#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k6q s VAL 2 N 0.00 4.93 0.28 3.84 1.01 -1.26 -4.12 120.40 125.08 1k6q s VAL 2 Ca 0.00 0.75 0.06 0.00 0.00 0.00 0.00 61.98 62.79 1k6q s VAL 2 Cb 0.00 -4.01 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1k6q s VAL 2 CO 0.00 -0.19 -0.04 -1.10 0.00 0.00 0.00 175.10 173.77 1k6q s GLN 3 N 2.61 1.53 -0.26 2.72 -0.21 -0.50 -5.01 119.66 120.54 1k6q s GLN 3 Ca 0.24 -1.78 -0.04 0.00 0.02 0.00 0.00 55.36 53.81 1k6q s GLN 3 Cb -0.15 -1.06 0.10 0.00 1.00 0.00 0.00 33.01 32.90 1k6q s GLN 3 CO 0.13 0.00 0.14 -0.51 -2.12 0.00 0.00 175.29 172.93 1k6q s LEU 4 N -3.43 0.38 -0.17 2.90 1.43 -1.26 -2.21 118.68 116.33 1k6q s LEU 4 Ca 0.30 -1.04 -0.15 0.00 -1.03 0.00 0.00 54.13 52.20 1k6q s LEU 4 Cb 0.04 -0.20 -0.04 0.00 0.03 0.00 0.00 46.19 46.02 1k6q s LEU 4 CO 0.12 -0.41 0.36 -1.10 0.23 0.00 0.00 176.35 175.55 1k6q s GLN 5 N 2.15 4.24 0.05 1.70 -0.21 0.40 -4.01 119.66 123.98 1k6q s GLN 5 Ca 0.07 0.19 0.03 0.00 0.02 0.00 0.00 55.36 55.67 1k6q s GLN 5 Cb -0.16 -3.47 -0.04 0.00 1.00 0.00 0.00 33.01 30.34 1k6q s GLN 5 CO -0.30 0.12 0.04 -0.65 -2.12 0.00 0.00 175.29 172.38 1k6q s GLN 6 N 0.81 2.79 0.93 2.91 -0.21 -1.26 -1.08 119.66 124.55 1k6q s GLN 6 Ca 0.19 -0.69 -0.12 0.00 0.02 0.00 0.00 55.36 54.77 1k6q s GLN 6 Cb -0.14 -2.68 0.08 0.00 1.00 0.00 0.00 33.01 31.27 1k6q s GLN 6 CO 0.07 0.58 0.71 -1.13 -2.12 0.00 0.00 175.29 173.40 1k6q n SER 7 N 0.81 -1.06 -4.77 5.90 3.41 -1.01 -4.95 113.62 111.95 1k6q n SER 7 Ca -0.11 0.38 -0.30 0.00 -0.26 0.00 0.00 58.87 58.58 1k6q n SER 7 Cb 0.52 -1.32 0.11 0.00 -0.26 0.00 0.00 64.21 63.26 1k6q n SER 7 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1k6q s GLY 8 N -2.24 1.63 0.16 5.00 0.00 -1.26 -4.61 107.32 106.00 1k6q s GLY 8 Ca 0.61 -0.11 -0.32 0.00 0.00 0.00 0.00 44.72 44.90 1k6q s GLY 8 CO 0.63 0.33 0.98 0.00 0.00 0.00 0.00 173.10 175.04 1k6q n ALA 9 N -3.60 -1.69 -2.95 3.20 0.00 -1.26 -4.70 120.51 109.49 1k6q n ALA 9 Ca 0.07 0.47 -0.24 0.00 0.00 0.00 0.00 53.44 53.74 1k6q n ALA 9 Cb 0.56 -1.88 -0.16 0.00 0.00 0.00 0.00 19.45 17.96 1k6q n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1k6q s GLU 10 N -0.60 1.54 -0.13 0.00 2.02 -0.09 -4.95 118.70 116.48 1k6q s GLU 10 Ca 0.72 -0.51 0.02 0.00 0.02 0.00 0.00 54.97 55.22 1k6q s GLU 10 Cb -0.92 -1.36 0.00 0.00 0.10 0.00 0.00 34.13 31.95 1k6q s GLU 10 CO 0.55 0.20 -0.20 -1.17 0.02 0.00 0.00 175.26 174.66 1k6q s LEU 11 N 0.10 2.29 0.11 1.80 2.96 -1.26 -0.57 118.68 124.10 1k6q s LEU 11 Ca -0.04 -0.51 -0.02 0.00 -0.22 0.00 0.00 54.13 53.34 1k6q s LEU 11 Cb -0.11 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 1k6q s LEU 11 CO 0.02 0.12 0.07 0.68 -1.32 0.00 0.00 176.35 175.91 1k6q s VAL 12 N 0.60 0.13 0.37 1.68 -7.23 -0.88 -4.98 120.40 110.09 1k6q s VAL 12 Ca -0.11 -1.79 -0.08 0.00 -1.81 0.00 0.00 61.98 58.19 1k6q s VAL 12 Cb -0.16 -1.84 -0.06 0.00 0.56 0.00 0.00 36.38 34.88 1k6q s VAL 12 CO 0.03 -0.60 0.69 -0.13 -0.31 0.00 0.00 175.10 174.78 1k6q s ARG 13 N -4.00 3.71 0.25 4.82 0.52 -1.25 -1.67 118.95 121.34 1k6q s ARG 13 Ca 0.18 0.28 -0.31 0.00 -0.52 0.00 0.00 55.73 55.36 1k6q s ARG 13 Cb 0.07 -2.49 -0.13 0.00 0.52 0.00 0.00 34.95 32.93 1k6q s ARG 13 CO -0.02 0.05 1.49 -2.30 0.02 0.00 0.00 175.30 174.54 1k6q n PRO 14 N -1.21 2.27 -0.22 3.54 -0.02 -1.26 -2.03 135.00 136.06 1k6q n PRO 14 Ca 0.01 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1k6q n PRO 14 Cb 0.54 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1k6q n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k6q n GLY 15 N 2.32 0.85 3.28 -1.23 0.00 0.13 -4.92 105.19 105.63 1k6q n GLY 15 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1k6q n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k6q n ALA 16 N -1.05 -2.30 -3.70 4.61 0.00 -0.86 -4.33 120.51 112.89 1k6q n ALA 16 Ca 0.00 -1.50 -0.24 0.00 0.00 0.00 0.00 53.44 51.70 1k6q n ALA 16 Cb 0.00 -0.09 -0.17 0.00 0.00 0.00 0.00 19.45 19.19 1k6q n ALA 16 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1k6q s LEU 17 N 0.00 1.25 0.37 0.00 1.98 -1.26 -2.29 118.68 118.73 1k6q s LEU 17 Ca 0.65 -0.23 0.08 0.00 -2.89 0.00 0.00 54.13 51.75 1k6q s LEU 17 Cb -0.04 -0.68 -0.07 0.00 0.66 0.00 0.00 46.19 46.06 1k6q s LEU 17 CO 0.48 -0.07 -0.05 0.68 -1.89 0.00 0.00 176.35 175.50 1k6q s VAL 18 N 1.27 2.13 -0.34 1.68 -7.23 -0.78 -5.00 120.40 112.13 1k6q s VAL 18 Ca -0.04 -2.11 0.02 0.00 -1.81 0.00 0.00 61.98 58.04 1k6q s VAL 18 Cb -0.14 -2.80 0.15 0.00 0.56 0.00 0.00 36.38 34.16 1k6q s VAL 18 CO -0.03 -0.11 0.38 -0.75 -0.31 0.00 0.00 175.10 174.28 1k6q s LYS 19 N -3.66 0.55 0.53 4.82 2.20 -1.26 -1.71 119.74 121.21 1k6q s LYS 19 Ca 0.34 -0.50 -0.16 0.00 -0.36 0.00 0.00 55.97 55.28 1k6q s LYS 19 Cb 0.06 -0.59 -0.07 0.00 -1.51 0.00 0.00 37.83 35.72 1k6q s LYS 19 CO 0.17 -1.13 1.00 -0.51 -0.36 0.00 0.00 175.35 174.52 1k6q s LEU 20 N 1.84 3.61 0.18 5.43 1.43 -0.61 -4.80 118.68 125.76 1k6q s LEU 20 Ca 0.14 1.63 0.10 0.00 -1.03 0.00 0.00 54.13 54.96 1k6q s LEU 20 Cb -0.14 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.52 1k6q s LEU 20 CO -0.14 -0.70 -0.20 -0.94 0.23 0.00 0.00 176.35 174.59 1k6q s SER 21 N -2.99 2.97 -0.19 2.29 1.04 -1.26 -0.85 113.70 114.72 1k6q s SER 21 Ca 0.60 -0.88 -0.04 0.00 0.48 0.00 0.00 55.95 56.11 1k6q s SER 21 Cb -0.11 -0.20 0.06 0.00 0.10 0.00 0.00 66.02 65.87 1k6q s SER 21 CO 0.32 0.02 0.08 0.00 0.98 0.00 0.00 173.24 174.63 1k6q s LYS 23 N 2.05 3.85 0.33 0.00 2.47 -0.24 -0.87 119.74 127.32 1k6q s LYS 23 Ca 0.02 -0.39 -0.04 0.00 -1.56 0.00 0.00 55.97 53.99 1k6q s LYS 23 Cb -0.16 -3.30 -0.05 0.00 -1.46 0.00 0.00 37.83 32.85 1k6q s LYS 23 CO -0.11 0.04 0.59 0.00 0.16 0.00 0.00 175.35 176.04 1k6q s ALA 24 N 1.01 3.59 -0.19 3.13 0.00 -0.28 -0.45 121.76 128.57 1k6q s ALA 24 Ca 0.04 -0.59 -0.17 0.00 0.00 0.00 0.00 51.96 51.25 1k6q s ALA 24 Cb -0.14 -2.33 0.05 0.00 0.00 0.00 0.00 23.12 20.70 1k6q s ALA 24 CO 0.03 0.12 0.50 -1.54 0.00 0.00 0.00 175.76 174.87 1k6q s SER 25 N -3.40 -0.54 0.00 0.00 1.04 -0.94 -4.85 113.70 105.01 1k6q s SER 25 Ca 0.44 1.02 0.00 0.00 0.48 0.00 0.00 55.95 57.89 1k6q s SER 25 Cb -0.10 1.02 0.00 0.00 0.10 0.00 0.00 66.02 67.03 1k6q s SER 25 CO 0.33 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.98 1k6q n GLY 26 N 2.97 0.53 3.83 7.32 0.00 -1.26 -1.41 105.19 117.17 1k6q n GLY 26 Ca -0.14 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.81 1k6q n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1k6q s PHE 27 N -2.23 -0.09 -0.29 1.61 -0.12 -1.26 -4.74 117.98 110.86 1k6q s PHE 27 Ca 0.00 -0.38 -0.05 0.00 -0.05 0.00 0.00 56.93 56.45 1k6q s PHE 27 Cb 0.00 0.72 0.02 0.00 -0.63 0.00 0.00 43.02 43.14 1k6q s PHE 27 CO 0.00 -1.20 0.04 1.21 -0.05 0.00 0.00 175.22 175.22 1k6q s ASN 28 N -2.99 4.93 0.61 1.98 3.84 -1.26 -4.96 114.94 117.09 1k6q s ASN 28 Ca 0.13 -0.89 0.31 0.00 0.21 0.00 0.00 52.86 52.63 1k6q s ASN 28 Cb -0.05 -1.81 1.71 0.00 -0.55 0.00 0.00 41.25 40.56 1k6q s ASN 28 CO 0.07 -0.21 1.95 0.16 -2.79 0.00 0.00 177.10 176.28 1k6q h ILE 29 N 6.05 0.00 0.00 -5.21 3.07 -1.92 0.30 117.51 119.80 1k6q h ILE 29 Ca -0.29 0.00 -0.01 0.00 1.55 0.00 0.00 64.86 66.11 1k6q h ILE 29 Cb 1.11 0.70 -0.00 0.00 -0.27 0.00 0.00 36.82 38.35 1k6q h ILE 29 CO 0.59 0.00 -0.03 0.50 -1.05 0.00 0.00 178.15 178.16 1k6q h LYS 30 N 0.00 0.00 0.00 0.16 3.64 -1.92 -2.51 116.57 115.94 1k6q h LYS 30 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1k6q h LYS 30 Cb 0.46 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1k6q h LYS 30 CO 0.00 0.03 -0.32 -0.25 -2.27 0.00 0.00 179.45 176.64 1k6q n ASP 31 N -3.93 0.65 -4.28 4.20 8.00 0.11 -4.11 116.55 117.19 1k6q n ASP 31 Ca -0.03 0.29 -0.25 0.00 0.71 0.00 0.00 54.79 55.51 1k6q n ASP 31 Cb 0.12 -0.25 -0.09 0.00 -0.02 0.00 0.00 41.12 40.88 1k6q n ASP 31 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1k6q s TYR 32 N -3.11 1.85 -0.13 1.24 1.51 -0.95 -5.07 117.35 112.70 1k6q s TYR 32 Ca 0.09 -1.15 -0.09 0.00 -1.01 0.00 0.00 57.07 54.90 1k6q s TYR 32 Cb 0.14 -1.23 -0.05 0.00 -0.11 0.00 0.00 41.96 40.71 1k6q s TYR 32 CO 0.65 -0.16 0.19 0.71 -1.11 0.00 0.00 175.55 175.84 1k6q s TYR 33 N -3.22 3.56 -0.01 2.71 2.02 -1.24 -4.21 117.35 116.96 1k6q s TYR 33 Ca 0.26 0.55 0.02 0.00 -0.37 0.00 0.00 57.07 57.54 1k6q s TYR 33 Cb 0.04 -2.08 -0.03 0.00 -0.40 0.00 0.00 41.96 39.49 1k6q s TYR 33 CO 0.14 0.57 -0.05 -1.64 -1.57 0.00 0.00 175.55 172.99 1k6q s MET 34 N -0.55 2.65 0.22 -0.62 -1.94 -0.58 -1.34 119.30 117.14 1k6q s MET 34 Ca 0.15 -0.65 0.11 0.00 -1.71 0.00 0.00 55.69 53.58 1k6q s MET 34 Cb -0.12 -2.57 -0.05 0.00 2.01 0.00 0.00 34.83 34.10 1k6q s MET 34 CO 0.04 0.62 -0.21 -1.01 -0.01 0.00 0.00 175.02 174.45 1k6q s HIS 35 N -0.98 2.20 -0.07 -0.03 3.76 0.85 -1.16 115.29 119.86 1k6q s HIS 35 Ca 0.17 -0.38 0.06 0.00 -0.15 0.00 0.00 55.06 54.75 1k6q s HIS 35 Cb -0.11 -1.04 -0.01 0.00 1.11 0.00 0.00 32.58 32.53 1k6q s HIS 35 CO 0.07 0.54 -0.25 -1.58 -0.85 0.00 0.00 174.74 172.67 1k6q s TRP 36 N -2.05 2.46 0.03 1.40 0.52 -0.97 -0.55 118.94 119.78 1k6q s TRP 36 Ca 0.23 -0.81 0.05 0.00 0.02 0.00 0.00 56.10 55.59 1k6q s TRP 36 Cb -0.06 -1.62 -0.02 0.00 -1.15 0.00 0.00 33.47 30.62 1k6q s TRP 36 CO 0.11 -0.27 -0.13 0.08 0.02 0.00 0.00 176.95 176.75 1k6q s VAL 37 N -0.03 1.06 -0.01 4.03 1.01 0.16 -0.79 120.40 125.83 1k6q s VAL 37 Ca -0.08 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.03 1k6q s VAL 37 Cb -0.15 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1k6q s VAL 37 CO 0.05 0.02 -0.16 -0.75 0.00 0.00 0.00 175.10 174.27 1k6q s LYS 38 N -1.03 2.31 -0.22 2.72 2.20 -0.41 0.93 119.74 126.25 1k6q s LYS 38 Ca 0.01 -0.82 -0.03 0.00 -0.36 0.00 0.00 55.97 54.77 1k6q s LYS 38 Cb -0.07 -2.29 0.10 0.00 -1.51 0.00 0.00 37.83 34.06 1k6q s LYS 38 CO 0.01 0.59 0.25 -1.14 -0.36 0.00 0.00 175.35 174.70 1k6q s GLN 39 N -1.05 0.23 0.67 4.03 0.74 -0.09 -1.74 119.66 122.45 1k6q s GLN 39 Ca 0.13 0.20 -0.11 0.00 0.05 0.00 0.00 55.36 55.63 1k6q s GLN 39 Cb -0.11 -1.04 -0.01 0.00 1.10 0.00 0.00 33.01 32.96 1k6q s GLN 39 CO 0.03 -0.71 1.05 1.03 -0.55 0.00 0.00 175.29 176.15 1k6q s ARG 40 N 2.36 3.13 -0.09 1.67 0.52 -1.26 -2.31 118.95 122.96 1k6q s ARG 40 Ca 0.08 0.85 -0.40 0.00 -0.52 0.00 0.00 55.73 55.74 1k6q s ARG 40 Cb -0.15 -2.02 -0.19 0.00 0.52 0.00 0.00 34.95 33.11 1k6q s ARG 40 CO -0.16 -0.94 1.27 -2.30 0.02 0.00 0.00 175.30 173.20 1k6q n PRO 41 N -3.01 0.35 -2.46 3.54 -0.02 -1.26 -0.99 135.00 131.15 1k6q n PRO 41 Ca 0.07 0.13 -0.08 0.00 -2.02 0.00 0.00 63.50 61.60 1k6q n PRO 41 Cb 0.54 -1.67 -0.00 0.00 -0.02 0.00 0.00 33.50 32.34 1k6q n PRO 41 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1k6q n GLU 42 N 2.46 -2.50 -3.49 -0.52 -0.58 -1.26 -4.94 120.64 109.82 1k6q n GLU 42 Ca 0.22 0.39 -0.18 0.00 -0.42 0.00 0.00 57.16 57.17 1k6q n GLU 42 Cb 0.08 -4.95 -0.04 0.00 -0.57 0.00 0.00 31.44 25.97 1k6q n GLU 42 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1k6q n GLN 43 N -2.70 1.16 -2.02 3.49 6.02 -0.16 -5.16 117.38 118.01 1k6q n GLN 43 Ca -0.09 -2.08 -0.29 0.00 -0.01 0.00 0.00 57.00 54.53 1k6q n GLN 43 Cb 0.57 0.69 0.19 0.00 1.02 0.00 0.00 30.24 32.72 1k6q n GLN 43 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1k6q s GLY 44 N -2.55 1.81 0.04 1.08 0.00 -1.26 -4.70 107.32 101.73 1k6q s GLY 44 Ca 0.03 -1.36 -0.20 0.00 0.00 0.00 0.00 44.72 43.19 1k6q s GLY 44 CO 0.02 -0.57 0.58 1.08 0.00 0.00 0.00 173.10 174.22 1k6q s LEU 45 N -5.86 4.48 -0.11 0.66 1.43 -1.26 -4.32 118.68 113.70 1k6q s LEU 45 Ca 0.75 1.22 -0.03 0.00 -1.03 0.00 0.00 54.13 55.04 1k6q s LEU 45 Cb -0.03 -2.91 0.04 0.00 0.03 0.00 0.00 46.19 43.33 1k6q s LEU 45 CO 0.53 0.20 0.05 -1.61 0.23 0.00 0.00 176.35 175.74 1k6q s GLU 46 N -0.69 0.27 0.37 1.70 2.02 -0.71 -4.99 118.70 116.67 1k6q s GLU 46 Ca 0.30 0.03 -0.26 0.00 0.02 0.00 0.00 54.97 55.06 1k6q s GLU 46 Cb -0.19 -1.30 -0.09 0.00 0.10 0.00 0.00 34.13 32.65 1k6q s GLU 46 CO 0.18 -0.48 1.11 -0.51 0.02 0.00 0.00 175.26 175.59 1k6q s LEU 47 N 2.05 4.27 -0.24 1.80 1.43 -1.26 -1.28 118.68 125.45 1k6q s LEU 47 Ca 0.03 2.23 -0.06 0.00 -1.03 0.00 0.00 54.13 55.30 1k6q s LEU 47 Cb -0.14 -3.97 -0.13 0.00 0.03 0.00 0.00 46.19 41.98 1k6q s LEU 47 CO -0.06 -0.48 -0.27 -0.38 0.23 0.00 0.00 176.35 175.40 1k6q n ILE 48 N 0.32 1.35 -2.24 -0.59 5.41 0.03 -4.61 119.36 119.03 1k6q n ILE 48 Ca 0.03 -0.42 0.00 0.00 1.00 0.00 0.00 62.75 63.36 1k6q n ILE 48 Cb 0.47 -1.60 0.00 0.00 -0.71 0.00 0.00 39.64 37.80 1k6q n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1k6q n GLY 49 N 1.88 -1.58 3.23 7.39 0.00 -1.25 -0.62 105.19 114.25 1k6q n GLY 49 Ca -0.45 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.40 1k6q n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1k6q s TRP 50 N -2.64 0.26 0.04 1.61 1.48 -0.53 -2.29 118.94 116.88 1k6q s TRP 50 Ca 0.00 -0.68 0.02 0.00 -1.06 0.00 0.00 56.10 54.38 1k6q s TRP 50 Cb 0.00 -0.09 -0.02 0.00 -1.16 0.00 0.00 33.47 32.19 1k6q s TRP 50 CO 0.00 -0.58 -0.07 -1.50 -4.06 0.00 0.00 176.95 170.73 1k6q s ILE 51 N -3.90 0.51 -0.45 0.66 2.07 -0.31 -2.62 121.20 117.17 1k6q s ILE 51 Ca 0.09 -1.10 -0.07 0.00 -1.41 0.00 0.00 60.65 58.16 1k6q s ILE 51 Cb 0.05 -0.63 0.12 0.00 0.13 0.00 0.00 42.46 42.13 1k6q s ILE 51 CO -0.07 -0.41 0.30 -0.62 -1.91 0.00 0.00 174.94 172.22 1k6q s ASP 52 N -1.63 5.55 0.52 4.50 2.15 0.38 -1.52 116.67 126.62 1k6q s ASP 52 Ca -0.10 -1.98 0.32 0.00 0.43 0.00 0.00 52.55 51.23 1k6q s ASP 52 Cb -0.09 -1.95 1.46 0.00 -0.30 0.00 0.00 42.92 42.04 1k6q s ASP 52 CO 0.00 -0.64 1.84 -0.65 -0.17 0.00 0.00 175.17 175.55 1k6q h PRO 53 N 8.29 0.05 0.12 4.34 0.11 -1.75 -0.03 132.00 143.13 1k6q h PRO 53 Ca -0.18 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.95 1k6q h PRO 53 Cb 1.06 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.12 1k6q h PRO 53 CO 0.80 0.03 -0.37 1.49 -0.21 0.00 0.00 178.00 179.75 1k6q h GLU 54 N 0.05 -0.58 0.00 1.05 4.57 -1.85 -3.26 114.58 114.57 1k6q h GLU 54 Ca 0.51 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.73 1k6q h GLU 54 Cb 1.93 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 30.65 1k6q h GLU 54 CO -0.04 -0.39 -0.83 0.27 -1.18 0.00 0.00 179.01 176.84 1k6q n ASN 55 N -5.44 0.81 0.00 1.04 0.23 -1.16 -4.99 115.26 105.74 1k6q n ASN 55 Ca -0.07 -0.73 0.00 0.00 -0.53 0.00 0.00 54.58 53.25 1k6q n ASN 55 Cb 0.36 1.09 0.00 0.00 -2.08 0.00 0.00 39.78 39.15 1k6q n ASN 55 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1k6q n GLY 56 N 1.39 0.75 3.77 4.83 0.00 -0.03 -5.04 105.19 110.86 1k6q n GLY 56 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1k6q n GLY 56 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1k6q s ASN 57 N -2.58 6.80 0.11 1.61 0.01 -1.21 -4.74 114.94 114.95 1k6q s ASN 57 Ca 0.00 2.49 0.02 0.00 -0.71 0.00 0.00 52.86 54.67 1k6q s ASN 57 Cb 0.00 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.98 1k6q s ASN 57 CO 0.00 -0.49 -0.06 0.42 -1.51 0.00 0.00 177.10 175.45 1k6q s THR 58 N -1.22 0.76 -0.07 1.60 -4.23 -1.26 -0.47 115.64 110.75 1k6q s THR 58 Ca 0.50 -1.96 -0.05 0.00 -1.18 0.00 0.00 61.69 59.01 1k6q s THR 58 Cb -0.35 -1.75 0.03 0.00 1.34 0.00 0.00 72.50 71.77 1k6q s THR 58 CO 0.46 -0.82 0.17 -0.63 -0.54 0.00 0.00 174.62 173.26 1k6q s ILE 59 N -3.58 -0.02 0.04 2.99 1.09 -1.08 -5.00 121.20 115.64 1k6q s ILE 59 Ca 0.14 0.08 0.09 0.00 -1.10 0.00 0.00 60.65 59.86 1k6q s ILE 59 Cb 0.05 -0.26 -0.03 0.00 -1.06 0.00 0.00 42.46 41.16 1k6q s ILE 59 CO -0.03 0.03 -0.26 -0.31 -0.10 0.00 0.00 174.94 174.27 1k6q s TYR 60 N 0.61 2.31 0.08 3.97 2.02 -1.26 -1.45 117.35 123.63 1k6q s TYR 60 Ca -0.04 -0.41 -0.31 0.00 -0.37 0.00 0.00 57.07 55.94 1k6q s TYR 60 Cb -0.06 -1.39 -0.09 0.00 -0.40 0.00 0.00 41.96 40.03 1k6q s TYR 60 CO -0.03 0.12 1.68 0.34 -1.57 0.00 0.00 175.55 176.08 1k6q s ASP 61 N -1.22 6.58 0.58 2.29 -1.08 0.21 -4.84 116.67 119.19 1k6q s ASP 61 Ca 0.12 2.52 0.33 0.00 -0.52 0.00 0.00 52.55 54.99 1k6q s ASP 61 Cb -0.10 -2.56 1.32 0.00 -1.46 0.00 0.00 42.92 40.12 1k6q s ASP 61 CO 0.02 -0.90 1.60 -0.65 0.52 0.00 0.00 175.17 175.76 1k6q h PRO 62 N 8.37 0.00 0.00 4.34 0.11 -1.95 0.07 132.00 142.95 1k6q h PRO 62 Ca -0.43 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 1k6q h PRO 62 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1k6q h PRO 62 CO 0.93 0.00 -0.12 -0.22 -0.21 0.00 0.00 178.00 178.39 1k6q h LYS 63 N 0.00 0.00 -0.14 1.05 3.64 -1.94 -2.89 116.57 116.29 1k6q h LYS 63 Ca 0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.88 1k6q h LYS 63 Cb 2.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 34.27 1k6q h LYS 63 CO -0.01 0.12 0.00 1.19 -2.27 0.00 0.00 179.45 178.48 1k6q n PHE 64 N -4.28 0.16 -0.18 1.91 3.72 0.01 -4.65 117.46 114.15 1k6q n PHE 64 Ca -0.03 -0.13 0.27 0.00 -0.05 0.00 0.00 57.45 57.51 1k6q n PHE 64 Cb 0.19 -0.01 0.70 0.00 -0.94 0.00 0.00 39.48 39.43 1k6q n PHE 64 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1k6q h GLN 65 N 2.85 0.04 -0.09 -1.08 5.75 -1.46 -1.10 115.11 120.02 1k6q h GLN 65 Ca 0.00 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1k6q h GLN 65 Cb 0.67 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.21 1k6q h GLN 65 CO 0.00 0.03 0.00 -0.25 -2.65 0.00 0.00 178.83 175.96 1k6q n ASP 66 N -4.30 2.06 -0.10 -0.69 8.00 -1.26 -4.61 116.55 115.65 1k6q n ASP 66 Ca 0.18 -1.57 -0.14 0.00 0.71 0.00 0.00 54.79 53.98 1k6q n ASP 66 Cb 0.92 -0.06 -0.09 0.00 -0.02 0.00 0.00 41.12 41.87 1k6q n ASP 66 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1k6q n LYS 67 N 0.46 0.53 -4.27 -1.24 3.00 -0.73 -4.87 118.16 111.05 1k6q n LYS 67 Ca 0.07 0.11 -0.23 0.00 -0.00 0.00 0.00 58.31 58.26 1k6q n LYS 67 Cb 0.28 -1.41 -0.07 0.00 0.00 0.00 0.00 35.03 33.83 1k6q n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1k6q s ALA 68 N -2.41 3.21 -0.26 3.14 0.00 -0.49 -2.10 121.76 122.84 1k6q s ALA 68 Ca -0.27 -1.61 -0.01 0.00 0.00 0.00 0.00 51.96 50.08 1k6q s ALA 68 Cb 0.07 -0.84 0.15 0.00 0.00 0.00 0.00 23.12 22.49 1k6q s ALA 68 CO 0.47 0.28 0.40 0.45 0.00 0.00 0.00 175.76 177.37 1k6q s SER 69 N -3.63 0.21 -0.05 0.00 0.15 -0.57 -4.80 113.70 105.01 1k6q s SER 69 Ca 0.31 0.04 -0.16 0.00 0.70 0.00 0.00 55.95 56.84 1k6q s SER 69 Cb -0.07 1.17 -0.05 0.00 -1.71 0.00 0.00 66.02 65.36 1k6q s SER 69 CO 0.20 -0.32 0.43 -0.63 1.20 0.00 0.00 173.24 174.12 1k6q s ILE 70 N 2.56 5.09 0.18 6.45 1.01 -1.26 -1.69 121.20 133.54 1k6q s ILE 70 Ca 0.12 0.87 0.01 0.00 0.00 0.00 0.00 60.65 61.65 1k6q s ILE 70 Cb -0.14 -3.75 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 1k6q s ILE 70 CO -0.21 0.47 0.04 0.42 0.00 0.00 0.00 174.94 175.66 1k6q s THR 71 N -0.36 0.48 0.03 2.92 -4.23 -0.89 -4.97 115.64 108.61 1k6q s THR 71 Ca 0.24 -1.97 -0.10 0.00 -1.18 0.00 0.00 61.69 58.68 1k6q s THR 71 Cb -0.16 -2.23 0.01 0.00 1.34 0.00 0.00 72.50 71.46 1k6q s THR 71 CO 0.12 -0.35 0.21 0.00 -0.54 0.00 0.00 174.62 174.05 1k6q s ALA 72 N -3.80 -0.43 -0.26 3.99 0.00 -1.26 0.12 121.76 120.13 1k6q s ALA 72 Ca 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 51.96 52.07 1k6q s ALA 72 Cb 0.07 0.22 0.08 0.00 0.00 0.00 0.00 23.12 23.49 1k6q s ALA 72 CO 0.06 -0.32 0.03 0.34 0.00 0.00 0.00 175.76 175.87 1k6q s ASP 73 N -1.85 3.69 0.36 0.00 -1.08 0.19 -4.97 116.67 113.01 1k6q s ASP 73 Ca -0.08 -1.29 0.05 0.00 -0.52 0.00 0.00 52.55 50.71 1k6q s ASP 73 Cb -0.03 -0.92 0.68 0.00 -1.46 0.00 0.00 42.92 41.20 1k6q s ASP 73 CO -0.02 -0.33 1.95 0.00 0.52 0.00 0.00 175.17 177.29 1k6q h THR 74 N 6.56 1.16 -3.32 1.71 1.03 -1.88 -1.55 112.91 116.62 1k6q h THR 74 Ca -0.15 -0.55 -0.61 0.00 -0.01 0.00 0.00 66.41 65.09 1k6q h THR 74 Cb 1.06 0.73 -0.12 0.00 -1.07 0.00 0.00 68.15 68.75 1k6q h THR 74 CO 0.42 0.20 0.53 -0.55 -0.01 0.00 0.00 175.52 176.11 1k6q s SER 75 N -6.69 6.37 0.00 0.00 0.15 -1.26 -2.41 113.70 109.85 1k6q s SER 75 Ca -0.08 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1k6q s SER 75 Cb 0.16 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 1k6q s SER 75 CO 0.75 -1.15 0.00 -1.54 1.20 0.00 0.00 173.24 172.50 1k6q n SER 76 N 7.28 0.00 -3.65 5.45 3.41 -1.25 -4.74 113.62 120.13 1k6q n SER 76 Ca 0.02 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.37 1k6q n SER 76 Cb 0.48 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.46 1k6q n SER 76 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1k6q n ASN 77 N 0.00 -3.97 -3.95 4.04 4.05 -0.94 -4.70 115.26 109.78 1k6q n ASN 77 Ca 0.00 -0.92 -0.16 0.00 0.45 0.00 0.00 54.58 53.95 1k6q n ASN 77 Cb 0.00 -3.79 -0.15 0.00 1.23 0.00 0.00 39.78 37.07 1k6q n ASN 77 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1k6q s THR 78 N -3.56 0.43 -0.05 -0.44 2.01 -0.63 -1.12 115.64 112.29 1k6q s THR 78 Ca 0.31 -0.22 0.05 0.00 0.31 0.00 0.00 61.69 62.14 1k6q s THR 78 Cb -0.09 -0.38 -0.02 0.00 0.01 0.00 0.00 72.50 72.02 1k6q s THR 78 CO 0.83 0.13 -0.20 0.00 -0.69 0.00 0.00 174.62 174.70 1k6q s ALA 79 N -0.02 2.43 0.24 7.40 0.00 -0.05 0.56 121.76 132.32 1k6q s ALA 79 Ca 0.01 -1.03 0.11 0.00 0.00 0.00 0.00 51.96 51.04 1k6q s ALA 79 Cb -0.03 -0.80 -0.05 0.00 0.00 0.00 0.00 23.12 22.24 1k6q s ALA 79 CO -0.00 0.51 -0.14 0.71 0.00 0.00 0.00 175.76 176.84 1k6q s TYR 80 N -0.56 2.45 -0.27 0.00 1.51 0.32 -1.14 117.35 119.67 1k6q s TYR 80 Ca 0.08 -0.29 -0.02 0.00 -1.01 0.00 0.00 57.07 55.83 1k6q s TYR 80 Cb -0.11 -1.13 0.09 0.00 -0.11 0.00 0.00 41.96 40.70 1k6q s TYR 80 CO 0.01 0.61 0.09 -1.17 -1.11 0.00 0.00 175.55 173.98 1k6q s LEU 81 N -3.25 1.49 -0.18 -1.29 2.96 -0.03 -2.10 118.68 116.28 1k6q s LEU 81 Ca 0.27 -1.31 -0.15 0.00 -0.22 0.00 0.00 54.13 52.72 1k6q s LEU 81 Cb -0.07 -0.65 -0.04 0.00 0.50 0.00 0.00 46.19 45.93 1k6q s LEU 81 CO 0.15 -0.39 0.37 -1.58 -1.32 0.00 0.00 176.35 173.58 1k6q s GLN 82 N 1.81 4.22 -0.16 1.98 0.74 -0.68 -1.57 119.66 126.00 1k6q s GLN 82 Ca 0.07 0.19 0.01 0.00 0.05 0.00 0.00 55.36 55.68 1k6q s GLN 82 Cb -0.17 -3.49 0.02 0.00 1.10 0.00 0.00 33.01 30.47 1k6q s GLN 82 CO -0.23 0.06 -0.19 -0.51 -0.55 0.00 0.00 175.29 173.87 1k6q s LEU 83 N 0.99 2.01 0.43 3.68 1.43 -0.69 -1.52 118.68 125.00 1k6q s LEU 83 Ca 0.19 -0.59 0.08 0.00 -1.03 0.00 0.00 54.13 52.78 1k6q s LEU 83 Cb -0.14 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.69 1k6q s LEU 83 CO 0.07 0.01 0.43 -0.94 0.23 0.00 0.00 176.35 176.15 1k6q s SER 84 N 1.19 5.15 -1.41 2.29 1.04 -0.89 -1.87 113.70 119.20 1k6q s SER 84 Ca 0.01 -0.71 -0.10 0.00 0.48 0.00 0.00 55.95 55.63 1k6q s SER 84 Cb -0.14 -0.51 0.01 0.00 0.10 0.00 0.00 66.02 65.49 1k6q s SER 84 CO -0.09 -0.72 0.30 -1.20 0.98 0.00 0.00 173.24 172.51 1k6q n SER 85 N -1.65 -0.95 -4.73 7.02 7.64 -1.16 -4.80 113.62 115.00 1k6q n SER 85 Ca 0.05 -1.22 -0.42 0.00 1.01 0.00 0.00 58.87 58.29 1k6q n SER 85 Cb 0.61 -2.00 -0.01 0.00 -1.01 0.00 0.00 64.21 61.80 1k6q n SER 85 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1k6q n LEU 86 N -4.65 4.13 -4.38 -3.43 4.77 -0.97 -4.61 117.00 107.85 1k6q n LEU 86 Ca -0.26 1.18 -0.20 0.00 -0.03 0.00 0.00 56.01 56.71 1k6q n LEU 86 Cb 0.66 -1.55 -0.10 0.00 -2.33 0.00 0.00 43.42 40.10 1k6q n LEU 86 CO 0.79 -0.07 -0.23 -0.89 -1.33 0.00 0.00 177.39 175.67 1k6q s THR 87 N -0.53 0.60 0.21 -5.08 2.01 -1.26 0.20 115.64 111.79 1k6q s THR 87 Ca 0.60 -2.00 0.36 0.00 0.31 0.00 0.00 61.69 60.96 1k6q s THR 87 Cb -0.53 -2.57 0.38 0.00 0.01 0.00 0.00 72.50 69.79 1k6q s THR 87 CO 0.56 0.00 2.07 0.77 -0.69 0.00 0.00 174.62 177.32 1k6q h SER 88 N 2.17 0.00 0.56 3.53 4.64 -1.96 -0.45 113.55 122.05 1k6q h SER 88 Ca -0.37 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.95 1k6q h SER 88 Cb 1.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1k6q h SER 88 CO 0.59 0.00 -0.03 -0.08 -0.87 0.00 0.00 176.83 176.43 1k6q h GLU 89 N 0.00 0.00 -0.01 4.77 4.57 -1.95 -0.45 114.58 121.52 1k6q h GLU 89 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1k6q h GLU 89 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1k6q h GLU 89 CO 0.00 0.03 -0.23 -0.25 -1.18 0.00 0.00 179.01 177.39 1k6q n ASP 90 N -3.21 1.24 -4.64 1.04 8.00 -0.18 -4.88 116.55 113.91 1k6q n ASP 90 Ca -0.01 -1.07 -0.43 0.00 0.71 0.00 0.00 54.79 53.99 1k6q n ASP 90 Cb 0.22 0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 1k6q n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1k6q s THR 91 N -2.40 3.91 -0.34 -3.53 2.01 -0.18 -4.85 115.64 110.26 1k6q s THR 91 Ca 0.26 1.06 0.00 0.00 0.31 0.00 0.00 61.69 63.32 1k6q s THR 91 Cb 0.19 -3.84 0.00 0.00 0.01 0.00 0.00 72.50 68.87 1k6q s THR 91 CO 0.49 -0.26 0.00 0.00 -0.69 0.00 0.00 174.62 174.15 1k6q n ALA 92 N 7.65 0.00 -2.77 7.40 0.00 -0.31 -4.80 120.51 127.68 1k6q n ALA 92 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.25 1k6q n ALA 92 Cb 0.45 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.82 1k6q n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1k6q s VAL 93 N -3.00 5.27 -0.16 0.00 1.01 -0.98 -0.68 120.40 121.85 1k6q s VAL 93 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1k6q s VAL 93 Cb 0.00 -3.38 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1k6q s VAL 93 CO 0.00 0.47 -0.09 -0.31 0.00 0.00 0.00 175.10 175.17 1k6q s TYR 94 N 0.18 2.90 0.09 5.22 1.51 0.24 -0.91 117.35 126.57 1k6q s TYR 94 Ca 0.08 -0.67 0.09 0.00 -1.01 0.00 0.00 57.07 55.56 1k6q s TYR 94 Cb -0.11 -1.94 -0.04 0.00 -0.11 0.00 0.00 41.96 39.76 1k6q s TYR 94 CO -0.01 -0.27 -0.20 0.71 -1.11 0.00 0.00 175.55 174.67 1k6q s TYR 95 N 0.67 2.49 0.03 2.71 1.51 0.27 -1.18 117.35 123.84 1k6q s TYR 95 Ca -0.05 -0.29 0.05 0.00 -1.01 0.00 0.00 57.07 55.78 1k6q s TYR 95 Cb -0.15 -1.37 -0.03 0.00 -0.11 0.00 0.00 41.96 40.29 1k6q s TYR 95 CO 0.02 0.31 -0.13 0.00 -1.11 0.00 0.00 175.55 174.65 1k6q s ALA 97 N -0.96 -0.32 0.03 0.00 0.00 0.29 -0.95 121.76 119.85 1k6q s ALA 97 Ca 0.16 0.16 -0.22 0.00 0.00 0.00 0.00 51.96 52.05 1k6q s ALA 97 Cb -0.11 -0.09 -0.06 0.00 0.00 0.00 0.00 23.12 22.86 1k6q s ALA 97 CO 0.06 -0.12 0.67 0.50 0.00 0.00 0.00 175.76 176.87 1k6q s ARG 98 N -0.53 4.39 -0.44 0.00 3.52 -0.71 -0.11 118.95 125.09 1k6q s ARG 98 Ca -0.06 0.89 -0.02 0.00 -0.13 0.00 0.00 55.73 56.41 1k6q s ARG 98 Cb -0.04 -3.34 0.12 0.00 -1.56 0.00 0.00 34.95 30.13 1k6q s ARG 98 CO 0.01 0.37 0.23 0.34 -0.81 0.00 0.00 175.30 175.43 1k6q s ASP 99 N -0.26 5.20 0.58 -2.12 2.15 -0.45 -2.85 116.67 118.91 1k6q s ASP 99 Ca 0.34 -2.18 0.32 0.00 0.43 0.00 0.00 52.55 51.46 1k6q s ASP 99 Cb -0.19 -1.81 1.77 0.00 -0.30 0.00 0.00 42.92 42.38 1k6q s ASP 99 CO 0.20 -0.50 2.20 0.71 -0.17 0.00 0.00 175.17 177.61 1k6q h THR 100 N 6.21 0.43 0.00 1.71 1.35 -1.77 -3.30 112.91 117.54 1k6q h THR 100 Ca -0.11 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 1k6q h THR 100 Cb 1.03 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 1k6q h THR 100 CO 0.69 0.04 0.00 0.00 -0.25 0.00 0.00 175.52 176.00 1k6q n ALA 101 N -2.26 0.00 -0.01 6.62 0.00 -1.26 -4.89 120.51 118.71 1k6q n ALA 101 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 1k6q n ALA 101 Cb 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.58 1k6q n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k6q n ALA 102 N -0.61 1.93 -3.79 0.00 0.00 -1.26 -5.10 120.51 111.68 1k6q n ALA 102 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 53.44 53.30 1k6q n ALA 102 Cb 0.00 0.21 0.02 0.00 0.00 0.00 0.00 19.45 19.68 1k6q n ALA 102 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1k6q n TYR 103 N -2.13 -1.86 -3.43 0.00 4.11 -1.26 -5.10 117.16 107.49 1k6q n TYR 103 Ca -0.04 -1.51 -0.44 0.00 -0.00 0.00 0.00 57.90 55.91 1k6q n TYR 103 Cb 0.58 0.75 -0.09 0.00 -0.00 0.00 0.00 39.34 40.58 1k6q n TYR 103 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.86 176.80 1k6q s PHE 104 N -2.46 3.25 -0.56 -3.48 0.08 -1.26 -2.34 117.98 111.21 1k6q s PHE 104 Ca 0.18 -0.83 0.23 0.00 0.12 0.00 0.00 56.93 56.63 1k6q s PHE 104 Cb -0.04 -2.94 0.10 0.00 -0.57 0.00 0.00 43.02 39.58 1k6q s PHE 104 CO 0.09 -0.72 1.08 -0.40 -0.10 0.00 0.00 175.22 175.16 1k6q n ASP 105 N 5.17 0.63 -3.86 1.36 5.75 -1.13 -4.88 116.55 119.59 1k6q n ASP 105 Ca -0.12 -0.07 -0.19 0.00 -0.01 0.00 0.00 54.79 54.40 1k6q n ASP 105 Cb 0.45 0.66 -0.16 0.00 -1.03 0.00 0.00 41.12 41.03 1k6q n ASP 105 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1k6q s TYR 106 N -3.22 0.57 0.03 2.11 2.02 -1.26 -5.02 117.35 112.58 1k6q s TYR 106 Ca 0.03 -0.12 0.07 0.00 -0.37 0.00 0.00 57.07 56.68 1k6q s TYR 106 Cb 0.14 -0.56 -0.03 0.00 -0.40 0.00 0.00 41.96 41.10 1k6q s TYR 106 CO 0.79 -0.17 -0.20 -1.58 -1.57 0.00 0.00 175.55 172.82 1k6q s TRP 107 N 0.97 2.50 0.84 2.71 0.52 -1.26 -1.73 118.94 123.48 1k6q s TRP 107 Ca -0.10 -0.30 -0.12 0.00 0.02 0.00 0.00 56.10 55.60 1k6q s TRP 107 Cb -0.14 -1.47 0.09 0.00 -1.15 0.00 0.00 33.47 30.80 1k6q s TRP 107 CO -0.01 0.19 1.10 0.20 0.02 0.00 0.00 176.95 178.46 1k6q s GLY 108 N -1.23 1.61 0.00 0.98 0.00 -0.13 -4.72 107.32 103.83 1k6q s GLY 108 Ca 0.13 -0.26 0.18 0.00 0.00 0.00 0.00 44.72 44.77 1k6q s GLY 108 CO 0.03 0.20 1.56 0.61 0.00 0.00 0.00 173.10 175.51 1k6q n GLN 109 N -3.57 0.05 0.00 2.90 0.00 -1.26 -4.79 117.38 110.71 1k6q n GLN 109 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 57.00 57.25 1k6q n GLN 109 Cb 0.57 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.31 1k6q n GLN 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1k6q n GLY 110 N 0.31 -0.80 3.27 2.61 0.00 -1.26 -5.03 105.19 104.29 1k6q n GLY 110 Ca 0.05 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 44.34 1k6q n GLY 110 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k6q s THR 111 N -2.26 2.57 -0.53 2.61 2.01 -0.32 -4.91 115.64 114.81 1k6q s THR 111 Ca 0.00 -0.82 -0.23 0.00 0.31 0.00 0.00 61.69 60.95 1k6q s THR 111 Cb 0.00 -2.06 0.04 0.00 0.01 0.00 0.00 72.50 70.49 1k6q s THR 111 CO 0.00 0.53 0.88 -0.89 -0.69 0.00 0.00 174.62 174.45 1k6q s THR 112 N 0.64 4.48 -0.24 -0.82 2.01 -1.26 -0.59 115.64 119.86 1k6q s THR 112 Ca -0.09 0.20 -0.10 0.00 0.31 0.00 0.00 61.69 62.00 1k6q s THR 112 Cb -0.16 -4.48 -0.05 0.00 0.01 0.00 0.00 72.50 67.82 1k6q s THR 112 CO 0.02 -1.03 0.15 -0.22 -0.69 0.00 0.00 174.62 172.86 1k6q s LEU 113 N 3.70 4.06 -0.12 4.42 2.96 0.14 -0.92 118.68 132.92 1k6q s LEU 113 Ca 0.28 0.09 0.01 0.00 -0.22 0.00 0.00 54.13 54.30 1k6q s LEU 113 Cb -0.13 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.46 1k6q s LEU 113 CO 0.19 0.06 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.21 1k6q s THR 114 N 1.07 2.60 -0.26 3.68 2.01 0.26 -1.17 115.64 123.83 1k6q s THR 114 Ca 0.07 -0.82 -0.04 0.00 0.31 0.00 0.00 61.69 61.21 1k6q s THR 114 Cb -0.14 -2.06 0.01 0.00 0.01 0.00 0.00 72.50 70.33 1k6q s THR 114 CO 0.04 0.54 0.00 -0.69 -0.69 0.00 0.00 174.62 173.82 1k6q s VAL 115 N 0.45 3.44 0.16 3.82 1.01 -1.26 -2.07 120.40 125.95 1k6q s VAL 115 Ca -0.13 -0.79 -0.25 0.00 0.00 0.00 0.00 61.98 60.82 1k6q s VAL 115 Cb -0.17 -2.73 0.07 0.00 0.00 0.00 0.00 36.38 33.55 1k6q s VAL 115 CO 0.06 0.19 0.98 -0.55 0.00 0.00 0.00 175.10 175.77 1k6q s SER 116 N 1.43 -0.15 -0.02 3.32 0.15 -0.67 -4.52 113.70 113.24 1k6q s SER 116 Ca 0.02 -0.44 0.21 0.00 0.70 0.00 0.00 55.95 56.44 1k6q s SER 116 Cb -0.16 0.49 -0.30 0.00 -1.71 0.00 0.00 66.02 64.33 1k6q s SER 116 CO -0.01 -0.91 0.57 -1.20 1.20 0.00 0.00 173.24 172.89 1k6q n SER 117 N -0.57 0.34 -4.56 5.45 7.64 -1.26 -3.83 113.62 116.81 1k6q n SER 117 Ca -0.06 -0.25 -0.35 0.00 1.01 0.00 0.00 58.87 59.22 1k6q n SER 117 Cb 0.61 1.73 0.09 0.00 -1.01 0.00 0.00 64.21 65.63 1k6q n SER 117 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1k6q n ALA 118 N -2.05 -0.80 -2.80 -0.43 0.00 -1.26 -5.00 120.51 108.16 1k6q n ALA 118 Ca -0.02 -0.27 -0.30 0.00 0.00 0.00 0.00 53.44 52.85 1k6q n ALA 118 Cb 0.50 -2.03 -0.04 0.00 0.00 0.00 0.00 19.45 17.88 1k6q n ALA 118 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1k6q s LYS 119 N -3.32 3.52 0.36 0.00 -0.14 -1.26 -5.04 119.74 113.87 1k6q s LYS 119 Ca 0.69 -0.29 -0.28 0.00 -1.36 0.00 0.00 55.97 54.73 1k6q s LYS 119 Cb -0.32 -2.93 -0.11 0.00 -1.68 0.00 0.00 37.83 32.79 1k6q s LYS 119 CO 0.54 0.51 1.44 0.99 -0.76 0.00 0.00 175.35 178.07 1k6q s THR 120 N -1.64 2.24 -0.13 2.17 2.01 -1.26 -4.74 115.64 114.29 1k6q s THR 120 Ca 0.38 0.24 -0.07 0.00 0.31 0.00 0.00 61.69 62.55 1k6q s THR 120 Cb -0.12 -3.15 0.05 0.00 0.01 0.00 0.00 72.50 69.29 1k6q s THR 120 CO 0.27 0.06 0.31 -0.89 -0.69 0.00 0.00 174.62 173.68 1k6q s THR 121 N -1.12 -0.04 0.59 -0.82 2.01 0.52 -4.93 115.64 111.85 1k6q s THR 121 Ca 0.52 0.13 -0.16 0.00 0.31 0.00 0.00 61.69 62.49 1k6q s THR 121 Cb -0.45 -0.47 -0.03 0.00 0.01 0.00 0.00 72.50 71.56 1k6q s THR 121 CO 0.60 0.05 1.06 -2.16 -0.69 0.00 0.00 174.62 173.49 1k6q s PRO 122 N 1.32 3.29 0.64 4.92 0.04 -1.26 -1.27 135.00 142.67 1k6q s PRO 122 Ca -0.09 1.23 -0.05 0.00 0.04 0.00 0.00 61.00 62.12 1k6q s PRO 122 Cb -0.10 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.45 1k6q s PRO 122 CO -0.10 -0.84 0.94 -1.25 0.04 0.00 0.00 177.00 175.79 1k6q s PRO 123 N -4.04 2.56 0.03 0.56 0.04 -1.25 -4.37 135.00 128.52 1k6q s PRO 123 Ca 0.64 -0.20 0.04 0.00 0.04 0.00 0.00 61.00 61.52 1k6q s PRO 123 Cb -0.16 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 1k6q s PRO 123 CO 0.37 -0.94 -0.05 -1.12 0.04 0.00 0.00 177.00 175.30 1k6q s SER 124 N -4.41 4.75 -0.25 6.66 0.01 -0.47 -4.93 113.70 115.05 1k6q s SER 124 Ca 0.57 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.68 1k6q s SER 124 Cb -0.11 -1.11 0.07 0.00 0.21 0.00 0.00 66.02 65.08 1k6q s SER 124 CO 0.44 0.25 -0.01 -0.69 0.41 0.00 0.00 173.24 173.65 1k6q s VAL 125 N -1.09 1.38 -0.23 3.43 1.01 -1.26 -1.35 120.40 122.30 1k6q s VAL 125 Ca 0.19 -1.29 -0.07 0.00 0.00 0.00 0.00 61.98 60.81 1k6q s VAL 125 Cb -0.11 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 1k6q s VAL 125 CO 0.10 -0.26 0.07 -0.31 0.00 0.00 0.00 175.10 174.70 1k6q s TYR 126 N 1.43 3.13 0.56 5.22 4.12 -0.98 -4.93 117.35 125.92 1k6q s TYR 126 Ca -0.01 -0.24 -0.19 0.00 0.02 0.00 0.00 57.07 56.65 1k6q s TYR 126 Cb -0.18 -2.19 -0.05 0.00 -1.52 0.00 0.00 41.96 38.01 1k6q s TYR 126 CO -0.10 -0.19 1.16 -1.25 0.02 0.00 0.00 175.55 175.19 1k6q s PRO 127 N 1.24 3.20 -0.37 -1.71 0.04 -1.26 -1.74 135.00 134.40 1k6q s PRO 127 Ca 0.05 1.69 0.02 0.00 0.04 0.00 0.00 61.00 62.80 1k6q s PRO 127 Cb -0.14 -1.97 0.11 0.00 0.04 0.00 0.00 34.50 32.53 1k6q s PRO 127 CO 0.04 -0.99 0.12 -0.51 0.04 0.00 0.00 177.00 175.70 1k6q s LEU 128 N -3.92 3.47 0.07 -3.56 1.43 -0.41 -4.90 118.68 110.86 1k6q s LEU 128 Ca 0.74 -2.15 0.00 0.00 -1.03 0.00 0.00 54.13 51.69 1k6q s LEU 128 Cb -0.26 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 1k6q s LEU 128 CO 0.30 -0.36 0.21 0.00 0.23 0.00 0.00 176.35 176.73 1k6q s ALA 129 N 0.92 3.98 0.10 4.21 0.00 -1.26 -2.10 121.76 127.61 1k6q s ALA 129 Ca 0.12 -0.86 -0.20 0.00 0.00 0.00 0.00 51.96 51.02 1k6q s ALA 129 Cb -0.20 -1.80 -0.05 0.00 0.00 0.00 0.00 23.12 21.07 1k6q s ALA 129 CO -0.12 0.80 1.35 -1.00 0.00 0.00 0.00 175.76 176.79 1k6q h PRO 130 N 3.03 -0.06 -0.63 0.00 0.13 -1.93 -3.46 132.00 129.07 1k6q h PRO 130 Ca -0.45 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.51 1k6q h PRO 130 Cb 1.16 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 1k6q h PRO 130 CO 0.75 -0.04 -0.18 0.41 -0.23 0.00 0.00 178.00 178.71 1k6q n GLY 131 N -1.18 0.76 0.92 1.56 0.00 -1.26 -4.75 105.19 101.24 1k6q n GLY 131 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1k6q n GLY 131 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1k6q n SER 132 N 0.55 0.00 0.00 1.61 7.64 -1.26 -5.24 113.62 116.92 1k6q n SER 132 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.79 1k6q n SER 132 Cb 0.36 0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1k6q n SER 132 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1k6q n ALA 133 N -1.73 -0.52 0.00 -0.43 0.00 -1.26 -5.33 120.51 111.24 1k6q n ALA 133 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1k6q n ALA 133 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.36 1k6q n ALA 133 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1k6q n ASN 137 N -2.14 0.00 0.12 0.00 5.15 -1.26 -5.27 115.26 111.86 1k6q n ASN 137 Ca 0.00 0.00 -0.14 0.00 -0.60 0.00 0.00 54.58 53.84 1k6q n ASN 137 Cb 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.17 1k6q n ASN 137 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 1k6q h SER 138 N 0.00 -0.23 -2.28 1.20 0.87 -2.02 -3.43 113.55 107.66 1k6q h SER 138 Ca 0.00 -0.12 -0.46 0.00 -1.23 0.00 0.00 61.79 59.98 1k6q h SER 138 Cb 0.00 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1k6q h SER 138 CO 0.00 -0.02 -0.39 -0.04 -0.53 0.00 0.00 176.83 175.85 1k6q s MET 139 N -5.48 3.44 -0.12 2.24 -1.94 -1.26 -2.94 119.30 113.23 1k6q s MET 139 Ca -0.15 -0.70 -0.03 0.00 -1.71 0.00 0.00 55.69 53.10 1k6q s MET 139 Cb 0.04 -2.85 0.05 0.00 2.01 0.00 0.00 34.83 34.07 1k6q s MET 139 CO 0.63 0.38 0.06 0.08 -0.01 0.00 0.00 175.02 176.16 1k6q s VAL 140 N -2.04 0.03 -0.13 -6.03 1.01 -1.03 -4.72 120.40 107.49 1k6q s VAL 140 Ca 0.35 -0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.31 1k6q s VAL 140 Cb -0.09 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1k6q s VAL 140 CO 0.30 -0.08 -0.06 -0.89 0.00 0.00 0.00 175.10 174.37 1k6q s THR 141 N 2.10 3.70 0.10 3.92 2.01 -1.26 -2.20 115.64 124.00 1k6q s THR 141 Ca 0.03 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.59 1k6q s THR 141 Cb -0.15 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.73 1k6q s THR 141 CO -0.07 0.52 -0.03 -1.48 -0.69 0.00 0.00 174.62 172.88 1k6q s LEU 142 N 0.13 2.33 0.00 4.42 2.34 -0.10 -4.62 118.68 123.18 1k6q s LEU 142 Ca -0.02 -1.06 0.07 0.00 0.06 0.00 0.00 54.13 53.18 1k6q s LEU 142 Cb -0.14 0.07 -0.03 0.00 -0.56 0.00 0.00 46.19 45.54 1k6q s LEU 142 CO 0.03 -0.56 0.26 0.61 -1.06 0.00 0.00 176.35 175.63 1k6q n GLY 143 N -0.03 2.97 3.09 -3.48 0.00 -0.89 0.79 105.19 107.64 1k6q n GLY 143 Ca -0.11 -1.91 -0.19 0.00 0.00 0.00 0.00 46.02 43.81 1k6q n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k6q s LEU 145 N -0.82 3.80 -0.63 0.00 2.96 -0.71 -1.26 118.68 122.03 1k6q s LEU 145 Ca 0.01 -1.95 -0.23 0.00 -0.22 0.00 0.00 54.13 51.73 1k6q s LEU 145 Cb -0.06 -1.34 0.06 0.00 0.50 0.00 0.00 46.19 45.34 1k6q s LEU 145 CO 0.00 -0.39 0.97 -0.69 -1.32 0.00 0.00 176.35 174.92 1k6q s VAL 146 N 1.17 4.31 -0.04 1.68 1.01 0.42 -2.31 120.40 126.64 1k6q s VAL 146 Ca 0.10 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.00 1k6q s VAL 146 Cb -0.18 -4.65 -0.03 0.00 0.00 0.00 0.00 36.38 31.52 1k6q s VAL 146 CO -0.14 -1.36 -0.08 -0.75 0.00 0.00 0.00 175.10 172.77 1k6q s LYS 147 N 4.11 2.65 -0.97 2.72 2.20 -0.45 -0.19 119.74 129.81 1k6q s LYS 147 Ca 0.25 -0.62 -0.05 0.00 -0.36 0.00 0.00 55.97 55.19 1k6q s LYS 147 Cb -0.15 -2.53 -0.06 0.00 -1.51 0.00 0.00 37.83 33.58 1k6q s LYS 147 CO 0.13 0.64 0.85 0.41 -0.36 0.00 0.00 175.35 177.02 1k6q n GLY 148 N 2.04 -1.01 3.46 5.54 0.00 0.55 -1.37 105.19 114.41 1k6q n GLY 148 Ca -0.17 0.52 -0.23 0.00 0.00 0.00 0.00 46.02 46.14 1k6q n GLY 148 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1k6q s TYR 149 N -3.36 2.14 -0.28 1.61 -0.85 -0.85 -3.97 117.35 111.79 1k6q s TYR 149 Ca 0.42 -0.53 -0.25 0.00 -0.52 0.00 0.00 57.07 56.18 1k6q s TYR 149 Cb -0.05 -1.13 0.12 0.00 0.38 0.00 0.00 41.96 41.28 1k6q s TYR 149 CO 0.68 0.49 1.02 0.12 -1.52 0.00 0.00 175.55 176.34 1k6q s PHE 150 N -2.76 -0.48 0.00 -3.49 5.36 -0.39 -0.71 117.98 115.50 1k6q s PHE 150 Ca 0.30 1.17 0.00 0.00 -0.96 0.00 0.00 56.93 57.43 1k6q s PHE 150 Cb 0.01 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 43.05 1k6q s PHE 150 CO 0.13 -0.23 0.00 -0.35 -1.46 0.00 0.00 175.22 173.31 1k6q n PRO 151 N 2.20 1.22 -2.44 10.12 -0.04 -1.26 -0.36 135.00 144.43 1k6q n PRO 151 Ca -0.12 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.02 1k6q n PRO 151 Cb 0.56 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.99 1k6q n PRO 151 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1k6q s GLU 152 N -0.70 3.86 0.25 0.54 2.02 -1.26 -4.77 118.70 118.64 1k6q s GLU 152 Ca 0.00 0.80 0.00 0.00 0.02 0.00 0.00 54.97 55.79 1k6q s GLU 152 Cb 0.00 -2.19 0.00 0.00 0.10 0.00 0.00 34.13 32.04 1k6q s GLU 152 CO 0.00 -0.25 0.01 -0.35 0.02 0.00 0.00 175.26 174.68 1k6q n PRO 153 N -1.67 1.39 -4.22 0.39 -0.04 -1.26 -4.91 135.00 124.67 1k6q n PRO 153 Ca 0.05 -1.81 -0.19 0.00 -0.04 0.00 0.00 63.50 61.51 1k6q n PRO 153 Cb 0.54 0.47 -0.12 0.00 -0.04 0.00 0.00 33.50 34.36 1k6q n PRO 153 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1k6q s VAL 154 N -1.88 1.28 0.09 0.52 -7.23 -1.26 -4.52 120.40 107.40 1k6q s VAL 154 Ca 0.01 -1.53 0.09 0.00 -1.81 0.00 0.00 61.98 58.74 1k6q s VAL 154 Cb -0.00 -1.34 -0.04 0.00 0.56 0.00 0.00 36.38 35.56 1k6q s VAL 154 CO 0.00 -0.30 -0.22 0.42 -0.31 0.00 0.00 175.10 174.69 1k6q s THR 155 N -1.67 2.52 -0.08 5.32 -4.23 -0.74 -4.95 115.64 111.81 1k6q s THR 155 Ca 0.04 -1.47 0.01 0.00 -1.18 0.00 0.00 61.69 59.09 1k6q s THR 155 Cb -0.08 -2.09 0.02 0.00 1.34 0.00 0.00 72.50 71.70 1k6q s THR 155 CO 0.03 0.22 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.55 1k6q s VAL 156 N -0.99 0.92 0.20 2.29 1.01 -1.26 -1.66 120.40 120.92 1k6q s VAL 156 Ca 0.15 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 61.90 1k6q s VAL 156 Cb -0.10 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.32 1k6q s VAL 156 CO 0.06 0.33 -0.13 -0.89 0.00 0.00 0.00 175.10 174.47 1k6q s THR 157 N 1.22 1.60 -0.12 3.92 2.01 -0.17 -4.94 115.64 119.15 1k6q s THR 157 Ca -0.05 -2.17 0.02 0.00 0.31 0.00 0.00 61.69 59.80 1k6q s THR 157 Cb -0.14 -2.04 0.01 0.00 0.01 0.00 0.00 72.50 70.34 1k6q s THR 157 CO -0.02 -0.60 -0.19 0.26 -0.69 0.00 0.00 174.62 173.38 1k6q s TRP 158 N -3.06 2.35 -1.61 4.92 0.52 -1.26 0.16 118.94 120.97 1k6q s TRP 158 Ca 0.22 -1.15 0.00 0.00 0.02 0.00 0.00 56.10 55.19 1k6q s TRP 158 Cb 0.00 -1.64 0.00 0.00 -1.15 0.00 0.00 33.47 30.69 1k6q s TRP 158 CO 0.06 -0.55 0.00 0.09 0.02 0.00 0.00 176.95 176.57 1k6q n ASN 159 N 4.11 -4.93 -2.25 2.95 3.02 -0.75 -2.07 115.26 115.34 1k6q n ASN 159 Ca -0.20 0.25 -0.16 0.00 -0.03 0.00 0.00 54.58 54.45 1k6q n ASN 159 Cb 0.51 -3.94 0.03 0.00 -0.61 0.00 0.00 39.78 35.78 1k6q n ASN 159 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1k6q n SER 160 N -0.83 -4.79 0.00 6.41 7.64 -1.26 -3.42 113.62 117.38 1k6q n SER 160 Ca -0.18 -0.23 0.00 0.00 1.01 0.00 0.00 58.87 59.47 1k6q n SER 160 Cb 0.58 -3.60 0.00 0.00 -1.01 0.00 0.00 64.21 60.18 1k6q n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1k6q n GLY 161 N -1.34 2.05 3.76 0.23 0.00 -0.88 -5.08 105.19 103.93 1k6q n GLY 161 Ca -0.06 -0.60 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 1k6q n GLY 161 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1k6q n SER 162 N 0.09 3.25 -1.78 1.61 7.64 -1.12 -4.37 113.62 118.93 1k6q n SER 162 Ca 0.00 1.11 -0.02 0.00 1.01 0.00 0.00 58.87 60.97 1k6q n SER 162 Cb 0.00 -1.60 -0.01 0.00 -1.01 0.00 0.00 64.21 61.59 1k6q n SER 162 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1k6q n LEU 163 N -0.23 -3.19 -0.04 -3.43 7.94 -1.26 -4.33 117.00 112.45 1k6q n LEU 163 Ca 0.06 0.68 -0.06 0.00 -1.11 0.00 0.00 56.01 55.58 1k6q n LEU 163 Cb 0.42 -1.66 -0.02 0.00 0.53 0.00 0.00 43.42 42.69 1k6q n LEU 163 CO 0.59 -1.14 -0.43 -1.20 -1.11 0.00 0.00 177.39 174.10 1k6q n SER 164 N 0.49 1.56 -4.51 1.96 7.64 -1.26 -4.76 113.62 114.74 1k6q n SER 164 Ca -0.12 0.25 -0.28 0.00 1.01 0.00 0.00 58.87 59.73 1k6q n SER 164 Cb 0.18 -0.59 0.25 0.00 -1.01 0.00 0.00 64.21 63.03 1k6q n SER 164 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1k6q s SER 165 N -5.83 1.09 -1.37 6.43 0.15 -1.26 -3.29 113.70 109.63 1k6q s SER 165 Ca -0.18 1.44 0.00 0.00 0.70 0.00 0.00 55.95 57.91 1k6q s SER 165 Cb 0.03 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 1k6q s SER 165 CO 0.27 -4.12 0.00 0.61 1.20 0.00 0.00 173.24 171.20 1k6q n GLY 166 N 0.54 0.89 3.33 9.45 0.00 -1.26 -4.80 105.19 113.35 1k6q n GLY 166 Ca 0.03 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 1k6q n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k6q s VAL 167 N -2.57 2.38 -0.07 1.61 1.01 -1.21 -1.11 120.40 120.44 1k6q s VAL 167 Ca 0.00 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 1k6q s VAL 167 Cb 0.00 -1.89 0.04 0.00 0.00 0.00 0.00 36.38 34.53 1k6q s VAL 167 CO 0.00 0.57 0.05 -1.00 0.00 0.00 0.00 175.10 174.73 1k6q s HIS 168 N -0.34 0.22 -0.19 5.22 3.76 -0.24 -5.00 115.29 118.72 1k6q s HIS 168 Ca 0.02 0.06 -0.00 0.00 -0.15 0.00 0.00 55.06 54.99 1k6q s HIS 168 Cb -0.12 -0.59 0.01 0.00 1.11 0.00 0.00 32.58 32.99 1k6q s HIS 168 CO 0.02 -0.28 -0.15 0.99 -0.85 0.00 0.00 174.74 174.47 1k6q s THR 169 N 2.12 2.50 0.28 1.30 2.01 -1.26 0.41 115.64 123.00 1k6q s THR 169 Ca 0.04 -0.79 -0.20 0.00 0.31 0.00 0.00 61.69 61.05 1k6q s THR 169 Cb -0.13 -2.08 -0.09 0.00 0.01 0.00 0.00 72.50 70.21 1k6q s THR 169 CO -0.04 0.50 0.79 -0.36 -0.69 0.00 0.00 174.62 174.82 1k6q s PHE 170 N 1.26 3.58 0.39 4.92 0.08 -0.76 -5.02 117.98 122.44 1k6q s PHE 170 Ca 0.03 1.45 -0.27 0.00 0.12 0.00 0.00 56.93 58.26 1k6q s PHE 170 Cb -0.14 -2.68 -0.10 0.00 -0.57 0.00 0.00 43.02 39.53 1k6q s PHE 170 CO -0.08 0.23 1.42 -2.14 -0.10 0.00 0.00 175.22 174.55 1k6q s PRO 171 N -2.26 4.04 0.57 0.24 0.02 -1.26 -4.28 135.00 132.08 1k6q s PRO 171 Ca 0.48 2.43 -0.19 0.00 0.02 0.00 0.00 61.00 63.74 1k6q s PRO 171 Cb -0.15 -2.89 -0.04 0.00 0.02 0.00 0.00 34.50 31.43 1k6q s PRO 171 CO 0.20 -0.53 1.14 0.00 -0.33 0.00 0.00 177.00 177.48 1k6q s ALA 172 N -1.16 2.63 0.10 -1.55 0.00 -1.26 -4.85 121.76 115.67 1k6q s ALA 172 Ca 0.54 0.81 0.04 0.00 0.00 0.00 0.00 51.96 53.35 1k6q s ALA 172 Cb -0.44 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.28 1k6q s ALA 172 CO 0.58 -0.92 -0.11 0.14 0.00 0.00 0.00 175.76 175.45 1k6q s VAL 173 N -1.84 1.02 -0.43 0.00 -7.23 -1.01 -4.97 120.40 105.94 1k6q s VAL 173 Ca 0.73 -1.64 -0.28 0.00 -1.81 0.00 0.00 61.98 58.97 1k6q s VAL 173 Cb -0.24 -1.38 0.02 0.00 0.56 0.00 0.00 36.38 35.34 1k6q s VAL 173 CO 0.30 -0.52 1.07 -0.22 -0.31 0.00 0.00 175.10 175.42 1k6q s LEU 174 N -2.43 3.79 0.16 1.32 2.96 -1.26 -1.59 118.68 121.63 1k6q s LEU 174 Ca 0.06 0.56 0.23 0.00 -0.22 0.00 0.00 54.13 54.76 1k6q s LEU 174 Cb -0.03 -3.47 0.09 0.00 0.50 0.00 0.00 46.19 43.28 1k6q s LEU 174 CO 0.01 -1.10 1.10 1.67 -1.32 0.00 0.00 176.35 176.71 1k6q n GLN 175 N 7.42 0.48 0.00 1.98 7.27 -0.23 -4.97 117.38 129.34 1k6q n GLN 175 Ca 0.11 0.09 0.00 0.00 0.07 0.00 0.00 57.00 57.27 1k6q n GLN 175 Cb 0.48 -1.75 0.00 0.00 2.41 0.00 0.00 30.24 31.38 1k6q n GLN 175 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1k6q n SER 176 N -2.43 0.00 -0.01 1.69 3.41 -1.26 -4.91 113.62 110.12 1k6q n SER 176 Ca 0.01 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.76 1k6q n SER 176 Cb 0.51 0.00 0.61 0.00 -0.26 0.00 0.00 64.21 65.07 1k6q n SER 176 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1k6q n ASP 177 N 0.00 0.07 -4.78 4.04 2.03 -1.26 -4.88 116.55 111.77 1k6q n ASP 177 Ca 0.00 0.26 -0.31 0.00 0.52 0.00 0.00 54.79 55.26 1k6q n ASP 177 Cb 0.00 -0.37 -0.06 0.00 -0.72 0.00 0.00 41.12 39.97 1k6q n ASP 177 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1k6q s LEU 178 N -2.90 2.48 0.03 -2.67 1.43 -1.26 -4.97 118.68 110.82 1k6q s LEU 178 Ca 0.17 -1.51 0.01 0.00 -1.03 0.00 0.00 54.13 51.78 1k6q s LEU 178 Cb 0.19 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.48 1k6q s LEU 178 CO 0.53 -0.86 0.08 -0.31 0.23 0.00 0.00 176.35 176.02 1k6q s TYR 179 N -2.82 3.25 -0.03 0.29 1.51 0.11 -1.06 117.35 118.60 1k6q s TYR 179 Ca 0.16 0.15 0.03 0.00 -1.01 0.00 0.00 57.07 56.40 1k6q s TYR 179 Cb 0.01 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.18 1k6q s TYR 179 CO 0.09 0.54 -0.11 0.99 -1.11 0.00 0.00 175.55 175.95 1k6q s THR 180 N -1.29 0.93 0.01 -0.71 2.01 -0.62 -0.33 115.64 115.64 1k6q s THR 180 Ca 0.26 -0.45 -0.07 0.00 0.31 0.00 0.00 61.69 61.74 1k6q s THR 180 Cb -0.12 -0.81 0.00 0.00 0.01 0.00 0.00 72.50 71.58 1k6q s THR 180 CO 0.18 0.28 0.14 -0.22 -0.69 0.00 0.00 174.62 174.31 1k6q s LEU 181 N 0.12 1.55 0.15 4.42 0.20 0.73 -2.41 118.68 123.45 1k6q s LEU 181 Ca -0.02 -0.26 0.05 0.00 0.69 0.00 0.00 54.13 54.58 1k6q s LEU 181 Cb -0.09 0.71 -0.04 0.00 -0.43 0.00 0.00 46.19 46.34 1k6q s LEU 181 CO 0.01 -0.41 -0.11 -0.94 -0.29 0.00 0.00 176.35 174.61 1k6q s SER 182 N -1.56 1.89 -0.02 3.68 1.04 -1.26 -0.44 113.70 117.03 1k6q s SER 182 Ca -0.12 -1.00 -0.03 0.00 0.48 0.00 0.00 55.95 55.28 1k6q s SER 182 Cb -0.06 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.03 1k6q s SER 182 CO 0.00 -0.30 0.07 -0.55 0.98 0.00 0.00 173.24 173.44 1k6q s SER 183 N -3.12 -0.01 0.06 7.02 0.15 -0.39 -1.82 113.70 115.58 1k6q s SER 183 Ca 0.17 -0.01 0.07 0.00 0.70 0.00 0.00 55.95 56.88 1k6q s SER 183 Cb 0.02 0.16 -0.03 0.00 -1.71 0.00 0.00 66.02 64.46 1k6q s SER 183 CO 0.01 -0.13 -0.21 -0.94 1.20 0.00 0.00 173.24 173.18 1k6q s SER 184 N -0.43 2.48 0.09 5.45 1.04 0.17 -0.05 113.70 122.44 1k6q s SER 184 Ca -0.05 -0.55 0.08 0.00 0.48 0.00 0.00 55.95 55.90 1k6q s SER 184 Cb -0.03 -0.19 -0.03 0.00 0.10 0.00 0.00 66.02 65.86 1k6q s SER 184 CO 0.00 0.14 -0.20 -0.69 0.98 0.00 0.00 173.24 173.47 1k6q s VAL 185 N -0.87 1.60 -0.36 5.02 1.01 0.24 -1.08 120.40 125.96 1k6q s VAL 185 Ca 0.07 -1.44 -0.00 0.00 0.00 0.00 0.00 61.98 60.61 1k6q s VAL 185 Cb -0.09 -1.45 0.12 0.00 0.00 0.00 0.00 36.38 34.96 1k6q s VAL 185 CO 0.02 -0.04 0.17 -0.89 0.00 0.00 0.00 175.10 174.36 1k6q s THR 186 N -1.11 0.77 0.19 3.92 2.01 -0.27 -0.92 115.64 120.23 1k6q s THR 186 Ca 0.05 -1.77 0.06 0.00 0.31 0.00 0.00 61.69 60.34 1k6q s THR 186 Cb -0.10 -1.56 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 1k6q s THR 186 CO 0.03 -0.83 0.15 -0.69 -0.69 0.00 0.00 174.62 172.60 1k6q s VAL 187 N 1.14 4.45 0.54 3.82 1.01 -0.93 -4.79 120.40 125.64 1k6q s VAL 187 Ca 0.14 -1.19 -0.21 0.00 0.00 0.00 0.00 61.98 60.72 1k6q s VAL 187 Cb -0.21 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 1k6q s VAL 187 CO -0.12 -0.19 1.23 -2.16 0.00 0.00 0.00 175.10 173.86 1k6q s PRO 188 N -3.33 3.27 0.09 2.72 0.04 -1.26 -2.45 135.00 134.07 1k6q s PRO 188 Ca 0.31 1.90 -0.17 0.00 0.04 0.00 0.00 61.00 63.08 1k6q s PRO 188 Cb -0.09 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1k6q s PRO 188 CO 0.24 -0.99 0.96 0.43 0.04 0.00 0.00 177.00 177.68 1k6q n SER 189 N -1.10 -0.59 -0.21 6.66 7.64 -1.15 -0.75 113.62 124.11 1k6q n SER 189 Ca 0.11 1.09 0.31 0.00 1.01 0.00 0.00 58.87 61.39 1k6q n SER 189 Cb 0.48 -0.18 0.72 0.00 -1.01 0.00 0.00 64.21 64.22 1k6q n SER 189 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1k6q h SER 190 N 0.00 0.00 0.00 6.43 4.64 -1.91 -3.16 113.55 119.56 1k6q h SER 190 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1k6q h SER 190 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1k6q h SER 190 CO -0.52 0.00 0.00 0.41 -0.87 0.00 0.00 176.83 175.85 1k6q n THR 191 N -3.99 0.00 -0.11 2.95 -1.04 0.07 -3.47 114.28 108.69 1k6q n THR 191 Ca 0.21 0.81 -0.03 0.00 -2.04 0.00 0.00 64.05 63.00 1k6q n THR 191 Cb 1.12 -1.80 -0.03 0.00 -1.82 0.00 0.00 70.33 67.81 1k6q n THR 191 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 1k6q n TRP 192 N -1.99 -0.12 0.00 -1.42 -0.00 -1.19 0.03 117.44 112.76 1k6q n TRP 192 Ca 0.00 0.33 0.00 0.00 -0.00 0.00 0.00 57.50 57.83 1k6q n TRP 192 Cb 0.00 -0.43 0.00 0.00 -0.00 0.00 0.00 31.31 30.88 1k6q n TRP 192 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1k6q n PRO 193 N -3.89 0.00 -0.25 5.87 -0.04 -1.25 -3.99 135.00 131.45 1k6q n PRO 193 Ca 0.01 0.04 -0.06 0.00 -0.04 0.00 0.00 63.50 63.45 1k6q n PRO 193 Cb 0.07 -0.68 -0.06 0.00 -0.04 0.00 0.00 33.50 32.79 1k6q n PRO 193 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1k6q n SER 194 N -0.22 -0.62 -3.25 3.54 3.41 -0.95 -4.60 113.62 110.93 1k6q n SER 194 Ca 0.00 1.44 -0.22 0.00 -0.26 0.00 0.00 58.87 59.82 1k6q n SER 194 Cb 0.00 -0.33 0.22 0.00 -0.26 0.00 0.00 64.21 63.84 1k6q n SER 194 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1k6q n GLU 195 N -4.32 -3.60 -3.84 4.33 -0.58 0.10 -5.02 120.64 107.71 1k6q n GLU 195 Ca 0.01 -1.07 -0.30 0.00 -0.42 0.00 0.00 57.16 55.38 1k6q n GLU 195 Cb 0.15 -1.52 -0.16 0.00 -0.57 0.00 0.00 31.44 29.35 1k6q n GLU 195 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1k6q s THR 196 N -1.90 1.19 -0.25 2.62 2.01 -1.26 -4.82 115.64 113.23 1k6q s THR 196 Ca 0.49 -1.22 -0.12 0.00 0.31 0.00 0.00 61.69 61.15 1k6q s THR 196 Cb -0.09 -1.67 -0.05 0.00 0.01 0.00 0.00 72.50 70.71 1k6q s THR 196 CO 0.41 -0.33 0.22 -0.69 -0.69 0.00 0.00 174.62 173.54 1k6q s VAL 197 N 1.52 5.31 0.06 3.82 1.01 -1.26 -4.94 120.40 125.92 1k6q s VAL 197 Ca 0.01 0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.33 1k6q s VAL 197 Cb -0.18 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1k6q s VAL 197 CO -0.12 0.29 -0.13 -0.89 0.00 0.00 0.00 175.10 174.26 1k6q s THR 198 N 1.34 0.97 -0.03 3.92 2.01 -1.26 0.12 115.64 122.70 1k6q s THR 198 Ca 0.10 -1.25 0.04 0.00 0.31 0.00 0.00 61.69 60.89 1k6q s THR 198 Cb -0.14 -0.96 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 1k6q s THR 198 CO 0.07 -0.26 -0.15 0.00 -0.69 0.00 0.00 174.62 173.59 1k6q s ASN 200 N -0.86 4.65 -0.00 0.00 0.02 0.43 -0.08 114.94 119.09 1k6q s ASN 200 Ca 0.12 -0.14 0.07 0.00 -1.02 0.00 0.00 52.86 51.89 1k6q s ASN 200 Cb -0.11 -1.67 -0.03 0.00 0.02 0.00 0.00 41.25 39.47 1k6q s ASN 200 CO 0.01 0.20 -0.22 -0.69 0.02 0.00 0.00 177.10 176.42 1k6q s VAL 201 N 0.18 2.44 -0.07 1.60 1.01 0.66 -1.00 120.40 125.22 1k6q s VAL 201 Ca -0.03 -1.08 -0.00 0.00 0.00 0.00 0.00 61.98 60.87 1k6q s VAL 201 Cb -0.14 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.34 1k6q s VAL 201 CO 0.03 0.50 -0.04 0.00 0.00 0.00 0.00 175.10 175.60 1k6q s ALA 202 N -0.73 0.85 -0.58 5.51 0.00 -0.66 -1.74 121.76 124.40 1k6q s ALA 202 Ca 0.11 -0.20 0.05 0.00 0.00 0.00 0.00 51.96 51.92 1k6q s ALA 202 Cb -0.10 -0.66 0.17 0.00 0.00 0.00 0.00 23.12 22.53 1k6q s ALA 202 CO 0.01 -0.28 0.44 1.58 0.00 0.00 0.00 175.76 177.52 1k6q n HIS 203 N 4.68 1.50 -0.28 0.00 -0.00 0.35 -1.79 115.22 119.68 1k6q n HIS 203 Ca -0.15 -3.89 0.10 0.00 0.46 0.00 0.00 57.72 54.24 1k6q n HIS 203 Cb 0.50 -0.26 0.24 0.00 -0.12 0.00 0.00 29.99 30.36 1k6q n HIS 203 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1k6q h PRO 204 N 5.41 0.22 -0.75 1.57 0.13 -1.79 -0.72 132.00 136.07 1k6q h PRO 204 Ca 0.20 -0.01 0.22 0.00 -0.87 0.00 0.00 66.00 65.53 1k6q h PRO 204 Cb 0.81 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 31.87 1k6q h PRO 204 CO 0.58 0.14 0.75 0.00 -0.23 0.00 0.00 178.00 179.24 1k6q h ALA 205 N 1.72 2.56 0.00 -0.56 0.00 -1.92 0.38 119.26 121.44 1k6q h ALA 205 Ca 0.49 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.35 1k6q h ALA 205 Cb 0.94 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.72 1k6q h ALA 205 CO -0.61 -1.13 -0.44 -1.13 0.00 0.00 0.00 179.25 175.93 1k6q n SER 206 N -3.67 1.57 -4.29 0.00 3.41 -0.36 -4.98 113.62 105.31 1k6q n SER 206 Ca 0.16 -3.11 -0.35 0.00 -0.26 0.00 0.00 58.87 55.30 1k6q n SER 206 Cb 1.01 -0.42 -0.08 0.00 -0.26 0.00 0.00 64.21 64.45 1k6q n SER 206 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1k6q n SER 207 N -0.81 -0.48 -4.64 4.04 3.41 0.13 -4.89 113.62 110.38 1k6q n SER 207 Ca 0.14 -1.18 -0.36 0.00 -0.26 0.00 0.00 58.87 57.20 1k6q n SER 207 Cb 0.75 -1.49 -0.10 0.00 -0.26 0.00 0.00 64.21 63.11 1k6q n SER 207 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1k6q s THR 208 N -3.67 5.15 -0.00 6.66 2.01 -0.72 -4.98 115.64 120.09 1k6q s THR 208 Ca 0.42 0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.57 1k6q s THR 208 Cb -0.24 -3.38 -0.02 0.00 0.01 0.00 0.00 72.50 68.87 1k6q s THR 208 CO 0.95 0.38 -0.17 -0.54 -0.69 0.00 0.00 174.62 174.55 1k6q s LYS 209 N 0.90 1.30 -0.09 4.92 1.02 -1.26 -0.50 119.74 126.03 1k6q s LYS 209 Ca 0.06 -0.65 -0.18 0.00 0.02 0.00 0.00 55.97 55.23 1k6q s LYS 209 Cb -0.13 -1.28 0.04 0.00 -0.52 0.00 0.00 37.83 35.94 1k6q s LYS 209 CO 0.03 0.35 0.43 0.08 -0.92 0.00 0.00 175.35 175.32 1k6q s VAL 210 N -0.48 0.02 -0.07 3.17 1.01 -0.71 -4.98 120.40 118.36 1k6q s VAL 210 Ca 0.06 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.87 1k6q s VAL 210 Cb -0.07 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1k6q s VAL 210 CO -0.00 -0.10 -0.12 -1.81 0.00 0.00 0.00 175.10 173.07 1k6q s ASP 211 N -0.61 1.76 -0.25 3.32 1.01 -1.26 -0.25 116.67 120.40 1k6q s ASP 211 Ca -0.07 -0.29 0.01 0.00 0.71 0.00 0.00 52.55 52.91 1k6q s ASP 211 Cb -0.03 -0.81 0.07 0.00 1.01 0.00 0.00 42.92 43.15 1k6q s ASP 211 CO 0.04 0.02 -0.04 -0.75 0.21 0.00 0.00 175.17 174.65 1k6q s LYS 212 N 0.75 1.60 0.07 8.23 2.47 0.89 -4.92 119.74 128.83 1k6q s LYS 212 Ca -0.13 -1.11 -0.31 0.00 -1.56 0.00 0.00 55.97 52.87 1k6q s LYS 212 Cb -0.16 -2.63 -0.06 0.00 -1.46 0.00 0.00 37.83 33.52 1k6q s LYS 212 CO 0.03 -0.65 1.21 0.21 0.16 0.00 0.00 175.35 176.30 1k6q s LYS 213 N 1.34 4.43 0.29 4.03 2.20 -1.26 -1.37 119.74 129.39 1k6q s LYS 213 Ca -0.04 1.79 -0.29 0.00 -0.36 0.00 0.00 55.97 57.08 1k6q s LYS 213 Cb -0.19 -3.34 -0.09 0.00 -1.51 0.00 0.00 37.83 32.70 1k6q s LYS 213 CO -0.07 -0.26 1.05 0.15 -0.36 0.00 0.00 175.35 175.86 1k6q s LYS 214 N 1.01 4.61 -0.06 4.03 -0.14 0.12 -4.92 119.74 124.39 1k6q s LYS 214 Ca 0.59 1.67 -0.05 0.00 -1.36 0.00 0.00 55.97 56.82 1k6q s LYS 214 Cb -0.30 -3.09 0.02 0.00 -1.68 0.00 0.00 37.83 32.78 1k6q s LYS 214 CO 0.29 0.22 0.16 0.42 -0.76 0.00 0.00 175.35 175.69 1k6q s ILE 215 N -1.26 -0.01 -2.00 2.17 1.01 -1.26 -4.79 121.20 115.06 1k6q s ILE 215 Ca 0.46 0.04 0.15 0.00 0.00 0.00 0.00 60.65 61.30 1k6q s ILE 215 Cb -0.29 -0.24 0.43 0.00 0.01 0.00 0.00 42.46 42.37 1k6q s ILE 215 CO 0.36 0.02 1.32 -0.81 0.00 0.00 0.00 174.94 175.83