23 -0.09 -0.10 -1.21 -0.55 0.00 0.00 175.29 173.57 2k8q s GLU 125 N 0.66 3.26 -0.11 1.67 0.41 -1.26 -5.10 118.70 118.23 2k8q s GLU 125 Ca -0.04 -0.69 -0.08 0.00 -0.41 0.00 0.00 54.97 53.75 2k8q s GLU 125 Cb -0.05 -2.85 0.04 0.00 -1.78 0.00 0.00 34.13 29.49 2k8q s GLU 125 CO -0.04 -0.17 0.27 0.14 -0.49 0.00 0.00 175.26 174.96 2k8q s VAL 126 N 1.35 -0.02 -0.29 2.63 -7.23 -1.26 -5.14 120.40 110.44 2k8q s VAL 126 Ca 0.04 0.06 -0.09 0.00 -1.81 0.00 0.00 61.98 60.18 2k8q s VAL 126 Cb -0.14 -0.39 -0.02 0.00 0.56 0.00 0.00 36.38 36.38 2k8q s VAL 126 CO -0.06 0.03 0.14 -0.70 -0.31 0.00 0.00 175.10 174.20 2k8q s GLU 127 N 0.66 3.55 -0.08 4.82 2.56 -1.26 -5.09 118.70 123.87 2k8q s GLU 127 Ca -0.04 -0.57 -0.05 0.00 0.00 0.00 0.00 54.97 54.31 2k8q s GLU 127 Cb -0.06 -3.53 -0.04 0.00 2.00 0.00 0.00 34.13 32.51 2k8q s GLU 127 CO -0.04 -0.31 0.12 0.99 -0.56 0.00 0.00 175.26 175.46 2k8q s THR 128 N 1.65 5.22 0.32 -1.70 2.01 -1.26 -5.10 115.64 116.78 2k8q s THR 128 Ca 0.06 -0.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.98 2k8q s THR 128 Cb -0.16 -3.31 0.01 0.00 0.01 0.00 0.00 72.50 69.04 2k8q s THR 128 CO 0.07 0.52 0.51 1.51 -0.69 0.00 0.00 174.62 176.54 2k8q s ASP 129 N -1.29 0.52 -0.30 3.53 -4.77 -1.26 -5.15 116.67 107.95 2k8q s ASP 129 Ca 0.18 -1.30 -0.15 0.00 -3.30 0.00 0.00 52.55 47.99 2k8q s ASP 129 Cb -0.12 0.66 0.18 0.00 -1.09 0.00 0.00 42.92 42.56 2k8q s ASP 129 CO 0.08 -1.30 1.15 -0.83 0.70 0.00 0.00 175.17 174.97 2k8q s GLY 130 N -3.16 -0.99 0.31 2.12 0.00 -1.26 -5.17 107.32 99.18 2k8q s GLY 130 Ca 0.27 2.20 -0.08 0.00 0.00 0.00 0.00 44.72 47.11 2k8q s GLY 130 CO 0.16 4.25 0.62 -1.34 0.00 0.00 0.00 173.10 176.80 2k8q s VAL 131 N 2.81 4.92 -0.04 1.40 -7.23 -1.26 -5.00 120.40 115.99 2k8q s VAL 131 Ca 0.29 0.36 0.06 0.00 -1.81 0.00 0.00 61.98 60.88 2k8q s VAL 131 Cb 0.01 -3.70 -0.08 0.00 0.56 0.00 0.00 36.38 33.16 2k8q s VAL 131 CO -0.21 -0.32 0.07 -0.24 -0.31 0.00 0.00 175.10 174.09 2k8q n SER 132 N -0.84 3.50 -2.67 4.85 2.88 -1.26 -5.02 113.62 115.06 2k8q n SER 132 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 2k8q n SER 132 Cb 0.54 0.88 0.04 0.00 -0.75 0.00 0.00 64.21 64.92 2k8q n SER 132 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2k8q n ASN 133 N -2.05 -5.47 -0.40 -3.46 2.85 -1.26 -5.23 115.26 100.24 2k8q n ASN 133 Ca -0.07 -0.28 0.14 0.00 -0.11 0.00 0.00 54.58 54.26 2k8q n ASN 133 Cb 0.51 -4.27 0.59 0.00 1.24 0.00 0.00 39.78 37.86 2k8q n ASN 133 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74