#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8q h ILE 2 N 0.00 0.92 -2.91 -0.61 2.04 -1.96 -3.47 117.51 111.52 2k8q h ILE 2 Ca 0.00 -2.44 -0.59 0.00 1.00 0.00 0.00 64.86 62.84 2k8q h ILE 2 Cb 0.00 2.70 0.15 0.00 -0.74 0.00 0.00 36.82 38.92 2k8q h ILE 2 CO 0.00 0.80 -0.12 1.07 0.00 0.00 0.00 178.15 179.90 2k8q n THR 3 N -3.71 2.40 0.00 -0.27 5.66 -1.26 -4.98 114.28 112.12 2k8q n THR 3 Ca -0.26 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.24 2k8q n THR 3 Cb 1.00 -0.88 0.00 0.00 -1.55 0.00 0.00 70.33 68.91 2k8q n THR 3 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2k8q n PRO 4 N 0.06 0.00 -4.33 1.09 -0.04 -1.26 -4.98 135.00 125.54 2k8q n PRO 4 Ca 0.11 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.34 2k8q n PRO 4 Cb 0.42 -0.47 -0.12 0.00 -0.04 0.00 0.00 33.50 33.30 2k8q n PRO 4 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2k8q s ARG 5 N -0.22 1.25 -0.27 0.54 3.00 -1.26 -5.08 118.95 116.91 2k8q s ARG 5 Ca 0.00 -1.35 -0.25 0.00 0.00 0.00 0.00 55.73 54.14 2k8q s ARG 5 Cb 0.00 -1.40 0.09 0.00 0.00 0.00 0.00 34.95 33.64 2k8q s ARG 5 CO 0.00 0.30 0.85 -0.59 0.00 0.00 0.00 175.30 175.86 2k8q s PHE 6 N -1.74 -0.66 -0.02 -0.53 -0.12 -1.26 -1.26 117.98 112.39 2k8q s PHE 6 Ca 0.13 1.62 0.06 0.00 -0.05 0.00 0.00 56.93 58.69 2k8q s PHE 6 Cb -0.07 0.31 -0.01 0.00 -0.63 0.00 0.00 43.02 42.61 2k8q s PHE 6 CO 0.06 -0.32 -0.20 -1.12 -0.05 0.00 0.00 175.22 173.59 2k8q s SER 7 N 0.33 2.38 -0.03 1.98 0.01 0.37 -4.99 113.70 113.76 2k8q s SER 7 Ca 0.01 -0.37 0.03 0.00 1.31 0.00 0.00 55.95 56.92 2k8q s SER 7 Cb -0.05 -0.37 -0.03 0.00 0.21 0.00 0.00 66.02 65.78 2k8q s SER 7 CO -0.02 0.23 -0.08 -0.63 0.41 0.00 0.00 173.24 173.15 2k8q s ILE 8 N -0.35 3.54 0.05 1.44 1.01 -1.26 0.39 121.20 126.02 2k8q s ILE 8 Ca 0.05 -0.68 0.06 0.00 0.00 0.00 0.00 60.65 60.07 2k8q s ILE 8 Cb -0.09 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.87 2k8q s ILE 8 CO 0.00 0.49 -0.17 -0.89 0.00 0.00 0.00 174.94 174.37 2k8q s THR 9 N -0.89 1.34 0.01 2.92 2.01 0.88 -4.89 115.64 117.03 2k8q s THR 9 Ca 0.15 -1.17 0.06 0.00 0.31 0.00 0.00 61.69 61.04 2k8q s THR 9 Cb -0.11 -1.21 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 2k8q s THR 9 CO 0.04 0.01 -0.17 0.00 -0.69 0.00 0.00 174.62 173.82 2k8q s GLN 10 N -1.34 2.21 0.40 4.92 -2.07 -1.26 -1.09 119.66 121.43 2k8q s GLN 10 Ca 0.03 -0.89 0.04 0.00 -1.82 0.00 0.00 55.36 52.71 2k8q s GLN 10 Cb -0.09 -2.25 -0.03 0.00 -1.09 0.00 0.00 33.01 29.55 2k8q s GLN 10 CO 0.02 0.56 0.10 -0.51 -1.32 0.00 0.00 175.29 174.15 2k8q s ASP 11 N -1.24 2.82 -0.14 12.60 1.01 -0.78 -4.95 116.67 125.98 2k8q s ASP 11 Ca 0.14 -1.61 0.09 0.00 0.71 0.00 0.00 52.55 51.87 2k8q s ASP 11 Cb -0.11 0.39 0.50 0.00 1.01 0.00 0.00 42.92 44.71 2k8q s ASP 11 CO 0.04 -0.86 1.26 -1.84 0.21 0.00 0.00 175.17 173.98 2k8q n GLU 12 N -0.90 3.35 0.00 8.23 0.28 -1.26 -4.20 120.64 126.14 2k8q n GLU 12 Ca -0.06 -1.91 0.00 0.00 -0.16 0.00 0.00 57.16 55.03 2k8q n GLU 12 Cb 0.65 -1.95 0.00 0.00 1.43 0.00 0.00 31.44 31.57 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 0.39 0.00 -3.87 3.44 0.28 -1.26 -3.17 120.64 116.46 2k8q n GLU 13 Ca 0.17 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 57.07 2k8q n GLU 13 Cb 0.82 -0.37 0.01 0.00 1.43 0.00 0.00 31.44 33.33 2k8q n GLU 13 CO 0.00 0.00 0.00 -0.59 -0.16 0.00 0.00 177.13 176.38 2k8q s PHE 14 N -1.07 0.34 -0.06 -1.84 -0.71 -1.26 -4.18 117.98 109.20 2k8q s PHE 14 Ca 0.00 -0.92 -0.01 0.00 -1.04 0.00 0.00 56.93 54.96 2k8q s PHE 14 Cb 0.00 0.64 -0.03 0.00 -1.21 0.00 0.00 43.02 42.42 2k8q s PHE 14 CO 0.00 -1.49 0.02 0.42 -1.34 0.00 0.00 175.22 172.83 2k8q s ILE 15 N -2.42 4.42 -0.26 -4.49 -1.09 -0.10 -1.86 121.20 115.40 2k8q s ILE 15 Ca 0.19 -0.33 0.02 0.00 -2.23 0.00 0.00 60.65 58.30 2k8q s ILE 15 Cb -0.04 -2.91 0.07 0.00 -1.58 0.00 0.00 42.46 37.99 2k8q s ILE 15 CO 0.14 0.51 -0.06 0.12 -1.23 0.00 0.00 174.94 174.42 2k8q s PHE 16 N -0.99 2.97 -0.24 3.97 5.36 -0.25 -2.33 117.98 126.47 2k8q s PHE 16 Ca 0.16 -2.20 -0.11 0.00 -0.96 0.00 0.00 56.93 53.82 2k8q s PHE 16 Cb -0.12 -1.93 -0.05 0.00 -0.34 0.00 0.00 43.02 40.58 2k8q s PHE 16 CO 0.06 -0.85 0.20 -1.17 -1.46 0.00 0.00 175.22 172.00 2k8q s LEU 17 N 1.20 4.11 -0.09 6.12 2.96 -0.06 -0.08 118.68 132.83 2k8q s LEU 17 Ca -0.04 0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 54.02 2k8q s LEU 17 Cb -0.19 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.29 2k8q s LEU 17 CO -0.07 0.03 -0.05 -0.75 -1.32 0.00 0.00 176.35 174.19 2k8q s LYS 18 N 1.19 3.03 -0.02 1.98 2.20 0.16 -0.27 119.74 128.01 2k8q s LYS 18 Ca 0.09 -0.51 0.04 0.00 -0.36 0.00 0.00 55.97 55.23 2k8q s LYS 18 Cb -0.14 -2.71 -0.01 0.00 -1.51 0.00 0.00 37.83 33.46 2k8q s LYS 18 CO 0.06 0.56 -0.15 0.42 -0.36 0.00 0.00 175.35 175.88 2k8q s ILE 19 N -0.52 1.22 -0.19 5.43 1.09 -0.33 -0.48 121.20 127.42 2k8q s ILE 19 Ca 0.08 -0.64 -0.09 0.00 -1.10 0.00 0.00 60.65 58.90 2k8q s ILE 19 Cb -0.12 -1.03 -0.05 0.00 -1.06 0.00 0.00 42.46 40.20 2k8q s ILE 19 CO 0.02 0.35 0.12 -0.36 -0.10 0.00 0.00 174.94 174.97 2k8q s PHE 20 N -0.21 3.41 0.14 3.97 0.08 -0.39 -1.02 117.98 123.97 2k8q s PHE 20 Ca 0.03 0.32 -0.13 0.00 0.12 0.00 0.00 56.93 57.27 2k8q s PHE 20 Cb -0.08 -2.12 0.02 0.00 -0.57 0.00 0.00 43.02 40.27 2k8q s PHE 20 CO 0.00 0.33 0.34 0.96 -0.10 0.00 0.00 175.22 176.75 2k8q s ILE 21 N 0.19 0.08 0.12 0.64 -4.36 -1.25 -4.26 121.20 112.37 2k8q s ILE 21 Ca 0.08 -0.93 -0.01 0.00 -0.26 0.00 0.00 60.65 59.53 2k8q s ILE 21 Cb -0.11 -1.42 0.03 0.00 1.25 0.00 0.00 42.46 42.20 2k8q s ILE 21 CO -0.01 -0.36 0.17 -1.20 0.24 0.00 0.00 174.94 173.78 2k8q n SER 22 N -0.20 0.14 -1.57 4.36 7.64 -1.26 -4.51 113.62 118.22 2k8q n SER 22 Ca -0.13 -1.14 0.04 0.00 1.01 0.00 0.00 58.87 58.66 2k8q n SER 22 Cb 0.63 -0.12 0.30 0.00 -1.01 0.00 0.00 64.21 64.01 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 -3.04 4.54 -3.17 6.43 3.02 -1.26 -4.96 115.26 116.82 2k8q n ASN 23 Ca 0.03 -2.72 -0.20 0.00 -0.03 0.00 0.00 54.58 51.65 2k8q n ASN 23 Cb 0.09 -0.65 0.19 0.00 -0.61 0.00 0.00 39.78 38.81 2k8q n ASN 23 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 2k8q n ILE 24 N 0.42 0.00 -1.51 2.41 -6.64 -1.26 -4.69 119.36 108.08 2k8q n ILE 24 Ca 0.22 0.00 -0.41 0.00 -1.77 0.00 0.00 62.75 60.79 2k8q n ILE 24 Cb 0.99 -0.65 -0.07 0.00 -1.44 0.00 0.00 39.64 38.46 2k8q n ILE 24 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 2k8q n ARG 25 N -4.35 0.77 -3.53 6.28 5.12 -1.26 -4.87 116.66 114.82 2k8q n ARG 25 Ca 0.09 0.08 -0.41 0.00 -1.93 0.00 0.00 57.85 55.67 2k8q n ARG 25 Cb 0.40 -2.66 -0.06 0.00 -1.16 0.00 0.00 32.46 28.97 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 10.12 3.56 0.81 -1.55 5.36 -1.26 -4.89 117.98 130.13 2k8q s PHE 26 Ca 1.12 -2.30 -0.11 0.00 -0.96 0.00 0.00 56.93 54.67 2k8q s PHE 26 Cb -0.64 -3.50 0.08 0.00 -0.34 0.00 0.00 43.02 38.61 2k8q s PHE 26 CO 0.38 -0.92 1.09 -1.12 -1.46 0.00 0.00 175.22 173.19 2k8q s SER 27 N 1.55 4.28 -0.14 6.13 0.01 -1.26 -4.99 113.70 119.29 2k8q s SER 27 Ca 0.16 1.50 0.17 0.00 1.31 0.00 0.00 55.95 59.09 2k8q s SER 27 Cb -0.17 -2.23 0.30 0.00 0.21 0.00 0.00 66.02 64.14 2k8q s SER 27 CO -0.05 -2.13 1.16 0.00 0.41 0.00 0.00 173.24 172.62 2k8q n ALA 28 N -3.55 2.46 -0.04 1.44 0.00 -1.26 -4.60 120.51 114.95 2k8q n ALA 28 Ca 0.07 -2.68 -0.04 0.00 0.00 0.00 0.00 53.44 50.80 2k8q n ALA 28 Cb 0.55 -0.38 -0.07 0.00 0.00 0.00 0.00 19.45 19.55 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 -1.34 0.56 1.09 0.00 0.31 -1.26 -4.56 118.33 113.13 2k8q n VAL 29 Ca 0.16 -0.35 0.12 0.00 -0.01 0.00 0.00 64.34 64.26 2k8q n VAL 29 Cb 0.65 -0.73 0.28 0.00 -0.91 0.00 0.00 33.84 33.12 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 2.46 -0.96 3.63 2.92 0.00 -1.26 -4.85 105.19 107.12 2k8q n GLY 30 Ca -0.13 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.80 3.84 -0.35 0.99 1.43 -1.26 -4.34 118.68 116.19 2k8q s LEU 31 Ca 0.16 1.33 -0.06 0.00 -1.03 0.00 0.00 54.13 54.53 2k8q s LEU 31 Cb 0.18 -3.54 0.20 0.00 0.03 0.00 0.00 46.19 43.06 2k8q s LEU 31 CO 0.64 -1.21 1.03 -0.70 0.23 0.00 0.00 176.35 176.33 2k8q s GLU 32 N 4.51 0.28 0.05 1.70 -6.30 -1.26 -4.97 118.70 112.71 2k8q s GLU 32 Ca 0.64 -0.20 -0.30 0.00 -2.50 0.00 0.00 54.97 52.61 2k8q s GLU 32 Cb -0.20 0.01 -0.04 0.00 0.00 0.00 0.00 34.13 33.90 2k8q s GLU 32 CO 0.27 -0.37 0.99 0.42 0.02 0.00 0.00 175.26 176.59 2k8q s ILE 33 N 1.45 4.65 -0.03 -3.70 1.01 -1.26 -4.39 121.20 118.92 2k8q s ILE 33 Ca 0.20 2.01 0.05 0.00 0.00 0.00 0.00 60.65 62.91 2k8q s ILE 33 Cb 0.07 -4.29 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 2k8q s ILE 33 CO -0.12 0.22 -0.19 -0.51 0.00 0.00 0.00 174.94 174.34 2k8q s ILE 34 N 0.58 1.52 -0.20 2.92 -1.16 -1.03 -5.00 121.20 118.83 2k8q s ILE 34 Ca 0.50 -0.79 -0.10 0.00 -0.51 0.00 0.00 60.65 59.75 2k8q s ILE 34 Cb -0.23 -1.28 -0.05 0.00 0.61 0.00 0.00 42.46 41.51 2k8q s ILE 34 CO 0.29 0.43 0.13 -0.63 -2.81 0.00 0.00 174.94 172.35 2k8q s ILE 35 N -0.19 5.40 0.30 2.00 1.09 -1.26 -0.88 121.20 127.66 2k8q s ILE 35 Ca 0.01 0.19 -0.05 0.00 -1.10 0.00 0.00 60.65 59.70 2k8q s ILE 35 Cb -0.10 -3.47 0.07 0.00 -1.06 0.00 0.00 42.46 37.90 2k8q s ILE 35 CO 0.01 0.43 0.33 1.67 -0.10 0.00 0.00 174.94 177.28 2k8q n GLN 36 N 3.59 -0.96 -0.26 2.79 -0.06 0.88 -4.63 117.38 118.73 2k8q n GLN 36 Ca -0.16 -0.52 0.18 0.00 -2.00 0.00 0.00 57.00 54.51 2k8q n GLN 36 Cb 0.52 -0.41 0.49 0.00 -4.06 0.00 0.00 30.24 26.78 2k8q n GLN 36 CO 0.00 0.00 0.00 1.05 -0.20 0.00 0.00 177.06 177.91 2k8q h GLU 37 N 0.00 0.44 0.00 3.69 4.11 -1.99 -3.39 114.58 117.44 2k8q h GLU 37 Ca -0.11 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.29 2k8q h GLU 37 Cb 0.33 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2k8q h GLU 37 CO 0.08 0.29 -0.07 0.27 0.07 0.00 0.00 179.01 179.65 2k8q n ASN 38 N -4.54 -0.01 -4.33 3.06 6.94 -1.26 -4.07 115.26 111.06 2k8q n ASN 38 Ca 0.20 0.06 -0.29 0.00 -0.02 0.00 0.00 54.58 54.53 2k8q n ASN 38 Cb 0.69 0.05 0.18 0.00 -2.36 0.00 0.00 39.78 38.33 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 0.35 -0.04 -3.83 0.23 -1.26 -2.34 119.30 110.41 2k8q s MET 39 Ca 0.00 -0.02 0.06 0.00 -1.03 0.00 0.00 55.69 54.70 2k8q s MET 39 Cb 0.00 -1.78 -0.01 0.00 -1.53 0.00 0.00 34.83 31.52 2k8q s MET 39 CO 0.00 -2.67 -0.21 0.42 -2.03 0.00 0.00 175.02 170.53 2k8q s ILE 40 N -3.39 1.70 -0.23 3.16 1.01 -0.25 -0.08 121.20 123.11 2k8q s ILE 40 Ca 0.69 -0.88 -0.06 0.00 0.00 0.00 0.00 60.65 60.39 2k8q s ILE 40 Cb -0.10 -1.44 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 2k8q s ILE 40 CO 0.54 0.48 0.02 -0.63 0.00 0.00 0.00 174.94 175.35 2k8q s ILE 41 N -0.19 3.95 -0.56 2.92 -1.09 -0.06 -1.48 121.20 124.69 2k8q s ILE 41 Ca 0.00 -0.30 -0.18 0.00 -2.23 0.00 0.00 60.65 57.94 2k8q s ILE 41 Cb -0.11 -2.82 0.10 0.00 -1.58 0.00 0.00 42.46 38.04 2k8q s ILE 41 CO 0.02 0.38 0.61 0.12 -1.23 0.00 0.00 174.94 174.84 2k8q s PHE 42 N 1.50 3.09 -0.22 3.97 5.36 0.16 -2.48 117.98 129.35 2k8q s PHE 42 Ca 0.06 -0.97 0.22 0.00 -0.96 0.00 0.00 56.93 55.27 2k8q s PHE 42 Cb -0.15 -3.81 -0.30 0.00 -0.34 0.00 0.00 43.02 38.43 2k8q s PHE 42 CO 0.01 -1.14 0.59 1.58 -1.46 0.00 0.00 175.22 174.80 2k8q n HIS 43 N 5.94 0.05 -0.84 10.12 -0.00 -1.26 -1.55 115.22 127.67 2k8q n HIS 43 Ca -0.10 0.01 -0.33 0.00 0.46 0.00 0.00 57.72 57.76 2k8q n HIS 43 Cb 0.42 -0.43 0.13 0.00 -0.12 0.00 0.00 29.99 30.00 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 -2.14 1.65 -1.22 0.27 0.00 -1.26 -4.70 117.00 109.60 2k8q n LEU 44 Ca -0.02 0.42 0.15 0.00 0.00 0.00 0.00 56.01 56.56 2k8q n LEU 44 Cb 0.52 -1.34 -0.07 0.00 0.00 0.00 0.00 43.42 42.54 2k8q n LEU 44 CO 0.45 -2.85 -0.46 -1.20 0.00 0.00 0.00 177.39 173.33 2k8q n SER 45 N -2.44 -7.04 0.00 1.96 7.64 -1.26 -4.23 113.62 108.25 2k8q n SER 45 Ca 0.10 1.04 0.07 0.00 1.01 0.00 0.00 58.87 61.09 2k8q n SER 45 Cb 0.52 -4.07 0.35 0.00 -1.01 0.00 0.00 64.21 60.00 2k8q n SER 45 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2k8q n PRO 46 N -4.02 0.15 -4.52 1.43 -0.04 -1.26 -4.62 135.00 122.12 2k8q n PRO 46 Ca -0.05 0.18 -0.33 0.00 -0.04 0.00 0.00 63.50 63.25 2k8q n PRO 46 Cb 0.58 -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 -2.70 2.92 -0.13 0.54 2.02 -1.26 -5.07 117.35 113.68 2k8q s TYR 47 Ca 0.12 -0.52 -0.17 0.00 -0.37 0.00 0.00 57.07 56.13 2k8q s TYR 47 Cb 0.10 -1.92 -0.04 0.00 -0.40 0.00 0.00 41.96 39.69 2k8q s TYR 47 CO 0.23 -0.17 0.43 -0.47 -1.57 0.00 0.00 175.55 174.01 2k8q s TYR 48 N 0.47 3.51 0.05 2.71 6.14 -1.26 -4.68 117.35 124.28 2k8q s TYR 48 Ca -0.06 0.82 0.05 0.00 0.64 0.00 0.00 57.07 58.52 2k8q s TYR 48 Cb -0.15 -2.49 -0.02 0.00 0.42 0.00 0.00 41.96 39.71 2k8q s TYR 48 CO 0.04 0.20 -0.15 -1.17 0.64 0.00 0.00 175.55 175.10 2k8q s LEU 49 N 0.54 2.20 -0.08 6.97 2.96 -0.60 -3.83 118.68 126.84 2k8q s LEU 49 Ca 0.24 -0.51 0.05 0.00 -0.22 0.00 0.00 54.13 53.68 2k8q s LEU 49 Cb -0.15 -0.65 -0.00 0.00 0.50 0.00 0.00 46.19 45.89 2k8q s LEU 49 CO 0.09 0.03 -0.24 -0.60 -1.32 0.00 0.00 176.35 174.31 2k8q s ARG 50 N -1.32 2.77 -0.22 1.98 3.52 -1.26 -0.67 118.95 123.76 2k8q s ARG 50 Ca 0.02 -0.87 0.02 0.00 -0.13 0.00 0.00 55.73 54.77 2k8q s ARG 50 Cb -0.09 -2.20 0.04 0.00 -1.56 0.00 0.00 34.95 31.14 2k8q s ARG 50 CO 0.02 0.26 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.10 2k8q s LEU 51 N 0.12 2.72 -0.40 -0.88 1.43 -0.55 -4.21 118.68 116.92 2k8q s LEU 51 Ca -0.12 -0.99 -0.05 0.00 -1.03 0.00 0.00 54.13 51.94 2k8q s LEU 51 Cb -0.16 -1.51 0.09 0.00 0.03 0.00 0.00 46.19 44.64 2k8q s LEU 51 CO 0.06 -0.09 0.19 -0.60 0.23 0.00 0.00 176.35 176.15 2k8q s ARG 52 N 1.21 2.31 0.22 1.70 3.00 -1.24 -1.09 118.95 125.05 2k8q s ARG 52 Ca -0.01 -1.59 -0.02 0.00 -1.00 0.00 0.00 55.73 53.11 2k8q s ARG 52 Cb -0.16 -3.59 -0.04 0.00 0.00 0.00 0.00 34.95 31.15 2k8q s ARG 52 CO -0.09 -0.95 0.43 -0.06 0.00 0.00 0.00 175.30 174.62 2k8q s PHE 53 N 1.27 3.48 -0.98 5.12 0.08 -1.26 -4.52 117.98 121.17 2k8q s PHE 53 Ca 0.04 0.41 0.14 0.00 0.12 0.00 0.00 56.93 57.64 2k8q s PHE 53 Cb -0.22 -1.91 0.62 0.00 -0.57 0.00 0.00 43.02 40.94 2k8q s PHE 53 CO -0.01 0.33 1.46 -0.35 -0.10 0.00 0.00 175.22 176.55 2k8q n PRO 54 N -0.75 0.01 -2.18 0.24 -0.04 -1.26 -4.76 135.00 126.25 2k8q n PRO 54 Ca -0.04 0.27 -0.07 0.00 -0.04 0.00 0.00 63.50 63.61 2k8q n PRO 54 Cb 0.54 -1.52 -0.00 0.00 -0.04 0.00 0.00 33.50 32.48 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 -1.53 -1.19 -4.40 0.54 8.25 -1.26 -5.14 115.22 110.48 2k8q n HIS 55 Ca 0.03 -0.66 -0.28 0.00 -0.26 0.00 0.00 57.72 56.55 2k8q n HIS 55 Cb 0.17 -0.13 -0.17 0.00 1.12 0.00 0.00 29.99 30.98 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 -2.64 2.07 0.42 -0.41 1.03 -1.26 -4.55 118.70 113.35 2k8q s GLU 56 Ca 0.08 -0.50 0.05 0.00 0.03 0.00 0.00 54.97 54.63 2k8q s GLU 56 Cb -0.01 -1.79 0.05 0.00 -0.80 0.00 0.00 34.13 31.58 2k8q s GLU 56 CO 0.05 -0.08 0.41 1.28 -1.33 0.00 0.00 175.26 175.60 2k8q n LEU 57 N 4.24 0.00 -3.82 1.83 4.77 -0.99 -3.57 117.00 119.46 2k8q n LEU 57 Ca -0.19 -2.03 -0.12 0.00 -0.03 0.00 0.00 56.01 53.64 2k8q n LEU 57 Cb 0.51 -0.13 -0.11 0.00 -2.33 0.00 0.00 43.42 41.36 2k8q n LEU 57 CO 0.23 -0.56 -0.14 -0.51 -1.33 0.00 0.00 177.39 175.09 2k8q s ILE 58 N -1.89 0.03 -0.45 -0.08 2.07 -0.96 -4.30 121.20 115.62 2k8q s ILE 58 Ca 0.31 -0.28 -0.15 0.00 -1.41 0.00 0.00 60.65 59.12 2k8q s ILE 58 Cb -0.02 -0.37 0.06 0.00 0.13 0.00 0.00 42.46 42.25 2k8q s ILE 58 CO 0.20 -0.16 0.35 -0.62 -1.91 0.00 0.00 174.94 172.80 2k8q s ASP 59 N -0.54 6.09 0.00 4.50 2.15 -1.26 -3.68 116.67 123.93 2k8q s ASP 59 Ca -0.06 -1.20 0.00 0.00 0.43 0.00 0.00 52.55 51.71 2k8q s ASP 59 Cb -0.04 -2.16 0.00 0.00 -0.30 0.00 0.00 42.92 40.42 2k8q s ASP 59 CO 0.01 -0.57 0.00 -0.67 -0.17 0.00 0.00 175.17 173.77 2k8q n ASP 60 N 5.16 1.61 0.21 -0.34 -0.08 -1.26 -4.99 116.55 116.87 2k8q n ASP 60 Ca -0.12 -0.85 0.07 0.00 -1.51 0.00 0.00 54.79 52.39 2k8q n ASP 60 Cb 0.45 0.00 0.47 0.00 2.34 0.00 0.00 41.12 44.37 2k8q n ASP 60 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 2k8q h GLU 61 N 0.00 0.00 -0.02 -0.67 4.11 -2.03 -2.71 114.58 113.26 2k8q h GLU 61 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.28 2k8q h GLU 61 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2k8q h GLU 61 CO 0.00 0.28 -0.68 0.07 0.07 0.00 0.00 179.01 178.75 2k8q h ARG 62 N 0.00 0.09 -6.67 1.06 -0.00 -1.99 -3.44 114.38 103.43 2k8q h ARG 62 Ca -0.00 -0.07 -0.53 0.00 -0.00 0.00 0.00 59.98 59.38 2k8q h ARG 62 Cb 0.67 0.01 0.05 0.00 -0.00 0.00 0.00 29.97 30.70 2k8q h ARG 62 CO 0.04 0.73 0.78 -1.54 -0.00 0.00 0.00 179.97 179.98 2k8q s SER 63 N -6.86 6.68 -0.23 0.08 1.04 -1.02 -4.88 113.70 108.50 2k8q s SER 63 Ca -0.02 2.59 -0.37 0.00 0.48 0.00 0.00 55.95 58.63 2k8q s SER 63 Cb 0.12 -2.61 0.15 0.00 0.10 0.00 0.00 66.02 63.78 2k8q s SER 63 CO 0.78 -0.72 1.36 0.28 0.98 0.00 0.00 173.24 175.93 2k8q s THR 64 N 0.48 0.00 0.01 2.02 -1.32 -0.89 -4.84 115.64 111.10 2k8q s THR 64 Ca 0.63 -0.01 0.05 0.00 -1.21 0.00 0.00 61.69 61.15 2k8q s THR 64 Cb -0.41 -1.20 -0.02 0.00 -1.51 0.00 0.00 72.50 69.36 2k8q s THR 64 CO 0.38 0.00 -0.16 0.00 -2.21 0.00 0.00 174.62 172.63 2k8q s ALA 65 N -2.11 1.33 0.11 11.08 0.00 -1.26 -0.18 121.76 130.74 2k8q s ALA 65 Ca 0.12 -0.75 0.09 0.00 0.00 0.00 0.00 51.96 51.42 2k8q s ALA 65 Cb 0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 2k8q s ALA 65 CO -0.03 0.31 -0.23 -0.65 0.00 0.00 0.00 175.76 175.16 2k8q s GLN 66 N -0.63 1.22 -0.13 0.00 -0.21 0.05 -4.98 119.66 114.98 2k8q s GLN 66 Ca 0.05 -1.23 -0.23 0.00 0.02 0.00 0.00 55.36 53.98 2k8q s GLN 66 Cb -0.07 -1.55 -0.03 0.00 1.00 0.00 0.00 33.01 32.36 2k8q s GLN 66 CO 0.00 0.36 0.69 -0.47 -2.12 0.00 0.00 175.29 173.75 2k8q s TYR 67 N -1.15 3.49 -0.31 0.91 5.04 -1.26 -1.51 117.35 122.55 2k8q s TYR 67 Ca 0.09 1.13 -0.12 0.00 -2.44 0.00 0.00 57.07 55.74 2k8q s TYR 67 Cb -0.10 -2.82 -0.03 0.00 0.35 0.00 0.00 41.96 39.36 2k8q s TYR 67 CO 0.05 -0.04 0.20 -0.51 -1.34 0.00 0.00 175.55 173.91 2k8q s ASP 68 N 0.96 5.94 -0.04 4.32 1.11 0.95 -4.95 116.67 124.96 2k8q s ASP 68 Ca 0.34 -0.28 0.07 0.00 0.18 0.00 0.00 52.55 52.86 2k8q s ASP 68 Cb -0.17 -2.10 -0.24 0.00 1.07 0.00 0.00 42.92 41.48 2k8q s ASP 68 CO 0.14 -0.16 0.66 0.77 1.18 0.00 0.00 175.17 177.76 2k8q h SER 69 N 8.42 0.11 -0.54 0.27 4.64 -1.93 0.12 113.55 124.64 2k8q h SER 69 Ca -0.33 -0.23 0.15 0.00 -0.47 0.00 0.00 61.79 60.91 2k8q h SER 69 Cb 1.17 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 2k8q h SER 69 CO 0.60 1.20 0.39 0.07 -0.87 0.00 0.00 176.83 178.22 2k8q h LYS 70 N 0.02 0.06 0.00 4.77 5.09 -1.95 -2.50 116.57 122.06 2k8q h LYS 70 Ca -0.29 -0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.44 2k8q h LYS 70 Cb 2.00 -0.01 0.00 0.00 0.10 0.00 0.00 32.23 34.32 2k8q h LYS 70 CO 0.09 0.04 0.00 -3.47 -2.09 0.00 0.00 179.45 174.02 2k8q n ASP 71 N -4.40 0.61 -2.10 7.07 2.03 -1.25 -5.00 116.55 113.52 2k8q n ASP 71 Ca 0.10 -0.91 -0.20 0.00 0.52 0.00 0.00 54.79 54.30 2k8q n ASP 71 Cb 0.58 0.10 -0.03 0.00 -0.72 0.00 0.00 41.12 41.05 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 -1.54 -4.01 -0.67 1.02 0.24 -4.91 120.64 110.66 2k8q n GLU 72 Ca 0.00 1.03 -0.27 0.00 -0.02 0.00 0.00 57.16 57.90 2k8q n GLU 72 Cb 0.06 -5.57 -0.03 0.00 -0.02 0.00 0.00 31.44 25.88 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 -2.74 1.89 -0.20 0.00 -1.09 -0.19 -0.03 121.20 118.84 2k8q s ILE 74 Ca 0.32 -0.95 -0.04 0.00 -2.23 0.00 0.00 60.65 57.75 2k8q s ILE 74 Cb -0.01 -1.62 -0.02 0.00 -1.58 0.00 0.00 42.46 39.23 2k8q s ILE 74 CO 0.19 0.52 -0.02 0.54 -1.23 0.00 0.00 174.94 174.95 2k8q s ASN 75 N 0.10 4.67 -0.14 3.58 2.20 -0.57 -1.19 114.94 123.59 2k8q s ASN 75 Ca -0.10 -0.24 -0.00 0.00 -0.94 0.00 0.00 52.86 51.58 2k8q s ASN 75 Cb -0.15 -1.79 -0.01 0.00 -2.00 0.00 0.00 41.25 37.30 2k8q s ASN 75 CO 0.05 0.06 -0.13 -0.69 -2.94 0.00 0.00 177.10 173.45 2k8q s VAL 76 N 1.00 2.97 -0.06 3.54 1.01 0.63 -0.77 120.40 128.72 2k8q s VAL 76 Ca 0.01 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2k8q s VAL 76 Cb -0.14 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 2k8q s VAL 76 CO 0.01 0.51 -0.09 -0.75 0.00 0.00 0.00 175.10 174.79 2k8q s LYS 77 N 0.54 2.67 -0.16 2.72 2.36 0.75 -0.88 119.74 127.74 2k8q s LYS 77 Ca -0.08 -0.60 -0.10 0.00 -2.55 0.00 0.00 55.97 52.64 2k8q s LYS 77 Cb -0.16 -2.53 0.06 0.00 -1.05 0.00 0.00 37.83 34.15 2k8q s LYS 77 CO 0.04 0.65 0.40 0.54 1.55 0.00 0.00 175.35 178.52 2k8q s VAL 78 N -0.81 -0.02 0.48 4.02 0.11 -0.99 -2.09 120.40 121.10 2k8q s VAL 78 Ca 0.13 0.09 -0.19 0.00 -2.93 0.00 0.00 61.98 59.07 2k8q s VAL 78 Cb -0.11 -0.59 -0.09 0.00 -1.53 0.00 0.00 36.38 34.06 2k8q s VAL 78 CO 0.02 0.03 0.99 0.00 -3.33 0.00 0.00 175.10 172.81 2k8q s ALA 79 N 1.24 2.99 0.36 1.54 0.00 -1.24 -0.92 121.76 125.73 2k8q s ALA 79 Ca -0.08 0.39 0.07 0.00 0.00 0.00 0.00 51.96 52.34 2k8q s ALA 79 Cb -0.08 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 2k8q s ALA 79 CO -0.11 -0.13 0.44 -1.59 0.00 0.00 0.00 175.76 174.37 2k8q s LYS 80 N -3.49 2.91 -0.03 0.00 -2.85 -1.26 -2.27 119.74 112.75 2k8q s LYS 80 Ca 0.62 -1.18 -0.10 0.00 -1.00 0.00 0.00 55.97 54.31 2k8q s LYS 80 Cb -0.11 -2.68 -0.31 0.00 -2.06 0.00 0.00 37.83 32.66 2k8q s LYS 80 CO 0.21 -0.03 0.76 -0.07 0.10 0.00 0.00 175.35 176.32 2k8q h LEU 81 N 0.94 0.62 -7.93 2.77 3.38 -1.88 -3.45 115.31 109.76 2k8q h LEU 81 Ca -0.44 -0.86 -0.64 0.00 0.09 0.00 0.00 57.88 56.03 2k8q h LEU 81 Cb 1.26 -0.20 -0.36 0.00 0.09 0.00 0.00 40.66 41.45 2k8q h LEU 81 CO 0.53 1.72 -0.84 0.20 0.09 0.00 0.00 178.44 180.14 2k8q s ASN 82 N -7.29 3.15 0.94 -0.43 0.01 -1.26 -5.12 114.94 104.94 2k8q s ASN 82 Ca -0.14 -0.71 -0.11 0.00 -0.71 0.00 0.00 52.86 51.20 2k8q s ASN 82 Cb 0.05 -1.34 0.16 0.00 0.41 0.00 0.00 41.25 40.53 2k8q s ASN 82 CO 0.87 -0.06 1.11 -0.75 -1.51 0.00 0.00 177.10 176.75 2k8q s LYS 83 N 1.36 0.85 -1.46 -0.60 2.20 -1.26 -2.95 119.74 117.88 2k8q s LYS 83 Ca 0.03 1.25 0.00 0.00 -0.36 0.00 0.00 55.97 56.88 2k8q s LYS 83 Cb -0.14 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.45 2k8q s LYS 83 CO -0.11 -2.65 0.00 0.09 -0.36 0.00 0.00 175.35 172.33 2k8q n ASN 84 N -4.21 -5.34 -4.66 1.43 5.03 -1.19 -4.95 115.26 101.36 2k8q n ASN 84 Ca 0.09 0.34 -0.37 0.00 0.87 0.00 0.00 54.58 55.51 2k8q n ASN 84 Cb 0.53 -4.05 -0.09 0.00 -1.02 0.00 0.00 39.78 35.16 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 -3.10 4.12 0.58 3.52 2.12 -1.15 -5.01 118.70 119.77 2k8q s GLU 85 Ca 0.00 -0.04 0.09 0.00 0.36 0.00 0.00 54.97 55.39 2k8q s GLU 85 Cb 0.00 -3.54 0.09 0.00 0.26 0.00 0.00 34.13 30.93 2k8q s GLU 85 CO 0.00 -0.00 0.77 1.52 -0.54 0.00 0.00 175.26 177.01 2k8q s TYR 86 N 1.22 1.35 0.11 5.30 1.13 -1.26 -4.73 117.35 120.46 2k8q s TYR 86 Ca 0.13 -0.75 0.04 0.00 -1.41 0.00 0.00 57.07 55.08 2k8q s TYR 86 Cb -0.14 -2.17 -0.04 0.00 -1.10 0.00 0.00 41.96 38.51 2k8q s TYR 86 CO 0.06 -1.14 -0.11 -0.06 -2.51 0.00 0.00 175.55 171.80 2k8q s PHE 87 N -2.69 1.14 -0.05 -3.49 0.40 -1.26 -4.99 117.98 107.04 2k8q s PHE 87 Ca 0.60 -0.65 -0.00 0.00 -0.60 0.00 0.00 56.93 56.27 2k8q s PHE 87 Cb -0.05 -0.61 -0.03 0.00 0.51 0.00 0.00 43.02 42.84 2k8q s PHE 87 CO 0.38 0.03 -0.05 -1.91 0.70 0.00 0.00 175.22 174.37 2k8q n GLU 88 N 0.46 0.12 0.32 0.44 0.00 -1.26 -4.62 120.64 116.10 2k8q n GLU 88 Ca -0.15 0.03 0.19 0.00 0.00 0.00 0.00 57.16 57.23 2k8q n GLU 88 Cb 0.58 -1.02 1.05 0.00 0.00 0.00 0.00 31.44 32.05 2k8q n GLU 88 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2k8q h ASP 89 N -0.04 0.00 0.23 4.31 5.19 -1.96 -0.91 116.42 123.25 2k8q h ASP 89 Ca -0.11 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.29 2k8q h ASP 89 Cb 1.16 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.67 2k8q h ASP 89 CO -0.03 0.01 -0.03 -0.07 -3.12 0.00 0.00 179.24 176.00 2k8q h LEU 90 N 0.00 0.00 -0.89 1.55 4.07 -1.94 -1.26 115.31 116.84 2k8q h LEU 90 Ca -0.00 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.85 2k8q h LEU 90 Cb 0.03 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.76 2k8q h LEU 90 CO 0.00 0.03 -0.52 -0.78 -1.08 0.00 0.00 178.44 176.10 2k8q h ASP 91 N 0.00 0.00 -3.47 -0.43 1.82 -1.46 -3.42 116.42 109.46 2k8q h ASP 91 Ca -0.00 0.00 -0.66 0.00 -0.39 0.00 0.00 57.03 55.97 2k8q h ASP 91 Cb 0.15 0.00 -0.28 0.00 0.68 0.00 0.00 39.33 39.88 2k8q h ASP 91 CO 0.00 0.52 -0.71 -0.76 -1.61 0.00 0.00 179.24 176.68 2k8q s LEU 92 N -7.54 3.17 0.00 2.28 2.01 -0.48 -4.97 118.68 113.15 2k8q s LEU 92 Ca -0.01 -0.57 0.14 0.00 0.01 0.00 0.00 54.13 53.70 2k8q s LEU 92 Cb 0.12 -1.75 0.61 0.00 0.01 0.00 0.00 46.19 45.18 2k8q s LEU 92 CO 0.74 -0.08 1.45 -0.81 1.01 0.00 0.00 176.35 178.66 2k8q n PRO 93 N 4.78 0.01 0.03 1.29 -0.04 -1.26 -2.09 135.00 137.72 2k8q n PRO 93 Ca -0.17 0.25 0.11 0.00 -0.04 0.00 0.00 63.50 63.65 2k8q n PRO 93 Cb 0.49 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.43 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 -1.49 0.19 0.23 0.52 -2.24 -1.26 -3.94 114.28 106.29 2k8q n THR 94 Ca 0.04 -0.32 0.12 0.00 -2.27 0.00 0.00 64.05 61.62 2k8q n THR 94 Cb 0.16 0.15 0.48 0.00 -2.10 0.00 0.00 70.33 69.02 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 0.05 -0.78 6.56 -1.68 -2.49 116.57 118.23 2k8q h LYS 95 Ca 0.00 0.00 -0.21 0.00 -1.06 0.00 0.00 60.65 59.38 2k8q h LYS 95 Cb 0.80 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.45 2k8q h LYS 95 CO 0.00 0.15 -1.12 -0.07 -2.06 0.00 0.00 179.45 176.35 2k8q h LEU 96 N 0.00 0.16 -1.86 2.94 -0.00 -1.70 -3.35 115.31 111.50 2k8q h LEU 96 Ca -0.00 -0.74 -0.01 0.00 -0.00 0.00 0.00 57.88 57.13 2k8q h LEU 96 Cb 0.73 -0.05 -0.00 0.00 -0.00 0.00 0.00 40.66 41.33 2k8q h LEU 96 CO 0.02 1.47 0.02 -0.07 -0.00 0.00 0.00 178.44 179.87 2k8q h LEU 97 N -0.70 0.09 -8.49 1.67 4.07 -1.68 -3.30 115.31 106.98 2k8q h LEU 97 Ca -0.27 -0.00 -0.60 0.00 0.08 0.00 0.00 57.88 57.09 2k8q h LEU 97 Cb 1.45 -0.02 -0.11 0.00 1.08 0.00 0.00 40.66 43.06 2k8q h LEU 97 CO -0.06 0.10 0.67 0.00 -1.08 0.00 0.00 178.44 178.07 2k8q s ALA 98 N -5.07 3.10 0.36 1.53 0.00 -0.94 -5.01 121.76 115.72 2k8q s ALA 98 Ca -0.05 -1.20 0.09 0.00 0.00 0.00 0.00 51.96 50.80 2k8q s ALA 98 Cb 0.17 -3.83 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 2k8q s ALA 98 CO 0.69 -2.51 -0.06 -0.98 0.00 0.00 0.00 175.76 172.90 2k8q s ARG 99 N 4.25 1.88 -0.45 0.00 3.03 -1.26 -4.89 118.95 121.51 2k8q s ARG 99 Ca 0.33 -1.96 -0.27 0.00 2.03 0.00 0.00 55.73 55.85 2k8q s ARG 99 Cb -0.12 -1.71 0.03 0.00 -1.03 0.00 0.00 34.95 32.12 2k8q s ARG 99 CO 0.20 0.09 1.03 -1.14 -1.13 0.00 0.00 175.30 174.35 2k8q s GLN 100 N -3.65 3.69 0.00 3.89 0.74 -1.26 -4.66 119.66 118.41 2k8q s GLN 100 Ca 0.33 0.45 0.00 0.00 0.05 0.00 0.00 55.36 56.19 2k8q s GLN 100 Cb 0.04 -3.89 0.00 0.00 1.10 0.00 0.00 33.01 30.26 2k8q s GLN 100 CO 0.17 -1.23 0.00 0.41 -0.55 0.00 0.00 175.29 174.09 2k8q n GLY 101 N 4.75 -1.08 2.00 2.59 0.00 -1.26 -5.04 105.19 107.15 2k8q n GLY 101 Ca 0.09 0.28 -0.18 0.00 0.00 0.00 0.00 46.02 46.21 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 3.76 -0.47 1.61 8.00 -1.26 -4.13 116.55 124.06 2k8q n ASP 102 Ca 0.00 -3.30 0.07 0.00 0.71 0.00 0.00 54.79 52.27 2k8q n ASP 102 Cb 0.00 -0.77 0.15 0.00 -0.02 0.00 0.00 41.12 40.48 2k8q n ASP 102 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2k8q n LEU 103 N -0.75 2.20 0.03 0.64 7.99 -1.26 -4.66 117.00 121.19 2k8q n LEU 103 Ca 0.48 -3.19 0.06 0.00 -0.01 0.00 0.00 56.01 53.35 2k8q n LEU 103 Cb 1.45 -0.40 -0.10 0.00 -0.11 0.00 0.00 43.42 44.26 2k8q n LEU 103 CO 0.49 0.97 -0.45 0.00 -1.51 0.00 0.00 177.39 176.88 2k8q n ALA 104 N -1.01 2.37 0.00 -1.18 0.00 -1.26 -5.06 120.51 114.37 2k8q n ALA 104 Ca 0.15 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2k8q n ALA 104 Cb 0.71 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.32 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 1.32 4.45 3.55 0.00 0.00 -1.26 -5.03 105.19 108.21 2k8q n GLY 105 Ca -0.07 -1.32 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 2k8q n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k8q n ALA 106 N -1.79 0.91 -3.69 4.61 0.00 -1.26 -4.92 120.51 114.37 2k8q n ALA 106 Ca 0.00 -0.72 -0.35 0.00 0.00 0.00 0.00 53.44 52.38 2k8q n ALA 106 Cb 0.00 -3.03 -0.14 0.00 0.00 0.00 0.00 19.45 16.27 2k8q n ALA 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k8q s ASP 107 N 11.02 4.14 0.01 0.00 1.01 -1.26 -5.09 116.67 126.51 2k8q s ASP 107 Ca 1.03 -0.66 -0.26 0.00 0.71 0.00 0.00 52.55 53.37 2k8q s ASP 107 Cb -0.35 -1.67 0.06 0.00 1.01 0.00 0.00 42.92 41.97 2k8q s ASP 107 CO 0.31 -0.07 0.59 0.00 0.21 0.00 0.00 175.17 176.21 2k8q s ALA 108 N 1.38 -1.53 0.18 5.23 0.00 -1.26 -5.18 121.76 120.58 2k8q s ALA 108 Ca 0.03 0.90 0.10 0.00 0.00 0.00 0.00 51.96 52.99 2k8q s ALA 108 Cb -0.15 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 2k8q s ALA 108 CO -0.05 -0.46 -0.19 -0.48 0.00 0.00 0.00 175.76 174.57 2k8q s LEU 109 N -1.67 2.62 -0.25 0.00 2.34 -1.26 -5.13 118.68 115.32 2k8q s LEU 109 Ca -0.08 -0.75 -0.07 0.00 0.06 0.00 0.00 54.13 53.30 2k8q s LEU 109 Cb -0.01 -1.35 0.12 0.00 -0.56 0.00 0.00 46.19 44.39 2k8q s LEU 109 CO 0.03 0.12 0.52 -0.89 -1.06 0.00 0.00 176.35 175.07 2k8q s THR 110 N -1.62 -0.81 0.22 5.48 2.01 -1.26 -5.15 115.64 114.51 2k8q s THR 110 Ca 0.22 0.06 -0.21 0.00 0.31 0.00 0.00 61.69 62.07 2k8q s THR 110 Cb -0.08 -0.84 -0.08 0.00 0.01 0.00 0.00 72.50 71.50 2k8q s THR 110 CO 0.11 0.02 0.74 -1.83 -0.69 0.00 0.00 174.62 172.97 2k8q s GLU 111 N 2.74 4.30 0.31 4.92 -1.05 -1.26 -5.08 118.70 123.58 2k8q s GLU 111 Ca 0.01 0.93 0.10 0.00 -0.15 0.00 0.00 54.97 55.85 2k8q s GLU 111 Cb -0.13 -2.92 -0.05 0.00 -0.44 0.00 0.00 34.13 30.60 2k8q s GLU 111 CO -0.16 0.41 -0.02 0.54 0.95 0.00 0.00 175.26 176.98 2k8q s ASN 112 N -1.59 4.22 -0.02 0.83 4.22 -1.26 -5.04 114.94 116.29 2k8q s ASN 112 Ca 0.43 -0.89 0.22 0.00 -2.14 0.00 0.00 52.86 50.47 2k8q s ASN 112 Cb -0.17 -0.60 -0.30 0.00 1.28 0.00 0.00 41.25 41.46 2k8q s ASN 112 CO 0.22 -0.13 0.49 0.41 -2.04 0.00 0.00 177.10 176.05 2k8q n THR 113 N -0.90 0.18 -3.57 0.54 -1.04 -1.26 -5.00 114.28 103.23 2k8q n THR 113 Ca -0.05 -0.54 -0.21 0.00 -2.04 0.00 0.00 64.05 61.21 2k8q n THR 113 Cb 0.61 -0.07 0.07 0.00 -1.82 0.00 0.00 70.33 69.12 2k8q n THR 113 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2k8q n ASP 114 N -2.34 -3.93 -4.81 8.00 9.92 -1.26 -4.97 116.55 117.15 2k8q n ASP 114 Ca -0.06 -0.62 -0.38 0.00 -0.53 0.00 0.00 54.79 53.20 2k8q n ASP 114 Cb 0.62 -4.86 -0.06 0.00 -0.64 0.00 0.00 41.12 36.18 2k8q n ASP 114 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k8q s ALA 115 N -3.37 3.55 0.20 2.24 0.00 -1.26 -5.09 121.76 118.03 2k8q s ALA 115 Ca 0.30 0.06 0.08 0.00 0.00 0.00 0.00 51.96 52.40 2k8q s ALA 115 Cb -0.13 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.27 2k8q s ALA 115 CO 0.75 0.39 -0.03 0.21 0.00 0.00 0.00 175.76 177.07 2k8q s LYS 116 N -1.39 2.26 0.20 0.00 2.47 -1.26 -5.14 119.74 116.87 2k8q s LYS 116 Ca 0.33 -1.25 0.03 0.00 -1.56 0.00 0.00 55.97 53.52 2k8q s LYS 116 Cb -0.19 -2.24 -0.05 0.00 -1.46 0.00 0.00 37.83 33.90 2k8q s LYS 116 CO 0.20 0.42 -0.02 0.15 0.16 0.00 0.00 175.35 176.26 2k8q s LYS 117 N -3.12 1.21 -0.02 4.03 -0.14 -1.26 -5.14 119.74 115.31 2k8q s LYS 117 Ca 0.28 -1.59 -0.23 0.00 -1.36 0.00 0.00 55.97 53.07 2k8q s LYS 117 Cb -0.08 -0.50 -0.05 0.00 -1.68 0.00 0.00 37.83 35.52 2k8q s LYS 117 CO 0.18 -0.08 0.68 0.95 -0.76 0.00 0.00 175.35 176.32 2k8q s THR 118 N -3.48 4.92 -0.28 2.17 -4.23 -1.26 -5.04 115.64 108.43 2k8q s THR 118 Ca 0.25 1.42 -0.01 0.00 -1.18 0.00 0.00 61.69 62.16 2k8q s THR 118 Cb 0.05 -4.02 0.13 0.00 1.34 0.00 0.00 72.50 70.00 2k8q s THR 118 CO 0.06 0.34 0.27 -1.58 -0.54 0.00 0.00 174.62 173.17 2k8q s GLN 119 N 0.23 0.29 -0.41 3.99 2.00 -1.26 -5.05 119.66 119.45 2k8q s GLN 119 Ca 0.35 -0.13 0.08 0.00 -2.00 0.00 0.00 55.36 53.67 2k8q s GLN 119 Cb -0.19 -0.78 0.27 0.00 0.80 0.00 0.00 33.01 33.11 2k8q s GLN 119 CO 0.19 -0.97 0.57 1.63 -0.50 0.00 0.00 175.29 176.21 2k8q n LYS 120 N 5.31 0.91 -0.17 1.67 4.76 -1.26 -5.12 118.16 124.24 2k8q n LYS 120 Ca -0.03 -3.36 -0.05 0.00 -2.87 0.00 0.00 58.31 52.00 2k8q n LYS 120 Cb 0.46 -1.37 0.04 0.00 -1.84 0.00 0.00 35.03 32.33 2k8q n LYS 120 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2k8q n PRO 121 N 1.18 -1.37 -3.69 1.97 -0.04 -1.26 -5.07 135.00 126.72 2k8q n PRO 121 Ca 0.22 -0.29 -0.24 0.00 -0.04 0.00 0.00 63.50 63.15 2k8q n PRO 121 Cb 0.54 -0.27 -0.17 0.00 -0.04 0.00 0.00 33.50 33.55 2k8q n PRO 121 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2k8q s LEU 122 N 0.00 0.49 -0.30 1.53 0.20 -1.26 -5.12 118.68 114.22 2k8q s LEU 122 Ca 0.12 -0.32 -0.10 0.00 0.69 0.00 0.00 54.13 54.52 2k8q s LEU 122 Cb -0.01 -0.32 -0.02 0.00 -0.43 0.00 0.00 46.19 45.41 2k8q s LEU 122 CO 0.09 -0.27 0.15 -0.63 -0.29 0.00 0.00 176.35 175.40 2k8q s ILE 123 N 2.06 4.71 0.03 6.68 1.01 -1.26 -5.09 121.20 129.33 2k8q s ILE 123 Ca 0.03 -0.31 -0.03 0.00 0.00 0.00 0.00 60.65 60.34 2k8q s ILE 123 Cb -0.14 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 2k8q s ILE 123 CO -0.06 0.11 0.23 -1.58 0.00 0.00 0.00 174.94 173.64 2k8q s GLN 124 N 1.64 3.48 0.19 2.79 0.74 -1.26 -5.07 119.66 122.17 2k8q s GLN 124 Ca 0.05 -0.28 -0.30 0.00 0.05 0.00 0.00 55.36 54.88 2k8q s GLN 124 Cb -0.17 -3.05 -0.08 0.00 1.10 0.00 0.00 33.01 30.81 2k8q s GLN 124 CO 0.07 0.63 1.20 -1.83 -0.55 0.00 0.00 175.29 174.81 2k8q s GLU 125 N -2.13 4.49 -0.50 1.67 -1.05 -1.26 -4.96 118.70 114.96 2k8q s GLU 125 Ca 0.31 1.88 0.04 0.00 -0.15 0.00 0.00 54.97 57.05 2k8q s GLU 125 Cb -0.13 -3.23 0.41 0.00 -0.44 0.00 0.00 34.13 30.73 2k8q s GLU 125 CO 0.21 -0.08 1.22 0.28 0.95 0.00 0.00 175.26 177.84 2k8q n VAL 126 N 2.41 2.60 -4.25 1.83 0.31 -1.26 -5.00 118.33 114.97 2k8q n VAL 126 Ca 0.04 -4.92 -0.21 0.00 -0.01 0.00 0.00 64.34 59.24 2k8q n VAL 126 Cb 0.45 -1.28 -0.16 0.00 -0.91 0.00 0.00 33.84 31.93 2k8q n VAL 126 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2k8q s GLU 127 N -3.61 1.05 -0.06 5.55 -6.30 -1.26 -5.14 118.70 108.94 2k8q s GLU 127 Ca 0.48 -0.18 0.03 0.00 -2.50 0.00 0.00 54.97 52.81 2k8q s GLU 127 Cb 0.39 -1.00 0.01 0.00 0.00 0.00 0.00 34.13 33.53 2k8q s GLU 127 CO -0.21 -0.07 -0.13 0.99 0.02 0.00 0.00 175.26 175.86 2k8q s THR 128 N 0.90 1.19 -0.16 -1.70 2.01 -1.26 -5.09 115.64 111.53 2k8q s THR 128 Ca -0.11 -0.54 -0.37 0.00 0.31 0.00 0.00 61.69 60.98 2k8q s THR 128 Cb -0.15 -1.06 -0.13 0.00 0.01 0.00 0.00 72.50 71.17 2k8q s THR 128 CO 0.01 0.36 1.81 -0.67 -0.69 0.00 0.00 174.62 175.44 2k8q n ASP 129 N 3.56 2.99 -3.46 3.53 -0.08 -1.26 -4.93 116.55 116.91 2k8q n ASP 129 Ca -0.21 1.02 0.01 0.00 -1.51 0.00 0.00 54.79 54.10 2k8q n ASP 129 Cb 0.52 -1.28 -0.04 0.00 2.34 0.00 0.00 41.12 42.67 2k8q n ASP 129 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 2k8q s GLY 130 N 3.74 -0.30 -0.05 0.27 0.00 -1.26 -5.16 107.32 104.56 2k8q s GLY 130 Ca 0.95 2.91 0.04 0.00 0.00 0.00 0.00 44.72 48.62 2k8q s GLY 130 CO 0.57 3.19 -0.18 0.54 0.00 0.00 0.00 173.10 177.22 2k8q s VAL 131 N 2.52 2.73 0.13 1.40 0.11 -1.26 -5.13 120.40 120.89 2k8q s VAL 131 Ca -0.03 -0.84 0.06 0.00 -2.93 0.00 0.00 61.98 58.24 2k8q s VAL 131 Cb -0.07 -2.05 -0.04 0.00 -1.53 0.00 0.00 36.38 32.69 2k8q s VAL 131 CO -0.18 0.58 -0.13 -0.94 -3.33 0.00 0.00 175.10 171.10 2k8q s SER 132 N -0.51 1.95 0.29 3.54 1.04 -1.26 -5.16 113.70 113.59 2k8q s SER 132 Ca 0.07 -0.84 0.08 0.00 0.48 0.00 0.00 55.95 55.73 2k8q s SER 132 Cb -0.12 -0.06 -0.06 0.00 0.10 0.00 0.00 66.02 65.89 2k8q s SER 132 CO 0.01 -0.18 -0.08 0.21 0.98 0.00 0.00 173.24 174.18 2k8q s ASN 133 N -2.58 3.01 0.00 7.02 2.47 -1.26 -5.38 114.94 118.22 2k8q s ASN 133 Ca 0.10 -1.16 0.30 0.00 0.42 0.00 0.00 52.86 52.52 2k8q s ASN 133 Cb -0.04 -0.21 1.56 0.00 -1.45 0.00 0.00 41.25 41.12 2k8q s ASN 133 CO 0.03 -0.27 2.04 -0.46 -3.72 0.00 0.00 177.10 174.71