#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u6q s ILE 2 N 0.00 4.61 0.00 1.39 -1.09 -0.07 -4.17 121.20 121.87 1u6q s ILE 2 Ca 0.00 1.75 0.00 0.00 -2.23 0.00 0.00 60.65 60.17 1u6q s ILE 2 Cb 0.00 -4.17 0.00 0.00 -1.58 0.00 0.00 42.46 36.71 1u6q s ILE 2 CO 0.00 0.38 0.00 0.61 -1.23 0.00 0.00 174.94 174.70 1u6q n GLY 3 N 2.23 0.61 6.43 6.18 0.00 -1.26 -2.80 105.19 116.58 1u6q n GLY 3 Ca -0.02 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1u6q n GLY 3 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6q n GLY 4 N 0.00 -1.17 2.93 -0.02 0.00 -1.26 -4.91 105.19 100.76 1u6q n GLY 4 Ca 0.00 -1.31 -0.11 0.00 0.00 0.00 0.00 46.02 44.61 1u6q n GLY 4 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u6q s GLU 5 N 0.00 0.17 0.57 1.61 2.02 -0.71 -5.00 118.70 117.36 1u6q s GLU 5 Ca 0.00 -0.31 -0.19 0.00 0.02 0.00 0.00 54.97 54.49 1u6q s GLU 5 Cb 0.00 0.04 -0.05 0.00 0.10 0.00 0.00 34.13 34.22 1u6q s GLU 5 CO 0.00 -0.02 1.13 -0.06 0.02 0.00 0.00 175.26 176.33 1u6q s PHE 6 N -0.73 2.63 0.35 1.61 0.40 -1.26 -2.12 117.98 118.86 1u6q s PHE 6 Ca -0.08 1.54 0.00 0.00 -0.60 0.00 0.00 56.93 57.80 1u6q s PHE 6 Cb -0.05 -3.29 0.00 0.00 0.51 0.00 0.00 43.02 40.19 1u6q s PHE 6 CO -0.00 -1.67 0.45 -2.37 0.70 0.00 0.00 175.22 172.33 1u6q n THR 7 N -1.52 0.00 -4.39 0.64 5.66 -0.38 -4.87 114.28 109.43 1u6q n THR 7 Ca 0.12 -1.93 -0.19 0.00 -3.05 0.00 0.00 64.05 58.99 1u6q n THR 7 Cb 0.51 1.13 -0.10 0.00 -1.55 0.00 0.00 70.33 70.32 1u6q n THR 7 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1u6q s THR 8 N -2.93 1.27 0.52 1.09 -4.23 -1.26 -4.25 115.64 105.85 1u6q s THR 8 Ca 0.32 -2.06 0.19 0.00 -1.18 0.00 0.00 61.69 58.96 1u6q s THR 8 Cb -0.00 -2.46 0.28 0.00 1.34 0.00 0.00 72.50 71.65 1u6q s THR 8 CO 0.23 -0.26 2.15 -0.29 -0.54 0.00 0.00 174.62 175.91 1u6q h ILE 9 N 2.34 0.90 0.00 2.99 6.09 -1.87 -1.80 117.51 126.15 1u6q h ILE 9 Ca -0.39 -0.09 -0.00 0.00 -1.37 0.00 0.00 64.86 63.01 1u6q h ILE 9 Cb 1.23 1.05 -0.00 0.00 0.47 0.00 0.00 36.82 39.57 1u6q h ILE 9 CO 0.66 0.02 -0.01 1.05 -3.07 0.00 0.00 178.15 176.81 1u6q h GLU 10 N 0.00 0.00 0.00 2.19 4.11 -1.89 0.13 114.58 119.12 1u6q h GLU 10 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1u6q h GLU 10 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1u6q h GLU 10 CO 0.00 0.01 -0.20 -0.91 0.07 0.00 0.00 179.01 177.99 1u6q h ASN 11 N 0.00 0.00 -1.97 3.06 -0.26 -1.71 -3.38 115.58 111.32 1u6q h ASN 11 Ca -0.00 -0.06 -0.49 0.00 -0.56 0.00 0.00 56.30 55.19 1u6q h ASN 11 Cb 0.04 0.00 -0.39 0.00 -1.06 0.00 0.00 38.32 36.91 1u6q h ASN 11 CO 0.00 0.03 -1.17 0.00 -1.06 0.00 0.00 177.43 175.23 1u6q n GLN 12 N -2.34 0.91 0.27 0.81 1.13 0.38 -5.01 117.38 113.54 1u6q n GLN 12 Ca 0.05 -3.32 0.18 0.00 -1.94 0.00 0.00 57.00 51.97 1u6q n GLN 12 Cb 0.45 -1.59 0.90 0.00 0.11 0.00 0.00 30.24 30.12 1u6q n GLN 12 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1u6q h PRO 13 N 3.24 0.00 -0.06 -1.09 0.13 -1.54 -2.17 132.00 130.50 1u6q h PRO 13 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1u6q h PRO 13 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1u6q h PRO 13 CO 0.49 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.59 1u6q n TRP 14 N -3.29 0.05 -2.55 1.56 2.14 -1.12 -1.55 117.44 112.68 1u6q n TRP 14 Ca -0.00 -0.02 -0.42 0.00 2.07 0.00 0.00 57.50 59.12 1u6q n TRP 14 Cb 0.32 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.79 1u6q n TRP 14 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 1u6q s PHE 15 N -1.95 3.33 -0.13 -2.67 5.36 -0.82 -1.13 117.98 119.96 1u6q s PHE 15 Ca 0.32 1.37 -0.04 0.00 -0.96 0.00 0.00 56.93 57.63 1u6q s PHE 15 Cb 0.20 -3.33 -0.03 0.00 -0.34 0.00 0.00 43.02 39.52 1u6q s PHE 15 CO 0.31 -0.88 0.00 0.00 -1.46 0.00 0.00 175.22 173.20 1u6q s ALA 16 N 2.08 3.21 -0.26 11.12 0.00 -0.40 -4.33 121.76 133.19 1u6q s ALA 16 Ca 0.53 -0.80 -0.07 0.00 0.00 0.00 0.00 51.96 51.63 1u6q s ALA 16 Cb -0.22 -1.61 -0.01 0.00 0.00 0.00 0.00 23.12 21.27 1u6q s ALA 16 CO 0.21 0.36 0.05 0.00 0.00 0.00 0.00 175.76 176.38 1u6q s ALA 17 N -0.14 3.07 -0.18 0.00 0.00 -0.50 -1.10 121.76 122.91 1u6q s ALA 17 Ca 0.04 -1.23 -0.05 0.00 0.00 0.00 0.00 51.96 50.73 1u6q s ALA 17 Cb -0.13 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 1u6q s ALA 17 CO 0.02 -0.60 -0.01 0.42 0.00 0.00 0.00 175.76 175.59 1u6q s ILE 18 N 1.56 4.08 0.47 0.00 1.01 -0.39 -0.83 121.20 127.11 1u6q s ILE 18 Ca 0.05 -0.28 0.04 0.00 0.00 0.00 0.00 60.65 60.46 1u6q s ILE 18 Cb -0.15 -2.82 -0.03 0.00 0.01 0.00 0.00 42.46 39.47 1u6q s ILE 18 CO 0.02 0.46 0.07 -0.31 0.00 0.00 0.00 174.94 175.18 1u6q s TYR 19 N 0.58 2.11 -0.04 3.97 1.51 0.35 -0.74 117.35 125.09 1u6q s TYR 19 Ca -0.01 -0.82 -0.01 0.00 -1.01 0.00 0.00 57.07 55.22 1u6q s TYR 19 Cb -0.14 -1.73 0.03 0.00 -0.11 0.00 0.00 41.96 40.01 1u6q s TYR 19 CO 0.02 0.21 0.08 0.50 -1.11 0.00 0.00 175.55 175.25 1u6q s ARG 20 N -3.88 0.01 -0.05 -0.62 3.52 -0.78 -1.69 118.95 115.46 1u6q s ARG 20 Ca 0.21 0.27 -0.30 0.00 -0.13 0.00 0.00 55.73 55.78 1u6q s ARG 20 Cb 0.04 -0.23 -0.03 0.00 -1.56 0.00 0.00 34.95 33.17 1u6q s ARG 20 CO 0.11 -0.17 1.11 1.03 -0.81 0.00 0.00 175.30 176.56 1u6q s ARG 21 N 1.16 4.42 0.11 5.12 0.52 0.96 -2.96 118.95 128.28 1u6q s ARG 21 Ca -0.09 1.56 0.02 0.00 -0.52 0.00 0.00 55.73 56.70 1u6q s ARG 21 Cb -0.12 -3.51 -0.04 0.00 0.52 0.00 0.00 34.95 31.80 1u6q s ARG 21 CO -0.04 -0.32 0.21 -1.01 0.02 0.00 0.00 175.30 174.16 1u6q s HIS 22 N 1.80 3.41 -0.10 -0.53 3.76 -0.06 -4.87 115.29 118.70 1u6q s HIS 22 Ca 0.53 0.14 -0.34 0.00 -0.15 0.00 0.00 55.06 55.24 1u6q s HIS 22 Cb -0.23 -1.67 -0.11 0.00 1.11 0.00 0.00 32.58 31.68 1u6q s HIS 22 CO 0.23 0.54 1.91 0.54 -0.85 0.00 0.00 174.74 177.10 1u6q n ARG 23 N -0.10 2.16 0.00 1.40 3.00 -1.26 -1.04 116.66 120.83 1u6q n ARG 23 Ca -0.07 0.79 0.00 0.00 -0.01 0.00 0.00 57.85 58.56 1u6q n ARG 23 Cb 0.53 -2.67 0.00 0.00 0.00 0.00 0.00 32.46 30.32 1u6q n ARG 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1u6q n GLY 23 N 4.52 0.95 0.00 -0.13 0.00 -1.26 -4.74 105.19 104.53 1u6q n GLY 23 Ca 0.23 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1u6q n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6q n GLY 24 N 0.00 1.83 3.76 -0.02 0.00 -0.21 -5.11 105.19 105.44 1u6q n GLY 24 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1u6q n GLY 24 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u6q s SER 25 N -1.64 5.77 -0.07 1.61 1.04 -1.26 -4.73 113.70 114.43 1u6q s SER 25 Ca 0.00 2.45 0.01 0.00 0.48 0.00 0.00 55.95 58.90 1u6q s SER 25 Cb 0.00 -2.61 0.02 0.00 0.10 0.00 0.00 66.02 63.53 1u6q s SER 25 CO 0.00 -1.20 -0.09 -0.69 0.98 0.00 0.00 173.24 172.24 1u6q s VAL 26 N -1.48 0.94 0.13 5.02 1.01 -1.26 -0.88 120.40 123.87 1u6q s VAL 26 Ca 0.68 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 62.41 1u6q s VAL 26 Cb -0.32 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 1u6q s VAL 26 CO 0.38 0.32 -0.23 0.42 0.00 0.00 0.00 175.10 175.99 1u6q s THR 27 N 0.90 1.97 0.24 3.92 -4.23 -1.16 -4.96 115.64 112.32 1u6q s THR 27 Ca -0.11 -1.73 -0.30 0.00 -1.18 0.00 0.00 61.69 58.38 1u6q s THR 27 Cb -0.15 -1.80 -0.09 0.00 1.34 0.00 0.00 72.50 71.80 1u6q s THR 27 CO 0.01 -0.06 1.17 -0.47 -0.54 0.00 0.00 174.62 174.73 1u6q s TYR 28 N -1.34 3.43 0.00 3.99 6.14 -1.26 -1.87 117.35 126.44 1u6q s TYR 28 Ca 0.12 1.53 0.00 0.00 0.64 0.00 0.00 57.07 59.36 1u6q s TYR 28 Cb -0.09 -3.41 0.00 0.00 0.42 0.00 0.00 41.96 38.88 1u6q s TYR 28 CO 0.06 -1.04 0.00 0.28 0.64 0.00 0.00 175.55 175.49 1u6q n VAL 29 N 1.75 0.00 -3.97 3.14 0.31 0.08 -4.91 118.33 114.72 1u6q n VAL 29 Ca 0.02 0.29 -0.11 0.00 -0.01 0.00 0.00 64.34 64.53 1u6q n VAL 29 Cb 0.44 -1.26 -0.03 0.00 -0.91 0.00 0.00 33.84 32.08 1u6q n VAL 29 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1u6q n GLY 31 N -0.48 1.97 3.10 0.00 0.00 -0.87 -1.26 105.19 107.64 1u6q n GLY 31 Ca -0.03 -2.23 -0.04 0.00 0.00 0.00 0.00 46.02 43.73 1u6q n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6q n GLY 32 N -1.92 0.85 2.90 -0.02 0.00 -0.26 -3.82 105.19 102.91 1u6q n GLY 32 Ca 0.16 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.93 1u6q n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1u6q s SER 33 N -2.90 0.04 -0.31 1.61 0.01 -0.65 -1.27 113.70 110.23 1u6q s SER 33 Ca 0.17 -0.09 -0.29 0.00 1.31 0.00 0.00 55.95 57.05 1u6q s SER 33 Cb -0.03 0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.25 1u6q s SER 33 CO 0.06 -0.06 1.06 -0.22 0.41 0.00 0.00 173.24 174.49 1u6q s LEU 34 N -0.29 3.95 -0.13 2.44 2.96 -0.28 -1.06 118.68 126.26 1u6q s LEU 34 Ca -0.03 1.08 -0.01 0.00 -0.22 0.00 0.00 54.13 54.94 1u6q s LEU 34 Cb -0.02 -3.53 -0.24 0.00 0.50 0.00 0.00 46.19 42.89 1u6q s LEU 34 CO -0.00 -0.85 0.33 0.80 -1.32 0.00 0.00 176.35 175.30 1u6q n MET 35 N 6.80 0.72 -3.67 1.98 1.56 0.11 -1.22 117.12 123.40 1u6q n MET 35 Ca 0.12 0.24 -0.10 0.00 -0.27 0.00 0.00 57.70 57.69 1u6q n MET 35 Cb 0.47 -1.69 -0.03 0.00 2.15 0.00 0.00 33.22 34.12 1u6q n MET 35 CO 0.00 0.00 0.00 -1.54 -0.73 0.00 0.00 175.97 173.70 1u6q s SER 36 N -6.74 -0.33 0.46 6.12 1.04 -1.15 -4.71 113.70 108.38 1u6q s SER 36 Ca -0.20 -0.37 0.28 0.00 0.48 0.00 0.00 55.95 56.14 1u6q s SER 36 Cb 0.07 0.59 1.34 0.00 0.10 0.00 0.00 66.02 68.12 1u6q s SER 36 CO 0.76 -1.05 1.74 -0.65 0.98 0.00 0.00 173.24 175.02 1u6q h PRO 37 N 2.15 0.18 -0.01 4.02 0.11 -1.95 -0.44 132.00 136.07 1u6q h PRO 37 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1u6q h PRO 37 Cb 1.27 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1u6q h PRO 37 CO 0.37 0.12 -0.77 0.00 -0.21 0.00 0.00 178.00 177.51 1u6q s TRP 39 N -2.80 1.76 -0.04 0.00 0.52 -0.18 -1.22 118.94 116.98 1u6q s TRP 39 Ca 0.12 -0.40 0.05 0.00 0.02 0.00 0.00 56.10 55.90 1u6q s TRP 39 Cb 0.17 -1.15 -0.01 0.00 -1.15 0.00 0.00 33.47 31.33 1u6q s TRP 39 CO 0.75 -0.08 -0.20 0.08 0.02 0.00 0.00 176.95 177.51 1u6q s VAL 40 N -0.28 1.64 -0.01 4.03 1.01 -0.63 -0.71 120.40 125.45 1u6q s VAL 40 Ca 0.03 -0.85 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1u6q s VAL 40 Cb -0.09 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 1u6q s VAL 40 CO 0.00 0.46 -0.15 -0.51 0.00 0.00 0.00 175.10 174.91 1u6q s ILE 41 N -0.19 3.01 0.00 2.22 2.07 -0.23 -0.73 121.20 127.36 1u6q s ILE 41 Ca 0.00 -0.92 0.00 0.00 -1.41 0.00 0.00 60.65 58.33 1u6q s ILE 41 Cb -0.11 -2.23 0.00 0.00 0.13 0.00 0.00 42.46 40.25 1u6q s ILE 41 CO 0.01 0.47 0.00 -0.24 -1.91 0.00 0.00 174.94 173.27 1u6q n SER 42 N 1.92 0.00 -4.53 4.50 2.88 -0.70 -1.64 113.62 116.04 1u6q n SER 42 Ca -0.16 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.04 1u6q n SER 42 Cb 0.52 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.86 1u6q n SER 42 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1u6q s ALA 43 N -1.51 2.97 0.36 -1.46 0.00 -1.26 -1.55 121.76 119.31 1u6q s ALA 43 Ca 0.00 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.15 1u6q s ALA 43 Cb 0.00 -1.38 0.72 0.00 0.00 0.00 0.00 23.12 22.46 1u6q s ALA 43 CO 0.00 0.39 1.99 1.15 0.00 0.00 0.00 175.76 179.29 1u6q h THR 44 N 4.74 1.09 0.00 0.00 2.02 -1.74 -2.62 112.91 116.40 1u6q h THR 44 Ca -0.39 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.53 1u6q h THR 44 Cb 1.19 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1u6q h THR 44 CO 0.57 0.14 0.00 1.12 0.37 0.00 0.00 175.52 177.72 1u6q h HIS 45 N 0.77 0.00 0.00 3.16 2.07 -1.93 -1.04 115.15 118.18 1u6q h HIS 45 Ca 0.26 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.78 1u6q h HIS 45 Cb 0.08 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.06 1u6q h HIS 45 CO -0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 1u6q n PHE 47 N -2.46 0.00 -0.38 0.00 3.72 -0.48 -4.88 117.46 112.98 1u6q n PHE 47 Ca 0.04 0.00 0.30 0.00 -0.05 0.00 0.00 57.45 57.74 1u6q n PHE 47 Cb 0.39 0.00 0.59 0.00 -0.94 0.00 0.00 39.48 39.53 1u6q n PHE 47 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1u6q h ILE 48 N 0.00 0.33 -0.01 4.37 6.09 -1.51 -0.13 117.51 126.65 1u6q h ILE 48 Ca 0.00 -0.08 0.00 0.00 -1.37 0.00 0.00 64.86 63.41 1u6q h ILE 48 Cb 0.00 0.09 0.00 0.00 0.47 0.00 0.00 36.82 37.38 1u6q h ILE 48 CO 0.00 0.04 -0.19 0.47 -3.07 0.00 0.00 178.15 175.40 1u6q n ASP 49 N -4.61 0.72 -3.02 2.19 8.00 -1.26 -4.27 116.55 114.29 1u6q n ASP 49 Ca 0.31 -0.68 -0.17 0.00 0.71 0.00 0.00 54.79 54.96 1u6q n ASP 49 Cb 1.17 0.03 -0.01 0.00 -0.02 0.00 0.00 41.12 42.28 1u6q n ASP 49 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1u6q n TYR 50 N -0.85 -1.40 0.45 1.24 4.02 -0.09 -5.02 117.16 115.52 1u6q n TYR 50 Ca 0.13 -2.94 0.04 0.00 -0.01 0.00 0.00 57.90 55.12 1u6q n TYR 50 Cb 0.31 0.39 0.22 0.00 -0.02 0.00 0.00 39.34 40.24 1u6q n TYR 50 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1u6q n PRO 51 N 1.20 0.20 -2.30 -0.72 -0.04 -1.03 -4.79 135.00 127.51 1u6q n PRO 51 Ca 0.17 0.08 -0.43 0.00 -0.04 0.00 0.00 63.50 63.28 1u6q n PRO 51 Cb 0.60 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.53 1u6q n PRO 51 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1u6q s LYS 52 N -2.22 3.88 0.53 0.54 1.02 -1.26 -4.89 119.74 117.34 1u6q s LYS 52 Ca 0.10 1.42 0.24 0.00 0.02 0.00 0.00 55.97 57.75 1u6q s LYS 52 Cb 0.05 -3.94 1.48 0.00 -0.52 0.00 0.00 37.83 34.91 1u6q s LYS 52 CO 0.10 -1.17 2.14 1.57 -0.92 0.00 0.00 175.35 177.06 1u6q h LYS 53 N 9.80 0.00 0.00 1.68 2.10 -1.90 -3.05 116.57 125.21 1u6q h LYS 53 Ca -0.29 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.33 1u6q h LYS 53 Cb 1.12 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.45 1u6q h LYS 53 CO 1.02 0.07 -0.12 0.93 -2.00 0.00 0.00 179.45 179.35 1u6q h GLU 54 N 0.00 0.00 0.00 0.07 3.07 -1.90 -3.13 114.58 112.68 1u6q h GLU 54 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1u6q h GLU 54 Cb 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1u6q h GLU 54 CO 0.01 0.12 0.00 -0.25 -1.40 0.00 0.00 179.01 177.49 1u6q n ASP 55 N -4.29 0.00 -4.84 1.42 8.00 -1.15 -4.87 116.55 110.81 1u6q n ASP 55 Ca -0.03 0.49 -0.37 0.00 0.71 0.00 0.00 54.79 55.59 1u6q n ASP 55 Cb 0.19 -0.50 -0.06 0.00 -0.02 0.00 0.00 41.12 40.74 1u6q n ASP 55 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1u6q s TYR 56 N -2.99 3.70 -0.08 1.24 2.02 -1.18 -0.03 117.35 120.02 1u6q s TYR 56 Ca 0.12 0.95 0.05 0.00 -0.37 0.00 0.00 57.07 57.82 1u6q s TYR 56 Cb 0.16 -2.26 -0.00 0.00 -0.40 0.00 0.00 41.96 39.45 1u6q s TYR 56 CO 0.44 0.61 -0.24 0.42 -1.57 0.00 0.00 175.55 175.21 1u6q s ILE 57 N -1.16 2.07 -0.09 2.71 1.01 -0.68 -4.16 121.20 120.91 1u6q s ILE 57 Ca 0.26 -1.04 0.04 0.00 0.00 0.00 0.00 60.65 59.91 1u6q s ILE 57 Cb -0.16 -1.77 0.00 0.00 0.01 0.00 0.00 42.46 40.55 1u6q s ILE 57 CO 0.14 0.56 -0.21 -0.69 0.00 0.00 0.00 174.94 174.75 1u6q s VAL 58 N 0.12 1.79 0.02 2.92 1.01 -0.71 -0.50 120.40 125.05 1u6q s VAL 58 Ca -0.12 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.06 1u6q s VAL 58 Cb -0.16 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 1u6q s VAL 58 CO 0.07 0.50 -0.15 -0.31 0.00 0.00 0.00 175.10 175.20 1u6q s TYR 59 N 0.42 2.64 0.05 5.22 1.51 -0.01 -0.98 117.35 126.20 1u6q s TYR 59 Ca -0.17 -0.20 0.08 0.00 -1.01 0.00 0.00 57.07 55.76 1u6q s TYR 59 Cb -0.17 -1.51 -0.03 0.00 -0.11 0.00 0.00 41.96 40.14 1u6q s TYR 59 CO 0.07 0.26 -0.22 -0.51 -1.11 0.00 0.00 175.55 174.05 1u6q s LEU 60 N -1.33 2.17 -1.14 -1.29 1.43 -0.95 -1.42 118.68 116.16 1u6q s LEU 60 Ca 0.15 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 1u6q s LEU 60 Cb -0.11 -1.03 0.00 0.00 0.03 0.00 0.00 46.19 45.09 1u6q s LEU 60 CO 0.05 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.41 1u6q n GLY 61 N 1.80 0.04 3.57 -3.19 0.00 -1.25 -2.13 105.19 104.02 1u6q n GLY 61 Ca -0.17 -0.35 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 1u6q n GLY 61 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1u6q s ARG 62 N -4.44 3.83 -0.04 1.61 3.52 -1.26 -3.79 118.95 118.39 1u6q s ARG 62 Ca 0.00 -0.42 0.21 0.00 -0.13 0.00 0.00 55.73 55.39 1u6q s ARG 62 Cb 0.00 -3.11 -0.32 0.00 -1.56 0.00 0.00 34.95 29.96 1u6q s ARG 62 CO 0.00 0.22 0.44 0.43 -0.81 0.00 0.00 175.30 175.59 1u6q n SER 63 N 3.64 0.21 -4.19 -2.12 7.64 -1.26 -4.66 113.62 112.89 1u6q n SER 63 Ca -0.17 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.54 1u6q n SER 63 Cb 0.52 1.91 -0.11 0.00 -1.01 0.00 0.00 64.21 65.52 1u6q n SER 63 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1u6q s ARG 64 N -3.41 0.88 0.17 1.43 0.52 -1.26 -2.86 118.95 114.42 1u6q s ARG 64 Ca -0.08 -1.09 -0.12 0.00 -0.52 0.00 0.00 55.73 53.91 1u6q s ARG 64 Cb 0.13 -0.75 0.06 0.00 0.52 0.00 0.00 34.95 34.91 1u6q s ARG 64 CO 0.87 0.15 1.71 1.25 0.02 0.00 0.00 175.30 179.30 1u6q h LEU 65 N 3.85 0.79 -4.67 2.53 5.85 -1.44 -3.31 115.31 118.91 1u6q h LEU 65 Ca -0.39 -0.18 -0.51 0.00 0.84 0.00 0.00 57.88 57.64 1u6q h LEU 65 Cb 1.19 -0.20 -0.41 0.00 0.37 0.00 0.00 40.66 41.60 1u6q h LEU 65 CO 0.47 0.75 -0.89 0.59 -0.34 0.00 0.00 178.44 179.02 1u6q n ASN 66 N -4.48 3.61 -3.76 1.25 4.13 -1.26 -5.04 115.26 109.71 1u6q n ASN 66 Ca 0.03 -3.37 -0.13 0.00 1.68 0.00 0.00 54.58 52.79 1u6q n ASN 66 Cb 0.17 -0.48 -0.10 0.00 -1.54 0.00 0.00 39.78 37.83 1u6q n ASN 66 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1u6q s SER 67 N -3.41 -0.29 -0.64 6.41 0.01 -1.25 -5.11 113.70 109.43 1u6q s SER 67 Ca 0.41 0.47 -0.21 0.00 1.31 0.00 0.00 55.95 57.92 1u6q s SER 67 Cb 0.42 0.55 0.08 0.00 0.21 0.00 0.00 66.02 67.28 1u6q s SER 67 CO -0.11 -0.22 0.88 0.20 0.41 0.00 0.00 173.24 174.40 1u6q s ASN 68 N -0.33 6.18 0.20 2.44 -0.87 -1.26 -4.49 114.94 116.81 1u6q s ASN 68 Ca -0.05 -1.12 -0.30 0.00 -1.57 0.00 0.00 52.86 49.82 1u6q s ASN 68 Cb -0.03 -2.38 -0.09 0.00 -0.02 0.00 0.00 41.25 38.73 1u6q s ASN 68 CO 0.02 -1.33 1.30 -0.89 -2.57 0.00 0.00 177.10 173.62 1u6q s THR 69 N 3.61 3.23 0.11 1.60 2.01 -1.26 -4.93 115.64 120.01 1u6q s THR 69 Ca 0.19 1.02 -0.31 0.00 0.31 0.00 0.00 61.69 62.90 1u6q s THR 69 Cb -0.19 -3.65 -0.10 0.00 0.01 0.00 0.00 72.50 68.57 1u6q s THR 69 CO 0.09 0.16 1.83 0.00 -0.69 0.00 0.00 174.62 176.00 1u6q s GLN 70 N -0.17 4.14 0.00 4.92 1.03 -1.26 -1.88 119.66 126.45 1u6q s GLN 70 Ca 0.56 2.57 0.00 0.00 0.04 0.00 0.00 55.36 58.53 1u6q s GLN 70 Cb -0.36 -3.66 0.00 0.00 0.03 0.00 0.00 33.01 29.02 1u6q s GLN 70 CO 0.38 -0.85 0.00 0.41 -2.54 0.00 0.00 175.29 172.70 1u6q n GLY 71 N 4.24 0.42 3.76 2.60 0.00 -1.26 -5.04 105.19 109.91 1u6q n GLY 71 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1u6q n GLY 71 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1u6q s GLU 72 N -0.77 2.15 -0.02 1.61 -1.05 -0.79 -4.83 118.70 115.00 1u6q s GLU 72 Ca 0.00 1.12 0.01 0.00 -0.15 0.00 0.00 54.97 55.95 1u6q s GLU 72 Cb 0.00 -1.89 0.01 0.00 -0.44 0.00 0.00 34.13 31.81 1u6q s GLU 72 CO 0.00 -1.71 -0.04 -1.64 0.95 0.00 0.00 175.26 172.82 1u6q s MET 73 N -4.91 0.51 -0.11 -4.83 -1.94 -0.91 -5.01 119.30 102.09 1u6q s MET 73 Ca 0.61 -0.11 -0.05 0.00 -1.71 0.00 0.00 55.69 54.43 1u6q s MET 73 Cb -0.17 -0.53 -0.04 0.00 2.01 0.00 0.00 34.83 36.10 1u6q s MET 73 CO 0.56 0.01 0.07 0.21 -0.01 0.00 0.00 175.02 175.86 1u6q s LYS 74 N 0.37 3.32 0.17 2.03 2.20 -1.26 -2.23 119.74 124.34 1u6q s LYS 74 Ca -0.04 -0.28 -0.00 0.00 -0.36 0.00 0.00 55.97 55.28 1u6q s LYS 74 Cb -0.08 -3.02 -0.04 0.00 -1.51 0.00 0.00 37.83 33.18 1u6q s LYS 74 CO -0.00 0.67 0.07 -0.06 -0.36 0.00 0.00 175.35 175.67 1u6q s PHE 75 N -0.76 1.07 0.38 4.03 0.40 -0.16 -4.68 117.98 118.26 1u6q s PHE 75 Ca 0.12 -1.24 0.08 0.00 -0.60 0.00 0.00 56.93 55.30 1u6q s PHE 75 Cb -0.12 -0.58 -0.07 0.00 0.51 0.00 0.00 43.02 42.76 1u6q s PHE 75 CO 0.03 -0.49 -0.01 -1.21 0.70 0.00 0.00 175.22 174.24 1u6q s GLU 76 N -4.06 1.95 -0.41 0.44 2.02 -0.43 -1.74 118.70 116.47 1u6q s GLU 76 Ca 0.30 -2.00 -0.15 0.00 0.02 0.00 0.00 54.97 53.13 1u6q s GLU 76 Cb 0.07 -1.72 0.02 0.00 0.10 0.00 0.00 34.13 32.60 1u6q s GLU 76 CO 0.06 0.02 0.31 0.08 0.02 0.00 0.00 175.26 175.75 1u6q s VAL 77 N -2.65 5.25 0.23 2.63 1.01 -1.26 -1.88 120.40 123.72 1u6q s VAL 77 Ca 0.35 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.77 1u6q s VAL 77 Cb 0.06 -3.92 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 1u6q s VAL 77 CO 0.18 -0.30 1.53 -0.08 0.00 0.00 0.00 175.10 176.44 1u6q h GLU 78 N 8.63 0.21 -2.58 2.72 4.81 -0.59 -3.43 114.58 124.35 1u6q h GLU 78 Ca -0.27 -0.16 -0.10 0.00 -0.13 0.00 0.00 59.36 58.70 1u6q h GLU 78 Cb 1.12 0.03 -0.27 0.00 0.63 0.00 0.00 28.75 30.26 1u6q h GLU 78 CO 0.73 0.79 -0.31 1.21 -0.73 0.00 0.00 179.01 180.69 1u6q s ASN 79 N -6.90 -0.44 -0.31 1.04 3.84 -1.19 -4.97 114.94 106.01 1u6q s ASN 79 Ca -0.03 0.95 -0.03 0.00 0.21 0.00 0.00 52.86 53.95 1u6q s ASN 79 Cb 0.12 0.98 0.05 0.00 -0.55 0.00 0.00 41.25 41.85 1u6q s ASN 79 CO 0.80 -0.21 0.03 -0.22 -2.79 0.00 0.00 177.10 174.72 1u6q s LEU 80 N 1.82 4.04 -0.24 3.21 2.96 -1.26 -0.96 118.68 128.25 1u6q s LEU 80 Ca -0.07 -1.24 -0.06 0.00 -0.22 0.00 0.00 54.13 52.55 1u6q s LEU 80 Cb -0.09 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.81 1u6q s LEU 80 CO -0.13 -0.28 0.02 -0.63 -1.32 0.00 0.00 176.35 174.01 1u6q s ILE 81 N 1.30 3.94 0.14 6.68 1.01 0.03 -5.00 121.20 129.29 1u6q s ILE 81 Ca -0.04 -0.30 0.06 0.00 0.00 0.00 0.00 60.65 60.37 1u6q s ILE 81 Cb -0.20 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 1u6q s ILE 81 CO 0.00 0.38 0.01 -0.76 0.00 0.00 0.00 174.94 174.56 1u6q s LEU 82 N 1.53 3.39 -0.09 2.97 1.43 -1.26 -0.79 118.68 125.86 1u6q s LEU 82 Ca 0.06 -0.30 -0.30 0.00 -1.03 0.00 0.00 54.13 52.57 1u6q s LEU 82 Cb -0.15 -2.08 -0.03 0.00 0.03 0.00 0.00 46.19 43.96 1u6q s LEU 82 CO 0.01 0.12 1.35 -2.28 0.23 0.00 0.00 176.35 175.79 1u6q s HIS 83 N -1.55 2.75 -0.50 0.29 5.65 -1.20 -4.90 115.29 115.82 1u6q s HIS 83 Ca 0.27 0.85 0.14 0.00 0.25 0.00 0.00 55.06 56.57 1u6q s HIS 83 Cb -0.10 -3.60 0.76 0.00 -1.18 0.00 0.00 32.58 28.46 1u6q s HIS 83 CO 0.19 -2.19 1.44 0.36 -0.65 0.00 0.00 174.74 173.88 1u6q n LYS 84 N 6.19 0.09 -0.38 2.88 0.00 -1.26 -1.97 118.16 123.71 1u6q n LYS 84 Ca 0.14 0.57 0.08 0.00 -0.00 0.00 0.00 58.31 59.10 1u6q n LYS 84 Cb 0.44 -1.79 0.23 0.00 -0.00 0.00 0.00 35.03 33.92 1u6q n LYS 84 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1u6q n ASP 85 N -1.98 3.65 -4.77 -5.58 10.43 -1.26 -5.04 116.55 112.00 1u6q n ASP 85 Ca -0.01 -2.83 -0.40 0.00 2.57 0.00 0.00 54.79 54.13 1u6q n ASP 85 Cb 0.04 -0.48 -0.02 0.00 1.84 0.00 0.00 41.12 42.50 1u6q n ASP 85 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 1u6q s TYR 86 N -2.48 3.04 0.11 1.24 6.14 -0.83 -4.67 117.35 119.90 1u6q s TYR 86 Ca 0.38 1.48 -0.15 0.00 0.64 0.00 0.00 57.07 59.42 1u6q s TYR 86 Cb 0.30 -3.56 0.03 0.00 0.42 0.00 0.00 41.96 39.14 1u6q s TYR 86 CO 0.10 -1.65 0.36 -1.54 0.64 0.00 0.00 175.55 173.46 1u6q s SER 87 N -0.77 -0.17 -0.05 4.32 1.04 -1.12 -4.99 113.70 111.96 1u6q s SER 87 Ca 0.53 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.63 1u6q s SER 87 Cb -0.36 0.44 0.02 0.00 0.10 0.00 0.00 66.02 66.21 1u6q s SER 87 CO 0.47 -0.80 -0.08 0.00 0.98 0.00 0.00 173.24 173.81 1u6q s ALA 88 N -3.63 0.93 0.00 5.32 0.00 -1.26 -0.37 121.76 122.75 1u6q s ALA 88 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.77 1u6q s ALA 88 Cb 0.02 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.66 1u6q s ALA 88 CO -0.11 0.04 0.00 -0.25 0.00 0.00 0.00 175.76 175.45 1u6q n ASP 89 N 3.94 0.56 -0.23 0.00 10.43 0.08 -5.00 116.55 126.31 1u6q n ASP 89 Ca -0.24 -0.39 0.03 0.00 2.57 0.00 0.00 54.79 56.77 1u6q n ASP 89 Cb 0.51 0.00 0.15 0.00 1.84 0.00 0.00 41.12 43.63 1u6q n ASP 89 CO 0.00 0.00 0.00 0.74 -1.07 0.00 0.00 177.20 176.87 1u6q h THR 90 N 0.11 0.65 0.00 -3.53 2.02 -2.02 -3.38 112.91 106.75 1u6q h THR 90 Ca 0.00 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1u6q h THR 90 Cb 0.00 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 1u6q h THR 90 CO 0.00 0.07 -0.76 0.18 0.37 0.00 0.00 175.52 175.38 1u6q n LEU 91 N -5.05 0.61 -4.79 2.58 4.77 -1.26 -5.09 117.00 108.77 1u6q n LEU 91 Ca 0.12 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.75 1u6q n LEU 91 Cb 0.38 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.43 1u6q n LEU 91 CO 0.18 0.01 0.72 0.00 -1.33 0.00 0.00 177.39 176.97 1u6q s ALA 92 N -1.93 2.94 -0.08 -1.18 0.00 -1.26 -4.70 121.76 115.55 1u6q s ALA 92 Ca 0.00 0.64 0.05 0.00 0.00 0.00 0.00 51.96 52.65 1u6q s ALA 92 Cb 0.00 -3.26 -0.00 0.00 0.00 0.00 0.00 23.12 19.86 1u6q s ALA 92 CO 0.00 -0.27 -0.24 -1.01 0.00 0.00 0.00 175.76 174.24 1u6q s HIS 93 N -1.88 2.43 -0.06 0.00 3.76 -1.26 -0.74 115.29 117.53 1u6q s HIS 93 Ca 0.64 -0.85 -0.02 0.00 -0.15 0.00 0.00 55.06 54.67 1u6q s HIS 93 Cb -0.18 -1.61 -0.04 0.00 1.11 0.00 0.00 32.58 31.86 1u6q s HIS 93 CO 0.22 -0.31 0.06 -1.01 -0.85 0.00 0.00 174.74 172.85 1u6q s HIS 94 N 0.09 3.29 -1.32 1.40 3.76 0.51 -4.50 115.29 118.52 1u6q s HIS 94 Ca -0.11 0.27 -0.13 0.00 -0.15 0.00 0.00 55.06 54.94 1u6q s HIS 94 Cb -0.16 -1.80 0.01 0.00 1.11 0.00 0.00 32.58 31.74 1u6q s HIS 94 CO 0.06 0.55 0.49 0.09 -0.85 0.00 0.00 174.74 175.09 1u6q n ASN 95 N 1.77 -2.14 -4.36 1.40 3.02 -1.26 -2.77 115.26 110.91 1u6q n ASN 95 Ca -0.17 -1.12 -0.44 0.00 -0.03 0.00 0.00 54.58 52.82 1u6q n ASN 95 Cb 0.54 -2.59 0.00 0.00 -0.61 0.00 0.00 39.78 37.12 1u6q n ASN 95 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1u6q n ASP 96 N -2.72 5.14 -3.72 6.41 4.64 -1.26 -4.45 116.55 120.59 1u6q n ASP 96 Ca -0.22 -2.99 -0.13 0.00 -1.38 0.00 0.00 54.79 50.07 1u6q n ASP 96 Cb 0.64 -1.58 -0.10 0.00 -1.04 0.00 0.00 41.12 39.04 1u6q n ASP 96 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 1u6q s ILE 97 N 1.70 0.00 0.07 5.18 2.07 -1.26 -4.25 121.20 124.72 1u6q s ILE 97 Ca 0.44 -0.03 -0.07 0.00 -1.41 0.00 0.00 60.65 59.58 1u6q s ILE 97 Cb 0.00 -0.62 -0.01 0.00 0.13 0.00 0.00 42.46 41.96 1u6q s ILE 97 CO 0.01 -0.01 0.14 0.00 -1.91 0.00 0.00 174.94 173.16 1u6q s ALA 98 N 0.12 -0.09 -0.06 1.50 0.00 -0.59 -3.27 121.76 119.36 1u6q s ALA 98 Ca -0.01 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.34 1u6q s ALA 98 Cb -0.03 0.38 -0.00 0.00 0.00 0.00 0.00 23.12 23.46 1u6q s ALA 98 CO 0.01 -0.43 -0.21 -0.51 0.00 0.00 0.00 175.76 174.62 1u6q s LEU 99 N -2.63 1.98 -0.18 0.00 1.43 0.03 -1.73 118.68 117.57 1u6q s LEU 99 Ca 0.02 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 1u6q s LEU 99 Cb 0.04 -1.16 0.03 0.00 0.03 0.00 0.00 46.19 45.13 1u6q s LEU 99 CO -0.09 0.18 -0.12 -0.76 0.23 0.00 0.00 176.35 175.79 1u6q s LEU 100 N 0.03 2.11 -0.24 1.79 1.02 0.09 -0.79 118.68 122.69 1u6q s LEU 100 Ca -0.06 -0.76 -0.23 0.00 0.02 0.00 0.00 54.13 53.10 1u6q s LEU 100 Cb -0.13 -1.24 -0.01 0.00 0.02 0.00 0.00 46.19 44.83 1u6q s LEU 100 CO 0.04 -0.11 0.76 -0.75 0.02 0.00 0.00 176.35 176.31 1u6q s LYS 101 N 1.41 4.17 0.10 1.70 2.20 -0.14 -1.60 119.74 127.59 1u6q s LYS 101 Ca 0.01 0.82 -0.03 0.00 -0.36 0.00 0.00 55.97 56.41 1u6q s LYS 101 Cb -0.15 -3.64 -0.05 0.00 -1.51 0.00 0.00 37.83 32.48 1u6q s LYS 101 CO -0.09 -0.46 0.30 0.96 -0.36 0.00 0.00 175.35 175.70 1u6q s ILE 102 N 2.65 5.26 -0.16 5.43 -4.36 -0.36 0.18 121.20 129.85 1u6q s ILE 102 Ca 0.32 -0.14 -0.13 0.00 -0.26 0.00 0.00 60.65 60.44 1u6q s ILE 102 Cb -0.15 -3.62 0.04 0.00 1.25 0.00 0.00 42.46 39.97 1u6q s ILE 102 CO 0.08 0.09 0.41 -0.60 0.24 0.00 0.00 174.94 175.16 1u6q s ARG 103 N -2.57 0.46 0.72 0.37 3.52 -0.79 -4.51 118.95 116.15 1u6q s ARG 103 Ca 0.38 0.60 -0.06 0.00 -0.13 0.00 0.00 55.73 56.53 1u6q s ARG 103 Cb -0.13 0.18 0.09 0.00 -1.56 0.00 0.00 34.95 33.54 1u6q s ARG 103 CO 0.26 -0.08 1.02 -1.54 -0.81 0.00 0.00 175.30 174.16 1u6q s SER 104 N 0.43 4.55 0.62 -2.12 1.04 -0.03 -1.32 113.70 116.87 1u6q s SER 104 Ca -0.02 0.22 0.33 0.00 0.48 0.00 0.00 55.95 56.97 1u6q s SER 104 Cb -0.04 -0.77 1.92 0.00 0.10 0.00 0.00 66.02 67.24 1u6q s SER 104 CO -0.02 -1.75 2.22 0.11 0.98 0.00 0.00 173.24 174.78 1u6q h LYS 105 N -0.65 0.00 -0.01 4.02 1.57 -1.91 0.21 116.57 119.81 1u6q h LYS 105 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1u6q h LYS 105 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1u6q h LYS 105 CO 0.53 0.00 -0.08 0.39 -0.57 0.00 0.00 179.45 179.71 1u6q n GLU 106 N -3.57 0.99 -0.58 3.15 4.71 -1.26 -4.93 120.64 119.15 1u6q n GLU 106 Ca -0.02 -0.40 0.00 0.00 -0.01 0.00 0.00 57.16 56.73 1u6q n GLU 106 Cb 0.17 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.11 1u6q n GLU 106 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1u6q n GLY 107 N 1.22 0.66 3.82 0.62 0.00 0.75 -5.08 105.19 107.19 1u6q n GLY 107 Ca 0.17 -0.42 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 1u6q n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u6q s ARG 108 N -0.91 2.84 0.61 1.61 0.52 -1.26 -4.75 118.95 117.62 1u6q s ARG 108 Ca 0.00 -1.14 -0.04 0.00 -0.52 0.00 0.00 55.73 54.03 1u6q s ARG 108 Cb 0.00 -2.52 0.13 0.00 0.52 0.00 0.00 34.95 33.08 1u6q s ARG 108 CO 0.00 0.31 0.84 0.00 0.02 0.00 0.00 175.30 176.47 1u6q s ALA 110 N -3.37 2.05 -0.35 0.00 0.00 -0.18 -4.86 121.76 115.05 1u6q s ALA 110 Ca 0.52 0.90 0.01 0.00 0.00 0.00 0.00 51.96 53.39 1u6q s ALA 110 Cb -0.02 -3.49 0.09 0.00 0.00 0.00 0.00 23.12 19.70 1u6q s ALA 110 CO 0.35 -1.99 0.07 -1.14 0.00 0.00 0.00 175.76 173.06 1u6q s GLN 111 N -3.94 1.86 0.12 0.00 2.00 -1.26 -4.85 119.66 113.58 1u6q s GLN 111 Ca 0.75 -1.72 -0.35 0.00 -2.00 0.00 0.00 55.36 52.03 1u6q s GLN 111 Cb -0.30 -3.29 -0.16 0.00 0.80 0.00 0.00 33.01 30.06 1u6q s GLN 111 CO 0.46 -0.90 1.35 -2.30 -0.50 0.00 0.00 175.29 173.40 1u6q n PRO 112 N 4.43 1.33 -2.51 1.67 -0.02 -1.26 -4.88 135.00 133.75 1u6q n PRO 112 Ca -0.02 0.48 -0.06 0.00 -2.02 0.00 0.00 63.50 61.88 1u6q n PRO 112 Cb 0.42 -2.11 -0.01 0.00 -0.02 0.00 0.00 33.50 31.78 1u6q n PRO 112 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1u6q n SER 113 N 2.55 -0.66 -0.01 2.55 3.41 -0.04 -4.97 113.62 116.45 1u6q n SER 113 Ca 0.17 -1.78 0.12 0.00 -0.26 0.00 0.00 58.87 57.12 1u6q n SER 113 Cb 0.22 1.19 0.54 0.00 -0.26 0.00 0.00 64.21 65.91 1u6q n SER 113 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1u6q h ARG 114 N 0.00 0.29 -0.31 4.33 2.43 -1.99 -2.38 114.38 116.74 1u6q h ARG 114 Ca -0.12 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 1u6q h ARG 114 Cb 0.51 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1u6q h ARG 114 CO 0.16 0.19 0.00 0.25 -1.51 0.00 0.00 179.97 179.07 1u6q n THR 115 N -4.47 0.67 -3.67 0.20 -2.24 -1.26 -4.87 114.28 98.64 1u6q n THR 115 Ca 0.07 -0.84 -0.27 0.00 -2.27 0.00 0.00 64.05 60.74 1u6q n THR 115 Cb 0.33 0.76 -0.17 0.00 -2.10 0.00 0.00 70.33 69.16 1u6q n THR 115 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1u6q s ILE 116 N -1.06 0.24 0.09 2.28 1.01 -0.90 -3.91 121.20 118.95 1u6q s ILE 116 Ca 0.26 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.42 1u6q s ILE 116 Cb 0.14 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.75 1u6q s ILE 116 CO 0.20 -0.28 0.13 -1.10 0.00 0.00 0.00 174.94 173.89 1u6q s GLN 117 N 1.98 0.81 0.45 2.79 -1.52 -0.59 -0.86 119.66 122.73 1u6q s GLN 117 Ca 0.01 -1.08 0.00 0.00 -1.95 0.00 0.00 55.36 52.34 1u6q s GLN 117 Cb -0.17 0.30 -0.00 0.00 -0.22 0.00 0.00 33.01 32.92 1u6q s GLN 117 CO -0.10 -0.24 0.67 0.95 -0.25 0.00 0.00 175.29 176.32 1u6q s THR 118 N -3.90 3.99 0.08 -0.19 -4.23 -1.26 -2.78 115.64 107.36 1u6q s THR 118 Ca 0.08 -0.49 0.09 0.00 -1.18 0.00 0.00 61.69 60.18 1u6q s THR 118 Cb 0.06 -3.48 -0.04 0.00 1.34 0.00 0.00 72.50 70.39 1u6q s THR 118 CO -0.09 -0.33 -0.22 0.27 -0.54 0.00 0.00 174.62 173.71 1u6q s ILE 119 N -2.56 2.55 0.21 2.99 -5.25 -0.36 -4.84 121.20 113.94 1u6q s ILE 119 Ca 0.48 -1.46 -0.28 0.00 -0.99 0.00 0.00 60.65 58.41 1u6q s ILE 119 Cb -0.10 -2.10 -0.09 0.00 2.95 0.00 0.00 42.46 43.12 1u6q s ILE 119 CO 0.38 0.22 0.87 0.00 -1.79 0.00 0.00 174.94 174.62 1u6q s LEU 121 N -1.19 3.30 0.95 0.00 2.01 -1.26 -1.15 118.68 121.34 1u6q s LEU 121 Ca 0.39 1.68 -0.14 0.00 0.01 0.00 0.00 54.13 56.07 1u6q s LEU 121 Cb -0.25 -4.51 0.17 0.00 0.01 0.00 0.00 46.19 41.61 1u6q s LEU 121 CO 0.30 -1.28 1.20 -2.16 1.01 0.00 0.00 176.35 175.42 1u6q s PRO 122 N -4.63 0.83 0.21 1.29 0.04 -1.26 -4.79 135.00 126.69 1u6q s PRO 122 Ca 0.60 -0.02 0.07 0.00 0.04 0.00 0.00 61.00 61.69 1u6q s PRO 122 Cb -0.14 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 1u6q s PRO 122 CO 0.47 -2.35 0.08 -1.54 0.04 0.00 0.00 177.00 173.70 1u6q s SER 123 N -4.40 5.10 0.15 6.66 1.04 -1.26 -4.91 113.70 116.08 1u6q s SER 123 Ca 0.68 -0.34 -0.34 0.00 0.48 0.00 0.00 55.95 56.43 1u6q s SER 123 Cb -0.10 -1.19 -0.15 0.00 0.10 0.00 0.00 66.02 64.68 1u6q s SER 123 CO 0.53 0.04 1.43 0.23 0.98 0.00 0.00 173.24 176.44 1u6q n MET 124 N -0.58 1.70 -3.92 4.02 2.81 -1.26 -2.62 117.12 117.27 1u6q n MET 124 Ca -0.08 0.61 -0.29 0.00 -1.81 0.00 0.00 57.70 56.13 1u6q n MET 124 Cb 0.56 -2.29 0.02 0.00 -0.71 0.00 0.00 33.22 30.80 1u6q n MET 124 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1u6q n TYR 125 N 2.70 -2.07 -3.07 2.03 4.02 -1.26 -4.95 117.16 114.55 1u6q n TYR 125 Ca 0.16 0.86 -0.18 0.00 -0.01 0.00 0.00 57.90 58.73 1u6q n TYR 125 Cb 0.25 -3.91 -0.04 0.00 -0.02 0.00 0.00 39.34 35.63 1u6q n TYR 125 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1u6q n ASN 126 N -2.88 -1.15 -4.76 7.72 2.85 -1.08 -5.13 115.26 110.84 1u6q n ASN 126 Ca -0.07 -2.80 -0.31 0.00 -0.11 0.00 0.00 54.58 51.29 1u6q n ASN 126 Cb 0.57 0.27 -0.07 0.00 1.24 0.00 0.00 39.78 41.79 1u6q n ASN 126 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 1u6q s ASP 127 N -0.81 5.50 0.63 1.20 -0.00 -1.26 -4.52 116.67 117.40 1u6q s ASP 127 Ca 0.33 0.01 -0.18 0.00 -0.00 0.00 0.00 52.55 52.71 1u6q s ASP 127 Cb 0.14 -1.48 -0.02 0.00 -0.00 0.00 0.00 42.92 41.55 1u6q s ASP 127 CO -0.16 0.20 1.27 -2.16 -0.00 0.00 0.00 175.17 174.32 1u6q s PRO 128 N -2.20 2.69 0.65 8.23 0.04 -1.26 -4.98 135.00 138.17 1u6q s PRO 128 Ca 0.27 2.00 -0.15 0.00 0.04 0.00 0.00 61.00 63.15 1u6q s PRO 128 Cb -0.12 -1.87 -0.00 0.00 0.04 0.00 0.00 34.50 32.54 1u6q s PRO 128 CO 0.19 -1.47 1.12 1.14 0.04 0.00 0.00 177.00 178.02 1u6q s GLN 129 N -3.36 2.78 0.56 4.56 -2.07 -1.26 -4.96 119.66 115.91 1u6q s GLN 129 Ca 0.81 1.46 -0.21 0.00 -1.82 0.00 0.00 55.36 55.60 1u6q s GLN 129 Cb -0.35 -1.94 -0.05 0.00 -1.09 0.00 0.00 33.01 29.57 1u6q s GLN 129 CO 0.38 -1.28 1.21 1.97 -1.32 0.00 0.00 175.29 176.25 1u6q n PHE 130 N -2.33 1.74 0.00 9.60 1.16 -1.26 -2.66 117.46 123.72 1u6q n PHE 130 Ca 0.11 0.44 0.00 0.00 -1.87 0.00 0.00 57.45 56.13 1u6q n PHE 130 Cb 0.52 -2.28 0.00 0.00 -1.61 0.00 0.00 39.48 36.11 1u6q n PHE 130 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1u6q n GLY 131 N 0.96 1.25 3.72 4.97 0.00 0.09 -4.97 105.19 111.21 1u6q n GLY 131 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1u6q n GLY 131 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u6q s THR 132 N -2.33 3.47 0.00 2.61 2.01 -1.09 -4.67 115.64 115.65 1u6q s THR 132 Ca 0.00 1.09 -0.26 0.00 0.31 0.00 0.00 61.69 62.83 1u6q s THR 132 Cb 0.00 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 1u6q s THR 132 CO 0.00 0.11 0.82 -0.44 -0.69 0.00 0.00 174.62 174.42 1u6q s SER 133 N 0.87 7.21 0.21 3.53 0.01 -1.26 -1.77 113.70 122.50 1u6q s SER 133 Ca 0.61 1.46 0.01 0.00 1.31 0.00 0.00 55.95 59.34 1u6q s SER 133 Cb -0.35 -2.49 -0.05 0.00 0.21 0.00 0.00 66.02 63.35 1u6q s SER 133 CO 0.32 -0.11 0.06 0.00 0.41 0.00 0.00 173.24 173.92 1u6q s GLU 135 N -4.00 1.84 0.11 0.00 -1.05 -0.49 -1.81 118.70 113.29 1u6q s GLU 135 Ca 0.31 -1.21 0.07 0.00 -0.15 0.00 0.00 54.97 53.99 1u6q s GLU 135 Cb 0.07 -2.12 -0.03 0.00 -0.44 0.00 0.00 34.13 31.61 1u6q s GLU 135 CO 0.08 0.47 -0.17 0.96 0.95 0.00 0.00 175.26 177.56 1u6q s ILE 136 N -1.29 1.44 0.01 1.83 -4.36 -0.73 -1.36 121.20 116.75 1u6q s ILE 136 Ca 0.20 -1.58 -0.05 0.00 -0.26 0.00 0.00 60.65 58.95 1u6q s ILE 136 Cb -0.10 -1.45 -0.00 0.00 1.25 0.00 0.00 42.46 42.15 1u6q s ILE 136 CO 0.11 -0.25 0.10 -0.89 0.24 0.00 0.00 174.94 174.25 1u6q s THR 137 N -1.61 0.09 0.00 8.37 2.01 -1.25 -1.89 115.64 121.36 1u6q s THR 137 Ca 0.06 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.34 1u6q s THR 137 Cb -0.08 -0.38 0.00 0.00 0.01 0.00 0.00 72.50 72.05 1u6q s THR 137 CO 0.04 -0.40 0.00 0.61 -0.69 0.00 0.00 174.62 174.18 1u6q n GLY 138 N 1.53 1.05 1.68 4.40 0.00 -0.89 -4.58 105.19 108.38 1u6q n GLY 138 Ca -0.23 -0.85 0.03 0.00 0.00 0.00 0.00 46.02 44.97 1u6q n GLY 138 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1u6q n PHE 139 N -0.32 1.79 -1.46 1.61 3.72 -1.26 -2.75 117.46 118.78 1u6q n PHE 139 Ca 0.00 -0.70 -0.29 0.00 -0.05 0.00 0.00 57.45 56.41 1u6q n PHE 139 Cb 0.00 -0.48 0.14 0.00 -0.94 0.00 0.00 39.48 38.20 1u6q n PHE 139 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1u6q s GLY 140 N -0.65 1.58 0.22 1.37 0.00 -1.26 -4.04 107.32 104.54 1u6q s GLY 140 Ca 0.45 -0.46 -0.30 0.00 0.00 0.00 0.00 44.72 44.41 1u6q s GLY 140 CO 0.12 0.09 0.89 0.28 0.00 0.00 0.00 173.10 174.49 1u6q n LYS 141 N -3.82 0.83 0.14 2.90 5.02 -0.86 -1.84 118.16 120.53 1u6q n LYS 141 Ca 0.06 0.29 0.09 0.00 -2.02 0.00 0.00 58.31 56.74 1u6q n LYS 141 Cb 0.59 -1.58 0.05 0.00 -0.02 0.00 0.00 35.03 34.07 1u6q n LYS 141 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1u6q h GLU 142 N 2.01 0.00 -3.26 1.97 5.08 -1.86 -1.88 114.58 116.64 1u6q h GLU 142 Ca -0.37 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.88 1u6q h GLU 142 Cb 1.38 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.45 1u6q h GLU 142 CO 0.62 0.08 -0.28 -0.80 -1.00 0.00 0.00 179.01 177.63 1u6q s ASN 143 N -5.82 -0.12 0.41 1.42 -0.87 -1.26 -4.24 114.94 104.47 1u6q s ASN 143 Ca 0.02 -0.13 0.11 0.00 -1.57 0.00 0.00 52.86 51.28 1u6q s ASN 143 Cb 0.08 0.33 0.87 0.00 -0.02 0.00 0.00 41.25 42.51 1u6q s ASN 143 CO 0.75 -0.55 1.96 0.28 -2.57 0.00 0.00 177.10 176.97 1u6q h SER 144 N 3.46 0.19 0.26 -1.22 0.02 -1.90 -2.44 113.55 111.92 1u6q h SER 144 Ca -0.31 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 1u6q h SER 144 Cb 1.19 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1u6q h SER 144 CO 0.44 0.31 -0.05 0.35 -1.14 0.00 0.00 176.83 176.75 1u6q n THR 145 N -4.33 0.00 -2.56 -2.27 -2.24 -1.26 -4.85 114.28 96.77 1u6q n THR 145 Ca -0.01 -0.05 -0.39 0.00 -2.27 0.00 0.00 64.05 61.32 1u6q n THR 145 Cb 0.23 -0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.20 1u6q n THR 145 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1u6q s ASP 146 N -2.31 7.27 -0.01 3.42 -0.00 -0.92 -4.95 116.67 119.17 1u6q s ASP 146 Ca 0.35 2.14 0.16 0.00 -0.00 0.00 0.00 52.55 55.20 1u6q s ASP 146 Cb 0.21 -2.61 -0.20 0.00 -0.00 0.00 0.00 42.92 40.31 1u6q s ASP 146 CO 0.43 -0.13 0.56 0.00 -0.00 0.00 0.00 175.17 176.03 1u6q n TYR 147 N 1.01 0.00 -4.09 4.23 4.11 -1.26 -4.96 117.16 116.20 1u6q n TYR 147 Ca -0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 57.90 57.64 1u6q n TYR 147 Cb 0.46 -0.13 -0.06 0.00 -0.00 0.00 0.00 39.34 39.62 1u6q n TYR 147 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1u6q s LEU 148 N -3.24 3.77 0.26 -3.48 1.43 -1.26 -5.12 118.68 111.04 1u6q s LEU 148 Ca 0.02 -0.16 -0.01 0.00 -1.03 0.00 0.00 54.13 52.95 1u6q s LEU 148 Cb 0.11 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 1u6q s LEU 148 CO 0.66 0.06 0.46 -0.31 0.23 0.00 0.00 176.35 177.46 1u6q s TYR 149 N -1.78 3.48 0.48 0.29 4.12 -1.26 -4.75 117.35 117.94 1u6q s TYR 149 Ca 0.31 0.38 -0.23 0.00 0.02 0.00 0.00 57.07 57.56 1u6q s TYR 149 Cb -0.10 -1.90 -0.07 0.00 -1.52 0.00 0.00 41.96 38.38 1u6q s TYR 149 CO 0.23 0.28 1.23 -1.25 0.02 0.00 0.00 175.55 176.06 1u6q s PRO 150 N -3.65 3.59 0.23 -1.71 0.04 -1.26 -4.94 135.00 127.30 1u6q s PRO 150 Ca 0.40 1.94 0.02 0.00 0.04 0.00 0.00 61.00 63.39 1u6q s PRO 150 Cb -0.10 -2.39 0.25 0.00 0.04 0.00 0.00 34.50 32.29 1u6q s PRO 150 CO 0.31 -0.74 1.58 1.49 0.04 0.00 0.00 177.00 179.68 1u6q h GLU 151 N 1.92 0.39 -5.78 4.56 4.57 -1.97 -3.44 114.58 114.82 1u6q h GLU 151 Ca -0.50 -0.23 -0.67 0.00 -1.18 0.00 0.00 59.36 56.78 1u6q h GLU 151 Cb 1.26 0.02 -0.12 0.00 -0.16 0.00 0.00 28.75 29.76 1u6q h GLU 151 CO 0.59 0.81 -0.56 -1.14 -1.18 0.00 0.00 179.01 177.54 1u6q s GLN 152 N -3.99 3.25 0.45 1.92 0.74 -1.26 -1.21 119.66 119.56 1u6q s GLN 152 Ca -0.06 -0.29 -0.24 0.00 0.05 0.00 0.00 55.36 54.83 1u6q s GLN 152 Cb 0.12 -2.99 -0.09 0.00 1.10 0.00 0.00 33.01 31.15 1u6q s GLN 152 CO 0.81 0.70 1.24 -0.11 -0.55 0.00 0.00 175.29 177.38 1u6q n LEU 153 N 2.17 4.11 -4.42 3.68 7.94 -1.14 -4.87 117.00 124.48 1u6q n LEU 153 Ca -0.19 1.06 -0.20 0.00 -1.11 0.00 0.00 56.01 55.56 1u6q n LEU 153 Cb 0.54 -1.49 -0.10 0.00 0.53 0.00 0.00 43.42 42.89 1u6q n LEU 153 CO 0.30 -0.80 -0.32 -0.54 -1.11 0.00 0.00 177.39 174.93 1u6q s LYS 154 N -2.33 1.54 0.14 1.96 1.02 -1.11 -1.24 119.74 119.71 1u6q s LYS 154 Ca 0.64 -1.81 -0.16 0.00 0.02 0.00 0.00 55.97 54.65 1u6q s LYS 154 Cb -0.49 -0.92 0.04 0.00 -0.52 0.00 0.00 37.83 35.94 1u6q s LYS 154 CO 0.56 -0.09 0.42 0.00 -0.92 0.00 0.00 175.35 175.32 1u6q s MET 155 N -3.82 1.11 0.30 1.68 0.23 -0.90 -2.10 119.30 115.79 1u6q s MET 155 Ca 0.32 -0.72 -0.17 0.00 -1.03 0.00 0.00 55.69 54.09 1u6q s MET 155 Cb 0.06 0.48 0.02 0.00 -1.53 0.00 0.00 34.83 33.86 1u6q s MET 155 CO 0.13 -0.44 0.66 -0.08 -2.03 0.00 0.00 175.02 173.26 1u6q s THR 156 N -3.81 0.00 -0.06 3.16 -1.32 -0.79 -1.74 115.64 111.08 1u6q s THR 156 Ca 0.04 -1.13 0.04 0.00 -1.21 0.00 0.00 61.69 59.44 1u6q s THR 156 Cb 0.01 -2.25 -0.00 0.00 -1.51 0.00 0.00 72.50 68.75 1u6q s THR 156 CO -0.11 0.00 -0.19 -0.69 -2.21 0.00 0.00 174.62 171.42 1u6q s VAL 157 N -3.59 1.63 0.28 5.08 1.01 -1.26 -1.77 120.40 121.77 1u6q s VAL 157 Ca 0.15 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.34 1u6q s VAL 157 Cb -0.04 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 1u6q s VAL 157 CO 0.09 0.46 0.13 0.68 0.00 0.00 0.00 175.10 176.46 1u6q s VAL 158 N 0.10 0.40 0.11 2.92 -7.23 -0.75 -4.89 120.40 111.06 1u6q s VAL 158 Ca -0.07 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.20 1u6q s VAL 158 Cb -0.13 -2.57 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 1u6q s VAL 158 CO 0.04 0.00 -0.24 -0.54 -0.31 0.00 0.00 175.10 174.04 1u6q s LYS 159 N -3.94 1.32 0.31 4.82 1.02 -0.39 -1.07 119.74 121.80 1u6q s LYS 159 Ca 0.37 -1.25 -0.29 0.00 0.02 0.00 0.00 55.97 54.82 1u6q s LYS 159 Cb 0.06 -1.70 -0.10 0.00 -0.52 0.00 0.00 37.83 35.57 1u6q s LYS 159 CO 0.15 0.40 1.23 -0.51 -0.92 0.00 0.00 175.35 175.71 1u6q s LEU 160 N -1.93 4.47 -0.06 3.17 1.43 -0.73 -0.66 118.68 124.38 1u6q s LEU 160 Ca 0.11 2.53 0.04 0.00 -1.03 0.00 0.00 54.13 55.77 1u6q s LEU 160 Cb -0.10 -3.64 -0.02 0.00 0.03 0.00 0.00 46.19 42.46 1u6q s LEU 160 CO 0.05 -0.40 -0.17 -0.63 0.23 0.00 0.00 176.35 175.44 1u6q s ILE 161 N -1.07 2.84 0.83 -0.59 1.01 0.35 -0.74 121.20 123.84 1u6q s ILE 161 Ca 0.48 -0.79 -0.12 0.00 0.00 0.00 0.00 60.65 60.22 1u6q s ILE 161 Cb -0.37 -2.11 0.10 0.00 0.01 0.00 0.00 42.46 40.09 1u6q s ILE 161 CO 0.48 0.58 1.16 -0.94 0.00 0.00 0.00 174.94 176.21 1u6q s SER 162 N -0.49 3.60 0.19 3.58 1.04 -1.26 -4.07 113.70 116.29 1u6q s SER 162 Ca 0.06 2.19 -0.11 0.00 0.48 0.00 0.00 55.95 58.57 1u6q s SER 162 Cb -0.12 -2.57 0.11 0.00 0.10 0.00 0.00 66.02 63.55 1u6q s SER 162 CO 0.01 -2.65 1.78 -0.74 0.98 0.00 0.00 173.24 172.63 1u6q h HIS 163 N -1.22 0.96 -0.16 5.02 2.76 -1.96 -1.12 115.15 119.43 1u6q h HIS 163 Ca -0.45 -0.04 -0.11 0.00 -2.20 0.00 0.00 60.37 57.58 1u6q h HIS 163 Cb 1.27 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.92 1u6q h HIS 163 CO 0.50 0.71 -0.37 0.07 -1.30 0.00 0.00 177.93 177.55 1u6q h ARG 164 N 0.94 0.33 -0.16 5.26 0.11 -1.98 -1.21 114.38 117.67 1u6q h ARG 164 Ca 0.23 -0.15 -0.16 0.00 0.10 0.00 0.00 59.98 60.00 1u6q h ARG 164 Cb 0.10 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.17 1u6q h ARG 164 CO -0.03 0.66 -0.58 1.49 0.10 0.00 0.00 179.97 181.61 1u6q h GLU 165 N 0.28 0.51 0.00 0.08 4.81 -1.87 -2.96 114.58 115.43 1u6q h GLU 165 Ca 0.03 -0.33 -0.01 0.00 -0.13 0.00 0.00 59.36 58.92 1u6q h GLU 165 Cb 0.78 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.20 1u6q h GLU 165 CO 0.06 0.94 -0.03 0.00 -0.73 0.00 0.00 179.01 179.25 1u6q n GLN 167 N -3.12 1.58 -1.39 0.00 6.02 -0.49 -1.40 117.38 118.59 1u6q n GLN 167 Ca 0.02 -0.86 -0.34 0.00 -0.01 0.00 0.00 57.00 55.81 1u6q n GLN 167 Cb 0.40 -1.45 0.10 0.00 1.02 0.00 0.00 30.24 30.31 1u6q n GLN 167 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1u6q s GLN 168 N -1.93 2.07 0.22 -1.09 -1.52 -1.10 -3.18 119.66 113.12 1u6q s GLN 168 Ca 0.37 1.78 -0.08 0.00 -1.95 0.00 0.00 55.36 55.48 1u6q s GLN 168 Cb 0.20 -1.82 0.32 0.00 -0.22 0.00 0.00 33.01 31.49 1u6q s GLN 168 CO 0.31 -1.90 1.76 -1.00 -0.25 0.00 0.00 175.29 174.22 1u6q h PRO 169 N -0.36 0.51 0.00 2.91 0.13 -1.91 -2.06 132.00 131.22 1u6q h PRO 169 Ca -0.48 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1u6q h PRO 169 Cb 1.30 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1u6q h PRO 169 CO 0.49 0.33 0.00 0.72 -0.23 0.00 0.00 178.00 179.32 1u6q n HIS 170 N -4.92 0.00 0.00 1.56 8.25 -1.26 -4.47 115.22 114.38 1u6q n HIS 170 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1u6q n HIS 170 Cb 0.28 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 30.95 1u6q n HIS 170 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1u6q n TYR 171 N -1.44 0.00 -0.02 4.41 4.02 -0.85 -4.76 117.16 118.53 1u6q n TYR 171 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 1u6q n TYR 171 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.55 1u6q n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1u6q n TYR 172 N 0.00 0.00 -1.56 -0.72 4.01 -0.49 -4.94 117.16 113.46 1u6q n TYR 172 Ca 0.00 -0.49 0.00 0.00 -0.16 0.00 0.00 57.90 57.25 1u6q n TYR 172 Cb 0.00 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 1u6q n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1u6q n GLY 173 N -0.49 1.75 0.00 2.72 0.00 -0.83 -1.23 105.19 107.11 1u6q n GLY 173 Ca 0.00 -0.32 0.09 0.00 0.00 0.00 0.00 46.02 45.79 1u6q n GLY 173 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u6q n SER 174 N -1.15 0.00 0.22 1.61 7.64 -1.26 -3.63 113.62 117.05 1u6q n SER 174 Ca 0.00 -1.35 0.11 0.00 1.01 0.00 0.00 58.87 58.64 1u6q n SER 174 Cb 0.00 0.00 0.42 0.00 -1.01 0.00 0.00 64.21 63.62 1u6q n SER 174 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1u6q h GLU 175 N 0.00 0.00 -5.55 1.43 5.08 -1.56 -3.42 114.58 110.57 1u6q h GLU 175 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1u6q h GLU 175 Cb 0.00 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.12 1u6q h GLU 175 CO 0.00 0.19 -0.54 0.54 -1.00 0.00 0.00 179.01 178.20 1u6q s VAL 176 N -3.53 4.95 0.53 3.13 0.11 -1.24 -4.78 120.40 119.57 1u6q s VAL 176 Ca 0.02 0.01 0.05 0.00 -2.93 0.00 0.00 61.98 59.13 1u6q s VAL 176 Cb 0.09 -3.18 0.03 0.00 -1.53 0.00 0.00 36.38 31.79 1u6q s VAL 176 CO 0.64 0.54 0.37 0.42 -3.33 0.00 0.00 175.10 173.73 1u6q s THR 177 N -0.34 1.68 -1.30 5.04 -4.23 -1.26 -4.93 115.64 110.30 1u6q s THR 177 Ca 0.09 -1.53 0.13 0.00 -1.18 0.00 0.00 61.69 59.20 1u6q s THR 177 Cb -0.12 -2.21 0.19 0.00 1.34 0.00 0.00 72.50 71.70 1u6q s THR 177 CO 0.02 0.00 1.34 0.35 -0.54 0.00 0.00 174.62 175.79 1u6q n THR 178 N -1.70 0.81 0.72 3.99 -2.24 -1.26 -2.12 114.28 112.48 1u6q n THR 178 Ca -0.03 0.20 0.11 0.00 -2.27 0.00 0.00 64.05 62.07 1u6q n THR 178 Cb 0.64 -0.99 0.28 0.00 -2.10 0.00 0.00 70.33 68.16 1u6q n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1u6q n LYS 179 N -1.35 2.15 -4.36 -0.78 5.02 -1.26 -4.93 118.16 112.65 1u6q n LYS 179 Ca 0.05 -1.74 -0.22 0.00 -2.02 0.00 0.00 58.31 54.38 1u6q n LYS 179 Cb 0.11 -1.45 -0.11 0.00 -0.02 0.00 0.00 35.03 33.56 1u6q n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1u6q s MET 180 N -1.61 1.37 -0.03 1.97 -1.94 -0.90 -2.26 119.30 115.89 1u6q s MET 180 Ca 0.35 -1.50 0.05 0.00 -1.71 0.00 0.00 55.69 52.89 1u6q s MET 180 Cb 0.20 -1.43 -0.01 0.00 2.01 0.00 0.00 34.83 35.60 1u6q s MET 180 CO 0.28 0.28 -0.18 -0.51 -0.01 0.00 0.00 175.02 174.88 1u6q s LEU 181 N -2.87 1.98 0.02 -0.03 1.43 0.61 -4.83 118.68 114.99 1u6q s LEU 181 Ca 0.19 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.94 1u6q s LEU 181 Cb -0.05 -1.00 -0.04 0.00 0.03 0.00 0.00 46.19 45.13 1u6q s LEU 181 CO 0.08 0.20 0.11 0.00 0.23 0.00 0.00 176.35 176.97 1u6q s ALA 183 N -1.29 -1.30 0.24 0.00 0.00 -0.73 -0.49 121.76 118.18 1u6q s ALA 183 Ca 0.26 1.35 -0.20 0.00 0.00 0.00 0.00 51.96 53.36 1u6q s ALA 183 Cb -0.12 -0.67 0.07 0.00 0.00 0.00 0.00 23.12 22.40 1u6q s ALA 183 CO 0.18 -0.26 0.98 0.00 0.00 0.00 0.00 175.76 176.65 1u6q s ALA 184 N -0.05 -1.38 -0.21 0.00 0.00 0.17 -1.25 121.76 119.03 1u6q s ALA 184 Ca -0.03 -0.45 -0.15 0.00 0.00 0.00 0.00 51.96 51.33 1u6q s ALA 184 Cb -0.03 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 1u6q s ALA 184 CO 0.02 -1.05 0.37 0.34 0.00 0.00 0.00 175.76 175.44 1u6q s ASP 185 N -3.33 6.38 0.54 0.00 3.68 -1.26 -1.26 116.67 121.42 1u6q s ASP 185 Ca 0.20 0.44 0.25 0.00 2.13 0.00 0.00 52.55 55.58 1u6q s ASP 185 Cb -0.03 -2.21 1.44 0.00 -1.45 0.00 0.00 42.92 40.66 1u6q s ASP 185 CO 0.07 -0.08 2.02 -0.65 0.13 0.00 0.00 175.17 176.66 1u6q h PRO 186 N 7.49 0.00 -0.18 4.34 0.11 -1.95 0.96 132.00 142.77 1u6q h PRO 186 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1u6q h PRO 186 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1u6q h PRO 186 CO 0.70 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.53 1u6q n GLN 187 N -4.24 2.01 -3.95 1.05 1.13 -1.26 -4.97 117.38 107.15 1u6q n GLN 187 Ca 0.07 -1.50 -0.32 0.00 -1.94 0.00 0.00 57.00 53.31 1u6q n GLN 187 Cb 0.52 -1.45 -0.01 0.00 0.11 0.00 0.00 30.24 29.41 1u6q n GLN 187 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 1u6q n TRP 188 N 0.75 -1.82 -0.05 1.08 7.02 0.33 -4.85 117.44 119.91 1u6q n TRP 188 Ca 0.17 0.72 0.00 0.00 -1.02 0.00 0.00 57.50 57.37 1u6q n TRP 188 Cb 0.45 -3.01 -0.14 0.00 -2.42 0.00 0.00 31.31 26.19 1u6q n TRP 188 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1u6q n LYS 189 N -4.22 0.89 -4.24 -0.99 4.76 -1.26 -4.66 118.16 108.44 1u6q n LYS 189 Ca 0.05 -0.09 -0.20 0.00 -2.87 0.00 0.00 58.31 55.21 1u6q n LYS 189 Cb 0.50 -1.44 -0.12 0.00 -1.84 0.00 0.00 35.03 32.14 1u6q n LYS 189 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1u6q s THR 190 N -2.83 1.42 0.00 -0.18 -1.32 -1.26 -4.36 115.64 107.11 1u6q s THR 190 Ca -0.08 -1.58 0.00 0.00 -1.21 0.00 0.00 61.69 58.83 1u6q s THR 190 Cb 0.08 -1.44 0.00 0.00 -1.51 0.00 0.00 72.50 69.63 1u6q s THR 190 CO 0.73 -0.26 0.00 -0.67 -2.21 0.00 0.00 174.62 172.21 1u6q n ASP 191 N 0.86 0.00 -4.93 8.08 2.03 -1.12 -4.19 116.55 117.28 1u6q n ASP 191 Ca -0.18 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 54.88 1u6q n ASP 191 Cb 0.55 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.99 1u6q n ASP 191 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1u6q s SER 192 N 0.00 5.34 0.35 1.67 1.04 -1.26 -0.89 113.70 119.94 1u6q s SER 192 Ca 0.00 0.53 -0.11 0.00 0.48 0.00 0.00 55.95 56.85 1u6q s SER 192 Cb 0.00 -1.42 0.03 0.00 0.10 0.00 0.00 66.02 64.73 1u6q s SER 192 CO 0.00 -1.21 0.65 0.00 0.98 0.00 0.00 173.24 173.65 1u6q n GLN 194 N -0.53 1.06 0.00 0.00 7.27 -1.26 -0.94 117.38 122.98 1u6q n GLN 194 Ca -0.04 0.38 0.00 0.00 0.07 0.00 0.00 57.00 57.41 1u6q n GLN 194 Cb 0.61 -1.91 0.00 0.00 2.41 0.00 0.00 30.24 31.34 1u6q n GLN 194 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1u6q n GLY 195 N 2.15 2.35 0.01 1.69 0.00 -1.26 -2.04 105.19 108.09 1u6q n GLY 195 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1u6q n GLY 195 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1u6q n ASP 196 N 0.00 0.55 -4.54 1.61 8.00 -0.12 -4.08 116.55 117.97 1u6q n ASP 196 Ca 0.00 -0.23 -0.43 0.00 0.71 0.00 0.00 54.79 54.84 1u6q n ASP 196 Cb 0.00 0.31 -0.00 0.00 -0.02 0.00 0.00 41.12 41.40 1u6q n ASP 196 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1u6q n SER 197 N -1.61 0.51 0.00 -2.24 7.64 -1.26 -1.96 113.62 114.70 1u6q n SER 197 Ca 0.05 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.00 1u6q n SER 197 Cb 0.36 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 1u6q n SER 197 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1u6q n GLY 198 N 1.42 2.19 3.82 0.23 0.00 -0.01 -2.05 105.19 110.79 1u6q n GLY 198 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1u6q n GLY 198 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1u6q s GLY 199 N -1.96 1.59 0.17 -0.02 0.00 -0.83 -3.54 107.32 102.72 1u6q s GLY 199 Ca 0.00 -0.51 -0.30 0.00 0.00 0.00 0.00 44.72 43.91 1u6q s GLY 199 CO 0.00 0.01 1.03 2.56 0.00 0.00 0.00 173.10 176.71 1u6q s PRO 200 N -5.33 4.67 -0.35 2.90 0.04 -1.26 -1.14 135.00 134.53 1u6q s PRO 200 Ca 0.63 1.60 -0.03 0.00 0.04 0.00 0.00 61.00 63.24 1u6q s PRO 200 Cb -0.14 -3.31 0.07 0.00 0.04 0.00 0.00 34.50 31.17 1u6q s PRO 200 CO 0.52 0.19 0.09 -1.17 0.04 0.00 0.00 177.00 176.67 1u6q s LEU 201 N -0.39 4.49 -0.21 -3.56 2.96 -0.50 -3.90 118.68 117.58 1u6q s LEU 201 Ca 0.47 -1.56 -0.07 0.00 -0.22 0.00 0.00 54.13 52.76 1u6q s LEU 201 Cb -0.27 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1u6q s LEU 201 CO 0.33 -0.38 0.04 -0.69 -1.32 0.00 0.00 176.35 174.33 1u6q s VAL 202 N 1.22 4.36 -0.04 1.68 1.01 -0.46 -1.79 120.40 126.38 1u6q s VAL 202 Ca 0.01 -0.17 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1u6q s VAL 202 Cb -0.21 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 1u6q s VAL 202 CO -0.02 0.41 -0.22 0.00 0.00 0.00 0.00 175.10 175.27 1u6q s SER 204 N -0.49 6.77 -0.10 0.00 0.15 -1.26 -0.99 113.70 117.79 1u6q s SER 204 Ca 0.06 0.84 0.00 0.00 0.70 0.00 0.00 55.95 57.56 1u6q s SER 204 Cb -0.11 -2.45 0.02 0.00 -1.71 0.00 0.00 66.02 61.77 1u6q s SER 204 CO 0.01 -0.67 -0.09 -0.22 1.20 0.00 0.00 173.24 173.47 1u6q s LEU 205 N 3.12 1.34 -0.97 3.45 2.96 -0.18 -4.79 118.68 123.61 1u6q s LEU 205 Ca 0.36 -0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 53.93 1u6q s LEU 205 Cb -0.14 -0.84 0.03 0.00 0.50 0.00 0.00 46.19 45.73 1u6q s LEU 205 CO 0.12 -0.07 0.17 0.00 -1.32 0.00 0.00 176.35 175.25 1u6q n GLN 206 N 4.60 -2.72 0.00 1.98 6.02 -1.26 -2.15 117.38 123.85 1u6q n GLN 206 Ca -0.16 0.45 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 1u6q n GLN 206 Cb 0.50 -5.07 0.00 0.00 1.02 0.00 0.00 30.24 26.70 1u6q n GLN 206 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1u6q n GLY 207 N -0.88 3.13 3.91 1.08 0.00 -1.26 -5.08 105.19 106.09 1u6q n GLY 207 Ca -0.07 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.66 1u6q n GLY 207 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1u6q s ARG 208 N 0.00 3.48 0.09 1.61 6.06 -0.91 -5.05 118.95 124.23 1u6q s ARG 208 Ca 0.00 -0.31 -0.30 0.00 -2.50 0.00 0.00 55.73 52.62 1u6q s ARG 208 Cb 0.00 -3.03 -0.05 0.00 0.06 0.00 0.00 34.95 31.92 1u6q s ARG 208 CO 0.00 0.61 1.01 -1.64 -2.50 0.00 0.00 175.30 172.78 1u6q s MET 209 N -2.28 4.63 0.08 5.12 -1.94 -1.26 -1.01 119.30 122.64 1u6q s MET 209 Ca 0.33 1.52 0.07 0.00 -1.71 0.00 0.00 55.69 55.89 1u6q s MET 209 Cb -0.13 -3.37 -0.03 0.00 2.01 0.00 0.00 34.83 33.31 1u6q s MET 209 CO 0.23 0.09 -0.17 0.99 -0.01 0.00 0.00 175.02 176.15 1u6q s THR 210 N 0.27 1.39 -1.01 2.05 2.01 -0.16 -4.29 115.64 115.89 1u6q s THR 210 Ca 0.49 -1.41 -0.21 0.00 0.31 0.00 0.00 61.69 60.88 1u6q s THR 210 Cb -0.24 -1.29 0.09 0.00 0.01 0.00 0.00 72.50 71.06 1u6q s THR 210 CO 0.30 -0.14 1.34 -0.22 -0.69 0.00 0.00 174.62 175.21 1u6q s LEU 211 N -1.81 4.20 0.08 4.42 2.96 -0.30 -1.86 118.68 126.37 1u6q s LEU 211 Ca 0.02 -1.82 0.03 0.00 -0.22 0.00 0.00 54.13 52.14 1u6q s LEU 211 Cb -0.10 -2.50 -0.24 0.00 0.50 0.00 0.00 46.19 43.85 1u6q s LEU 211 CO 0.03 -1.28 1.13 0.74 -1.32 0.00 0.00 176.35 175.65 1u6q h THR 212 N 6.24 1.50 -3.98 3.68 2.02 -1.68 -3.37 112.91 117.32 1u6q h THR 212 Ca 0.21 -3.18 -0.12 0.00 0.77 0.00 0.00 66.41 64.09 1u6q h THR 212 Cb 1.00 2.82 -0.12 0.00 -1.74 0.00 0.00 68.15 70.11 1u6q h THR 212 CO 1.30 0.89 -0.34 -0.83 0.37 0.00 0.00 175.52 176.91 1u6q s GLY 213 N -4.77 0.69 -0.13 2.16 0.00 -0.90 -2.87 107.32 101.50 1u6q s GLY 213 Ca -0.02 -1.05 0.01 0.00 0.00 0.00 0.00 44.72 43.66 1u6q s GLY 213 CO 0.84 -0.91 -0.16 -0.42 0.00 0.00 0.00 173.10 172.45 1u6q s ILE 214 N -4.02 1.66 -0.10 0.90 1.01 -1.09 -1.41 121.20 118.16 1u6q s ILE 214 Ca 0.23 -0.72 -0.36 0.00 0.00 0.00 0.00 60.65 59.80 1u6q s ILE 214 Cb 0.03 -1.51 -0.14 0.00 0.01 0.00 0.00 42.46 40.85 1u6q s ILE 214 CO 0.04 0.47 1.76 0.52 0.00 0.00 0.00 174.94 177.74 1u6q n VAL 215 N 4.41 0.38 0.04 2.92 0.31 -0.29 -1.77 118.33 124.33 1u6q n VAL 215 Ca -0.19 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1u6q n VAL 215 Cb 0.51 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.88 1u6q n VAL 215 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1u6q n SER 216 N 5.53 0.69 -3.63 4.52 2.88 -0.81 -0.83 113.62 121.96 1u6q n SER 216 Ca 0.23 0.11 -0.10 0.00 -1.33 0.00 0.00 58.87 57.78 1u6q n SER 216 Cb 0.24 -0.19 -0.03 0.00 -0.75 0.00 0.00 64.21 63.47 1u6q n SER 216 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1u6q s TRP 217 N -1.67 0.39 0.00 0.66 1.48 -0.96 -4.92 118.94 113.91 1u6q s TRP 217 Ca 0.00 -0.79 0.00 0.00 -1.06 0.00 0.00 56.10 54.25 1u6q s TRP 217 Cb 0.00 0.32 0.00 0.00 -1.16 0.00 0.00 33.47 32.63 1u6q s TRP 217 CO 0.00 -1.16 0.00 0.41 -4.06 0.00 0.00 176.95 172.14 1u6q n GLY 218 N -0.46 1.56 3.51 3.67 0.00 -1.26 -0.22 105.19 111.98 1u6q n GLY 218 Ca -0.03 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 45.10 1u6q n GLY 218 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1u6q s ARG 219 N -2.00 3.28 1.78 1.61 6.06 -1.26 -4.88 118.95 123.54 1u6q s ARG 219 Ca 0.00 -0.39 0.00 0.00 -2.50 0.00 0.00 55.73 52.84 1u6q s ARG 219 Cb 0.00 -4.10 0.00 0.00 0.06 0.00 0.00 34.95 30.91 1u6q s ARG 219 CO 0.00 -1.58 0.00 0.41 -2.50 0.00 0.00 175.30 171.63 1u6q n GLY 220 N 5.17 -1.24 2.77 8.12 0.00 -1.26 -4.65 105.19 114.11 1u6q n GLY 220 Ca 0.01 -1.21 -0.23 0.00 0.00 0.00 0.00 46.02 44.58 1u6q n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6q n ALA 222 N 5.14 -1.23 -2.78 0.00 0.00 -1.26 -4.90 120.51 115.48 1u6q n ALA 222 Ca -0.07 0.20 -0.33 0.00 0.00 0.00 0.00 53.44 53.24 1u6q n ALA 222 Cb 0.50 -3.70 -0.07 0.00 0.00 0.00 0.00 19.45 16.18 1u6q n ALA 222 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1u6q s LEU 223 N -5.85 3.91 0.22 0.00 1.43 -1.26 -4.72 118.68 112.41 1u6q s LEU 223 Ca 0.31 0.18 -0.31 0.00 -1.03 0.00 0.00 54.13 53.28 1u6q s LEU 223 Cb -0.14 -2.21 -0.14 0.00 0.03 0.00 0.00 46.19 43.72 1u6q s LEU 223 CO 0.58 0.29 1.24 1.17 0.23 0.00 0.00 176.35 179.86 1u6q n LYS 224 N 1.35 1.54 -1.65 1.70 4.81 -1.26 -2.07 118.16 122.58 1u6q n LYS 224 Ca -0.14 0.55 -0.16 0.00 -0.87 0.00 0.00 58.31 57.69 1u6q n LYS 224 Cb 0.53 -2.09 -0.06 0.00 0.02 0.00 0.00 35.03 33.43 1u6q n LYS 224 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1u6q n ASP 225 N 1.91 -4.35 -3.68 3.14 8.00 -1.26 -4.93 116.55 115.39 1u6q n ASP 225 Ca 0.13 0.34 -0.28 0.00 0.71 0.00 0.00 54.79 55.69 1u6q n ASP 225 Cb 0.29 -3.90 -0.12 0.00 -0.02 0.00 0.00 41.12 37.37 1u6q n ASP 225 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1u6q s LYS 226 N -3.69 1.60 0.89 -1.24 -0.14 -0.88 -4.15 119.74 112.14 1u6q s LYS 226 Ca 0.00 -2.54 -0.11 0.00 -1.36 0.00 0.00 55.97 51.95 1u6q s LYS 226 Cb 0.00 -2.44 0.13 0.00 -1.68 0.00 0.00 37.83 33.84 1u6q s LYS 226 CO 0.00 -1.28 1.09 -2.14 -0.76 0.00 0.00 175.35 172.26 1u6q s PRO 227 N -0.42 1.28 0.38 -1.68 0.02 -1.26 -4.42 135.00 128.90 1u6q s PRO 227 Ca 0.25 0.84 -0.24 0.00 0.02 0.00 0.00 61.00 61.87 1u6q s PRO 227 Cb -0.07 -1.81 -0.10 0.00 0.02 0.00 0.00 34.50 32.54 1u6q s PRO 227 CO -0.13 -2.23 0.99 0.20 -0.33 0.00 0.00 177.00 175.51 1u6q s GLY 228 N -3.41 2.68 -0.07 0.52 0.00 -0.38 -4.55 107.32 102.10 1u6q s GLY 228 Ca 0.63 0.57 0.03 0.00 0.00 0.00 0.00 44.72 45.95 1u6q s GLY 228 CO 0.57 0.97 -0.13 0.14 0.00 0.00 0.00 173.10 174.65 1u6q s VAL 229 N -1.76 3.12 0.05 1.40 1.01 0.69 -1.78 120.40 123.13 1u6q s VAL 229 Ca 0.56 -0.69 0.05 0.00 0.00 0.00 0.00 61.98 61.90 1u6q s VAL 229 Cb -0.18 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 1u6q s VAL 229 CO 0.23 0.58 -0.14 -0.31 0.00 0.00 0.00 175.10 175.46 1u6q s TYR 230 N -0.49 1.20 -0.01 5.22 2.02 0.75 -1.93 117.35 124.10 1u6q s TYR 230 Ca 0.07 -0.41 -0.30 0.00 -0.37 0.00 0.00 57.07 56.06 1u6q s TYR 230 Cb -0.12 -0.69 -0.05 0.00 -0.40 0.00 0.00 41.96 40.70 1u6q s TYR 230 CO 0.02 0.04 1.35 0.99 -1.57 0.00 0.00 175.55 176.37 1u6q s THR 231 N -1.06 3.83 -0.77 -0.71 2.01 -0.73 -0.29 115.64 117.93 1u6q s THR 231 Ca -0.00 1.22 -0.26 0.00 0.31 0.00 0.00 61.69 62.95 1u6q s THR 231 Cb -0.09 -3.78 0.03 0.00 0.01 0.00 0.00 72.50 68.67 1u6q s THR 231 CO 0.02 0.01 1.29 -0.60 -0.69 0.00 0.00 174.62 174.65 1u6q s ARG 232 N 2.24 3.24 0.32 4.92 3.52 -0.96 -2.66 118.95 129.57 1u6q s ARG 232 Ca 0.62 -0.36 0.07 0.00 -0.13 0.00 0.00 55.73 55.93 1u6q s ARG 232 Cb -0.30 -4.32 0.77 0.00 -1.56 0.00 0.00 34.95 29.54 1u6q s ARG 232 CO 0.26 -2.15 1.80 0.28 -0.81 0.00 0.00 175.30 174.68 1u6q h VAL 233 N 6.12 0.74 -0.72 7.11 2.07 -1.82 -2.77 116.25 126.97 1u6q h VAL 233 Ca -0.22 -0.25 0.13 0.00 0.82 0.00 0.00 66.70 67.17 1u6q h VAL 233 Cb 1.05 -0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 1u6q h VAL 233 CO 1.30 0.14 0.48 0.77 0.02 0.00 0.00 177.57 180.27 1u6q h SER 234 N 0.74 0.42 -0.30 0.57 4.64 -1.88 -1.38 113.55 116.36 1u6q h SER 234 Ca 0.55 0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.83 1u6q h SER 234 Cb 0.88 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.88 1u6q h SER 234 CO -0.32 0.23 0.02 -0.74 -0.87 0.00 0.00 176.83 175.14 1u6q h HIS 235 N 0.45 0.65 -0.14 4.77 6.17 -1.88 -3.11 115.15 122.07 1u6q h HIS 235 Ca 0.35 -0.07 0.00 0.00 0.71 0.00 0.00 60.37 61.36 1u6q h HIS 235 Cb 0.72 -0.19 0.00 0.00 2.52 0.00 0.00 27.41 30.47 1u6q h HIS 235 CO -0.00 0.61 0.00 1.19 0.71 0.00 0.00 177.93 180.44 1u6q n PHE 236 N -4.27 0.18 -0.23 5.26 3.01 -0.53 -4.45 117.46 116.43 1u6q n PHE 236 Ca 0.02 -0.09 -0.00 0.00 1.01 0.00 0.00 57.45 58.39 1u6q n PHE 236 Cb 0.25 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.79 1u6q n PHE 236 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1u6q h LEU 237 N 1.74 -0.69 -1.34 4.37 3.38 -1.49 0.95 115.31 122.23 1u6q h LEU 237 Ca 0.00 0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.23 1u6q h LEU 237 Cb 0.38 0.44 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 1u6q h LEU 237 CO 0.00 -0.24 0.49 -0.65 0.09 0.00 0.00 178.44 178.13 1u6q h PRO 238 N -0.02 0.79 -0.30 1.13 0.11 -1.87 -0.87 132.00 130.98 1u6q h PRO 238 Ca 0.32 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.26 1u6q h PRO 238 Cb 0.51 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.43 1u6q h PRO 238 CO -0.70 0.52 -0.30 2.35 -0.21 0.00 0.00 178.00 179.66 1u6q h TRP 239 N 0.81 0.89 -0.58 0.65 7.01 -1.22 -2.53 115.95 120.98 1u6q h TRP 239 Ca 0.31 -0.27 -0.06 0.00 2.11 0.00 0.00 58.89 60.98 1u6q h TRP 239 Cb 0.19 -0.19 -0.03 0.00 -2.10 0.00 0.00 29.16 27.04 1u6q h TRP 239 CO -0.00 1.03 0.11 0.82 -2.79 0.00 0.00 178.44 177.61 1u6q h ILE 240 N 0.49 1.24 -0.14 2.65 2.04 -0.49 -2.24 117.51 121.06 1u6q h ILE 240 Ca 0.05 -0.92 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 1u6q h ILE 240 Cb 0.88 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1u6q h ILE 240 CO 0.08 0.34 -0.01 -0.09 0.00 0.00 0.00 178.15 178.47 1u6q h ARG 241 N 0.88 0.25 -0.08 2.37 2.43 -1.13 -2.70 114.38 116.40 1u6q h ARG 241 Ca 0.18 -0.08 -0.11 0.00 -0.81 0.00 0.00 59.98 59.16 1u6q h ARG 241 Cb 0.36 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1u6q h ARG 241 CO 0.00 0.50 -0.43 0.66 -1.51 0.00 0.00 179.97 179.19 1u6q h SER 242 N -0.02 0.18 -0.08 -3.80 4.64 -1.40 -3.03 113.55 110.05 1u6q h SER 242 Ca 0.04 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1u6q h SER 242 Cb 0.39 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1u6q h SER 242 CO 0.01 0.60 0.00 1.41 -0.87 0.00 0.00 176.83 177.98 1u6q n HIS 243 N -4.01 0.09 -0.27 4.77 8.25 -0.85 -5.12 115.22 118.09 1u6q n HIS 243 Ca -0.02 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 1u6q n HIS 243 Cb 0.49 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.60 1u6q n HIS 243 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23